NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4452 8.1233 122.4949 51.9425 19.6312 176.0386 2 F 4.7107 8.4553 118.4465 56.2391 41.6578 171.2426 3 V 4.5526 9.2343 120.2375 61.2912 35.4431 174.0054 4 V 4.4697 8.9985 127.8244 62.5615 32.3994 175.3404 5 T 3.8845 8.6515 119.9657 59.5994 71.6527 173.6943 6 D 4.0904 7.5084 119.4143 57.9484 40.8936 179.0770 7 N 4.4884 8.1629 114.7537 56.1126 39.2799 175.1573 8 C 4.3919 8.1991 118.5455 62.3137 31.7938 173.8392 9 I 4.2014 7.8548 121.0674 62.9209 36.6327 177.1002 10 K 3.8408 8.8450 123.0627 56.7570 30.6839 176.3832 11 C 4.1472 7.3278 112.8767 59.8652 30.9921 173.5504 12 K 4.1424 8.3685 118.3276 57.7655 29.6449 175.3012 13 Y 3.9798 7.4224 119.1143 59.4462 38.9527 178.2793 14 T 3.3775 8.1329 107.2554 62.6693 67.2372 173.4528 15 E 4.0468 7.6122 123.5338 59.4925 28.8644 178.4620 16 C 4.1466 7.7616 114.5679 61.0503 29.5812 176.1638 17 V 3.4984 6.8754 114.1483 64.0446 30.7840 178.3434 18 E 3.9371 7.9458 117.4754 59.0301 29.4884 178.2314 19 V 3.7604 7.0372 116.8516 62.6589 31.7458 175.6879 20 C 4.2882 7.8052 122.7238 58.6179 31.2704 172.1933 21 P 4.3159 0.0000 0.0000 65.2461 31.0579 177.5378 22 V 4.1295 7.7599 109.0979 60.0141 32.4251 175.3647 23 D 4.4055 7.3923 118.0666 55.8726 38.5321 173.3665 24 C 5.0678 7.5217 108.4197 57.4024 31.8371 174.7053 25 F 5.1278 8.0717 118.0835 57.3621 40.6142 174.2838 26 Y 5.1998 9.3579 120.1005 56.1401 41.6102 174.1680 27 E 4.8789 9.4848 122.3246 54.6272 31.6671 175.6660 28 G 2.0000 8.0311 111.1874 41.7696 0.0000 172.3227 29 P 4.2809 0.0000 0.0000 65.3041 31.4191 177.5297 30 N 4.9623 7.4920 115.4232 51.6670 37.9284 173.4317 31 F 5.1077 7.5710 117.4762 58.6146 42.2062 171.9260 32 L 5.3617 7.6022 123.6345 53.0685 45.1484 176.1444 33 V 4.6828 9.0700 113.7489 59.8098 36.3224 174.3724 34 I 4.5253 8.8608 123.6817 59.7807 39.1294 175.2199 35 H 4.3112 9.2464 127.9582 55.0516 29.8377 173.8641 36 P 4.2982 0.0000 0.0000 66.4378 30.9225 177.5887 37 D 4.5468 8.2005 116.6247 56.3749 41.2093 177.8580 38 E 4.2233 8.1460 118.7667 57.5213 29.8681 176.4465 39 C 4.0419 7.6748 119.2662 59.9414 31.8930 173.0242 40 I 4.2941 8.3847 118.9723 60.0483 36.9367 174.9226 41 D 4.6013 8.0351 119.2104 56.0111 38.1765 174.9355 42 C 3.9238 7.9568 112.8329 58.5772 30.3556 174.7527 43 A 2.5897 6.9046 122.3900 52.2032 17.1224 179.1394 44 L 3.9476 7.3106 115.8366 57.5940 42.0463 179.1573 45 C 4.2808 7.8749 113.7837 60.6623 29.6692 175.1448 46 E 3.9209 7.7835 122.5598 58.8674 29.0292 176.8471 47 P 4.3479 0.0000 0.0000 64.4951 31.8298 177.2248 48 E 4.2989 7.8056 118.0029 57.2852 29.7874 175.9800 49 C 4.2657 7.3489 119.8455 58.1861 31.4603 172.3907 50 P 3.9941 0.0000 0.0000 65.1192 30.9528 177.2627 51 A 4.5042 8.0741 118.3761 51.8345 19.0235 176.6117 52 Q 3.2227 7.7716 114.0555 56.8082 27.1017 174.5162 53 A 4.5238 7.8028 118.3342 52.9814 20.7751 178.1524 54 I 4.8285 7.5627 116.3200 60.7111 38.4776 175.5237 55 F 4.9464 9.2360 124.0246 55.4466 43.8097 174.5394 56 S 2.7900 8.4265 115.7584 57.4510 63.3435 174.5639 57 E 3.8575 8.3647 127.3999 59.5138 29.2966 178.5615 58 D 4.6081 7.9262 113.8822 54.4221 39.5365 176.0349 59 E 4.5131 7.8136 118.0981 55.8924 30.5784 176.1129 60 V 3.1855 7.5128 120.1480 61.8426 31.9332 174.0260 61 P 4.1155 0.0000 0.0000 62.6047 31.8135 176.6649 62 E 3.8501 8.8442 121.9279 59.4721 29.5693 178.1953 63 D 4.6876 7.9699 114.6323 54.5879 39.9423 176.1253 64 M 5.0216 8.2022 119.6072 55.0869 33.4840 177.2507 65 Q 3.9790 7.9702 121.6336 59.3520 28.7076 178.5416 66 E 3.8863 8.3078 119.5852 59.4258 29.4462 178.8199 67 F 4.1483 8.6252 117.8035 60.1390 38.7457 177.4209 68 I 3.7321 7.7704 119.5718 64.5133 36.9663 177.9606 69 Q 3.9065 8.0000 119.5468 59.1194 28.8871 177.9445 70 L 4.0784 7.8579 122.5612 57.6852 42.0588 178.6762 71 N 4.3274 8.6945 116.4430 56.2243 38.2647 177.1396 72 A 3.8525 7.4944 