NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.6541 0.0000 0.0000 62.5209 33.8136 174.2641 3 V 4.7100 8.3170 120.7914 59.4970 33.4307 172.9368 4 Q 4.6034 9.0490 126.8967 55.0773 31.1925 173.4262 5 H 5.0773 8.6585 122.6793 54.9023 31.4018 174.3941 6 V 4.1833 8.1554 115.9285 61.2595 35.7351 174.4464 7 G 3.7212 9.8662 109.4200 46.1655 0.0000 174.3699 8 G 3.8918 8.0189 107.0182 44.9352 0.0000 173.9537 9 T 4.4500 7.4499 116.6108 61.4498 71.0127 172.8228 10 Y 4.7432 8.3495 123.9661 58.2844 38.7612 174.9408 11 T 4.7616 8.9550 113.8778 59.9307 72.9977 171.8661 12 H 5.2279 8.6687 121.1803 55.2816 30.9526 173.9892 13 I 4.6027 8.2692 125.4953 58.3180 40.3911 173.4418 14 P 4.5413 0.0000 0.0000 61.9026 32.1426 175.9886 15 L 4.0180 8.3547 119.5849 54.8680 42.3102 178.3439 16 S 4.3438 8.5590 118.0461 57.7955 64.9003 173.6578 17 P 4.2868 0.0000 0.0000 66.4015 30.9436 178.8869 18 R 4.2385 7.9504 116.9418 58.7565 30.0223 179.0857 19 T 3.8928 7.8797 116.0657 66.5688 68.5613 176.5610 20 L 4.1398 7.8040 120.6694 58.2711 41.6839 179.5184 21 N 4.3946 8.8100 116.3037 56.0124 38.3754 177.3445 22 A 3.9690 7.9724 122.2676 54.9607 18.4809 179.0892 23 W 4.5468 8.2996 126.8968 61.0867 30.6228 178.3271 24 V 3.1914 7.7904 117.7055 65.8480 30.8317 178.2057 25 K 3.8883 8.1382 118.3452 59.1001 31.6192 179.1544 26 L 3.8129 7.9573 120.4050 57.9550 42.3010 178.9301 27 V 2.8277 7.1764 118.2546 65.8316 31.1610 177.7342 28 E 4.0373 7.9525 117.2069 57.8983 29.0630 178.8343 29 E 3.9418 7.5616 119.6134 58.4812 29.8683 177.3145 30 K 4.4039 7.4057 113.1422 55.0858 33.5130 174.6331 31 K 3.5979 7.5215 122.0761 57.5373 29.2760 175.2607 32 F 3.3387 7.9485 125.6359 58.0899 37.0191 175.9323 33 G 3.8577 7.5869 108.3764 44.0535 0.0000 173.5225 34 A 3.9817 8.7583 122.0895 55.2356 17.9237 179.6606 35 E 4.1336 8.1654 114.6492 58.7713 29.6135 179.2265 36 V 3.9317 8.1600 114.1678 63.9316 31.5579 178.2830 37 V 3.7446 7.8666 118.8235 65.6121 31.6480 176.2786 38 P 4.4352 0.0000 0.0000 65.2213 31.2764 178.7878 39 G 3.8400 8.0897 104.4157 48.1188 0.0000 175.5460 40 F 3.8480 9.0415 123.8642 60.4049 39.0990 176.8854 41 Q 3.7945 8.0815 117.0050 59.4216 28.6993 179.2275 42 A 4.0746 7.5935 119.3917 54.7175 18.6257 179.2397 43 L 4.0881 7.3373 116.1629 56.2344 41.6913 177.9565 44 S 4.3529 6.8006 112.0538 57.3938 63.1567 173.3914 45 E 3.8966 7.8984 121.8043 57.3807 29.8348 176.3267 46 G 3.8330 8.5598 113.8048 46.9496 0.0000 173.1941 47 C 4.5707 7.7155 116.7855 58.3796 30.3009 172.6999 48 T 4.7915 8.1935 110.6983 59.2184 72.1251 173.2169 49 P 4.4547 0.0000 0.0000 66.2729 31.3034 178.3473 50 Y 4.0987 8.3930 118.2646 60.6179 38.6842 177.5635 51 D 4.2139 7.8879 119.2944 57.5782 40.6779 178.5806 52 I 3.6415 7.7672 120.2348 64.6200 37.0802 177.7491 53 N 4.6678 7.9795 116.3143 55.2316 38.6597 177.6134 54 Q 3.8664 7.6301 119.8744 59.2276 28.5982 178.3717 55 M 4.2324 7.9402 118.4524 58.3995 32.0258 178.5669 56 L 4.3999 7.6666 117.9617 57.7693 41.8939 178.9410 57 N 4.3837 8.2248 116.4687 56.6707 38.2370 177.0967 58 C 4.2431 7.9980 116.7831 62.2661 28.4627 175.7211 59 V 4.4939 7.5265 112.1702 61.2811 31.4186 178.1856 60 G 3.8226 7.9453 108.9841 47.5764 0.0000 174.7887 61 D 4.6405 7.9994 117.0072 54.5478 39.6871 176.8224 62 H 4.8345 8.0347 119.9347 54.1269 27.9535 174.8729 63 Q 4.0208 8.4505 122.5230 59.1427 28.9905 177.6601 64 A 3.9263 8.1985 120.6229 55.2657 18.2736 178.9423 65 A 3.8059 8.5820 118.0163 55.8245 18.3675 179.8302 66 M 3.9956 8.0346 116.7381 58.4452 