NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 W 4.8869 8.2744 130.5291 56.7055 31.8619 174.7247 5 V 3.2494 6.6271 125.5390 60.3157 31.9657 173.2624 6 P 4.5633 0.0000 0.0000 61.8049 33.2601 175.1309 7 P 4.4897 0.0000 0.0000 65.8203 31.3750 178.6953 8 E 4.0194 8.3387 117.7506 59.3915 29.3240 179.1597 9 V 3.5115 7.8168 118.0889 66.0159 31.1695 178.1576 10 F 4.0596 7.9650 116.5613 60.2113 38.9054 176.8973 11 D 4.5110 7.9859 117.1940 57.4272 40.9271 178.3374 12 L 4.0888 7.9270 117.2671 56.8671 41.9561 178.5902 13 V 4.3065 7.5154 110.2950 61.2066 32.0532 177.5507 14 A 4.0751 7.7573 121.8950 55.2413 18.2745 179.4034 15 E 3.9042 8.1365 117.2197 59.6160 29.8233 178.5876 16 D 4.3923 8.1379 118.5203 56.9721 40.8291 178.4714 17 K 4.0197 8.7045 120.4746 59.4851 32.2996 178.6237 18 A 4.0144 8.2168 121.0643 55.2489 18.2609 179.5609 19 R 3.8619 8.1058 117.0963 59.8718 29.7704 178.0950 20 C 4.3971 8.4864 116.4417 60.3275 35.0842 176.0564 21 M 4.2058 8.5258 121.8617 57.9343 31.3154 178.7991 22 S 4.1169 8.0180 112.2721 61.4449 62.6620 175.7096 23 E 4.0590 8.4407 120.6826 58.7949 29.6243 177.9920 24 H 4.9427 8.0295 113.1719 54.5585 29.6900 175.4144 25 G 3.9317 8.1230 108.2838 46.3952 0.0000 173.7888 26 T 4.2504 7.8379 116.7169 63.1590 69.1203 174.1797 27 T 4.6220 8.6038 115.7045 59.6695 71.2219 175.4411 28 Q 3.8258 8.5082 122.9987 59.2922 28.9867 178.5179 29 A 3.9659 7.9224 121.4630 55.1778 18.4374 179.4502 30 Q 3.9565 8.0161 116.4912 59.0634 28.6671 179.0688 31 I 3.6628 7.4047 120.9511 64.4968 37.1660 178.1638 32 D 4.3556 8.3297 119.9882 57.4064 40.5379 178.6620 33 D 4.3672 8.2222 119.3370 57.3957 40.7913 178.8845 34 V 3.9095 7.7144 119.9635 65.7389 31.3338 177.8324 35 D 4.4765 8.2256 117.0900 56.5565 40.6676 177.7951 36 K 4.4799 7.9056 117.4821 56.0776 32.1891 177.5755 37 G 3.8779 8.2798 107.7212 45.5746 0.0000 173.4389 38 N 4.7498 8.5329 118.6557 51.3956 38.7052 173.7476 39 L 4.9944 8.4513 125.2741 52.8751 44.6248 175.8601 40 V 4.5907 8.3067 124.4138 59.8726 34.6392 175.3080 41 N 3.6673 8.1097 120.0868 52.5217 37.6265 175.4585 42 E 4.5408 7.3977 119.5383 54.1139 32.3759 174.9387 43 P 4.7821 0.0000 0.0000 65.0495 31.1932 178.7072 44 S 4.8669 8.0702 113.1486 60.3232 63.0772 175.3767 45 I 4.2586 7.6151 121.1938 62.9200 38.6424 177.4516 46 T 4.0408 8.2267 111.0538 65.2217 68.5889 176.0111 47 C 4.4095 8.6672 119.7536 59.2768 41.3226 175.4740 48 Y 3.9850 7.9183 121.1257 60.9284 38.5254 177.7362 49 M 3.9122 8.2616 119.6307 58.4387 32.0108 178.0345 50 Y 4.0365 7.9971 119.6375 60.7878 38.9473 177.2024 51 C 3.9549 8.2362 119.4531 59.7158 41.9425 175.4617 52 L 3.2590 7.3875 121.6219 57.7666 41.5100 178.7848 53 L 3.8553 7.5048 118.9343 57.6941 41.5459 179.1804 54 E 3.6091 7.8271 119.2313 59.0060 29.2856 178.6135 55 A 3.9732 7.4560 119.7883 54.0968 18.2315 178.0541 56 F 5.0354 6.7617 112.8501 56.9800 39.3163 175.5694 57 S 3.7755 7.7971 114.5161 59.6487 60.9612 173.6936 58 L 4.3431 8.0274 121.0760 56.1217 42.0349 177.3714 59 V 5.4984 7.5192 109.4639 58.4304 35.9419 174.9763 60 D 4.9398 8.2254 121.5102 52.1171 41.7489 176.3185 61 D 4.7354 8.7104 117.2438 55.6230 39.5511 176.3011 62 E 4.8681 8.8994 119.0066 54.8210 30.2413 175.8702 63 A 4.2934 8.1161 119.0748 53.2817 16.8833 178.2222 64 N 4.5876 7.8425 117.2382 54.4371 39.3184 174.9998 65 V 4.3465 8.2320 122.9315 62.2576 32.6227 176.1278 66 D 4.6105 8.9623 127.4565 53.2581 40.3653 176.2113 67 E 3.9871 8.5001 127.4489 58.8371 29.8189 177.8683 68 D 4.3188 8.1184 118.5390 57.5179 40.8080 178.5845 69 I 3.7110 7.6309 118.4252 64.5212 37.3154 177.8943 70 M 4.1809 8.1976 118.9739 58.5456 32.1208 178.1172 71 L 4.0078 8.3799 119.6687 57.9616 41.6858 179.8560 72 G 3.7392 8.2316 104.0498 47.3308 0.0000 174.8049 73 L 4.2975 7.4473 119.0107 54.9986 42.2283 176.8418 74 L 4.3638 6.9796 118.7645 52.1783 43.2562 174.7750 75 P 4.3962 0.0000 0.0000 62.4300 32.1570 176.7095 76 D 4.2877 8.8603 119.5753 57.8524 40.7725 178.7297 77 Q 4.0887 7.9391 115.4735 58.1441 29.1502 177.1047 78 L 4.2663 7.7599 120.4457 55.8379 42.1290 178.6109 79 Q 3.9477 7.6793 118.8081 58.7078 28.5833 178.2762 80 E 3.8991 