NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4276 8.3044 118.1883 55.0258 32.2851 174.4460 2 L 4.6171 8.9152 135.0000 52.4194 43.1117 168.7572 3 T 3.1270 7.6410 116.4563 61.0667 68.2866 169.6926 4 A 4.7364 8.2996 129.0925 50.6570 20.3078 175.9523 5 E 5.4164 9.0060 121.2066 54.9069 32.2885 176.2867 6 E 4.0237 8.2113 120.1327 56.2637 26.3872 170.6037 7 K 3.3656 7.6775 119.5630 57.0615 32.8929 176.2282 8 A 4.3907 8.2444 127.7429 54.1251 19.7141 176.1116 9 A 3.2637 6.4646 120.9052 54.3360 20.5973 180.0058 10 V 3.3376 8.0205 110.9445 63.4574 32.9413 177.2684 11 T 4.6659 7.1327 111.7902 60.9283 67.3646 174.3324 12 G 3.9943 7.9408 109.2864 47.0676 0.0000 173.0716 13 F 4.3600 7.7411 122.1454 61.7020 41.0745 176.0258 14 W 6.0554 7.7409 123.6527 55.1170 34.7339 176.8585 15 G 3.2995 8.7266 107.0593 47.2757 0.0000 172.6621 16 K 3.9425 9.3679 124.4682 56.6070 28.4496 175.8960 17 V 4.2756 6.6003 112.4683 60.7052 35.4170 171.3440 18 D 4.8237 7.7107 120.7897 52.2787 44.0289 176.7446 19 V 3.8808 8.1555 124.5927 64.4309 33.4592 176.9010 20 D 4.0373 8.6162 112.0361 56.5639 41.9227 176.5053 21 V 3.5829 7.8771 119.7131 65.1686 31.3201 177.9129 22 V 3.6524 7.4304 118.0182 65.9507 31.1239 177.8086 23 G 3.8633 8.1873 104.0104 48.2420 0.0000 174.8590 24 A 3.8698 8.2528 122.6085 54.5622 18.4664 178.8617 25 Q 3.7247 7.7326 115.7518 60.3710 28.7443 179.2852 26 A 4.0432 9.0290 121.8899 54.9975 18.3107 179.2925 27 L 4.1316 9.0360 118.8165 57.2699 42.1374 179.0427 28 G 3.7556 7.8009 105.1116 46.6727 0.0000 176.2509 29 R 3.9233 7.4936 120.0934 58.8520 30.1282 178.7918 30 L 4.1173 7.6713 119.8235 58.3147 41.9872 178.8130 31 L 3.8712 7.1981 116.2518 58.0259 41.6555 179.6974 32 V 3.7269 7.8482 112.1166 64.0553 31.6193 179.0229 33 V 3.6518 7.6711 118.1685 63.7213 32.4949 177.2290 34 Y 3.8347 7.4408 121.9034 53.8602 36.8687 173.9901 35 P 4.2884 0.0000 0.0000 65.2591 31.6866 178.6535 36 W 4.2767 7.7770 115.4562 59.1578 28.7615 177.8142 37 T 4.1120 7.6529 114.5321 65.6530 66.5074 174.9758 38 Q 4.2714 8.4937 120.6368 59.7060 28.6047 178.4199 39 R 3.8170 8.0421 118.9833 59.2256 29.8554 178.1924 40 F 4.5077 7.0540 115.7066 59.5404 40.6645 177.4776 41 F 4.5482 8.1574 118.0813 57.1885 36.2353 175.1284 42 Q 4.4159 7.9467 118.9476 57.0779 30.0214 179.8257 43 H 3.6264 7.0630 112.3548 57.3580 29.5954 175.7148 44 F 4.4257 7.7458 116.3991 58.6289 40.6471 177.8170 45 G 4.1902 8.0049 113.9760 44.6401 0.0000 174.5915 46 N 4.3845 8.7202 126.4730 53.6160 37.3590 173.0974 47 L 4.8479 7.8976 124.6618 54.2639 43.1342 177.8511 48 S 4.4194 7.8149 113.2911 57.2806 62.6653 172.5223 49 S 4.6203 8.6341 110.6972 56.2141 62.9641 173.9586 50 A 3.9195 8.6345 129.4368 53.7226 19.0857 177.6714 51 G 4.2169 7.3440 107.3854 44.9172 0.0000 173.0094 52 A 4.9759 5.8000 123.9373 51.6913 20.5643 179.8083 53 V 3.9913 7.8750 114.7557 64.7822 33.0942 178.2039 54 M 4.0823 8.0499 118.6185 58.2686 32.0110 177.2426 55 N 4.0069 8.3186 115.3148 57.4286 39.8242 175.6389 56 N 3.8223 8.0179 113.9215 53.4884 36.5912 172.2411 57 P 4.1018 0.0000 0.0000 66.6993 31.3546 179.6923 58 K 3.8927 6.6637 113.5917 57.3440 33.3034 178.7275 59 V 2.8743 7.5355 120.5054 66.6113 31.7898 180.1363 60 K 4.2563 8.4441 113.1252 57.6500 33.0768 177.9898 61 A 3.4048 8.1972 116.7058 53.6917 17.9783 178.3364 62 H 3.8206 8.7623 117.3993 58.4994 30.3219 178.1464 63 G 3.6186 8.8612 107.8364 48.4346 0.0000 174.9979 64 K 3.6171 8.4079 117.6242 60.8735 31.9384 177.1932 65 R 4.0572 7.2222 122.2216 58.0767 30.8860 178.6157 66 V 3.9111 7.2139 119.0188 65.7197 31.5963 177.8109 67 L 4.1809 8.4940 118.9729 57.9354 41.3038 179.1773 68 D 4.5703 8.6460 118.1015 57.3981 40.8534 178.5652 69 A 4.2372 7.5156 118.5013 55.1022 18.7257 178.8759 70 F 4.8639 8.5574 118.3959 60.1980 40.4433 176.2494 71 T 3.8112 7.4226 110.5356 63.6740 66.1947 168.8598 72 Q 4.5644 10.0528 125.6283 55.6633 25.3835 177.5626 73 G 3.7694 8.0267 101.3323 49.6809 0.0000 176.6622 74 L 3.8499 7.6089 119.8247 56.8662 43.3043 178.6807 75 K 3.7667 7.3572 108.7383 58.4861 31.4109 178.5460 76 H 4.6881 8.4693 114.7651 53.9325 29.3136 174.9890 77 L 4.0485 8.3425 125.9367 56.5585 41.7139 176.8607 78 D 4.8525 6.9689 122.4489 52.8515 