NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.7694 8.0393 114.0419 61.4129 32.8688 174.8119 2 H 4.4751 7.8262 120.5986 53.7246 28.4026 172.7740 3 L 5.1869 8.1654 123.8705 51.5208 45.7193 178.8069 4 T 4.2800 8.3115 113.0295 60.5716 71.2190 174.0190 5 P 4.2749 0.0000 0.0000 65.5676 31.3483 178.8276 6 E 4.0076 8.0602 116.2208 59.3387 29.5690 178.9644 7 E 3.9474 7.8912 119.5995 58.9565 29.5615 179.2585 8 K 3.8591 8.0141 118.5565 59.6510 32.0443 179.5804 9 S 4.2534 8.1482 116.1389 60.9380 62.7370 176.6671 10 A 4.0019 7.9353 123.2941 55.0246 18.1614 179.5791 11 V 3.2350 7.7101 117.0517 66.4689 31.1175 178.4052 12 T 3.9993 8.4915 109.5385 64.6528 68.3983 175.9620 13 A 4.0438 8.1678 123.1560 55.2254 18.7818 179.1925 14 L 3.8868 8.0541 118.3028 57.7636 42.0708 178.9559 15 W 4.2157 8.4265 128.6893 60.3330 30.4450 178.1404 16 G 3.7826 8.0057 104.3443 47.4874 0.0000 175.2503 17 K 4.2600 7.7254 119.4467 57.3579 32.5362 177.6901 18 V 3.4349 7.2804 120.2073 62.3895 31.9060 175.1906 19 N 4.6008 8.2840 125.3624 51.8994 39.7638 175.2533 20 V 3.5523 8.2270 127.8412 66.4209 31.6186 177.1743 21 D 4.3536 8.1984 117.8133 57.4898 40.6652 178.5039 22 E 3.8419 8.1722 118.9649 59.4861 29.7607 179.1668 23 V 3.6492 7.9773 118.3073 65.3964 31.4629 178.2032 24 G 3.6742 8.6321 106.4738 47.7486 0.0000 175.7321 25 G 3.6866 8.3013 109.3330 47.2020 0.0000 175.1455 26 E 3.8863 8.0307 121.4683 58.9858 29.7155 178.8708 27 A 3.9293 8.0739 120.8243 54.8773 18.4637 179.4222 28 L 3.9315 7.9677 119.0231 58.2332 42.2129 179.3334 29 G 3.5969 8.0311 105.6648 47.9551 0.0000 175.6152 30 R 3.8361 8.1558 121.4027 58.6594 30.0204 178.2368 31 L 3.9564 7.9380 120.2975 58.3664 42.1239 179.0941 32 L 4.1811 7.9428 120.0135 57.0894 41.2285 179.6513 33 V 3.5251 7.5543 117.9094 65.8368 31.6752 177.9025 34 V 3.4308 7.9517 117.7918 64.6370 32.9643 175.8784 35 Y 3.7694 7.2396 115.0917 54.1932 37.8604 174.0106 36 P 4.6410 0.0000 0.0000 64.9054 31.8138 177.8782 37 W 4.3981 8.2585 115.0802 59.7690 27.4349 178.0202 38 T 4.2617 7.8316 110.1060 64.1403 68.0574 175.8184 39 Q 4.3280 8.3763 121.1270 57.5378 28.5443 177.8683 40 R 3.7307 7.4872 117.2948 59.4494 29.2548 178.3778 41 F 4.0195 6.9734 115.9348 58.2701 39.1064 175.8182 42 F 4.4595 7.5893 118.6837 56.8749 39.1169 177.9548 43 E 4.1763 8.1921 122.7214 59.2764 29.6821 179.7331 44 S 4.3749 8.0653 112.1753 60.7177 63.3738 175.4413 45 F 4.4523 7.9787 118.4233 59.0976 39.7322 175.6160 46 G 4.0829 7.5622 104.5157 44.1568 0.0000 174.3674 47 D 4.5984 8.5953 125.0063 53.9674 40.8897 175.7557 48 L 4.9183 8.4016 124.6266 54.4127 43.6419 178.4551 49 S 4.3256 8.3187 116.9364 61.1197 63.1468 174.8408 50 T 4.7224 7.3727 106.6213 58.1657 73.0302 172.7756 51 P 4.1849 0.0000 0.0000 66.0047 31.3327 178.5295 52 D 4.2769 8.0625 116.5543 57.4824 40.6404 178.4093 53 A 3.9985 8.1115 120.1306 55.2861 18.6771 179.6486 54 V 3.6706 8.4268 116.7572 66.6486 31.5237 178.3669 55 M 4.2084 8.3784 117.6381 57.7776 31.8689 178.2596 56 G 3.9724 7.9622 103.8681 44.2616 0.0000 173.2344 57 N 4.3515 7.5087 120.4852 53.1744 39.1552 173.8156 58 P 4.2052 0.0000 0.0000 65.2302 31.4232 178.9184 59 K 3.5359 7.9107 117.3853 59.0710 31.8067 179.4703 60 V 3.6311 7.6215 117.9979 65.8327 31.6069 177.8588 61 K 3.8287 8.2119 118.2146 59.6155 31.5214 179.2085 62 A 3.9654 8.0950 121.0124 55.4488 18.2801 179.2102 63 H 4.4422 8.8005 117.3336 59.1003 29.9026 177.7229 64 G 3.6111 8.3516 108.5080 47.6492 0.0000 175.8412 65 K 4.0613 7.9928 121.4535 59.3761 