NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1589 8.1727 122.0483 56.2768 34.0730 173.9392 2 V 4.5345 8.1772 127.3560 60.7346 32.3305 174.5474 3 F 4.4858 9.9354 128.8584 57.5809 40.2246 174.9081 4 E 4.2745 9.1108 120.9990 55.5790 31.0245 176.7826 5 R 3.4345 9.0356 120.7214 60.8772 29.9556 179.4925 6 C 4.3555 8.0178 115.4040 59.5839 40.3633 175.7458 7 E 3.9107 8.1096 120.8491 59.2461 29.3258 178.4769 8 L 3.5159 7.9827 120.1092 57.7358 42.0436 178.5573 9 A 3.9222 7.7035 120.7792 55.4629 18.2388 179.9320 10 R 3.8992 8.0597 116.3720 59.5145 29.9664 179.4195 11 T 3.8457 7.9270 115.5731 66.6686 68.5891 176.6588 12 L 3.8318 8.1792 121.2245 57.4542 41.5047 179.4758 13 K 3.9018 8.0736 119.5057 59.7427 32.0006 179.1596 14 R 3.9348 8.0537 116.8590 58.6203 29.9587 177.9940 15 L 4.4167 7.2791 116.9731 54.0573 41.7894 176.8028 16 G 3.8455 8.1147 107.1634 46.9086 0.0000 174.9575 17 M 4.0074 7.7087 120.1958 55.9533 32.5343 175.8106 18 D 4.4307 8.0418 118.2657 55.5906 41.1697 175.7742 19 G 3.9376 9.4493 115.6649 45.5442 0.0000 171.4864 20 Y 4.1987 8.2496 121.9765 58.6677 38.9207 176.3242 21 R 3.5894 9.0080 126.7357 57.2521 27.8294 177.2529 22 G 3.8335 8.1878 103.3665 45.7158 0.0000 174.0627 23 I 4.0215 7.7102 122.3192 59.6002 38.0912 176.0283 24 S 4.7000 8.2876 120.6915 57.7747 65.1134 174.8435 25 L 4.2399 8.5358 124.3992 58.4691 41.7851 179.1597 26 A 4.1265 8.1421 120.2388 55.2719 18.3191 179.2647 27 N 4.4365 7.9998 114.6367 56.3662 38.5955 177.7036 28 W 4.3669 7.9709 119.8935 60.0419 29.0254 178.5610 29 M 4.1395 8.5597 119.0343 58.5182 31.4458 177.9669 30 C 3.1427 8.0903 118.6775 59.0224 42.6005 175.2768 31 L 3.9927 8.1395 121.6876 58.2883 41.6921 178.7603 32 A 4.1354 8.3249 120.7312 54.9904 18.3142 179.4462 33 K 2.9215 8.2171 118.0954 59.3865 32.0537 179.1826 34 W 4.2822 7.7572 117.3466 59.2496 29.0114 178.4020 35 E 4.3417 8.4824 118.9379 58.7177 29.4811 177.8432 36 S 4.5199 7.9883 109.2918 56.6899 64.7099 174.3795 37 G 3.6719 8.3833 108.6255 46.9953 0.0000 173.6474 38 Y 3.6472 7.7179 113.4833 58.5499 35.4860 168.5463 39 N 5.2680 7.7510 119.5086 52.1007 39.5205 175.5964 40 T 4.0823 8.9269 117.8305 63.8566 69.8048 175.8259 41 R 4.6078 8.0690 119.6068 55.7511 31.1133 176.4828 42 A 4.3419 7.9874 122.7593 52.5318 19.3499 177.4590 43 T 5.1436 8.3038 110.5776 60.2676 72.5040 173.1116 44 N 4.8576 8.6626 121.5311 52.5073 42.3038 172.5635 45 Y 4.7736 8.7698 128.0302 57.3124 40.9028 173.8591 46 N 4.8369 8.2671 124.1931 50.9859 39.3253 174.9495 47 A 3.7106 8.3768 127.5553 54.9081 18.9251 179.0210 48 G 3.8907 8.1826 104.0047 48.3771 0.0000 173.9184 49 D 4.7940 7.6510 116.7484 51.6967 40.0044 175.7955 50 R 3.9284 7.9587 116.0660 56.8546 28.2864 175.7819 51 S 4.9882 7.2118 107.2244 56.9096 66.7928 172.8184 52 T 5.0979 8.9921 116.1470 61.9253 72.7436 172.9610 53 D 5.2478 9.0290 126.0937 53.6084 42.7427 175.0062 54 Y 4.8665 9.3046 121.6040 57.3844 41.2783 177.6050 55 G 4.4713 8.8623 111.8687 45.8848 0.0000 173.5243 56 I 3.9167 8.2890 116.9264 62.8485 37.9014 177.4737 57 F 4.7449 7.9670 115.5716 56.3772 39.9701 175.1360 58 Q 3.5955 7.9787 119.2622 57.0796 26.7129 174.2509 59 I 4.3335 8.1263 118.8233 61.0698 39.1416 176.8721 60 N 5.3612 9.1937 126.2669 53.3430 39.3431 175.8964 61 S 4.6109 9.4255 120.9260 60.7274 63.7987 176.3003 62 R 3.7428 8.8867 121.9101 58.6008 30.3526 177.9471 63 Y 4.2131 7.5907 111.1893 57.7669 40.7327 176.8530 64 W 4.9661 8.4833 118.8721 57.4577 31.0055 174.0712 65 C 5.6395 8.1592 112.3569 53.6684 45.4618 172.3652 66 N 5.2750 9.0321 119.4072 52.0776 40.3091 174.7924 67 D 4.8496 8.5808 123.0892 52.2086 40.6800 177.5590 68 G 4.1229 8.6911 112.5202 46.1897 0.0000 175.0332 69 K 4.2971 8.1090 116.1531 57.0932 33.3555 