NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3844 8.3301 116.7948 57.9664 64.4058 173.2636 2 A 4.0748 8.1130 125.0002 51.7328 18.4929 177.3491 3 D 4.4650 9.4307 121.2012 56.8718 41.7782 177.1052 4 H 4.3752 8.2340 116.8678 58.2732 28.9212 177.2364 5 E 4.0012 8.0350 120.9617 59.3558 29.3404 179.5703 6 R 3.8988 7.9031 115.7631 59.1957 29.4743 178.3878 7 E 3.8643 7.9421 119.1004 58.9792 29.4516 178.6908 8 A 3.9683 8.2413 120.2365 55.0552 18.5750 179.0297 9 Q 3.9988 8.3939 118.5269 59.1737 28.9793 178.4122 10 K 3.8844 8.0638 120.4699 59.4183 32.1583 178.5752 11 A 3.9569 7.7375 121.1891 55.1489 18.0806 179.3874 12 E 3.7123 7.7563 117.2696 59.5397 29.0379 179.2058 13 E 3.8841 7.9616 119.1860 59.1033 29.5121 178.4728 14 E 3.9554 7.8817 119.2482 58.9841 29.4667 178.5191 15 L 3.8859 7.5660 120.6133 58.2617 42.1712 179.0264 16 Q 3.9518 7.7294 116.8082 58.6173 28.6615 178.6326 17 K 3.9040 7.6803 120.9880 59.5066 32.1425 179.0124 18 V 3.6087 7.7078 117.9760 65.9544 31.4303 177.7277 19 L 3.8751 7.6439 118.7147 57.7675 41.1854 179.3105 20 E 4.0281 8.1100 118.2863 59.6893 29.6086 179.4012 21 E 4.0985 8.1802 118.0155 59.2785 29.4294 179.3211 22 A 4.1484 8.7978 121.7399 55.3295 18.3778 179.6395 23 S 4.3021 8.9017 114.3032 62.5453 62.8202 175.8136 24 K 4.2287 8.2797 121.5094 57.0955 31.6503 178.7329 25 K 3.6445 8.1951 117.9696 59.7330 32.5418 178.6921 26 A 3.6316 8.2938 121.0878 55.0222 18.0586 180.1121 27 V 3.2571 8.3827 111.9861 64.4566 31.3484 178.5023 28 E 3.8369 7.8844 116.8923 59.2003 29.8265 178.1188 29 A 4.0371 8.6864 121.6167 54.7223 18.1953 178.9253 30 E 4.2848 7.9875 116.3274 56.9441 30.3376 175.7053 31 R 4.1954 8.4269 120.4715 59.0949 28.7556 174.8752 32 G 3.7035 8.4668 113.2462 45.1614 0.0000 172.2437 33 A 4.8289 7.9601 123.6122 49.3704 20.0938 174.9316 34 P 4.4033 0.0000 0.0000 63.7216 32.1261 177.0314 35 G 3.8780 8.8776 108.1349 45.6681 0.0000 173.5868 36 A 4.0209 7.2397 120.9138 52.2824 18.7673 178.2489 37 A 4.5178 7.9235 120.3681 52.3191 20.7457 177.4357 38 L 3.8939 7.4420 119.4343 54.6991 42.9922 179.9688 39 I 2.6495 8.0224 113.5108 63.2006 39.0697 169.8536 40 S 3.6268 8.5685 119.8262 59.3223 62.9062 171.7855 41 Y 3.9757 8.7946 122.5704 60.5057 36.7843 176.2988 42 P 4.4350 0.0000 0.0000 65.2783 31.8640 177.6376 43 D 4.6709 8.0998 118.1523 56.1602 41.7764 178.3979 44 A 4.1282 8.0218 121.5174 54.9897 18.0079 179.4588 45 I 4.0643 7.8380 117.3185 63.5584 38.2850 177.3744 46 W 4.2851 7.8729 126.2107 60.2953 30.4803 177.3308 47 W 4.3948 8.4993 128.2086 59.8732 31.2761 176.2633 48 S 3.9022 8.0152 114.6013 57.4254 59.4874 172.4118 49 V 4.2857 6.9527 125.5970 64.2949 38.0306 175.2706 50 E 3.9436 7.9702 119.7098 59.1165 30.7185 179.6805 51 T 3.8821 7.1298 111.6860 64.9493 67.6196 175.8130 52 A 3.9278 7.5281 122.7941 55.6412 18.3509 179.1281 53 T 4.3678 7.1131 109.4116 62.7896 68.6608 177.0543 54 T 3.1860 7.9643 117.0733 61.2233 69.4796 172.3173 55 V 3.4506 9.5630 121.3260 63.8036 30.5280 172.6284 56 G 4.1251 8.2230 104.2630 45.8288 0.0000 172.4535 57 Y 4.5676 7.8160 117.0028 57.7816 38.1206 177.4719 58 G 3.7972 8.3161 110.3228 46.6846 0.0000 175.0750 59 D 4.9095 8.8769 117.6860 54.5934 40.7278 173.5555 60 R 4.6496 7.4058 115.1761 57.3761 33.2942 174.3121 61 Y 4.5989 7.8337 114.3528 56.5391 38.2097 171.9592 62 P 4.7295 0.0000 0.0000 62.1798 33.0819 177.7157 63 V 4.3272 7.8226 125.7574 62.6153 30.4479 177.1721 64 T 4.3477 8.3764 111.4480 64.8392 70.0712 175.0779 65 E 4.0523 8.2496 121.9070 59.2776 29.6351 179.0677 66 E 4.3405 7.6354 112.1332 55.7086 29.2625 177.2749 67 G 3.9646 8.9421 106.5973 49.4741 0.0000 175.6866 68 R 3.7631 8.3594 120.8149 58.7953 