NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3065 8.2549 117.2830 56.5403 30.5703 175.5193 3 H 4.9538 8.4754 115.3864 54.4874 31.6769 170.5667 4 L 3.6211 9.3792 117.0969 56.9328 40.2511 174.5436 5 K 4.5399 7.7822 113.5143 55.5023 34.5308 176.5718 6 S 4.5735 7.7627 115.3129 56.2056 64.6026 173.1125 7 G 3.9341 8.3541 110.8212 45.2086 0.0000 173.0331 8 R 4.2625 8.5619 118.4782 55.2692 30.8972 175.6650 9 K 4.3225 7.1457 118.8266 54.1582 35.2519 175.8240 10 L 4.3878 7.7630 113.8720 54.7279 43.6534 173.6572 11 N 4.5967 8.6241 122.5136 52.6965 40.7273 174.8815 12 R 3.9849 8.7245 119.3234 56.0853 29.5093 177.3239 13 H 4.6127 8.1065 115.4020 55.2764 26.8142 177.6210 14 S 3.2965 8.1605 119.9723 60.2346 65.0629 174.5122 15 S 4.1391 8.5952 110.1668 58.7894 62.9225 174.2831 16 H 4.5026 8.7919 118.0735 56.4837 32.0832 175.3271 17 R 3.7561 7.7478 119.7503 59.6009 29.9148 177.8297 18 L 3.9404 7.8211 119.9185 57.5336 42.2029 178.1304 19 A 3.9686 7.8215 120.5697 54.9074 18.1200 178.2950 20 L 3.7413 8.3606 117.2907 57.3625 41.9507 178.8393 21 Y 4.3854 5.5905 114.5971 61.2633 38.4400 178.2290 22 R 3.7333 7.3886 118.3673 59.8283 30.0457 178.3152 23 N 4.6135 8.1962 112.3822 54.2739 38.5297 175.5711 24 Q 4.5164 8.0643 118.3434 55.4091 30.4401 176.2531 25 A 4.4237 8.2754 120.3020 54.0790 20.1378 179.3007 26 K 3.8950 8.1326 115.0313 59.7868 32.3117 178.9303 27 S 4.3970 8.0950 114.6721 60.9239 63.1355 175.8269 28 L 3.9161 7.4859 123.0641 58.5952 41.6242 179.3764 29 L 4.0874 8.4411 117.5449 57.3460 41.6843 178.2578 30 T 4.5754 7.6540 111.3685 62.0131 68.7150 174.7471 31 H 4.6066 8.3922 113.4221 55.3066 34.5353 174.4559 32 G 4.2631 8.3227 114.3335 44.9507 0.0000 173.1478 33 R 4.9336 7.5249 118.3221 53.7349 33.5021 174.8778 34 I 4.7682 9.5089 122.3309 59.9995 42.0870 174.3471 35 T 5.5726 8.6414 121.0803 61.2241 70.6767 173.3457 36 T 4.7312 8.5119 115.1291 60.1621 72.1949 172.7742 37 T 3.7166 8.6112 112.6344 62.2870 68.8547 173.5629 38 V 3.3335 8.4417 120.0522 66.3732 29.9597 176.3346 39 P 4.1640 0.0000 0.0000 65.9052 31.7467 178.4417 40 K 4.0313 7.9016 115.9854 58.5786 31.9439 178.0965 41 A 4.3935 8.5416 121.1806 54.1546 19.6177 178.9309 42 K 3.9477 7.2680 114.8178 58.3041 32.5326 177.7446 43 E 4.2564 7.9597 119.4567 58.0452 30.4589 177.2495 44 L 3.8905 7.2832 118.6386 57.1353 42.0840 178.5165 45 R 4.0963 8.2635 117.6053 58.3134 29.7799 177.4117 46 G 4.0753 8.9529 109.7129 47.7843 0.0000 174.3004 47 F 3.9047 7.9763 121.5073 60.6455 39.7980 177.1265 48 V 3.8766 7.7773 117.9141 66.0199 31.2983 177.4448 49 D 4.2367 8.2224 117.6008 57.8852 41.0800 178.6614 50 H 4.1784 7.8940 117.6571 59.3941 29.9850 177.4316 51 L 3.7992 7.6025 120.1089 57.5287 41.3946 179.3703 52 I 3.4717 7.5045 119.9937 64.6682 37.1531 177.7960 53 H 3.9487 7.5753 118.0360 58.4799 29.4131 177.1497 54 L 4.0641 7.5124 119.8339 56.6355 41.3797 177.9763 55 A 3.9476 6.9204 118.4678 51.5335 18.9810 177.3353 56 K 4.1503 7.6438 121.7542 58.1151 33.4403 177.5619 57 R 4.6203 7.6491 115.8843 53.9154 28.4598 176.6965 58 G 4.1649 8.2605 105.1757 47.0435 0.0000 171.5045 59 D 4.4790 8.9474 120.4708 52.6497 40.1049 176.8596 60 L 3.7616 8.6800 121.7013 58.9861 41.9249 178.3863 61 H 3.9668 8.3896 116.8847 59.5784 29.4054 176.1465 62 A 4.0112 7.6443 120.3050 56.1833 18.0570 178.8635 63 R 3.8914 7.9215 116.2352 59.4399 29.8249 178.3576 64 R 3.9381 8.2087 117.5562 60.0598 29.8529 178.2806 65 L 3.9295 7.9695 118.4551 57.2246 41.4550 179.3138 66 V 3.7424 7.9134 118.0452 66.3098 31.7831 177.8951 67 L 4.4939 7.6564 119.9256 56.2400 41.7485 177.7569 68 R 4.4251 8.9492 116.8889 56.9738 30.1714 175.4031 69 D 4.8119 7.4784 115.4200 55.6597 43.2391 176.0922 70 L 4.4139 8.2612 120.4888 53.9113 42.1064 177.6675 71 Q 3.9656 8.6274 125.0946 57.6733 29.3451 174.9998 72 D 4.5392 7.9384 117.4480 53.0297 40.4307 176.0926 73 V 3.5067 8.6058 127.3497 66.2151 31.3673 177.8403 74 K 3.9518 8.1049 118.2966 59.3612 31.2614 178.5834 75 L 3.8972 7.7641 120.1469 58.4412 41.9647 179.6696 76 V 3.7102 7.6181 118.2510 66.1662 31.4873 178.3119 77 R 4.0383 8.4444 118.0033 59.2154 29.8153 178.7893 78 K 3.8858 8.1879 117.3062 59.0074 32.2444 176.9467 79 L 4.3625 7.4424 118.7638 57.4167 42.3809 177.8091 80 F 3.7961 8.9063 118.3384 61.0308 39.1843 176.9075 81 D 4.5894 8.4516 117.2932 56.2660 