NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.5337 8.3044 120.2868 55.2909 33.8661 173.9392 3 V 4.2295 8.0556 121.5464 59.8215 33.7926 172.9017 4 W 4.5605 9.1750 135.0000 57.5333 31.6078 174.8682 5 T 4.1395 8.0827 123.9443 61.5329 66.9101 172.6039 6 P 4.4736 0.0000 0.0000 63.4635 32.2609 175.7504 7 V 3.9512 7.3597 120.1373 62.5338 32.4506 175.4708 8 N 4.1967 8.7442 126.1670 54.8396 35.8693 173.4438 9 N 5.0479 7.5018 108.3140 52.9836 40.1752 174.2108 10 K 4.1220 8.2652 115.9776 56.4716 32.7882 176.5637 11 M 5.0065 8.3026 120.6765 53.9447 35.3934 175.3991 12 F 4.6525 8.3226 116.2996 57.2996 41.2038 176.2255 13 E 3.4728 8.2474 123.6582 57.2763 28.0271 176.1582 14 T 3.8541 8.3645 123.2891 66.3044 68.8907 174.3279 15 F 4.5259 8.9710 124.0341 57.6915 36.8657 176.4660 16 S 4.4755 8.1173 114.3423 60.3840 63.0286 174.4525 17 Y 4.4622 8.2813 117.4681 57.9862 38.0195 175.0383 18 L 4.6847 7.6086 120.4394 52.2391 43.6201 174.5319 19 P 4.4632 0.0000 0.0000 61.7309 31.7938 175.0166 20 P 4.2807 0.0000 0.0000 62.9021 31.7494 176.4386 21 L 4.0053 8.3222 122.6980 54.7311 42.2120 177.9603 22 T 4.2141 8.1958 113.9595 61.2140 71.0966 175.2083 23 D 4.3707 8.6148 121.4246 57.7913 40.7166 178.9006 24 E 3.9346 8.1087 119.1160 59.1697 29.6396 178.5996 25 Q 3.9986 7.8631 117.7474 58.3818 28.8267 178.4209 26 I 3.6952 8.1243 121.2419 64.3265 37.1306 178.2205 27 A 4.0317 8.2513 121.4873 55.1632 18.1476 179.5930 28 A 3.9651 7.8806 118.9977 55.3302 18.4501 179.9036 29 Q 4.0789 7.9559 116.3026 59.0775 28.8174 179.0581 30 V 3.7416 8.1681 119.3340 66.2445 31.5069 177.6372 31 D 4.4282 8.3931 118.6629 57.7403 40.5510 178.2952 32 Y 4.0865 8.2176 119.8584 60.6249 38.7602 178.0589 33 I 3.9581 8.0804 120.7744 64.5683 37.2599 178.5638 34 V 3.4930 7.9227 118.5252 66.0462 31.2100 177.7722 35 A 3.8565 8.3512 119.5453 54.7476 18.1983 178.3424 36 N 4.0952 7.0540 112.1721 52.0538 38.7269 175.6876 37 G 3.7742 7.4879 108.4345 46.0874 0.0000 174.0618 38 W 4.9619 7.5405 118.7375 55.9397 30.7348 176.5080 39 I 4.3327 8.9583 123.5677 59.7046 37.5790 174.0647 40 P 4.8838 0.0000 0.0000 62.9735 32.7968 175.1926 41 C 4.9744 8.7590 120.4840 58.5987 35.6889 172.4074 42 L 5.3191 8.6727 124.0461 53.2004 44.3131 175.2067 43 E 5.6303 9.0988 121.3342 54.9807 34.0606 174.6422 44 F 5.5775 9.0895 115.4168 56.0990 41.8382 172.9516 45 A 4.5286 8.2473 120.7638 50.1463 22.8216 176.1440 46 E 4.4227 8.5805 118.3965 55.4918 30.8686 177.8078 47 A 4.3461 8.6865 121.8500 55.6676 18.4627 179.7810 48 D 4.4623 8.1645 113.8025 56.5182 41.0782 177.2485 49 K 4.5898 7.7133 116.7686 56.0565 32.4591 177.0571 50 A 3.8144 7.6543 124.5907 54.2435 18.5983 178.3297 51 Y 4.6426 7.4193 111.4893 55.5340 40.1346 175.7014 52 V 3.7577 8.2531 122.4885 63.9014 31.9842 175.1314 53 S 4.7020 8.8833 119.4192 56.9706 66.1094 173.8471 54 N 5.0560 8.6072 114.7948 52.6884 39.0112 176.0963 55 E 3.9147 8.2943 120.5592 59.9129 29.3692 179.1033 56 S 4.0496 8.5704 114.8211 60.3618 62.9077 175.9232 57 A 2.5800 7.7392 123.5073 53.4536 17.8011 179.0446 58 I 3.5907 6.9565 116.3471 63.2990 38.0489 177.0057 59 R 4.3635 7.2588 116.5105 55.4326 30.6260 176.2017 60 F 5.0314 7.1622 118.1280 56.1699 41.1835 177.2094 61 G 4.0744 8.2278 117.9448 46.4105 0.0000 175.9881 62 S 4.6202 8.4508 114.6920 58.6079 62.1273 174.4586 63 V 4.4104 7.3053 107.2823 61.2281 33.1099 177.3259 64 S 4.5714 8.1624 113.3998 58.6519 63.5611 173.2971 65 C 4.1683 8.0115 119.5444 61.5336 27.9254 173.1859 66 L 3.5983 8.4331 123.9839 55.7306 38.9020 173.3113 67 Y 4.4661 7.4896 118.9863 55.8501 40.2988 174.5173 68 Y 4.9164 7.3034 123.3067 56.3183 42.3431 174.7465 69 D 4.4829 9.0192 123.8011 55.4853 41.6785 177.0003 70 N 4.5496 8.9400 117.2717 54.0159 35.9019 176.0441 71 R 3.9502 7.9548 118.3920 59.3261 30.3979 177.1124 72 Y 4.3608 7.7050 114.4987 57.9703 38.3020 175.1600 73 W 5.0598 8.6428 123.6764 55.1348 32.9697 174.5142 74 T 4.2146 8.1948 117.4443 62.7613 69.1292 174.7574 75 M 4.5598 8.5930 126.9729 55.4580 33.1564 175.2546 76 W 4.8340 9.5912 135.0000 55.9517 31.2121 176.9041 77 K 