31.8553 178.9017 67 Q 3.9648 8.3258 119.9397 59.1590 28.7546 177.9195 68 I 3.6634 7.5578 120.3792 64.6813 37.1394 178.4956 69 I 3.7833 8.0081 120.6658 64.1218 36.8482 178.3882 70 R 3.9401 8.4792 120.0866 59.5846 29.9406 178.3803 71 E 3.9550 8.5003 118.6140 59.5632 29.4232 179.5206 72 I 3.7321 7.5066 118.9090 64.1355 37.0444 178.5775 73 I 3.7344 7.8792 120.7509 64.4212 37.0185 177.9000 74 N 4.2418 8.3757 117.6773 56.5251 38.4276 177.1597 75 E 3.8386 7.9334 119.4071 59.6477 29.5529 179.4124 76 E 3.6250 7.7532 118.1111 58.7451 29.3250 179.1324 77 A 3.8922 7.3268 120.9499 54.9627 18.4577 179.4586 78 A 3.9261 7.8349 119.2364 55.4366 18.4916 179.5646 79 E 3.8827 8.1881 117.7934 58.8434 29.7063 178.7108 80 W 4.0133 8.5873 128.9683 60.6865 30.6467 177.5705 81 D 4.5481 8.2668 117.4174 57.6498 40.3498 178.8641 82 V 3.7416 7.7078 117.5926 65.2409 31.6048 177.0996 83 Q 4.4923 7.7190 114.9238 55.1332 30.0104 175.9212 84 H 4.4841 7.5527 117.4389 53.0576 29.1349 171.1937 85 P 4.6115 0.0000 0.0000 61.3262 33.2238 175.9606 86 I 4.0323 7.9080 119.1671 61.3439 37.7482 175.6032 87 P 3.8188 0.0000 0.0000 63.1595 26.9721 174.2053 88 A 3.8498 7.7154 125.6165 53.0432 19.3658 178.5091 89 G 5.0681 7.1006 115.1571 45.1281 0.0000 169.4387 90 P 4.6720 0.0000 0.0000 61.4482 33.7957 175.8490 91 L 4.5819 8.0186 119.3548 52.4341 43.8278 174.2236 92 P 4.4749 0.0000 0.0000 61.9033 32.2354 175.7667 93 A 4.0718 8.4017 121.8390 53.3271 18.7401 178.4174 94 G 3.9991 8.6690 108.2774 45.9868 0.0000 173.1956 95 Q 4.2960 7.6117 120.6558 54.5703 29.9260 174.8005 96 L 4.3467 8.4013 127.4712 53.7563 42.8687 176.5180 97 R 4.1904 8.7523 122.5932 56.1181 29.8082 176.0833 98 E 3.9579 8.7501 118.3171 56.3231 30.0310 175.5695 99 P 3.7822 0.0000 0.0000 62.2375 31.9066 176.6142 100 R 4.6182 9.6848 122.8437 54.4542 32.0244 177.6325 101 G 4.0651 10.2584 107.4013 48.1066 0.0000 175.2370 102 S 4.6403 7.9334 113.5244 59.0256 63.6224 175.7513 103 D 4.4255 8.1737 123.9263 57.3880 40.3683 178.5123 104 I 3.3498 7.2415 119.0507 63.8571 37.2923 177.6654 105 A 2.9752 7.4652 119.4203 51.7842 18.7347 177.1593 106 G 3.8816 7.1575 105.3727 46.7725 0.0000 174.7350 107 T 4.3878 8.1977 116.2123 63.9435 70.1422 176.4386 108 T 4.6484 7.9257 108.6932 60.8974 68.9043 173.5902 109 S 5.2086 7.8907 115.0683 55.3642 66.3375 173.4209 110 T 4.2103 8.2463 112.7372 60.4760 71.3693 175.9804 111 V 3.6296 7.9792 122.1299 65.4496 30.9166 178.0752 112 E 3.8457 8.0327 118.8539 59.0593 29.3949 179.1774 113 E 3.4049 7.5589 117.7646 59.1314 29.3875 179.4240 114 Q 4.1059 7.8800 117.9157 59.1160 28.5922 178.7333 115 I 3.7999 8.1431 120.9886 64.8857 37.2302 178.5429 116 Q 4.0139 8.0766 118.5019 58.6901 28.4259 178.9213 117 W 4.4886 7.9689 120.1453 59.8948 28.9259 178.4878 118 M 4.2520 8.0849 119.0434 56.6250 31.4069 177.1629 119 F 4.8715 7.5419 114.9150 56.7896 41.5315 175.5214 120 R 3.9716 7.9102 116.3358 55.5324 29.5367 174.8682 121 P 4.3562 0.0000 0.0000 65.7125 31.6678 176.8086 122 Q 3.9824 8.2472 118.3547 56.8417 29.1524 176.4541 123 N 4.0814 8.6718 119.8467 53.8259 35.6314 172.1902 124 P 4.4892 0.0000 0.0000 62.3499 33.0180 176.7927 125 V 4.1666 8.1387 121.3895 61.1156 32.8139 174.2179 126 P 4.6971 0.0000 0.0000 61.8583 28.5094 176.9955 127 V 3.3637 7.6042 119.7019 64.9485 31.9531 177.7339 128 G 3.8650 7.8184 106.1842 47.5149 0.0000 175.3442 129 N 4.2873 7.9584 118.9456 55.6897 38.4149 177.5206 130 I 3.6820 7.4998 121.5026 64.0545 37.1226 177.8078 131 Y 3.4904 7.6767 120.4070 60.5739 