120.8891 55.1913 18.3505 179.2621 73 E 3.9270 8.0455 116.0948 59.5510 29.6822 179.2661 74 L 3.5081 7.9576 119.7323 56.8845 41.3238 179.1345 75 A 3.8202 7.7106 120.1150 54.8870 18.2237 179.1601 76 E 3.9370 7.4984 115.9079 58.4289 29.6238 178.0818 77 V 4.2797 7.3463 109.1332 60.7811 33.4677 175.5946 78 W 5.2247 7.9538 119.8693 54.4633 30.8843 174.1099 79 P 4.7782 0.0000 0.0000 62.4763 32.3404 175.1403 80 N 4.1949 8.9242 121.0685 53.7062 39.7528 173.6776 81 I 4.6451 8.2352 125.6028 59.5115 40.1241 174.9924 82 T 4.5267 8.8185 117.3236 61.0383 70.1916 173.5029 83 E 4.6319 7.7259 121.3383 53.8712 32.5227 175.6276 84 K 4.0599 8.3608 123.8561 56.7250 32.7349 175.4316 85 K 4.6543 8.8224 124.5726 54.4073 35.7079 175.3228 86 D 4.5373 8.3866 120.9060 53.1272 41.2508 175.0935 87 P 4.7363 0.0000 0.0000 61.4939 32.2766 176.1836 88 L 4.0999 8.1586 119.9774 54.0680 42.0280 176.8632 89 P 4.3024 0.0000 0.0000 65.6180 31.1451 176.5204 90 D 5.0038 7.9134 117.5046 53.2453 42.1181 177.6513 91 A 4.2882 8.4373 125.6193 54.8053 17.9792 180.0574 92 E 4.1123 8.1927 114.3030 59.6771 29.8079 178.6550 93 D 4.3772 7.8807 118.7335 56.6992 41.1768 178.0897 94 W 4.6477 8.1095 117.9084 56.8788 29.2587 175.2867 95 D 4.7209 7.9112 118.7851 57.6103 40.3237 175.7090 96 G 4.1268 9.4677 116.1543 45.4540 0.0000 173.4510 97 V 3.8006 7.6858 120.7087 62.3687 32.0758 175.8723 98 K 4.3564 8.6913 126.1639 56.8368 33.8977 176.4009 99 G 4.2131 8.7424 105.3356 46.7412 0.0000 175.5343 100 K 4.3568 7.8639 116.0119 57.3066 32.4636 179.0620 101 L 4.1255 8.3123 122.4166 57.9026 42.0776 178.9082 102 Q 4.0266 7.7357 115.8670 58.5378 28.4862 176.5929 103 H 4.6651 8.0794 114.6142 55.0650 29.1731 174.7606 104 L 4.0108 7.6352 123.0691 55.1167 42.2998 175.8396 105 E 4.7126 8.6007 125.1539 54.4749 31.5347 176.0948 106 R 4.5285 8.6682 121.9906 56.8107 30.2150 175.9180 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 8.12 4.45 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 2 F 8.46 4.71 0.00 2.92 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 3 V 9.23 4.55 2.19 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 1.18 0.00 0.00 0.97 0.00 0.00 4 V 9.00 4.47 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 0.90 0.00 0.00 1.09 0.00 0.00 5 T 8.65 3.88 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 1.31 0.00 0.00 6 D 7.51 4.09 0.00 2.57 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 7 N 8.16 4.49 0.00 2.79 3.03 0.00 0.00 7.30 8.00 0.00 0.00 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 C 8.20 4.39 0.00 3.14 3.52 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 9 I 7.85 4.20 1.91 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.90 0.83 0.00 0.00 10 K 8.85 3.84 0.00 1.71 1.33 0.00 0.61 0.00 0.00 1.07 0.00 0.00 2.20 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.70 0.21 7.81 11 C 7.33 4.15 0.00 3.04 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 0.00 0.00 0.00 0.00 12 K 8.37 4.14 0.00 1.80 1.61 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.34 7.81 13 Y 7.42 3.98 0.00 3.05 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 14 T 8.13 3.38 4.14 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 1.20 0.00 0.00 15 E 7.61 4.05 0.00 2.15 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 2.36 2.34 0.00 16 C 7.76 4.15 0.00 2.82 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 17 V 6.88 3.50 1.91 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 0.36 0.00 0.00 0.83 0.00 0.00 18 E 7.95 3.94 0.00 1.89 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 2.24 2.19 0.00 19 V 7.04 3.76 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 0.73 0.00 0.00 0.90 0.00 0.00 20 C 7.81 4.29 0.00 3.32 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 21 P 0.00 4.32 0.00 2.21 2.16 0.00 3.79 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 1.98 1.97 0.00 22 V 7.76 4.13 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 0.76 0.00 0.00 1.00 0.00 0.00 23 D 7.39 4.41 0.00 2.79 2.63 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 24 C 7.52 5.07 0.00 3.08 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 25 F 8.07 5.13 0.00 3.02 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 26 Y 9.36 5.20 0.00 3.14 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 27 E 9.48 4.88 0.00 1.76 1.87 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 2.14 2.04 0.00 28 G 8.