NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4227 8.3049 120.3232 54.1833 33.2009 177.7797 3 L 3.8514 8.7435 127.5607 54.9031 42.0657 176.5852 4 T 4.1971 8.8441 115.9079 61.3037 72.2589 174.6171 5 A 3.9939 8.3962 121.0932 55.7284 18.5286 178.6538 6 E 3.8019 8.3008 116.9251 60.2008 29.4908 178.7214 7 E 3.9312 8.5641 117.9831 59.2607 29.6752 179.5380 8 K 3.8173 7.8271 118.9504 59.4683 32.2310 178.8028 9 A 4.0069 8.2396 121.1216 54.8380 18.2788 179.3932 10 A 3.9409 8.0223 119.3257 55.3383 18.4327 179.9862 11 V 3.5064 7.6371 116.5000 66.5153 31.3797 178.1690 12 T 3.9659 7.7672 113.6981 66.7359 68.7338 176.0715 13 A 4.2240 8.5289 122.9095 55.2627 18.4127 179.5191 14 F 4.1371 8.4967 119.2653 61.1094 39.4271 176.9292 15 W 4.5533 9.1363 128.6334 60.6933 30.2330 178.0174 16 G 3.6613 7.7166 103.5619 47.1063 0.0000 174.8837 17 K 4.1695 7.6580 119.2032 56.2578 32.6451 177.1422 18 V 3.5520 6.6936 120.3053 62.2727 31.8452 176.4492 19 K 4.2213 8.1802 127.0811 54.8574 32.0496 177.2844 20 V 3.5457 8.0717 119.2345 64.3987 31.4753 177.6199 21 D 4.3400 8.0415 118.1588 57.0469 39.0513 177.7343 22 E 3.8099 9.3581 122.5780 58.8291 29.5404 179.0675 23 V 3.6441 8.3791 118.1106 65.7604 31.7449 178.6071 24 G 3.7490 8.2984 105.6836 47.9329 0.0000 175.9998 25 G 3.6399 7.9149 108.3724 47.1035 0.0000 175.5440 26 E 3.8758 8.0411 121.0356 59.0315 29.7266 178.6972 27 A 3.9431 8.2702 121.2300 55.1583 18.4593 179.4082 28 L 3.9701 7.9731 118.9562 58.1128 42.2852 179.3852 29 G 3.5448 8.1007 105.6990 47.9931 0.0000 175.9923 30 R 3.9242 8.2489 120.9945 58.4872 29.9963 178.9014 31 L 4.0160 7.9205 120.3912 58.2991 42.0050 179.1601 32 L 4.0203 7.5886 119.7298 56.8124 41.2118 179.7979 33 V 3.4913 7.2735 117.3583 66.0286 31.6769 178.0872 34 V 3.5228 7.9296 116.7916 64.2649 32.6507 175.4576 35 Y 3.9811 7.1479 116.2771 54.0173 38.0679 173.9677 36 P 4.5908 0.0000 0.0000 64.1047 31.5962 177.6740 37 W 4.4131 7.9874 115.4943 59.3877 27.6492 177.8565 38 T 4.4629 7.4137 110.2184 64.0126 68.2289 176.3599 39 Q 4.2811 8.2017 121.5500 58.7667 28.4368 178.1884 40 R 3.8989 7.7101 119.3672 59.0459 30.0712 177.8026 41 F 4.3491 7.9256 115.8830 58.1592 39.2575 176.1456 42 F 4.4618 7.7597 117.4434 56.8251 39.3716 177.0737 43 E 4.0253 8.4255 123.8951 59.5885 29.4093 179.6711 44 S 4.2707 8.1957 112.1421 61.3277 63.0359 175.1839 45 F 4.4851 8.5966 118.0670 58.3838 39.6775 175.9860 46 G 4.0136 7.6451 106.3628 44.2936 0.0000 174.9204 47 D 4.5084 8.5838 126.1678 54.2789 41.1099 175.5805 48 L 4.8960 8.3526 125.1604 54.3725 43.6079 177.7784 49 S 4.2685 8.5566 117.0194 60.7052 63.1047 174.7686 50 T 4.7011 7.4918 109.2942 58.5024 73.0022 174.2775 51 A 3.9413 8.4949 122.8849 55.7211 18.3921 179.7832 52 D 4.2487 8.0398 116.3642 57.3719 40.7589 178.5934 53 A 3.9988 7.7661 120.1806 55.1169 18.5272 179.6417 54 V 3.6698 8.0579 116.8806 66.6168 31.5188 178.3387 55 M 4.1293 8.0638 116.6173 57.4792 31.8371 177.4283 56 N 4.8364 7.6579 113.8935 51.9129 39.7387 175.1527 57 N 4.3704 7.3931 120.8138 53.2427 39.9689 173.5048 58 P 4.2361 0.0000 0.0000 65.6036 31.5203 178.8990 59 K 3.7757 8.5010 117.7382 59.1299 31.7588 179.6772 60 V 3.7924 7.9598 118.1329 66.0453 31.5006 178.0206 61 K 3.9338 8.3657 118.2946 59.3874 31.7360 179.2489 62 A 3.9696 8.2832 121.1632 55.5053 18.3728 179.1468 63 H 4.2790 8.6920 117.2611 59.3936 29.9485 177.5119 64 G 3.7578 8.4787 107.7520 47.7510 0.0000 175.4876 65 K 3.9916 7.8477 121.6711 59.2419 32.2327 179.0354 66 K 3.9904 7.7961 118.7864 59.3925 31.9654 