38.6528 177.8280 132 R 4.0935 8.0624 119.2438 59.9107 30.2546 179.1680 133 R 4.1632 7.6835 117.4450 58.9048 30.0176 179.2511 134 W 4.3898 7.8758 119.1140 59.8696 29.1623 178.7757 135 I 3.5665 8.1491 120.2609 64.0396 36.3450 178.1156 136 Q 3.8533 8.4426 120.7780 59.4000 28.9520 178.3954 137 I 3.8003 7.7948 120.7251 64.4993 37.1672 178.6126 138 G 3.5436 8.0013 106.2050 47.8540 0.0000 175.7888 139 L 4.0327 8.2330 122.3214 57.5251 41.6329 179.5850 140 Q 4.1068 8.2956 118.1335 58.8556 28.7178 178.9876 141 K 3.9690 7.9677 120.5584 59.4714 32.1738 178.4820 142 C 3.9780 8.5136 117.4540 62.9329 27.7818 176.1475 143 V 3.7911 7.9636 118.4266 66.4636 31.2464 178.1936 144 R 4.0860 8.0886 116.1205 58.6703 29.9136 177.9711 145 M 4.5244 7.7158 116.4305 56.0995 33.6635 175.4644 146 Y 3.9310 8.3681 121.0335 58.2464 38.0198 175.8645 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 4.65 0.00 2.16 2.05 0.00 3.70 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 2.12 2.08 0.00 3 V 8.32 4.71 2.18 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 0.87 0.00 0.00 1.16 0.00 0.00 4 Q 9.05 4.60 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 5 H 8.66 5.08 0.00 3.17 3.18 0.00 5.78 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 6 V 8.16 4.18 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 0.51 0.00 0.00 0.87 0.00 0.00 7 G 9.87 3.72 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 0.00 0.00 0.00 8 G 8.02 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 0.00 0.00 0.00 9 T 7.45 4.45 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 1.20 0.00 0.00 10 Y 8.35 4.74 0.00 2.77 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 11 T 8.96 4.76 4.25 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 1.20 0.00 0.00 12 H 8.67 5.23 0.00 3.10 3.21 0.00 5.86 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 13 I 8.27 4.60 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.03 0.96 0.00 0.00 14 P 0.00 4.54 0.00 2.25 2.13 0.00 3.78 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 15 L 8.35 4.02 0.00 1.66 1.65 0.83 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.56 4.34 0.00 4.05 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 17 P 0.00 4.29 0.00 2.30 2.37 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 18 R 7.95 4.24 0.00 1.89 2.03 0.00 3.13 0.00 0.00 3.34 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 19 T 7.88 3.89 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 20 L 7.80 4.14 0.00 1.95 1.82 0.95 0.66 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 21 N 8.81 4.39 0.00 2.71 2.88 0.00 0.00 6.94 7.07 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 22 A 7.97 3.97 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 W 8.30 4.55 0.00 3.40 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 24 V 7.79 3.19 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 0.90 0.00 0.00 1.00 0.00 0.00 25 K 8.14 3.89 0.00 1.89 1.78 0.00 1.71 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.56 7.81 26 L 7.96 3.81 0.00 1.67 1.69 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.18 2.83 1.15 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 -0.25 0.00 0.00 -0.82 0.00 0.00 28 E 7.95 4.04 0.00 1.93 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 0.00 2.33 2.33 0.00 29 E 7.56 3.94 0.00 2.05 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 2.28 2.35 0.00 30 K 7.41 4.40 0.00 1.71 1.77 0.00 1.94 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.35 