176.6714 70 T 4.3971 7.6992 118.1394 62.2746 68.9281 172.9977 71 P 4.2440 0.0000 0.0000 63.6826 32.3421 176.4807 72 G 3.8672 8.3447 109.2344 46.5629 0.0000 172.3376 73 A 4.7497 7.4904 118.0929 50.3079 22.0254 177.4506 74 V 4.3278 8.1854 112.3535 59.2543 35.5492 176.1739 75 N 4.9455 7.9692 116.9762 51.9955 37.6858 174.4509 76 A 3.9299 8.9056 125.1283 54.9841 19.0889 178.5231 77 C 4.5687 8.5848 111.2197 57.3559 41.1247 173.0321 78 H 4.0565 8.0039 116.3244 56.5831 26.2986 174.3613 79 L 4.8220 8.2172 117.4844 52.8319 46.4364 176.7727 80 S 4.6106 8.3819 115.7082 58.1253 63.2261 176.0123 81 C 4.1191 8.7928 124.2115 59.5084 40.8278 176.4195 82 S 3.8638 7.8885 115.0334 61.1059 61.6930 175.8094 83 A 4.1100 7.8219 122.4830 54.2096 18.1375 177.8702 84 L 4.4939 7.7737 116.7896 54.9359 41.7699 177.5291 85 L 5.0624 7.8698 117.1096 54.5198 42.5276 176.6886 86 Q 4.3994 7.9008 117.5055 55.2379 29.6341 175.9933 87 D 4.4097 8.5436 120.1514 57.0631 41.1570 176.7282 88 N 4.6000 8.0413 118.2008 53.1683 39.3765 174.6119 89 I 4.3001 8.4250 118.7424 60.9616 37.9898 177.1167 90 A 3.9362 8.3636 124.7814 56.0276 18.2217 180.2449 91 D 4.2698 8.0846 116.5157 57.4262 40.9748 178.7221 92 A 4.1127 7.9895 120.8825 55.1108 18.3690 179.7192 93 V 3.3733 8.2288 116.9517 66.0194 31.6912 178.0619 94 A 3.8233 8.1061 120.6914 55.2588 18.0708 178.8818 95 C 4.2184 8.3734 116.7123 59.7454 39.0680 175.5264 96 A 3.9152 8.3748 122.7639 55.2150 17.5556 179.8134 97 K 3.8736 7.7567 116.3781 59.3848 32.1407 179.2544 98 R 4.0918 7.7299 118.6752 59.2282 30.0588 178.6875 99 V 2.7296 7.6996 118.2286 65.8567 31.3600 178.1469 100 V 3.8767 7.7393 110.2104 62.9386 31.2391 178.2710 101 R 4.1305 7.6638 117.8847 57.6498 30.3987 176.5083 102 D 4.6974 7.5658 118.9235 52.9061 41.8253 175.3923 103 P 4.2189 0.0000 0.0000 66.1566 31.5473 178.4033 104 Q 4.0222 8.1873 116.2673 56.8173 29.9259 177.6909 105 G 3.8030 7.8853 106.9528 46.8650 0.0000 176.2276 106 I 3.4634 7.7752 120.5436 63.4678 37.8726 177.6618 107 R 4.2755 7.3036 116.8671 57.4171 29.9854 177.3722 108 A 4.0571 7.7761 121.3899 54.0903 18.7123 177.6252 109 W 4.7027 7.9943 116.1920 55.2935 30.1018 176.6314 110 D 4.4538 9.0961 123.4897 57.4706 40.5843 177.7922 111 A 4.0689 8.3732 120.7687 55.0827 18.1926 179.2566 112 W 3.9672 8.4524 126.6430 60.6326 30.5548 178.4452 113 R 3.8092 8.1192 116.5928 59.4069 29.6845 178.2818 114 N 4.4389 8.0588 114.9062 54.9527 38.7663 176.6772 115 R 4.2138 7.8200 116.1881 55.8205 31.8604 175.7063 116 C 4.5351 7.1660 114.1133 57.2698 43.0753 174.1872 117 Q 3.1638 6.7834 120.7104 57.0349 28.6829 175.5781 118 N 4.1717 8.5458 122.1575 54.6130 36.2961 173.9704 119 R 4.5150 7.3283 114.1074 54.1295 33.1586 176.1227 120 D 4.5656 8.4619 119.4923 54.0536 40.2828 175.9346 121 V 4.5985 8.1676 118.7340 61.2919 32.4798 178.2218 122 R 4.0048 8.1379 122.7023 59.6069 29.6322 178.6688 123 Q 4.0181 8.1160 115.4750 59.4429 28.2867 178.0980 124 Y 4.2903 7.9485 118.0735 59.8716 38.2288 176.6038 125 V 4.4060 7.8686 110.6517 60.7325 33.0218 175.5023 126 Q 4.1533 7.9766 120.1555 57.1272 28.9018 176.8600 127 G 3.9487 8.8661 109.9689 46.0835 0.0000 174.5490 128 C 4.4494 8.0072 115.6546 56.5284 40.6484 174.0682 129 G 3.8835 8.1117 107.2207 46.6554 0.0000 174.2006 130 V 4.0001 7.8680 118.1074 61.0727 31.9812 175.8618 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 K 8.17 4.16 0.00 2.01 1.61 0.00 1.25 0.00 0.00 0.88 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 1.11 7.81 2 V 8.18 4.53 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.94 4.49 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 4 E 9.11 4.27 0.00 1.93 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 2.45 0.00 5 R 9.04 3.43 0.00 1.99 1.92 0.00 