8.0443 119.1389 59.5396 29.5258 179.2862 81 R 3.8626 7.9075 117.8906 59.1936 30.1163 178.2493 82 A 3.9474 8.3912 121.0245 55.2720 18.4497 179.4251 83 Q 3.9188 8.4503 117.0177 59.1980 28.6650 179.2979 84 S 4.0754 8.1831 114.1023 61.4834 62.4347 176.6042 85 V 3.6642 8.0520 122.0627 65.2219 31.0284 178.1465 86 M 4.2315 8.5061 119.4462 57.7107 31.5454 178.9376 87 G 3.6041 7.9710 105.6557 47.4832 0.0000 175.5187 88 K 4.1062 7.7103 120.9205 59.1766 32.4751 177.6278 89 C 4.6040 8.2110 113.4333 56.1012 40.9496 173.4212 90 L 4.9073 7.1978 120.7410 51.7887 43.9007 174.6302 91 P 4.5239 0.0000 0.0000 62.4151 32.1432 176.4085 92 T 4.1693 8.1595 109.9520 61.8331 69.4873 173.8692 93 S 4.6029 8.2081 116.1715 56.3692 65.9990 173.5679 94 G 3.9330 7.8566 110.2821 45.7621 0.0000 172.5945 95 S 4.2370 8.4152 113.1461 60.0562 63.5698 173.6505 96 D 4.3397 7.1878 119.6767 52.0168 42.1236 176.1001 97 N 4.1623 8.0139 116.0891 56.3661 38.2578 178.4226 98 C 4.3213 7.9627 117.5652 60.1027 41.1734 175.5186 99 N 4.2473 8.4459 118.6181 56.3924 38.4947 176.9879 100 K 4.2417 8.3561 121.9160 59.0713 32.1735 179.2849 101 I 3.8998 7.6165 119.5339 64.0787 37.0009 177.6472 102 Y 4.0610 8.2298 120.6332 60.9953 38.5984 178.1622 103 N 4.0065 8.4215 117.3566 55.9312 38.4847 177.2316 104 L 3.6801 7.8099 121.4734 57.9819 42.1382 178.7581 105 A 2.0000 7.5859 120.8444 54.3242 18.0748 179.7036 106 K 3.6845 7.4906 116.9411 59.6303 32.1355 178.5808 107 C 4.0744 7.8591 118.6155 59.6808 41.7313 175.8909 108 V 3.5357 7.7293 119.8410 66.1577 30.9681 177.8523 109 Q 3.9683 7.9292 116.7341 59.3004 28.6372 178.7274 110 E 4.0906 8.4458 118.7696 58.8824 29.4910 178.7989 111 S 4.7250 7.6091 113.2993 59.3520 64.6079 174.6674 112 A 4.5124 9.0099 126.3727 50.3167 19.8655 174.6685 113 P 4.2076 0.0000 0.0000 66.8109 31.8401 178.2766 114 D 4.7782 8.0011 116.1331 55.9373 41.2103 178.0589 115 V 3.7733 7.8129 119.4650 65.6790 31.7221 177.0219 116 W 4.3987 7.8300 131.1888 56.0940 28.7450 173.8085 117 F 4.7746 8.1720 123.0968 55.6698 40.9002 174.9196 118 V 3.9538 7.5791 126.7787 60.6103 33.3145 175.5193 119 I 3.8676 8.1027 126.7033 61.6725 36.9291 175.8208 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 4 W 8.27 4.89 0.00 3.32 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 5 V 6.63 3.25 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 -0.06 0.00 0.00 6 P 0.00 4.56 0.00 2.44 2.21 0.00 3.79 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.04 0.00 7 P 0.00 4.49 0.00 2.22 2.14 0.00 3.63 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 8 E 8.34 4.02 0.00 2.06 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 2.41 2.44 0.00 9 V 7.82 3.51 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 0.73 0.00 0.00 0.86 0.00 0.00 10 F 7.96 4.06 0.00 3.21 3.12 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 11 D 7.99 4.51 0.00 2.78 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 12 L 7.93 4.09 0.00 1.53 1.61 0.84 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.52 4.31 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 0.63 0.00 0.00 1.01 0.00 0.00 14 A 7.76 4.08 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.14 3.90 0.00 2.08 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 2.40 2.42 0.00 16 D 8.14 4.39 0.00 2.85 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 17 K 8.70 4.02 0.00 1.97 2.07 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.76 7.81 18 A 8.22 4.01 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 19 R 8.11 3.86 0.00 1.92 2.05 0.00 3.20 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 20 C 8.49 4.40 0.00 3.26 3.14 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 21 M 8.53 4.21 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.02 0.00 22 S 8.02 4.12 0.00 3.89 4.02 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 23 E 8.44 4.06 0.00 1.92 1.67 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 2.30 2.51 0.00 24 H 8.03 4.94 0.00 3.37 3.37 0.00 5.67 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 8.12 3.93 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 0.00 0.00 0.00 26 T 