NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3272 8.3144 122.1421 54.7027 33.4694 174.7271 2 E 4.4545 8.2019 117.4161 53.4355 32.3295 173.8706 3 T 4.1395 8.8689 118.8557 61.2708 72.0290 174.5057 4 A 4.0128 8.6397 123.9514 55.6505 18.1740 180.0975 5 A 4.1734 7.9934 118.3629 55.2822 18.5264 179.5057 6 A 4.0622 7.8725 119.2095 54.7764 18.4890 179.7579 7 K 4.0330 8.3126 118.5777 59.3196 32.1410 178.9257 8 F 4.0610 8.1896 120.7866 61.2659 39.3894 177.0306 9 E 3.9681 8.1222 118.1923 59.4172 29.0544 179.3108 10 R 3.9080 7.9865 117.7796 59.3449 30.2300 178.0322 11 Q 4.0376 7.9149 116.2577 57.3861 29.2954 176.0993 12 H 4.5605 8.0534 114.6724 53.9444 31.7975 173.2353 13 M 4.6798 7.9571 118.3834 54.1272 33.2319 176.9809 14 D 4.8068 8.8603 122.6069 53.7843 41.8782 175.6040 15 S 4.3742 8.4385 118.8019 60.4558 63.7371 176.7081 16 S 4.0240 8.1511 115.5228 60.4224 62.7865 174.1843 17 T 4.6755 7.2061 109.5630 59.5319 71.2164 174.3456 18 S 4.2227 8.5750 117.4724 60.3460 63.7588 173.0801 19 A 4.2903 7.0228 120.9949 50.6915 21.5732 174.6772 20 A 3.4657 8.1677 121.5795 51.5551 17.6766 177.7307 21 S 4.1130 8.1406 117.2886 61.5914 63.2601 175.0242 22 S 4.7106 7.5329 113.6498 55.4051 66.0673 174.5143 23 S 4.2805 8.6227 114.0353 61.1214 63.0452 175.9275 24 N 4.5172 7.9385 118.5049 55.6500 38.0668 176.3062 25 Y 4.1118 7.7626 121.3245 61.1565 38.7193 177.8209 26 C 4.0696 8.6605 117.1029 60.2210 39.7518 175.7026 27 N 4.3798 8.3244 117.3758 56.7609 38.0200 177.3877 28 Q 3.9394 7.8753 118.7372 59.2453 28.8224 178.6099 29 M 3.7238 7.7862 119.9471 58.2248 31.8032 178.7175 30 M 3.9586 8.3873 119.2656 58.1513 32.0039 178.7973 31 K 4.3804 7.5853 119.8631 59.1774 32.2480 178.4756 32 S 4.0630 7.9275 112.3640 61.5640 62.2298 175.6270 33 R 4.3092 7.8571 117.1641 55.2412 30.1004 175.9268 34 N 4.2948 8.1593 115.3606 54.5575 36.7601 175.0668 35 L 4.4133 8.3280 117.9724 55.5349 42.6589 177.6677 36 T 5.2598 7.5566 109.2142 60.3038 69.1759 175.5349 37 K 4.3300 8.2729 123.5651 58.3169 33.4461 176.0159 38 D 4.8619 7.8337 115.6217 53.4280 42.8305 175.3179 39 R 3.2666 7.1678 114.0999 56.1777 31.2297 173.3891 40 C 4.8424 8.5508 115.9780 55.1520 39.9308 173.8558 41 K 4.1022 8.2120 126.2232 55.9167 32.2107 174.4764 42 P 4.8550 0.0000 0.0000 65.6230 32.1467 176.6370 43 V 5.1087 7.5897 115.5514 60.5529 34.4031 173.5812 44 N 4.8137 9.0426 120.2589 52.6811 42.4582 172.9319 45 T 4.8304 7.9382 120.7182 61.6379 71.8261 172.8378 46 F 4.9390 8.9571 124.1568 55.6090 42.4182 174.4606 47 V 4.5267 8.9764 123.1777 61.2184 33.3119 175.6580 48 H 6.0495 8.4424 128.7595 53.9594 26.2758 172.9576 49 E 4.7795 7.6589 118.5039 53.6647 34.6024 176.1193 50 S 4.5452 8.2834 114.2166 57.8988 65.5263 174.7826 51 L 4.0299 8.4950 123.9858 58.3107 41.8265 179.2146 52 A 4.0326 7.9756 120.4133 55.1284 18.1733 179.1249 53 D 4.3190 7.6803 116.6351 57.6421 41.2367 178.9622 54 V 3.8019 7.8455 118.5437 65.9721 31.5425 178.1546 55 Q 3.9170 8.2758 117.8038 58.6814 28.5532 178.2859 56 A 4.0698 8.0749 121.4857 54.5396 18.2984 179.5424 57 V 3.6113 7.7631 116.7515 65.5639 31.3541 176.7684 58 C 3.9779 8.0100 114.8918 57.9666 40.0669 174.4960 59 S 4.4323 7.5368 114.4773 58.1187 63.7475 174.5240 60 Q 4.6726 8.2042 129.2716 56.0191 26.7435 178.0607 61 K 4.2424 8.3145 132.4263 56.7612 32.8571 174.8777 62 N 4.5218 8.8255 127.6130 53.5325 39.5545 174.3361 63 V 4.5910 8.5547 118.6397 59.0042 36.6309 174.9553 64 A 4.1058 8.3698 125.2007 52.2089 19.0239 178.6688 65 C 4.6973 8.7694 120.3930 56.1038 41.0749 175.1266 66 K 3.7151 8.9174 121.7319 59.3323 31.6553 177.8913 67 N 4.5938 