NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2728 8.2549 119.7040 55.6514 31.5652 174.6748 3 H 3.9021 8.3440 116.1469 56.4583 29.0755 174.4082 4 L 4.0530 8.7054 121.6537 56.1810 42.8186 172.6213 5 K 4.0483 8.0876 121.7605 56.0509 30.9360 174.9798 6 S 4.7088 7.6433 113.5858 55.4433 66.0852 173.3752 7 G 3.5257 9.2623 109.0059 47.8323 0.0000 173.6824 8 R 3.3022 8.1808 123.2655 53.0420 31.6804 175.6081 9 K 4.0639 7.7138 118.6333 56.5831 33.4987 176.6794 10 L 4.2120 7.8336 117.6697 54.8617 43.3946 173.7328 11 N 4.8448 8.4562 122.9213 49.2994 38.6901 173.3703 12 R 4.3520 7.2260 121.3090 54.5127 33.6745 174.2574 13 H 4.6268 8.0073 115.7551 55.7970 30.9688 176.1520 14 S 3.2978 8.5607 109.7788 59.4089 63.9553 176.5880 15 S 4.0249 8.4753 116.5145 61.1422 63.5543 176.2654 16 H 4.0844 8.2029 122.0570 58.6474 29.5540 177.0936 17 R 3.8881 7.9268 119.0225 58.6894 30.0116 177.7420 18 L 3.5656 7.6621 120.2588 57.5244 42.3246 178.2274 19 A 4.0234 8.5529 121.0408 54.9763 17.8738 179.4037 20 L 3.8724 8.2452 119.2845 58.7055 42.2602 178.6087 21 Y 4.0791 7.7285 116.5588 61.3393 37.6070 178.9573 22 R 4.2724 7.9606 118.3016 59.4274 30.1960 178.3178 23 N 4.5053 8.1967 113.0700 54.9799 38.6683 176.0189 24 Q 4.4038 7.5883 119.1141 57.5334 30.0234 177.2740 25 A 4.2117 8.5810 121.9379 55.5753 18.4840 179.4598 26 K 3.8107 8.4813 116.8746 60.0515 32.2557 179.4289 27 S 4.2129 8.1517 114.4051 61.8216 62.8139 176.3379 28 L 3.9564 8.7975 123.7892 58.3554 41.7028 179.0413 29 L 4.2664 8.4026 118.5285 57.9421 41.6067 179.4040 30 T 4.1198 7.8116 115.0707 65.6963 68.5513 175.6748 31 H 4.8709 8.3275 115.5478 55.7604 31.1206 174.0408 32 G 4.3272 9.2012 117.0780 43.8507 0.0000 172.5952 33 R 5.0588 7.4085 120.0440 54.4829 32.3802 175.7587 34 I 4.6672 8.7009 121.9984 60.1716 42.2337 174.2266 35 T 4.9292 8.6143 122.3959 62.3805 70.7495 172.8012 36 T 4.8022 7.8060 118.2483 59.9714 72.7230 172.7976 37 T 4.4298 8.5162 115.0225 62.0569 67.9546 175.5001 38 V 3.4086 8.3640 128.1181 66.0002 31.4987 176.2929 39 P 4.4610 0.0000 0.0000 65.7173 31.4464 178.1581 40 K 3.7378 8.1754 117.2794 59.8548 31.7091 178.2742 41 A 3.9233 7.9896 119.6771 55.1559 18.4605 179.4745 42 K 3.9379 8.5821 116.9262 59.2269 31.9082 178.9876 43 E 3.9481 8.3605 119.7880 59.3399 29.6837 178.3512 44 L 3.6418 7.4459 120.0962 58.3669 42.1966 178.4973 45 R 3.5745 8.1238 111.8156 59.5490 29.6945 178.5309 46 G 4.0267 8.4381 109.6431 49.2519 0.0000 173.8248 47 F 4.1390 8.5272 122.0117 61.3813 39.0015 176.8168 48 V 3.4213 8.3671 116.4115 66.8680 31.7466 178.5093 49 D 4.3499 8.2366 117.2814 57.4918 41.0447 178.5230 50 H 4.0968 7.9900 118.0543 59.0779 30.1736 176.8944 51 L 3.9996 7.6534 120.1865 57.8561 41.6260 179.0146 52 I 3.4242 7.5495 119.7588 64.9857 36.8782 177.8284 53 H 3.9664 7.7091 117.4281 58.0802 29.6434 176.4666 54 L 4.0500 7.9004 121.7990 56.9761 41.8011 177.4934 55 A 4.1435 7.1400 118.2426 53.0223 18.8338 178.8506 56 K 4.2161 7.3430 115.3203 57.2284 33.5856 177.4980 57 R 4.5961 7.2769 115.3727 53.6517 28.5793 177.1550 58 G 3.8256 8.1535 111.8364 47.8977 0.0000 171.2586 59 D 4.3738 8.0084 120.0153 53.5442 40.0053 177.0671 60 L 3.9488 8.8015 122.9319 59.8304 41.8952 178.2382 61 H 3.7831 8.6289 114.2232 59.7536 29.4610 175.8584 62 A 4.0219 8.9464 121.4811 55.7059 18.1227 179.7352 63 R 4.4247 8.1765 116.8285 59.9491 30.0012 178.9999 64 R 4.0682 8.5195 118.2404 58.6137 29.8180 178.8233 65 L 3.9278 7.6511 119.2617 58.2627 42.1859 178.9218 66 V 3.6408 8.7472 119.0103 65.3297 31.3863 176.7936 67 L 3.9994 8.4401 120.0735 55.4564 41.2837 180.6519 68 R 3.3951 6.3852 117.7985 58.2679 31.1845 177.3631 69 D 4.6097 8.1576 116.3427 55.7184 41.5843 176.8233 70 L 4.3578 6.9756 117.8212 54.1396 42.3621 176.7601 71 Q 4.1923 8.6437 123.2516 56.2502 29.6519 175.0833 72 D 4.6727 7.7171 117.1808 53.7148 42.0236 176.3830 73 V 3.7386 8.3940 122.0117 64.5983 31.0764 178.4556 74 K 3.9932 8.5501 119.3582 59.2272 32.0458 178.8087 75 L 3.9493 7.8823 119.9467 58.0293 42.0406 178.5480 76 V 3.5694 8.2650 118.6210 67.0931 31.3884 177.5298 77 R 3.8481 8.1258 115.4463 59.5560 29.7021 178.4664 78 K 3.9644 7.8995 119.9863 60.4517 32.8058 177.9634 79 L 3.9260 8.2132 120.4518 57.5594 41.6414 178.5304 80 F 4.3365 8.6544 120.7333 60.0750 