NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3994 8.3049 120.3466 55.1360 33.3914 175.1358 2 K 4.1477 8.4697 125.4181 55.4114 33.2309 174.9868 3 S 4.7534 8.1487 114.6453 57.9733 63.6567 173.0673 4 T 4.7205 7.4602 112.1979 60.9061 71.8691 174.2877 5 F 4.3485 8.5610 120.8669 61.5465 39.3625 178.8338 6 K 3.9867 8.2158 116.5931 59.6120 32.0595 178.9588 7 S 4.2450 7.9984 113.9797 61.4155 62.3032 176.0215 8 E 3.9410 7.2647 119.8690 58.6324 30.0417 180.9808 9 Y 4.8318 6.8744 114.2683 54.8477 41.5786 174.2313 10 P 4.5735 0.0000 0.0000 62.0852 33.7586 177.0424 11 F 3.9771 8.9163 121.8476 61.9569 39.2223 177.4198 12 E 3.9982 8.6374 120.4802 59.8908 29.2175 179.3565 13 K 4.1368 7.9559 122.4828 59.3616 32.2086 181.5629 14 R 4.4703 8.1967 120.9821 60.1003 30.1346 179.7233 15 K 4.5502 8.1553 124.6521 59.1305 31.5426 180.4911 16 A 4.2030 7.7428 121.4045 55.3465 18.2282 179.6449 17 E 3.9102 8.1660 116.6239 59.7054 29.5349 179.4250 18 S 3.5909 7.9202 114.6156 61.7163 62.8083 176.7841 19 E 3.8944 8.0984 120.6419 59.4675 29.1823 179.2947 20 R 3.9219 7.9100 118.7000 59.4854 30.0150 178.6342 21 I 4.0079 7.9562 119.2170 64.4868 37.0390 178.2520 22 A 4.0576 8.1149 119.9208 54.3107 18.1261 178.5488 23 D 4.5523 7.8345 118.6331 57.4379 41.8308 178.5728 24 R 4.3926 8.5246 118.6584 57.9523 29.7701 178.7363 25 F 4.6358 8.2678 120.4404 57.8394 41.2896 175.1780 26 K 4.1244 8.9861 130.3293 58.0157 31.7399 176.8563 27 N 5.1765 7.9586 118.7938 52.7702 38.0949 176.2785 28 R 4.9666 7.9865 117.8557 55.0151 34.3365 175.5734 29 I 4.1894 8.9423 124.6470 58.7511 39.6554 172.9984 30 P 4.9589 0.0000 0.0000 62.3534 32.7017 175.0675 31 V 4.6362 9.4465 125.5176 60.8853 34.6922 174.0690 32 I 4.5400 8.1770 128.0338 59.6524 39.1589 174.0482 33 C 5.3078 9.2256 128.5358 57.8345 33.3085 172.7973 34 E 5.0154 8.9274 125.3760 54.0263 33.2299 175.5473 35 K 2.9986 8.4573 122.6760 55.4850 33.4310 176.4156 36 A 3.9002 8.7119 129.1726 53.2326 18.7595 178.3896 37 E 3.6351 8.6872 125.7509 60.0390 29.7547 179.5303 38 K 4.4803 7.7564 116.4989 54.1866 31.9741 178.2735 39 S 4.4785 8.4099 117.6757 59.6888 63.0990 175.4148 40 D 4.4685 8.6358 123.8119 55.1832 40.2853 178.2046 41 I 3.8944 7.7246 111.7474 59.7983 37.8655 173.5155 42 P 4.2968 0.0000 0.0000 63.1481 31.6461 175.3879 43 E 4.8049 8.5702 121.3439 53.7299 31.2279 175.2633 44 I 4.4325 8.4280 126.9672 60.2263 38.7247 175.3502 45 D 4.6206 8.5706 121.6859 53.4588 40.0189 176.3753 46 K 4.3366 7.8710 120.6242 55.5707 32.1817 176.0132 47 R 4.9392 8.3160 119.1040 55.3931 31.6831 174.8169 48 K 4.5773 7.7239 119.9204 55.5343 33.0069 175.4397 49 Y 4.6262 9.3600 123.3857 56.0055 41.5462 175.1596 50 L 4.7613 8.6329 123.3742 53.5796 42.7699 175.9661 51 V 4.5701 8.6844 118.3717 58.6247 34.5944 174.1634 52 P 4.7886 0.0000 0.0000 62.2634 32.0294 177.3685 53 A 3.8611 8.2489 126.4384 55.3509 18.4045 178.8712 54 D 4.7702 7.8923 112.4363 54.1699 41.4888 176.5320 55 L 4.2595 8.0454 123.2452 55.2169 42.8164 175.9331 56 T 5.0465 8.2350 114.1598 59.7092 72.3928 175.6457 57 V 3.6838 8.6345 121.8785 66.3581 31.4957 178.3661 58 G 3.9682 8.3788 105.6335 48.4447 0.0000 175.4550 59 Q 4.0909 8.1999 120.1414 58.4969 28.7385 178.4198 60 F 3.9043 8.5487 122.2037 61.0535 39.4133 177.3783 61 V 3.5124 8.2815 118.3649 66.1766 31.4077 177.2690 62 Y 4.0724 7.8179 118.9522 60.6771 38.4795 178.3602 63 V 3.1535 7.3969 118.5603 66.0340 31.7929 178.0104 64 I 3.3150 7.0794 119.3690 64.4908 36.7591 178.2699 65 R 3.7025 7.6104 118.9359 59.0471 29.8684 178.9093 66 K 3.6814 7.6348 117.7042 59.5418 31.9115 179.1549 67 R 3.8578 7.5775 117.9923 58.8424 29.8905 177.8041 68 I 4.2322 7.0880 109.6590 60.0824 39.6211 175.6976 69 M 3.0160 7.6681 117.0605 57.0360 30.6988 176.7385 70 L 4.1134 7.7170 121.4515 53.7203 43.5185 174.4881 71 P 4.2807 0.0000 0.0000 62.0232 31.6543 175.2153 72 P 4.1628 0.0000 0.0000 66.6830 31.1936 178.1012 73 E 4.0491 8.4422 116.2269 59.2518 29.7586 181.7073 74 K 4.1504 7.8236 119.6917 54.4274 32.2747 177.6570 75 A 4.7008 8.0696 120.6612 51.0425 21.4313 176.0991 76 I 