179.3767 67 V 3.7053 7.9735 118.4083 66.3266 31.5471 178.2149 68 L 4.4777 8.1659 118.4756 57.8276 41.4503 179.3023 69 D 4.5924 8.3903 119.5759 57.3926 40.8984 178.8768 70 S 4.2142 8.2560 114.8663 61.3389 62.9941 176.6731 71 F 3.9582 8.4276 121.5310 60.4613 38.4816 177.5923 72 S 4.3357 8.6461 114.1075 61.7396 62.9527 176.1286 73 N 4.5256 8.2724 119.4790 56.8274 38.7219 177.0454 74 G 3.8258 7.9245 106.5900 48.2744 0.0000 175.2686 75 M 3.9361 7.6743 119.8585 58.1672 31.9643 178.5764 76 K 4.1349 8.1739 117.8699 57.9152 33.4820 176.8250 77 H 5.0104 8.0543 115.8820 54.7534 29.0342 174.7843 78 L 4.1312 7.8124 118.1617 56.8267 42.1771 178.3852 79 D 4.6998 7.9299 116.8666 54.8553 42.4430 176.1773 80 D 4.8072 7.6687 118.2698 51.6909 41.2388 175.4950 81 L 4.1782 7.9657 123.4694 57.2734 41.9973 178.5166 82 K 3.9510 8.2495 117.4285 60.0189 32.1969 178.8771 83 G 3.6705 7.8521 105.6523 47.9113 0.0000 175.7649 84 T 3.6436 7.5461 117.1265 65.7583 68.6171 175.6116 85 F 4.5666 8.2945 117.1962 56.8432 39.2853 177.2063 86 A 3.9722 7.5341 122.7503 55.5648 18.2702 180.0700 87 A 3.9438 7.8596 118.2638 55.2602 18.4159 179.7319 88 L 4.0175 7.8261 117.1032 57.9409 41.8422 179.3302 89 S 4.1695 8.8217 115.0897 60.6788 62.2720 175.9641 90 E 3.8814 7.9283 121.7769 58.8261 29.3749 178.5288 91 L 3.8811 7.6902 119.9504 58.4637 42.1733 178.6695 92 H 4.1855 8.4449 116.3352 59.3654 28.8599 177.4277 93 C 4.8486 7.9939 119.8380 62.1513 27.8454 175.9113 94 D 4.2321 7.7221 119.4201 57.0185 40.7007 178.2643 95 K 4.2279 7.5766 116.7247 58.6352 32.9047 178.7001 96 L 4.2570 8.2006 117.9302 55.2458 42.1921 176.6126 97 H 4.7538 8.2281 112.9231 56.6264 25.6698 175.1799 98 V 3.7542 8.2292 119.4131 62.2272 32.2746 175.0081 99 D 4.2014 8.5546 126.8367 53.4320 41.7260 175.1668 100 P 3.3241 0.0000 0.0000 65.0966 31.8390 178.1370 101 E 3.8962 8.1171 118.6375 59.1526 29.2588 178.5476 102 N 4.3613 7.9247 116.7459 56.0635 38.6233 177.2336 103 F 4.4706 7.4445 119.4021 60.6330 38.9870 177.8811 104 K 4.0968 8.0395 117.6033 59.3196 31.9889 179.1889 105 L 3.8626 7.8096 119.3167 57.7413 41.5050 179.3470 106 L 4.1320 8.3186 120.5164 58.0787 42.0980 179.1237 107 G 3.7846 8.1232 105.2526 48.1320 0.0000 175.4371 108 N 4.4723 8.3252 119.0307 55.9174 38.4853 177.7715 109 V 3.6565 7.9699 119.8275 65.7690 31.5586 177.7546 110 L 3.8507 8.0676 120.1883 58.2083 41.8850 179.1836 111 V 3.5138 7.6463 117.6191 65.9256 31.4874 178.1246 112 V 3.5801 7.8624 118.0323 66.0213 31.3951 178.2285 113 V 3.5461 7.9572 118.1152 65.7990 31.3619 178.0211 114 L 3.8797 8.0822 118.9524 57.6248 41.3763 179.2041 115 A 3.9487 7.5266 120.6306 55.2730 18.0919 179.6777 116 R 3.8236 7.7626 115.8882 59.5977 30.2200 178.0928 117 N 4.3105 7.9424 115.0621 54.8173 39.0071 176.4111 118 F 4.6370 8.4166 117.1896 55.7515 40.6772 177.1420 119 G 3.8392 8.8134 108.9677 45.8480 0.0000 177.3288 120 K 3.9557 9.0119 122.5539 59.5062 32.2039 177.9767 121 E 4.1967 8.3570 118.7182 58.8654 29.7779 177.4655 122 F 4.4022 8.2260 123.3114 56.7391 37.9383 175.6143 123 T 4.0587 7.2852 115.2695 60.2831 71.1665 173.3630 124 P 4.0894 0.0000 0.0000 65.9831 31.3864 179.1281 125 V 3.4964 7.5690 116.2362 65.8538 31.5163 177.6180 126 L 3.7935 7.5945 120.1191 57.9908 41.7568 178.6884 127 Q 3.5260 8.1001 119.5701 58.9056 28.8262 178.0502 128 A 3.9744 7.9741 121.7608 55.2498 18.3483 179.2886 129 D 4.1956 8.0174 117.2181 57.7188 40.8931 179.1936 130 F 3.9831 8.2054 118.0780 60.5611 38.8464 177.8041 131 Q 4.1112 8.5666 118.2815 58.7619 