NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3168 8.3049 120.3239 53.7497 34.4900 175.3409 2 E 3.5654 8.1655 115.8784 56.7577 26.7751 173.6897 3 L 4.2225 7.5644 119.2270 54.8186 43.7800 178.4287 4 T 4.3042 8.8610 115.0862 60.3944 71.2450 173.9878 5 P 4.2850 0.0000 0.0000 65.6739 31.3315 179.1794 6 R 3.9738 7.9384 114.5093 59.2476 29.2274 178.7191 7 E 3.9822 7.8537 118.2975 59.1746 29.2641 179.3865 8 K 3.9973 7.7636 117.2208 59.2596 32.4235 178.6641 9 D 4.4661 8.1784 118.6377 57.2598 41.0933 178.4643 10 K 4.1011 8.0153 118.4122 59.1778 31.9644 179.3053 11 L 4.0199 7.6264 119.6123 57.4351 41.4400 179.2356 12 L 4.0036 7.8272 120.5057 57.8489 42.0206 178.7383 13 L 3.9385 7.7877 119.8672 58.1056 42.2713 178.3635 14 F 4.1371 8.4986 120.8332 61.9126 38.8110 177.3071 15 T 3.8131 8.2249 114.9798 66.3915 68.0545 176.6854 16 A 4.0079 8.0867 122.7336 54.9708 18.2881 179.5553 17 A 3.8788 8.0082 119.4473 55.1525 18.2559 179.7795 18 L 3.7381 7.4492 117.4106 57.6938 41.5132 179.9570 19 V 3.5049 7.3767 116.8133 65.9739 31.4735 177.9987 20 A 3.9368 7.6357 120.6087 55.0947 18.1344 178.9690 21 E 3.8112 8.4209 118.2148 59.7470 29.7269 179.4274 22 R 3.9795 7.7755 117.9411 59.1510 30.1660 179.2088 23 R 3.9537 7.8372 117.7148 59.0169 29.9943 178.8402 24 L 3.9527 8.2507 120.3016 58.0040 41.8468 178.8684 25 A 4.0013 7.5326 119.7259 55.1039 18.3862 179.4284 26 R 4.1082 7.6494 114.9545 57.4332 30.1473 177.7413 27 G 3.8956 7.9763 106.7536 45.3751 0.0000 173.4046 28 L 4.4437 7.4819 118.4986 53.6005 43.0328 176.7086 29 K 4.4693 8.3967 121.0547 55.6058 32.8919 177.1054 30 L 4.4354 8.7015 126.1211 55.0172 43.2584 177.4032 31 N 4.6864 8.7401 119.8497 52.0566 39.9027 174.1435 32 Y 4.1364 8.4168 117.3011 60.8137 38.8286 176.8602 33 P 3.8996 0.0000 0.0000 65.8836 31.4095 178.1652 34 E 3.9051 8.5776 118.2642 59.1757 29.3439 179.5389 35 S 4.0389 7.8680 114.8621 61.6221 62.9820 176.8255 36 V 3.4754 7.4158 120.5731 65.9196 31.1777 177.9348 37 A 3.9498 7.8822 120.4882 54.8665 18.2916 179.3722 38 L 3.8584 7.8991 118.7782 58.5277 42.1864 179.3284 39 I 3.7769 7.7339 119.7226 64.3799 37.0875 178.6926 40 S 4.1445 8.2498 115.8349 61.6464 62.7303 176.6286 41 A 4.0806 8.1997 123.4428 54.8998 18.0513 179.3790 42 F 4.0459 8.1590 118.8254 61.6933 39.4781 177.4735 43 I 3.6112 7.7758 119.0103 64.5891 36.8583 178.3495 44 M 3.9539 7.9482 119.2901 58.4617 31.8276 178.6924 45 E 4.0548 8.1787 118.6753 58.7416 29.5540 179.6615 46 G 3.2392 7.5910 105.9507 47.6249 0.0000 175.6502 47 A 3.1033 7.6043 123.7699 54.3586 17.9321 179.5566 48 R 3.6929 7.4200 116.1693 59.7211 30.1628 178.1703 49 D 4.4983 7.7093 117.2103 55.4399 40.8073 177.3705 50 G 3.9830 7.6785 107.3509 45.2497 0.0000 173.8346 51 K 4.2529 7.5311 118.4636 55.5975 32.8650 177.9238 52 S 4.5350 8.3960 116.7218 57.8738 65.3319 175.5631 53 V 3.5439 8.0830 121.4932 66.1465 30.9022 177.9050 54 A 4.0158 7.9721 119.9500 55.3207 18.1372 179.6399 55 S 4.0224 7.8860 113.6376 61.8814 62.8847 177.0007 56 L 4.1261 8.0201 121.6086 58.0846 41.1314 179.4046 57 M 4.0556 8.1320 117.8499 57.7799 32.0714 177.8672 58 E 4.2774 7.7265 118.8071 58.7573 30.3301 178.0412 59 E 4.2431 8.6367 118.9513 59.2704 29.3015 179.3734 60 G 3.8127 8.4419 104.8870 46.7357 0.0000 174.8433 61 R 4.5851 7.5122 119.8868 55.8038 30.3392 176.1625 62 H 4.9449 7.6570 115.8695 55.5829 29.8918 175.3157 63 V 3.5964 7.8760 120.6619 64.6251 31.7813 176.1006 64 L 4.9249 7.4649 116.8767 52.9738 45.3154 175.7091 65 T 4.5568 8.3534 111.6884 59.3970 71.5424 175.4552 66 R 3.9147 8.3051 121.1261 59.0765 30.0748 177.2980 67 E 4.3076 7.7005 112.1943 57.1454 30.1940 176.6560 68 Q 4.5883 8.0990 118.4076 