NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0951 8.0549 120.3909 62.4031 32.5629 175.1865 2 L 3.9616 8.2752 127.5029 52.5347 42.2237 176.0369 3 S 4.5279 9.7292 119.2988 57.6964 66.2199 175.0615 4 E 4.2710 8.8476 121.5379 59.7372 29.2352 179.9333 5 G 3.6239 8.1030 105.1558 47.7447 0.0000 175.3833 6 E 3.9122 8.2111 120.9316 59.0741 29.3894 179.4839 7 W 4.4289 8.2742 119.0918 59.9114 29.1078 178.3471 8 Q 4.0922 8.6004 119.6994 59.1398 28.5349 178.3220 9 L 4.0775 8.0001 119.9856 57.6734 41.6732 179.5797 10 V 3.7615 8.0044 118.1042 66.2769 31.6389 178.0276 11 L 4.3766 8.5384 118.2318 57.1464 41.3119 178.9317 12 H 4.2321 8.3293 118.5268 59.2201 30.3022 177.3132 13 V 3.7489 7.9028 120.6458 64.5151 31.4303 178.1571 14 W 3.8355 8.5951 128.8264 60.0182 30.2419 177.8149 15 A 4.0231 8.2458 120.8667 54.9217 17.8594 179.7701 16 K 3.6676 7.6615 116.8704 59.3808 32.0015 179.7442 17 V 3.0051 6.9766 118.3582 65.4734 31.0445 177.2902 18 E 3.9875 6.9668 115.0909 57.3325 29.4046 178.1633 19 A 4.1872 7.3958 120.5965 53.6484 20.1914 177.7430 20 D 4.6556 7.9267 116.2522 52.1547 42.9536 175.5314 21 V 3.4102 7.8601 123.6945 65.9197 32.0438 176.7922 22 A 4.0515 7.9875 120.0659 55.0938 18.2966 179.7176 23 G 3.6831 8.5040 104.3227 45.9997 0.0000 175.7097 24 H 4.1501 8.2200 118.6224 58.5842 28.6857 178.1425 25 G 3.5456 8.3276 107.7285 47.7015 0.0000 175.7011 26 Q 3.8704 8.1560 120.4647 58.9603 28.7960 178.7282 27 D 4.2968 7.9999 119.6655 57.3788 40.7451 179.1293 28 I 3.6631 7.9165 120.4616 64.3715 37.0830 178.5360 29 L 3.4213 7.7766 119.8444 57.4857 41.2111 179.6927 30 I 3.5647 7.6321 119.9134 64.1949 36.9605 178.3424 31 R 3.7714 7.9142 119.5774 59.2314 29.8877 178.1349 32 L 3.9440 7.8473 120.1224 58.4726 41.5788 179.1413 33 F 4.6010 8.0750 117.7645 60.4319 38.5552 178.0347 34 K 4.0310 8.1861 117.7590 59.6165 32.0292 179.4133 35 S 4.3060 8.2151 114.4698 60.2860 64.0166 174.5625 36 H 4.6746 8.0668 118.4052 52.2263 29.5875 171.9389 37 P 4.5133 0.0000 0.0000 64.2699 31.4716 177.4468 38 E 4.0663 8.2396 116.5756 59.4260 29.3637 179.1748 39 T 4.0124 8.2594 111.5465 64.6132 68.8495 176.4320 40 L 3.5880 7.8747 123.4107 57.7342 41.8154 178.5257 41 E 3.9788 7.6908 117.6267 58.8077 29.6087 178.3914 42 K 4.4517 8.0238 116.9084 57.0226 32.6693 177.3629 43 F 4.6357 8.2561 119.4119 55.4552 39.5304 175.5209 44 D 4.3890 8.6297 124.5265 57.1972 40.9721 178.7093 45 R 3.8185 7.8958 117.9654 58.2633 30.2535 176.6626 46 F 5.0427 8.0684 114.2001 56.7621 40.9007 176.4997 47 K 4.1732 8.1288 118.6582 58.3159 32.5154 177.4818 48 H 4.3889 8.0576 114.8962 57.4349 28.9732 175.4226 49 L 4.1749 7.6554 121.8001 54.4538 41.7444 176.7417 50 K 4.5422 9.4308 122.3350 55.9011 34.4193 176.5385 51 T 4.7480 7.5132 108.5325 58.8338 73.1603 174.1868 52 E 3.9024 8.6472 121.7079 59.4045 29.7289 178.7770 53 A 3.9873 7.9792 120.3348 55.2856 18.2317 179.3011 54 E 3.9318 8.1679 116.1207 59.7070 29.9155 179.1059 55 M 4.1829 8.1322 118.6982 58.5376 31.8672 179.0955 56 K 4.0085 8.2524 117.1739 58.8451 32.2700 178.4795 57 A 4.4759 7.6183 118.9360 51.7915 19.2330 177.0805 58 S 4.3412 7.5236 113.2987 57.1803 62.4871 174.3470 59 E 3.9971 8.8548 129.6474 59.3426 29.4246 177.9631 60 D 4.4193 8.1929 117.8249 57.1627 41.2685 177.8392 61 L 3.4416 8.1371 121.0916 57.7199 42.1366 178.7948 62 K 3.8525 7.9382 119.3138 59.4211 32.1149 178.8813 63 K 4.0046 8.3586 118.9506 59.8807 31.9463 178.8744 64 H 4.4219 8.7047 118.6768 59.0943 29.7573 177.4427 65 G 3.5753 8.4035 108.0505 47.7037 0.0000 175.8652 66 V 3.6032 7.7156 119.9531 66.0330 31.5653 178.0709 67 T 3.8799 7.8928 115.5589 66.7415 68.3232 176.6176 68 V 3.5787 7.9095 119.9199 66.2192 31.5935 178.1852 69 L 4.2535 