36.0999 176.5530 79 D 4.7714 7.6044 118.1841 51.2790 41.8778 175.8506 80 L 4.0348 8.1318 124.5124 58.0502 42.2691 180.4354 81 K 4.0329 8.3248 115.7449 59.3629 33.1654 178.0301 82 G 4.0234 9.0070 106.6291 46.6711 0.0000 175.2082 83 A 4.1164 8.3957 122.3819 54.7316 19.2179 180.9640 84 F 4.9013 7.7280 112.0478 56.7748 40.0010 178.1093 85 A 4.2343 9.2618 127.4925 55.5227 18.5956 180.3882 86 Q 3.9857 7.6500 113.0400 58.6498 29.1766 178.0606 87 L 4.5685 7.7496 118.2218 54.7294 44.6385 175.9008 88 S 4.5080 9.0763 115.7621 58.1135 61.0049 172.2053 89 G 3.9807 7.3572 110.6986 46.8018 0.0000 173.9437 90 L 3.7724 7.7255 121.0331 56.9684 42.5513 178.6571 91 H 4.2218 8.0138 115.7960 59.0931 28.9987 176.4105 92 C 3.4976 8.0925 120.4407 61.4775 30.7607 174.8511 93 N 4.1308 8.3865 121.2980 56.2023 38.4904 176.3283 94 K 4.0316 6.9431 118.4066 57.6566 32.7261 177.0547 95 L 4.1185 7.3906 119.7186 55.8021 41.3198 173.8087 96 H 3.9562 7.6163 119.0520 56.5736 25.4508 172.7963 97 V 3.8211 7.6511 121.7340 60.5021 32.5030 174.8010 98 N 4.1266 9.1269 124.5721 54.2191 38.1999 174.8482 99 P 4.0722 0.0000 0.0000 65.0934 32.2729 178.1305 100 Q 3.8751 7.8712 118.7631 59.3826 29.0266 177.7012 101 N 4.2126 8.0395 117.6525 56.2816 38.5520 177.4663 102 F 4.4748 8.7795 119.8893 60.7805 39.3531 177.5807 103 R 4.2187 7.8840 116.1128 57.5257 30.0357 179.0136 104 L 3.8038 7.5160 119.6884 57.6336 41.8584 178.6415 105 L 4.3638 7.8298 118.9301 56.7133 42.3305 178.7303 106 G 3.5750 7.5624 105.4446 47.6419 0.0000 175.3878 107 N 4.3514 8.0861 119.2089 56.5743 38.8522 176.8505 108 V 3.8397 7.5391 118.2856 67.0533 31.6899 176.7466 109 L 4.0892 8.5989 119.8665 55.8290 41.5356 180.0175 110 A 3.9052 8.3431 119.7166 54.2219 19.1529 179.0726 111 L 4.0468 7.3471 116.4025 58.1407 42.3462 179.2043 112 V 3.7926 7.5570 110.1673 63.7148 31.7106 178.4850 113 V 3.8325 7.4859 112.2438 63.7397 31.5059 177.5812 114 A 4.1500 9.3908 116.0925 52.7531 17.6954 178.6278 115 R 4.0658 7.7728 119.8527 61.0044 30.8653 179.4116 116 N 3.4888 6.5258 111.9328 54.4186 39.6218 175.0569 117 F 4.5986 8.3672 114.7875 56.7578 41.1154 177.9543 118 G 3.9908 8.0222 108.9614 45.4859 0.0000 176.0404 119 G 3.6442 8.9224 108.2880 48.6830 0.0000 174.4882 120 Q 4.1883 8.4676 118.1492 59.0468 29.2152 177.8721 121 F 4.5630 8.1140 120.3973 57.3310 38.8770 174.2422 122 T 3.9134 7.7387 111.6667 60.6563 69.6893 173.0470 123 P 4.2063 0.0000 0.0000 65.5741 32.9965 178.9269 124 N 4.3165 8.7498 112.0118 55.1925 37.7097 177.0986 125 V 3.3580 6.1302 126.3389 65.5604 32.4077 179.4581 126 Q 3.2616 8.2863 122.0098 58.3591 28.4478 177.2330 127 A 4.1440 7.9045 120.8259 53.5789 18.4937 179.5027 128 L 3.2157 7.5821 110.8216 57.5074 42.1521 179.2898 129 F 4.2475 8.7345 119.2821 60.1768 39.0294 177.6313 130 Q 4.1585 8.4467 118.6401 58.7139 29.1974 177.6261 131 K 4.3070 8.1086 118.6099 57.0751 32.2835 178.5583 132 V 3.6310 8.1486 113.0993 64.7338 31.3937 178.2865 133 V 3.9061 8.0936 111.8946 63.1781 31.1291 177.7479 134 A 4.1924 8.4571 119.8275 53.4975 17.5986 179.3230 135 G 3.4542 5.3800 110.1616 47.0258 0.0000 175.1911 136 V 3.5950 9.0291 121.0101 64.1978 32.6694 175.5667 137 A 4.7316 7.8481 119.1359 50.8514 18.7543 173.3908 138 N 4.6870 7.4892 120.1557 55.2627 41.6723 179.0275 139 A 3.7219 8.1393 120.2001 54.9466 19.3766 179.1251 140 L 3.6069 7.4679 114.3518 58.0456 41.7604 179.3962 141 A 3.1747 8.2456 120.0189 53.6391 18.4214 176.5226 142 H 4.9441 7.8966 113.8721 55.0176 28.0744 174.2702 143 K 4.1410 9.4346 134.6304 57.3110 35.0259 178.1114 144 Y 2.8047 8.0242 114.8243 54.7156 42.0327 174.9284 145 H 4.7526 9.5672 118.9219 56.1104 30.4783 174.9045 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 4.43 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.50 0.00 2 L 8.92 4.62 0.00 1.68 1.67 0.92 0.68 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 3 T 7.64 3.13 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 4 A 8.30 4.74 1.22 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 0.00 0.00 5 E 9.01 5.42 0.00 1.88 1.79 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 2.16 2.23 0.00 6 E 8.21 4.02 0.00 2.03 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 