40.0521 175.9340 81 D 4.9177 8.0883 116.8266 51.4068 39.3603 173.7157 82 E 4.7651 7.8892 122.9108 58.0877 36.8167 175.4954 83 I 3.7556 7.8853 120.2590 62.0675 37.4685 179.3005 84 A 3.8999 7.8778 125.5484 55.1158 20.4528 178.4721 85 P 4.2649 0.0000 0.0000 65.7115 31.4210 178.4337 86 R 3.9547 8.0933 112.2181 57.5894 29.3848 176.3873 87 Y 4.9037 7.5261 115.1692 57.4865 39.3568 177.0280 88 R 3.9529 7.7747 121.6713 59.3574 30.1629 176.8175 89 D 4.6792 7.9819 115.1142 55.3201 41.9372 176.9108 90 R 4.0037 7.7421 119.4427 56.1409 30.4122 176.3225 91 Q 4.1514 8.5371 125.0368 54.9989 27.7108 176.3909 92 G 3.3630 8.2155 112.5073 44.4688 0.0000 171.1857 93 G 3.7165 8.0218 104.1185 46.8441 0.0000 173.4280 94 Y 4.1382 7.3551 113.2743 58.2892 39.5534 176.8482 95 T 4.8691 7.7546 113.9478 60.2121 70.1848 173.1411 96 R 4.7466 8.7711 125.5240 54.7677 34.3979 174.3701 97 V 4.6617 8.2332 122.8922 61.7748 34.3135 173.7049 98 L 4.7855 8.7620 128.7905 52.7331 43.9253 176.5801 99 K 4.5211 8.7078 123.0044 56.4090 33.0468 176.1445 100 L 4.7825 8.5972 123.6806 52.7548 43.4125 176.7863 101 A 4.0789 8.5920 126.1035 52.4067 19.2421 172.8102 102 E 3.8436 8.7197 127.1898 55.3983 30.7112 173.8215 103 R 4.6451 8.0070 119.8041 53.6879 32.8261 174.1587 104 R 3.7668 8.3342 119.7110 56.6450 29.5788 176.0278 105 R 4.7505 8.3272 126.9664 53.8462 28.4983 174.7064 106 G 4.1450 7.6352 111.7094 45.8982 0.0000 171.8213 107 D 4.5678 7.9055 114.3328 51.7209 41.7193 175.1172 108 G 3.8839 8.2399 107.6689 47.0476 0.0000 173.0794 109 A 4.8855 7.2695 119.7033 49.1320 22.9355 175.6070 110 P 4.5460 0.0000 0.0000 62.8195 32.4396 175.6048 111 L 4.8010 8.5545 124.8915 54.1955 42.2394 175.8708 112 A 5.0348 9.4148 124.1626 50.0782 23.4351 174.6078 113 L 4.6434 8.7021 119.4933 54.0196 45.2191 175.0857 114 V 5.3657 9.0286 127.6087 60.5123 33.5857 174.4128 115 E 5.8899 8.3801 124.0178 53.6476 33.7210 174.0612 116 L 4.7081 8.4588 120.7887 53.9762 42.3726 177.2069 117 V 3.7145 8.5080 124.8607 63.1125 32.4586 175.6222 118 E 4.8224 8.9399 124.0921 56.0063 30.0983 176.5425 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 R 8.25 4.27 0.00 1.81 1.96 0.00 3.25 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 3 H 8.34 3.90 0.00 3.21 3.23 0.00 5.67 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.71 4.05 0.00 1.68 2.01 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.09 4.05 0.00 1.87 2.11 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.23 7.81 6 S 7.64 4.71 0.00 3.93 3.82 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 7 G 9.26 3.53 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 0.00 8 R 8.18 3.30 0.00 1.90 2.18 0.00 3.42 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 9 K 7.71 4.06 0.00 1.88 1.83 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.55 7.81 10 L 7.83 4.21 0.00 1.59 1.58 0.93 0.92 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 11 N 8.46 4.84 0.00 2.61 2.66 0.00 0.00 7.13 7.65 0.00 0.00 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 R 7.23 4.35 0.00 1.65 1.62 0.00 3.01 0.00 0.00 2.46 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.26 0.00 13 H 8.01 4.63 0.00 3.38 3.44 0.00 5.68 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.56 3.30 0.00 4.05 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 15 S 8.48 4.02 0.00 4.09 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 16 H 8.20 4.08 0.00 2.98 3.20 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.93 3.89 0.00 1.75 2.01 0.00 3.20 0.00 0.00 3.07 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.21 0.00 18 L 7.66 3.57 0.00 1.53 1.73 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 19 A 8.55 4.02 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 20 L 8.25 3.87 0.00 1.68 1.65 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.73 4.08 0.00 2.29 1.78 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 22 R 7.96 4.27 0.00 2.07 2.09 0.00 3.21 0.00 0.00 3.64 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 23 N 8.20 4.51 0.00 2.74 2.90 0.00 0.00 7.09 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 24 Q 7.59 4.40 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.61 0.00 25 A 8.58 4.21 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.48 