8.1819 118.6038 57.8171 41.4044 179.6926 70 T 3.9590 8.3873 116.1968 66.5513 68.4189 176.5047 71 A 4.0006 8.0114 122.7113 55.0909 18.3521 179.4801 72 L 3.7476 8.1596 119.0612 58.0824 42.1404 179.3840 73 G 3.2098 8.4913 105.9215 47.5980 0.0000 175.5346 74 A 4.0047 7.7922 122.2248 54.8061 18.6323 179.5903 75 I 3.7870 7.6026 118.3059 64.6176 37.1946 178.6783 76 L 4.0008 7.8941 120.1404 57.6127 41.1894 179.3252 77 K 4.0439 7.7458 116.2920 57.8490 32.2803 178.5228 78 K 3.9888 7.8548 118.6567 55.7653 32.6009 176.5163 79 K 2.0000 8.3244 118.2630 56.3720 29.7983 175.7733 80 G 3.9362 7.9859 106.3842 45.7464 0.0000 173.9834 81 H 4.5568 7.5053 119.2321 55.4136 27.6505 174.9315 82 H 5.3002 7.3082 110.2573 54.3417 29.8726 176.2666 83 E 3.9428 8.6295 122.6376 60.3678 29.0479 178.4827 84 A 4.0627 7.9278 118.7539 55.1308 17.5477 178.9894 85 E 4.1063 8.1087 116.8235 59.4404 29.7145 179.1677 86 L 4.3202 8.1515 118.8994 57.0119 41.6940 179.1749 87 K 3.8404 7.8943 118.7325 59.3411 32.0178 177.3821 88 P 4.3063 0.0000 0.0000 65.4785 31.3552 178.1702 89 L 3.9697 7.5036 120.2294 57.9969 42.0590 178.7653 90 A 4.1302 8.5586 121.0463 55.2652 18.2581 179.5747 91 Q 3.7778 8.1624 116.7390 59.1155 28.7984 179.3465 92 S 3.9481 8.2381 115.3789 61.8177 63.0104 176.2461 93 H 4.2278 8.6362 119.9355 58.0632 28.2166 177.7885 94 A 2.9833 7.8421 122.5750 54.7184 18.1973 179.0793 95 T 3.7198 7.2384 105.8195 62.0480 69.6520 175.4550 96 K 4.1920 7.4336 120.5353 58.2609 33.3262 176.8629 97 H 4.3277 8.0782 114.1270 56.0674 29.4313 175.3019 98 K 3.7537 7.7182 116.9661 57.4098 28.6369 176.4012 99 I 4.2206 7.9118 119.2574 58.7565 38.4216 175.0535 100 P 4.4303 0.0000 0.0000 62.2695 32.0534 177.5843 101 I 3.3709 8.3874 122.0237 64.5913 36.8655 178.4502 102 K 3.6542 7.9167 119.7179 59.7874 31.9234 178.1974 103 Y 4.0768 8.0426 116.7359 60.5901 37.7556 178.1504 104 L 4.1813 7.8712 120.4053 57.4267 41.6328 178.9691 105 E 3.9579 7.8748 119.0608 59.2479 29.6494 178.6627 106 F 4.4723 7.7108 117.8322 60.8319 38.9196 177.5848 107 I 3.8623 8.1682 118.1517 64.0144 37.7565 178.0486 108 S 4.1870 8.3247 116.3325 61.6029 62.6405 176.4267 109 E 4.0589 8.5576 121.0680 59.4054 29.1984 179.2894 110 A 4.0288 8.0875 120.7833 55.0947 18.3793 179.6298 111 I 3.6746 8.1240 118.6219 64.7764 37.2815 178.6996 112 I 3.8497 7.9525 120.4563 64.6285 36.9587 178.0175 113 H 4.1417 8.4798 119.0742 59.4079 29.6842 177.5664 114 V 3.6163 8.0382 120.0938 65.9219 31.3129 177.9825 115 L 3.7640 8.0255 119.0013 57.7703 41.0468 178.9692 116 H 4.4244 8.0131 117.4635 59.3683 29.9295 177.2673 117 S 4.1900 7.9057 115.8907 61.6154 62.8079 176.4430 118 R 4.0938 7.8554 118.7249 57.3780 31.2222 176.3882 119 H 5.0257 8.1448 116.0705 53.8707 29.9503 172.9588 120 P 4.2783 0.0000 0.0000 65.8721 31.6445 179.2824 121 G 3.6996 8.1315 106.3835 47.4439 0.0000 173.6147 122 D 5.0679 8.0778 118.0211 54.0026 41.3846 176.2615 123 F 5.0017 8.0413 121.3218 56.3497 39.7117 174.9711 124 G 3.8598 8.0845 106.8225 43.9956 0.0000 173.1950 125 A 3.9004 8.4156 120.9855 54.9418 18.2275 179.4295 126 D 4.1931 7.9740 116.9890 56.7987 39.3953 178.7223 127 A 3.9897 7.7640 121.9725 54.4356 18.3484 179.4111 128 Q 3.1852 7.8404 117.2673 58.8178 28.6870 179.3316 129 G 3.4742 8.2564 106.8456 47.5834 0.0000 175.6962 130 A 3.8611 7.9758 123.1749 55.1313 18.3284 179.4604 131 M 4.0100 8.4514 117.2087 58.6417 32.2425 177.8846 132 N 4.3109 8.5170 117.6914 56.6730 39.0378 176.9976 133 K 3.8929 8.2013 119.6820 59.3441 32.1094 179.2148 134 A 3.8371 8.1106 121.2923 55.1405 18.2644 179.7186 135 L 4.1329 8.3082 117.6875 57.6422 41.6950 179.5096 136 E 3.9866 8.5796 119.2719 59.2798 29.3861 179.0396 137 L 4.0082 8.2217 120.5780 57.9530 