4.6821 7.0802 117.8335 59.7345 41.4226 174.1225 77 F 4.9922 9.5361 126.1894 55.8489 43.3435 173.5615 78 I 5.0207 8.2630 122.3700 59.8201 39.1736 175.0536 79 F 5.1938 9.5811 124.2804 55.7525 43.3938 174.5743 80 V 4.4307 9.1927 123.8737 61.5006 33.9048 175.7886 81 N 4.1845 9.5684 127.9566 53.6268 34.4522 171.4360 82 D 4.5219 8.0429 114.6287 55.1048 39.4689 174.3771 83 T 4.5382 7.9708 117.2412 61.7204 70.1516 173.6295 84 L 4.7910 8.3464 128.8729 52.5033 41.2106 173.9908 85 P 4.4851 0.0000 0.0000 61.3457 32.2967 174.9312 86 P 4.4942 0.0000 0.0000 62.4106 32.2430 177.4718 87 T 3.8636 8.6316 110.6850 64.2494 68.5709 175.2612 88 A 4.2206 7.8660 123.0378 52.9762 19.4122 177.4220 89 A 4.1007 8.1647 120.8127 52.1379 19.2858 176.8384 90 L 4.8422 8.2835 122.3440 54.1666 44.2248 178.4002 91 M 4.1369 8.8146 122.9256 58.2478 31.9603 179.4913 92 S 4.0947 7.9045 114.7105 61.3538 63.1246 176.4179 93 A 4.0197 7.9822 124.0984 54.9788 18.2021 179.4811 94 I 3.7600 7.7004 117.8244 64.5305 37.0210 178.0526 95 Y 4.0639 8.2767 120.4516 60.8924 38.4569 178.1121 96 Q 3.9855 7.9286 117.2915 59.1615 28.9567 178.5136 97 E 4.1853 7.8843 117.2370 58.4220 29.6567 177.4499 98 H 4.9072 7.9955 112.4265 54.8549 31.6860 173.6145 99 K 3.9576 7.8904 119.8636 56.9355 32.7102 176.4412 100 D 4.6792 9.6763 124.3574 54.2746 41.8945 178.0573 101 K 4.1829 8.6950 124.2095 56.9705 32.0233 178.5324 102 D 4.4306 8.5826 115.6713 54.3003 39.9026 177.8450 103 G 4.1275 8.2770 107.8487 46.1456 0.0000 173.8931 104 F 4.6274 9.6154 119.7331 56.3853 41.6539 174.3869 105 L 5.0978 8.3359 121.8308 53.7554 44.2626 174.5277 106 Y 5.0153 8.9313 124.5196 56.8816 39.1637 175.2551 107 V 4.8387 8.9329 124.2789 61.5141 35.3432 174.2744 108 T 5.9909 9.2612 119.8610 61.0661 72.8607 172.6125 109 Y 6.2340 8.2650 121.0968 55.0966 42.2010 174.6291 110 S 4.8876 7.7865 112.8425 59.1693 66.5014 175.8628 111 G 3.8141 8.7973 108.4275 46.2202 0.0000 172.4758 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 4.40 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 2 K 8.47 4.15 0.00 1.86 1.72 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.43 1.48 7.81 3 S 8.15 4.75 0.00 3.77 3.78 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 4 T 7.46 4.72 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 1.25 0.00 0.00 5 F 8.56 4.35 0.00 3.35 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 6 K 8.22 3.99 0.00 1.80 1.89 0.00 1.61 0.00 0.00 1.60 0.00 0.00 3.11 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.60 1.58 7.81 7 S 8.00 4.25 0.00 3.89 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 8 E 7.26 3.94 0.00 1.94 1.84 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 2.23 2.21 0.00 9 Y 6.87 4.83 0.00 2.52 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 10 P 0.00 4.57 0.00 2.34 2.20 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.05 0.00 11 F 8.92 3.98 0.00 3.25 3.23 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 0.00 12 E 8.64 4.00 0.00 2.28 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 2.46 2.50 0.00 13 K 7.96 4.14 0.00 1.90 1.71 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.09 7.81 14 R 8.20 4.47 0.00 1.97 2.35 0.00 3.54 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 15 K 8.16 4.55 0.00 1.75 1.83 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.20 7.81 16 A 7.74 4.20 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 17 E 8.17 3.91 0.00 2.64 2.35 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 2.41 2.42 0.00 18 S 7.92 3.59 0.00 3.76 3.61 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 0.00 0.00 0.00 0.00 19 E 8.10 3.89 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 2.31 2.46 0.00 20 R 7.91 3.92 0.00 2.05 1.97 0.00 3.13 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 21 I 7.96 4.01 2.05 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.42 0.81 0.00 0.00 22 A 8.11 4.06 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 23 D 7.83 4.55 0.00 2.97 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 R 8.52 4.39 0.00 