NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7146 8.4293 116.2137 55.1787 29.3031 173.3262 2 C 4.1221 7.8102 114.6957 56.7191 30.1687 172.7244 3 D 4.5728 8.4127 118.5070 55.0414 40.2344 175.4098 4 L 4.0814 7.5017 120.6971 57.2316 42.1537 175.8577 5 P 4.6035 0.0000 0.0000 62.2124 32.3908 175.3041 6 C 4.3278 8.4947 113.3107 57.7280 30.7237 174.9706 7 G 3.9014 8.2620 107.5669 45.4879 0.0000 172.8477 8 V 4.2605 7.1942 118.9310 60.9424 32.9204 174.3830 9 Y 4.6366 7.9899 123.3882 56.7274 42.1059 174.3642 10 D 3.6797 7.8966 117.6740 51.7328 43.7629 174.7505 11 P 4.0867 0.0000 0.0000 64.6467 31.1902 178.0341 12 A 3.9922 8.5023 120.6965 55.2702 17.6167 179.5599 13 Q 3.8352 7.9835 116.3026 59.0773 28.7351 179.0269 14 A 4.0702 7.7798 121.2177 54.9709 18.4786 179.3566 15 R 3.8380 8.1015 117.3092 59.7838 30.3108 178.6827 16 I 3.8689 8.1247 119.8588 64.6376 37.1125 178.3500 17 E 4.0154 7.9901 118.1765 59.3318 29.2971 179.2795 18 A 4.0782 8.2643 120.9019 55.0804 18.2989 179.5660 19 E 3.9713 8.5430 117.7564 59.6367 29.4111 179.7077 20 S 4.1174 7.9305 114.8797 61.3755 62.8717 176.7314 21 V 3.5708 7.7492 120.9778 66.0444 31.2626 178.0506 22 K 4.1342 8.1310 119.0046 59.4456 32.0306 178.5293 23 A 4.2890 8.2240 122.6809 54.7410 18.2277 179.7079 24 I 3.7552 8.1471 118.6092 64.6405 37.0144 178.6806 25 Q 4.0304 8.1872 118.9368 59.0464 26.9595 178.7464 26 E 4.0180 8.4391 119.6865 59.3636 29.4177 179.5975 27 K 4.3278 8.1706 118.6475 59.7027 31.9225 179.3660 28 M 4.4105 8.2849 117.9708 58.0714 31.9092 178.2834 29 A 4.1581 7.8018 119.7634 53.9669 18.5775 177.8351 30 A 4.3479 7.2738 118.2577 52.3915 20.8783 175.9459 31 N 4.5596 8.1872 115.0196 52.4212 38.7601 173.7983 32 D 4.8415 8.4471 124.5167 53.0745 40.0959 176.5165 33 D 4.4394 8.4329 120.7288 54.2944 42.4508 175.9975 34 L 3.9360 8.7251 128.8156 59.1107 42.1407 179.0312 35 H 4.1392 8.2910 115.2192 58.6247 28.6098 177.5585 36 F 4.1285 8.6574 122.6734 61.3821 39.2894 177.1493 37 Q 3.8546 8.5572 118.0750 58.9327 28.3902 179.0842 38 I 3.6260 7.8461 120.6910 64.4912 37.1340 178.6562 39 R 3.7975 7.9069 118.5297 59.2051 29.7974 179.0025 40 A 3.7037 8.0196 120.7542 55.2685 18.2555 179.8965 41 T 3.7237 7.8122 114.1568 66.6627 68.4149 177.0474 42 V 3.5471 7.8394 120.2763 66.2567 31.5534 178.2090 43 I 4.0062 7.9372 121.0983 63.5444 36.8655 178.2937 44 K 3.9094 8.3240 120.9725 59.3675 32.0360 178.3735 45 E 3.8970 8.1960 119.5939 59.4553 29.4505 178.9435 46 Q 3.9775 7.8492 117.9294 59.1168 28.7984 178.9723 47 R 4.0585 8.2142 118.9129 58.9952 30.0256 178.9472 48 A 4.0091 8.2598 120.9423 55.0287 18.3305 179.2841 49 E 3.8618 8.1607 117.7975 59.4272 29.6771 179.0892 50 L 3.9365 7.9507 118.7470 57.5894 41.6618 179.3258 51 A 4.0580 8.1086 120.7931 55.1646 18.2609 179.8402 52 K 3.9206 8.2773 117.1505 59.7688 32.1007 179.0335 53 H 4.1510 8.3861 118.5375 59.6942 29.9021 177.0398 54 H 4.2365 8.2976 118.0070 58.9165 28.4826 177.8702 55 L 4.1100 8.0243 120.8020 57.8091 41.4601 179.1784 56 D 4.5277 8.5128 119.3223 57.4400 40.7530 179.0504 57 V 3.7505 8.0388 118.7556 65.9473 31.4504 178.0933 58 L 3.9296 7.9966 118.5393 57.4765 41.2530 179.3384 59 W 4.6228 8.4797 127.4267 60.7284 30.8421 177.8184 60 S 4.0179 8.9301 113.1291 60.4804 62.8595 175.1282 61 D 4.7162 8.3636 120.9087 56.0450 41.8057 177.4000 62 Y 3.4747 7.5626 118.3279 60.1015 39.0761 175.5889 63 F 3.9534 7.9358 118.3250 57.4371 39.4999 175.4517 64 K 4.4960 8.1979 124.3083 53.9201 34.6139 175.3572 65 P 4.4563 0.0000 0.0000 65.9328 30.9849 177.1819 66 P 4.2955 0.0000 0.0000 65.7068 31.1581 178.4215 67 H 4.3062 8.0085 115.1824 59.0245 28.4215 177.9249 68 F 4.3967 7.7538 117.4950 60.1240 38.7910 177.1852 69 E 4.2261 7.8324 117.5357 59.3856 29.4770 178.9605 70 S 4.3375 8.3259 114.4476 60.1951 64.0775 174.3495 71 Y 4.5080 8.2443 122.0445 54.7767 37.0233 174.2222 72 P 4.3450 0.0000 0.0000 64.9858 31.6430 177.7540 73 E 4.5703 8.0992 116.6921 56.0774 30.3516 177.1845 74 L 3.9083 8.3361 122.7802 58.5494 42.0642 178.4258 75 H 4.4158 8.4616 115.5754 59.5557 28.6363 177.6533 76 T 3.8242 7.9716 116.7114 66.3862 68.3342 176.1695 77 L 3.8267 8.1034 122.4770 58.3056 42.1371 179.3230 78 V 3.5571 7.9431 118.1648 65.8886 