NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2720 8.3344 116.7651 57.8083 63.8800 176.2386 5 V 3.3425 9.0505 130.7898 63.2491 31.5656 168.7921 6 V 4.2415 9.0334 128.6613 61.3818 34.0327 174.5063 7 K 4.7281 8.1734 124.9497 54.3546 35.2656 177.2647 8 S 4.2187 8.8309 118.8770 61.8460 62.8643 176.2860 9 E 4.2421 8.0523 115.1160 57.9326 29.8236 176.8083 10 D 4.5951 7.9667 119.5613 54.7381 41.0275 177.4357 11 Y 4.0989 7.7170 119.1960 60.1255 37.6466 177.4505 12 A 4.3248 7.0490 119.6324 52.2910 18.8618 176.5908 13 L 4.7061 7.5160 116.3352 51.8968 43.7452 174.8824 14 P 4.3310 0.0000 0.0000 63.1653 31.7263 175.6423 15 S 4.8309 8.2710 114.8194 56.5308 66.2605 172.2203 16 Y 4.4939 8.3622 120.9366 56.4751 39.6780 174.8313 17 V 4.2776 6.7226 117.7966 59.8885 35.7195 174.3905 18 D 4.6980 8.4774 123.3301 52.9541 41.1654 176.3677 19 R 4.5299 7.9321 122.8149 54.3201 34.3007 176.4419 20 R 3.3047 8.7039 122.2301 59.1671 30.0917 177.2073 21 D 4.7511 7.9326 113.3507 53.7461 39.8973 175.6927 22 Y 4.8172 8.0627 121.1234 55.5225 38.7672 173.7499 23 P 4.6057 0.0000 0.0000 65.1214 31.8560 176.8770 24 L 4.6448 6.7276 119.2719 52.0344 40.2706 174.2861 25 P 4.7844 0.0000 0.0000 61.6884 32.4458 177.2204 26 D 4.6625 8.6020 118.1661 56.4884 41.0402 176.9728 27 V 4.5520 7.1044 107.7141 59.0330 35.8092 174.8623 28 A 4.2481 8.3018 124.0331 52.0838 19.0073 177.3182 29 H 3.6966 8.8526 122.1295 58.3535 29.9111 175.8810 30 V 4.1635 7.9545 119.0926 60.7867 32.6186 174.8502 31 K 4.3356 8.5417 125.8276 57.2581 34.2064 176.2003 32 N 4.7732 7.8729 116.3434 51.7834 39.7557 174.1142 33 L 4.7208 8.1063 121.8199 52.4649 44.7606 177.2974 34 S 4.4296 8.3568 117.6827 57.3747 65.4513 175.0745 35 A 3.9707 8.5140 123.2676 55.6377 17.9717 180.0220 36 S 4.1338 7.9959 112.0146 61.6132 63.2443 176.5074 37 Q 4.0074 7.9867 121.2568 58.6631 28.4208 178.7514 38 K 3.9845 8.7352 119.7080 59.4149 31.9902 179.2797 39 A 4.0522 8.0963 121.0720 54.7641 18.2023 179.5320 40 L 3.9030 7.9192 119.1115 58.3577 42.0022 179.3379 41 K 3.9977 7.8858 117.1543 59.3457 32.2407 178.8453 42 E 4.1220 8.2151 118.9003 59.4972 29.4593 179.1729 43 K 3.8957 8.3978 119.8589 59.7604 31.9046 178.1842 44 E 4.2629 8.2071 118.3901 58.6897 29.6653 177.8641 45 K 4.0568 8.1366 117.1784 58.1129 32.2382 176.5435 46 A 4.5073 7.5928 121.8053 49.6246 21.1308 176.2798 47 S 3.8742 8.4450 112.5459 58.9399 62.6731 175.4656 48 W 4.6464 8.4349 126.6123 59.4025 29.1963 178.4772 49 S 4.2672 7.9035 113.9032 61.4424 62.2742 175.5860 50 S 4.4339 7.9223 114.4424 59.5131 63.0414 174.6529 51 L 4.3690 7.5753 121.4940 54.2983 41.9978 177.7453 52 S 4.4832 9.0858 118.5059 57.6679 65.1591 175.7637 53 I 3.6552 8.1623 122.3752 64.8223 36.9150 178.1127 54 D 4.3934 8.2111 119.0306 57.8025 40.5357 179.0152 55 E 4.0061 8.4443 118.8196 59.1858 29.4443 179.3380 56 K 3.8542 8.3770 118.9989 59.5625 32.0853 179.4231 57 V 3.6063 8.0357 118.5490 66.0424 31.4889 177.7223 58 E 3.9774 8.3123 119.0192 59.2089 29.4205 178.6613 59 L 3.9659 8.2734 119.4730 57.9077 41.6511 178.8492 60 Y 4.0824 8.1732 119.4458 60.8921 38.6251 178.2039 61 R 4.4801 8.2957 118.3287 57.5756 30.5234 178.4832 62 L 4.0864 7.5874 119.2961 57.3854 41.7379 179.0300 63 K 3.7176 7.5728 119.2442 57.5826 31.7694 176.6052 64 F 5.1682 7.1463 116.0193 55.5084 42.4872 174.6593 65 K 3.7762 8.7973 124.9546 57.4296 32.5960 176.2990 66 E 5.0107 8.6080 119.5144 54.0956 32.1524 177.0271 67 S 5.2584 9.1950 119.3706 57.5608 65.1535 175.5092 68 F 3.8557 9.2126 120.6980 60.9388 38.4269 177.6360 69 A 4.0641 8.1871 118.0048 55.4103 18.2539 179.1048 70 E 4.0984 8.2061 116.9436 59.8285 29.4160 179.5412 71 M 4.2640 8.2971 115.7119 57.4612 31.3734 177.2249 72 N 4.7746 7.7877 115.9540 51.8660 39.4357 175.1288 73 R 4.1084 7.1174 118.2152 55.8906 30.1904 176.7843 74 S 4.5282 8.3788 115.4714 58.0731 64.2112 172.5631 75 T 4.7535 8.0003 109.9721 60.4001 71.9112 173.1974 76 N 4.6749 8.4680 116.0721 53.1813 39.0188 176.7100 77 E 3.9082 8.1466 121.7667 59.2505 29.3660 178.8907 78 W 4.2993 8.2465 116.1948 59.4645 27.9668 178.2960 79 K 3.1897 6.6613 119.0026 59.2592 31.3142 179.3331 80 T 3.7617 7.5571 115.3627 66.4920 68.3302 176.5549 81 V 3.6099 