7 K 7.68 3.37 0.00 1.86 2.12 0.00 1.54 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.14 1.12 7.81 8 A 8.24 4.39 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 9 A 6.46 3.26 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 10 V 8.02 3.34 1.87 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 0.76 0.00 0.00 0.64 0.00 0.00 11 T 7.13 4.67 4.60 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 0.33 0.00 0.00 12 G 7.94 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 0.00 0.00 0.00 13 F 7.74 4.36 0.00 3.13 3.29 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 14 W 7.74 6.06 0.00 3.60 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 15 G 8.73 3.30 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 0.00 16 K 9.37 3.94 0.00 1.75 2.19 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 1.37 7.81 17 V 6.60 4.28 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 0.01 0.00 0.00 -0.06 0.00 0.00 18 D 7.71 4.82 0.00 2.53 2.36 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 19 V 8.16 3.88 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 0.95 0.00 0.00 0.89 0.00 0.00 20 D 8.62 4.04 0.00 2.81 2.77 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 0.00 0.00 0.00 0.00 21 V 7.88 3.58 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 0.80 0.00 0.00 0.87 0.00 0.00 22 V 7.43 3.65 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 0.99 0.00 0.00 0.91 0.00 0.00 23 G 8.19 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 24 A 8.25 3.87 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 25 Q 7.73 3.72 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 26 A 9.03 4.04 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 27 L 9.04 4.13 0.00 2.04 1.69 1.19 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 28 G 7.80 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 29 R 7.49 3.92 0.00 2.10 2.00 0.00 3.29 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.97 0.00 30 L 7.67 4.12 0.00 1.84 1.72 0.84 0.85 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 31 L 7.20 3.87 0.00 1.55 1.42 -0.79 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.85 3.73 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 0.78 0.00 0.00 0.86 0.00 0.00 33 V 7.67 3.65 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 0.64 0.00 0.00 0.31 0.00 0.00 34 Y 7.44 3.83 0.00 1.88 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 35 P 0.00 4.29 0.00 2.18 2.16 0.00 3.63 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 36 W 7.78 4.28 0.00 3.38 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 37 T 7.65 4.11 4.35 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 1.43 0.00 0.00 38 Q 8.49 4.27 0.00 2.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 39 R 8.04 3.82 0.00 1.69 1.48 0.00 3.22 0.00 0.00 3.13 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 40 F 7.05 4.51 0.00 2.85 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 41 F 8.16 4.55 0.00 2.60 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 42 Q 7.95 4.42 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.49 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 43 H 7.06 3.63 0.00 2.87 3.08 0.00 5.75 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 44 F 7.75 4.43 0.00 3.21 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 45 G 8.00 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.72 4.38 0.00 2.68 2.78 0.00 0.00 6.62 7.78 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 47 L 7.90 4.85 0.00 1.57 1.56 0.84 1.02 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 48 S 7.81 4.42 0.00 3.84 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.63 4.62 0.00 4.06 4.19 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 0.00 0.00 0.00 50 A 8.63 3.92 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 51 G 7.34 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 0.00 0.00 0.00 0.00 52 A 5.80 4.98 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 53 V 7.88 3.99 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 0.74 0.00 0.00 0.89 0.00 0.00 54 M 8.05 4.08 0.00 1.95 2.24 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.79 