56.0004 30.1350 175.2094 69 V 5.0200 7.2363 110.9113 59.2225 35.7430 175.4270 70 M 4.3284 9.0089 122.0968 54.9176 33.2411 175.9763 71 E 4.0583 8.6329 121.6639 57.9245 30.3643 177.5581 72 G 4.0258 8.9418 113.5078 45.6722 0.0000 175.5893 73 V 3.6850 7.6925 119.6820 65.4500 31.6556 176.3692 74 P 4.3573 0.0000 0.0000 65.4328 31.3567 178.1275 75 E 4.0998 7.6340 116.1472 58.8427 29.5491 177.6352 76 M 4.2977 7.6948 116.3056 56.4615 31.1554 176.8275 77 I 4.6698 7.3570 120.2477 58.3935 37.6513 173.8166 78 P 4.6558 0.0000 0.0000 65.3079 32.6800 176.0177 79 D 4.9890 7.3271 115.4856 52.8705 42.7303 175.1095 80 I 4.7885 8.5817 118.9489 59.8002 41.5059 174.6734 81 Q 5.5413 8.8601 123.9458 53.2728 32.4031 174.8819 82 V 4.5769 8.1623 120.1180 60.8323 34.6492 172.2961 83 E 5.4560 8.8969 120.4065 54.2275 32.9472 174.8001 84 A 4.5754 8.3014 121.5480 51.2615 23.1281 175.5821 85 T 4.4236 8.3439 116.4220 63.1625 69.1072 175.3795 86 F 4.4468 9.1199 126.4004 55.2635 40.5969 175.3324 87 P 4.3452 0.0000 0.0000 65.3399 31.0847 177.0036 88 D 4.7633 8.1420 116.7870 52.9961 40.1509 177.0578 89 G 3.9023 8.0445 108.2974 45.4831 0.0000 173.1897 90 S 5.1258 8.2912 114.3653 58.4580 63.1036 174.5302 91 K 4.6882 8.8652 122.1745 54.6003 36.9017 174.4416 92 L 4.9720 8.4075 123.5227 53.4536 44.1817 175.4411 93 V 4.4256 8.7690 126.2461 61.4757 33.8368 174.0791 94 T 4.9770 8.5797 124.3876 61.7213 70.8964 173.7359 95 V 4.2769 8.6691 126.7433 61.4221 33.7014 174.0849 96 H 4.7459 8.8703 125.4337 55.7326 29.7425 175.6206 97 N 4.1341 9.0205 118.7655 53.7414 35.9345 172.6118 98 P 4.2966 0.0000 0.0000 64.7668 32.2162 177.0706 99 I 4.6999 7.5739 119.3224 59.3861 38.6997 175.4404 100 I 4.2058 8.0963 125.0997 61.6087 38.0757 174.9790 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 4.32 0.00 2.00 2.18 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 2.48 2.55 0.00 2 E 8.17 3.57 0.00 2.15 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 2.21 2.45 0.00 3 L 7.56 4.22 0.00 1.62 1.60 0.89 0.97 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 4 T 8.86 4.30 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 1.25 0.00 0.00 5 P 0.00 4.28 0.00 2.18 2.14 0.00 3.60 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 6 R 7.94 3.97 0.00 2.04 2.19 0.00 2.97 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 7 E 7.85 3.98 0.00 2.26 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 2.30 2.33 0.00 8 K 7.76 4.00 0.00 1.92 1.87 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.54 7.81 9 D 8.18 4.47 0.00 2.97 2.78 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 10 K 8.02 4.10 0.00 1.97 1.85 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.71 1.62 7.81 11 L 7.63 4.02 0.00 1.90 1.75 0.90 0.30 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 12 L 7.83 4.00 0.00 1.77 1.94 0.93 0.45 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 13 L 7.79 3.94 0.00 1.82 1.91 0.92 0.90 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 14 F 8.50 4.14 0.00 3.12 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 15 T 8.22 3.81 4.28 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 1.22 0.00 0.00 16 A 8.09 4.01 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 17 A 8.01 3.88 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 18 L 7.45 3.74 0.00 1.75 1.59 0.82 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.38 3.50 2.21 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 0.98 0.00 0.00 0.93 0.00 0.00 20 A 7.64 3.94 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 21 E 8.42 3.81 0.00 2.10 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 0.00 2.28 2.34 0.00 22 