NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 L 4.2746 8.1849 120.6212 54.2236 43.0730 176.5485 12 S 4.0319 8.3264 118.1013 58.0019 63.4391 172.8749 13 M 4.1907 8.7711 123.1904 55.2106 33.5287 176.0367 14 D 4.6395 8.4609 121.2834 54.6500 42.1662 175.5198 15 K 5.3521 8.6136 120.1089 54.7222 36.4751 175.4967 16 V 4.6355 8.8867 122.3262 61.1054 34.1216 174.4477 17 F 5.5662 8.2786 121.0623 55.1005 41.3816 174.0344 18 I 4.4337 8.9162 121.0039 59.6283 39.9810 173.9287 19 E 4.6765 9.0678 128.3430 54.9609 30.9673 175.8818 20 Q 3.2534 8.9479 126.6428 56.9630 26.8594 174.4399 21 L 4.2057 8.2566 120.1707 55.0357 43.4102 176.2874 22 E 5.1841 8.7360 126.4725 55.2484 31.2707 176.0706 23 V 4.5908 8.6954 121.7183 60.4445 35.3618 173.3055 24 I 4.8888 8.1574 123.0938 60.3170 39.4694 174.7031 25 T 4.4787 8.6441 119.7746 62.1084 71.7352 171.3009 26 T 4.8535 8.4778 118.8828 62.1651 70.0937 174.1329 27 I 4.9875 8.4164 126.4156 59.4868 41.1221 173.1647 28 G 4.1584 8.4549 114.4807 43.1653 0.0000 174.9670 29 V 3.4732 7.7939 120.9710 63.6835 32.3935 177.1209 30 Y 4.2810 6.9579 116.9322 56.9098 39.7155 176.0820 31 D 4.4164 8.7453 122.7761 57.4545 41.3581 179.0362 32 W 4.4408 8.2315 116.7277 59.6605 27.9644 178.1749 33 E 3.8562 7.0789 118.8279 58.8580 28.6580 178.3841 34 Q 4.1971 7.6523 115.7578 57.1440 29.0298 177.0150 35 Q 4.5721 7.8090 118.1304 54.8034 29.8117 174.4676 36 I 4.6837 7.1959 112.3474 58.7440 40.6404 174.3408 37 K 4.9230 8.4306 119.0962 54.8921 34.2733 175.9385 38 Q 4.7204 8.9599 121.8606 54.0629 33.7037 173.8146 39 K 4.9449 8.5942 121.6435 55.5255 33.6833 175.6029 40 L 5.0559 8.9072 126.1089 52.8788 45.6180 175.4399 41 V 4.8348 8.7110 121.9489 61.0985 34.4640 174.1241 42 L 5.2567 9.0361 127.6210 53.0337 44.9481 174.9775 43 D 5.4134 9.2516 122.7971 52.5072 44.0449 175.0688 44 L 5.2343 9.1126 122.7877 52.9528 45.7510 175.1933 45 E 5.2446 9.1955 123.1820 54.8288 32.5759 174.8792 46 M 5.3611 9.2412 123.8106 53.0947 35.6247 175.0322 47 A 4.7130 9.6106 126.2880 52.6178 19.3282 176.6530 48 H 4.5978 8.7583 120.8808 55.2932 33.4871 172.8339 49 D 4.4791 8.5700 126.1958 54.0528 41.8215 175.3654 50 N 4.6621 9.5676 124.6005 54.8324 39.7469 177.1092 51 R 3.9010 8.4686 117.4855 59.7706 30.0488 178.4682 52 A 4.0073 7.9517 119.6996 55.2502 18.5752 179.2132 53 A 4.0880 8.1397 118.6521 55.4221 18.2466 179.9306 54 G 3.6044 8.3221 103.2994 47.0905 0.0000 174.9351 55 K 4.3272 7.4469 120.8017 58.1951 32.9989 178.2391 56 S 4.2295 8.4353 114.2929 59.0954 63.0791 174.2348 57 D 4.3605 7.9345 118.8827 54.6360 40.2588 171.8021 58 D 4.9275 8.2143 117.7311 51.5454 42.7382 177.6492 59 V 3.5750 8.4600 125.9023 64.5333 31.6173 178.1087 60 A 3.9732 8.8053 123.1675 54.7829 18.2299 177.9530 61 D 4.5383 8.0912 114.0090 55.3914 41.3847 176.7162 62 A 4.4384 7.7465 122.4030 50.7778 19.7688 176.5333 63 L 4.1058 7.8777 121.6873 54.7613 43.0097 177.8267 64 D 4.4406 8.2270 125.9819 52.7210 39.2610 175.9839 65 Y 4.0555 7.8099 123.1361 59.4408 38.1533 178.4614 66 A 3.9302 7.0000 122.1488 54.9702 18.4852 179.1986 67 Q 3.8882 7.7587 117.9537 59.1171 29.0505 178.4100 68 V 2.8674 7.6400 119.6018 65.9317 31.4623 177.8764 69 S 4.1035 8.1344 114.9211 61.9785 62.7538 176.8950 70 Q 3.9957 8.1869 120.0882 59.0055 28.4495 178.9018 71 A 4.0863 8.4560 122.1639 55.0928 18.3609 179.9302 72 V 3.5644 8.1441 117.0452 66.0864 31.6336 178.2576 73 L 4.0012 8.0996 118.8016 57.9375 41.5071 179.4125 74 E 4.0267 8.3818 118.5046 59.6025 29.1665 178.9351 75 H 4.1741 8.0784 117.2560 59.3504 30.3088 177.1862 76 I 4.0854 8.1133 121.7611 64.6000 36.7772 178.3625 77 E 4.0888 8.5283 118.5970 59.2191 29.3735 178.6988 78 Q 4.3645 8.2048 115.8969 55.7683 29.2561 175.7921 79 G 3.7726 7.3276 108.7007 43.4990 0.0000 173.1226 80 R 4.5482 7.4260 117.3314 54.0687 32.8879 175.4117 81 F 4.9034 8.8484 121.1903 55.6151 42.3994 176.2396 82 L 4.3880 8.5668 123.2165 55.7203 42.1897 177.4792 83 L 4.8144 7.5706 117.3478 52.0928 44.9782 177.7511 84 V 3.5304 8.4900 116.4191 64.4006 31.4138 178.3880 85 E 3.8939 8.2083 116.9940 59.6917 29.0602 179.2586 86 R 3.9097 7.7765 119.5424 58.8799 30.0610 178.6772 87 V 3.1477 7.5163 117.3838 65.7965 31.6065 177.6390 88 A 3.8786 8.0923 120.8266 55.1144 18.2188 179.2797 89 E 3.8340 8.1497 117.7309 59.5247 29.7402 178.8961 90 E 