NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1698 8.1727 122.0504 56.2869 34.1215 174.0356 2 V 4.5475 8.1634 127.0387 60.7238 32.3094 174.5421 3 F 4.4459 9.9550 128.8472 57.5792 40.2665 174.7739 4 E 4.2977 8.9175 120.5792 55.4382 31.0396 176.8131 5 R 3.2557 8.9684 121.6962 60.7914 29.9515 179.4452 6 C 4.2987 8.0262 115.3137 59.6462 36.2823 175.7329 7 E 3.8953 8.0990 120.7441 59.2562 29.2509 178.5219 8 L 3.6058 8.0117 120.0958 57.7670 42.1834 178.5088 9 A 3.9378 7.9403 120.8028 55.4856 18.4538 179.8903 10 R 3.8990 8.1101 116.3915 59.5476 30.1288 179.5116 11 T 3.8495 7.8337 115.4594 66.6892 68.5182 176.6534 12 L 3.8511 8.0821 121.2289 57.6169 41.6055 179.5352 13 K 3.9102 7.8994 119.1880 59.5937 31.9366 178.9099 14 R 3.9753 7.6793 117.3369 58.8933 30.0385 177.4706 15 L 4.3562 7.4936 116.4526 54.0039 41.7954 176.7154 16 G 3.8408 7.8094 106.8503 47.0821 0.0000 175.2036 17 M 3.8819 7.8678 121.0125 56.3468 32.4341 175.8015 18 D 4.4148 8.0088 117.7882 55.9872 41.1422 175.7937 19 G 3.9335 9.3737 115.5994 45.4349 0.0000 171.3073 20 Y 4.2324 8.2753 121.9650 58.6630 38.8294 176.3711 21 R 3.5477 8.9701 126.9572 57.3064 27.7388 177.2884 22 G 3.7966 8.2467 103.3704 45.6631 0.0000 174.0396 23 I 4.1267 7.5174 121.8284 58.9063 38.0274 175.8125 24 S 4.6202 8.3525 120.4765 57.8192 63.8105 174.9662 25 L 4.2169 8.9885 123.6612 58.6519 41.7806 179.3677 26 A 4.1268 8.1954 120.0397 55.3540 18.2573 179.2414 27 N 4.4772 8.1708 115.0669 56.2267 38.5723 177.7311 28 W 4.2168 8.0159 119.9799 59.9336 29.1343 178.3477 29 M 4.1539 8.5352 118.9643 58.5456 31.4211 177.9315 30 C 3.1588 8.0363 118.5685 59.0921 44.8317 175.3531 31 L 3.9316 8.1230 121.6197 58.2998 41.7704 178.8306 32 A 4.1239 8.3532 120.7920 54.8658 18.3609 179.4197 33 K 2.7977 8.1716 118.2761 59.3339 32.0313 179.0446 34 W 4.3138 7.6656 117.0145 58.8628 29.0763 178.3848 35 E 4.3315 8.2092 118.6113 58.5337 29.5806 177.6239 36 S 4.5418 7.8638 109.8621 56.5508 64.4319 174.2414 37 G 3.2775 7.9586 108.6837 47.1100 0.0000 173.1421 38 Y 3.6568 7.6376 112.8340 58.7163 35.4780 169.2045 39 N 5.3727 7.5983 117.5636 51.8951 40.1404 175.3942 40 T 3.9925 8.9721 117.5301 63.8490 69.1802 175.9230 41 R 4.5119 8.0019 116.9572 55.6326 30.0152 176.1324 42 A 4.3248 7.7273 122.6586 52.7105 19.2602 177.1193 43 T 4.9830 8.4037 111.6185 59.9512 72.3898 173.1253 44 N 4.8626 8.8293 122.0592 52.2797 41.9637 172.3764 45 Y 4.5752 8.7449 128.2155 57.3963 40.6611 173.9164 46 N 4.6047 8.5593 125.1529 51.1550 38.3405 175.3416 47 A 3.6460 8.2126 127.3097 54.6737 18.8909 179.3711 48 G 3.7181 7.9647 104.2497 48.0236 0.0000 173.7814 49 D 4.6839 7.3588 114.8071 52.0305 40.4675 175.6679 50 R 4.0017 8.1962 116.5857 57.1040 28.1726 175.8221 51 S 4.9759 7.6945 111.9158 57.0718 66.3256 172.8471 52 T 5.1029 8.6388 116.3182 61.9576 72.4855 172.7346 53 D 5.4337 8.8897 125.4383 53.2766 43.1460 175.0645 54 Y 5.0352 8.9825 120.7050 57.4368 41.6089 177.4526 55 G 4.1886 9.0721 112.2258 45.1089 0.0000 173.3960 56 I 3.8377 8.2952 116.8585 62.8697 37.8178 177.3352 57 F 4.6934 7.9923 115.3406 56.3933 39.9777 175.2205 58 Q 3.6149 7.9835 119.1802 57.1316 26.4969 174.0453 59 I 4.3869 8.2156 119.1128 60.9879 39.3484 176.9050 60 N 5.3247 9.2435 126.5172 53.4866 39.6335 175.7142 61 S 4.6472 9.1199 120.9481 60.2665 63.2323 175.4928 62 R 3.7050 8.5339 122.0971 58.6448 30.4379 177.7317 63 Y 4.2359 7.5209 114.5798 58.0197 40.6596 177.3001 64 W 4.7640 7.9089 118.8137 57.9197 30.4214 173.7436 65 C 5.5921 7.8846 110.5735 53.4688 45.8197 171.7875 66 N 4.8011 8.9468 119.7780 52.1525 39.5876 174.8414 67 D 4.8096 8.4803 122.8317 52.1811 40.5988 178.0051 68 G 4.0416 8.4952 108.7647 45.9369 0.0000 174.6672 69 K 4.3702 7.7899 116.3859 56.7481 33.3637 176.1756 70 T 4.3603 