7.8690 120.0378 66.2118 31.6102 178.3461 82 V 3.8012 8.3455 118.4209 65.8809 31.4392 178.2121 83 G 3.6213 8.4686 105.6700 47.7168 0.0000 175.6282 84 A 4.1118 8.4045 123.2431 54.8173 18.3896 179.4709 85 A 4.1894 8.3789 119.4959 55.9025 18.4620 179.8295 86 M 4.0561 8.2494 117.1209 58.2535 31.9548 178.7990 87 F 3.9414 8.2989 120.8819 61.4706 39.6722 177.3747 88 F 4.1120 8.4048 117.2065 60.2998 38.3984 177.8881 89 I 3.9309 8.0836 119.6075 64.1259 36.9667 178.2779 90 G 3.6219 8.3672 107.0914 47.7655 0.0000 175.3400 91 F 3.8431 8.1930 123.6062 61.2018 39.2304 177.1169 92 T 3.7184 8.0123 115.0321 66.7327 68.1976 176.0832 93 A 3.9666 7.6114 122.2282 55.2870 18.2185 179.7136 94 L 3.8626 7.4648 117.0320 57.8274 41.5303 179.7009 95 L 3.8884 7.2928 118.4919 57.6628 41.4656 179.4042 96 L 4.0747 7.7933 119.0533 57.5864 41.5799 179.4811 97 I 3.6813 8.1009 120.2302 64.0582 37.0939 178.1020 98 W 4.1630 8.4564 129.4168 60.5922 30.4413 177.4577 99 E 3.9323 8.8397 119.5345 59.2135 28.8255 178.6492 100 K 4.0486 8.1129 118.7597 59.7888 32.3319 178.0169 101 H 3.9820 7.9623 117.3085 58.9139 29.8755 176.0345 102 Y 4.2221 7.4917 116.0101 57.8057 38.7659 176.7451 103 V 3.9228 7.3486 118.4058 64.3594 32.6964 175.6987 104 Y 4.6129 7.5403 116.1197 57.4207 38.6191 175.9528 105 G 4.0093 8.3645 113.3174 43.5327 0.0000 171.1911 106 P 4.2401 0.0000 0.0000 62.6288 31.6619 176.2106 107 I 4.0278 7.7885 114.6008 58.8805 39.3297 173.5184 108 P 4.3869 0.0000 0.0000 62.7595 31.7527 177.5676 109 H 4.2965 8.5110 115.7061 58.1628 28.5837 177.1178 110 T 2.4800 6.9773 108.8996 62.6618 68.5628 174.6300 111 F 4.4615 7.6773 120.0533 57.5752 39.3987 176.4487 112 E 4.3423 8.1654 121.7973 55.6908 31.3054 177.3156 113 E 3.9870 8.7400 121.9499 59.6592 29.8279 178.9963 114 E 3.9622 8.1988 118.8380 58.7484 29.7368 178.0003 115 W 3.9356 8.3425 128.0886 60.6808 30.6085 177.6981 116 V 3.6489 8.3961 118.0393 66.1925 30.9237 177.7969 117 A 4.0179 8.2099 120.3038 55.1136 18.1206 179.8501 118 K 3.7992 8.0220 117.0111 59.4210 32.0138 179.3548 119 Q 3.8018 8.0211 120.0847 59.3835 28.8614 178.5156 120 T 3.9504 8.1922 117.0124 66.5293 68.5701 176.3235 121 K 3.5539 7.8865 121.4146 59.5873 32.1885 178.5726 122 R 3.8818 8.1586 119.1126 59.6925 29.8147 178.3513 123 M 4.0338 8.2813 118.6211 58.4179 31.9673 178.6846 124 L 4.1370 8.2519 119.3124 58.0513 41.4972 179.3825 125 D 4.4766 8.4131 118.4816 56.8315 40.7822 177.6496 126 M 4.3382 7.9392 114.8554 53.8950 32.0618 175.9347 127 K 3.9618 8.0722 117.1751 55.7960 30.5967 176.0758 128 V 3.3730 8.1048 117.4890 64.9220 32.4901 175.0916 129 A 3.9234 8.7422 129.1391 52.9069 15.5167 175.2632 130 P 4.5996 0.0000 0.0000 63.9364 32.8993 178.8789 131 I 4.0926 7.8780 119.4920 63.8437 37.4922 176.4707 132 Q 4.5597 7.9332 113.4967 56.9083 33.5744 176.4625 133 G 3.8221 8.3300 105.9121 47.8996 0.0000 173.1306 134 F 4.7805 8.1948 121.0165 59.0901 43.0055 176.2690 135 S 4.3122 9.7506 116.4851 61.6012 63.3573 176.7329 136 A 4.1834 8.3628 122.0323 54.9907 18.1814 178.0025 137 K 4.4646 8.5696 113.6995 56.1668 32.6550 175.6870 138 W 4.6317 8.2115 130.0615 55.3523 32.2756 174.9908 139 D 4.4384 7.7398 125.5501 53.1238 40.1694 176.5053 140 Y 4.2092 8.4694 124.8771 60.0523 38.5434 177.2537 141 D 4.4796 8.2314 119.3089 57.2491 41.1878 177.7430 142 K 3.9805 8.5070 115.7221 56.3545 32.5202 176.3640 143 N 3.9652 7.4871 116.9758 53.6131 37.8576 171.9959 144 E 3.4822 5.9000 113.1393 53.9351 33.9272 174.9311 145 W 4.3264 7.8712 119.9917 56.3023 29.5933 176.7214 146 K 3.7866 8.5902 124.0773 56.9313 32.2947 177.2442 147 K 4.1503 8.5305 122.2497 56.7866 32.0973 176.8964 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 S 8.33 4.27 0.00 3.83 3.26 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 5 V 9.05 3.34 2.07 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 0.72 0.00 0.00 0.92 0.00 0.00 6 V 9.03 4.24 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 0.91 0.00 0.00 1.04 0.00 0.00 7 K 8.17 4.73 0.00 1.82 1.92 0.00 1.88 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.41 7.81 8 S 8.83 4.22 0.00 3.94 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 9 E 8.05 4.24 