3.9801 8.5144 119.0821 59.2813 29.5871 179.5609 91 V 3.4835 8.0563 118.3848 65.7473 31.6791 177.8344 92 A 3.9212 7.9888 120.4807 55.2789 18.2074 179.3789 93 E 3.8727 8.1476 116.9194 59.4713 29.4931 179.2458 94 L 3.9375 7.9901 120.2758 58.4362 42.2435 179.2417 95 I 4.0555 7.7313 119.2712 64.7710 36.8749 178.4099 96 M 4.3096 8.0499 119.4131 58.5246 31.5018 179.0625 97 T 3.8546 7.9346 115.2515 66.5362 68.8865 176.8000 98 R 4.0159 7.9979 118.0460 57.0560 29.3819 177.2737 99 F 4.6748 7.7855 114.4851 56.0172 40.1546 175.0148 100 A 4.0512 7.5945 121.8619 52.9258 16.4832 177.9972 101 V 3.9340 7.2883 120.1289 63.6784 32.1804 174.2342 102 P 4.6361 0.0000 0.0000 64.8607 32.9139 175.6073 103 W 5.6420 8.1046 129.4680 56.1901 34.3293 173.1074 104 L 4.3452 7.6019 124.8044 54.3251 43.8566 174.0015 105 R 4.7216 8.1523 120.1135 54.4696 33.5480 174.0130 106 I 4.8447 8.7094 126.4591 59.4166 40.8158 174.1835 107 R 4.9294 9.1928 127.9211 54.4058 32.4738 174.0041 108 L 5.2081 8.8338 128.7223 53.5561 44.8422 175.0480 109 T 4.9950 8.9358 122.6870 61.7300 72.2019 173.2689 110 K 4.5634 9.0007 127.4338 53.8888 32.4298 174.5433 111 P 4.4717 0.0000 0.0000 64.6612 31.5249 178.0317 112 G 3.8535 8.0201 103.2478 46.1330 0.0000 174.3412 113 A 4.1389 7.9592 123.3289 54.5840 18.6975 178.5633 114 V 4.4832 7.4919 108.7903 58.7720 34.2750 174.9229 115 P 4.2278 0.0000 0.0000 65.8930 31.2552 177.3523 116 Q 4.2079 8.0664 113.3539 56.3926 29.0189 175.2724 117 A 4.8519 7.6354 120.9107 49.6951 21.9494 176.6282 118 K 4.0619 8.6937 121.0012 59.2453 32.6169 177.0103 119 G 4.1132 7.2550 103.9689 45.3050 0.0000 172.3534 120 V 4.5628 7.8168 111.7750 59.2193 36.0277 176.0681 121 G 4.2772 7.3104 105.8195 46.1206 0.0000 172.2953 122 V 4.6196 7.5153 111.2821 59.6087 36.3621 174.8534 123 I 5.0874 8.3249 122.9040 59.5818 39.9805 174.9418 124 I 4.7127 8.6396 120.0661 59.0196 41.0832 174.0939 125 E 4.9225 8.7206 122.7762 54.7456 32.4155 175.4069 126 R 4.8001 8.3619 120.9558 54.8438 34.9979 173.8589 127 A 5.0476 8.2184 120.6073 50.8837 22.5172 176.5765 128 R 4.2060 8.6404 117.9047 56.4673 29.8978 176.7943 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 11 L 8.18 4.27 0.00 1.62 1.64 0.90 0.57 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 12 S 8.33 4.03 0.00 3.85 3.65 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 0.00 0.00 0.00 0.00 13 M 8.77 4.19 0.00 1.91 1.74 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 2.39 2.46 0.00 14 D 8.46 4.64 0.00 2.75 2.64 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 15 K 8.61 5.35 0.00 1.71 1.85 0.00 1.74 0.00 0.00 1.91 0.00 0.00 2.57 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.53 1.61 7.81 16 V 8.89 4.64 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 1.01 0.00 0.00 0.96 0.00 0.00 17 F 8.28 5.57 0.00 3.09 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 18 I 8.92 4.43 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 1.02 0.77 0.90 0.00 0.00 19 E 9.07 4.68 0.00 2.26 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 0.00 2.24 2.33 0.00 20 Q 8.95 3.25 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.70 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 21 L 8.26 4.21 0.00 1.77 1.66 0.93 0.93 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 22 E 8.74 5.18 0.00 1.89 1.85 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 2.25 2.48 0.00 23 V 8.70 4.59 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 0.82 0.00 0.00 0.95 0.00 0.00 24 I 8.16 4.89 1.89 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 1.25 0.93 0.94 0.00 0.00 25 T 8.64 4.48 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 1.27 0.00 0.00 26 T 8.48 4.85 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 1.35 0.00 0.00 27 I 8.42 4.99 1.93 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 1.26 0.54 0.92 0.00 0.00 28 G 8.45 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 29 V 7.79 3.47 1.80 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 -0.13 0.00 0.00 0.52 0.00 0.00 30 Y 6.96 4.28 0.00 1.99 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 31 D 8.75 4.42 0.00 2.78 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 32 W 8.23 4.44 0.00 3.55 3.31 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 33 E 7.08 3.86 0.00 1.68 