28.4322 178.8694 132 K 3.9685 7.8010 119.5479 59.2717 32.0020 179.4843 133 V 3.5314 7.5336 118.0464 66.2857 31.5214 178.5839 134 V 3.8763 8.1937 111.9502 64.2544 31.3447 178.4548 135 A 4.1040 8.1848 120.8843 55.1513 18.2665 179.9572 136 G 3.5016 8.1473 104.2684 47.7693 0.0000 176.1363 137 V 2.9592 8.0683 120.9141 65.4186 31.6325 177.8530 138 A 3.9293 8.4442 120.7521 55.2597 18.1184 179.2911 139 N 4.3799 8.2503 114.5736 56.6479 38.4838 177.5773 140 A 4.1220 7.7292 120.4328 54.9777 18.4671 179.2095 141 L 3.9037 7.5493 116.8074 56.8689 41.6972 178.2334 142 A 4.9680 7.6969 118.2898 52.5631 18.6676 178.2916 143 H 4.0853 7.8351 117.7362 59.4399 30.0161 177.1227 144 R 4.0721 7.7434 114.6587 57.6156 29.3206 175.7507 145 Y 4.6939 7.0024 113.9170 58.9774 41.0539 175.6778 146 H 4.4467 7.8998 124.2487 55.2319 27.6911 174.7912 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 M 8.30 4.42 0.00 1.99 1.40 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 3 L 8.74 3.85 0.00 1.65 1.58 0.78 0.44 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 4 T 8.84 4.20 4.22 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 1.19 0.00 0.00 5 A 8.40 3.99 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 6 E 8.30 3.80 0.00 2.03 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 0.00 2.36 2.41 0.00 7 E 8.56 3.93 0.00 2.09 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 2.39 2.29 0.00 8 K 7.83 3.82 0.00 2.08 1.82 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.41 7.81 9 A 8.24 4.01 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 10 A 8.02 3.94 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 11 V 7.64 3.51 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.33 0.00 0.00 12 T 7.77 3.97 4.54 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 1.27 0.00 0.00 13 A 8.53 4.22 1.48 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 0.00 0.00 14 F 8.50 4.14 0.00 3.24 3.54 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 15 W 9.14 4.55 0.00 3.84 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 16 G 7.72 3.66 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 0.00 17 K 7.66 4.17 0.00 1.15 1.84 0.00 1.54 0.00 0.00 1.10 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.30 7.81 18 V 6.69 3.55 0.94 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 0.13 0.00 0.00 0.18 0.00 0.00 19 K 8.18 4.22 0.00 1.90 1.86 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.48 7.81 20 V 8.07 3.55 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 0.92 0.00 0.00 0.92 0.00 0.00 21 D 8.04 4.34 0.00 2.92 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 22 E 9.36 3.81 0.00 1.84 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 0.00 2.22 2.26 0.00 23 V 8.38 3.64 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 0.95 0.00 0.00 0.86 0.00 0.00 24 G 8.30 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 0.00 0.00 0.00 25 G 7.91 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.04 3.88 0.00 2.09 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 2.26 2.28 0.00 27 A 8.27 3.94 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 28 L 7.97 3.97 0.00 1.94 1.64 0.92 0.80 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 29 G 8.10 3.54 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 0.00 0.00 0.00 30 R 8.25 3.92 0.00 1.88 1.94 0.00 3.10 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.68 0.00 31 L 7.92 4.02 0.00 1.82 1.80 0.99 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.59 