NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 L 4.2351 8.1844 120.6214 54.2930 42.9757 175.8736 12 S 3.7403 8.6121 117.9602 56.2784 62.9455 172.4769 13 M 4.1706 8.9165 125.0497 55.0136 32.7563 175.4138 14 D 4.6208 8.5248 120.3707 54.8922 42.1916 175.4276 15 K 5.3348 8.6103 119.5151 54.7213 36.4695 175.4664 16 V 4.6068 8.9471 122.1722 61.1020 34.0381 174.4695 17 F 5.5915 8.3100 121.3792 55.1240 41.4901 174.3538 18 I 4.4902 8.7642 119.8436 59.6899 40.4748 173.9058 19 E 4.6513 9.1078 128.4926 54.8323 30.8353 175.9157 20 Q 3.3214 8.9286 126.9971 56.9708 26.7931 174.1312 21 L 4.2326 8.5039 120.7730 54.9403 43.5441 176.1017 22 E 5.2652 8.7713 126.3829 54.8607 31.4067 175.8728 23 V 4.6215 8.7731 122.2901 60.2085 35.5224 173.8017 24 I 4.9008 8.1997 122.2774 60.2099 39.8014 174.7131 25 T 4.5172 8.8563 120.2262 61.9323 71.7886 171.3974 26 T 4.8096 8.4865 118.9128 62.4103 69.8089 174.2008 27 I 5.6316 7.8102 125.9486 59.7122 41.1594 172.8273 28 G 3.9560 7.5330 112.5259 44.3490 0.0000 174.4352 29 V 3.5556 7.6219 116.2721 63.5958 31.7596 176.8416 30 Y 4.4185 6.8809 117.1893 57.2172 38.6895 176.1479 31 D 4.2126 8.7394 121.1915 56.8933 41.9745 178.5607 32 W 4.3401 8.2939 116.9266 59.6357 28.3414 178.0783 33 E 3.6620 6.5852 118.9592 58.7436 28.5237 178.4602 34 Q 4.3000 7.4862 115.0845 56.8914 28.9918 176.4102 35 Q 4.4263 7.9518 119.0198 55.8941 30.1265 175.5542 36 I 4.5977 7.1665 108.6578 58.8030 40.1631 174.6122 37 K 4.8431 8.3408 120.0638 55.3647 33.6412 176.0705 38 Q 4.7184 9.2732 121.8543 53.9458 33.5646 174.0292 39 K 4.7757 8.6466 122.5438 55.9264 33.2811 175.8342 40 L 5.0362 8.8621 126.7420 52.9095 45.4148 175.4043 41 V 4.8105 8.7175 121.4711 61.1224 34.5554 174.1542 42 L 5.2644 9.0706 127.6917 53.0159 45.0161 174.9589 43 D 5.4478 9.2217 123.3109 52.5068 43.8066 175.1553 44 L 5.2539 8.9731 122.8967 52.9146 45.5282 175.2954 45 E 5.2908 9.2949 122.9238 54.8296 32.9927 174.7270 46 M 5.3285 9.2733 124.0196 53.1089 35.4426 175.0497 47 A 4.7480 9.2702 126.4649 52.5262 19.2783 176.6510 48 H 4.5941 8.9101 121.9469 55.0638 33.3940 172.9427 49 D 4.3757 8.5967 126.4313 54.3753 41.5780 175.9833 50 N 4.5886 9.5289 125.1894 55.7195 39.0667 177.2777 51 R 3.8933 8.2330 119.7837 59.1836 30.0557 178.6314 52 A 3.9276 7.9403 119.7856 55.3028 18.4740 179.4566 53 A 4.0706 8.0822 118.9023 55.2109 18.2590 179.9290 54 G 3.5313 8.1713 103.8687 47.5034 0.0000 175.5806 55 K 4.2583 7.7494 119.8703 58.6239 32.5642 178.8913 56 S 4.3081 8.3982 113.7937 58.5995 63.3195 173.9834 57 D 4.3759 8.1316 119.8783 54.8377 40.1852 171.9299 58 D 4.8815 7.7162 116.6185 51.4535 42.4868 177.4290 59 V 3.5953 8.4538 126.2998 64.3465 31.5019 178.0606 60 A 3.9691 8.4154 123.1807 54.6830 18.2358 177.8193 61 D 4.5775 8.3703 114.0429 54.8425 41.3113 176.2515 62 A 4.5824 7.7613 122.6213 50.2762 20.8563 176.4007 63 L 4.1262 7.8962 121.8886 53.7751 42.4022 177.2391 64 D 4.2644 8.2756 126.8133 53.1973 40.3258 175.2946 65 Y 4.0731 8.0523 125.6245 59.7569 37.7159 178.5065 66 A 4.0352 7.6163 122.6028 55.1757 18.5259 179.6524 67 Q 3.9431 7.8931 116.1504 58.8268 28.8976 178.7628 68 V 2.9218 7.3873 119.2225 65.9167 31.4491 178.2361 69 S 4.1023 8.3341 115.1621 61.5766 62.6151 176.4030 70 Q 3.9426 8.1191 121.8982 59.2696 28.7786 178.2613 71 A 4.0599 8.1050 121.6629 55.1773 18.3509 179.8333 72 V 3.5647 7.9673 116.6298 66.1633 31.6452 178.2023 73 L 4.0029 8.1073 118.8308 57.9196 41.4939 179.4830 74 E 3.9634 8.4922 118.6192 59.5339 29.1961 178.6323 75 H 4.0773 8.1868 117.1532 59.6018 30.2548 177.0535 76 I 4.0856 8.1252 121.5064 64.5058 36.7812 178.2507 77 E 4.0626 8.7130 118.6015 59.2785 29.4213 178.6949 78 Q 4.4156 8.0102 115.2443 55.4845 29.3634 176.0962 79 G 3.5968 7.2346 108.9376 44.0472 0.0000 173.2978 80 R 4.5359 7.4803 117.4308 54.0571 33.1959 175.5213 81 F 4.8967 8.6667 120.1688 55.7751 42.6467 175.8757 82 L 4.2542 8.6580 123.4591 56.3123 42.3407 176.9354 83 L 4.7936 7.4851 117.0793 52.3805 44.6765 177.8626 84 V 3.5353 8.3018 115.4089 64.4863 31.4645 178.4894 85 E 3.9036 8.2303 117.9711 59.7052 29.2086 179.3711 86 R 3.9414 7.8189 118.4553 59.0659 30.1888 178.5656 87 V 3.0574 7.4830 117.4278 65.8385 31.5032 177.7603 88 A 3.8979 8.1665 120.7718 55.0031 18.3418 179.1956 89 E 3.8362 8.1993 