7.81 31 K 7.52 3.60 0.00 2.05 2.18 0.00 2.01 0.00 0.00 1.92 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.47 7.81 32 F 7.95 3.34 0.00 2.45 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 33 G 7.59 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 34 A 8.76 3.98 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 35 E 8.17 4.13 0.00 2.18 2.23 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 2.32 2.32 0.00 36 V 8.16 3.93 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 0.46 0.00 0.00 1.04 0.00 0.00 37 V 7.87 3.74 2.27 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 1.10 0.00 0.00 1.00 0.00 0.00 38 P 0.00 4.44 0.00 2.24 2.12 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 39 G 8.09 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 0.00 0.00 0.00 40 F 9.04 3.85 0.00 2.95 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 41 Q 8.08 3.79 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 42 A 7.59 4.07 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 43 L 7.34 4.09 0.00 1.33 1.47 1.18 0.93 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 44 S 6.80 4.35 0.00 3.39 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 7.90 3.90 0.00 2.00 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 2.21 2.18 0.00 46 G 8.56 3.83 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 0.00 0.00 0.00 47 C 7.72 4.57 0.00 3.05 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 48 T 8.19 4.79 4.39 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 1.28 0.00 0.00 49 P 0.00 4.45 0.00 2.25 1.95 0.00 3.72 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 2.02 2.01 0.00 50 Y 8.39 4.10 0.00 3.12 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.89 4.21 0.00 2.88 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.77 3.64 2.21 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.30 0.79 0.00 0.00 53 N 7.98 4.67 0.00 2.88 2.85 0.00 0.00 6.92 8.28 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 54 Q 7.63 3.87 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.78 0.00 0.00 0.00 0.00 0.00 1.87 2.09 0.00 55 M 7.94 4.23 0.00 1.43 2.16 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.26 0.00 56 L 7.67 4.40 0.00 1.82 1.81 0.94 0.70 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 57 N 8.22 4.38 0.00 2.92 2.91 0.00 0.00 7.03 7.69 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 58 C 8.00 4.24 0.00 3.34 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 59 V 7.53 4.49 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 0.43 0.00 0.00 1.26 0.00 0.00 60 G 7.95 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 61 D 8.00 4.64 0.00 2.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 H 8.03 4.83 0.00 3.52 3.50 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 8.45 4.02 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.53 0.00 64 A 8.20 3.93 1.23 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 0.00 0.00 65 A 8.58 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 M 8.03 4.00 0.00 2.10 2.28 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 2.69 2.92 0.00 67 Q 8.33 3.96 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 68 I 7.56 3.66 1.93 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 1.51 1.05 0.88 0.00 0.00 69 I 8.01 3.78 1.86 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 1.34 0.83 0.91 0.00 0.00 70 R 8.48 3.94 0.00 2.05 1.94 0.00 3.12 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 