4.02 0.00 1.74 1.60 0.57 0.75 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 33 V 7.27 3.49 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 0.70 0.00 0.00 0.91 0.00 0.00 34 V 7.93 3.52 1.48 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 -0.03 0.00 0.00 0.73 0.00 0.00 35 Y 7.15 3.98 0.00 2.56 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 36 P 0.00 4.59 0.00 2.20 2.08 0.00 3.81 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 37 W 7.99 4.41 0.00 3.63 3.58 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 38 T 7.41 4.46 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 1.02 0.00 0.00 39 Q 8.20 4.28 0.00 2.31 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 40 R 7.71 3.90 0.00 1.69 1.85 0.00 3.09 0.00 0.00 2.69 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.52 0.00 41 F 7.93 4.35 0.00 2.46 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 4.46 0.00 2.84 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 0.00 0.00 0.00 43 E 8.43 4.03 0.00 2.05 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 0.00 2.41 2.47 0.00 44 S 8.20 4.27 0.00 4.26 4.14 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 45 F 8.60 4.49 0.00 3.20 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 46 G 7.65 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 0.00 0.00 0.00 47 D 8.58 4.51 0.00 2.66 2.63 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 48 L 8.35 4.90 0.00 1.64 1.59 1.02 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.56 4.27 0.00 4.00 4.10 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 50 T 7.49 4.70 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 1.21 0.00 0.00 51 A 8.49 3.94 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 52 D 8.04 4.25 0.00 2.69 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 53 A 7.77 4.00 1.48 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 0.00 0.00 54 V 8.06 3.67 2.19 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 1.01 0.00 0.00 0.98 0.00 0.00 55 M 8.06 4.13 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.97 0.00 56 N 7.66 4.84 0.00 2.85 2.83 0.00 0.00 6.93 7.32 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 57 N 7.39 4.37 0.00 2.94 2.86 0.00 0.00 7.11 8.36 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 58 P 0.00 4.24 0.00 2.17 2.06 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.16 0.00 59 K 8.50 3.78 0.00 1.76 0.86 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.68 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.13 1.29 7.81 60 V 7.96 3.79 2.36 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 1.13 0.00 0.00 1.08 0.00 0.00 61 K 8.37 3.93 0.00 2.01 1.85 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.51 7.81 62 A 8.28 3.97 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 63 H 8.69 4.28 0.00 3.73 3.68 0.00 5.80 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 64 G 8.48 3.76 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 0.00 0.00 0.00 65 K 7.85 3.99 0.00 2.00 1.96 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.64 7.81 66 K 7.80 3.99 0.00 1.90 1.86 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.59 7.81 67 V 7.97 3.71 2.39 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 1.30 0.00 0.00 1.14 0.00 0.00 68 L 8.17 4.48 0.00 2.01 1.90 1.26 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.39 4.59 0.00 2.99 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 70 S 8.26 4.21 0.00 4.12 