117.8223 59.6111 29.6666 179.0033 90 E 4.0106 8.3705 118.7028 59.1223 29.4650 179.5298 91 V 3.4638 7.8838 118.2347 65.7545 31.6191 177.6708 92 A 3.9233 7.9106 120.5696 55.4273 18.1877 179.3304 93 E 3.8643 8.0239 117.1901 59.1852 29.6370 178.5744 94 L 3.9320 8.1644 120.7449 58.2591 42.1328 179.1446 95 I 4.0706 7.9922 119.6765 64.7859 37.0411 178.3455 96 M 4.3691 7.9970 120.8564 58.1382 31.5420 179.0970 97 T 3.9341 7.7938 114.7125 66.8461 68.8135 176.8744 98 R 3.8723 8.0080 118.5193 57.5776 29.1456 177.4243 99 F 4.7059 7.9318 114.8950 56.2598 39.7226 175.3972 100 A 3.6404 7.5401 120.8547 53.0494 16.6675 177.8442 101 V 4.1188 7.2565 117.4769 63.2121 32.4120 174.7205 102 P 4.7216 0.0000 0.0000 64.4612 32.9908 175.4934 103 W 5.6976 8.0895 129.8851 56.1132 34.2883 173.1367 104 L 4.3649 7.7217 125.1441 54.4193 43.8500 173.8334 105 R 4.7150 8.3889 120.6825 54.4681 33.1887 174.1734 106 I 4.8722 8.7818 126.6872 59.3888 40.7391 174.3166 107 R 4.9945 9.1599 126.8885 54.3900 32.7993 173.8679 108 L 5.1658 8.9271 128.5745 53.5544 44.9137 174.9732 109 T 5.0162 9.0477 123.0460 61.6476 72.1856 173.2245 110 K 4.6790 9.0293 128.2002 54.0404 32.6987 174.7425 111 P 4.4761 0.0000 0.0000 65.0608 31.7393 178.3750 112 G 3.7167 8.0815 106.5130 47.4781 0.0000 174.5430 113 A 4.1959 7.8949 122.6294 54.6550 18.6301 178.2248 114 V 4.5224 7.5241 108.8282 58.7057 34.5310 175.1859 115 P 4.2542 0.0000 0.0000 65.7235 31.3657 177.2885 116 Q 4.1847 8.0953 115.1142 56.4575 28.9728 175.2271 117 A 4.8488 7.8060 120.8303 49.7396 21.8735 176.5016 118 K 4.0564 8.7983 121.1726 59.0986 32.5896 176.9530 119 G 4.1368 7.1847 102.7610 45.9800 0.0000 173.0693 120 V 4.6153 7.5480 112.1684 59.9256 36.3152 175.8801 121 G 3.7915 7.6571 106.8441 46.5835 0.0000 172.6066 122 V 4.7151 7.9846 112.3000 59.5093 35.8003 175.1082 123 I 5.0408 8.3462 123.5335 59.5441 39.7494 174.9508 124 I 4.6794 8.6843 120.2190 58.9719 41.0826 174.0681 125 E 4.8974 8.7191 123.0384 54.6686 31.9965 175.5464 126 R 4.7740 8.4320 122.1327 54.5314 34.4017 174.2269 127 A 5.0985 8.2999 121.7750 50.7304 22.7863 176.3792 128 R 4.2261 8.5532 117.4070 56.4401 29.9272 176.8519 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 4.24 0.00 1.62 1.66 0.90 0.52 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 12 S 8.61 3.74 0.00 3.80 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.92 4.17 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.20 0.00 14 D 8.52 4.62 0.00 2.84 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 15 K 8.61 5.33 0.00 1.73 1.86 0.00 1.77 0.00 0.00 1.85 0.00 0.00 2.64 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.47 1.62 7.81 16 V 8.95 4.61 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 1.03 0.00 0.00 0.97 0.00 0.00 17 F 8.31 5.59 0.00 3.10 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 18 I 8.76 4.49 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 1.05 0.63 0.90 0.00 0.00 19 E 9.11 4.65 0.00 2.17 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 2.23 2.31 0.00 20 Q 8.93 3.32 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.68 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 21 L 8.50 4.23 0.00 1.74 1.65 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.77 5.27 0.00 1.88 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 2.23 2.46 0.00 23 V 8.77 4.62 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 0.75 0.00 0.00 0.95 0.00 0.00 24 I 8.20 4.90 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 0.96 0.94 0.00 0.00 25 T 8.86 4.52 4.31 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 1.25 0.00 0.00 26 T 8.49 4.81 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 1.29 0.00 0.00 27 I 7.81 5.63 1.91 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 1.19 0.66 0.90 0.00 0.00 28 G 7.53 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 0.00 0.00 0.00 29 V 7.62 3.56 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.05 0.00 0.00 30 Y 6.88 4.42 0.00 2.26 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 31 D 8.74 4.21 0.00 2.76 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 32 W 8.29 4.34 0.00 3.63 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 33 E 6.59 3.66 0.00 1.48 1.86 