7.4805 116.6098 61.7064 68.8972 173.0857 71 P 4.2615 0.0000 0.0000 63.7668 32.0601 176.2581 72 G 3.9216 8.4315 108.3925 46.6052 0.0000 172.6409 73 A 4.7472 7.6845 118.0460 50.1939 21.6634 177.3191 74 V 4.3425 8.3791 112.5035 59.2850 35.6668 176.0120 75 N 4.9676 8.1139 117.5616 51.8167 37.6713 174.4446 76 A 3.9458 9.1799 125.0816 54.7058 19.1058 178.4857 77 C 4.4858 8.5125 111.5185 57.2551 41.1123 173.0260 78 H 4.1222 8.0349 116.2189 56.6182 26.2484 174.3647 79 L 4.8225 8.4394 117.7623 52.8901 46.4108 176.7512 80 S 4.6567 8.3615 115.5384 58.0639 63.2879 176.0236 81 C 4.1565 8.6261 123.6634 59.5250 39.2136 176.3403 82 S 3.9246 7.8049 114.6314 61.2849 61.6492 175.9652 83 A 4.1236 7.7841 122.4805 54.4598 18.1426 177.9731 84 L 4.4179 7.7418 116.2378 55.2308 41.8069 177.6833 85 L 5.2566 7.7334 116.8151 53.7242 42.2970 176.6625 86 Q 4.3854 7.7645 117.9230 55.3470 29.6117 175.8970 87 D 4.4416 8.5110 119.4271 57.0670 41.1703 176.9793 88 N 4.5839 8.0547 118.1298 53.2535 39.3868 174.6428 89 I 4.2894 8.4571 118.6495 60.9979 38.0506 177.0389 90 A 3.9415 8.6551 125.3456 56.0597 18.1884 180.2070 91 D 4.2997 8.0811 116.4623 57.3827 40.9287 178.6849 92 A 4.1248 7.9927 120.9272 55.0801 18.4517 179.7667 93 V 3.3415 8.1739 116.8794 66.0404 31.4974 178.1419 94 A 3.8585 8.0124 120.5638 55.2382 18.0750 178.8283 95 C 4.2175 8.3488 116.8305 59.6100 37.8932 175.6033 96 A 3.8478 8.0998 122.5957 54.9873 17.5897 179.7541 97 K 3.7632 7.5214 116.2676 59.4268 32.3217 179.2207 98 R 4.0559 7.6001 118.9154 59.3125 29.8960 178.5134 99 V 2.2056 7.4528 118.1721 65.7501 31.4600 177.8916 100 V 3.9354 7.6101 109.2685 62.4937 31.3992 177.7729 101 R 4.3093 7.6997 117.4637 56.7113 30.6845 176.3682 102 D 4.7342 7.3057 119.9788 52.5953 41.9217 175.3144 103 P 4.2335 0.0000 0.0000 66.3482 31.0757 177.8439 104 Q 4.0153 8.1423 117.4478 56.5256 30.1147 177.1861 105 G 3.7882 7.8335 106.6264 46.9553 0.0000 176.4563 106 I 3.6147 7.7982 121.1266 63.4066 37.9283 177.7346 107 R 4.2286 7.2746 117.7815 57.7852 29.9494 177.4940 108 A 4.0645 7.6316 120.6522 54.0613 18.6739 177.4999 109 W 4.7382 8.0665 116.9876 55.2866 30.0428 177.3339 110 V 3.7267 8.7543 123.8951 66.0575 30.8738 177.5408 111 A 4.0612 8.3286 120.0734 54.8727 18.0684 179.2025 112 W 3.9551 8.4283 126.9027 60.6902 30.5582 178.4475 113 R 3.6929 8.1352 116.4682 59.1952 29.6564 178.4326 114 N 4.3277 7.7849 114.6753 55.9691 38.7476 177.0183 115 R 3.9887 7.6617 116.3235 56.1780 31.0614 176.3848 116 C 4.5700 7.6479 115.4661 57.7024 42.6509 174.4069 117 Q 3.2127 6.4752 118.9818 57.2892 28.7263 175.3410 118 N 4.2005 8.7015 119.9216 54.1464 36.2446 173.8169 119 R 4.5074 7.2894 115.8082 54.0542 32.9706 175.7945 120 D 4.4783 8.4602 118.8489 53.9277 40.2049 175.3589 121 A 4.8122 8.4079 128.4691 52.1246 19.7480 178.6429 122 R 4.0123 8.0955 118.6520 59.8856 29.8592 178.6232 123 Q 3.9190 8.1432 115.6487 59.9109 28.1322 178.5162 124 Y 4.3859 7.8658 117.3115 59.7802 38.3425 176.6885 125 V 4.3895 7.9320 110.9935 60.7053 33.1572 175.5538 126 Q 4.1749 8.0015 120.1656 57.2653 28.8340 176.7788 127 G 3.9379 8.9136 110.1889 46.1083 0.0000 174.5319 128 C 4.4366 8.0424 115.5546 56.6479 40.5879 174.0490 129 G 3.8641 8.1530 107.2671 46.7162 0.0000 174.1724 130 V 4.0096 7.8691 118.0825 61.0883 32.1107 175.8086 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 K 8.17 4.17 0.00 1.94 1.69 0.00 1.28 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.87 1.11 7.81 2 V 8.16 4.55 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 9.96 4.45 0.00 2.87 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.92 4.30 0.00 1.97 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 2.29 2.36 0.00 5 R 8.97 3.26 0.00 1.93 1.91 0.00 3.46 0.00 0.00 3.48 