NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.1975 8.1693 122.4865 55.1237 42.3709 175.8924 2 S 4.5979 7.9269 121.0536 55.3634 67.2033 172.8683 3 A 3.9651 8.2509 122.9905 55.1440 18.4486 180.6568 4 D 4.2461 7.9340 117.3900 56.8852 39.5881 178.7732 5 Q 3.9538 7.9021 119.1348 58.4023 28.9388 178.4513 6 I 3.5749 7.7262 121.2968 64.2061 37.1138 178.6426 7 S 4.0912 8.1649 115.2626 61.5735 62.8989 176.5869 8 T 3.7822 7.6570 118.9614 66.4984 68.2008 176.7443 9 V 2.9295 7.4618 119.9876 65.7107 31.2416 178.0546 10 Q 4.1232 7.8549 117.2331 58.4410 28.3932 178.1927 11 A 4.0333 7.8852 121.3009 55.1738 18.1834 179.3748 12 S 4.3593 8.0323 111.6275 61.6609 62.6461 176.2167 13 F 4.6515 9.1109 123.7189 61.2090 38.8908 176.5774 14 D 4.3566 7.9011 117.4066 57.0503 41.0417 178.0325 15 K 4.1723 7.7805 117.3558 58.3607 32.3178 178.4949 16 V 4.4046 7.4758 110.5855 60.7739 32.9401 177.4281 17 K 3.6837 7.7127 117.1972 58.6326 32.5577 177.6870 18 G 3.8653 7.8508 107.4336 45.8316 0.0000 173.2085 19 D 4.9802 8.0074 118.7950 51.3833 41.4489 174.5739 20 P 4.2815 0.0000 0.0000 66.4847 31.2887 178.3504 21 V 3.7079 7.7788 117.3120 65.7200 31.6678 178.0054 22 G 3.8607 8.1619 106.6328 47.2386 0.0000 175.6791 23 I 3.0888 7.0553 121.1187 63.7362 37.1167 178.1864 24 L 3.5698 7.6739 121.2534 57.8606 41.7873 178.1804 25 Y 4.1198 8.3410 119.6367 60.8544 38.7219 178.0194 26 A 3.9165 8.0722 121.4485 55.1897 18.2790 179.8842 27 V 3.3830 7.5051 116.3626 66.1847 31.4044 178.3513 28 F 4.4796 7.9876 116.5038 60.5455 38.7474 177.3150 29 K 3.9626 7.9141 118.3597 59.1266 31.9738 178.5252 30 A 4.3945 7.6299 120.2694 53.8201 18.9385 176.8732 31 D 4.4543 7.9930 117.8022 51.2444 42.4130 173.6751 32 P 4.3176 0.0000 0.0000 65.1254 30.9610 177.9598 33 S 4.2843 8.1997 113.2601 60.6389 63.3886 176.2690 34 I 4.0036 7.8840 124.3174 64.7295 37.1384 177.6466 35 M 2.9555 7.8207 118.2696 58.3106 31.7058 177.5823 36 A 4.2317 7.8235 118.8621 53.8728 18.6318 178.7036 37 K 4.2866 7.9123 115.2437 56.0939 32.7167 176.5516 38 F 4.6166 7.9254 119.9277 55.6773 39.7899 176.8435 39 T 3.8645 8.5720 116.8875 64.6614 68.5714 175.2523 40 Q 4.0225 7.8249 121.3226 57.4225 29.3511 175.8912 41 F 5.1178 7.7008 114.0046 57.3240 41.2410 175.2203 42 A 4.0778 8.0684 124.0140 53.2896 18.5517 177.4259 43 G 3.9298 8.8818 108.5222 46.0364 0.0000 173.0590 44 K 4.5890 7.6558 117.9686 54.0621 35.4263 174.8382 45 D 4.7004 8.2652 119.1265 52.8596 42.0443 176.4586 46 L 3.9603 8.6935 128.5590 58.5958 41.7975 178.7662 47 E 4.0872 8.2882 116.9291 59.3103 29.4955 178.9178 48 S 4.2786 7.9562 114.9516 60.7667 63.2604 175.8955 49 I 4.0065 7.5548 114.7486 62.0574 37.6754 177.6166 50 K 2.4800 7.2655 121.9047 59.1073 31.8739 177.1244 51 G 3.9188 7.7732 104.5199 45.7783 0.0000 173.5413 52 T 4.5830 7.7318 110.8863 59.6034 72.2949 175.2358 53 A 4.0839 8.4432 123.1585 54.9592 18.4501 178.2918 54 P 4.4097 0.0000 0.0000 65.5050 31.3678 178.6096 55 F 4.2152 8.1538 119.5638 61.4147 39.3678 176.8054 56 E 4.0065 8.2455 119.0876 59.5210 29.2751 178.8806 57 T 3.9062 8.1874 115.7429 67.0959 68.5778 176.3189 58 H 4.2181 8.3319 117.7245 58.8818 28.7703 177.7803 59 A 3.8827 8.2821 122.8519 55.2044 18.1484 179.4892 60 N 4.4010 8.3930 115.0655 56.3265 38.6683 177.9865 61 R 3.9946 7.8153 119.4599 59.3026 30.1982 179.2240 62 I 3.9250 7.8597 119.5565 64.5747 37.2308 178.7554 63 V 4.0010 8.1408 119.0994 65.5870 31.4112 178.1259 64 G 3.8139 8.2861 105.9856 47.9526 0.0000 175.4138 65 F 4.2423 8.3911 122.5010 60.7859 39.3974 177.2101 66 F 4.0036 8.4746 120.5660 61.2193 39.1793 177.0005 67 S 3.9311 8.6518 113.2666 61.1658 62.0359 175.9107 68 K 3.7536 7.7484 122.1081 59.5818 31.5793 178.8418 69 I 3.7007 6.4452 120.3043 63.5726 37.4499 178.1338 70 I 3.4553 7.1843 120.8393 64.0358 36.5594 178.7819 71 G 3.6604 7.7836 105.9513 46.6390 0.0000 174.5489 72 E 4.4363 7.4670 117.9070 55.0228 