NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3691 8.1776 115.2780 57.9321 63.5556 174.5786 2 I 3.3021 8.0015 121.7095 63.0877 37.6737 176.3796 3 Q 4.1758 8.0707 120.3458 57.6416 29.7191 177.9236 4 A 4.1227 7.5207 120.1752 53.6540 19.2162 177.6651 5 E 3.7381 7.5553 117.5099 55.5109 29.7607 178.0199 6 E 3.9029 8.3964 122.1552 58.6811 29.9716 177.7533 7 W 4.4907 7.2819 114.7524 56.9642 28.8590 174.8419 8 Y 5.0321 7.5090 121.6309 57.0533 37.5470 174.7615 9 F 4.4684 9.2434 126.5100 56.6671 40.7816 178.2365 10 G 3.4829 5.8149 110.5018 46.9064 0.0000 176.5917 11 K 4.3389 8.6187 121.1307 54.7042 30.4669 175.3414 12 I 4.5726 7.1279 113.8184 58.7195 40.7489 176.9805 13 T 4.3074 8.0680 112.6318 61.1447 71.0421 175.7528 14 R 3.7841 9.1371 121.7721 59.5319 30.0418 178.5404 15 R 3.8859 7.9263 118.0476 59.3916 30.1249 177.9172 16 E 3.9558 8.3184 119.3236 59.2848 29.7007 178.7955 17 S 4.1400 8.2951 114.4643 61.6778 62.8229 176.4509 18 E 3.9837 8.3232 122.1017 58.9743 28.9709 179.1876 19 R 3.8872 7.9163 117.8347 59.5448 30.2450 178.3213 20 L 4.1775 7.7635 117.4806 57.8124 41.7051 179.1915 21 L 4.1918 7.8743 117.9449 56.7074 42.9724 178.6298 22 L 4.5266 7.8041 120.6805 52.5796 38.5672 175.9311 23 N 4.8799 7.2849 117.3759 51.2452 41.8077 174.4242 24 A 4.2616 8.9480 129.0397 55.3744 18.4143 177.8886 25 E 4.1362 8.6961 113.7027 57.6250 29.9089 176.5502 26 N 4.5355 8.3271 118.4276 51.7738 38.8165 173.5091 27 P 4.5218 0.0000 0.0000 61.5508 32.6190 175.7324 28 R 3.9045 8.1042 117.7834 57.8978 30.3365 177.6877 29 G 4.1244 9.2227 109.9408 46.4170 0.0000 173.4108 30 T 4.6909 7.5640 118.0689 63.9417 69.6973 173.5036 31 F 5.4392 8.7110 119.8771 56.2003 42.2790 172.5527 32 L 4.5668 8.5572 116.7846 54.7505 43.8812 174.0945 33 V 5.2039 9.0974 120.8425 61.3215 34.4910 174.6034 34 R 4.9301 9.1231 122.9832 54.2753 33.5607 174.0615 35 E 4.6479 9.0584 119.4086 56.2807 30.2326 177.1422 36 S 4.3413 8.2593 117.4087 58.1987 62.5802 174.4293 37 E 4.1477 9.0001 126.4631 58.9314 29.6639 177.9188 38 T 4.2395 7.8246 107.1040 62.2230 70.4578 174.5995 39 T 4.4728 7.9472 120.1061 60.8222 69.8308 174.0027 40 K 4.1152 8.5099 126.4271 57.8950 33.1127 177.9256 41 G 3.7318 8.6360 107.9699 45.7538 0.0000 173.0691 42 A 4.7150 7.3192 121.0703 50.5948 22.0647 175.4570 43 Y 5.3483 8.7597 116.7636 56.3245 42.3711 174.2287 44 C 5.2058 9.4839 119.8317 58.0216 35.3294 172.4252 45 L 4.9486 9.4360 129.1654 54.0753 43.1972 174.9308 46 S 5.1654 8.8417 123.7882 57.1829 64.9048 173.7698 47 V 5.0729 9.0133 124.5989 61.0441 34.8679 174.6949 48 S 4.9978 9.2825 122.7066 58.2019 64.8860 172.4607 49 D 5.1834 9.1729 120.8819 53.2752 45.5493 173.6045 50 F 5.5996 8.7821 121.6882 57.9735 42.3976 172.4879 51 D 4.6394 7.4882 123.8763 52.1371 42.4543 175.9376 52 N 4.3087 8.7089 115.8426 55.9436 38.9780 177.1400 53 A 4.0509 8.0733 120.4501 54.7893 18.5743 178.3651 54 K 4.2292 8.9606 112.9778 55.2904 34.0593 178.8626 55 G 3.2412 7.9755 108.3261 45.0034 0.0000 171.9678 56 L 4.9443 8.5392 123.9129 55.2520 42.8051 177.2195 57 N 5.0300 9.2708 122.6611 51.9747 41.4168 173.0611 58 V 4.8837 8.2441 118.5208 61.0170 34.2995 174.5277 59 K 4.5183 9.0047 126.5290 54.7814 35.2651 174.6567 60 H 5.2314 8.2690 120.0666 54.1433 31.5343 172.7339 61 Y 4.7032 8.8227 121.1520 55.7676 40.7896 174.9881 62 K 4.6437 8.8438 126.0780 56.3910 33.9156 175.2090 63 I 4.7181 8.9090 128.6436 59.8460 39.4981 174.9912 64 R 4.6440 8.8461 126.6717 54.5868 32.4342 175.4275 65 K 4.5793 8.0635 122.2883 54.4806 34.8025 175.8633 66 L 4.3303 8.8316 128.0165 54.2313 42.4750 178.0348 67 D 4.5275 8.5159 121.3733 57.3837 40.9764 178.1427 68 S 4.2144 7.9101 113.7273 59.2190 63.0844 174.0989 69 G 4.1168 8.1585 109.9893 45.6867 0.0000 174.9703 70 G 4.0293 8.1132 106.3603 45.9971 0.0000 172.7382 71 F 5.5331 9.2923 