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.28 0.00 2.08 2.06 0.00 3.62 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.94 0.00 30 N 7.49 4.96 0.00 2.74 2.85 0.00 0.00 6.22 8.15 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 31 F 7.57 5.11 0.00 3.07 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 32 L 7.60 5.36 0.00 1.45 1.63 0.81 0.79 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 33 V 9.07 4.68 2.13 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 0.84 0.00 0.00 1.19 0.00 0.00 34 I 8.86 4.53 1.95 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.29 0.79 0.00 0.00 35 H 9.25 4.31 0.00 3.30 3.28 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.30 0.00 2.26 2.18 0.00 3.59 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 1.92 2.00 0.00 37 D 8.20 4.55 0.00 2.74 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 38 E 8.15 4.22 0.00 2.04 2.00 0.00 0.00 0.00 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 2.06 0.00 39 C 7.67 4.04 0.00 3.02 2.90 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 40 I 8.38 4.29 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 1.41 0.77 0.98 0.00 0.00 41 D 8.04 4.60 0.00 2.97 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 42 C 7.96 3.92 0.00 3.05 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 43 A 6.90 2.59 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 44 L 7.31 3.95 0.00 1.50 1.70 0.88 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 45 C 7.87 4.28 0.00 3.34 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 46 E 7.78 3.92 0.00 2.22 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 0.00 2.42 2.40 0.00 47 P 0.00 4.35 0.00 2.23 2.13 0.00 3.81 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.02 0.00 48 E 7.81 4.30 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 2.45 2.40 0.00 49 C 7.35 4.27 0.00 3.10 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 50 P 0.00 3.99 0.00 0.79 1.57 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.78 0.00 51 A 8.07 4.50 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 52 Q 7.77 3.22 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 53 A 7.80 4.52 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 54 I 7.56 4.83 1.92 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 1.18 0.00 0.00 55 F 9.24 4.95 0.00 2.96 2.80 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 56 S 8.43 2.79 0.00 3.21 3.47 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 0.00 0.00 0.00 0.00 57 E 8.36 3.86 0.00 2.13 1.88 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 2.28 2.25 0.00 58 D 7.93 4.61 0.00 2.79 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 7.81 4.51 0.00 2.08 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 2.25 2.19 0.00 60 V 7.51 3.19 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 0.74 0.00 0.00 1.04 0.00 0.00 61 P 0.00 4.12 0.00 2.11 1.82 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 62 E 8.84 3.85 0.00 1.93 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 2.36 2.24 0.00 63 D 7.97 4.69 0.00 2.83 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 64 M 8.20 5.02 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.60 0.00 65 Q 7.97 3.98 0.00 2.05 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.68 