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 1.47 1.47 0.00 34 Q 7.49 4.30 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 35 Q 7.95 4.43 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.71 0.00 0.00 0.00 0.00 0.00 2.69 2.50 0.00 36 I 7.17 4.60 1.99 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 1.73 0.76 1.06 0.00 0.00 37 K 8.34 4.84 0.00 1.69 1.80 0.00 1.65 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.42 7.81 38 Q 9.27 4.72 0.00 1.91 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 39 K 8.65 4.78 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.47 7.81 40 L 8.86 5.04 0.00 1.56 1.47 0.81 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.72 4.81 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 1.04 0.00 0.00 0.93 0.00 0.00 42 L 9.07 5.26 0.00 1.58 1.49 0.93 0.84 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 43 D 9.22 5.45 0.00 2.51 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 44 L 8.97 5.25 0.00 1.57 1.52 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 45 E 9.29 5.29 0.00 2.03 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 0.00 2.32 2.32 0.00 46 M 9.27 5.33 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.45 0.00 47 A 9.27 4.75 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 48 H 8.91 4.59 0.00 3.18 3.23 0.00 5.96 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.60 4.38 0.00 2.61 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 9.53 4.59 0.00 2.84 2.90 0.00 0.00 6.79 7.31 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 51 R 8.23 3.89 0.00 2.08 1.96 0.00 3.18 0.00 0.00 3.17 7.56 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 7.94 3.93 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 8.08 4.07 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 54 G 8.17 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.75 4.26 0.00 1.77 1.87 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.58 7.81 56 S 8.40 4.31 0.00 4.00 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 57 D 8.13 4.38 0.00 2.78 2.75 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 58 D 7.72 4.88 0.00 2.73 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 8.45 3.60 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 0.72 0.00 0.00 0.85 0.00 0.00 60 A 8.42 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 61 D 8.37 4.58 0.00 2.81 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 62 A 7.76 4.58 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 63 L 7.90 4.13 0.00 1.16 1.42 0.83 1.18 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 64 D 8.28 4.26 0.00 2.61 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 0.00 0.00 0.00 0.00 65 Y 8.05 4.07 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 7.62 4.04 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 67 Q 7.89 3.94 0.00 2.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.40 0.00 68 V 7.39 2.92 1.93 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 0.85 0.00 0.00 -0.04 0.00 0.00 69 S 8.33 4.10 0.00 4.02 3.91 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 70 Q 8.12 3.94 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.56 0.00 71 A 8.10 4.06 1.60 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 72 V 7.97 3.56 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 1.10 0.00 0.00 1.00 0.00 0.00 73 L 8.11 4.00 0.00 1.89 1.73 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.49 3.96 0.00 2.03 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 2.57 2.49 0.00 75 H 8.19 4.08 0.00 3.29 3.57 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 8.13 4.09 1.90 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 1.39 0.98 0.87 0.00 0.00 77 E 8.71 4.06 0.00 2.00 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 2.53 2.50 0.00 78 Q 8.01 4.42 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 79 G 7.23 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 80 R 7.48 4.54 0.00 1.58 1.71 0.00 3.09 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.48 0.00 81 F 8.67 4.90 0.00 2.98 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 82 L 8.66 4.25 0.00 1.69 1.63 0.88 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.49 4.79 0.00 1.66 1.67 0.90 0.91 