32.7487 179.1962 66 K 3.9457 7.7663 119.6852 59.2317 32.1691 178.7859 67 V 3.6148 7.5543 118.0534 66.1965 31.4865 177.7967 68 L 4.4048 8.2053 119.6602 57.2356 41.8400 179.0779 69 G 3.7093 8.3577 106.3719 47.9677 0.0000 175.4503 70 A 4.0885 7.7816 122.1979 54.6279 18.7619 178.9017 71 F 4.2230 8.4239 119.1524 61.7136 39.4079 177.0263 72 S 4.0285 8.6235 112.5015 61.8892 62.3953 176.0215 73 D 4.4941 8.5845 121.4783 57.0758 40.3960 178.6540 74 G 3.7786 8.0113 105.2251 46.2634 0.0000 175.4369 75 L 3.8594 7.5151 119.8073 56.4333 41.7058 178.0898 76 A 4.2239 7.1477 118.5444 52.8247 19.2999 176.8255 77 H 4.9387 7.5554 115.2685 54.7728 29.7993 175.7201 78 L 3.9594 8.1137 120.6087 57.5142 41.7343 178.5650 79 D 4.5096 7.9016 116.8930 55.8786 42.0599 176.1435 80 N 4.9990 8.1522 117.2009 51.2899 39.2397 174.6886 81 L 4.0343 7.9210 123.7088 58.1244 42.3362 178.9695 82 K 3.7956 8.2398 117.8254 59.8643 31.7250 178.9072 83 G 3.7282 8.1608 104.6254 48.4484 0.0000 175.2411 84 T 3.7583 7.6149 116.8871 65.6287 68.6602 175.8473 85 F 4.6348 8.1386 117.0019 56.9358 39.3643 177.2883 86 A 4.1903 7.8065 122.1421 55.9684 18.1602 180.0603 87 T 3.8385 7.8717 113.0321 66.9412 68.6122 176.8197 88 L 4.1613 7.9456 120.2957 57.4992 41.7670 179.2476 89 S 4.8022 8.7703 115.1841 60.9591 62.3129 176.1218 90 E 3.8138 8.2951 121.1214 59.3793 29.1999 178.8913 91 L 3.8956 8.0247 120.2977 58.6394 42.0179 178.7947 92 H 4.0973 8.3586 115.9232 59.1155 28.4964 177.2065 93 C 3.6661 7.4826 118.9935 62.4000 31.3718 175.0531 94 D 4.4095 8.5197 120.0669 56.9554 40.6258 178.1765 95 K 4.2227 7.9132 116.9267 57.7428 33.0722 177.8372 96 L 4.1050 7.6576 117.3011 55.5561 42.7985 176.3069 97 H 4.1264 8.3603 113.6017 56.7888 25.9260 175.3417 98 V 4.4637 7.5583 117.6408 60.6978 33.1846 174.5794 99 D 4.3931 8.8477 127.3320 53.7524 41.7344 175.1953 100 P 3.1889 0.0000 0.0000 64.6239 31.8055 177.8844 101 E 3.8355 9.1402 119.8607 59.4513 29.2768 178.3889 102 N 4.2149 8.0350 116.3210 56.3580 38.4970 177.3618 103 F 4.4454 7.2008 119.0041 60.7049 39.1399 177.9223 104 R 3.9728 7.9515 117.2095 59.1009 29.8345 178.9621 105 L 3.7704 8.0793 118.9169 57.6734 41.6591 178.9791 106 L 4.0277 8.2998 120.7609 58.4591 41.9681 179.2675 107 G 3.7084 8.2740 105.3393 48.0156 0.0000 175.4086 108 N 4.4499 8.0750 118.4419 55.8426 38.5264 177.6890 109 V 3.5656 8.0610 119.8526 65.9730 31.6676 177.3292 110 L 3.8112 8.3601 120.2866 58.6779 41.6709 179.1018 111 V 3.5555 7.7944 117.5473 66.4288 31.4028 177.8601 112 C 4.1577 8.0733 116.3694 62.4716 27.8494 176.2254 113 V 3.5740 7.8054 120.2734 65.8581 31.0438 178.1498 114 L 3.8864 7.7998 118.6072 57.5887 41.3197 179.3635 115 A 3.7997 7.1849 120.7337 54.9895 18.0487 179.2965 116 H 4.0847 7.8487 116.0746 59.6787 30.0743 176.9978 117 H 3.8378 8.1561 116.9881 58.6338 28.6454 177.3102 118 F 4.5611 8.3678 117.2544 56.7241 39.8752 178.0861 119 G 3.7789 8.7022 108.2015 45.9177 0.0000 175.9097 120 K 3.9650 9.1330 121.0934 59.8236 32.2270 177.7648 121 E 4.0778 8.4900 117.7617 59.1353 29.6152 177.7045 122 F 4.4437 8.0739 121.9072 57.3525 37.6614 175.0959 123 T 4.2888 7.4222 116.8247 59.5839 71.6221 173.5613 124 P 4.1658 0.0000 0.0000 65.6122 31.1232 177.2540 125 P 4.2815 0.0000 0.0000 65.0930 31.2409 178.9390 126 V 3.5422 7.1168 116.1099 65.8824 31.4265 177.2620 127 Q 3.5132 7.7610 119.1494 59.3224 28.8762 178.2131 128 A 3.9713 8.1084 120.9198 55.3222 18.5033 179.2540 129 A 3.8886 7.7203 118.7561 55.8945 18.4563 179.6456 130 Y 3.9593 8.2313 114.8845 