3.4461 8.5305 129.2516 57.6158 30.4032 178.1376 78 L 4.9254 8.2441 125.3686 52.6361 45.0545 174.0173 79 P 4.3138 0.0000 0.0000 63.4598 32.0525 177.7639 80 M 4.3165 8.6670 124.0362 53.6102 30.3861 175.5551 81 F 4.3812 7.4744 118.7970 58.8613 40.0400 175.9492 82 G 3.9536 9.0950 111.5894 46.1763 0.0000 172.8830 83 C 4.3109 7.9347 120.1772 59.3680 31.6567 173.4745 84 R 4.5935 8.6261 124.9356 55.5875 30.8852 174.6990 85 D 4.6698 7.8221 117.5959 51.1530 43.3415 174.0121 86 P 4.3082 0.0000 0.0000 66.0743 31.2412 178.4606 87 M 4.1040 8.2635 117.3190 58.3436 31.7960 178.4477 88 Q 3.9723 8.0039 119.7223 59.1534 29.2051 178.7592 89 V 3.5915 7.6415 118.5744 66.1258 31.8865 177.7050 90 L 4.0281 7.9535 118.7093 58.0983 41.3880 179.8852 91 R 3.9993 8.3887 118.1343 59.2391 29.8924 178.9873 92 E 4.1115 8.1057 118.1387 59.2039 29.4217 179.3311 93 I 3.5222 7.8387 120.0643 64.1880 37.1445 178.5133 94 V 3.4672 7.5962 118.2651 65.9966 31.4000 177.8753 95 A 3.9482 8.0711 120.5459 55.2384 18.2437 179.2126 96 C 2.0000 7.6063 117.3895 62.1112 31.1811 175.9803 97 T 3.7761 7.6221 111.1357 64.1473 68.0503 176.5926 98 K 3.8254 7.5874 122.0495 59.3367 32.3322 178.3809 99 A 3.9724 7.6134 119.9163 53.6005 19.7390 177.7055 100 F 4.6973 7.7135 115.5697 55.0251 38.9745 174.1427 101 P 4.4005 0.0000 0.0000 64.2575 31.8603 177.8999 102 D 4.6684 8.0613 116.5439 53.8686 41.2855 175.4884 103 A 4.7572 7.3180 121.4473 50.5523 21.1396 177.1326 104 Y 4.2066 8.5694 118.0477 57.8486 39.3891 175.2029 105 V 5.2981 8.8914 123.3711 61.0966 35.1973 174.3472 106 R 4.9948 9.3020 123.2519 54.2929 33.1771 173.6566 107 L 4.6466 8.1854 123.9387 54.0090 43.7008 175.7265 108 V 4.7676 8.6748 118.4787 59.5471 36.4735 174.2016 109 A 4.8662 7.9755 121.6741 50.5986 22.8108 175.2281 110 F 5.2371 9.0452 120.5427 55.7986 42.3673 174.1729 111 D 5.3697 8.7056 122.6624 52.8615 42.3155 176.6843 112 N 4.7554 9.1287 122.7059 54.1423 38.4917 176.4931 113 Q 4.1604 8.9112 118.9798 59.1153 28.9225 177.7537 114 K 4.0213 8.2599 114.6914 57.0827 32.9278 176.6250 115 Q 3.4773 7.9222 118.5014 55.7427 27.0084 172.6642 116 V 4.4562 7.8169 116.8175 60.0223 34.9825 173.9566 117 Q 4.3484 8.8443 123.6615 56.8366 29.1381 175.6913 118 I 4.1708 7.9292 125.1234 60.9666 39.1097 174.3797 119 M 4.3883 6.6851 116.8906 55.1763 33.9855 173.7323 120 G 4.2443 8.4158 105.7814 46.2449 0.0000 172.3930 121 F 5.1042 7.6060 116.1278 55.2236 41.7126 173.0239 122 L 4.5428 8.8295 122.8158 55.5470 42.0536 176.7802 123 V 4.5439 8.9290 118.1499 61.4706 34.0651 175.6346 124 Q 4.6427 7.7759 121.0841 54.5782 32.3438 173.1245 125 R 4.4203 8.1362 121.6588 52.9157 32.8073 173.4837 126 P 4.1681 0.0000 0.0000 62.5832 31.6751 177.5532 127 K 4.1290 8.4907 120.4592 59.4038 32.6566 177.7736 128 T 4.1088 7.7721 108.1277 62.4187 69.3754 174.7225 129 A 4.2546 7.9289 126.8572 52.9166 18.6437 177.3491 130 R 4.5676 8.8177 120.3722 55.9109 31.6359 175.4745 131 D 4.9380 8.4395 116.6792 52.7321 39.7293 175.4587 132 F 5.3193 7.7208 112.9725 55.5019 41.0049 173.7414 133 Q 4.4980 8.3787 120.3268 53.0344 31.2369 174.1623 134 P 4.4381 0.0000 0.0000 62.3806 32.2593 176.8930 135 A 3.9729 8.9726 124.1247 55.7039 18.1406 179.3201 136 N 4.5988 8.1021 109.3205 54.1725 37.7415 175.5226 137 K 4.4593 8.0779 117.9632 56.3562 32.8090 177.3579 138 R 3.5951 7.5993 121.2184 57.6335 30.1506 176.6038 139 S 5.1072 7.5180 110.3961 56.3131 65.9596 174.2850 140 V 3.9941 8.4838 114.2869 61.7557 32.2342 175.6441 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 2 M 8.30 4.53 0.00 1.98 2.14 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.58 0.00 3 V 8.06 4.23 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 1.09 0.00 0.00 0.97 0.00 0.00 4 W 9.17 4.56 0.00 3.49 3.06 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 5 T 8.08 4.14 4.07 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 1.05 0.00 0.00 6 P 0.00 4.47 0.00 2.23 2.19 0.00 3.78 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 1.96 1.96 0.00 7 V 7.36 3.95 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 0.76 