3.37 0.00 0.00 3.44 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 6 C 8.02 4.36 0.00 3.00 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 7 E 8.11 3.91 0.00 2.06 2.25 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 2.65 2.43 0.00 8 L 7.98 3.52 0.00 1.28 1.28 -0.34 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.70 3.92 1.32 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 0.00 0.00 10 R 8.06 3.90 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.93 3.85 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 1.23 0.00 0.00 12 L 8.18 3.83 0.00 1.71 1.57 0.90 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.07 3.90 0.00 1.95 1.94 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.05 3.93 0.00 1.79 1.97 0.00 3.20 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.95 0.00 15 L 7.28 4.42 0.00 1.57 1.56 0.88 0.92 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 16 G 8.11 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 0.00 0.00 0.00 17 M 7.71 4.01 0.00 1.35 1.97 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.22 0.00 18 D 8.04 4.43 0.00 2.68 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 19 G 9.45 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 20 Y 8.25 4.20 0.00 3.39 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 21 R 9.01 3.59 0.00 1.88 1.83 0.00 3.33 0.00 0.00 2.97 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.35 0.00 22 G 8.19 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 23 I 7.71 4.02 1.76 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 0.85 0.58 -0.36 0.00 0.00 24 S 8.29 4.70 0.00 4.11 4.03 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 0.00 0.00 0.00 25 L 8.54 4.24 0.00 2.02 1.81 0.98 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.14 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.00 4.44 0.00 2.78 2.73 0.00 0.00 6.98 7.34 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 28 W 7.97 4.37 0.00 3.55 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 29 M 8.56 4.14 0.00 2.15 2.34 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 30 C 8.09 3.14 0.00 2.58 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.14 3.99 0.00 1.90 1.91 0.65 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.32 4.14 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 33 K 8.22 2.92 0.00 1.71 1.63 0.00 0.61 0.00 0.00 1.02 0.00 0.00 2.69 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.15 0.47 7.81 34 W 7.76 4.28 0.00 3.43 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 35 E 8.48 4.34 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.42 0.00 36 S 7.99 4.52 0.00 4.07 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 37 G 8.38 3.67 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 0.00 0.00 0.00 38 Y 7.72 3.65 0.00 3.28 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.75 5.27 0.00 2.85 2.88 0.00 0.00 6.99 6.55 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 40 T 8.93 4.08 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 41 R 8.07 4.61 0.00 1.76 2.01 0.00 3.19 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.59 0.00 42 A 7.99 4.34 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 43 T 8.30 5.14 4.12 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 1.29 0.00 0.00 44 N 8.66 4.86 0.00 2.88 2.77 0.00 0.00 6.93 6.93 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 45 Y 8.77 4.77 0.00 3.00 2.84 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 46 N 8.27 4.84 0.00 2.59 2.57 0.00 0.00 6.69 7.50 0.00 0.00 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 A 8.38 3.71 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 48 G 8.18 