60.9711 37.9062 178.6750 131 Q 4.1145 8.8689 119.6004 58.9399 28.8437 178.8594 132 K 3.9007 7.9280 119.0513 59.5191 32.2064 179.4273 133 V 3.4767 7.6412 118.1209 66.2482 31.5264 178.5317 134 V 3.8151 8.4339 112.2851 64.3602 31.3320 178.5062 135 A 4.1490 8.6606 121.2603 54.7591 18.1958 179.6107 136 G 3.6316 8.6570 104.7721 48.3364 0.0000 176.0789 137 V 3.3371 7.6743 120.8597 65.0823 31.3193 178.0465 138 A 3.9355 7.8369 120.1714 55.2540 17.8580 179.4241 139 N 4.3007 8.6431 115.2693 56.3248 38.3590 177.4637 140 A 4.1358 7.6942 121.2294 54.4112 18.9576 178.9683 141 L 4.1127 7.6506 116.4215 56.2384 41.6862 178.2502 142 A 4.3839 7.7347 120.3101 53.1227 18.9503 178.8374 143 H 4.2141 7.8932 111.9291 58.6760 28.5853 176.5795 144 K 4.3968 8.1983 117.5021 56.1364 31.7709 176.2320 145 Y 3.8993 7.8858 118.1509 57.9898 38.3914 175.5868 146 H 4.4792 8.2465 118.6865 56.0004 28.5123 173.1106 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 V 8.04 3.77 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 0.83 0.00 0.00 0.90 0.00 0.00 2 H 7.83 4.48 0.00 3.32 3.37 0.00 5.66 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.17 5.19 0.00 1.54 1.50 0.80 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.31 4.28 4.30 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 1.20 0.00 0.00 5 P 0.00 4.27 0.00 2.16 2.13 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 6 E 8.06 4.01 0.00 2.14 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 0.00 2.34 2.33 0.00 7 E 7.89 3.95 0.00 2.07 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 2.29 2.32 0.00 8 K 8.01 3.86 0.00 1.90 1.79 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.42 7.81 9 S 8.15 4.25 0.00 3.97 3.90 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 10 A 7.94 4.00 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 11 V 7.71 3.23 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 0.68 0.00 0.00 0.16 0.00 0.00 12 T 8.49 4.00 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 1.19 0.00 0.00 13 A 8.17 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 8.05 3.89 0.00 1.78 1.93 0.47 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.43 4.22 0.00 3.92 3.32 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 16 G 8.01 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 17 K 7.73 4.26 0.00 2.19 2.20 0.00 1.82 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.49 7.81 18 V 7.28 3.43 0.93 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 -0.12 0.00 0.00 0.68 0.00 0.00 19 N 8.28 4.60 0.00 2.71 2.58 0.00 0.00 6.83 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 8.23 3.55 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 1.15 0.00 0.00 1.05 0.00 0.00 21 D 8.20 4.35 0.00 2.84 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 22 E 8.17 3.84 0.00 1.98 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 2.27 2.42 0.00 23 V 7.98 3.65 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 0.83 0.00 0.00 0.60 0.00 0.00 24 G 8.63 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 25 G 8.30 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 26 E 8.03 3.89 0.00 2.18 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 0.00 2.31 2.34 0.00 27 A 8.07 3.93 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 28 L 7.97 3.93 0.00 1.74 1.61 0.88 1.06 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 29 G 8.03 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 30 R 8.16 3.84 0.00 2.17 1.89 0.00 3.04 