8.1210 113.5573 52.6002 37.7716 175.4058 68 G 3.9916 8.3516 108.7713 45.7475 0.0000 174.3651 69 Q 4.1950 8.6369 119.0430 56.3378 29.1672 176.6829 70 T 4.5272 8.1772 108.1415 61.6095 69.5829 174.0640 71 N 4.8323 7.8556 120.3033 54.2217 37.9305 175.0558 72 C 5.3621 7.4671 115.4029 56.6178 41.0389 173.2300 73 Y 4.9684 8.5810 118.4473 56.3970 42.1655 173.9537 74 Q 5.0538 9.6378 125.3127 54.1581 31.5923 174.7128 75 S 4.5293 8.3984 121.2927 58.3125 63.2733 174.1918 76 Y 4.3658 8.8469 122.0980 60.5400 37.9339 176.7542 77 S 4.8837 7.8451 113.9724 56.8397 65.1861 173.4889 78 T 4.2040 8.0441 112.1553 61.7326 69.9282 173.6243 79 M 4.9935 8.9225 122.3840 53.3715 36.8750 174.4710 80 S 4.9136 9.0554 116.0098 58.0324 63.6257 173.0332 81 I 5.1215 9.0970 120.5595 59.4286 41.5012 174.2328 82 T 5.0312 8.8721 120.3811 61.9711 71.3307 172.4809 83 D 4.9632 10.2426 127.1379 53.0928 43.3684 174.2501 84 C 5.5894 9.1708 123.5523 55.3970 43.5617 173.0214 85 R 5.2973 8.5608 123.0509 53.8518 33.0027 175.0470 86 E 4.0423 9.2291 126.4350 56.6986 30.1879 177.1481 87 T 4.1962 8.3465 118.3426 61.1337 70.4407 174.5069 88 G 3.7028 8.7086 109.2092 48.7465 0.0000 175.8600 89 S 4.2509 7.8889 112.1878 59.1605 63.2054 173.9848 90 S 4.1582 7.4172 115.9491 58.4317 62.2899 173.4330 91 K 4.5212 8.7293 127.3203 54.3845 34.9931 175.5386 92 Y 4.4337 8.6607 125.6374 57.1281 39.2178 173.9170 93 P 3.3253 0.0000 0.0000 63.2898 31.9722 177.0087 94 N 4.6843 8.2555 119.9178 52.1196 37.0738 173.1865 95 C 4.6133 7.9984 117.2875 56.5699 38.9318 173.1864 96 A 5.0273 8.6126 124.8500 50.4062 21.9714 174.6389 97 Y 5.1607 9.4399 117.9775 56.1348 42.4591 174.6839 98 K 4.5805 8.9984 123.6338 55.2399 34.1605 175.3612 99 T 4.7273 8.6072 124.5398 63.5589 69.0860 174.5262 100 T 4.5282 9.2169 122.6339 62.0441 72.2065 173.0054 101 Q 4.2384 8.7321 127.7601 55.7413 30.6327 174.1561 102 A 4.4645 8.3746 124.7626 51.6903 23.7738 174.9008 103 N 5.8316 8.6531 115.1361 50.8172 41.3989 174.2370 104 K 4.7225 8.2780 122.0352 54.8509 37.7843 175.1462 105 H 4.8420 9.3651 118.8919 55.7383 29.9852 175.1968 106 I 4.8326 8.2931 115.1620 59.3148 40.8168 174.3791 107 I 4.8957 7.9836 124.0811 59.6630 40.2218 175.0797 108 V 4.6779 8.3793 119.3219 59.2828 35.8917 174.5375 109 A 5.0159 8.7547 125.4802 51.3440 20.3902 175.8358 110 C 5.2095 8.7509 118.8353 55.2598 38.5682 173.2061 111 E 4.6237 8.4878 117.7551 56.3279 32.7671 174.5680 112 G 3.9916 9.5074 106.2252 44.7661 0.0000 172.0498 113 N 4.7652 8.1745 115.9623 50.6291 40.1488 172.0558 114 P 4.3698 0.0000 0.0000 62.5075 32.0470 176.0368 115 Y 4.6871 8.3151 120.8552 57.2893 38.5307 174.7408 116 V 4.4652 7.9580 119.5998 58.3451 36.0329 173.5919 117 P 4.4374 0.0000 0.0000 62.7663 31.2345 176.8307 118 V 4.4683 8.2487 115.0303 61.2456 34.0624 175.3561 119 H 5.0921 7.7519 119.8464 54.8440 33.3908 171.6806 120 F 4.5735 9.0080 128.1757 57.8489 39.5933 174.1514 121 D 4.5857 8.2892 125.8894 55.6834 42.5712 175.4210 122 A 4.6434 6.7900 117.3359 52.1283 22.7304 174.7580 123 S 4.9992 8.6370 110.9292 57.6367 66.3278 174.9031 124 V 4.1521 8.7379 114.3318 61.8364 32.7485 175.0558 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 K 8.31 4.33 0.00 1.79 1.69 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.01 7.81 2 E 8.20 4.45 0.00 1.96 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.38 0.00 3 T 8.87 4.14 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 1.23 0.00 0.00 4 A 8.64 4.01 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 5 A 7.99 4.17 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 6 A 7.87 4.06 