NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3350 8.3044 120.3461 55.4121 32.6912 174.5312 2 H 4.3407 8.7636 127.3096 55.0244 30.4368 172.7860 3 L 4.6420 7.9006 126.6247 52.5052 45.5811 176.6572 4 T 4.1166 8.2948 113.0757 60.7150 70.8732 173.9208 5 P 4.1946 0.0000 0.0000 66.1599 31.3628 178.8170 6 E 3.9804 8.0978 116.5693 59.3948 29.5081 179.1588 7 E 3.9394 7.9786 118.6468 59.1191 29.4428 179.2941 8 K 3.8934 8.2132 120.1399 59.3892 32.2054 179.1515 9 S 4.0983 8.2837 114.4122 61.0828 62.8511 176.3914 10 A 3.9586 8.0241 124.5954 54.9401 18.1278 179.7549 11 V 3.3151 7.5417 116.3922 66.3726 31.4675 178.3983 12 T 3.9247 8.0862 115.2760 66.6753 68.1315 176.3840 13 A 4.0407 8.0311 121.4921 55.3059 18.6557 179.1879 14 L 3.8945 7.9420 118.3226 57.9739 42.2427 178.9444 15 W 4.3874 8.8489 128.4091 60.2265 30.3836 178.0466 16 G 3.7636 7.9687 104.9876 46.7801 0.0000 174.7871 17 K 4.4566 7.7486 118.4073 55.2637 32.7018 176.3728 18 V 3.7130 6.8775 120.7160 61.7655 32.0844 175.7506 19 N 4.4881 8.2352 125.8270 52.2520 38.7267 174.9712 20 V 3.4553 8.1540 128.2520 66.1461 31.3913 177.2358 21 D 4.3127 8.0930 117.7811 57.3546 40.8238 178.2941 22 E 3.8312 8.0641 119.2860 59.3964 29.6307 179.0559 23 V 3.6277 7.9972 118.6707 65.5571 31.4989 178.3025 24 G 3.6483 8.4018 106.2313 47.7532 0.0000 176.0522 25 G 3.6184 7.8693 108.4220 47.2231 0.0000 175.7257 26 E 3.8928 7.9977 120.1386 59.2116 29.5558 179.2397 27 A 3.9286 8.0888 120.8493 55.1799 18.5193 179.4886 28 L 4.0060 8.0352 119.0219 57.9840 42.2416 179.3479 29 G 3.5421 8.1002 105.7048 48.0552 0.0000 175.9615 30 R 3.9142 8.2456 121.4750 58.4807 29.9621 178.9341 31 L 4.0057 8.0407 120.3028 58.2953 41.8125 179.1609 32 L 4.0767 7.8571 119.9779 56.6378 41.2228 179.6618 33 V 3.6113 7.1625 117.2304 65.7963 31.7828 178.0390 34 V 3.5082 7.9761 116.7683 64.4096 32.7321 175.4982 35 Y 3.8797 7.4006 116.4483 53.8270 37.9497 173.9534 36 P 4.5056 0.0000 0.0000 64.4069 31.4458 178.1694 37 W 4.3671 8.0426 116.0682 58.8491 28.0123 177.5476 38 T 4.2480 7.7228 110.6777 63.8206 68.3491 175.9633 39 Q 4.4862 8.2640 121.4603 57.7959 28.5498 177.9547 40 R 3.7706 7.4274 116.8545 58.4629 29.3405 177.8058 41 F 4.4295 6.9531 115.7917 57.3128 39.5706 175.6622 42 F 4.6637 7.7458 118.6013 56.5369 39.8057 177.1468 43 E 3.9586 8.5650 122.2706 59.7590 29.3904 178.5410 44 S 4.6357 8.0715 111.5178 59.0103 63.0644 174.6747 45 F 4.5345 8.4920 119.6448 58.2503 39.9948 176.1022 46 G 4.0021 8.0996 105.4676 44.2705 0.0000 175.1672 47 D 4.5960 8.5967 127.2688 53.6914 40.9283 175.3997 48 L 4.8860 8.3482 125.4953 54.3800 43.2445 177.9243 49 S 4.2828 8.2419 115.3547 60.7858 63.1575 175.0216 50 T 4.7138 7.4538 110.0193 58.1991 72.7619 172.5793 51 P 4.1991 0.0000 0.0000 66.3002 31.1761 178.6957 52 D 4.3401 8.0615 116.6031 56.8290 40.5687 178.5894 53 A 3.9925 7.3757 120.7239 55.0780 18.6004 179.5759 54 V 3.6850 8.0859 117.1246 66.5745 31.4800 178.2851 55 M 4.0410 8.3578 117.1585 57.3967 31.8825 177.3114 56 G 3.8915 7.4540 105.2992 44.9564 0.0000 173.5321 57 N 4.3216 7.8873 120.3185 52.9526 39.6226 173.3254 58 P 4.2278 0.0000 0.0000 66.1346 31.1313 178.5409 59 K 3.6548 8.2638 118.1208 58.7191 31.7949 179.6071 60 V 3.6823 7.7364 118.2597 65.8957 31.6008 178.0053 61 K 3.8827 7.8889 117.7596 59.4724 31.7861 179.1136 62 A 3.9697 8.0938 121.0800 55.4900 18.1912 179.2409 63 H 4.3579 8.6149 117.0697 59.3298 29.9262 177.6490 64 G 3.6260 8.6873 108.0058 47.7318 0.0000 175.5291 65 K 3.9666 8.1146 121.8946 59.0540 32.1680 178.9484 66 K 3.9803 7.7738 120.1260 59.3738 32.1878 179.0073 67 V 3.6053 8.0148 118.7692 66.2586 31.5606 178.1230 68 L 4.4142 8.4465 118.8217 57.2006 41.5226 179.7480 69 G 3.7221 8.3098 106.0629 47.9682 0.0000 175.7179 70 A 4.1875 8.2119 123.8877 54.5515 18.1406 179.5257 71 F 4.1700 8.2765 118.6598 61.5924 39.8748 177.1213 72 S 4.3129 8.9956 115.2813 61.9000 62.5838 176.3718 73 D 4.5065 8.2274 121.1530 57.4860 40.5682 179.2598 74 G 3.5113 7.9213 105.5232 47.5198 0.0000 175.7716 75 L 3.7356 7.1695 119.8459 57.3282 41.6325 178.7092 76 A 4.1607 7.4353 118.6593 53.2584 19.2180 176.8020 77 H 4.9013 7.9790 115.1428 54.7699 29.7701 175.6312 78 