0.00 0.00 3.01 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 31 L 7.94 3.96 0.00 1.97 1.89 1.01 0.49 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 7.94 4.18 0.00 2.01 1.70 1.05 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.55 3.53 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 0.95 0.00 0.00 34 V 7.95 3.43 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 -0.08 0.00 0.00 0.75 0.00 0.00 35 Y 7.24 3.77 0.00 2.68 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 4.64 0.00 2.26 2.17 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.03 0.00 37 W 8.26 4.40 0.00 3.54 3.44 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 0.00 0.00 0.00 38 T 7.83 4.26 4.46 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 1.16 0.00 0.00 39 Q 8.38 4.33 0.00 2.19 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.46 2.62 0.00 40 R 7.49 3.73 0.00 1.61 2.03 0.00 2.95 0.00 0.00 2.33 7.58 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 6.97 4.02 0.00 1.51 2.57 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 42 F 7.59 4.46 0.00 3.00 2.29 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 43 E 8.19 4.18 0.00 2.02 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 2.26 0.00 44 S 8.07 4.37 0.00 4.12 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 45 F 7.98 4.45 0.00 3.35 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 46 G 7.56 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 0.00 0.00 0.00 47 D 8.60 4.60 0.00 2.66 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 4.92 0.00 1.74 1.61 1.11 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.32 4.33 0.00 4.02 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 50 T 7.37 4.72 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 51 P 0.00 4.18 0.00 2.15 2.12 0.00 3.59 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 4.28 0.00 2.67 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 8.11 4.00 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 54 V 8.43 3.67 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 1.06 0.00 0.00 0.99 0.00 0.00 55 M 8.38 4.21 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.95 0.00 56 G 7.96 3.97 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 0.00 0.00 0.00 57 N 7.51 4.35 0.00 3.06 2.81 0.00 0.00 7.06 7.66 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 58 P 0.00 4.21 0.00 2.12 2.03 0.00 3.60 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 59 K 7.91 3.54 0.00 1.92 0.74 0.00 1.40 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.02 1.04 7.81 60 V 7.62 3.63 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 1.08 0.00 0.00 1.02 0.00 0.00 61 K 8.21 3.83 0.00 1.95 1.81 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.70 7.81 62 A 8.10 3.97 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 63 H 8.80 4.44 0.00 3.49 3.54 0.00 5.79 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 8.35 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.06 0.00 2.19 2.09 0.00 1.52 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 1.60 1.46 7.81 66 K 7.77 3.95 0.00 1.94 2.05 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.53 1.52 7.81 67 V 7.55 3.61 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 0.97 0.00 0.00 0.87 0.00 0.00 68 L 8.21 4.40 0.00 2.02 1.81 1.25 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.36 3.71 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 0.00 0.00 0.00 70 A 7.78 