0.00 55 N 8.32 4.01 0.00 2.64 2.79 0.00 0.00 7.07 7.79 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 56 N 8.02 3.82 0.00 2.83 2.82 0.00 0.00 7.05 9.04 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 57 P 0.00 4.10 0.00 2.21 2.29 0.00 3.76 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 2.00 1.98 0.00 58 K 6.66 3.89 0.00 1.43 1.24 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.39 1.31 7.81 59 V 7.54 2.87 1.87 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 0.66 0.00 0.00 0.48 0.00 0.00 60 K 8.44 4.26 0.00 2.12 1.66 0.00 1.92 0.00 0.00 1.94 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.51 7.81 61 A 8.20 3.40 1.45 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 0.00 0.00 62 H 8.76 3.82 0.00 3.81 3.75 0.00 5.78 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 63 G 8.86 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 64 K 8.41 3.62 0.00 2.29 1.83 0.00 1.63 0.00 0.00 2.00 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.67 7.81 65 R 7.22 4.06 0.00 1.85 1.98 0.00 3.41 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 66 V 7.21 3.91 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 1.11 0.00 0.00 1.09 0.00 0.00 67 L 8.49 4.18 0.00 1.77 1.85 1.05 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.65 4.57 0.00 2.79 2.82 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 0.00 0.00 0.00 69 A 7.52 4.24 1.61 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 70 F 8.56 4.86 0.00 3.26 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 71 T 7.42 3.81 4.77 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 0.00 0.00 0.00 2.31 0.00 0.00 72 Q 10.05 4.56 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.27 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 73 G 8.03 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.61 3.85 0.00 1.39 1.47 0.12 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.36 3.77 0.00 1.62 0.74 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.17 7.81 76 H 8.47 4.69 0.00 3.23 3.19 0.00 5.77 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.34 4.05 0.00 1.71 1.67 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 78 D 6.97 4.85 0.00 2.84 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 79 D 7.60 4.77 0.00 2.76 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 0.00 0.00 0.00 0.00 80 L 8.13 4.03 0.00 1.75 1.84 0.99 0.87 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 81 K 8.32 4.03 0.00 1.88 2.01 0.00 1.42 0.00 0.00 2.04 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.42 7.81 82 G 9.01 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 0.00 0.00 0.00 83 A 8.40 4.12 1.02 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 0.00 0.00 84 F 7.73 4.90 0.00 3.30 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 85 A 9.26 4.23 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 86 Q 7.65 3.99 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 87 L 7.75 4.57 0.00 1.85 1.68 1.01 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 88 S 9.08 4.51 0.00 3.98 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 G 7.36 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 0.00 0.00 0.00 90 L 7.73 3.77 0.00 1.74 1.93 1.01 0.96 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 91 H 8.01 4.22 0.00 3.15 3.56 0.00 5.87 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 92 C 8.09 3.50 0.00 2.15 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 93 N 8.39 4.13 0.00 2.58 2.78 0.00 0.00 7.09 7.49 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 94 K 6.94 4.03 0.00 1.58 1.67 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.50 7.81 95 L 7.39 4.12 0.00 1.63 1.69 0.34 0.60 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 96 H 7.62 3.96 0.00 3.40 3.45 0.00 5.78 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 7.65 3.82 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 0.05 0.00 0.00 0.31 0.00 0.00 98 N 9.13 4.13 0.00 2.99 2.72 0.00 0.00 7.11 8.03 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 99 P 0.00 4.07 0.00 1.97 1.84 0.00 3.93 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.32 0.00 100 Q 7.87 3.88 