0.00 0.00 0.91 0.00 0.00 8 N 8.74 4.20 0.00 2.80 2.88 0.00 0.00 6.84 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 9 N 7.50 5.05 0.00 2.48 2.66 0.00 0.00 7.31 6.68 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 10 K 8.27 4.12 0.00 1.93 1.50 0.00 0.61 0.00 0.00 1.25 0.00 0.00 2.29 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.30 1.39 7.81 11 M 8.30 5.01 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.64 0.00 12 F 8.32 4.65 0.00 3.12 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 13 E 8.25 3.47 0.00 2.14 1.63 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 2.20 2.14 0.00 14 T 8.36 3.85 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 0.11 0.00 0.00 15 F 8.97 4.53 0.00 3.33 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 16 S 8.12 4.48 0.00 4.18 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 0.00 17 Y 8.28 4.46 0.00 3.01 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 18 L 7.61 4.68 0.00 1.87 1.62 0.87 0.98 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 19 P 0.00 4.46 0.00 2.04 2.00 0.00 3.71 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 2.03 2.13 0.00 20 P 0.00 4.28 0.00 2.04 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 2.07 2.18 0.00 21 L 8.32 4.01 0.00 1.57 1.47 0.35 0.52 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 22 T 8.20 4.21 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 23 D 8.61 4.37 0.00 2.70 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 24 E 8.11 3.93 0.00 2.01 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 0.00 2.35 2.38 0.00 25 Q 7.86 4.00 0.00 2.28 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.59 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 26 I 8.12 3.70 2.05 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.74 1.09 0.00 0.00 27 A 8.25 4.03 1.40 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 0.00 0.00 28 A 7.88 3.97 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 29 Q 7.96 4.08 0.00 2.42 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.33 1.87 0.00 30 V 8.17 3.74 2.31 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 1.10 0.00 0.00 1.13 0.00 0.00 31 D 8.39 4.43 0.00 2.98 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 32 Y 8.22 4.09 0.00 3.20 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 33 I 8.08 3.96 2.17 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.90 1.08 0.00 0.00 34 V 7.92 3.49 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 1.07 0.00 0.00 1.01 0.00 0.00 35 A 8.35 3.86 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 36 N 7.05 4.10 0.00 1.44 1.42 0.00 0.00 7.03 7.63 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 37 G 7.49 3.77 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 0.00 0.00 0.00 38 W 7.54 4.96 0.00 3.37 3.07 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 39 I 8.96 4.33 2.12 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.90 0.75 0.00 0.00 40 P 0.00 4.88 0.00 2.09 1.99 0.00 3.82 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.14 0.00 41 C 8.76 4.97 0.00 3.07 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 L 8.67 5.32 0.00 1.87 1.65 0.85 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43 E 9.10 5.63 0.00 2.06 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 0.00 2.35 2.30 0.00 44 F 9.09 5.58 0.00 3.08 3.04 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 45 A 8.25 4.53 -0.12 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 0.00 0.00 46 E 8.58 4.42 0.00 2.18 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 0.00 2.30 2.27 0.00 47 A 8.69 4.35 1.47 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 0.00 0.00 48 D 8.16 4.46 0.00 2.70 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 49 K 7.71 4.59 0.00 1.53 1.70 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.42 7.81 50 A 7.65 3.81 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.42 4.64 0.00 2.93 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 52 V 8.25 3.76 