42.0819 178.5436 138 F 4.1292 8.3673 120.6381 61.6768 39.2918 177.4392 139 R 3.5295 8.2488 117.4712 58.8251 29.8605 178.8978 140 K 3.8259 8.4621 119.8450 59.7694 31.7737 178.6343 141 D 4.3567 8.1830 119.0538 57.2430 40.6841 178.8419 142 I 3.5590 7.6680 120.3564 64.1803 36.9171 178.2938 143 A 3.7045 8.2155 121.8359 54.9763 18.1443 179.5500 144 A 3.9369 7.9160 119.2504 55.1988 18.4090 180.0984 145 K 4.0021 7.8500 116.5754 59.7150 32.0980 179.0508 146 Y 4.0862 8.5740 117.5305 61.1159 37.7984 178.8412 147 K 4.0042 8.4958 120.6347 59.3181 32.0833 178.1204 148 E 3.9305 7.9870 118.6315 59.5612 29.6641 178.4683 149 L 4.4155 7.7805 115.1355 55.0481 41.9027 177.5367 150 G 3.7898 8.2040 107.2661 46.2664 0.0000 173.6768 151 Y 4.5727 8.2590 114.0295 57.1633 39.1690 176.7413 152 Q 4.1378 8.2780 122.7927 58.0808 29.5514 176.0478 153 G 4.0562 8.2747 110.2231 45.7126 0.0000 173.0770 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 8.05 4.10 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 1.06 0.00 0.00 0.95 0.00 0.00 2 L 8.28 3.96 0.00 0.64 0.58 0.55 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.73 4.53 0.00 4.03 3.98 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 0.00 0.00 0.00 4 E 8.85 4.27 0.00 2.07 2.13 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 2.51 2.39 0.00 5 G 8.10 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 6 E 8.21 3.91 0.00 2.02 1.72 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 2.22 2.27 0.00 7 W 8.27 4.43 0.00 3.53 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 8 Q 8.60 4.09 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 9 L 8.00 4.08 0.00 1.97 1.75 0.95 0.79 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 10 V 8.00 3.76 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.90 0.00 0.00 11 L 8.54 4.38 0.00 1.86 1.81 0.93 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.33 4.23 0.00 3.34 3.57 0.00 5.95 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.90 3.75 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 0.99 0.00 0.00 0.81 0.00 0.00 14 W 8.60 3.84 0.00 3.68 3.21 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 15 A 8.25 4.02 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 16 K 7.66 3.67 0.00 1.45 1.55 0.00 1.60 0.00 0.00 1.45 0.00 0.00 2.71 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.48 1.44 7.81 17 V 6.98 3.01 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 0.00 0.00 -0.17 0.00 0.00 0.22 0.00 0.00 18 E 6.97 3.99 0.00 1.90 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 2.21 1.99 0.00 19 A 7.40 4.19 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 20 D 7.93 4.66 0.00 2.65 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.86 3.41 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 1.06 0.00 0.00 0.84 0.00 0.00 22 A 7.99 4.05 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 23 G 8.50 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.22 4.15 0.00 3.29 3.24 0.00 5.82 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 25 G 8.33 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 0.00 0.00 0.00 0.00 26 Q 8.16 3.87 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.46 0.00 27 D 8.00 4.30 0.00 2.73 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 28 I 7.92 3.66 1.87 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 1.51 0.63 0.88 0.00 0.00 29 L 7.78 3.42 0.00 1.26 0.74 0.73 0.44 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 30 I 7.63 3.56 1.84 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 1.36 0.62 0.87 0.00 0.00 31 R 7.91 3.77 0.00 1.88 2.03 0.00 3.06 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 32 L 7.85 3.94 