NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5227 8.3044 120.6124 55.4639 33.8119 174.6003 2 L 4.2236 9.0299 129.0971 52.5693 42.9292 169.9436 3 V 4.0536 9.0653 128.5415 63.1714 31.9466 174.5890 4 I 4.0786 8.5240 128.2561 62.7355 38.5487 175.5013 5 S 4.8382 7.5453 114.0606 56.2094 66.3049 174.5670 6 N 4.3852 8.7429 118.7902 56.3301 38.6826 174.9610 7 N 4.6711 8.0045 113.1012 52.9800 39.6301 173.7187 8 V 4.3739 7.1742 116.5703 61.9868 34.0969 173.9308 9 H 5.2230 8.7606 124.0680 53.9743 32.7323 173.1460 10 L 4.6344 8.7913 122.9773 52.3538 43.1589 174.5942 11 P 4.5840 0.0000 0.0000 62.4496 32.2171 177.6322 12 D 4.3755 8.8812 121.5481 57.4407 41.0081 178.8087 13 A 4.0027 8.0231 120.6855 54.8494 18.4317 177.6781 14 E 4.3125 8.3505 113.9491 56.5473 29.8079 175.3472 15 I 4.8035 7.7401 120.8488 59.5981 39.4452 175.3639 16 E 4.3555 9.1518 130.1389 55.0597 29.9409 174.2911 17 L 4.9017 8.3735 127.2067 53.5389 42.8861 176.2207 18 T 4.8458 9.2378 114.1617 59.6827 72.4958 172.7587 19 A 4.9754 8.3650 122.9115 50.2425 21.8141 175.4868 20 I 4.1877 8.7971 124.4858 60.2956 37.9191 176.3463 21 R 4.3009 8.4980 125.9540 54.4553 31.9826 176.7865 22 A 4.2082 8.2078 122.6601 51.2787 17.1784 176.7966 23 Q 4.1617 8.3041 119.5695 58.6706 28.9790 177.6649 24 G 3.9192 10.0434 109.3975 45.1695 0.0000 172.1740 25 A 4.6219 7.8513 120.4998 50.6576 22.4487 175.7716 26 G 4.1068 8.0486 105.9550 45.6722 0.0000 175.0458 27 G 3.9405 7.4183 107.6719 43.6017 0.0000 167.6000 28 Q 3.5914 8.5178 128.7851 56.6886 30.7773 169.1428 29 N 4.3897 8.9373 128.3634 54.0293 38.8521 173.7413 30 V 3.2097 8.1634 120.6735 63.5030 29.1371 169.7551 31 N 5.1252 7.9575 120.7524 49.9919 38.2805 172.9099 32 K 4.4438 7.7593 118.0672 55.0622 36.3826 176.1274 33 V 4.0458 8.2255 124.1054 60.7699 32.3995 176.2379 34 S 4.3775 8.3319 118.2041 58.8039 63.4407 174.7512 35 S 4.5133 8.5373 118.3718 58.7959 62.7903 173.9682 36 A 4.4401 7.7101 123.7349 51.9754 19.0152 177.4478 37 M 4.7488 9.2316 122.9915 55.0670 35.2102 174.2472 38 H 5.4108 9.2962 121.4345 54.2898 33.8156 171.5168 39 L 5.0091 8.7551 127.2153 53.2090 45.1701 175.0788 40 R 4.9897 9.1841 126.0668 55.0055 33.4013 173.3365 41 F 5.0393 9.3433 130.5186 56.4331 41.9024 174.6111 42 D 4.6876 7.7177 127.4619 53.4672 39.2352 177.2247 43 I 3.8423 7.8326 125.0231 63.5136 37.6819 177.5617 44 N 4.3181 8.1796 118.1790 56.5150 38.7347 175.7091 45 A 4.2195 7.6496 118.5030 53.6436 19.1233 177.6269 46 S 5.1050 7.9800 110.3726 57.9743 63.5363 174.5731 47 S 4.6149 8.6105 113.8383 58.3004 62.8316 174.2577 48 L 4.0979 7.3713 120.8173 54.6786 41.9890 176.1718 49 P 4.5242 0.0000 0.0000 62.0553 33.2949 175.6088 50 P 4.3025 0.0000 0.0000 65.9408 31.2256 178.5819 51 F 4.0797 8.3343 118.6930 61.7963 39.3317 176.7159 52 Y 3.9649 8.1464 115.6174 60.8267 37.6411 178.5124 53 K 4.0298 8.2243 119.4941 59.6697 32.1321 179.2727 54 E 3.9347 8.4213 119.0036 59.3440 29.1138 179.5750 55 R 3.7328 7.5469 117.2008 59.1100 30.4394 178.9182 56 L 4.1386 7.9449 118.6671 57.7133 41.5181 179.1995 57 L 3.8972 8.0301 119.4648 57.9013 42.0851 177.2098 58 A 4.5282 7.9421 119.7250 52.2262 18.8136 177.2424 59 L 4.3506 7.3989 118.7296 56.0751 42.5258 176.4068 60 N 4.7513 8.5467 116.8862 53.4980 38.7058 173.8189 61 D 4.7187 7.6204 116.1924 52.8565 42.5920 176.7854 62 S 4.5920 8.4556 119.8417 59.1856 62.8431 174.8387 63 R 4.3928 8.7962 120.2308 56.0204 30.1264 175.5162 64 I 4.5035 7.2014 119.1025 59.9475 38.6314 175.4279 65 T 4.5934 7.6314 115.5498 59.7011 70.7332 175.8131 66 S 4.1273 8.5009 117.0341 61.2236 62.5610 174.8314 67 D 4.4210 8.0555 117.8974 54.5362 41.7708 175.4051 68 G 3.6201 8.2930 107.2097 45.9315 0.0000 173.5573 69 V 4.8315 8.3226 117.9158 61.0288 35.6970 175.1908 70 I 4.4100 9.1941 129.6104 60.6773 38.1503 175.0278 71 V 4.8875 7.8833 124.4994 61.1125 33.6050 174.5749 72 L 5.0294 9.0117 127.1476 53.0701 47.0464 175.6621 73 K 4.8111 8.4419 118.1839 55.6432 35.0525 176.1965 74 A 4.5000 8.9750 129.3699 50.3134 19.3931 