7.84 4.25 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 0.79 0.00 0.00 27 T 8.60 4.62 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 1.18 0.00 0.00 28 Q 8.51 3.83 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 29 A 7.92 3.97 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 30 Q 8.02 3.96 0.00 2.25 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 31 I 7.40 3.66 1.90 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.47 0.87 0.00 0.00 32 D 8.33 4.36 0.00 2.83 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 33 D 8.22 4.37 0.00 2.98 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 34 V 7.71 3.91 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 1.58 0.00 0.00 1.12 0.00 0.00 35 D 8.23 4.48 0.00 2.82 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.91 4.48 0.00 1.90 1.88 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.72 7.81 37 G 8.28 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 38 N 8.53 4.75 0.00 2.99 2.81 0.00 0.00 6.40 6.28 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 39 L 8.45 4.99 0.00 1.58 1.53 1.12 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.31 4.59 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.90 0.00 0.00 41 N 8.11 3.67 0.00 1.55 2.39 0.00 0.00 6.91 7.65 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 42 E 7.40 4.54 0.00 1.97 1.82 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 0.00 2.26 2.29 0.00 43 P 0.00 4.78 0.00 2.15 2.11 0.00 3.84 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 44 S 8.07 4.87 0.00 4.05 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 45 I 7.62 4.26 1.90 0.00 0.00 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 1.77 1.40 1.04 0.00 0.00 46 T 8.23 4.04 4.52 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 1.30 0.00 0.00 47 C 8.67 4.41 0.00 3.01 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 48 Y 7.92 3.98 0.00 3.23 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 49 M 8.26 3.91 0.00 2.38 2.43 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.06 2.78 0.00 50 Y 8.00 4.04 0.00 3.11 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 51 C 8.24 3.95 0.00 3.16 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 52 L 7.39 3.26 0.00 1.22 1.16 0.67 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.50 3.86 0.00 1.66 1.57 1.11 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 54 E 7.83 3.61 0.00 1.19 1.65 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 2.13 2.28 0.00 55 A 7.46 3.97 0.94 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 56 F 6.76 5.04 0.00 3.00 2.87 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 57 S 7.80 3.78 0.00 4.03 3.93 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 58 L 8.03 4.34 0.00 1.83 1.73 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.52 5.50 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 0.57 0.00 0.00 0.62 0.00 0.00 60 D 8.23 4.94 0.00 2.93 2.86 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 61 D 8.71 4.74 0.00 2.85 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 62 E 8.90 4.87 0.00 2.03 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 2.19 2.16 0.00 63 A 8.12 4.29 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 64 N 7.84 4.59 0.00 3.05 2.78 0.00 0.00 6.68 7.56 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 65 V 8.23 4.35 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 0.86 0.00 0.00 1.03 0.00 0.00 66 D 8.96 4.61 0.00 2.72 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 67 E 8.50 3.99 0.00 2.10 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 2.38 2.41 0.00 68 D 8.12 4.32 0.00 2.88 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 69 I 7.63 3.71 2.00 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 1.41 0.68 0.93 0.00 0.00 70 M 8.20 4.18 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 71 L 8.38 4.01 0.00 1.85 1.68 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.23 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.45 4.30 0.00 1.78 1.77 0.94 1.35 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 