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 71 F 8.42 4.22 0.00 3.18 3.36 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 72 S 8.62 4.03 0.00 4.56 4.44 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 0.00 0.00 0.00 73 D 8.58 4.49 0.00 2.85 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 74 G 8.01 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 75 L 7.52 3.86 0.00 1.39 1.40 -0.40 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.15 4.22 1.14 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 77 H 7.56 4.94 0.00 3.08 3.17 0.00 5.83 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.11 3.96 0.00 1.53 1.65 nan 0.90 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 79 D 7.90 4.51 0.00 2.64 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 80 N 8.15 5.00 0.00 2.71 2.58 0.00 0.00 7.04 6.07 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 81 L 7.92 4.03 0.00 1.73 1.79 0.85 1.09 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 82 K 8.24 3.80 0.00 1.71 1.71 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.18 1.44 7.81 83 G 8.16 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 0.00 0.00 0.00 84 T 7.61 3.76 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 0.41 0.00 0.00 85 F 8.14 4.63 0.00 3.18 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 86 A 7.81 4.19 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 87 T 7.87 3.84 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 1.22 0.00 0.00 88 L 7.95 4.16 0.00 1.99 1.82 1.09 1.00 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 89 S 8.77 4.80 0.00 4.20 4.12 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 0.00 0.00 0.00 90 E 8.30 3.81 0.00 2.21 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 2.31 2.55 0.00 91 L 8.02 3.90 0.00 1.79 1.92 0.92 1.03 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 92 H 8.36 4.10 0.00 3.83 3.84 0.00 5.87 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.48 3.67 0.00 1.23 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 94 D 8.52 4.41 0.00 2.61 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 7.91 4.22 0.00 1.78 1.82 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.59 7.81 96 L 7.66 4.10 0.00 1.68 1.63 0.76 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 97 H 8.36 4.13 0.00 3.39 3.43 0.00 5.63 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 7.56 4.46 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 0.25 0.00 0.00 0.54 0.00 0.00 99 D 8.85 4.39 0.00 2.76 2.57 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 0.00 100 P 0.00 3.19 0.00 1.93 1.82 0.00 3.40 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.46 0.00 101 E 9.14 3.84 0.00 2.05 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 2.31 2.40 0.00 102 N 8.03 4.21 0.00 2.45 2.75 0.00 0.00 7.02 7.70 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 0.00 103 F 7.20 4.45 0.00 3.10 2.95 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 0.00 0.00 0.00 104 R 7.95 3.97 0.00 1.94 1.98 0.00 3.31 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 105 L 8.08 3.77 0.00 1.70 1.36 0.63 0.10 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 0.00 106 L 8.30 4.03 0.00 1.77 1.75 0.91 1.07 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 0.00 107 G 8.27 3.71 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 0.00 0.00 0.00 108 N 8.07 4.45 0.00 2.96 2.95 0.00 0.00 6.63 7.17 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 0.00 109 V 