41.0871 177.1368 82 E 4.4413 8.1897 118.0291 57.0272 31.2849 176.6312 83 I 4.0392 8.3078 119.4943 63.8022 38.1933 177.8135 84 A 4.0555 8.1251 122.6698 55.4750 17.3193 177.5830 85 P 3.9584 0.0000 0.0000 65.8950 32.2293 179.2368 86 R 3.6593 7.7990 119.0175 59.7313 29.9717 177.5140 87 Y 4.3947 7.2680 111.6381 58.2148 38.1401 176.6358 88 R 4.0158 9.0097 122.0942 59.0789 30.2435 176.2192 89 D 4.8099 7.4717 117.9168 50.6260 40.3013 173.8620 90 R 4.4021 7.4366 119.8093 56.0247 33.0459 174.7187 91 Q 4.4037 8.9259 128.2316 51.8000 27.7022 172.8428 92 G 3.9017 9.3881 108.0990 43.8710 0.0000 171.4534 93 G 4.2025 8.8929 104.9078 46.1407 0.0000 174.5947 94 Y 3.8246 7.9993 116.7713 59.2796 38.6581 176.2220 95 T 4.8727 8.1450 114.1568 60.4956 70.8790 172.7238 96 R 4.6352 10.5265 128.3760 54.6516 32.8350 175.0786 97 V 5.2419 8.2621 124.3008 60.3578 33.5439 174.2298 98 L 4.8641 8.4210 127.3679 52.8754 45.1251 175.4984 99 K 4.7269 8.4684 120.1167 55.1512 33.6610 175.9944 100 L 4.6393 8.0524 124.6700 53.2727 43.1719 176.8919 101 A 4.1898 8.5214 126.0652 51.6368 19.6696 173.1615 102 E 3.6582 8.6551 123.9410 56.1837 29.3865 174.7633 103 R 4.6617 8.2304 118.5906 53.5872 32.2886 175.5689 104 R 3.8224 7.7964 118.4888 57.3011 30.5424 177.4651 105 R 4.4890 8.4138 125.3935 54.0289 28.4507 176.3191 106 G 4.2323 7.4977 104.1300 46.2491 0.0000 171.0236 107 D 4.3774 8.4250 116.5203 52.6282 44.3538 175.2534 108 G 3.7846 8.6193 109.0137 46.3112 0.0000 172.6215 109 A 4.8999 7.1921 121.1056 49.3859 22.4888 176.0734 110 P 4.5727 0.0000 0.0000 63.0834 32.7489 175.3332 111 L 4.8947 8.4153 120.3674 53.5851 45.1424 174.8941 112 A 4.6750 8.2529 119.9585 50.9599 23.5379 174.7786 113 L 5.1972 8.8625 120.6485 53.4492 45.6356 175.5491 114 V 5.1841 9.0087 124.2095 61.5417 34.9787 173.6012 115 E 5.0498 9.2761 124.5122 55.1673 33.4657 173.9866 116 L 4.7076 8.4530 121.2947 53.4682 42.3664 176.9189 117 V 3.6866 8.4698 123.8311 62.5909 32.3451 175.4562 118 E 4.7531 8.7066 125.0411 57.0799 29.9846 176.6157 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 4.31 0.00 1.90 1.45 0.00 2.99 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 1.48 1.72 0.00 3 H 8.48 4.95 0.00 3.18 3.25 0.00 5.85 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 4 L 9.38 3.62 0.00 1.75 1.66 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.78 4.54 0.00 1.71 1.76 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.49 7.81 6 S 7.76 4.57 0.00 3.85 3.80 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 7 G 8.35 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 0.00 0.00 0.00 8 R 8.56 4.26 0.00 1.82 1.90 0.00 3.41 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 9 K 7.15 4.32 0.00 1.91 1.81 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.72 7.81 10 L 7.76 4.39 0.00 1.62 1.64 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.62 4.60 0.00 2.66 2.68 0.00 0.00 7.33 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 8.72 3.98 0.00 1.76 1.57 0.00 3.03 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.37 0.00 13 H 8.11 4.61 0.00 3.20 3.33 0.00 5.87 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.16 3.30 0.00 4.11 3.96 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 0.00 0.00 0.00 15 S 8.60 4.14 0.00 4.02 4.08 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 16 H 8.79 4.50 0.00 2.69 2.88 0.00 5.63 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 17 R 7.75 3.76 0.00 1.89 1.93 0.00 3.33 0.00 0.00 3.31 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.99 0.00 18 L 7.82 3.94 0.00 1.83 1.52 0.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.82 3.97 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 20 L 8.36 3.74 0.00 1.32 1.04 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 5.59 4.39 0.00 2.45 1.69 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 22 R 7.39 3.73 0.00 1.89 1.96 0.00 3.14 0.00 0.00 3.31 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.64 0.00 23 N 8.20 4.61 0.00 2.67 2.82 0.00 0.00 6.97 8.53 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 24 Q 8.06 4.52 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.61 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 25 A 8.28 4.42 1.45 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 0.00 0.00 0.00 26 K 8.13 3.90 0.00 1.74 1.95 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.75 7.81 27 S 8.09 4.40 0.00 3.86 3.89 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 28 L 7.49 3.92 0.00 1.92 1.84 0.94 0.69 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 29 L 8.44 4.09 0.00 1.73 1.75 0.