L 3.9920 7.9799 120.1981 57.7863 41.9354 179.0725 79 D 4.4846 7.9667 117.3968 56.4317 41.5825 176.0312 80 N 4.9457 8.0298 117.1833 50.8331 39.0747 174.3284 81 L 4.0568 7.9639 122.6949 57.2008 42.1506 178.6149 82 K 4.0269 8.1333 118.1275 59.6019 31.8372 179.3153 83 G 3.6041 7.7486 104.1632 48.1970 0.0000 175.4356 84 T 3.7531 7.4196 116.6218 65.7235 68.6936 175.8674 85 F 4.6949 7.9924 116.9638 57.2061 39.3111 177.3545 86 A 4.0553 7.7256 122.6303 55.7384 18.1297 180.0312 87 T 3.8194 7.8356 113.2579 66.9689 68.6104 176.8652 88 L 4.1386 7.9980 120.3039 57.6143 41.6602 179.3922 89 S 4.4317 8.6776 114.9079 61.1305 62.3982 176.1542 90 E 3.9339 8.3688 121.2212 59.2123 29.1177 179.2374 91 L 3.9431 7.9382 120.4988 58.5249 42.1506 178.8101 92 H 4.2374 8.6776 116.4815 58.7436 28.0646 177.1446 93 C 3.5257 7.8265 120.7894 62.1008 31.1499 175.3589 94 D 4.3104 8.2575 120.2921 56.9347 40.6273 177.6576 95 K 4.2452 7.7626 116.2367 57.3272 33.3686 177.4285 96 L 4.1943 7.6832 117.2987 54.6787 42.3915 176.1332 97 H 4.1355 7.2747 113.3055 56.6760 26.4691 175.3338 98 V 3.6328 7.9077 119.2790 61.0705 32.0048 174.9125 99 D 4.3396 8.8149 127.3410 54.0342 41.5895 175.3382 100 P 3.0298 0.0000 0.0000 64.6986 31.3222 178.0545 101 E 3.8606 8.1165 118.3469 59.0569 29.3883 178.4510 102 N 4.3525 7.9194 116.5614 56.0382 38.4447 177.2520 103 F 4.5280 7.5666 119.5576 60.4158 38.9303 178.0052 104 R 3.9839 7.9151 117.4783 59.1644 29.9991 178.8337 105 L 3.8080 7.7398 118.5142 57.6424 41.5518 179.2982 106 L 4.1186 8.2123 120.4664 57.9650 41.9680 179.2292 107 G 3.6864 8.0814 105.7999 47.7211 0.0000 175.7912 108 K 4.0149 8.0963 121.1186 59.1758 32.0472 179.6244 109 V 3.6059 7.8545 118.4544 65.9702 31.3966 177.6659 110 L 3.8512 8.3372 120.5102 58.2116 41.8492 179.1316 111 V 3.5557 7.8325 118.1077 66.2304 31.4176 177.8459 112 C 4.1394 8.0516 116.5455 62.7247 27.8634 176.2984 113 V 3.5171 7.9000 120.1403 65.8152 31.0051 178.1713 114 L 3.8180 7.9107 118.7985 57.5355 41.3112 179.3005 115 A 3.7447 7.2556 120.6444 55.2259 18.0841 179.1639 116 H 4.0717 7.9951 115.7586 59.6364 30.0279 176.7632 117 H 3.8403 8.0925 119.0784 58.9504 29.9284 176.6786 118 F 4.5373 8.3701 118.5032 56.7818 39.5683 177.2178 119 G 3.7971 8.8519 108.1741 45.9110 0.0000 176.5928 120 K 3.8741 9.0949 123.7033 59.2740 31.9321 177.2484 121 E 4.0971 8.0252 118.6370 58.8359 29.9178 177.1565 122 F 4.5517 8.1500 122.6340 57.1183 37.7853 175.1362 123 T 4.2252 7.4401 116.0076 59.9929 71.3436 173.5576 124 P 4.1644 0.0000 0.0000 65.6182 31.4268 177.2642 125 P 4.2020 0.0000 0.0000 65.3446 31.2132 178.9281 126 V 3.5689 7.3346 116.1258 65.7710 31.3515 177.8790 127 Q 3.4624 7.9333 119.5263 58.9830 28.7498 178.0293 128 A 4.0102 8.1496 121.6641 55.1814 18.3359 179.5336 129 A 3.8991 7.8018 118.7831 55.5373 18.4535 179.5498 130 Y 3.9487 8.2497 115.2455 61.0749 38.0238 178.6289 131 Q 4.1486 8.7008 119.8037 58.8442 28.8028 178.8145 132 K 4.0180 7.9042 119.8427 59.2354 31.9799 179.6657 133 V 3.4917 7.6083 118.1105 66.2004 31.4553 178.6486 134 V 3.8255 8.1770 112.0183 64.2941 31.3783 178.4893 135 A 4.1123 8.1447 120.6529 55.0269 18.1270 179.9736 136 G 3.5065 8.1906 104.3367 47.8905 0.0000 176.2191 137 V 3.3262 7.9937 120.7325 65.4738 31.5356 178.0067 138 A 3.9022 8.1756 120.7312 55.2752 18.1160 179.4158 139 N 4.3400 8.3126 114.7976 56.3553 38.3595 177.5748 140 A 4.0423 8.0207 121.6758 55.0212 18.2787 179.3100 141 L 3.9906 7.9663 116.9744 56.7759 41.7659 178.4932 142 A 4.4220 7.8880 119.1477 52.8955 18.9147 178.3446 143 H 4.0397 7.8750 117.3390 59.0107 29.9566 175.9190 144 K 4.5341 8.4400 116.2961 56.3538 31.9699 176.2802 145 Y 4.1618 8.0261 117.5141 58.2846 38.4998 175.5247 146 H 4.4334 8.2595 117.4524 56.2021 28.2229 173.3338 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 M 8.30 4.34 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.58 0.00 2 H 8.76 4.34 0.00 3.20 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.90 4.64 0.00 1.52 1.41 0.78 0.84 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 4 T 8.29 4.12 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 5 P 0.00 4.19 0.00 2.08 2.14 0.00 3.85 