30.0744 175.7446 73 L 3.8999 6.7117 118.8422 55.2563 42.0720 175.0100 74 P 4.6628 0.0000 0.0000 62.9556 31.9443 176.4685 75 N 4.6300 8.1344 119.9739 53.0165 37.1567 174.9650 76 I 4.2647 7.2434 112.3007 60.2977 38.8474 176.9445 77 E 3.9191 8.0963 121.9248 59.6663 29.5083 178.2999 78 A 4.0200 7.9357 120.2349 55.3245 18.4855 179.2274 79 D 4.5562 8.0621 117.0076 57.4219 40.9264 178.9916 80 V 3.7855 8.0415 119.0352 65.8713 31.5052 177.7726 81 N 4.3803 8.5631 116.6311 56.7488 38.5196 177.3690 82 T 3.9078 8.0739 116.9780 66.6426 68.5932 176.2980 83 F 4.1423 8.6425 122.6138 61.4442 39.3288 177.3969 84 V 3.3335 8.2291 117.6250 65.7950 31.1121 177.7314 85 A 3.9598 7.9250 119.8837 55.0422 18.2561 179.1964 86 S 4.2157 7.7063 110.7802 60.5020 63.9177 175.4889 87 H 4.3287 7.7882 118.8468 56.6707 29.1242 177.0419 88 K 3.8651 8.0942 122.2011 58.9755 31.7987 176.8072 89 P 4.3881 0.0000 0.0000 64.3111 31.4501 177.5810 90 R 4.2904 7.4158 115.3818 55.2074 30.1525 176.3975 91 G 3.8610 7.7081 106.4653 46.1589 0.0000 174.4599 92 V 3.6182 7.8736 119.1718 62.9290 32.1777 176.0662 93 T 4.5284 8.1676 117.0638 60.4783 72.1518 175.4387 94 H 3.9402 8.4282 118.2678 58.9408 28.6256 177.7095 95 D 4.3994 8.0765 120.2432 57.6479 40.6520 178.8073 96 Q 4.2762 8.0891 118.0924 58.9073 28.6918 178.7253 97 L 4.2245 8.1835 120.0855 58.1224 41.7711 179.4151 98 N 4.2725 8.6357 116.5321 56.1626 38.3671 177.3123 99 N 4.4508 8.4683 118.2071 55.8784 38.5201 177.1555 100 F 3.9913 8.6233 122.5218 61.2562 39.5209 177.0785 101 R 4.1326 8.2598 118.0653 59.5656 29.8366 178.2947 102 A 4.1002 8.1906 120.6299 55.0874 18.2809 179.8595 103 G 3.4340 8.4451 104.6715 47.7915 0.0000 175.6759 104 F 3.9342 8.1658 123.4327 61.0019 39.3331 177.4556 105 V 2.9355 7.8422 117.8397 65.5634 31.3074 177.8485 106 S 3.8638 8.0236 113.0784 61.3619 62.0719 175.2306 107 Y 3.8858 7.9603 122.3603 61.2593 38.4384 178.2698 108 M 3.7980 7.6641 119.3345 58.2629 31.6633 179.0305 109 K 3.8267 7.3433 117.5165 58.9533 32.2639 178.7511 110 A 4.0782 7.5166 119.2443 53.5631 18.6622 177.4814 111 H 4.5406 7.5095 112.3139 55.4137 30.7351 173.3692 112 T 4.6392 7.5484 107.9550 59.6176 71.8272 173.7002 113 D 4.6141 8.3062 120.7510 53.3625 39.8937 175.9605 114 F 4.7099 8.5354 126.5816 59.4227 39.6315 176.3224 115 A 4.1069 7.9443 119.5414 55.5930 18.0201 179.7410 116 G 3.6929 8.1690 102.2015 46.6243 0.0000 174.4282 117 A 4.5716 7.4922 121.0122 51.4162 19.6975 177.5267 118 E 3.2742 7.2983 117.8132 59.3005 29.6098 178.9128 119 A 3.9824 7.8903 119.7577 54.9632 18.5235 179.2383 120 A 3.8799 7.8873 118.8566 55.1561 18.4425 179.7410 121 W 4.4473 8.5000 117.7828 59.7444 29.0382 178.7772 122 G 3.8614 8.6655 105.8360 47.9999 0.0000 175.4641 123 A 4.0457 8.2207 123.6951 55.0295 18.3362 179.7876 124 T 3.8070 8.0446 114.1747 66.9746 68.4829 176.9126 125 L 4.4075 8.5315 120.8851 57.7542 41.7441 179.2316 126 D 4.4346 8.5710 119.2294 57.5422 40.8061 178.9229 127 T 3.8568 8.1196 116.2257 66.5382 68.5060 176.3475 128 F 4.2069 8.4601 122.7156 61.6915 39.3459 177.2916 129 F 3.9180 8.5651 117.5299 59.9619 38.3637 177.8611 130 G 3.6533 7.8414 105.0409 48.1091 0.0000 175.0913 131 M 4.2157 7.9659 120.2351 58.3232 32.3274 178.3381 132 I 3.7773 7.5603 119.9796 64.5791 37.1403 178.4527 133 F 4.4353 8.5732 117.1175 59.7754 38.8580 176.4868 134 S 4.5308 7.8198 113.4514 59.0549 63.3408 174.7642 135 K 4.5807 7.9334 119.1983 56.7569 34.1381 175.9427 136 M 4.3057 7.9028 120.2267 55.6302 30.7475 174.3431 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 L 8.17 4.20 0.00 1.57 1.65 0.88 0.48 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 2 S 7.93 4.60 0.00 4.09 3.92 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 3 A 8.25 3.97 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 4 D 7.93 4.25 0.00 2.88 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 5 Q 7.90 3.95 