31.6094 177.9511 69 K 3.8485 8.3371 117.5159 59.1492 31.9914 178.9503 70 V 3.6004 9.4419 118.6036 65.9553 31.4071 177.7659 71 A 4.3803 8.3854 120.5294 54.7842 18.6008 178.8711 72 E 3.8924 8.2849 117.4501 59.7635 29.6609 178.8107 73 Q 3.9778 8.3164 119.3968 59.0839 28.8661 178.3579 74 V 3.5894 7.1617 117.2388 66.3060 31.7739 177.6237 75 M 4.1879 8.3887 118.8111 58.2669 31.8267 178.6318 76 K 3.9248 8.2740 119.5747 59.4915 32.3603 178.5268 77 A 4.1166 8.2338 121.1740 55.2213 18.2170 179.8942 78 G 3.6232 7.8943 104.0978 47.9457 0.0000 176.0453 79 I 3.8530 7.7020 121.7238 64.2095 37.1829 178.1912 80 E 3.9514 8.1481 119.3264 59.3515 28.8130 179.6313 81 V 3.4468 7.6479 118.1005 66.1803 31.4210 178.2235 82 F 4.2797 8.4853 115.9717 60.1039 39.1158 177.0801 83 A 4.3029 8.5747 120.7236 54.1591 18.5868 179.3601 84 L 3.9034 8.3549 119.7064 58.5053 42.2763 179.5571 85 V 3.7332 7.5972 110.8054 64.2033 31.3893 178.4058 86 T 4.0596 7.7353 115.3693 66.6249 68.0828 175.7057 87 A 3.9873 8.0336 122.2501 55.3319 18.2728 179.6204 88 A 3.9887 8.2540 117.9133 55.1962 18.4327 179.5552 89 L 4.7871 8.0220 117.7348 57.1714 42.1845 179.0612 90 A 4.3138 8.0286 120.8862 55.4713 16.9776 179.3154 91 T 3.7188 7.6059 109.9050 64.0295 67.0881 175.1417 92 D 4.2255 7.8823 120.4716 58.5008 40.4717 178.4757 93 F 4.2075 8.2650 114.1734 60.1056 38.1013 177.2203 94 V 2.8586 5.4500 117.0227 65.7671 30.9859 177.9416 95 R 3.9176 7.6124 118.1307 58.7289 29.8975 178.5089 96 R 3.9715 9.0719 117.1770 59.3549 29.1294 178.5816 97 E 3.9812 8.0084 118.7944 59.4611 29.3967 179.2426 98 E 3.9461 8.0791 118.0337 59.2089 29.3578 178.7673 99 E 3.9680 7.7513 118.4055 59.1434 29.7018 178.7507 100 R 4.0718 7.7111 117.2990 59.2613 30.3028 178.7034 101 R 4.2950 7.5436 114.9485 56.1053 30.3563 177.6249 102 G 3.8612 8.0696 106.6386 46.2826 0.0000 173.2022 103 H 4.3378 8.1633 124.2825 56.0062 29.9135 174.9095 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 S 8.33 4.38 0.00 3.88 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 2 A 8.11 4.07 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 3 D 9.43 4.47 0.00 2.55 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 4 H 8.23 4.38 0.00 3.20 3.37 0.00 5.82 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 5 E 8.04 4.00 0.00 2.08 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 2.34 2.46 0.00 6 R 7.90 3.90 0.00 2.02 2.18 0.00 2.95 0.00 0.00 3.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 7 E 7.94 3.86 0.00 2.16 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 0.00 2.29 2.30 0.00 8 A 8.24 3.97 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 9 Q 8.39 4.00 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 10 K 8.06 3.88 0.00 1.86 1.91 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.43 7.81 11 A 7.74 3.96 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 12 E 7.76 3.71 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 2.13 2.38 0.00 13 E 7.96 3.88 0.00 1.95 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 2.28 2.29 0.00 14 E 7.88 3.96 0.00 2.01 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 2.27 2.29 0.00 15 L 7.57 3.89 0.00 1.56 1.65 0.87 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.73 3.95 0.00 2.