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 6 E 8.10 3.98 0.00 1.98 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 2.39 2.39 0.00 7 E 7.98 3.94 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 2.27 2.26 0.00 8 K 8.21 3.89 0.00 1.75 1.74 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.36 7.81 9 S 8.28 4.10 0.00 4.09 4.09 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 0.00 0.00 0.00 10 A 8.02 3.96 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 7.54 3.32 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 0.61 0.00 0.00 0.45 0.00 0.00 12 T 8.09 3.92 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 1.25 0.00 0.00 13 A 8.03 4.04 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 14 L 7.94 3.89 0.00 2.02 2.09 0.54 0.50 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 15 W 8.85 4.39 0.00 3.85 3.24 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 16 G 7.97 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 17 K 7.75 4.46 0.00 1.96 2.04 0.00 1.70 0.00 0.00 1.58 0.00 0.00 3.24 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.56 7.81 18 V 6.88 3.71 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 -0.03 0.00 0.00 0.74 0.00 0.00 19 N 8.24 4.49 0.00 2.70 2.58 0.00 0.00 6.81 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 20 V 8.15 3.46 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 1.27 0.00 0.00 0.95 0.00 0.00 21 D 8.09 4.31 0.00 2.85 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 22 E 8.06 3.83 0.00 1.94 1.96 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 2.21 2.24 0.00 23 V 8.00 3.63 1.88 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 0.91 0.00 0.00 0.63 0.00 0.00 24 G 8.40 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 0.00 0.00 0.00 25 G 7.87 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 26 E 8.00 3.89 0.00 2.20 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 2.28 2.40 0.00 27 A 8.09 3.93 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 28 L 8.04 4.01 0.00 1.85 1.63 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 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 3.91 0.00 1.80 1.92 0.00 3.08 0.00 0.00 3.02 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.75 0.00 31 L 8.04 4.01 0.00 1.89 1.90 1.02 0.62 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 32 L 7.86 4.08 0.00 1.94 1.68 1.05 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.16 3.61 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 0.72 0.00 0.00 0.97 0.00 0.00 34 V 7.98 3.51 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 0.02 0.00 0.00 0.73 0.00 0.00 35 Y 7.40 3.88 0.00 2.64 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 4.51 0.00 2.32 2.32 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.96 0.00 37 W 8.04 4.37 0.00 3.53 3.45 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 38 T 7.72 4.25 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 1.10 0.00 0.00 39 Q 8.26 4.49 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 40 R 7.43 3.77 0.00 1.56 1.89 0.00 2.94 0.00 0.00 2.53 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 6.95 4.43 0.00 1.83 2.37 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 42 F 7.75 4.66 0.00 2.83 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 0.00 0.00 0.00 43 E 8.56 3.96 0.00 1.97 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 2.27 2.27 0.00 44 S 8.07 4.64 0.00 4.06 4.05 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 0.00 45 F 8.49 4.53 0.00 3.23 3.13 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 46 G 8.10 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 0.00 0.00 0.00 47 D 8.60 4.60 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 48 L 8.35 4.89 0.00 1.67 1.63 1.08 1.04 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 49 S 8.24 4.28 0.00 4.03 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 50 T 7.45 4.71 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 P 0.00 4.20 0.00 2.15 2.12 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 52 D 8.06 4.34 0.00 2.75 2.70 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 53 A 