8.06 3.57 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 1.12 0.00 0.00 1.11 0.00 0.00 110 L 8.36 3.81 0.00 1.68 1.76 0.90 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.79 3.56 2.29 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 1.31 0.00 0.00 1.17 0.00 0.00 112 C 8.07 4.16 0.00 3.21 2.92 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 0.00 113 V 7.81 3.57 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 1.03 0.00 0.00 0.88 0.00 0.00 114 L 7.80 3.89 0.00 1.05 0.92 0.57 0.88 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 0.00 115 A 7.18 3.80 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 0.00 116 H 7.85 4.08 0.00 3.21 3.41 0.00 5.78 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 0.00 117 H 8.16 3.84 0.00 3.07 2.48 0.00 5.89 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 4.56 0.00 3.26 3.22 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 0.00 119 G 8.70 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 0.00 120 K 9.13 3.97 0.00 1.92 2.02 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.54 7.81 121 E 8.49 4.08 0.00 2.42 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 0.00 2.40 2.45 0.00 122 F 8.07 4.44 0.00 3.10 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 0.00 123 T 7.42 4.29 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 1.29 0.00 0.00 124 P 0.00 4.17 0.00 2.16 2.15 0.00 3.57 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 2.20 0.00 125 P 0.00 4.28 0.00 2.11 2.06 0.00 3.48 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 7.12 3.54 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 0.90 0.00 0.00 0.88 0.00 0.00 127 Q 7.76 3.51 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.49 0.00 0.00 0.00 0.00 0.00 2.49 2.67 0.00 128 A 8.11 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 0.00 129 A 7.72 3.89 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 8.23 3.96 0.00 3.39 3.27 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 0.00 131 Q 8.87 4.11 0.00 2.23 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.78 0.00 0.00 0.00 0.00 0.00 2.71 2.63 0.00 132 K 7.93 3.90 0.00 2.06 1.81 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.47 7.81 133 V 7.64 3.48 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 0.81 0.00 0.00 0.78 0.00 0.00 134 V 8.43 3.82 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 1.04 0.00 0.00 1.15 0.00 0.00 135 A 8.66 4.15 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 0.00 136 G 8.66 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 0.00 137 V 7.67 3.34 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 0.60 0.00 0.00 0.69 0.00 0.00 138 A 7.84 3.94 1.44 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 0.00 0.00 0.00 0.00 0.00 139 N 8.64 4.30 0.00 2.88 2.89 0.00 0.00 6.95 7.30 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 0.00 140 A 7.69 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 0.00 141 L 7.65 4.11 0.00 0.85 0.47 0.07 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.73 4.38 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 0.00 143 H 7.89 4.21 0.00 3.38 3.69 0.00 5.55 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 8.20 4.40 0.00 1.74 1.82 0.00 1.65 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.95 1.60 7.81 145 Y 7.89 3.90 0.00 3.26 2.99 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 0.00 146 H 8.25 4.48 0.00 3.19 3.22 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