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 6 C 8.03 4.30 0.00 3.00 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 7 E 8.10 3.90 0.00 2.06 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 2.54 2.41 0.00 8 L 8.01 3.61 0.00 1.38 1.42 -0.12 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.94 3.94 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 10 R 8.11 3.90 0.00 2.00 1.99 0.00 3.14 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.83 3.85 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 1.20 0.00 0.00 12 L 8.08 3.85 0.00 1.73 1.60 0.95 0.45 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 13 K 7.90 3.91 0.00 1.98 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.68 3.98 0.00 2.02 2.02 0.00 3.30 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.49 4.36 0.00 1.68 1.55 0.84 0.89 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 16 G 7.81 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 17 M 7.87 3.88 0.00 1.26 1.93 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.20 0.00 18 D 8.01 4.41 0.00 2.67 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 19 G 9.37 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 20 Y 8.28 4.23 0.00 3.32 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 21 R 8.97 3.55 0.00 1.89 1.84 0.00 3.22 0.00 0.00 2.98 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.33 0.00 22 G 8.25 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 23 I 7.52 4.13 1.88 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 0.93 0.71 -0.19 0.00 0.00 24 S 8.35 4.62 0.00 4.07 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 25 L 8.99 4.22 0.00 2.07 1.82 0.98 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.20 4.13 1.52 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 0.00 0.00 27 N 8.17 4.48 0.00 2.83 2.76 0.00 0.00 6.93 7.67 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 28 W 8.02 4.22 0.00 3.56 3.16 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 29 M 8.54 4.15 0.00 2.14 2.35 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.91 0.00 30 C 8.04 3.16 0.00 2.64 3.16 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 31 L 8.12 3.93 0.00 1.85 1.84 0.53 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.35 4.12 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 33 K 8.17 2.80 0.00 1.41 1.69 0.00 0.67 0.00 0.00 0.98 0.00 0.00 2.58 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.98 0.21 7.81 34 W 7.67 4.31 0.00 3.30 3.22 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 35 E 8.21 4.33 0.00 2.01 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 2.58 2.40 0.00 36 S 7.86 4.54 0.00 4.09 4.15 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 37 G 7.96 3.28 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 0.00 38 Y 7.64 3.66 0.00 3.24 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 39 N 7.60 5.37 0.00 2.85 2.81 0.00 0.00 7.02 7.10 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 40 T 8.97 3.99 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 1.49 0.00 0.00 41 R 8.00 4.51 0.00 2.00 2.09 0.00 3.09 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 42 A 7.73 4.32 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 43 T 8.40 4.98 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 1.32 0.00 0.00 44 N 8.83 4.86 0.00 3.06 2.66 0.00 0.00 6.79 7.18 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 45 Y 8.74 4.58 0.00 3.00 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 46 N 8.56 4.60 0.00 2.63 2.59 0.00 0.00 6.51 7.44 0.00 0.00 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 A 8.21 3.65 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 48 G 7.96 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 