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 49 D 7.65 4.79 0.00 2.75 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 50 R 7.96 3.93 0.00 2.02 2.17 0.00 3.11 0.00 0.00 3.20 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.54 0.00 51 S 7.21 4.99 0.00 4.00 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 52 T 8.99 5.10 4.10 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 0.58 0.00 0.00 53 D 9.03 5.25 0.00 2.71 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 9.30 4.87 0.00 2.91 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 55 G 8.86 4.47 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 0.00 56 I 8.29 3.92 1.70 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.86 0.12 0.00 0.00 57 F 7.97 4.74 0.00 3.25 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 58 Q 7.98 3.60 0.00 2.55 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.84 0.00 0.00 0.00 0.00 0.00 2.53 2.71 0.00 59 I 8.13 4.33 2.14 0.00 0.00 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 1.36 0.97 1.11 0.00 0.00 60 N 9.19 5.36 0.00 3.11 3.09 0.00 0.00 6.97 7.63 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 61 S 9.43 4.61 0.00 4.10 4.62 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 62 R 8.89 3.74 0.00 1.58 1.54 0.00 2.85 0.00 0.00 2.88 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 63 Y 7.59 4.21 0.00 2.03 1.93 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 64 W 8.48 4.97 0.00 3.42 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 8.16 5.64 0.00 3.06 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 66 N 9.03 5.28 0.00 2.84 2.70 0.00 0.00 7.02 9.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.58 4.85 0.00 2.97 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 68 G 8.69 4.12 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 0.00 0.00 0.00 69 K 8.11 4.30 0.00 1.90 1.96 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.62 1.48 7.81 70 T 7.70 4.40 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 1.20 0.00 0.00 71 P 0.00 4.24 0.00 2.02 1.98 0.00 3.82 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 72 G 8.34 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 73 A 7.49 4.75 1.18 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 0.00 0.00 74 V 8.19 4.33 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 0.62 0.00 0.00 0.87 0.00 0.00 75 N 7.97 4.95 0.00 2.74 2.56 0.00 0.00 6.76 7.73 0.00 0.00 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 A 8.91 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.58 4.57 0.00 3.33 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 78 H 8.00 4.06 0.00 3.30 3.37 0.00 5.80 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.22 4.82 0.00 1.69 1.50 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.38 4.61 0.00 3.83 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 81 C 8.79 4.12 0.00 2.25 1.18 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 82 S 7.89 3.86 0.00 3.87 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 83 A 7.82 4.11 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 84 L 7.77 4.49 0.00 1.92 1.82 1.06 0.43 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 85 L 7.87 5.06 0.00 1.79 1.69 1.12 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.90 4.40 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 7.10 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 87 D 8.54 4.41 0.00 2.62 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 88 N 8.04 4.60 0.00 2.69 2.74 0.00 0.00 6.93 7.94 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 89 I 8.42 4.30 1.79 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.93 1.02 0.00 0.00 90 A 8.36 3.94 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 