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.26 0.00 10 D 7.97 4.60 0.00 3.01 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 7.72 4.10 0.00 2.99 3.19 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 12 A 7.05 4.32 1.06 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 13 L 7.52 4.71 0.00 1.75 1.57 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.33 0.00 2.07 2.04 0.00 3.62 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 2.05 2.11 0.00 15 S 8.27 4.83 0.00 3.97 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 16 Y 8.36 4.49 0.00 3.03 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 6.72 4.28 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 0.68 0.00 0.00 0.85 0.00 0.00 18 D 8.48 4.70 0.00 2.69 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 19 R 7.93 4.53 0.00 1.83 1.97 0.00 3.09 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 20 R 8.70 3.30 0.00 1.78 2.08 0.00 3.18 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 21 D 7.93 4.75 0.00 2.84 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 22 Y 8.06 4.82 0.00 2.93 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 23 P 0.00 4.61 0.00 2.23 2.37 0.00 3.75 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.03 0.00 24 L 6.73 4.64 0.00 1.72 1.66 0.94 1.21 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 25 P 0.00 4.78 0.00 2.07 1.90 0.00 3.88 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 26 D 8.60 4.66 0.00 2.74 2.79 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 27 V 7.10 4.55 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 0.72 0.00 0.00 1.09 0.00 0.00 28 A 8.30 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 8.85 3.70 0.00 1.96 3.20 0.00 5.91 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.95 4.16 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 0.81 0.00 0.00 0.63 0.00 0.00 31 K 8.54 4.34 0.00 1.85 1.85 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.40 7.81 32 N 7.87 4.77 0.00 2.69 2.75 0.00 0.00 6.70 7.85 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 33 L 8.11 4.72 0.00 1.57 1.52 0.90 0.86 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 34 S 8.36 4.43 0.00 4.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.51 3.97 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 36 S 8.00 4.13 0.00 4.06 4.13 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 0.00 0.00 0.00 37 Q 7.99 4.01 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.39 0.00 38 K 8.74 3.98 0.00 1.86 1.86 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.21 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.62 7.81 39 A 8.10 4.05 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 40 L 7.92 3.90 0.00 1.89 1.91 0.99 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.89 4.00 0.00 1.79 1.87 0.00 1.88 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.64 1.61 7.81 42 E 8.22 4.12 0.00 2.17 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 2.48 2.48 0.00 43 K 8.40 3.90 0.00 1.95 2.01 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.51 7.81 44 E 8.21 4.26 0.00 2.18 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.40 0.00 45 K 8.14 4.06 0.00 1.94 1.88 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.26 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.43 7.81 46 A 7.59 4.51 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 47 S 8.44 3.87 0.00 3.80 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 48 W 8.43 4.65 0.00 3.55 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 49 S 7.90 4.27 0.00 3.92 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.92 4.43 0.00 4.04 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 51 L 7.58 4.37 0.00 1.97 1.64 1.01 0.99 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 52 S 9.09 4.48 0.00 4.05 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 53 I 8.16 3.66 1.87 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 1.64 0.92 0.90 0.00 0.00 54 D 8.21 4.39 0.00 2.72 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 55 E 8.44 4.01 0.00 2.26 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 56 K 8.38 3.85 0.00 1.93 1.83 