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 6 I 7.73 3.57 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.12 0.78 0.00 0.00 7 S 8.16 4.09 0.00 4.00 4.11 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 8 T 7.66 3.78 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 1.13 0.00 0.00 9 V 7.46 2.93 1.12 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 0.01 0.00 0.00 0.16 0.00 0.00 10 Q 7.85 4.12 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 11 A 7.89 4.03 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 12 S 8.03 4.36 0.00 4.20 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 0.00 13 F 9.11 4.65 0.00 3.54 3.20 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 14 D 7.90 4.36 0.00 2.92 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 15 K 7.78 4.17 0.00 2.02 1.91 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.66 7.81 16 V 7.48 4.40 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 0.99 0.00 0.00 1.00 0.00 0.00 17 K 7.71 3.68 0.00 1.63 1.07 0.00 1.57 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.39 1.33 7.81 18 G 7.85 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 0.00 0.00 0.00 19 D 8.01 4.98 0.00 2.76 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 20 P 0.00 4.28 0.00 2.29 2.34 0.00 3.82 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 2.10 2.07 0.00 21 V 7.78 3.71 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 1.29 0.00 0.00 1.07 0.00 0.00 22 G 8.16 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 23 I 7.06 3.09 1.73 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 0.44 -0.03 0.71 0.00 0.00 24 L 7.67 3.57 0.00 1.39 1.36 0.21 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.34 4.12 0.00 3.28 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 26 A 8.07 3.92 1.55 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 27 V 7.51 3.38 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.27 0.00 0.00 28 F 7.99 4.48 0.00 2.97 2.94 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 29 K 7.91 3.96 0.00 1.34 1.59 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.26 7.81 30 A 7.63 4.39 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 31 D 7.99 4.45 0.00 2.75 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.32 0.00 2.27 2.26 0.00 3.75 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 2.06 2.01 0.00 33 S 8.20 4.28 0.00 4.08 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.88 4.00 2.18 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.05 1.38 0.00 0.00 35 M 7.82 2.96 0.00 1.94 1.19 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.42 0.00 36 A 7.82 4.23 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 37 K 7.91 4.29 0.00 1.94 1.75 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.67 7.81 38 F 7.93 4.62 0.00 3.25 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.57 3.86 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 1.17 0.00 0.00 40 Q 7.82 4.02 0.00 1.78 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.87 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 41 F 7.70 5.12 0.00 3.07 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 42 A 8.07 4.08 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 43 G 8.88 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 44 K 7.66 4.59 0.00 1.88 1.78 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.41 7.81 45 D 8.27 4.70 0.00 2.71 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 8.69 3.96 0.00 1.80 1.67 1.10 0.74 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 47 E 8.29 4.09 0.00 2.28 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 2.37 2.38 0.00 48 S 7.96 4.28 0.00 4.01 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 49 I 7.55 4.01 1.89 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 1.66 0.35 0.98 0.00 0.00 50 K 7.27 2.48 0.00 1.59 