0.00 1.77 1.49 1.09 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 33 F 8.08 4.60 0.00 3.13 2.89 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 34 K 8.19 4.03 0.00 1.74 1.83 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.64 7.81 35 S 8.22 4.31 0.00 3.74 3.57 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 36 H 8.07 4.67 0.00 3.05 2.79 0.00 5.62 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 37 P 0.00 4.51 0.00 2.14 2.09 0.00 3.81 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 38 E 8.24 4.07 0.00 2.29 2.28 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 2.01 2.38 0.00 39 T 8.26 4.01 4.56 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 1.02 0.00 0.00 40 L 7.87 3.59 0.00 1.26 1.74 -0.02 0.64 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 41 E 7.69 3.98 0.00 2.16 2.27 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 2.39 2.45 0.00 42 K 8.02 4.45 0.00 1.96 1.73 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.18 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.75 1.93 7.81 43 F 8.26 4.64 0.00 3.16 2.98 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 0.00 0.00 0.00 44 D 8.63 4.39 0.00 2.63 2.72 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 45 R 7.90 3.82 0.00 1.48 1.17 0.00 2.99 0.00 0.00 2.87 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.29 0.00 46 F 8.07 5.04 0.00 2.88 2.73 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 47 K 8.13 4.17 0.00 1.86 2.20 0.00 1.59 0.00 0.00 1.78 0.00 0.00 3.15 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.45 7.81 48 H 8.06 4.39 0.00 3.31 3.48 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.66 4.17 0.00 1.62 1.59 0.95 0.79 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 50 K 9.43 4.54 0.00 1.76 1.80 0.00 1.65 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.47 7.81 51 T 7.51 4.75 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 52 E 8.65 3.90 0.00 2.04 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 2.36 2.36 0.00 53 A 7.98 3.99 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 54 E 8.17 3.93 0.00 2.12 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 2.36 2.35 0.00 55 M 8.13 4.18 0.00 2.07 2.26 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.61 0.00 56 K 8.25 4.01 0.00 1.82 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.56 7.81 57 A 7.62 4.48 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 58 S 7.52 4.34 0.00 3.95 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 59 E 8.85 4.00 0.00 2.14 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 2.40 2.46 0.00 60 D 8.19 4.42 0.00 2.91 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 61 L 8.14 3.44 0.00 1.46 1.64 -0.14 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.94 3.85 0.00 1.88 1.98 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.36 4.00 0.00 2.14 1.94 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.59 7.81 64 H 8.70 4.42 0.00 3.62 3.49 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 65 G 8.40 3.58 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 0.00 66 V 7.72 3.60 2.27 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 1.13 0.00 0.00 0.98 0.00 0.00 67 T 7.89 3.88 4.37 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 1.27 0.00 0.00 68 V 7.91 3.58 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 1.09 0.00 0.00 0.98 0.00 0.00 69 L 8.18 4.25 0.00 1.81 1.94 0.88 0.78 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 70 T 8.39 3.96 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 1.25 0.00 0.00 71 A 8.01 4.00 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 72 L 8.16 3.75 0.00 1.58 1.68 