1.94 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 1.56 1.47 0.00 34 Q 7.65 4.20 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 35 Q 7.81 4.57 0.00 2.29 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.68 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 36 I 7.20 4.68 1.98 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.77 1.05 0.00 0.00 37 K 8.43 4.92 0.00 1.67 1.77 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.37 1.40 7.81 38 Q 8.96 4.72 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 39 K 8.59 4.94 0.00 1.78 1.70 0.00 1.73 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.47 7.81 40 L 8.91 5.06 0.00 1.55 1.46 0.82 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.71 4.83 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 1.07 0.00 0.00 0.93 0.00 0.00 42 L 9.04 5.26 0.00 1.61 1.49 0.88 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 43 D 9.25 5.41 0.00 2.50 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 44 L 9.11 5.23 0.00 1.55 1.51 0.88 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 45 E 9.20 5.24 0.00 2.07 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 0.00 2.32 2.32 0.00 46 M 9.24 5.36 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 47 A 9.61 4.71 1.47 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 0.00 0.00 48 H 8.76 4.60 0.00 3.19 3.22 0.00 5.95 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 49 D 8.57 4.48 0.00 2.63 2.50 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 50 N 9.57 4.66 0.00 2.85 2.86 0.00 0.00 6.87 7.50 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 51 R 8.47 3.90 0.00 2.12 1.96 0.00 3.18 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 52 A 7.95 4.01 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 53 A 8.14 4.09 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 54 G 8.32 3.60 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 0.00 0.00 0.00 55 K 7.45 4.33 0.00 1.72 1.83 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.43 7.81 56 S 8.44 4.23 0.00 4.04 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 57 D 7.93 4.36 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 58 D 8.21 4.93 0.00 2.67 2.50 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 59 V 8.46 3.58 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 0.79 0.00 0.00 0.89 0.00 0.00 60 A 8.81 3.97 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 61 D 8.09 4.54 0.00 2.83 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 62 A 7.75 4.44 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 63 L 7.88 4.11 0.00 1.22 1.46 0.90 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.23 4.44 0.00 2.69 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 65 Y 7.81 4.06 0.00 3.10 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 66 A 7.00 3.93 1.13 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 0.00 0.00 67 Q 7.76 3.89 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.73 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 68 V 7.64 2.87 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 0.87 0.00 0.00 0.06 0.00 0.00 69 S 8.13 4.10 0.00 4.04 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 70 Q 8.19 4.00 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.59 0.00 71 A 8.46 4.09 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 72 V 8.14 3.56 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 1.09 0.00 0.00 0.95 0.00 0.00 73 L 8.10 4.00 0.00 1.90 1.73 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.38 4.03 0.00 2.07 2.26 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 2.36 2.60 0.00 75 H 8.08 4.17 0.00 3.28 3.51 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 8.11 4.09 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.91 0.89 0.00 0.00 77 E 8.53 4.09 0.00 1.99 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 2.54 2.50 0.00 78 Q 8.20 4.36 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 79 G 7.33 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 7.43 4.55 0.00 1.55 1.87 0.00 3.08 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.46 0.00 81 F 8.85 4.90 0.00 2.97 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 82 L 8.57 4.39 0.00 1.62 1.65 0.86 1.00 