91 D 8.08 4.27 0.00 2.75 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 92 A 7.99 4.11 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 93 V 8.23 3.37 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 0.79 0.00 0.00 0.88 0.00 0.00 94 A 8.11 3.82 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 95 C 8.37 4.22 0.00 3.07 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 96 A 8.37 3.92 0.70 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 0.00 0.00 97 K 7.76 3.87 0.00 1.60 1.35 0.00 1.28 0.00 0.00 0.85 0.00 0.00 2.28 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.90 7.81 98 R 7.73 4.09 0.00 2.00 2.17 0.00 3.29 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.96 0.00 99 V 7.70 2.73 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 -0.35 0.00 0.00 -0.30 0.00 0.00 100 V 7.74 3.88 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 1.24 0.00 0.00 1.47 0.00 0.00 101 R 7.66 4.13 0.00 2.04 2.06 0.00 3.25 0.00 0.00 3.39 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.10 0.00 102 D 7.57 4.70 0.00 3.01 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 0.00 103 P 0.00 4.22 0.00 2.02 2.13 0.00 3.69 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 2.03 2.13 0.00 104 Q 8.19 4.02 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.83 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 105 G 7.89 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 0.00 0.00 0.00 106 I 7.78 3.46 0.97 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.78 0.00 0.00 107 R 7.30 4.28 0.00 2.04 2.04 0.00 3.24 0.00 0.00 3.30 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.47 0.00 108 A 7.78 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 7.99 4.70 0.00 3.56 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 9.10 4.45 0.00 2.82 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 0.00 111 A 8.37 4.07 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.45 3.97 0.00 3.48 3.47 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 0.00 113 R 8.12 3.81 0.00 2.19 2.01 0.00 3.33 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.99 0.00 114 N 8.06 4.44 0.00 2.56 2.75 0.00 0.00 6.89 7.12 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 0.00 115 R 7.82 4.21 0.00 1.33 0.89 0.00 2.21 0.00 0.00 2.65 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.20 0.00 116 C 7.17 4.54 0.00 1.57 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 0.00 117 Q 6.78 3.16 0.00 0.93 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 118 N 8.55 4.17 0.00 2.79 2.81 0.00 0.00 6.92 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 0.00 119 R 7.33 4.51 0.00 1.78 1.79 0.00 3.24 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 120 D 8.46 4.57 0.00 2.64 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.17 4.60 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.05 0.00 0.00 122 R 8.14 4.00 0.00 1.89 2.03 0.00 3.16 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.78 0.00 123 Q 8.12 4.02 0.00 2.02 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.12 0.00 0.00 0.00 0.00 0.00 2.13 1.74 0.00 124 Y 7.95 4.29 0.00 3.26 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 0.00 125 V 7.87 4.41 2.14 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 1.07 0.00 0.00 1.06 0.00 0.00 126 Q 7.98 4.15 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.55 2.30 0.00 127 G 8.87 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 0.00 0.00 0.00 128 C 8.01 4.45 0.00 2.98 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.11 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 0.00 130 V 7.87 4.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.96 0.00 0.00