0.27 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.49 3.21 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 0.00 74 A 7.79 4.00 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 75 I 7.60 3.79 1.90 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.59 0.95 0.00 0.00 76 L 7.89 4.00 0.00 1.19 1.57 -0.09 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.75 4.04 0.00 1.66 1.79 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.50 7.81 78 K 7.85 3.99 0.00 1.82 1.80 0.00 1.77 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.77 7.81 79 K 8.32 2.00 0.00 1.22 0.74 0.00 1.46 0.00 0.00 1.40 0.00 0.00 2.65 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.30 0.70 7.81 80 G 7.99 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 81 H 7.51 4.56 0.00 3.15 3.24 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.31 5.30 0.00 3.27 3.46 0.00 5.66 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 83 E 8.63 3.94 0.00 2.12 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 0.00 2.40 2.47 0.00 84 A 7.93 4.06 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 85 E 8.11 4.11 0.00 2.26 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 2.40 2.47 0.00 86 L 8.15 4.32 0.00 1.74 1.67 0.95 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.89 3.84 0.00 1.83 1.88 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.68 7.81 88 P 0.00 4.31 0.00 2.28 2.31 0.00 3.82 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 2.09 2.03 0.00 89 L 7.50 3.97 0.00 2.00 1.87 0.96 1.18 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 90 A 8.56 4.13 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 91 Q 8.16 3.78 0.00 2.27 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.54 0.00 92 S 8.24 3.95 0.00 3.87 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 93 H 8.64 4.23 0.00 3.49 3.57 0.00 5.81 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 94 A 7.84 2.98 -0.16 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 95 T 7.24 3.72 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 0.78 0.00 0.00 96 K 7.43 4.19 0.00 1.55 1.70 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.17 1.34 7.81 97 H 8.08 4.33 0.00 2.99 3.14 0.00 5.85 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.72 3.75 0.00 1.88 1.87 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.38 7.81 99 I 7.91 4.22 2.04 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 1.32 0.92 1.09 0.00 0.00 100 P 0.00 4.43 0.00 1.69 1.77 0.00 2.30 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.81 0.00 101 I 8.39 3.37 1.70 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.63 0.70 0.00 0.00 102 K 7.92 3.65 0.00 1.75 1.71 0.00 1.57 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 0.69 7.81 103 Y 8.04 4.08 0.00 3.10 3.07 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 0.00 104 L 7.87 4.18 0.00 1.82 1.81 0.64 0.92 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 0.00 105 E 7.87 3.96 0.00 1.94 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 2.44 2.42 0.00 106 F 7.71 4.47 0.00 3.25 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 0.00 107 I 8.17 3.86 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.67 1.10 0.00 0.00 108 S 8.32 4.19 0.00 4.19 3.98 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 0.00 0.00 0.00 109 E 8.56 4.06 0.00 2.29 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 2.66 2.61 0.00 110 A 8.09 4.03 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 0.00 111 I 8.12 3.67 2.10 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.72 1.05 0.00 0.00 112 I 7.95 3.85 2.14 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 1.70 1.10 1.19 