NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3329 8.2649 123.5852 51.7850 19.9098 177.8542 3 R 4.1954 8.2174 117.1940 56.1450 26.6474 175.2494 4 I 3.6614 7.8298 123.8319 63.1357 39.3393 176.4852 5 A 4.3348 7.8517 125.1881 51.7684 18.4413 178.6938 6 G 4.2487 8.3811 114.6971 45.7760 0.0000 174.1402 7 V 4.2789 8.0592 114.9778 63.9446 34.7391 175.8108 8 E 4.1819 8.1347 119.1745 56.6544 29.8279 176.0701 9 I 4.7152 7.8954 123.4402 58.9250 38.3525 173.8602 10 P 4.5316 0.0000 0.0000 61.8166 30.1227 176.1681 11 R 4.1759 7.5040 118.6875 56.5621 32.3358 176.3270 12 N 4.0641 8.5485 113.4988 53.5884 35.8782 173.4463 13 K 4.2843 7.5936 116.0857 54.1637 35.5292 174.4905 14 R 3.9259 8.3507 120.3037 56.9229 31.3325 178.2131 15 V 3.7332 7.8924 115.5599 64.4188 31.4007 178.5551 16 D 4.5121 7.9880 118.4929 56.6220 39.6052 178.7523 17 V 3.4155 7.8060 119.4527 65.2256 31.1834 177.4213 18 A 4.2666 8.5553 121.1297 55.5489 18.3107 179.6866 19 L 4.1503 7.6869 116.8252 57.9903 41.3895 179.8524 20 T 4.6902 7.5525 116.7059 66.4641 68.4435 175.9797 21 Y 4.1984 7.4649 116.1715 59.6793 38.3372 177.2873 22 I 4.1321 7.3040 121.4724 61.1952 37.9224 174.7980 23 Y 4.1617 9.6277 127.6598 58.8676 39.0004 176.6566 24 G 3.8363 8.5203 115.6011 44.9910 0.0000 172.8475 25 I 4.3300 7.7369 120.7915 59.4400 39.0024 174.0749 26 G 4.1545 8.0421 121.1356 45.3854 0.0000 174.4093 27 K 4.0311 8.5828 119.0002 59.1160 32.3206 179.4781 28 A 3.9549 7.7348 120.4954 55.3471 18.3141 179.6189 29 R 4.1523 7.9300 115.2091 58.5332 29.2268 178.8602 30 A 4.0856 7.3591 118.2011 54.8392 19.0341 179.3774 31 K 4.0046 7.9753 115.2370 58.1699 31.5672 179.0490 32 E 4.1803 8.0128 120.7388 59.1545 29.3396 178.2771 33 A 4.5836 7.8125 120.2188 54.7229 18.4771 179.7958 34 L 3.8453 7.5051 118.4752 58.2488 41.6400 179.4756 35 E 4.1164 7.7007 115.4989 58.5115 29.4541 178.4675 36 K 4.4540 7.4647 115.5768 56.3902 32.3582 177.1420 37 T 4.3622 6.8538 106.8286 60.5135 70.0457 173.9549 38 G 4.0055 8.3404 107.4488 46.6043 0.0000 173.7026 39 I 3.8804 7.4170 119.8524 60.4169 37.4530 175.5397 40 N 4.4967 8.6591 124.0735 52.7908 39.2646 173.9856 41 P 4.0989 0.0000 0.0000 64.9048 31.8869 177.8053 42 A 4.0602 7.5321 121.3086 55.2580 18.2751 178.1607 43 T 4.1188 7.7488 104.8545 62.1045 69.7829 172.9513 44 R 5.0445 7.8295 119.8780 55.4714 31.4034 176.5119 45 V 4.2891 8.3183 117.5083 63.5814 33.0418 177.1718 46 K 4.3835 8.0183 116.8642 57.9996 33.3072 176.8103 47 D 4.7634 7.6185 120.0555 52.3483 39.1234 174.7576 48 L 4.8024 7.5829 118.0496 54.6424 43.5728 177.0423 49 T 4.0170 7.8153 117.1979 63.9148 69.8839 175.7369 50 E 3.9969 8.7482 123.1683 59.3044 29.4988 179.3085 51 A 4.0141 8.0637 120.5142 55.5893 18.2990 179.4060 52 E 3.5877 8.1185 116.0916 59.0579 29.4841 179.1791 53 V 3.6545 7.4965 116.9471 64.9168 31.7523 177.0314 54 V 4.2727 7.3136 115.8388 63.6655 33.2399 177.2963 55 R 3.8102 8.5794 119.4125 59.4857 29.9084 178.3622 56 L 4.1389 8.1140 120.3289 58.4579 42.0498 178.0000 57 R 4.0202 8.1091 118.8103 58.7932 30.0233 177.4642 58 E 3.9080 8.6898 119.4081 60.2719 29.7434 177.7909 59 Y 4.2240 7.7844 118.3109 61.4744 38.7207 178.3369 60 V 2.8277 7.8845 118.6230 65.4506 31.7099 178.0427 61 E 4.0110 8.0330 118.5838 59.3426 29.5590 177.9169 62 N 4.5715 7.8247 114.3709 55.5073 39.2533 176.7005 63 T 3.8039 7.3581 117.1460 64.6491 68.6868 173.9703 64 W 5.3100 6.7595 114.7194 53.7628 31.5842 174.8638 65 K 3.9332 8.7554 118.4759 57.5923 32.0552 175.7951 66 L 4.2167 8.0241 120.9059 56.4899 43.4903 174.0368 67 E 3.8965 8.6056 119.9604 55.5761 29.7556 174.2269 68 G 3.7179 8.6288 103.2068 48.0820 0.0000 175.3461 69 E 4.0538 8.1611 119.3008 59.0182 29.6947 178.9197 70 L 3.9849 8.2545 121.7719 58.1577 42.1972 178.8013 71 R 3.9698 8.1660 117.9452 59.4012 29.8910 177.8616 72 A 3.9600 8.0815 120.5283 55.2848 18.2730 179.2636 73 E 3.8688 7.8545 117.3075 59.2360 29.4957 178.8591 74 V 3.5681 7.6457 117.0482 66.3667 31.5480 177.7815 75 A 4.1053 8.9507 120.9052 54.6417 18.1360 179.6240 76 A 3.8251 8.3151 120.1304 55.5065 18.7829 179.5023 77 N 4.3422 8.4659 115.0034 55.9469 38.4931 177.7175 78 I 3.7868 7.2361 121.3458 64.3132 37.3675 178.1383 79 K 3.8787 7.7877 118.7378 59.4944 31.5464 179.4265 80 R 