3.81 0.00 1.91 1.92 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.55 7.81 27 S 8.15 4.21 0.00 4.06 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 28 L 8.80 3.96 0.00 1.81 1.84 0.93 0.71 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 29 L 8.40 4.27 0.00 1.67 1.72 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.81 4.12 4.50 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 0.90 0.00 0.00 31 H 8.33 4.87 0.00 3.22 3.30 0.00 5.62 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 9.20 4.33 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 0.00 33 R 7.41 5.06 0.00 1.70 1.86 0.00 3.25 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 34 I 8.70 4.67 1.88 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 1.25 0.94 0.91 0.00 0.00 35 T 8.61 4.93 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 1.31 0.00 0.00 36 T 7.81 4.80 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 1.21 0.00 0.00 37 T 8.52 4.43 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 1.20 0.00 0.00 38 V 8.36 3.41 2.07 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 0.96 0.00 0.00 0.92 0.00 0.00 39 P 0.00 4.46 0.00 2.18 2.09 0.00 3.62 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 40 K 8.18 3.74 0.00 1.80 1.96 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.71 1.55 7.81 41 A 7.99 3.92 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 42 K 8.58 3.94 0.00 1.79 1.87 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.49 7.81 43 E 8.36 3.95 0.00 2.03 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 44 L 7.45 3.64 0.00 1.90 1.61 0.93 1.03 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 45 R 8.12 3.57 0.00 1.86 1.77 0.00 3.19 0.00 0.00 3.14 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 46 G 8.44 4.03 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 0.00 0.00 0.00 47 F 8.53 4.14 0.00 2.98 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 48 V 8.37 3.42 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 0.96 0.00 0.00 0.96 0.00 0.00 49 D 8.24 4.35 0.00 3.10 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 50 H 7.99 4.10 0.00 3.15 3.40 0.00 6.01 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.65 4.00 0.00 1.70 1.48 0.46 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.55 3.42 1.49 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.05 0.56 0.00 0.00 53 H 7.71 3.97 0.00 2.90 3.21 0.00 5.58 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.90 4.05 0.00 1.79 1.63 0.90 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.14 4.14 0.59 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 56 K 7.34 4.22 0.00 1.82 1.86 0.00 1.51 0.00 0.00 1.77 0.00 0.00 3.20 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.48 1.46 7.81 57 R 7.28 4.60 0.00 2.20 2.04 0.00 2.80 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.75 0.00 58 G 8.15 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 59 D 8.01 4.37 0.00 2.75 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 60 L 8.80 3.95 0.00 1.65 1.73 0.93 0.84 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 61 H 8.63 3.78 0.00 3.25 3.48 0.00 5.96 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.95 4.02 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.18 4.42 0.00 1.51 2.09 0.00 2.91 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 64 R 8.52 4.07 0.00 2.00 1.97 0.00 3.20 0.00 0.00 3.11 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 65 L 7.65 3.93 0.00 1.74 1.73 0.83 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.75 3.64 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 0.73 0.00 0.00 0.75 0.00 0.00 67 L 8.44 4.00 0.00 2.06 1.44 1.03 0.99 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 68 R 6.39 3.40 0.00 1.93 2.14 0.00 3.21 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.95 0.00 69 D 8.16 4.61 0.00 2.51 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 70 L 6.98 4.36 0.00 1.64 1.60 0.85 0.90 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 71 Q 8.64 4.19 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.95 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 72 D 7.72 4.67 0.00 2.79 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.39 3.74 