1.62 0.00 1.12 0.00 0.00 1.36 0.00 0.00 2.71 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.17 1.13 7.81 51 G 7.77 3.92 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 0.00 0.00 0.00 52 T 7.73 4.58 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 53 A 8.44 4.08 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 54 P 0.00 4.41 0.00 2.46 2.26 0.00 3.72 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 2.25 2.24 0.00 55 F 8.15 4.22 0.00 3.02 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.25 4.01 0.00 2.15 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 2.36 2.51 0.00 57 T 8.19 3.91 4.49 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 1.20 0.00 0.00 58 H 8.33 4.22 0.00 3.68 3.51 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 59 A 8.28 3.88 1.21 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 60 N 8.39 4.40 0.00 3.09 2.93 0.00 0.00 7.01 7.26 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 61 R 7.82 3.99 0.00 2.08 2.05 0.00 3.13 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 62 I 7.86 3.93 1.97 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.75 1.10 0.00 0.00 63 V 8.14 4.00 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 1.30 0.00 0.00 0.98 0.00 0.00 64 G 8.29 3.81 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 0.00 0.00 0.00 65 F 8.39 4.24 0.00 3.29 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 66 F 8.47 4.00 0.00 3.19 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 67 S 8.65 3.93 0.00 4.34 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.75 3.75 0.00 1.75 1.57 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.32 1.35 7.81 69 I 6.45 3.70 1.31 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 1.15 0.82 0.22 0.00 0.00 70 I 7.18 3.46 1.24 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 -0.14 0.58 0.00 0.00 71 G 7.78 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 E 7.47 4.44 0.00 2.06 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 2.22 2.36 0.00 73 L 6.71 3.90 0.00 1.60 1.51 0.66 0.71 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 74 P 0.00 4.66 0.00 2.12 2.05 0.00 3.69 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 1.88 1.88 0.00 75 N 8.13 4.63 0.00 2.62 2.85 0.00 0.00 6.91 7.55 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 76 I 7.24 4.26 1.80 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.65 0.72 0.00 0.00 77 E 8.10 3.92 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 2.40 2.41 0.00 78 A 7.94 4.02 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 79 D 8.06 4.56 0.00 2.79 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 8.04 3.79 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 1.06 0.00 0.00 1.12 0.00 0.00 81 N 8.56 4.38 0.00 3.05 2.90 0.00 0.00 6.99 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.07 3.91 4.69 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 1.22 0.00 0.00 83 F 8.64 4.14 0.00 3.28 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 84 V 8.23 3.33 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 1.02 0.00 0.00 1.12 0.00 0.00 85 A 7.92 3.96 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 86 S 7.71 4.22 0.00 3.91 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 H 7.79 4.33 0.00 2.43 2.94 0.00 5.82 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 88 K 8.09 3.87 0.00 1.86 1.72 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.44 7.81 89 P 0.00 4.39 0.00 1.97 2.02 0.00 3.59 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 90 R 7.42 4.29 0.00 1.76 1.82 0.00 2.90 0.00 0.00 2.95 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 91 G 7.71 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 92 V 7.87 3.62 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.94 0.00 0.00 93 T 8.17 4.53 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 