7.38 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 54 V 8.09 3.68 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 1.04 0.00 0.00 0.98 0.00 0.00 55 M 8.36 4.04 0.00 2.00 2.13 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 2.84 0.00 56 G 7.45 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.89 4.32 0.00 2.95 2.86 0.00 0.00 6.85 7.59 0.00 0.00 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 4.23 0.00 2.23 2.26 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 59 K 8.26 3.65 0.00 1.36 0.74 0.00 1.38 0.00 0.00 1.19 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.18 1.21 7.81 60 V 7.74 3.68 2.24 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 0.90 0.00 0.00 1.05 0.00 0.00 61 K 7.89 3.88 0.00 2.00 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.62 7.81 62 A 8.09 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 63 H 8.61 4.36 0.00 3.63 3.60 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 8.69 3.63 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 0.00 0.00 0.00 65 K 8.11 3.97 0.00 1.86 2.02 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.58 7.81 66 K 7.77 3.98 0.00 2.06 1.88 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.50 7.81 67 V 8.01 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 1.03 0.00 0.00 0.93 0.00 0.00 68 L 8.45 4.41 0.00 1.95 1.90 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.31 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 70 A 8.21 4.19 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 71 F 8.28 4.17 0.00 3.11 3.37 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 72 S 9.00 4.31 0.00 4.33 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 73 D 8.23 4.51 0.00 2.90 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 74 G 7.92 3.51 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 0.00 0.00 0.00 75 L 7.17 3.74 0.00 1.61 1.50 0.41 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.44 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 7.98 4.90 0.00 3.07 3.13 0.00 5.83 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.98 3.99 0.00 1.51 1.66 0.79 1.01 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 79 D 7.97 4.48 0.00 2.63 2.70 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 80 N 8.03 4.95 0.00 2.71 2.57 0.00 0.00 7.07 6.80 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 81 L 7.96 4.06 0.00 1.75 1.82 0.88 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.13 4.03 0.00 1.73 1.78 0.00 1.57 0.00 0.00 1.48 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.46 7.81 83 G 7.75 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 84 T 7.42 3.75 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 0.39 0.00 0.00 85 F 7.99 4.69 0.00 3.05 2.96 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 86 A 7.73 4.06 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 87 T 7.84 3.82 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 1.22 0.00 0.00 88 L 8.00 4.14 0.00 2.01 1.87 1.11 0.88 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 89 S 8.68 4.43 0.00 4.05 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 90 E 8.37 3.93 0.00 2.25 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 2.33 2.51 0.00 91 L 7.94 3.94 0.00 1.89 1.82 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.68 4.24 0.00 3.74 3.79 0.00 5.86 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 93 C 7.83 3.53 0.00 1.23 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 94 D 8.26 4.31 0.00 2.69 2.69 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 0.00 0.00 0.00 0.00 95 K 7.76 4.25 0.00 1.68 1.81 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.36 7.81 96 L 7.68 4.19 0.00 1.72 1.61 0.73 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.27 4.14 0.00 3.47 3.45 0.00 5.64 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.91 3.63 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 0.13 0.00 0.00 0.42 0.00 0.00 99 D 8.81 4.34 0.00 2.79 2.58 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 0.00 100 P 0.00 3.03 0.00 1.87 1.73 0.00 3.35 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.44 