3.8539 7.7812 117.6666 59.4357 30.6444 178.1473 81 L 4.1326 7.5156 116.2727 56.5489 41.3311 178.6572 82 M 4.0578 7.8671 119.2548 57.9659 32.5134 177.5159 83 D 4.4925 8.2318 117.5459 55.3857 39.4719 176.5435 84 I 4.1833 7.7073 118.9491 60.3863 40.4582 175.5239 85 G 3.8447 8.1623 106.7599 46.1561 0.0000 173.0750 86 C 4.4661 7.6594 113.6439 57.7522 32.1903 173.1649 87 Y 3.8161 8.4969 121.4283 60.5174 38.7870 177.7428 88 R 4.3068 8.1488 119.0403 58.7166 30.4404 178.9038 89 G 4.2603 7.7646 106.5533 47.0875 0.0000 175.4244 90 L 4.1883 7.5882 116.7408 55.4586 41.5165 178.5631 91 R 4.2666 7.5626 119.9415 58.7477 30.3642 178.3786 92 H 4.3022 8.1079 114.6733 58.9911 28.4844 176.8636 93 R 3.9196 8.1525 120.4270 59.1469 29.5685 178.1388 94 R 3.7295 7.6897 123.0253 57.7639 30.5699 177.8157 95 G 3.8327 7.3802 105.7041 45.8416 0.0000 173.4728 96 L 4.2917 7.5324 119.7971 52.8835 42.3903 174.9595 97 P 4.4466 0.0000 0.0000 63.0690 31.8320 176.4009 98 V 4.2203 8.1519 117.1496 63.0042 31.7064 176.2121 99 R 4.2618 7.9465 116.0444 56.2611 30.3955 176.7272 100 G 3.8646 8.1349 105.5186 46.4054 0.0000 173.9765 101 Q 4.2072 7.8569 118.3811 54.4415 29.6325 175.9448 102 R 4.0309 8.2889 118.0247 56.8487 29.3922 177.1433 103 T 4.1129 8.3665 114.4229 63.7820 69.6232 176.3685 104 R 3.9242 8.1379 122.1154 59.4066 30.1235 176.7744 105 T 4.4999 7.9720 105.5898 61.0027 71.7724 175.0808 106 N 4.1093 7.3812 111.9910 51.5562 39.8881 175.0082 107 A 3.7998 9.1817 118.6997 52.5442 15.5558 180.2858 108 R 3.9588 8.1035 120.3801 61.0856 30.3162 179.0845 109 T 3.6272 8.0067 113.2036 66.2866 68.4882 174.8537 110 R 4.4154 7.7723 117.6322 56.9170 31.4782 177.6845 111 K 3.9752 7.6651 116.9753 57.7895 32.2463 177.4452 112 G 3.9410 8.9303 104.6454 43.4520 0.0000 171.2295 113 P 4.2561 0.0000 0.0000 62.2734 31.5430 176.1656 114 R 3.7604 8.5589 119.0854 57.1715 29.8703 177.0573 115 K 4.3070 8.2894 123.8302 54.5841 30.5614 176.6435 116 T 3.5410 7.8906 118.5545 63.4079 69.1579 174.7326 117 V 3.6261 7.6506 126.8525 63.5855 32.5449 173.6864 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 A 8.26 4.33 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 R 8.22 4.20 0.00 1.91 1.94 0.00 3.22 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 4 I 7.83 3.66 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.78 0.96 0.00 0.00 5 A 7.85 4.33 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 6 G 8.38 4.25 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 0.00 7 V 8.06 4.28 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 0.84 0.00 0.00 0.93 0.00 0.00 8 E 8.13 4.18 0.00 2.13 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 2.45 2.53 0.00 9 I 7.90 4.72 1.87 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 1.48 0.83 0.91 0.00 0.00 10 P 0.00 4.53 0.00 2.24 2.25 0.00 3.97 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 2.04 0.00 11 R 7.50 4.18 0.00 1.81 1.93 0.00 3.32 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 12 N 8.55 4.06 0.00 2.76 2.87 0.00 0.00 6.60 7.61 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 13 K 7.59 4.28 0.00 1.74 1.64 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.30 1.39 7.81 14 R 8.35 3.93 0.00 1.91 2.23 0.00 3.50 0.00 0.00 3.36 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 15 V 7.89 3.73 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 0.87 0.00 0.00 1.07 0.00 0.00 16 D 7.99 4.51 0.00 2.93 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 17 V 7.81 3.42 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 1.17 0.00 0.00 0.97 0.00 0.00 18 A 8.56 4.27 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.69 4.15 0.00 1.79 1.80 1.