71 E 8.50 3.95 0.00 2.02 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 2.54 0.00 72 I 7.51 3.73 1.98 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 1.74 1.18 0.96 0.00 0.00 73 I 7.88 3.73 2.11 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.98 1.23 0.00 0.00 74 N 8.38 4.24 0.00 2.84 2.86 0.00 0.00 7.09 7.61 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 75 E 7.93 3.84 0.00 2.07 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 2.27 2.37 0.00 76 E 7.75 3.63 0.00 1.16 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 0.00 2.11 1.94 0.00 77 A 7.33 3.89 1.44 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 0.00 0.00 0.00 78 A 7.83 3.93 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 79 E 8.19 3.88 0.00 2.06 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 2.29 2.36 0.00 80 W 8.59 4.01 0.00 3.85 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 81 D 8.27 4.55 0.00 2.92 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 82 V 7.71 3.74 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 0.79 0.00 0.00 0.96 0.00 0.00 83 Q 7.72 4.49 0.00 1.84 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.24 2.62 0.00 84 H 7.55 4.48 0.00 2.91 3.09 0.00 5.84 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 85 P 0.00 4.61 0.00 2.12 2.04 0.00 3.40 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 1.89 2.02 0.00 86 I 7.91 4.03 1.88 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 0.48 0.95 0.00 0.00 87 P 0.00 3.82 0.00 2.26 2.26 0.00 3.69 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.04 0.00 88 A 7.72 3.85 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 89 G 7.10 5.07 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 0.00 0.00 0.00 90 P 0.00 4.67 0.00 2.20 2.08 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 91 L 8.02 4.58 0.00 1.58 1.59 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.47 0.00 2.10 2.02 0.00 3.76 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 93 A 8.40 4.07 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 94 G 8.67 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 0.00 0.00 0.00 95 Q 7.61 4.30 0.00 2.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 96 L 8.40 4.35 0.00 1.57 1.59 0.78 0.04 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 97 R 8.75 4.19 0.00 2.07 2.06 0.00 3.23 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 98 E 8.75 3.96 0.00 2.00 1.95 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 2.36 2.33 0.00 99 P 0.00 3.78 0.00 1.13 0.49 0.00 3.30 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.44 0.00 100 R 9.68 4.62 0.00 1.76 2.08 0.00 3.41 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 101 G 10.26 4.07 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 0.00 0.00 0.00 102 S 7.93 4.64 0.00 4.08 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 0.00 103 D 8.17 4.43 0.00 2.63 2.91 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 0.00 0.00 0.00 0.00 104 I 7.24 3.35 1.46 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 0.82 -0.22 -0.26 0.00 0.00 105 A 7.47 2.98 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 0.00 106 G 7.16 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.20 4.39 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 0.00 108 T 7.93 4.65 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 1.25 0.00 0.00 109 S 7.89 5.21 0.00 3.94 4.14 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 