0.00 101 E 8.12 3.86 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 2.32 2.40 0.00 102 N 7.92 4.35 0.00 2.42 2.75 0.00 0.00 6.86 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 0.00 103 F 7.57 4.53 0.00 3.07 2.88 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 0.00 104 R 7.92 3.98 0.00 2.02 1.96 0.00 3.31 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 105 L 7.74 3.81 0.00 1.77 1.37 0.68 -0.22 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 0.00 106 L 8.21 4.12 0.00 1.91 1.87 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.08 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.10 4.01 0.00 2.05 1.96 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.60 7.81 109 V 7.85 3.61 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 1.13 0.00 0.00 1.17 0.00 0.00 110 L 8.34 3.85 0.00 1.74 1.76 0.87 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.83 3.56 2.32 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 1.30 0.00 0.00 1.18 0.00 0.00 112 C 8.05 4.14 0.00 3.18 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 0.00 113 V 7.90 3.52 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 0.99 0.00 0.00 0.95 0.00 0.00 114 L 7.91 3.82 0.00 0.88 1.11 0.55 1.21 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 0.00 115 A 7.26 3.74 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 0.00 116 H 8.00 4.07 0.00 3.16 3.42 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.09 3.84 0.00 2.86 2.74 0.00 5.99 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 0.00 118 F 8.37 4.54 0.00 3.31 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 0.00 119 G 8.85 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 0.00 120 K 9.09 3.87 0.00 1.77 1.93 0.00 1.81 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.49 7.81 121 E 8.03 4.10 0.00 2.05 2.25 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 2.34 2.29 0.00 122 F 8.15 4.55 0.00 3.10 3.17 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 0.00 123 T 7.44 4.23 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 1.31 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 125 P 0.00 4.20 0.00 2.11 2.06 0.00 3.50 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.33 3.57 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 1.00 0.00 0.00 0.90 0.00 0.00 127 Q 7.93 3.46 0.00 1.62 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.42 2.59 0.00 128 A 8.15 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 0.00 129 A 7.80 3.90 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 0.00 130 Y 8.25 3.95 0.00 3.35 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 0.00 131 Q 8.70 4.15 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.76 2.62 0.00 132 K 7.90 4.02 0.00 1.86 1.82 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.66 7.81 133 V 7.61 3.49 2.14 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 0.92 0.00 0.00 0.72 0.00 0.00 134 V 8.18 3.83 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 0.96 0.00 0.00 1.13 0.00 0.00 135 A 8.14 4.11 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 0.00 136 G 8.19 3.51 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 0.00 0.00 0.00 137 V 7.99 3.33 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 0.48 0.00 0.00 0.57 0.00 0.00 138 A 8.18 3.90 1.46 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 0.00 0.00 139 N 8.31 4.34 0.00 2.93 2.90 0.00 0.00 6.93 6.82 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 0.00 140 A 8.02 4.04 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 0.00 141 L 7.97 3.99 0.00 0.85 0.53 0.01 0.33 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 0.00 142 A 7.89 4.42 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 0.00 143 H 7.88 4.04 0.00 3.30 3.45 0.00 5.75 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 0.00 144 K 8.44 4.53 0.00 1.85 1.85 0.00 1.84 0.00 0.00 1.85 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.60 7.81 145 Y 8.03 4.16 0.00 3.15 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 0.00 146 H 8.26 4.43 0.00 3.22 3.25 0.00 5.75 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