121.4886 55.8573 42.0398 174.3312 72 Y 5.1529 8.4351 118.3809 57.3465 41.0309 174.9500 73 I 4.3035 9.0471 120.2460 62.2391 38.5649 176.2117 74 T 4.7437 7.7619 114.4114 59.7985 69.1038 174.9382 75 S 2.8456 8.4438 122.5430 60.2627 63.0719 175.2520 76 R 3.9966 7.2483 117.6888 57.6904 30.0315 176.8745 77 T 4.1576 7.7808 114.0055 61.5641 69.7152 173.0185 78 Q 4.8931 7.7301 123.9434 53.8775 31.7433 175.3108 79 F 4.9261 8.9802 117.6695 55.7605 42.7271 176.2731 80 N 4.8912 8.9995 120.3225 55.5766 39.1131 175.8634 81 S 4.4689 7.6770 112.0799 55.6134 67.3627 174.7608 82 L 3.4133 7.1036 124.2015 58.2990 41.6635 179.3757 83 Q 4.1786 7.8862 117.5246 59.1323 28.6883 178.5794 84 Q 3.9263 8.1083 119.1344 58.3987 28.6783 178.4970 85 L 2.4400 7.4313 121.2890 57.6579 41.9540 179.1043 86 V 3.1545 7.2819 116.5946 65.7709 31.5967 177.5065 87 A 3.9812 7.9428 120.5917 55.0990 18.2056 178.9076 88 Y 3.7687 7.6955 118.0800 61.0326 38.8283 177.6705 89 Y 4.5460 7.5633 117.1068 59.0203 37.7919 177.4612 90 S 4.6050 7.3282 116.4938 58.9888 63.2248 174.6596 91 K 4.3023 7.4825 119.0822 56.1357 33.9232 175.9617 92 H 4.6353 7.4254 115.4638 53.6104 31.9623 174.1498 93 A 4.0322 8.7462 127.2275 53.9788 20.0339 180.0027 94 D 4.3686 7.8891 112.5575 55.9062 40.5068 174.8862 95 G 3.9516 9.0027 115.9097 46.2449 0.0000 173.5024 96 L 3.9451 7.8862 121.3644 53.7872 42.2867 177.9224 97 C 4.4288 8.6659 115.4708 61.2532 29.8366 173.3505 98 H 4.4496 7.0834 115.8395 54.9220 32.6286 173.5887 99 R 4.1331 7.6858 120.4833 55.6724 30.1648 176.0330 100 L 4.1968 8.5168 120.9380 55.1745 41.3895 175.9085 101 T 4.7117 8.1448 113.3291 61.9431 70.0530 174.3174 102 T 5.0850 7.7744 109.0680 58.4274 73.4459 173.5477 103 V 3.6024 8.3080 122.0346 61.4778 32.2820 175.4663 104 C 4.2788 8.2353 124.3542 59.0379 31.8913 171.7835 105 P 4.5858 0.0000 0.0000 62.5194 31.9644 176.4608 106 T 4.2702 8.3296 109.6782 61.9513 68.9913 174.6382 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 S 8.18 4.37 0.00 3.82 3.74 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 2 I 8.00 3.30 1.24 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 -0.26 0.66 0.00 0.00 3 Q 8.07 4.18 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.12 0.00 0.00 0.00 0.00 0.00 2.19 2.27 0.00 4 A 7.52 4.12 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 5 E 7.56 3.74 0.00 1.16 1.12 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 2.12 1.59 0.00 6 E 8.40 3.90 0.00 2.04 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 2.35 2.29 0.00 7 W 7.28 4.49 0.00 3.47 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 8 Y 7.51 5.03 0.00 2.66 2.99 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 9 F 9.24 4.47 0.00 2.72 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 10 G 5.81 3.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 8.62 4.34 0.00 1.78 1.78 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.45 7.81 12 I 7.13 4.57 1.93 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 1.55 0.87 0.99 0.00 0.00 13 T 8.07 4.31 4.41 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 1.22 0.00 0.00 14 R 9.14 3.78 0.00 1.78 2.04 0.00 3.00 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.34 0.00 15 R 7.93 3.89 0.00 1.91 1.91 0.00 3.24 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 16 E 8.32 3.96 0.00 2.15 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 0.00 2.35 2.43 0.00 17 S 8.30 4.14 0.00 4.06 4.11 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 18 E 8.32 3.98 0.00 2.24 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 0.00 2.38 2.57 0.00 19 R 7.92 3.89 0.00 1.92 2.13 0.00 3.28 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 20 L 7.76 4.18 0.00 1.83 1.77 1.16 1.02 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 21 L 7.87 4.19 0.00 1.68 