74 L 6.98 4.36 0.00 1.55 1.18 0.69 0.06 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 75 P 0.00 4.40 0.00 2.16 2.21 0.00 3.01 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.91 0.00 76 D 8.86 4.29 0.00 2.78 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 77 Q 7.94 4.09 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.71 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 78 L 7.76 4.27 0.00 1.53 1.41 -0.19 0.66 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 79 Q 7.68 3.95 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 80 E 8.04 3.90 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 81 R 7.91 3.86 0.00 1.84 2.02 0.00 3.17 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 1.69 1.69 0.00 82 A 8.39 3.95 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 83 Q 8.45 3.92 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 84 S 8.18 4.08 0.00 3.96 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 0.00 85 V 8.05 3.66 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 1.05 0.00 0.00 0.96 0.00 0.00 86 M 8.51 4.23 0.00 2.14 2.33 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.62 0.00 87 G 7.97 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 88 K 7.71 4.11 0.00 1.72 2.03 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.46 7.81 89 C 8.21 4.60 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 90 L 7.20 4.91 0.00 1.75 1.57 0.96 0.90 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 91 P 0.00 4.52 0.00 2.18 2.06 0.00 3.76 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 1.98 1.95 0.00 92 T 8.16 4.17 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 1.25 0.00 0.00 93 S 8.21 4.60 0.00 3.96 3.93 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 94 G 7.86 3.93 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 0.00 0.00 0.00 95 S 8.42 4.24 0.00 3.97 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 7.19 4.34 0.00 2.81 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 97 N 8.01 4.16 0.00 2.12 1.42 0.00 0.00 6.85 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 98 C 7.96 4.32 0.00 3.06 3.12 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 99 N 8.45 4.25 0.00 2.82 2.80 0.00 0.00 7.27 7.12 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 0.00 100 K 8.36 4.24 0.00 2.02 1.87 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.46 7.81 101 I 7.62 3.90 2.15 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.20 1.18 0.00 0.00 102 Y 8.23 4.06 0.00 3.04 3.15 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 0.00 103 N 8.42 4.01 0.00 2.92 2.77 0.00 0.00 6.72 6.98 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 0.00 104 L 7.81 3.68 0.00 1.74 1.61 0.88 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.59 2.00 0.55 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 0.00 106 K 7.49 3.68 0.00 1.52 1.74 0.00 0.89 0.00 0.00 0.88 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.09 0.64 7.81 107 C 7.86 4.07 0.00 2.96 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 0.00 108 V 7.73 3.54 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 1.25 0.00 0.00 1.00 0.00 0.00 109 Q 7.93 3.97 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 110 E 8.45 4.09 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 111 S 7.61 4.72 0.00 3.84 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 0.00 112 A 9.01 4.51 1.24 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 0.00 0.00 113 P 0.00 4.21 0.00 2.26 2.18 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 114 D 8.00 4.78 0.00 2.76 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 0.00 115 V 7.81 3.77 2.34 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 0.84 0.00 0.00 0.93 0.00 0.00 116 W 7.83 4.40 0.00 3.53 3.15 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 0.00 117 F 8.17 4.77 0.00 3.05 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 7.58 3.95 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 0.95 0.00 0.00 0.82 0.00 0.00 119 I 8.10 3.87 1.83 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.67 0.83 0.00 0.00