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.55 4.69 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 1.00 0.00 0.00 21 Y 7.46 4.20 0.00 3.21 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 22 I 7.30 4.13 2.09 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.06 1.05 0.00 0.00 23 Y 9.63 4.16 0.00 2.99 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 24 G 8.52 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 25 I 7.74 4.33 2.13 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.15 1.01 0.00 0.00 26 G 8.04 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 0.00 0.00 0.00 27 K 8.58 4.03 0.00 1.81 1.75 0.00 1.59 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.54 7.81 28 A 7.73 3.95 1.28 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 29 R 7.93 4.15 0.00 1.75 2.12 0.00 2.53 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.23 0.00 30 A 7.36 4.09 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 31 K 7.98 4.00 0.00 1.89 1.90 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.63 7.81 32 E 8.01 4.18 0.00 2.34 2.42 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 2.47 2.86 0.00 33 A 7.81 4.58 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 34 L 7.51 3.85 0.00 2.09 1.88 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.70 4.12 0.00 2.06 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 0.00 2.37 2.46 0.00 36 K 7.46 4.45 0.00 2.00 1.61 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.68 7.81 37 T 6.85 4.36 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 0.83 0.00 0.00 38 G 8.34 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 39 I 7.42 3.88 1.89 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 1.22 0.86 0.93 0.00 0.00 40 N 8.66 4.50 0.00 2.80 2.70 0.00 0.00 7.23 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 41 P 0.00 4.10 0.00 2.10 2.12 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 2.04 2.10 0.00 42 A 7.53 4.06 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 43 T 7.75 4.12 4.25 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 1.22 0.00 0.00 44 R 7.83 5.04 0.00 1.87 1.90 0.00 3.29 0.00 0.00 3.17 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 45 V 8.32 4.29 2.17 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 0.87 0.00 0.00 1.04 0.00 0.00 46 K 8.02 4.38 0.00 1.90 2.10 0.00 1.63 0.00 0.00 1.76 0.00 0.00 3.29 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.42 7.81 47 D 7.62 4.76 0.00 2.73 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 48 L 7.58 4.80 0.00 1.75 1.82 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.82 4.02 4.44 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 1.23 0.00 0.00 50 E 8.75 4.00 0.00 2.05 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 2.40 2.44 0.00 51 A 8.06 4.01 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 52 E 8.12 3.59 0.00 2.17 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 2.39 2.35 0.00 53 V 7.50 3.65 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 0.80 0.00 0.00 0.98 0.00 0.00 54 V 7.31 4.27 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 0.99 0.00 0.00 0.98 0.00 0.00 55 R 8.58 3.81 0.00 1.90 1.97 0.00 3.11 0.00 0.00 3.06 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 56 L 8.11 4.14 0.00 1.74 1.76 1.01 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 57 R 8.11 4.02 0.00 2.02 1.88 0.00 3.28 0.00 0.00 3.28 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 58 E 8.69 3.91 0.00 2.24 1.99 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 2.33 2.50 0.00 59 Y 7.78 4.22 0.00 3.28 3.01 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 60 V 7.88 2.83 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 1.07 0.00 0.00 0.71 0.00 0.00 61 E 8.03 4.01 0.00 2.01 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 2.34 2.35 0.00 62 N 7.82 4.57 0.00 2.99 2.84 0.00 0.00 7.32 7.85 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 63 T 7.36 3.80 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 0.31 0.00 0.00 64 W 6.76 5.31 0.00 3.28 3.09 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 0.00 0.00 0.00 65 K 8.76 3.93 0.00 1.92 1.94 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.43 7.81 66 L 8.02 4.22 0.00 2.14 1.75 1.05 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.61 3.90 0.00 2.35 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 2.21 2.30 0.00 68 G 8.63 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 69 E 8.16 4.05 0.00 2.23 2.24 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 2.60 2.41 0.00 70 L 8.25 3.98 0.00 1.79 2.12 0.94 0.88 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 71 R 8.17 3.97 0.00 1.74 1.83 0.00 2.86 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 