31.4716 177.4222 79 N 4.0268 8.1153 116.8754 56.7194 38.7040 176.7680 80 E 3.7733 8.3452 120.0906 58.8087 29.4559 179.2068 81 A 3.7734 7.4357 120.9713 55.2985 18.5103 180.2086 82 V 3.6100 7.7790 110.8728 64.3012 31.5522 179.0490 83 K 3.9901 7.9714 118.2596 59.1497 31.8487 179.2445 84 A 4.0994 8.1130 121.4152 55.0744 18.2867 179.7139 85 L 4.0077 7.8484 117.5041 57.9974 41.5004 179.8170 86 S 4.1250 8.1026 115.0152 61.5411 62.5125 176.6302 87 A 3.9904 7.8840 122.3969 55.0231 18.4613 179.2285 88 A 4.1733 7.9870 120.7217 54.6511 18.1938 179.9337 89 K 3.9135 7.9643 116.0853 59.2687 32.2201 178.4262 90 A 4.4587 7.4227 117.8067 51.3238 19.0439 176.5992 91 S 4.7033 7.3031 111.9022 56.9929 65.6010 173.7999 92 T 4.3926 8.2998 112.5895 61.2338 69.7745 173.7712 93 D 4.5097 8.2941 124.3329 53.2868 41.4095 174.9449 94 P 4.5943 0.0000 0.0000 64.8837 31.1835 178.2924 95 A 3.9964 8.6104 120.2482 55.2458 17.7498 179.7601 96 T 3.9661 8.2092 108.6844 64.8765 68.9019 177.2489 97 G 3.6069 8.0420 108.1879 47.5264 0.0000 175.3367 98 Q 3.9772 8.3747 122.1988 58.7561 29.1751 178.1014 99 K 3.7693 8.3144 120.6417 59.4011 32.1742 178.6545 100 A 4.1912 7.9921 120.6892 55.2181 18.2769 179.5938 101 L 3.9965 7.9046 117.5562 57.9593 41.6461 179.4906 102 D 4.3127 8.3948 119.1717 57.6457 40.7725 178.4899 103 Y 4.3201 7.7389 116.6687 61.2335 37.8380 178.6553 104 I 3.7971 8.1687 120.5881 64.3454 37.2458 178.3330 105 A 4.1341 8.3459 121.8082 55.2246 18.2442 179.7776 106 Q 4.0278 7.9912 116.2326 59.2147 28.7364 178.9489 107 I 3.8151 8.0416 120.9301 64.3318 37.1158 177.9302 108 D 4.3668 8.6635 119.4512 57.1872 41.0397 178.3001 109 K 4.1449 8.1831 119.9631 59.7332 32.2988 178.9009 110 I 3.6271 7.7084 119.6436 64.0818 36.9166 177.9558 111 F 3.9829 8.6017 121.9009 61.4109 39.0843 177.4193 112 W 4.1595 8.2558 118.1989 59.5823 28.2675 178.4936 113 E 4.0859 8.4096 119.1725 59.6538 28.7229 179.4527 114 T 4.0294 7.8156 108.6629 64.4485 68.8981 176.6080 115 K 4.0371 7.5413 120.9593 58.6698 32.2155 178.4886 116 K 4.3897 8.1225 115.6424 56.2290 32.4207 176.7225 117 A 4.2018 7.5436 127.2970 52.5472 18.2861 177.4111 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 H 8.43 4.71 0.00 3.24 3.25 0.00 5.48 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 2 C 7.81 4.12 0.00 3.16 3.07 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 0.00 0.00 0.00 0.00 3 D 8.41 4.57 0.00 2.87 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 4 L 7.50 4.08 0.00 1.76 1.77 0.92 0.92 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 5 P 0.00 4.60 0.00 2.28 2.09 0.00 3.81 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 6 C 8.49 4.33 0.00 3.04 3.05 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 7 G 8.26 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 8 V 7.19 4.26 1.83 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 0.73 0.00 0.00 0.87 0.00 0.00 9 Y 7.99 4.64 0.00 2.83 2.38 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 10 D 7.90 3.68 0.00 2.56 2.37 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 11 P 0.00 4.09 0.00 2.25 1.88 0.00 2.98 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.07 0.00 12 A 8.50 3.99 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.98 3.84 0.00 1.87 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 14 A 7.78 4.07 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 15 R 8.10 3.84 0.00 1.90 2.10 0.00 3.13 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 16 I 8.12 3.87 1.87 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 1.53 1.06 0.92 0.00 0.00 17 E 7.99 4.02 0.00 2.19 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 0.00 2.58 2.55 0.00 18 A 8.26 4.08 1.43 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 0.00 0.00 19 E 8.54 3.97 0.00 2.17 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 2.34 2.60 0.00 20 S 7.93 4.12 0.00 4.10 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 21 V 7.75 3.57 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 1.00 0.00 0.00 0.99 0.00 0.00 22 K 8.13 4.13 0.00 1.89 1.80 0.00 1.70 0.00 0.00 1.66 0.00 0.00 3.15 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.61 7.81 23 A 8.22 4.29 1.41 