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 0.57 0.00 0.00 0.77 0.00 0.00 53 S 8.88 4.70 0.00 4.07 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 54 N 8.61 5.06 0.00 2.75 2.86 0.00 0.00 6.55 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 55 E 8.29 3.91 0.00 2.15 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 2.39 2.39 0.00 56 S 8.57 4.05 0.00 4.06 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 57 A 7.74 2.58 1.11 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 0.00 0.00 0.00 0.00 0.00 58 I 6.96 3.59 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.81 0.89 0.00 0.00 59 R 7.26 4.36 0.00 1.91 1.99 0.00 3.19 0.00 0.00 3.21 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 60 F 7.16 5.03 0.00 3.00 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 61 G 8.23 4.07 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 0.00 62 S 8.45 4.62 0.00 3.86 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 63 V 7.31 4.41 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 0.66 0.00 0.00 0.48 0.00 0.00 64 S 8.16 4.57 0.00 4.12 4.31 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 65 C 8.01 4.17 0.00 2.96 2.94 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 66 L 8.43 3.60 0.00 1.78 1.76 0.94 0.96 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 67 Y 7.49 4.47 0.00 2.94 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 68 Y 7.30 4.92 0.00 2.81 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 69 D 9.02 4.48 0.00 2.87 2.66 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 0.00 0.00 0.00 0.00 70 N 8.94 4.55 0.00 3.05 3.26 0.00 0.00 7.00 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 71 R 7.95 3.95 0.00 1.53 1.69 0.00 3.08 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 72 Y 7.70 4.36 0.00 3.05 2.85 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 0.00 73 W 8.64 5.06 0.00 3.05 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 74 T 8.19 4.21 2.85 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 0.96 0.00 0.00 75 M 8.59 4.56 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.79 0.00 76 W 9.59 4.83 0.00 3.67 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 77 K 8.53 3.45 0.00 1.69 0.84 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.88 0.21 7.81 78 L 8.24 4.93 0.00 1.60 1.58 1.01 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.31 0.00 0.63 1.80 0.00 3.65 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.15 0.00 80 M 8.67 4.32 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 81 F 7.47 4.38 0.00 3.10 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 82 G 9.10 3.95 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 0.00 0.00 0.00 83 C 7.93 4.31 0.00 3.00 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 84 R 8.63 4.59 0.00 1.80 1.87 0.00 3.22 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.72 0.00 85 D 7.82 4.67 0.00 2.63 2.51 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 86 P 0.00 4.31 0.00 2.22 2.13 0.00 3.67 0.00 0.00 3.78 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 87 M 8.26 4.10 0.00 2.08 2.26 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.71 0.00 88 Q 8.00 3.97 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 89 V 7.64 3.59 2.26 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 1.05 0.00 0.00 1.02 0.00 0.00 90 L 7.95 4.03 0.00 1.92 1.73 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.39 4.00 0.00 2.02 2.01 0.00 3.15 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 92 E 8.11 4.11 0.00 2.22 2.16 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 2.61 2.65 0.00 93 I 7.84 3.52 1.99 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 1.35 0.78 0.85 0.00 0.00 94 V 7.60 3.47 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 0.98 0.00 0.00 0.93 0.00 0.00 95 A 8.07 3.95 1.50 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 0.00 0.00 96 C 7.61 2.00 0.00 1.23 2.39 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 97 T 7.62 3.78 4.28 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 