176.7319 75 Q 4.6990 8.4349 119.0971 56.9395 29.2827 177.2392 76 Q 4.0678 8.3697 119.7998 59.6831 29.4578 175.9247 77 Y 4.1973 8.1585 114.1068 57.0621 38.7403 176.0550 78 R 4.0953 8.8588 121.7642 58.5512 30.7120 177.2636 79 T 4.7326 7.6668 107.5790 59.5940 72.5002 175.0890 80 Q 4.0782 8.6264 121.9573 58.7047 28.7698 178.7254 81 E 3.8720 8.1223 120.3011 59.5488 29.6963 178.7953 82 Q 3.7842 7.5453 117.3608 58.8921 28.6100 178.4784 83 N 4.4417 8.2079 117.5796 55.8645 38.5162 177.5287 84 R 3.8201 8.2442 120.6361 59.4147 30.1936 178.4354 85 A 3.9482 7.9684 120.5368 54.9936 18.2466 178.9176 86 D 4.2217 8.4100 116.7103 57.6122 41.3103 178.2890 87 A 3.9122 8.3455 121.4849 55.3130 18.3403 179.6509 88 L 3.8837 7.9508 117.3014 57.8516 41.6839 179.5495 89 L 4.1888 8.0624 121.7906 57.4072 41.9604 178.8983 90 R 3.8679 8.6749 119.5254 59.2188 29.9403 178.2402 91 L 3.8806 8.2644 120.6895 58.1936 42.0273 179.0697 92 S 4.0081 7.9637 114.2009 61.3383 62.8732 175.9008 93 E 3.8802 8.5564 123.4752 58.8912 29.4301 178.5142 94 L 3.9919 8.0707 120.3398 58.1797 41.9674 179.0094 95 I 3.7259 7.9963 119.9060 64.5834 37.0679 178.7131 96 V 3.7890 8.0414 119.1724 65.6958 31.3603 177.3964 97 N 4.2446 8.8265 117.1441 56.8594 38.6275 176.7871 98 A 4.0857 8.0171 119.9358 54.5566 18.4330 178.8716 99 A 4.2293 7.3669 117.6368 54.4820 19.1971 179.3577 100 K 4.1716 8.3450 116.4148 58.2676 33.1754 177.4894 101 L 4.4066 7.3078 119.8812 54.0997 42.7319 176.1307 102 E 4.3479 8.3268 116.9274 58.1335 30.6903 175.1978 103 H 4.4485 7.7916 111.2560 55.8988 31.1182 172.9824 104 H 4.3306 8.9737 115.3689 57.2757 26.7934 172.4704 105 H 4.8386 8.6061 116.1803 58.6892 36.8450 175.1853 106 H 4.5904 8.1249 120.0711 53.4303 28.0433 173.4614 107 H 4.3516 7.0459 114.7604 55.8699 33.1279 173.2561 108 H 4.5225 8.6052 122.9253 56.0860 29.5099 173.1549 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 M 8.30 4.52 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 2 L 9.03 4.22 0.00 1.74 1.49 0.85 0.26 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 3 V 9.07 4.05 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 0.89 0.00 0.00 0.96 0.00 0.00 4 I 8.52 4.08 1.62 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.56 0.00 0.00 5 S 7.55 4.84 0.00 3.83 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 6 N 8.74 4.39 0.00 2.66 2.84 0.00 0.00 6.74 7.80 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 7 N 8.00 4.67 0.00 2.68 2.77 0.00 0.00 6.67 7.72 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 8 V 7.17 4.37 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 0.78 0.00 0.00 0.98 0.00 0.00 9 H 8.76 5.22 0.00 3.00 3.12 0.00 5.92 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.79 4.63 0.00 1.67 1.72 0.65 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.58 0.00 2.20 1.99 0.00 3.83 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.14 0.00 12 D 8.88 4.38 0.00 2.72 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 0.00 0.00 0.00 0.00 13 A 8.02 4.00 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 14 E 8.35 4.31 0.00 2.23 1.90 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 2.28 2.29 0.00 15 I 7.74 4.80 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.00 1.03 0.00 0.00 16 E 9.15 4.36 0.00 2.08 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 2.30 2.31 0.00 17 L 8.37 4.90 0.00 1.56 1.61 0.98 0.87 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 18 T 9.24 4.85 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 1.24 0.00 0.00 19 A 8.37 4.98 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 20 I 8.80 4.19 2.01 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 1.20 0.65 0.91 0.00 0.00 21 R 8.50 4.30 0.00 1.77 1.85 0.00 3.26 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 22 A 8.21 4.21 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 23 Q 8.30 4.16 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 5.43 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 