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.65 4.58 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 1.35 0.00 0.00 31 H 8.39 4.61 0.00 3.35 3.26 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.32 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 0.00 0.00 0.00 0.00 33 R 7.52 4.93 0.00 1.67 1.83 0.00 3.23 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 34 I 9.51 4.77 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 1.25 1.00 0.91 0.00 0.00 35 T 8.64 5.57 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 1.21 0.00 0.00 36 T 8.51 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 1.21 0.00 0.00 37 T 8.61 3.72 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 1.21 0.00 0.00 38 V 8.44 3.33 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 1.02 0.00 0.00 0.94 0.00 0.00 39 P 0.00 4.16 0.00 2.21 2.13 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 40 K 7.90 4.03 0.00 1.89 1.91 0.00 1.63 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.67 1.52 7.81 41 A 8.54 4.39 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.27 3.95 0.00 1.87 1.89 0.00 1.68 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.46 7.81 43 E 7.96 4.26 0.00 2.21 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 1.88 2.02 0.00 44 L 7.28 3.89 0.00 1.96 1.80 0.98 0.85 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 45 R 8.26 4.10 0.00 1.93 1.76 0.00 3.17 0.00 0.00 3.17 8.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 46 G 8.95 4.08 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 0.00 0.00 0.00 47 F 7.98 3.90 0.00 2.87 2.96 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 0.00 0.00 0.00 48 V 7.78 3.88 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 0.96 0.00 0.00 1.01 0.00 0.00 49 D 8.22 4.24 0.00 2.65 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 H 7.89 4.18 0.00 3.17 3.03 0.00 5.79 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 51 L 7.60 3.80 0.00 1.65 1.59 1.08 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.50 3.47 1.57 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.20 0.54 0.00 0.00 53 H 7.58 3.95 0.00 2.81 3.19 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.51 4.06 0.00 1.62 1.62 0.71 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 55 A 6.92 3.95 -0.01 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 0.00 0.00 56 K 7.64 4.15 0.00 1.69 1.75 0.00 2.03 0.00 0.00 1.90 0.00 0.00 3.50 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.40 7.81 57 R 7.65 4.62 0.00 2.05 2.08 0.00 3.09 0.00 0.00 3.39 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 58 G 8.26 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.95 4.48 0.00 2.86 2.84 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 0.00 0.00 0.00 60 L 8.68 3.76 0.00 1.70 1.72 0.90 0.78 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 61 H 8.39 3.97 0.00 3.26 3.61 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 7.64 4.01 1.66 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 0.00 0.00 63 R 7.92 3.89 0.00 1.75 1.75 0.00 2.72 0.00 0.00 2.95 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.56 0.00 64 R 8.21 3.94 0.00 1.84 1.99 0.00 3.18 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 65 L 7.97 3.93 0.00 1.94 1.60 0.65 0.52 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 66 V 7.91 3.74 2.29 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 1.11 0.00 0.00 1.09 0.00 0.00 67 L 7.66 4.49 0.00 1.84 1.67 0.96 1.45 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 68 R 8.95 4.43 0.00 1.86 1.97 0.00 3.16 0.00 0.00 3.24 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 69 D 7.48 4.81 0.00 2.94 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 70 L 8.26 4.41 0.00 1.75 1.65 0.97 0.92 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 71 Q 8.63 3.97 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.22 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 72 D 7.94 4.54 0.00 2.77 