1.91 1.80 0.00 3.31 0.00 0.00 3.22 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 25 F 8.27 4.64 0.00 3.02 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 26 K 8.99 4.12 0.00 1.77 1.72 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.36 1.01 7.81 27 N 7.96 5.18 0.00 2.39 2.79 0.00 0.00 6.59 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 28 R 7.99 4.97 0.00 1.61 1.72 0.00 3.32 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 29 I 8.94 4.19 1.83 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 0.66 0.35 0.74 0.00 0.00 30 P 0.00 4.96 0.00 2.09 2.06 0.00 3.38 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.68 0.00 31 V 9.45 4.64 2.14 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 0.84 0.00 0.00 0.83 0.00 0.00 32 I 8.18 4.54 1.13 0.00 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 -0.36 0.66 0.00 0.00 33 C 9.23 5.31 0.00 3.10 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 34 E 8.93 5.02 0.00 2.04 1.85 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 2.33 2.35 0.00 35 K 8.46 3.00 0.00 1.48 1.52 0.00 2.00 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.14 0.90 7.81 36 A 8.71 3.90 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 E 8.69 3.64 0.00 1.92 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 2.30 2.41 0.00 38 K 7.76 4.48 0.00 1.76 1.66 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.28 0.97 7.81 39 S 8.41 4.48 0.00 3.84 3.75 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 40 D 8.64 4.47 0.00 2.73 2.55 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 41 I 7.72 3.89 1.98 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.23 0.97 0.00 0.00 42 P 0.00 4.30 0.00 2.10 2.08 0.00 3.69 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 43 E 8.57 4.80 0.00 1.94 1.87 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 2.28 2.31 0.00 44 I 8.43 4.43 2.00 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 1.50 0.77 1.02 0.00 0.00 45 D 8.57 4.62 0.00 2.82 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.87 4.34 0.00 1.74 1.65 0.00 1.59 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.30 7.81 47 R 8.32 4.94 0.00 1.95 2.26 0.00 3.24 0.00 0.00 3.46 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 48 K 7.72 4.58 0.00 1.44 1.60 0.00 1.52 0.00 0.00 1.53 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.81 1.22 7.81 49 Y 9.36 4.63 0.00 3.03 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.63 4.76 0.00 1.37 1.51 0.69 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.68 4.57 2.18 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 1.02 0.00 0.00 0.95 0.00 0.00 52 P 0.00 4.79 0.00 2.09 1.97 0.00 3.66 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 2.14 2.11 0.00 53 A 8.25 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 54 D 7.89 4.77 0.00 2.68 2.71 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 0.00 0.00 0.00 0.00 55 L 8.05 4.26 0.00 1.81 1.64 1.06 1.25 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 56 T 8.23 5.05 4.40 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 1.22 0.00 0.00 57 V 8.63 3.68 2.22 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 1.10 0.00 0.00 0.94 0.00 0.00 58 G 8.38 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.20 4.09 0.00 2.31 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 60 F 8.55 3.90 0.00 3.21 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 61 V 8.28 3.51 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 0.89 0.00 0.00 0.97 0.00 0.00 62 Y 7.82 4.07 0.00 2.99 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 63 V 7.40 3.15 1.75 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 0.63 0.00 0.00 0.90 0.00 0.00 64 I 7.08 3.31 1.48 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.89 0.09 0.00 0.00 65 R 7.61 3.70 0.00 1.82 1.74 0.00 3.12 0.00 0.00 3.12 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 66 K 7.63 3.68 0.00 1.49 1.64 0.00 0.61 0.00 0.00 0.92 0.00 0.00 2.71 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.10 