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 84 V 8.30 3.54 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 0.80 0.00 0.00 0.89 0.00 0.00 85 E 8.23 3.90 0.00 2.02 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 2.38 2.42 0.00 86 R 7.82 3.94 0.00 1.88 2.16 0.00 3.19 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.82 0.00 87 V 7.48 3.06 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 0.66 0.00 0.00 -0.04 0.00 0.00 88 A 8.17 3.90 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 89 E 8.20 3.84 0.00 2.25 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 2.30 2.38 0.00 90 E 8.37 4.01 0.00 2.17 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 2.38 2.49 0.00 91 V 7.88 3.46 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 92 A 7.91 3.92 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 93 E 8.02 3.86 0.00 2.11 1.93 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 2.29 2.34 0.00 94 L 8.16 3.93 0.00 1.77 1.92 0.85 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.99 4.07 1.91 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 1.60 0.89 0.99 0.00 0.00 96 M 8.00 4.37 0.00 2.09 2.11 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 2.77 2.61 0.00 97 T 7.79 3.93 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 1.16 0.00 0.00 98 R 8.01 3.87 0.00 0.99 1.00 0.00 2.94 0.00 0.00 3.05 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.63 0.00 99 F 7.93 4.71 0.00 3.29 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 0.00 100 A 7.54 3.64 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 0.00 101 V 7.26 4.12 2.18 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 1.10 0.00 0.00 1.05 0.00 0.00 102 P 0.00 4.72 0.00 2.26 2.35 0.00 4.04 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.03 0.00 103 W 8.09 5.70 0.00 3.41 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 0.00 104 L 7.72 4.36 0.00 1.67 1.56 0.69 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 105 R 8.39 4.71 0.00 1.53 1.68 0.00 3.08 0.00 0.00 3.47 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 8.78 4.87 1.79 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 1.01 0.94 0.85 0.00 0.00 107 R 9.16 4.99 0.00 1.78 1.73 0.00 3.01 0.00 0.00 3.31 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 108 L 8.93 5.17 0.00 1.70 1.41 0.92 0.75 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 0.00 109 T 9.05 5.02 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 0.00 110 K 9.03 4.68 0.00 1.76 1.68 0.00 1.61 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.35 7.81 111 P 0.00 4.48 0.00 2.21 2.17 0.00 3.71 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 2.00 2.08 0.00 112 G 8.08 3.72 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 0.00 0.00 0.00 113 A 7.89 4.20 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 0.00 114 V 7.52 4.52 2.11 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 0.84 0.00 0.00 1.03 0.00 0.00 115 P 0.00 4.25 0.00 2.18 2.20 0.00 3.79 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 2.00 2.00 0.00 116 Q 8.10 4.18 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 117 A 7.81 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 8.80 4.06 0.00 1.73 1.85 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.44 7.81 119 G 7.18 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 0.00 0.00 0.00 120 V 7.55 4.62 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 0.76 0.00 0.00 0.99 0.00 0.00 121 G 7.66 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 0.00 0.00 0.00 122 V 7.98 4.72 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 0.71 0.00 0.00 0.88 0.00 0.00 123 I 8.35 5.04 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 1.38 0.60 0.90 0.00 0.00 124 I 8.68 4.68 1.81 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 1.16 1.06 0.87 0.00 0.00 125 E 8.72 4.90 0.00 1.83 1.75 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 2.12 2.30 0.00 126 R 8.43 4.77 0.00 1.53 1.68 0.00 3.23 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.61 0.00 127 A 8.30 5.10 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 0.00 128 R 8.55 4.23 0.00 1.76 1.87 0.00 3.38 0.00 0.00 3.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00