NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3046 0.0000 0.0000 60.9965 34.0074 176.4518 3 L 4.2125 7.1053 118.0236 55.7011 41.7391 176.9265 4 G 4.1886 7.9927 104.4535 46.1643 0.0000 176.2132 5 S 4.2214 8.0018 117.0639 60.5251 62.5793 175.9217 6 A 4.1328 8.2012 123.9011 55.1389 17.8204 179.5445 7 M 3.8835 7.8765 116.0141 58.5539 32.4773 178.3368 8 R 4.0441 7.6226 118.3428 59.5680 30.3320 178.4332 9 E 3.9303 8.2066 118.0473 59.8279 29.3424 179.6279 10 L 4.6672 7.4425 119.4004 57.5759 42.1199 178.6635 11 L 3.8397 7.5693 118.4466 57.4643 41.5782 178.9350 12 L 4.2315 7.8246 117.8682 55.9789 42.5019 177.6306 13 S 4.2121 8.0709 113.4657 58.9162 63.4498 175.4969 14 D 4.4231 8.7232 122.0985 57.2993 40.7117 178.7302 15 E 4.4193 8.0734 121.1006 58.9402 29.5343 178.0497 16 Y 4.2132 7.8943 117.9419 60.6131 39.0180 177.2461 17 A 4.0137 8.1273 121.0927 55.0513 18.6013 178.7596 18 E 3.9540 8.6440 117.3494 58.9653 29.5410 176.9821 19 Q 3.7878 6.7310 113.8860 55.8373 28.8913 177.6419 20 K 4.2881 8.5784 123.0083 56.5999 34.0304 176.6240 21 R 4.5606 7.5138 117.1499 54.4759 33.1141 176.3922 22 A 3.9419 8.6174 123.5108 55.5721 18.4045 180.6794 23 V 3.3980 7.3828 115.3872 66.0751 31.9838 177.9632 24 N 4.3684 8.2095 115.7862 56.3573 38.4163 177.5781 25 R 3.9592 8.0130 119.4305 59.2412 30.2241 178.3317 26 F 4.1216 8.6676 120.8216 62.2577 39.2396 177.3289 27 M 3.9769 8.7134 118.0468 58.0758 31.6553 178.5585 28 L 3.9936 7.7446 120.7364 57.7041 42.1346 178.7252 29 L 3.7928 8.0037 119.3077 57.4710 41.5669 178.8859 30 L 3.7105 7.6102 118.6631 58.1461 41.4833 179.6205 31 S 3.8670 7.9925 112.4499 61.8276 62.2124 176.4789 32 T 3.8123 7.9012 118.2098 66.7012 68.0944 176.1942 33 L 3.8402 7.8610 120.9493 58.2535 41.4593 178.8688 34 Y 3.5044 7.3933 119.4406 60.5546 38.6226 177.8751 35 S 4.2402 7.9179 112.0194 60.1203 62.6657 175.0178 36 L 4.3860 8.4107 122.1892 54.8576 41.9536 175.9869 37 D 4.6233 7.4571 126.3446 52.2886 42.1530 176.9254 38 A 3.5809 8.1858 129.9176 54.7352 18.3777 178.4942 39 Q 3.8999 7.9945 117.4190 59.5653 29.2733 178.4384 40 A 4.0537 8.1817 121.0210 54.8345 18.2628 179.3178 41 F 3.9499 8.1451 118.7640 61.3221 39.4046 176.8358 42 A 4.1599 8.2137 122.1270 54.7674 16.6531 179.4657 43 E 3.8808 8.2617 116.3505 59.4572 29.2900 179.3165 44 A 4.2017 7.5202 121.0830 54.7666 18.5035 179.6203 45 T 3.4794 7.7508 114.1957 66.7133 68.3043 176.5215 46 E 4.0853 7.5752 119.3316 59.7122 29.5185 179.2220 47 S 4.1789 7.3892 108.3661 59.3157 63.2818 173.4575 48 L 4.2591 8.2324 125.8407 53.9901 42.4755 174.9276 49 H 3.5426 7.8551 120.0076 55.1490 30.5723 174.2138 50 G 3.9186 6.8928 110.5497 44.9342 0.0000 173.7634 51 R 4.0337 8.7568 119.4940 59.0451 30.3212 178.5249 52 T 4.5033 7.7082 103.7410 61.0943 70.7911 173.9421 53 R 4.4823 7.6810 120.9133 54.7779 31.7854 175.1691 54 V 4.2572 8.0758 119.9941 61.9050 33.3859 175.0157 55 Y 4.7260 8.6895 123.4003 59.8049 38.8323 175.9077 56 F 5.5660 8.3132 114.2925 54.7658 41.8726 174.1689 57 A 4.2708 8.0030 123.1063 52.5361 20.8553 176.7454 58 A 4.5340 8.5360 121.0996 52.4402 19.1913 177.0126 59 D 4.2405 7.4302 113.7150 51.5975 42.2903 174.9413 60 E 2.8038 7.0386 121.7022 59.4212 29.6285 179.0628 61 Q 3.8289 7.8330 116.8655 59.6080 27.2138 179.0131 62 T 3.7733 7.6423 116.0231 66.9266 68.2111 176.2188 63 L 4.3871 7.6623 119.5432 57.1213 41.8498 178.9581 64 L 4.1558 7.8032 118.8196 57.5431 41.6509 178.2154 65 K 3.8415 7.6316 116.7994 58.6352 31.9742 177.0515 66 N 4.1592 8.4323 118.0899 54.7045 39.6097 171.0460 67 G 3.9399 8.7616 120.7970 45.0855 0.0000 172.5986 68 N 4.4430 8.8596 122.2381 54.9502 38.2865 175.2923 69 Q 4.2757 7.8926 121.8711 54.7335 29.3085 174.4605 70 T 4.8776 8.0447 114.1209 60.0818 72.0181 174.1093 71 K 4.4274 8.5644 122.4806 53.2952 32.3285 170.3517 72 P 4.7555 0.0000 0.0000 62.7179 32.0724 175.0474 73 K 3.6779 9.1852 126.7006 56.0594 33.4667 175.7278 74 H 2.0000 8.0286 118.4880 58.6879 28.6870 175.4999 75 V 4.0226 7.1673 118.3941 61.0626 34.4125 171.7509 76 P 3.9824 0.0000 0.0000 64.5268 31.6062 176.3951 77 G 4.2136 7.3255 104.8739 46.6687 0.0000 173.2790 78 T 4.4476 