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.41 1.61 7.81 57 V 8.04 3.61 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 1.10 0.00 0.00 0.91 0.00 0.00 58 E 8.31 3.98 0.00 2.21 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 0.00 2.31 2.36 0.00 59 L 8.27 3.97 0.00 1.83 1.64 0.86 0.80 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 60 Y 8.17 4.08 0.00 3.14 3.19 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 61 R 8.30 4.48 0.00 1.86 2.04 0.00 3.48 0.00 0.00 3.42 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.76 0.00 62 L 7.59 4.09 0.00 1.80 1.60 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.57 3.72 0.00 1.37 0.94 0.00 1.06 0.00 0.00 1.28 0.00 0.00 2.80 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.48 0.21 7.81 64 F 7.15 5.17 0.00 2.62 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.80 3.78 0.00 0.97 2.00 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.21 7.81 66 E 8.61 5.01 0.00 2.25 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 2.29 2.24 0.00 67 S 9.19 5.26 0.00 4.08 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 68 F 9.21 3.86 0.00 3.08 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 69 A 8.19 4.06 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 70 E 8.21 4.10 0.00 2.26 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 0.00 2.36 2.35 0.00 71 M 8.30 4.26 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 72 N 7.79 4.77 0.00 2.79 2.87 0.00 0.00 7.02 7.28 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 73 R 7.12 4.11 0.00 1.91 2.10 0.00 3.08 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 74 S 8.38 4.53 0.00 4.06 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 T 8.00 4.75 4.27 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 1.24 0.00 0.00 76 N 8.47 4.67 0.00 2.69 2.66 0.00 0.00 6.41 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 77 E 8.15 3.91 0.00 2.09 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 2.34 2.35 0.00 78 W 8.25 4.30 0.00 3.67 3.34 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 79 K 6.66 3.19 0.00 1.40 1.34 0.00 1.25 0.00 0.00 1.20 0.00 0.00 2.89 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.56 3.76 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 1.19 0.00 0.00 81 V 7.87 3.61 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.98 0.00 0.00 82 V 8.35 3.80 2.35 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 1.10 0.00 0.00 1.20 0.00 0.00 83 G 8.47 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 84 A 8.40 4.11 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.38 4.19 1.52 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 0.00 0.00 86 M 8.25 4.06 0.00 2.15 2.38 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 2.93 2.61 0.00 87 F 8.30 3.94 0.00 3.14 3.13 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 0.00 0.00 0.00 88 F 8.40 4.11 0.00 3.32 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 89 I 8.08 3.93 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.65 0.93 0.00 0.00 90 G 8.37 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 91 F 8.19 3.84 0.00 2.45 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 92 T 8.01 3.72 4.40 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 1.21 0.00 0.00 93 A 7.61 3.97 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.46 3.86 0.00 1.42 1.55 0.90 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.29 3.89 0.00 1.71 1.63 0.91 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.79 4.07 0.00 1.87 1.73 0.92 0.82 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 97 I 8.10 3.68 2.03 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.90 0.90 0.00 0.00 98 W 8.46 4.16 0.00 3.37 3.34 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 99 E 8.84 3.93 0.00 2.28 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 0.00 1.69 2.11 0.00 100 K 8.11 4.05 0.00 1.89 2.03 0.00 1.86 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.47 7.81 101 H 7.96 3.98 0.00 2.92 2.75 0.00 5.97 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 0.00 102 Y 7.49 4.22 0.00 1.43 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 