49 D 7.36 4.68 0.00 2.70 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 50 R 8.20 4.00 0.00 2.04 2.21 0.00 3.12 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.53 0.00 51 S 7.69 4.98 0.00 3.89 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 52 T 8.64 5.10 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 0.56 0.00 0.00 53 D 8.89 5.43 0.00 2.74 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 54 Y 8.98 5.04 0.00 2.93 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 55 G 9.07 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 0.00 0.00 0.00 0.00 56 I 8.30 3.84 1.69 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 0.90 1.78 0.11 0.00 0.00 57 F 7.99 4.69 0.00 3.23 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 58 Q 7.98 3.61 0.00 2.53 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 59 I 8.22 4.39 2.15 0.00 0.00 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 1.37 1.05 1.15 0.00 0.00 60 N 9.24 5.32 0.00 3.07 3.02 0.00 0.00 6.97 7.16 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 61 S 9.12 4.65 0.00 4.06 4.40 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.53 3.70 0.00 1.59 1.32 0.00 2.71 0.00 0.00 2.93 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.07 0.00 63 Y 7.52 4.24 0.00 1.53 1.79 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 64 W 7.91 4.76 0.00 3.58 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 65 C 7.88 5.59 0.00 3.22 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 66 N 8.95 4.80 0.00 2.78 2.70 0.00 0.00 7.07 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 67 D 8.48 4.81 0.00 2.96 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 68 G 8.50 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 69 K 7.79 4.37 0.00 1.84 1.93 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.46 7.81 70 T 7.48 4.36 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 1.16 0.00 0.00 71 P 0.00 4.26 0.00 2.02 1.98 0.00 3.82 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 72 G 8.43 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 73 A 7.68 4.75 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 74 V 8.38 4.34 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 0.64 0.00 0.00 0.88 0.00 0.00 75 N 8.11 4.97 0.00 2.78 2.64 0.00 0.00 6.76 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 76 A 9.18 3.95 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 77 C 8.51 4.49 0.00 3.32 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 78 H 8.03 4.12 0.00 3.33 3.36 0.00 5.62 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.44 4.82 0.00 1.66 1.50 0.96 1.11 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 80 S 8.36 4.66 0.00 3.83 3.69 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 81 C 8.63 4.16 0.00 2.20 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 82 S 7.80 3.92 0.00 3.89 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.78 4.12 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 84 L 7.74 4.42 0.00 1.96 1.83 1.05 0.64 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 85 L 7.73 5.26 0.00 1.80 1.72 1.12 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.76 4.39 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 7.10 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 87 D 8.51 4.44 0.00 2.63 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 88 N 8.05 4.58 0.00 2.70 2.75 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 89 I 8.46 4.29 1.81 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.57 1.02 0.00 0.00 90 A 8.66 3.94 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 91 D 8.08 4.30 0.00 2.75 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 92 A 7.99 4.12 