7.5858 110.9462 60.3642 69.6317 172.9299 79 P 4.9137 0.0000 0.0000 62.8441 32.0435 173.7038 80 Y 4.9607 8.2395 117.7484 56.9929 41.7315 174.3422 81 W 5.1569 8.9884 118.3279 55.4669 33.7627 175.0098 82 V 4.9924 8.2968 121.5107 59.7437 35.0326 174.5626 83 I 4.3669 8.0097 124.3635 61.6467 37.3236 176.0768 84 T 4.2415 7.9821 120.3071 63.4613 71.3161 175.0063 85 N 4.6261 8.0875 121.3081 52.1293 37.0999 172.7868 86 T 4.5954 7.1881 109.6270 58.4765 72.0785 174.9195 87 N 4.6275 8.3709 122.1322 52.7355 39.9073 176.0730 88 T 3.9976 8.3568 116.0051 66.6557 68.3794 176.4138 89 G 3.8729 8.2172 107.5377 48.0533 0.0000 175.1109 90 R 4.0636 9.1908 122.6064 57.7340 29.6318 178.8914 91 K 3.6114 7.7233 119.0096 59.5226 32.1840 177.9754 92 C 4.1569 8.8257 120.2483 62.8425 31.3858 175.7910 93 S 4.4399 8.3752 115.5676 61.7657 62.4754 176.2783 94 M 4.2658 8.7885 122.5276 57.9273 31.5266 178.7119 95 I 3.8724 7.5585 119.6709 63.9651 37.5243 177.4022 96 E 3.9241 8.6865 120.6636 59.9391 29.3416 178.3644 97 H 4.0864 8.4595 117.7357 59.4990 29.8450 177.2336 98 I 3.7925 7.9196 120.6592 63.8985 37.2065 177.4157 99 M 4.2724 8.2100 119.4205 57.7224 32.3112 177.9009 100 Q 4.0112 8.5703 118.5714 59.2361 28.5745 178.8308 101 S 4.0633 8.0267 113.7475 61.2504 62.0941 175.1575 102 M 4.3275 7.9089 118.8851 54.7709 32.7715 175.3474 103 Q 3.5605 8.2007 116.8537 56.8682 26.0322 173.4366 104 F 4.5510 7.9677 115.2221 54.7585 41.4257 174.8068 105 P 4.3130 0.0000 0.0000 62.6593 31.6611 177.1982 106 A 4.1402 8.7779 123.5617 54.4867 17.7911 179.4804 107 E 3.8352 8.0453 117.8758 59.6276 29.8111 178.1346 108 L 4.0023 8.2599 118.2761 58.2040 41.5673 179.6207 109 I 3.5588 7.5054 118.5106 64.6358 37.1287 177.6513 110 E 3.9470 7.8272 118.4535 59.7008 29.6319 178.2754 111 K 3.9751 7.8919 118.4333 58.5413 32.0001 178.9719 112 V 3.6317 8.5136 118.5201 66.7771 31.8383 178.3643 113 C 4.3386 8.5497 118.2328 62.1947 31.0967 175.6831 114 G 3.7522 8.7471 108.3146 47.6952 0.0000 175.4745 115 T 4.1831 7.7092 110.8143 64.2379 69.0880 174.7555 116 I 3.9519 7.3218 125.2754 61.6844 37.1696 175.4979 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 2 P 0.00 4.30 0.00 1.79 1.90 0.00 3.16 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.94 0.00 3 L 7.11 4.21 0.00 1.86 1.81 0.87 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 4 G 7.99 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 5 S 8.00 4.22 0.00 3.90 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 6 A 8.20 4.13 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 7 M 7.88 3.88 0.00 1.88 2.32 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.65 0.00 8 R 7.62 4.04 0.00 2.08 2.00 0.00 3.17 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 1.66 1.86 0.00 9 E 8.21 3.93 0.00 2.20 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 2.34 2.48 0.00 10 L 7.44 4.67 0.00 1.55 1.69 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.57 3.84 0.00 1.81 1.73 0.74 0.74 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 12 L 7.82 4.23 0.00 1.80 1.74 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.07 4.21 0.00 3.98 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 14 D 8.72 4.42 0.00 2.80 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 15 E 8.07 4.42 0.00 2.05 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 2.42 2.24 0.00 16 Y 7.89 4.21 0.00 3.04 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 17 A 8.13 4.01 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 18 E 8.64 3.95 0.00 2.24 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 2.32 2.40 0.00 19 Q 6.73 3.79 0.00 2.07 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.52 2.45 0.00 20 K 8.58 4.29 0.00 1.63 1.77 0.00 1.60 0.00 0.00 1.79 0.00 0.00 3.11 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.45 7.81 21 R 7.51 4.56 0.00 1.83 1.79 0.00 3.33 0.00 0.00 3.31 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 22 A 8.62 3.94 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 23 V 7.38 3.40 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 1.18 0.00 0.00 0.88 0.00 0.00 24 N 8.21 4.37 0.00 