R 7.78 3.98 0.00 1.95 1.93 0.00 3.25 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 23 R 7.84 3.95 0.00 1.92 1.96 0.00 3.14 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 24 L 8.25 3.95 0.00 1.78 1.79 0.90 1.05 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 25 A 7.53 4.00 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 26 R 7.65 4.11 0.00 2.03 1.99 0.00 3.16 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 27 G 7.98 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 0.00 0.00 0.00 28 L 7.48 4.44 0.00 1.66 1.60 0.91 0.87 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 29 K 8.40 4.47 0.00 1.64 1.73 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.46 7.81 30 L 8.70 4.44 0.00 1.61 1.57 0.89 0.37 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 31 N 8.74 4.69 0.00 3.01 3.01 0.00 0.00 6.66 7.04 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 32 Y 8.42 4.14 0.00 3.07 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 33 P 0.00 3.90 0.00 2.25 2.28 0.00 3.97 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.12 0.00 34 E 8.58 3.91 0.00 2.06 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 2.30 2.42 0.00 35 S 7.87 4.04 0.00 4.02 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 36 V 7.42 3.48 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 0.91 0.00 0.00 0.43 0.00 0.00 37 A 7.88 3.95 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 38 L 7.90 3.86 0.00 1.86 1.75 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.73 3.78 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.26 0.92 0.00 0.00 40 S 8.25 4.14 0.00 4.06 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 41 A 8.20 4.08 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 42 F 8.16 4.05 0.00 3.17 3.32 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 43 I 7.78 3.61 2.07 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 1.69 0.88 0.97 0.00 0.00 44 M 7.95 3.95 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.57 0.00 45 E 8.18 4.05 0.00 1.97 1.88 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 2.53 2.48 0.00 46 G 7.59 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 47 A 7.60 3.10 0.10 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 0.00 0.00 0.00 0.00 0.00 0.00 48 R 7.42 3.69 0.00 1.67 2.02 0.00 3.22 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 49 D 7.71 4.50 0.00 2.79 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 50 G 7.68 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 0.00 0.00 0.00 51 K 7.53 4.25 0.00 1.88 1.80 0.00 1.66 0.00 0.00 1.86 0.00 0.00 3.14 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.32 7.81 52 S 8.40 4.53 0.00 4.05 4.02 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 53 V 8.08 3.54 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 1.01 0.00 0.00 0.29 0.00 0.00 54 A 7.97 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 55 S 7.89 4.02 0.00 4.04 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 56 L 8.02 4.13 0.00 1.97 1.83 1.06 0.89 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 57 M 8.13 4.06 0.00 2.02 2.31 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.70 0.00 58 E 7.73 4.28 0.00 2.13 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 0.00 2.31 2.45 0.00 59 E 8.64 4.24 0.00 2.32 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 0.00 2.46 2.63 0.00 60 G 8.44 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 61 R 7.51 4.59 0.00 1.60 1.85 0.00 3.07 0.00 0.00 3.04 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.69 0.00 62 H 7.66 4.94 0.00 3.05 3.18 0.00 5.65 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.88 