4.34 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 71 F 8.43 3.96 0.00 3.41 3.19 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 72 S 8.65 4.34 0.00 4.24 4.15 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 0.00 0.00 0.00 0.00 73 N 8.27 4.53 0.00 2.85 2.84 0.00 0.00 7.12 7.88 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 74 G 7.92 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 0.00 0.00 0.00 75 M 7.67 3.94 0.00 1.85 2.18 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 1.62 2.59 0.00 76 K 8.17 4.13 0.00 1.59 1.66 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.72 7.81 77 H 8.05 5.01 0.00 3.06 3.14 0.00 5.62 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.81 4.13 0.00 1.60 1.69 0.86 1.04 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 79 D 7.93 4.70 0.00 2.65 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 80 D 7.67 4.81 0.00 2.65 2.46 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 0.00 81 L 7.97 4.18 0.00 1.78 1.82 0.87 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.25 3.95 0.00 1.90 1.90 0.00 1.78 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.59 7.81 83 G 7.85 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.55 3.64 4.10 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 0.56 0.00 0.00 85 F 8.29 4.57 0.00 3.08 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 86 A 7.53 3.97 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 87 A 7.86 3.94 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 88 L 7.83 4.02 0.00 1.99 1.81 1.05 0.90 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 89 S 8.82 4.17 0.00 3.94 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 90 E 7.93 3.88 0.00 2.25 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 2.28 2.41 0.00 91 L 7.69 3.88 0.00 1.82 1.77 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.44 4.19 0.00 3.29 3.73 0.00 5.86 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 93 C 7.99 4.85 0.00 2.71 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 0.00 0.00 0.00 0.00 94 D 7.72 4.23 0.00 2.82 2.67 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 0.00 0.00 0.00 0.00 95 K 7.58 4.23 0.00 1.92 1.84 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.48 7.81 96 L 8.20 4.26 0.00 1.85 1.85 0.80 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.23 4.75 0.00 3.48 3.57 0.00 5.75 0.00 0.00 0.00 0.00 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 8.23 3.75 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 0.24 0.00 0.00 0.59 0.00 0.00 99 D 8.55 4.20 0.00 2.65 2.41 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 0.00 100 P 0.00 3.32 0.00 2.11 2.21 0.00 3.23 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.46 0.00 101 E 8.12 3.90 0.00 2.02 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 0.00 2.25 2.36 0.00 102 N 7.92 4.36 0.00 2.65 2.79 0.00 0.00 6.91 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 0.00 103 F 7.44 4.47 0.00 3.06 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 0.00 104 K 8.04 4.10 0.00 2.02 1.87 0.00 1.68 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.59 7.81 105 L 7.81 3.86 0.00 1.64 1.19 0.75 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.32 4.13 0.00 1.84 1.80 0.99 1.41 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 0.00 107 G 8.12 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 0.00 108 N 8.33 4.47 0.00 2.99 2.94 0.00 0.00 6.69 7.54 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 