0.00 0.00 0.00 0.00 0.00 2.67 2.51 0.00 66 E 8.31 3.89 0.00 1.96 1.83 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 2.09 1.90 0.00 67 F 8.63 4.15 0.00 3.32 3.40 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 68 I 7.77 3.73 1.96 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 1.44 1.55 0.92 0.00 0.00 69 Q 8.00 3.91 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.72 2.37 0.00 70 L 7.86 4.08 0.00 1.94 1.81 0.81 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.69 4.33 0.00 3.06 3.09 0.00 0.00 7.53 7.33 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 72 A 7.49 3.85 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 73 E 8.05 3.93 0.00 2.09 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 2.41 2.21 0.00 74 L 7.96 3.51 0.00 1.33 0.43 0.51 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.71 3.82 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 76 E 7.50 3.94 0.00 2.03 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 2.39 2.38 0.00 77 V 7.35 4.28 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 0.68 0.00 0.00 0.74 0.00 0.00 78 W 7.95 5.22 0.00 3.60 3.24 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 79 P 0.00 4.78 0.00 2.17 2.25 0.00 3.99 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 2.09 1.97 0.00 80 N 8.92 4.19 0.00 2.61 2.69 0.00 0.00 5.85 7.75 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 81 I 8.24 4.65 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 1.20 1.00 0.94 0.00 0.00 82 T 8.82 4.53 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 1.28 0.00 0.00 83 E 7.73 4.63 0.00 1.89 1.82 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 2.16 2.21 0.00 84 K 8.36 4.06 0.00 1.69 1.68 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.49 7.81 85 K 8.82 4.65 0.00 1.59 1.57 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.30 1.35 7.81 86 D 8.39 4.54 0.00 2.70 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 87 P 0.00 4.74 0.00 2.07 1.87 0.00 3.78 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 88 L 8.16 4.10 0.00 1.68 1.52 0.84 0.78 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 89 P 0.00 4.30 0.00 2.19 2.23 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 90 D 7.91 5.00 0.00 2.91 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 91 A 8.44 4.29 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 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.19 4.11 0.00 2.19 2.19 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 2.31 2.49 0.00 93 D 7.88 4.38 0.00 2.63 2.45 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 0.00 0.00 0.00 0.00 94 W 8.11 4.65 0.00 3.39 3.25 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 95 D 7.91 4.72 0.00 3.04 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 96 G 9.47 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 97 V 7.69 3.80 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 0.98 0.00 0.00 0.84 0.00 0.00 98 K 8.69 4.36 0.00 2.00 1.97 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.42 7.81 99 G 8.74 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 0.00 0.00 0.00 100 K 7.86 4.36 0.00 2.13 1.88 0.00 1.90 0.00 0.00 2.13 0.00 0.00 3.24 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.76 1.76 7.81 101 L 8.31 4.13 0.00 2.07 1.71 0.61 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.74 4.03 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.88 0.00 0.00 0.00 0.00 0.00 2.47 1.90 0.00 103 H 8.08 4.67 0.00 3.04 3.10 0.00 5.86 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.64 4.01 0.00 1.52 1.62 1.04 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.60 4.71 0.00 2.02 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 2.25 2.38 0.00 106 R 8.67 4.53 0.00 1.88 1.94 0.00 3.81 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00