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 17 K 7.68 3.90 0.00 1.76 1.89 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.45 7.81 18 V 7.71 3.61 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 1.01 0.00 0.00 0.97 0.00 0.00 19 L 7.64 3.88 0.00 1.85 1.81 0.87 0.76 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 20 E 8.11 4.03 0.00 2.22 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 2.56 2.52 0.00 21 E 8.18 4.10 0.00 2.20 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 2.35 2.47 0.00 22 A 8.80 4.15 1.53 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 23 S 8.90 4.30 0.00 4.10 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 K 8.28 4.23 0.00 1.94 1.83 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.56 7.81 25 K 8.20 3.64 0.00 1.87 1.88 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.66 1.68 7.81 26 A 8.29 3.63 1.07 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 0.00 0.00 27 V 8.38 3.26 1.39 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 0.49 0.00 0.00 0.69 0.00 0.00 28 E 7.88 3.84 0.00 1.93 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 2.28 2.31 0.00 29 A 8.69 4.04 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 30 E 7.99 4.28 0.00 1.88 1.76 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 1.96 2.01 0.00 31 R 8.43 4.20 0.00 1.58 1.85 0.00 3.26 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 32 G 8.47 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 33 A 7.96 4.83 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 34 P 0.00 4.40 0.00 2.18 2.05 0.00 3.84 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 1.97 1.95 0.00 35 G 8.88 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.24 4.02 1.18 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 0.00 0.00 37 A 7.92 4.52 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 38 L 7.44 3.89 0.00 1.31 1.30 -0.01 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 39 I 8.02 2.65 1.83 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 1.35 0.58 0.84 0.00 0.00 40 S 8.57 3.63 0.00 3.98 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 41 Y 8.79 3.98 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 42 P 0.00 4.43 0.00 2.16 2.32 0.00 3.82 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 43 D 8.10 4.67 0.00 2.76 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 44 A 8.02 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 45 I 7.84 4.06 2.06 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.14 1.24 0.00 0.00 46 W 7.87 4.29 0.00 3.40 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 47 W 8.50 4.39 0.00 3.57 3.47 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 48 S 8.02 3.90 0.00 4.03 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 0.00 49 V 6.95 4.29 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 0.66 0.00 0.00 0.73 0.00 0.00 50 E 7.97 3.94 0.00 2.12 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 0.00 2.22 2.24 0.00 51 T 7.13 3.88 3.55 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 0.49 0.00 0.00 52 A 7.53 3.93 1.26 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 0.00 0.00 53 T 7.11 4.37 4.29 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 1.24 0.00 0.00 54 T 7.96 3.19 4.20 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 1.17 0.00 0.00 55 V 9.56 3.45 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 0.55 0.00 0.00 0.90 0.00 0.00 56 G 8.22 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 0.00 0.00 0.00 0.00 57 Y 7.82 4.57 0.00 3.01 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 58 G 8.32 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 0.00 0.00 0.00 59 D 8.88 4.91 0.00 3.09 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 60 R 7.41 4.65 0.00 1.75 1.73 0.00 3.03 0.00 0.00 3.