1.72 0.88 0.79 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 22 L 7.80 4.53 0.00 1.69 1.66 0.95 0.82 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 23 N 7.28 4.88 0.00 2.68 2.63 0.00 0.00 6.90 7.91 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 24 A 8.95 4.26 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 25 E 8.70 4.14 0.00 2.09 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 2.32 2.26 0.00 26 N 8.33 4.54 0.00 2.78 2.78 0.00 0.00 6.98 8.01 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 27 P 0.00 4.52 0.00 2.19 2.15 0.00 3.70 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 28 R 8.10 3.90 0.00 1.50 1.68 0.00 3.43 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 29 G 9.22 4.12 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 0.00 30 T 7.56 4.69 4.27 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 1.20 0.00 0.00 31 F 8.71 5.44 0.00 3.23 3.08 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 0.00 0.00 0.00 0.00 32 L 8.56 4.57 0.00 0.59 0.79 0.69 0.19 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 33 V 9.10 5.20 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 1.33 0.00 0.00 1.08 0.00 0.00 34 R 9.12 4.93 0.00 2.01 1.95 0.00 3.01 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 35 E 9.06 4.65 0.00 1.90 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.51 0.00 36 S 8.26 4.34 0.00 3.94 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 37 E 9.00 4.15 0.00 1.98 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 2.31 2.28 0.00 38 T 7.82 4.24 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 39 T 7.95 4.47 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 1.18 0.00 0.00 40 K 8.51 4.12 0.00 1.83 1.79 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.36 7.81 41 G 8.64 3.73 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 0.00 0.00 0.00 42 A 7.32 4.72 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 43 Y 8.76 5.35 0.00 3.13 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 44 C 9.48 5.21 0.00 2.97 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 45 L 9.44 4.95 0.00 1.82 1.81 0.94 0.58 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 46 S 8.84 5.17 0.00 3.83 3.76 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 47 V 9.01 5.07 2.28 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 1.15 0.00 0.00 1.07 0.00 0.00 48 S 9.28 5.00 0.00 3.93 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 49 D 9.17 5.18 0.00 2.78 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 50 F 8.78 5.60 0.00 3.10 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 51 D 7.49 4.64 0.00 2.66 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 52 N 8.71 4.31 0.00 2.71 2.90 0.00 0.00 6.88 7.35 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 53 A 8.07 4.05 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 54 K 8.96 4.23 0.00 1.64 1.77 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.39 7.81 55 G 7.98 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 0.00 0.00 0.00 56 L 8.54 4.94 0.00 1.92 1.70 1.10 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 57 N 9.27 5.03 0.00 2.80 2.82 0.00 0.00 5.97 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 58 V 8.24 4.88 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 0.65 0.00 0.00 0.92 0.00 0.00 59 K 9.00 4.52 0.00 1.71 1.11 0.00 1.56 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.32 1.28 7.81 60 H 8.27 5.23 0.00 2.89 3.11 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.82 4.70 0.00 2.91 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 62 K 8.84 4.64 0.00 1.89 1.74 0.00 1.68 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.65 7.81 63 I 8.91 4.72 2.15 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.74 