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 0.93 0.00 0.00 0.94 0.00 0.00 74 K 8.55 3.99 0.00 1.91 2.06 0.00 1.53 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.49 7.81 75 L 7.88 3.95 0.00 1.93 1.79 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.26 3.57 2.33 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 1.28 0.00 0.00 1.00 0.00 0.00 77 R 8.13 3.85 0.00 2.17 1.96 0.00 3.23 0.00 0.00 3.10 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 78 K 7.90 3.96 0.00 1.78 2.10 0.00 1.81 0.00 0.00 1.63 0.00 0.00 3.20 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.65 7.81 79 L 8.21 3.93 0.00 1.67 1.76 0.65 0.59 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 80 F 8.65 4.34 0.00 3.32 3.02 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 0.00 0.00 0.00 81 D 8.09 4.92 0.00 2.75 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 82 E 7.89 4.77 0.00 1.85 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 0.00 2.13 2.25 0.00 83 I 7.89 3.76 2.04 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.66 1.11 0.00 0.00 84 A 7.88 3.90 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 85 P 0.00 4.26 0.00 2.14 2.10 0.00 3.62 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 86 R 8.09 3.95 0.00 1.68 1.78 0.00 2.83 0.00 0.00 3.10 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.50 0.00 87 Y 7.53 4.90 0.00 3.13 3.36 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 88 R 7.77 3.95 0.00 1.94 2.03 0.00 3.44 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 89 D 7.98 4.68 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 90 R 7.74 4.00 0.00 1.90 2.04 0.00 2.99 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 91 Q 8.54 4.15 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.68 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 92 G 8.22 3.36 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 0.00 93 G 8.02 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 94 Y 7.36 4.14 0.00 2.61 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 95 T 7.75 4.87 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 1.24 0.00 0.00 96 R 8.77 4.75 0.00 1.87 1.83 0.00 3.12 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 97 V 8.23 4.66 2.06 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 0.82 0.00 0.00 0.95 0.00 0.00 98 L 8.76 4.79 0.00 1.61 1.53 0.92 0.72 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 99 K 8.71 4.52 0.00 1.63 1.73 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.46 7.81 100 L 8.60 4.78 0.00 1.58 1.56 0.92 0.74 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 0.00 101 A 8.59 4.08 1.24 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 0.00 102 E 8.72 3.84 0.00 2.10 1.94 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 2.18 2.28 0.00 103 R 8.01 4.65 0.00 2.01 1.83 0.00 3.13 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 104 R 8.33 3.77 0.00 2.07 2.13 0.00 3.13 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 105 R 8.33 4.75 0.00 1.84 1.88 0.00 3.30 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 1.63 1.62 0.00 106 G 7.64 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 0.00 0.00 0.00 0.00 107 D 7.91 4.57 0.00 2.73 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 0.00 108 G 8.24 3.88 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 0.00 109 A 7.27 4.89 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 0.00 110 P 0.00 4.55 0.00 2.12 2.23 0.00 3.68 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.99 0.00 111 L 8.55 4.80 0.00 1.59 1.61 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 112 A 9.41 5.03 1.19 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 0.00 113 L 8.70 4.64 0.00 1.73 1.64 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.03 5.37 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 0.91 0.00 0.00 115 E 8.38 5.89 0.00 2.04 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 2.25 2.18 0.00 116 L 8.46 4.71 0.00 1.64 1.80 1.04 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.51 3.71 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 0.74 0.00 0.00 1.01 0.00 0.00 118 E 8.94 4.82 0.00 2.22 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 0.00 2.06 2.11 0.00