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 7 K 8.31 4.03 0.00 1.99 2.12 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.45 7.81 8 F 8.19 4.06 0.00 3.22 3.33 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 9 E 8.12 3.97 0.00 2.09 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 2.56 2.77 0.00 10 R 7.99 3.91 0.00 1.81 2.12 0.00 3.36 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 7.91 4.04 0.00 1.53 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.23 2.54 0.00 12 H 8.05 4.56 0.00 2.02 2.72 0.00 5.61 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 13 M 7.96 4.68 0.00 1.98 2.18 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.68 0.00 14 D 8.86 4.81 0.00 2.74 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 15 S 8.44 4.37 0.00 3.96 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 16 S 8.15 4.02 0.00 3.86 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 17 T 7.21 4.68 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 1.19 0.00 0.00 18 S 8.57 4.22 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.02 4.29 1.16 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 20 A 8.17 3.47 1.11 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 21 S 8.14 4.11 0.00 3.97 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.53 4.71 0.00 3.97 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 23 S 8.62 4.28 0.00 4.03 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 24 N 7.94 4.52 0.00 2.93 3.21 0.00 0.00 6.41 7.36 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 25 Y 7.76 4.11 0.00 3.09 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 26 C 8.66 4.07 0.00 3.11 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 27 N 8.32 4.38 0.00 2.76 2.94 0.00 0.00 7.03 7.63 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 28 Q 7.88 3.94 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 29 M 7.79 3.72 0.00 0.90 1.17 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.80 0.00 30 M 8.39 3.96 0.00 1.67 1.91 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 2.36 0.00 31 K 7.59 4.38 0.00 1.98 1.77 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.31 7.81 32 S 7.93 4.06 0.00 3.98 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.86 4.31 0.00 1.96 2.08 0.00 3.70 0.00 0.00 3.21 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.07 0.00 34 N 8.16 4.29 0.00 2.85 2.91 0.00 0.00 6.89 7.61 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 35 L 8.33 4.41 0.00 1.76 1.63 0.77 0.39 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 36 T 7.56 5.26 4.39 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 1.44 0.00 0.00 37 K 8.27 4.33 0.00 1.77 1.90 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.49 7.81 38 D 7.83 4.86 0.00 2.65 2.62 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 39 R 7.17 3.27 0.00 1.77 1.76 0.00 2.86 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.40 0.00 40 C 8.55 4.84 0.00 3.07 3.16 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 41 K 8.21 4.10 0.00 1.80 1.77 0.00 1.77 0.00 0.00 1.60 0.00 0.00 3.23 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.61 1.42 7.81 42 P 0.00 4.85 0.00 2.14 2.14 0.00 3.67 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 2.14 2.13 0.00 43 V 7.59 5.