1.22 0.00 0.00 64 R 8.85 4.64 0.00 0.67 1.45 0.00 3.14 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 65 K 8.06 4.58 0.00 1.56 1.47 0.00 1.62 0.00 0.00 1.44 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.30 0.40 7.81 66 L 8.83 4.33 0.00 1.83 1.62 1.02 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.52 4.53 0.00 2.65 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 68 S 7.91 4.21 0.00 3.86 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 69 G 8.16 4.12 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 0.00 70 G 8.11 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 71 F 9.29 5.53 0.00 3.17 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 72 Y 8.44 5.15 0.00 3.41 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 73 I 9.05 4.30 1.88 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.05 0.95 0.00 0.00 74 T 7.76 4.74 4.32 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 1.30 0.00 0.00 75 S 8.44 2.85 0.00 3.46 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 76 R 7.25 4.00 0.00 1.81 1.94 0.00 3.22 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 77 T 7.78 4.16 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 0.76 0.00 0.00 78 Q 7.73 4.89 0.00 1.87 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.77 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 79 F 8.98 4.93 0.00 3.19 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 80 N 9.00 4.89 0.00 3.04 2.98 0.00 0.00 6.75 7.57 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 81 S 7.68 4.47 0.00 3.97 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 82 L 7.10 3.41 0.00 0.80 1.41 0.76 0.32 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 83 Q 7.89 4.18 0.00 2.22 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.60 2.91 0.00 84 Q 8.11 3.93 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 85 L 7.43 2.44 0.00 1.61 1.64 1.21 0.74 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 V 7.28 3.15 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 0.10 0.00 0.00 -0.05 0.00 0.00 87 A 7.94 3.98 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 88 Y 7.70 3.77 0.00 2.80 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 0.00 0.00 0.00 0.00 89 Y 7.56 4.55 0.00 2.94 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 90 S 7.33 4.60 0.00 3.87 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 91 K 7.48 4.30 0.00 1.53 1.47 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.23 1.38 7.81 92 H 7.43 4.64 0.00 2.53 3.11 0.00 5.61 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.75 4.03 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 94 D 7.89 4.37 0.00 3.09 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 0.00 0.00 0.00 95 G 9.00 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 96 L 7.89 3.95 0.00 1.63 1.31 0.55 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 97 C 8.67 4.43 0.00 3.36 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 98 H 7.08 4.45 0.00 3.13 3.16 0.00 5.76 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.69 4.13 0.00 2.04 1.92 0.00 3.23 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 100 L 8.52 4.20 0.00 1.18 0.37 0.17 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 101 T 8.14 4.71 4.30 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 1.37 0.00 0.00 102 T 7.77 5.09 4.29 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 1.27 0.00 0.00 103 V 8.31 3.60 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 0.72 0.00 0.00 1.12 0.00 0.00 104 C 8.24 4.28 0.00 2.93 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 0.00 105 P 0.00 4.59 0.00 2.11 1.98 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 106 T 8.33 4.27 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 1.07 0.00 0.00