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 83 L 7.57 4.81 0.00 1.65 1.49 0.90 0.92 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 84 V 8.49 3.53 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 0.84 0.00 0.00 0.90 0.00 0.00 85 E 8.21 3.89 0.00 2.13 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 0.00 2.34 2.31 0.00 86 R 7.78 3.91 0.00 1.92 2.24 0.00 3.18 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.73 0.00 87 V 7.52 3.15 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 0.78 0.00 0.00 -0.10 0.00 0.00 88 A 8.09 3.88 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.15 3.83 0.00 2.23 1.94 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 2.29 2.37 0.00 90 E 8.51 3.98 0.00 2.13 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 2.38 2.53 0.00 91 V 8.06 3.48 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 0.96 0.00 0.00 0.90 0.00 0.00 92 A 7.99 3.92 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 93 E 8.15 3.87 0.00 2.22 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 2.32 2.46 0.00 94 L 7.99 3.94 0.00 1.75 1.91 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.73 4.06 1.89 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 1.56 1.10 0.95 0.00 0.00 96 M 8.05 4.31 0.00 2.11 2.12 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 2.73 2.76 0.00 97 T 7.93 3.85 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 1.17 0.00 0.00 98 R 8.00 4.02 0.00 1.23 1.14 0.00 2.82 0.00 0.00 3.08 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.68 0.00 99 F 7.79 4.67 0.00 3.28 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 0.00 100 A 7.59 4.05 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 0.00 101 V 7.29 3.93 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 0.99 0.00 0.00 1.03 0.00 0.00 102 P 0.00 4.64 0.00 2.26 2.36 0.00 4.07 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.03 0.00 103 W 8.10 5.64 0.00 3.43 3.02 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 0.00 104 L 7.60 4.35 0.00 1.60 1.52 0.69 0.46 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 0.00 105 R 8.15 4.72 0.00 1.59 1.67 0.00 3.07 0.00 0.00 3.46 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 106 I 8.71 4.84 1.77 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 1.03 0.53 0.84 0.00 0.00 107 R 9.19 4.93 0.00 1.79 1.74 0.00 3.02 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 108 L 8.83 5.21 0.00 1.71 1.41 0.92 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 109 T 8.94 4.99 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 1.24 0.00 0.00 110 K 9.00 4.56 0.00 1.75 1.68 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.38 7.81 111 P 0.00 4.47 0.00 2.09 2.12 0.00 3.94 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 112 G 8.02 3.85 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 0.00 0.00 0.00 113 A 7.96 4.14 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 0.00 114 V 7.49 4.48 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 0.82 0.00 0.00 1.01 0.00 0.00 115 P 0.00 4.23 0.00 2.04 2.14 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 116 Q 8.07 4.21 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 117 A 7.64 4.85 1.21 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 0.00 0.00 0.00 118 K 8.69 4.06 0.00 1.80 1.82 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.44 7.81 119 G 7.25 4.11 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 0.00 120 V 7.82 4.56 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 0.75 0.00 0.00 0.99 0.00 0.00 121 G 7.31 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 0.00 0.00 0.00 0.00 122 V 7.52 4.62 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 0.73 0.00 0.00 0.89 0.00 0.00 123 I 8.32 5.09 1.86 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 0.59 0.95 0.00 0.00 124 I 8.64 4.71 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.20 0.87 0.00 0.00 125 E 8.72 4.92 0.00 1.83 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.31 0.00 126 R 8.36 4.80 0.00 1.52 1.67 0.00 3.25 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.62 0.00 127 A 8.22 5.05 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 0.00 128 R 8.64 4.21 0.00 1.75 1.88 0.00 3.38 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00