3.60 1.88 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 0.60 0.00 0.00 0.23 0.00 0.00 64 L 7.46 4.92 0.00 1.57 1.46 0.88 0.76 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 65 T 8.35 4.56 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 66 R 8.31 3.91 0.00 1.90 1.97 0.00 3.17 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 67 E 7.70 4.31 0.00 2.16 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 0.00 2.28 2.27 0.00 68 Q 8.10 4.59 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.68 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 69 V 7.24 5.02 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 0.68 0.00 0.00 0.99 0.00 0.00 70 M 9.01 4.33 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.50 0.00 71 E 8.63 4.06 0.00 1.92 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 2.29 2.32 0.00 72 G 8.94 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 73 V 7.69 3.69 2.27 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 1.02 0.00 0.00 1.03 0.00 0.00 74 P 0.00 4.36 0.00 2.23 2.25 0.00 3.66 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 2.12 2.12 0.00 75 E 7.63 4.10 0.00 2.21 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 2.34 2.33 0.00 76 M 7.69 4.30 0.00 1.81 2.29 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.39 0.00 77 I 7.36 4.67 1.94 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 1.57 1.34 0.98 0.00 0.00 78 P 0.00 4.66 0.00 2.15 2.33 0.00 3.87 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 79 D 7.33 4.99 0.00 2.68 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 80 I 8.58 4.79 1.88 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 1.22 0.82 0.92 0.00 0.00 81 Q 8.86 5.54 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.71 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 82 V 8.16 4.58 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 0.69 0.00 0.00 0.96 0.00 0.00 83 E 8.90 5.46 0.00 1.87 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 2.23 2.14 0.00 84 A 8.30 4.58 1.05 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 0.00 0.00 0.00 0.00 0.00 85 T 8.34 4.42 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 1.23 0.00 0.00 86 F 9.12 4.45 0.00 3.32 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 87 P 0.00 4.35 0.00 2.10 2.15 0.00 3.87 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 2.08 2.10 0.00 88 D 8.14 4.76 0.00 2.77 2.76 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 89 G 8.04 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 0.00 0.00 0.00 90 S 8.29 5.13 0.00 3.80 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 91 K 8.87 4.69 0.00 0.97 1.27 0.00 1.45 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 0.67 7.81 92 L 8.41 4.97 0.00 1.80 1.53 0.99 0.87 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 93 V 8.77 4.43 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 1.00 0.00 0.00 1.16 0.00 0.00 94 T 8.58 4.98 4.18 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 1.07 0.00 0.00 95 V 8.67 4.28 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 1.01 0.00 0.00 0.97 0.00 0.00 96 H 8.87 4.75 0.00 3.10 3.21 0.00 5.90 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 9.02 4.13 0.00 2.76 2.80 0.00 0.00 7.01 8.67 0.00 0.00 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 P 0.00 4.30 0.00 2.19 2.30 0.00 3.84 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 99 I 7.57 4.70 1.88 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 1.39 0.62 0.88 0.00 0.00 100 I 8.10 4.21 1.88 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 1.27 0.58 0.92 0.00 0.00