24 G 10.04 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 0.00 0.00 0.00 25 A 7.85 4.62 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 26 G 8.05 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 0.00 0.00 0.00 27 G 7.42 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 28 Q 8.52 3.59 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 5.70 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 29 N 8.94 4.39 0.00 2.94 2.89 0.00 0.00 7.08 7.68 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 30 V 8.16 3.21 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 0.92 0.00 0.00 0.93 0.00 0.00 31 N 7.96 5.13 0.00 2.72 2.72 0.00 0.00 7.11 7.69 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 32 K 7.76 4.44 0.00 1.70 1.68 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.42 7.81 33 V 8.23 4.05 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 0.73 0.00 0.00 0.94 0.00 0.00 34 S 8.33 4.38 0.00 4.09 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 35 S 8.54 4.51 0.00 3.89 4.06 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 36 A 7.71 4.44 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 37 M 9.23 4.75 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.52 0.00 38 H 9.30 5.41 0.00 3.15 3.09 0.00 5.57 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.76 5.01 0.00 1.74 1.42 0.93 0.99 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 40 R 9.18 4.99 0.00 1.88 1.76 0.00 3.16 0.00 0.00 3.53 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 41 F 9.34 5.04 0.00 3.07 2.91 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 0.00 0.00 0.00 42 D 7.72 4.69 0.00 2.51 2.43 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 43 I 7.83 3.84 1.94 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 1.00 0.00 0.00 44 N 8.18 4.32 0.00 2.84 2.78 0.00 0.00 7.37 7.51 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 45 A 7.65 4.22 1.20 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 0.00 0.00 46 S 7.98 5.11 0.00 4.05 3.63 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 47 S 8.61 4.61 0.00 4.03 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 48 L 7.37 4.10 0.00 1.78 1.80 1.18 0.85 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 49 P 0.00 4.52 0.00 2.50 2.13 0.00 3.84 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 50 P 0.00 4.30 0.00 2.23 2.18 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 51 F 8.33 4.08 0.00 3.03 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 52 Y 8.15 3.96 0.00 3.26 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 53 K 8.22 4.03 0.00 2.04 1.89 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.28 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.53 1.73 7.81 54 E 8.42 3.93 0.00 2.02 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 2.31 2.48 0.00 55 R 7.55 3.73 0.00 1.73 1.80 0.00 2.96 0.00 0.00 2.50 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.85 0.00 56 L 7.94 4.14 0.00 1.88 1.75 1.03 0.42 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 57 L 8.03 3.90 0.00 1.83 1.69 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 58 A 7.94 4.53 1.27 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 0.00 0.00 0.00 59 L 7.40 4.35 0.00 1.99 1.60 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 60 N 8.55 4.75 0.00 2.82 2.86 0.00 0.00 6.88 8.50 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 61 D 7.62 4.72 0.00 2.46 2.41 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 62 S 8.46 4.59 0.00 3.89 3.87 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 0.00 0.00 0.00 63 R 8.80 4.39 0.00 1.99 1.94 0.00 3.11 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 64 I 7.20 4.50 1.98 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.89 0.97 0.00 0.00 65 T 7.63 4.59 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 66 S 8.50 4.13 0.00 3.85 3.93 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 67 D 8.06 4.42 