2.92 2.96 0.00 0.00 7.03 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 25 R 8.01 3.96 0.00 2.06 2.20 0.00 3.06 0.00 0.00 2.63 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.36 0.00 26 F 8.67 4.12 0.00 3.11 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 27 M 8.71 3.98 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 3.08 0.00 28 L 7.74 3.99 0.00 2.03 1.82 1.03 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 29 L 8.00 3.79 0.00 1.77 1.53 0.99 0.18 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 30 L 7.61 3.71 0.00 1.46 1.67 0.28 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 31 S 7.99 3.87 0.00 3.94 3.78 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 32 T 7.90 3.81 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 1.11 0.00 0.00 33 L 7.86 3.84 0.00 1.51 1.53 0.59 0.84 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 34 Y 7.39 3.50 0.00 1.43 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 35 S 7.92 4.24 0.00 4.07 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 36 L 8.41 4.39 0.00 1.75 1.61 1.02 1.10 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 37 D 7.46 4.62 0.00 2.67 2.55 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 38 A 8.19 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 7.99 3.90 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 40 A 8.18 4.05 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 41 F 8.15 3.95 0.00 3.23 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 42 A 8.21 4.16 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.26 3.88 0.00 2.17 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 2.33 2.63 0.00 44 A 7.52 4.20 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 45 T 7.75 3.48 4.18 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 1.29 0.00 0.00 46 E 7.58 4.09 0.00 1.90 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 0.00 2.38 2.51 0.00 47 S 7.39 4.18 0.00 4.01 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 48 L 8.23 4.26 0.00 1.31 1.81 0.96 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.86 3.54 0.00 3.09 3.09 0.00 5.59 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 6.89 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 51 R 8.76 4.03 0.00 1.79 1.96 0.00 3.17 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 52 T 7.71 4.50 4.23 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 1.20 0.00 0.00 53 R 7.68 4.48 0.00 1.99 2.05 0.00 3.24 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.65 0.00 54 V 8.08 4.26 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 0.93 0.00 0.00 0.96 0.00 0.00 55 Y 8.69 4.73 0.00 3.34 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 56 F 8.31 5.57 0.00 3.18 3.35 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 57 A 8.00 4.27 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 58 A 8.54 4.53 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 59 D 7.43 4.24 0.00 2.48 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 7.04 2.80 0.00 1.16 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 2.04 1.93 0.00 61 Q 7.83 3.83 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 62 T 7.64 3.77 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 1.24 0.00 0.00 63 L 7.66 4.39 0.00 1.77 1.75 1.13 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.80 4.16 0.00 1.65 1.68 0.87 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.63 3.84 0.00 1.94 1.65 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.58 1.53 7.81 66 N 8.43 4.16 0.00 2.68 2.76 0.00 0.00 6.85 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 67 G 8.76 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 N 8.86 4.44 0.00 2.84 2.94 0.00 0.00 6.21 7.39 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 69 Q 7.89 4.28 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 70 T 8.04 4.88 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 1.27 0.00 0.00 71 K 8.56 4.43 0.00 1.65 1.77 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.36 7.81 72 P 0.00 4.76 0.00 2.19 2.23 0.00 3.72 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 