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 0.00 0.00 24 I 8.15 3.76 2.04 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 1.55 0.80 0.92 0.00 0.00 25 Q 8.19 4.03 0.00 2.30 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 26 E 8.44 4.02 0.00 2.20 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 2.35 2.66 0.00 27 K 8.17 4.33 0.00 2.23 2.08 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.71 7.81 28 M 8.28 4.41 0.00 2.06 2.34 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.57 0.00 29 A 7.80 4.16 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 30 A 7.27 4.35 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 31 N 8.19 4.56 0.00 2.17 2.17 0.00 0.00 7.14 8.25 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 32 D 8.45 4.84 0.00 2.82 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 33 D 8.43 4.44 0.00 2.86 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 34 L 8.73 3.94 0.00 1.79 1.64 0.89 1.01 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 35 H 8.29 4.14 0.00 3.48 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.66 4.13 0.00 3.21 3.28 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 37 Q 8.56 3.85 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 38 I 7.85 3.63 1.98 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.78 0.87 0.00 0.00 39 R 7.91 3.80 0.00 1.81 1.88 0.00 3.15 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 1.62 1.84 0.00 40 A 8.02 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.81 3.72 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 1.17 0.00 0.00 42 V 7.84 3.55 2.17 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 1.00 0.00 0.00 0.97 0.00 0.00 43 I 7.94 4.01 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.06 0.89 0.00 0.00 44 K 8.32 3.91 0.00 1.82 1.98 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.20 3.90 0.00 2.29 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 2.29 2.39 0.00 46 Q 7.85 3.98 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 47 R 8.21 4.06 0.00 1.83 2.12 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 48 A 8.26 4.01 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 49 E 8.16 3.86 0.00 2.21 2.13 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 2.29 2.37 0.00 50 L 7.95 3.94 0.00 1.95 1.69 0.93 0.65 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 51 A 8.11 4.06 1.43 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 0.00 0.00 52 K 8.28 3.92 0.00 1.98 1.86 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.66 7.81 53 H 8.39 4.15 0.00 3.21 3.42 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 54 H 8.30 4.24 0.00 3.37 3.29 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.02 4.11 0.00 1.89 1.76 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.51 4.53 0.00 2.91 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 57 V 8.04 3.75 2.31 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 1.24 0.00 0.00 0.86 0.00 0.00 58 L 8.00 3.93 0.00 2.09 1.71 0.75 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.48 4.62 0.00 3.49 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 60 S 8.93 4.02 0.00 4.04 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 0.00 61 D 8.36 4.72 0.00 2.98 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 62 Y 7.56 3.47 0.00 1.43 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 0.00 0.00 0.00 0.00 63 F 7.94 3.95 0.00 2.90 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 0.00 0.00 0.00 64 K 8.20 4.50 0.00 1.45 1.57 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.17 7.81 65 P 0.00 4.46 0.00 2.15 2.16 0.00 3.56 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 2.12 2.24 0.00 66 P 0.00 4.30 0.00 2.01 2.04 0.00 3.38 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 67 H 8.01 4.31 0.00 2.98 3.06 0.00 5.64 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 68 F 7.75 4.40 0.00 3.18 3.03 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 69 E 7.83 4.23 0.00 2.16 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 2.65 2.51 0.00 70 S 8.33 4.34 0.00 3.93 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 71 Y 8.24 4.51 0.00 2.98 