0.00 2.11 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 101 N 8.04 4.21 0.00 2.59 2.82 0.00 0.00 7.16 8.77 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 0.00 102 F 8.78 4.47 0.00 2.99 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 0.00 103 R 7.88 4.22 0.00 1.93 1.97 0.00 3.18 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 104 L 7.52 3.80 0.00 1.73 1.35 0.62 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.83 4.36 0.00 1.77 1.65 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.56 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 0.00 107 N 8.09 4.35 0.00 3.03 2.82 0.00 0.00 6.84 7.08 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 0.00 108 V 7.54 3.84 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 0.95 0.00 0.00 1.08 0.00 0.00 109 L 8.60 4.09 0.00 1.92 1.78 1.28 1.37 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 0.00 110 A 8.34 3.91 1.62 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 0.00 111 L 7.35 4.05 0.00 1.71 1.69 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 112 V 7.56 3.79 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 0.85 0.00 0.00 0.93 0.00 0.00 113 V 7.49 3.83 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 1.09 0.00 0.00 1.01 0.00 0.00 114 A 9.39 4.15 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.77 4.07 0.00 1.90 1.95 0.00 3.26 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 116 N 6.53 3.49 0.00 2.58 2.49 0.00 0.00 6.73 7.45 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 0.00 117 F 8.37 4.60 0.00 3.24 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.02 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 0.00 0.00 0.00 119 G 8.92 3.64 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 0.00 0.00 0.00 120 Q 8.47 4.19 0.00 2.71 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.69 0.00 0.00 0.00 0.00 0.00 2.59 2.57 0.00 121 F 8.11 4.56 0.00 2.90 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 0.00 122 T 7.74 3.91 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 1.27 0.00 0.00 123 P 0.00 4.21 0.00 2.18 2.13 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 124 N 8.75 4.32 0.00 2.73 2.53 0.00 0.00 6.81 7.68 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 0.00 125 V 6.13 3.36 1.85 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 0.70 0.00 0.00 0.74 0.00 0.00 126 Q 8.29 3.26 0.00 1.48 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 127 A 7.90 4.14 1.20 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 0.00 0.00 0.00 128 L 7.58 3.22 0.00 1.66 1.60 0.78 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.73 4.25 0.00 3.40 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 0.00 130 Q 8.45 4.16 0.00 2.30 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 131 K 8.11 4.31 0.00 1.82 1.69 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.43 7.81 132 V 8.15 3.63 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 0.59 0.00 0.00 0.53 0.00 0.00 133 V 8.09 3.91 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.16 0.00 0.00 134 A 8.46 4.19 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 G 5.38 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 0.00 0.00 0.00 136 V 9.03 3.59 2.38 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 0.25 0.00 0.00 0.92 0.00 0.00 137 A 7.85 4.73 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 138 N 7.49 4.69 0.00 2.85 2.83 0.00 0.00 6.97 7.29 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 0.00 139 A 8.14 3.72 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 0.00 140 L 7.47 3.61 0.00 1.19 1.29 0.26 -0.14 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 0.00 141 A 8.25 3.17 0.98 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 0.00 0.00 142 H 7.90 4.94 0.00 3.16 3.35 0.00 5.95 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 K 9.43 4.14 0.00 1.68 1.79 0.00 1.82 0.00 0.00 1.64 0.00 0.00 3.30 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.20 7.81 144 Y 8.02 2.80 0.00 3.21 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 0.00 145 H 9.57 4.75 0.00 3.55 3.72 0.00 5.81 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