1.13 0.00 0.00 98 K 7.59 3.83 0.00 1.84 1.94 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.39 7.81 99 A 7.61 3.97 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 0.00 100 F 7.71 4.70 0.00 2.78 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 0.00 101 P 0.00 4.40 0.00 2.12 2.11 0.00 3.28 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.87 0.00 102 D 8.06 4.67 0.00 2.68 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 0.00 103 A 7.32 4.76 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 0.00 104 Y 8.57 4.21 0.00 2.51 2.70 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 0.00 105 V 8.89 5.30 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 0.95 0.00 0.00 0.92 0.00 0.00 106 R 9.30 4.99 0.00 1.87 1.94 0.00 2.34 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.34 0.00 107 L 8.19 4.65 0.00 1.51 0.72 0.84 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.67 4.77 1.63 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 0.41 0.00 0.00 0.50 0.00 0.00 109 A 7.98 4.87 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 0.00 110 F 9.05 5.24 0.00 2.99 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 0.00 111 D 8.71 5.37 0.00 2.44 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 0.00 112 N 9.13 4.76 0.00 2.94 3.05 0.00 0.00 6.30 7.39 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 0.00 113 Q 8.91 4.16 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.05 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 114 K 8.26 4.02 0.00 1.76 1.87 0.00 2.08 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.46 7.81 115 Q 7.92 3.48 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 116 V 7.82 4.46 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 0.54 0.00 0.00 0.91 0.00 0.00 117 Q 8.84 4.35 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.19 1.91 0.00 118 I 7.93 4.17 1.23 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 0.61 -0.61 0.00 0.00 119 M 6.69 4.39 0.00 2.09 2.22 0.00 0.00 0.00 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.67 0.00 120 G 8.42 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 0.00 121 F 7.61 5.10 0.00 3.26 3.29 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 0.00 122 L 8.83 4.54 0.00 1.65 1.65 0.58 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.93 4.54 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 0.72 0.00 0.00 0.91 0.00 0.00 124 Q 7.78 4.64 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 8.14 4.42 0.00 1.22 1.53 0.00 2.21 0.00 0.00 2.60 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.26 0.00 126 P 0.00 4.17 0.00 2.10 2.20 0.00 2.23 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 127 K 8.49 4.13 0.00 1.89 1.99 0.00 1.55 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.40 7.81 128 T 7.77 4.11 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 1.21 0.00 0.00 129 A 7.93 4.25 1.59 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 0.00 0.00 130 R 8.82 4.57 0.00 1.79 1.87 0.00 3.17 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.79 0.00 131 D 8.44 4.94 0.00 2.89 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 0.00 132 F 7.72 5.32 0.00 3.21 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 0.00 133 Q 8.38 4.50 0.00 1.88 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.02 0.00 0.00 0.00 0.00 0.00 2.28 2.04 0.00 134 P 0.00 4.44 0.00 2.35 2.19 0.00 3.58 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 135 A 8.97 3.97 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 0.00 136 N 8.10 4.60 0.00 2.84 2.95 0.00 0.00 5.85 7.13 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 0.00 137 K 8.08 4.46 0.00 1.59 1.71 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.30 7.81 138 R 7.60 3.60 0.00 1.48 0.66 0.00 3.04 0.00 0.00 2.98 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.54 0.00 139 S 7.52 5.11 0.00 4.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 8.48 3.99 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 0.61 0.00 0.00 0.95 0.00 0.00