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 1.00 0.00 0.00 44 N 9.04 4.81 0.00 2.60 2.31 0.00 0.00 6.98 6.70 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 45 T 7.94 4.83 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 0.84 0.00 0.00 46 F 8.96 4.94 0.00 3.00 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 47 V 8.98 4.53 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 1.07 0.00 0.00 1.09 0.00 0.00 48 H 8.44 6.05 0.00 3.09 3.46 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.66 4.78 0.00 1.95 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 2.26 2.27 0.00 50 S 8.28 4.55 0.00 4.07 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 51 L 8.50 4.03 0.00 1.83 1.75 1.02 1.04 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 52 A 7.98 4.03 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 53 D 7.68 4.32 0.00 2.82 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 54 V 7.85 3.80 2.20 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 1.23 0.00 0.00 1.09 0.00 0.00 55 Q 8.28 3.92 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 56 A 8.07 4.07 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 57 V 7.76 3.61 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.01 0.00 0.00 58 C 8.01 3.98 0.00 2.91 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.54 4.43 0.00 3.99 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 60 Q 8.20 4.67 0.00 1.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.97 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 61 K 8.31 4.24 0.00 1.65 1.64 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.76 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.45 7.81 62 N 8.83 4.52 0.00 2.82 2.69 0.00 0.00 7.01 7.71 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 63 V 8.55 4.59 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 0.71 0.00 0.00 0.79 0.00 0.00 64 A 8.37 4.11 1.19 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 0.00 0.00 0.00 0.00 0.00 65 C 8.77 4.70 0.00 3.22 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 66 K 8.92 3.72 0.00 1.76 1.90 0.00 1.90 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.51 7.81 67 N 8.12 4.59 0.00 2.81 2.90 0.00 0.00 6.28 7.00 0.00 0.00 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 8.35 3.99 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 0.00 0.00 0.00 69 Q 8.64 4.19 0.00 2.32 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.65 0.00 0.00 0.00 0.00 0.00 2.37 2.28 0.00 70 T 8.18 4.53 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 1.17 0.00 0.00 71 N 7.86 4.83 0.00 3.13 3.19 0.00 0.00 6.05 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 72 C 7.47 5.36 0.00 3.03 2.83 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 73 Y 8.58 4.97 0.00 2.88 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 74 Q 9.64 5.05 0.00 1.83 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.01 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 75 S 8.40 4.53 0.00 3.92 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.85 4.37 0.00 3.11 3.10 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 77 S 7.85 4.88 0.00 3.91 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 78 T 8.04 4.20 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 1.02 0.00 0.00 79 M 8.92 4.99 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 80 S 9.06 4.91 0.00 3.95 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 81 I 9.10 5.12 1.89 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.81 1.00 0.00 0.00 82 T 8.87 5.03 4.43 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 1.34 0.00 0.00 83 D 10.24 4.96 0.00 2.75 2.61 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 84 C 9.17 5.59 0.00 2.88 2.80 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 85 R 8.56 5.30 0.00 1.76 1.85 0.00 3.17 