0.00 0.00 113 H 8.48 4.14 0.00 3.35 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.04 3.62 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 0.97 0.00 0.00 0.95 0.00 0.00 115 L 8.03 3.76 0.00 1.06 0.44 0.81 0.65 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 0.00 116 H 8.01 4.42 0.00 3.59 3.59 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 0.00 117 S 7.91 4.19 0.00 3.98 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 0.00 118 R 7.86 4.09 0.00 1.46 1.51 0.00 2.73 0.00 0.00 2.69 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.47 0.00 119 H 8.14 5.03 0.00 3.18 3.18 0.00 5.63 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.28 0.00 2.19 2.23 0.00 3.66 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.93 0.00 121 G 8.13 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 0.00 122 D 8.08 5.07 0.00 2.77 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 0.00 123 F 8.04 5.00 0.00 3.03 3.05 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 0.00 124 G 8.08 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 0.00 125 A 8.42 3.90 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 0.00 126 D 7.97 4.19 0.00 2.87 2.90 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 0.00 127 A 7.76 3.99 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 0.00 128 Q 7.84 3.19 0.00 1.95 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 129 G 8.26 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 0.00 0.00 0.00 130 A 7.98 3.86 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 0.00 131 M 8.45 4.01 0.00 2.43 2.45 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.89 0.00 132 N 8.52 4.31 0.00 2.85 2.95 0.00 0.00 7.19 7.22 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 0.00 133 K 8.20 3.89 0.00 1.86 1.66 0.00 1.57 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.50 7.81 134 A 8.11 3.84 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 0.00 135 L 8.31 4.13 0.00 1.75 1.80 0.98 1.06 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 0.00 136 E 8.58 3.99 0.00 2.20 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 2.54 0.00 137 L 8.22 4.01 0.00 1.79 1.96 1.04 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.37 4.13 0.00 3.06 3.25 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 0.00 139 R 8.25 3.53 0.00 2.01 1.85 0.00 3.14 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.97 0.00 140 K 8.46 3.83 0.00 1.74 2.01 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.46 7.81 141 D 8.18 4.36 0.00 2.77 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 0.00 142 I 7.67 3.56 1.32 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.17 0.49 0.00 0.00 143 A 8.22 3.70 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 0.00 144 A 7.92 3.94 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 0.00 145 K 7.85 4.00 0.00 2.05 1.91 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.66 7.81 146 Y 8.57 4.09 0.00 3.05 3.06 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 0.00 0.00 0.00 147 K 8.50 4.00 0.00 2.10 1.99 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.47 7.81 148 E 7.99 3.93 0.00 2.04 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 0.00 2.35 2.39 0.00 149 L 7.78 4.42 0.00 1.96 1.94 0.79 1.06 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 0.00 150 G 8.20 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 0.00 151 Y 8.26 4.57 0.00 2.66 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 0.00 152 Q 8.28 4.14 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.82 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 153 G 8.27 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00