0.00 110 T 8.25 4.21 4.24 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 1.14 0.00 0.00 111 V 7.98 3.63 1.51 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 0.44 0.00 0.00 0.74 0.00 0.00 112 E 8.03 3.85 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 113 E 7.56 3.40 0.00 1.63 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 0.00 2.05 2.13 0.00 114 Q 7.88 4.11 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 115 I 8.14 3.80 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.88 1.01 0.00 0.00 116 Q 8.08 4.01 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 117 W 7.97 4.49 0.00 3.58 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 0.00 118 M 8.08 4.25 0.00 1.36 1.63 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.30 0.00 119 F 7.54 4.87 0.00 2.95 2.40 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 0.00 120 R 7.91 3.97 0.00 2.00 2.18 0.00 3.20 0.00 0.00 3.44 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.84 0.00 121 P 0.00 4.36 0.00 2.24 2.28 0.00 3.83 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 122 Q 8.25 3.98 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.65 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 123 N 8.67 4.08 0.00 2.82 2.98 0.00 0.00 7.20 8.02 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 0.00 124 P 0.00 4.49 0.00 2.25 2.27 0.00 3.77 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 1.97 1.95 0.00 125 V 8.14 4.17 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 1.01 0.00 0.00 0.90 0.00 0.00 126 P 0.00 4.70 0.00 2.22 2.10 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.02 0.00 127 V 7.60 3.36 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 0.60 0.00 0.00 0.98 0.00 0.00 128 G 7.82 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 0.00 129 N 7.96 4.29 0.00 2.79 2.83 0.00 0.00 7.05 7.32 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 0.00 130 I 7.50 3.68 1.50 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.88 0.62 0.00 0.00 131 Y 7.68 3.49 0.00 2.68 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 0.00 132 R 8.06 4.09 0.00 2.07 2.06 0.00 3.13 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.87 0.00 133 R 7.68 4.16 0.00 2.09 2.13 0.00 3.21 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.91 0.00 134 W 7.88 4.39 0.00 3.44 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 0.00 135 I 8.15 3.57 1.34 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.15 0.22 0.00 0.00 136 Q 8.44 3.85 0.00 2.36 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 137 I 7.79 3.80 2.06 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.06 0.92 0.00 0.00 138 G 8.00 3.54 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 0.00 0.00 0.00 139 L 8.23 4.03 0.00 1.76 1.80 0.48 1.27 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 0.00 140 Q 8.30 4.11 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 141 K 7.97 3.97 0.00 1.96 1.92 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.47 7.81 142 C 8.51 3.98 0.00 2.88 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 0.00 0.00 0.00 143 V 7.96 3.79 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 0.87 0.00 0.00 1.11 0.00 0.00 144 R 8.09 4.09 0.00 2.09 2.00 0.00 3.19 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 145 M 7.72 4.52 0.00 2.01 2.31 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.54 0.00 146 Y 8.37 3.93 0.00 3.15 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