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 86 E 9.23 4.04 0.00 1.75 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.96 0.00 87 T 8.35 4.20 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 1.20 0.00 0.00 88 G 8.71 3.70 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 0.00 0.00 0.00 89 S 7.89 4.25 0.00 3.97 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 90 S 7.42 4.16 0.00 3.84 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 91 K 8.73 4.52 0.00 1.77 1.66 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.49 7.81 92 Y 8.66 4.43 0.00 2.85 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 3.33 0.00 1.81 1.40 0.00 3.70 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.79 0.00 94 N 8.26 4.68 0.00 2.86 2.76 0.00 0.00 7.00 7.61 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 95 C 8.00 4.61 0.00 3.08 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 96 A 8.61 5.03 1.08 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 97 Y 9.44 5.16 0.00 2.77 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 98 K 9.00 4.58 0.00 1.86 1.73 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 99 T 8.61 4.73 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 1.32 0.00 0.00 100 T 9.22 4.53 4.38 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 1.24 0.00 0.00 101 Q 8.73 4.24 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 102 A 8.37 4.46 1.24 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 0.00 103 N 8.65 5.83 0.00 2.57 2.73 0.00 0.00 7.04 7.61 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 0.00 104 K 8.28 4.72 0.00 1.70 1.82 0.00 1.70 0.00 0.00 1.88 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.49 7.81 105 H 9.37 4.84 0.00 3.19 3.20 0.00 5.58 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.29 4.83 1.69 0.00 0.00 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 1.23 0.71 1.10 0.00 0.00 107 I 7.98 4.90 1.73 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.67 0.76 0.00 0.00 108 V 8.38 4.68 1.81 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 0.67 0.00 0.00 0.79 0.00 0.00 109 A 8.75 5.02 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 0.00 110 C 8.75 5.21 0.00 1.99 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 0.00 0.00 0.00 111 E 8.49 4.62 0.00 2.04 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 2.09 2.17 0.00 112 G 9.51 3.99 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 0.00 0.00 0.00 113 N 8.17 4.77 0.00 2.64 2.72 0.00 0.00 6.93 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 0.00 114 P 0.00 4.37 0.00 2.23 2.06 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.32 4.69 0.00 2.82 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 0.00 116 V 7.96 4.47 1.97 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 0.66 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.44 0.00 0.49 1.23 0.00 3.36 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 118 V 8.25 4.47 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 0.56 0.00 0.00 0.95 0.00 0.00 119 H 7.75 5.09 0.00 3.27 3.10 0.00 5.85 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 0.00 120 F 9.01 4.57 0.00 2.79 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 0.00 121 D 8.29 4.59 0.00 2.45 2.48 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 0.00 122 A 6.79 4.64 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 0.00 123 S 8.64 5.00 0.00 4.02 4.07 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 0.00 124 V 8.74 4.15 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 0.64 0.00 0.00 0.93 0.00 0.00