0.00 109 V 7.97 3.66 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 1.14 0.00 0.00 1.15 0.00 0.00 110 L 8.07 3.85 0.00 1.87 1.72 0.22 0.71 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 0.00 111 V 7.65 3.51 2.30 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 1.18 0.00 0.00 1.13 0.00 0.00 112 V 7.86 3.58 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 0.93 0.00 0.00 1.01 0.00 0.00 113 V 7.96 3.55 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 0.91 0.00 0.00 0.98 0.00 0.00 114 L 8.08 3.88 0.00 0.96 0.78 0.54 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.53 3.95 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 0.00 116 R 7.76 3.82 0.00 1.91 2.01 0.00 3.22 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 117 N 7.94 4.31 0.00 2.68 2.25 0.00 0.00 6.92 7.46 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 0.00 118 F 8.42 4.64 0.00 3.42 3.38 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 0.00 119 G 8.81 3.84 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 0.00 0.00 0.00 120 K 9.01 3.96 0.00 1.93 2.03 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.56 7.81 121 E 8.36 4.20 0.00 2.61 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.41 0.00 122 F 8.23 4.40 0.00 3.04 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 0.00 123 T 7.29 4.06 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 1.27 0.00 0.00 124 P 0.00 4.09 0.00 2.12 2.12 0.00 3.54 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 125 V 7.57 3.50 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 0.98 0.00 0.00 0.88 0.00 0.00 126 L 7.59 3.79 0.00 1.55 1.24 0.91 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 8.10 3.53 0.00 1.58 2.05 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 2.40 2.58 0.00 128 A 7.97 3.97 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 0.00 129 D 8.02 4.20 0.00 2.75 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.21 3.98 0.00 3.24 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 0.00 131 Q 8.57 4.11 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.71 2.59 0.00 132 K 7.80 3.97 0.00 1.89 1.82 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.61 7.81 133 V 7.53 3.53 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 1.10 0.00 0.00 0.70 0.00 0.00 134 V 8.19 3.88 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 0.92 0.00 0.00 1.10 0.00 0.00 135 A 8.18 4.10 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 0.00 136 G 8.15 3.50 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 0.00 0.00 0.00 0.00 137 V 8.07 2.96 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 -0.19 0.00 0.00 0.74 0.00 0.00 138 A 8.44 3.93 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 0.00 139 N 8.25 4.38 0.00 2.91 2.93 0.00 0.00 6.95 7.02 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 0.00 140 A 7.73 4.12 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 0.00 141 L 7.55 3.90 0.00 1.18 0.53 0.18 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.70 4.97 1.57 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 0.00 0.00 143 H 7.84 4.09 0.00 3.32 3.49 0.00 5.61 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 0.00 144 R 7.74 4.07 0.00 1.52 1.75 0.00 3.45 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 145 Y 7.00 4.69 0.00 3.16 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 0.00 146 H 7.90 4.45 0.00 3.24 3.16 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00