2.04 2.16 0.00 73 K 9.19 3.68 0.00 1.83 1.55 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.41 7.81 74 H 8.03 2.00 0.00 2.83 2.79 0.00 5.95 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.17 4.02 1.91 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 0.82 0.00 0.00 0.74 0.00 0.00 76 P 0.00 3.98 0.00 1.91 1.87 0.00 3.83 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 77 G 7.33 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 0.00 0.00 0.00 0.00 78 T 7.59 4.45 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 0.79 0.00 0.00 79 P 0.00 4.91 0.00 2.27 2.22 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.28 0.00 80 Y 8.24 4.96 0.00 3.12 3.31 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 81 W 8.99 5.16 0.00 3.38 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 82 V 8.30 4.99 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 0.75 0.00 0.00 0.95 0.00 0.00 83 I 8.01 4.37 1.65 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 1.71 1.03 0.85 0.00 0.00 84 T 7.98 4.24 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 1.15 0.00 0.00 85 N 8.09 4.63 0.00 2.73 2.68 0.00 0.00 6.76 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 T 7.19 4.60 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 0.96 0.00 0.00 87 N 8.37 4.63 0.00 2.98 2.99 0.00 0.00 6.20 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.36 4.00 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 1.21 0.00 0.00 89 G 8.22 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 90 R 9.19 4.06 0.00 1.81 1.95 0.00 3.11 0.00 0.00 3.27 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.43 0.00 91 K 7.72 3.61 0.00 1.94 1.82 0.00 0.62 0.00 0.00 0.65 0.00 0.00 2.77 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.23 0.34 7.81 92 C 8.83 4.16 0.00 2.99 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 93 S 8.38 4.44 0.00 4.18 4.18 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 94 M 8.79 4.27 0.00 2.40 2.55 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.62 0.00 95 I 7.56 3.87 2.09 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.08 0.87 0.00 0.00 96 E 8.69 3.92 0.00 2.03 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 0.00 2.36 2.38 0.00 97 H 8.46 4.09 0.00 3.41 3.56 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 7.92 3.79 1.91 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.12 0.93 0.00 0.00 99 M 8.21 4.27 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.99 0.00 100 Q 8.57 4.01 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.53 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 101 S 8.03 4.06 0.00 3.83 3.80 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 0.00 102 M 7.91 4.33 0.00 2.45 2.65 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.69 0.00 103 Q 8.20 3.56 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.66 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 104 F 7.97 4.55 0.00 2.98 2.97 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 0.00 105 P 0.00 4.31 0.00 2.25 2.20 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.99 0.00 106 A 8.78 4.14 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 0.00 107 E 8.05 3.84 0.00 2.06 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 2.32 2.50 0.00 108 L 8.26 4.00 0.00 1.99 1.73 1.19 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.51 3.56 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.10 0.93 0.00 0.00 110 E 7.83 3.95 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 111 K 7.89 3.98 0.00 2.04 1.77 0.00 1.77 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.60 7.81 112 V 8.51 3.63 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 0.90 0.00 0.00 0.87 0.00 0.00 113 C 8.55 4.34 0.00 3.05 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 0.00 114 G 8.75 3.75 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 0.00 0.00 0.00 115 T 7.71 4.18 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 116 I 7.32 3.95 1.95 0.00 0.00 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 1.32 0.84 1.00 0.00 0.00