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 0.00 0.00 93 V 8.17 3.34 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 0.71 0.00 0.00 0.90 0.00 0.00 94 A 8.01 3.86 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 95 C 8.35 4.22 0.00 3.14 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 96 A 8.10 3.85 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 97 K 7.52 3.76 0.00 1.66 1.44 0.00 1.29 0.00 0.00 0.85 0.00 0.00 2.22 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.96 7.81 98 R 7.60 4.06 0.00 1.91 2.11 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.94 0.00 99 V 7.45 2.21 1.76 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 -0.17 0.00 0.00 -0.82 0.00 0.00 100 V 7.61 3.94 2.14 0.00 0.00 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 1.43 0.00 0.00 101 R 7.70 4.31 0.00 2.05 2.03 0.00 3.23 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.12 0.00 102 D 7.31 4.73 0.00 3.00 2.61 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 0.00 0.00 0.00 103 P 0.00 4.23 0.00 2.15 2.20 0.00 3.78 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 1.98 2.01 0.00 104 Q 8.14 4.02 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.75 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 7.83 3.79 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 0.00 106 I 7.80 3.61 1.03 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.06 -0.58 0.00 0.00 107 R 7.27 4.23 0.00 1.97 2.03 0.00 3.21 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.48 0.00 108 A 7.63 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.07 4.74 0.00 3.52 3.26 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 0.00 110 V 8.75 3.73 2.18 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 1.10 0.00 0.00 1.00 0.00 0.00 111 A 8.33 4.06 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.43 3.96 0.00 3.50 3.50 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 0.00 113 R 8.14 3.69 0.00 2.08 1.99 0.00 3.57 0.00 0.00 3.57 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.11 0.00 114 N 7.78 4.33 0.00 2.56 2.70 0.00 0.00 7.00 7.00 0.00 0.00 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 R 7.66 3.99 0.00 1.00 0.66 0.00 2.79 0.00 0.00 2.82 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.06 0.00 116 C 7.65 4.57 0.00 1.68 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 0.00 117 Q 6.48 3.21 0.00 0.93 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.83 0.00 0.00 0.00 0.00 0.00 2.17 2.30 0.00 118 N 8.70 4.20 0.00 2.80 2.82 0.00 0.00 6.86 7.66 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 0.00 119 R 7.29 4.51 0.00 1.80 1.81 0.00 3.26 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.58 0.00 120 D 8.46 4.48 0.00 2.64 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 0.00 121 A 8.41 4.81 1.53 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 0.00 0.00 122 R 8.10 4.01 0.00 1.93 2.04 0.00 3.27 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 123 Q 8.14 3.92 0.00 1.98 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.12 0.00 0.00 0.00 0.00 0.00 1.97 1.45 0.00 124 Y 7.87 4.39 0.00 3.19 3.13 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 0.00 125 V 7.93 4.39 2.14 0.00 0.00 0.00 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 1.06 0.00 0.00 126 Q 8.00 4.17 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.96 0.00 0.00 0.00 0.00 0.00 2.59 2.31 0.00 127 G 8.91 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 0.00 128 C 8.04 4.44 0.00 3.09 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.15 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 0.00 0.00 0.00 130 V 7.87 4.01 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 0.81 0.00 0.00 0.96 0.00 0.00