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 61 Y 7.83 4.60 0.00 3.11 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 62 P 0.00 4.73 0.00 2.13 1.90 0.00 3.48 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 63 V 7.82 4.33 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 0.75 0.00 0.00 0.93 0.00 0.00 64 T 8.38 4.35 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 1.21 0.00 0.00 65 E 8.25 4.05 0.00 1.97 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 2.35 2.29 0.00 66 E 7.64 4.34 0.00 1.93 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 2.18 2.32 0.00 67 G 8.94 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 0.00 0.00 0.00 68 R 8.36 3.76 0.00 1.90 1.91 0.00 3.15 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 69 K 8.34 3.85 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.48 7.81 70 V 9.44 3.60 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 1.05 0.00 0.00 1.02 0.00 0.00 71 A 8.39 4.38 1.56 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 0.00 0.00 72 E 8.28 3.89 0.00 2.05 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 2.42 2.36 0.00 73 Q 8.32 3.98 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 74 V 7.16 3.59 2.23 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 0.71 0.00 0.00 1.05 0.00 0.00 75 M 8.39 4.19 0.00 2.08 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.77 0.00 76 K 8.27 3.92 0.00 1.92 1.95 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 77 A 8.23 4.12 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 78 G 7.89 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 0.00 0.00 0.00 79 I 7.70 3.85 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.89 0.94 0.00 0.00 80 E 8.15 3.95 0.00 2.14 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 2.50 2.46 0.00 81 V 7.65 3.45 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 0.65 0.00 0.00 0.89 0.00 0.00 82 F 8.49 4.28 0.00 3.21 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 83 A 8.57 4.30 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 84 L 8.35 3.90 0.00 1.85 1.79 0.91 0.87 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 85 V 7.60 3.73 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 0.75 0.00 0.00 1.07 0.00 0.00 86 T 7.74 4.06 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 1.24 0.00 0.00 87 A 8.03 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 88 A 8.25 3.99 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 89 L 8.02 4.79 0.00 1.77 1.78 0.98 1.01 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 90 A 8.03 4.31 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 91 T 7.61 3.72 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 1.10 0.00 0.00 92 D 7.88 4.23 0.00 2.97 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 93 F 8.27 4.21 0.00 3.28 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 94 V 5.45 2.86 1.78 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 0.75 0.00 0.00 -0.06 0.00 0.00 95 R 7.61 3.92 0.00 1.78 1.96 0.00 3.13 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 96 R 9.07 3.97 0.00 2.13 2.31 0.00 2.95 0.00 0.00 3.50 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.74 0.00 97 E 8.01 3.98 0.00 2.13 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 2.38 0.00 98 E 8.08 3.95 0.00 2.17 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 2.40 2.33 0.00 99 E 7.75 3.97 0.00 1.96 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 0.00 2.33 2.35 0.00 100 R 7.71 4.07 0.00 2.07 1.99 0.00 3.23 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 101 R 7.54 4.30 0.00 1.92 1.99 0.00 3.41 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 102 G 8.07 3.86 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 0.00 0.00 0.00 103 H 8.16 4.34 0.00 3.14 3.18 0.00 5.77 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