0.00 2.70 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 68 G 8.29 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.32 4.83 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 0.95 0.00 0.00 0.93 0.00 0.00 70 I 9.19 4.41 2.06 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 0.80 0.95 0.00 0.00 71 V 7.88 4.89 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 0.90 0.00 0.00 1.01 0.00 0.00 72 L 9.01 5.03 0.00 1.58 1.49 0.93 0.81 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 73 K 8.44 4.81 0.00 1.74 1.86 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.77 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.46 7.81 74 A 8.97 4.50 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Q 8.43 4.70 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.98 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 76 Q 8.37 4.07 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.04 7.07 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 77 Y 8.16 4.20 0.00 3.16 2.86 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 78 R 8.86 4.10 0.00 1.83 2.07 0.00 3.38 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 79 T 7.67 4.73 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 1.24 0.00 0.00 80 Q 8.63 4.08 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.01 0.00 0.00 0.00 0.00 0.00 2.55 2.44 0.00 81 E 8.12 3.87 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 2.32 2.37 0.00 82 Q 7.55 3.78 0.00 2.03 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.47 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 83 N 8.21 4.44 0.00 2.92 2.96 0.00 0.00 6.84 8.09 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 84 R 8.24 3.82 0.00 2.03 2.12 0.00 3.09 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 85 A 7.97 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 86 D 8.41 4.22 0.00 2.87 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 87 A 8.35 3.91 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 88 L 7.95 3.88 0.00 1.84 1.68 0.89 0.28 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 89 L 8.06 4.19 0.00 1.79 1.77 0.92 0.58 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 90 R 8.67 3.87 0.00 2.07 2.00 0.00 3.40 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 91 L 8.26 3.88 0.00 1.79 1.71 0.80 0.35 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 92 S 7.96 4.01 0.00 4.06 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 93 E 8.56 3.88 0.00 2.24 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 2.31 2.47 0.00 94 L 8.07 3.99 0.00 1.91 1.83 0.94 1.03 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 95 I 8.00 3.73 1.97 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.19 0.95 0.00 0.00 96 V 8.04 3.79 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 1.09 0.00 0.00 1.03 0.00 0.00 97 N 8.83 4.24 0.00 2.99 3.00 0.00 0.00 7.29 8.68 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 98 A 8.02 4.09 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 99 A 7.37 4.23 1.48 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 0.00 100 K 8.34 4.17 0.00 1.90 1.98 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.70 1.47 7.81 101 L 7.31 4.41 0.00 1.72 1.67 1.00 0.88 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 0.00 102 E 8.33 4.35 0.00 1.89 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 2.12 2.28 0.00 103 H 7.79 4.45 0.00 3.11 3.26 0.00 5.66 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 0.00 104 H 8.97 4.33 0.00 3.38 3.41 0.00 5.76 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 H 8.61 4.84 0.00 3.10 3.29 0.00 5.72 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 H 8.12 4.59 0.00 3.14 3.23 0.00 5.84 0.00 0.00 0.00 0.00 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 H 7.05 4.35 0.00 3.02 3.11 0.00 5.72 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 H 8.61 4.52 0.00 3.01 3.04 0.00 5.98 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00