0.91 7.81 67 R 7.58 3.86 0.00 1.83 1.95 0.00 3.21 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 68 I 7.09 4.23 1.85 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.71 0.86 0.00 0.00 69 M 7.67 3.02 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 70 L 7.72 4.11 0.00 1.73 1.48 0.87 0.96 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 71 P 0.00 4.28 0.00 2.20 1.97 0.00 3.66 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 2.10 2.06 0.00 72 P 0.00 4.16 0.00 2.16 2.23 0.00 3.75 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 1.99 2.00 0.00 73 E 8.44 4.05 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 2.23 1.88 0.00 74 K 7.82 4.15 0.00 1.78 1.63 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.39 1.27 7.81 75 A 8.07 4.70 0.98 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 0.00 0.00 76 I 7.08 4.68 1.73 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.00 0.72 0.00 0.00 77 F 9.54 4.99 0.00 2.83 2.40 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 78 I 8.26 5.02 1.86 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.64 0.89 0.00 0.00 79 F 9.58 5.19 0.00 3.02 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 80 V 9.19 4.43 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 1.03 0.00 0.00 0.93 0.00 0.00 81 N 9.57 4.18 0.00 2.89 2.66 0.00 0.00 6.99 8.06 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 82 D 8.04 4.52 0.00 2.83 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.97 4.54 4.46 0.00 0.00 0.00 0.00 0.00 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 84 L 8.35 4.79 0.00 1.66 1.63 0.51 0.87 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 85 P 0.00 4.49 0.00 2.21 2.04 0.00 3.93 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 86 P 0.00 4.49 0.00 2.25 2.22 0.00 3.72 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 2.08 1.96 0.00 87 T 8.63 3.86 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 1.23 0.00 0.00 88 A 7.87 4.22 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 89 A 8.16 4.10 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 90 L 8.28 4.84 0.00 1.71 1.59 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 91 M 8.81 4.14 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.80 0.00 92 S 7.90 4.09 0.00 4.00 4.17 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 93 A 7.98 4.02 1.36 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 94 I 7.70 3.76 2.03 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 1.44 0.80 0.95 0.00 0.00 95 Y 8.28 4.06 0.00 3.06 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 96 Q 7.93 3.99 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.70 0.00 97 E 7.88 4.19 0.00 2.03 1.77 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 2.31 2.33 0.00 98 H 8.00 4.91 0.00 3.21 3.25 0.00 5.67 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.89 3.96 0.00 1.31 0.74 0.00 1.28 0.00 0.00 0.61 0.00 0.00 2.54 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.06 1.16 7.81 100 D 9.68 4.68 0.00 3.17 3.23 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 0.00 101 K 8.69 4.18 0.00 1.81 1.72 0.00 1.85 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.36 1.00 7.81 102 D 8.58 4.43 0.00 2.89 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 0.00 103 G 8.28 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 0.00 0.00 0.00 0.00 104 F 9.62 4.63 0.00 2.85 2.53 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 0.00 105 L 8.34 5.10 0.00 1.88 1.59 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.93 5.02 0.00 2.93 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.93 4.84 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 1.04 0.00 0.00 0.77 0.00 0.00 108 T 9.26 5.99 4.45 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 1.31 0.00 0.00 109 Y 8.26 6.23 0.00 3.11 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 0.00 110 S 7.79 4.89 0.00 4.02 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 0.00 111 G 8.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00