72 A 8.08 3.96 1.41 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 73 E 7.85 3.87 0.00 2.06 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 2.31 2.32 0.00 74 V 7.65 3.57 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 0.91 0.00 0.00 1.00 0.00 0.00 75 A 8.95 4.11 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 76 A 8.32 3.83 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 77 N 8.47 4.34 0.00 2.71 2.89 0.00 0.00 7.13 6.95 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 78 I 7.24 3.79 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.73 0.80 0.00 0.00 79 K 7.79 3.88 0.00 1.79 1.87 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.77 7.81 80 R 7.78 3.85 0.00 1.79 2.10 0.00 3.24 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 81 L 7.52 4.13 0.00 1.88 1.69 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 82 M 7.87 4.06 0.00 2.19 2.03 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.52 0.00 83 D 8.23 4.49 0.00 2.85 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 84 I 7.71 4.18 1.87 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 1.23 0.84 0.94 0.00 0.00 85 G 8.16 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 86 C 7.66 4.47 0.00 3.21 3.11 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 87 Y 8.50 3.82 0.00 3.00 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 88 R 8.15 4.31 0.00 1.94 2.00 0.00 3.20 0.00 0.00 3.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 89 G 7.76 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 0.00 0.00 0.00 0.00 90 L 7.59 4.19 0.00 1.45 1.58 0.79 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.56 4.27 0.00 2.09 2.22 0.00 3.26 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.86 0.00 92 H 8.11 4.30 0.00 3.24 3.38 0.00 5.86 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.15 3.92 0.00 1.89 1.83 0.00 3.16 0.00 0.00 3.25 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 94 R 7.69 3.73 0.00 1.77 1.93 0.00 3.24 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 95 G 7.38 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 0.00 0.00 0.00 96 L 7.53 4.29 0.00 1.66 1.63 0.91 0.77 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 97 P 0.00 4.45 0.00 2.17 2.04 0.00 3.73 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 98 V 8.15 4.22 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 0.95 0.00 0.00 99 R 7.95 4.26 0.00 1.82 1.95 0.00 3.40 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 100 G 8.13 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 0.00 101 Q 7.86 4.21 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.05 7.04 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 102 R 8.29 4.03 0.00 1.80 1.92 0.00 3.20 0.00 0.00 3.28 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 103 T 8.37 4.11 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 1.22 0.00 0.00 104 R 8.14 3.92 0.00 1.79 2.00 0.00 3.23 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 105 T 7.97 4.50 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 1.21 0.00 0.00 106 N 7.38 4.11 0.00 2.87 2.06 0.00 0.00 6.02 7.26 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 0.00 107 A 9.18 3.80 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 0.00 108 R 8.10 3.96 0.00 1.93 2.00 0.00 3.21 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.01 0.00 109 T 8.01 3.63 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 1.21 0.00 0.00 110 R 7.77 4.42 0.00 1.77 1.95 0.00 3.15 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 111 K 7.67 3.98 0.00 1.72 1.86 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.64 7.81 112 G 8.93 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 0.00 113 P 0.00 4.26 0.00 2.19 2.08 0.00 3.79 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 1.99 2.00 0.00 114 R 8.56 3.76 0.00 1.82 1.97 0.00 3.19 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 115 K 8.29 4.31 0.00 1.71 1.78 0.00 1.67 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.62 7.81 116 T 7.89 3.54 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 1.21 0.00 0.00 117 V 7.65 3.63 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 0.72 0.00 0.00 0.93 0.00 0.00