1.26 0.00 0.00 94 H 8.43 3.94 0.00 2.98 3.08 0.00 5.65 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 8.08 4.40 0.00 2.74 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.09 4.28 0.00 2.39 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.60 2.45 0.00 97 L 8.18 4.22 0.00 2.21 2.07 1.15 0.72 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 98 N 8.64 4.27 0.00 3.02 2.88 0.00 0.00 7.07 7.74 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 99 N 8.47 4.45 0.00 3.03 2.92 0.00 0.00 6.53 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 0.00 100 F 8.62 3.99 0.00 3.32 3.42 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 0.00 101 R 8.26 4.13 0.00 1.54 1.93 0.00 2.84 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 102 A 8.19 4.10 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 0.00 103 G 8.45 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.17 3.93 0.00 2.70 3.11 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 0.00 105 V 7.84 2.94 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 0.87 0.00 0.00 1.05 0.00 0.00 106 S 8.02 3.86 0.00 3.94 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 0.00 107 Y 7.96 3.89 0.00 2.93 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 0.00 108 M 7.66 3.80 0.00 1.43 1.10 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.66 0.00 109 K 7.34 3.83 0.00 1.58 1.72 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.15 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.41 0.92 7.81 110 A 7.52 4.08 1.09 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 0.00 0.00 111 H 7.51 4.54 0.00 2.59 3.06 0.00 5.60 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 0.00 112 T 7.55 4.64 4.33 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 1.26 0.00 0.00 113 D 8.31 4.61 0.00 2.72 2.66 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 0.00 0.00 0.00 0.00 114 F 8.54 4.71 0.00 3.02 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 0.00 115 A 7.94 4.11 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 0.00 116 G 8.17 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 0.00 117 A 7.49 4.57 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 0.00 118 E 7.30 3.27 0.00 2.03 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 0.00 2.34 2.20 0.00 119 A 7.89 3.98 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 0.00 120 A 7.89 3.88 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 0.00 121 W 8.50 4.45 0.00 3.60 3.38 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 0.00 122 G 8.67 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 0.00 123 A 8.22 4.05 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 0.00 124 T 8.04 3.81 4.51 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 1.06 0.00 0.00 125 L 8.53 4.41 0.00 2.06 2.19 1.33 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.57 4.43 0.00 3.00 2.76 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 0.00 127 T 8.12 3.86 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 1.22 0.00 0.00 128 F 8.46 4.21 0.00 2.92 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 0.00 129 F 8.57 3.92 0.00 3.17 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 0.00 0.00 0.00 0.00 130 G 7.84 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 M 7.97 4.22 0.00 2.11 2.21 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 2.61 2.59 0.00 132 I 7.56 3.78 1.88 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.27 1.16 0.00 0.00 133 F 8.57 4.44 0.00 2.88 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 0.00 134 S 7.82 4.53 0.00 4.04 4.17 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 0.00 135 K 7.93 4.58 0.00 1.81 1.90 0.00 1.78 0.00 0.00 1.92 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.51 7.81 136 M 7.90 4.31 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.82 0.00