0.00 103 V 7.35 3.92 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 0.54 0.00 0.00 0.83 0.00 0.00 104 Y 7.54 4.61 0.00 2.97 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.36 4.01 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 0.00 0.00 0.00 106 P 0.00 4.24 0.00 2.15 2.03 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 107 I 7.79 4.03 1.45 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.48 0.57 0.00 0.00 108 P 0.00 4.39 0.00 2.25 1.95 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.08 0.00 109 H 8.51 4.30 0.00 3.42 3.48 0.00 5.65 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 6.98 2.48 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 111 F 7.68 4.46 0.00 3.02 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.17 4.34 0.00 2.26 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 2.39 2.40 0.00 113 E 8.74 3.99 0.00 2.08 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 2.43 2.43 0.00 114 E 8.20 3.96 0.00 2.12 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 2.36 0.00 115 W 8.34 3.94 0.00 3.58 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 0.00 116 V 8.40 3.65 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.12 0.00 0.00 117 A 8.21 4.02 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 0.00 118 K 8.02 3.80 0.00 1.57 1.54 0.00 1.43 0.00 0.00 1.35 0.00 0.00 2.81 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.43 7.81 119 Q 8.02 3.80 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 120 T 8.19 3.95 4.48 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 0.00 0.00 0.00 1.48 0.00 0.00 121 K 7.89 3.55 0.00 1.65 1.79 0.00 1.51 0.00 0.00 1.46 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.22 7.81 122 R 8.16 3.88 0.00 1.78 1.96 0.00 3.07 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 123 M 8.28 4.03 0.00 1.85 2.23 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.41 0.00 124 L 8.25 4.14 0.00 1.45 1.27 -0.65 1.24 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 0.00 125 D 8.41 4.48 0.00 2.73 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 0.00 126 M 7.94 4.34 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.80 0.00 127 K 8.07 3.96 0.00 1.92 1.93 0.00 1.49 0.00 0.00 1.03 0.00 0.00 2.57 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.55 1.25 7.81 128 V 8.10 3.37 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 0.67 0.00 0.00 0.90 0.00 0.00 129 A 8.74 3.92 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.60 0.00 2.22 2.35 0.00 3.82 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 131 I 7.88 4.09 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.45 0.94 0.00 0.00 132 Q 7.93 4.56 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.09 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 133 G 8.33 3.82 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 0.00 0.00 0.00 134 F 8.19 4.78 0.00 3.13 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 0.00 135 S 9.75 4.31 0.00 4.19 4.31 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 0.00 136 A 8.36 4.18 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.57 4.46 0.00 2.06 1.95 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.46 1.44 7.81 138 W 8.21 4.63 0.00 2.72 2.68 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 0.00 139 D 7.74 4.44 0.00 2.32 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 0.00 0.00 0.00 140 Y 8.47 4.21 0.00 3.08 3.09 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 0.00 141 D 8.23 4.48 0.00 2.80 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 K 8.51 3.98 0.00 1.46 1.67 0.00 1.74 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.38 1.27 7.81 143 N 7.49 3.97 0.00 2.83 2.76 0.00 0.00 6.91 7.28 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 0.00 144 E 5.90 3.48 0.00 1.71 1.66 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 1.82 1.94 0.00 145 W 7.87 4.33 0.00 3.21 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 0.00 146 K 8.59 3.79 0.00 1.68 1.77 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.49 7.81 147 K 8.53 4.15 0.00 1.71 1.71 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.48 7.81