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 72 P 0.00 4.34 0.00 2.21 2.24 0.00 3.76 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 2.03 2.01 0.00 73 E 8.10 4.57 0.00 2.08 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 2.36 2.26 0.00 74 L 8.34 3.91 0.00 1.81 1.81 0.48 -0.41 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 75 H 8.46 4.42 0.00 3.28 3.37 0.00 5.68 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 76 T 7.97 3.82 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 1.19 0.00 0.00 77 L 8.10 3.83 0.00 1.84 1.86 1.05 1.17 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 78 V 7.94 3.56 2.05 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 0.94 0.00 0.00 1.16 0.00 0.00 79 N 8.12 4.03 0.00 2.72 2.77 0.00 0.00 7.24 7.24 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 80 E 8.35 3.77 0.00 1.44 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 2.19 2.36 0.00 81 A 7.44 3.77 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 82 V 7.78 3.61 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 0.74 0.00 0.00 0.83 0.00 0.00 83 K 7.97 3.99 0.00 1.93 1.80 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.47 7.81 84 A 8.11 4.10 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.85 4.01 0.00 1.91 1.73 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.10 4.12 0.00 4.04 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 87 A 7.88 3.99 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 88 A 7.99 4.17 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 89 K 7.96 3.91 0.00 1.98 2.01 0.00 1.69 0.00 0.00 1.94 0.00 0.00 3.22 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.63 7.81 90 A 7.42 4.46 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 91 S 7.30 4.70 0.00 3.82 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 92 T 8.30 4.39 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 1.22 0.00 0.00 93 D 8.29 4.51 0.00 2.70 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 94 P 0.00 4.59 0.00 2.20 2.11 0.00 3.94 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 2.13 1.93 0.00 95 A 8.61 4.00 1.41 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 0.00 0.00 96 T 8.21 3.97 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 1.22 0.00 0.00 97 G 8.04 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 0.00 0.00 0.00 98 Q 8.37 3.98 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 99 K 8.31 3.77 0.00 1.93 1.99 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.24 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.31 7.81 100 A 7.99 4.19 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 0.00 101 L 7.90 4.00 0.00 1.93 1.74 0.98 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.39 4.31 0.00 2.59 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.74 4.32 0.00 3.23 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 0.00 104 I 8.17 3.80 2.08 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.88 0.94 0.00 0.00 105 A 8.35 4.13 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 0.00 106 Q 7.99 4.03 0.00 2.42 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.62 0.00 107 I 8.04 3.82 2.10 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 1.47 0.96 1.08 0.00 0.00 108 D 8.66 4.37 0.00 2.84 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 0.00 109 K 8.18 4.14 0.00 2.01 2.02 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.60 7.81 110 I 7.71 3.63 1.88 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.83 -0.08 0.00 0.00 111 F 8.60 3.98 0.00 2.98 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 0.00 112 W 8.26 4.16 0.00 3.56 3.26 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 0.00 113 E 8.41 4.09 0.00 2.30 2.16 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 2.45 2.78 0.00 114 T 7.82 4.03 4.04 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 0.00 0.00 1.25 0.00 0.00 115 K 7.54 4.04 0.00 1.77 1.86 0.00 1.53 0.00 0.00 1.17 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.30 0.21 7.81 116 K 8.12 4.39 0.00 1.79 1.90 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.83 7.81 117 A 7.54 4.20 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