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 8.61 3.51 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 0.95 0.00 0.00 1.00 0.00 0.00 74 K 8.10 3.95 0.00 2.00 1.82 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.52 7.81 75 L 7.76 3.90 0.00 1.53 1.93 0.96 0.93 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 76 V 7.62 3.71 2.47 0.00 0.00 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 1.08 0.00 0.00 77 R 8.44 4.04 0.00 1.91 2.01 0.00 3.22 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 1.68 1.67 0.00 78 K 8.19 3.89 0.00 1.77 2.12 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.74 7.81 79 L 7.44 4.36 0.00 1.95 1.94 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.91 3.80 0.00 3.23 3.13 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 81 D 8.45 4.59 0.00 2.73 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 82 E 8.19 4.44 0.00 1.92 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 2.21 2.30 0.00 83 I 8.31 4.04 2.04 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 1.50 0.89 1.12 0.00 0.00 84 A 8.13 4.06 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 85 P 0.00 3.96 0.00 2.16 2.01 0.00 3.61 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.19 0.00 86 R 7.80 3.66 0.00 0.67 1.69 0.00 3.05 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.68 0.00 87 Y 7.27 4.39 0.00 3.19 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 88 R 9.01 4.02 0.00 1.86 2.03 0.00 3.38 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 89 D 7.47 4.81 0.00 2.66 2.57 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 90 R 7.44 4.40 0.00 1.68 1.52 0.00 3.00 0.00 0.00 3.00 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.32 0.00 91 Q 8.93 4.40 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.33 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 92 G 9.39 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 93 G 8.89 4.20 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 0.00 94 Y 8.00 3.82 0.00 2.58 2.24 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 95 T 8.14 4.87 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 1.30 0.00 0.00 96 R 10.53 4.64 0.00 1.94 1.75 0.00 3.09 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 97 V 8.26 5.24 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 1.19 0.00 0.00 0.93 0.00 0.00 98 L 8.42 4.86 0.00 1.62 1.53 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.47 4.73 0.00 1.63 1.73 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.45 7.81 100 L 8.05 4.64 0.00 1.57 1.58 0.92 0.78 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 0.00 101 A 8.52 4.19 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 0.00 102 E 8.66 3.66 0.00 2.12 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 2.22 2.28 0.00 103 R 8.23 4.66 0.00 1.86 1.95 0.00 3.07 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 104 R 7.80 3.82 0.00 2.01 1.96 0.00 3.11 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 105 R 8.41 4.49 0.00 1.80 1.90 0.00 3.25 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 106 G 7.50 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 0.00 0.00 0.00 0.00 107 D 8.43 4.38 0.00 2.74 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 0.00 108 G 8.62 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 0.00 0.00 0.00 109 A 7.19 4.90 1.23 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 0.00 0.00 110 P 0.00 4.57 0.00 2.13 2.19 0.00 3.66 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 2.07 2.00 0.00 111 L 8.42 4.89 0.00 1.73 1.59 0.92 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 0.00 112 A 8.25 4.67 1.26 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 0.00 0.00 0.00 113 L 8.86 5.20 0.00 1.74 1.48 0.97 0.97 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 0.00 114 V 9.01 5.18 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 0.93 0.00 0.00 0.94 0.00 0.00 115 E 9.28 5.05 0.00 2.03 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 2.21 2.17 0.00 116 L 8.45 4.71 0.00 1.73 1.94 1.04 1.05 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 0.00 117 V 8.47 3.69 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 0.79 0.00 0.00 1.02 0.00 0.00 118 E 8.71 4.75 0.00 2.09 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 2.00 2.05 0.00