NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.3467 8.2549 120.8691 56.0486 31.9199 175.1927 4 T 4.8215 7.7471 111.9980 57.9193 71.4953 171.5424 5 P 4.6510 0.0000 0.0000 63.0890 32.4659 175.7602 6 K 4.5183 9.3132 124.4155 55.8242 33.8759 175.9252 7 I 5.2361 8.2275 122.6332 59.8054 41.0352 174.8285 8 Q 4.7270 9.2304 124.3267 54.2977 32.7447 174.1134 9 V 5.0825 8.4619 123.8404 61.5895 33.5264 174.1079 10 Y 5.2199 8.1180 123.5290 56.6738 41.4580 173.2101 11 S 5.4902 9.1379 115.1229 57.1221 64.3459 174.2391 12 R 4.1347 8.7960 121.6373 59.1454 30.3464 176.1476 13 H 5.1879 8.5755 113.7646 52.7519 32.3146 172.4400 14 P 4.2244 0.0000 0.0000 63.0306 31.5766 176.3654 15 A 4.2201 8.7228 126.4936 52.2497 19.2062 176.5203 16 E 4.5003 8.6492 122.8695 54.7026 31.9518 173.9365 17 N 5.0774 8.3425 122.8197 54.5198 38.9731 175.9528 18 G 3.9867 8.8227 109.8602 45.7460 0.0000 173.5660 19 K 4.1733 7.5875 119.8200 55.0325 32.6326 176.8583 20 S 4.4938 8.3679 118.1732 58.4160 63.1765 172.9958 21 N 4.8967 8.5879 124.0415 52.9788 42.4290 172.2166 22 F 5.0872 8.9364 114.0432 55.9914 43.7877 173.4421 23 L 4.0913 8.6683 125.3497 53.3460 43.4755 174.6523 24 N 5.2367 8.4775 124.2285 51.6481 41.6908 173.3290 25 C 5.1795 9.2119 122.8117 54.9067 44.7166 171.3990 26 Y 5.1086 9.5736 127.6583 56.8768 39.2698 173.6865 27 V 4.8437 8.5762 128.1743 61.7467 33.6351 174.9210 28 S 4.9737 9.1195 121.0173 58.3248 66.8529 174.9279 29 G 3.9714 8.8353 106.2767 46.6261 0.0000 173.1364 30 F 5.0402 7.2077 113.7813 54.9626 40.6298 173.6636 31 H 4.8476 8.3828 116.2152 54.9233 32.2045 172.3761 32 P 4.5188 0.0000 0.0000 62.2775 32.4649 175.7563 33 S 4.2347 8.2998 111.6123 60.6581 63.3165 174.3770 34 D 4.3749 7.9977 120.8658 54.8680 40.7871 175.3671 35 I 4.5383 8.0272 123.0748 59.4393 41.6220 173.4587 36 E 4.4811 9.0111 129.2351 54.4961 31.7208 174.7004 37 V 4.5707 8.1168 127.1743 61.1064 33.5699 174.1987 38 D 5.0113 8.9646 127.9155 52.4193 44.5735 174.9573 39 L 4.9929 8.3354 121.3065 53.2467 43.9883 175.2835 40 L 5.1118 8.8564 123.7982 52.8419 44.8675 175.6430 41 K 4.3849 8.9395 124.4757 54.5745 34.1209 175.6114 42 N 4.2153 9.4970 128.0954 54.4473 36.1945 176.3740 43 G 3.8925 8.3833 105.2813 45.5609 0.0000 173.7102 44 E 4.3454 8.0731 121.0088 54.3193 30.2093 175.0895 45 R 4.2902 8.6965 124.6175 57.2226 30.3588 175.9709 46 I 4.1377 8.9518 128.0123 61.3019 36.8207 175.6665 47 E 4.4177 8.7179 124.5943 55.3719 32.0585 176.0986 48 K 3.7497 8.5933 118.2439 57.4483 29.5731 176.0802 49 V 3.7411 7.1454 116.4685 63.0720 32.0713 175.3407 50 E 4.6875 8.2027 126.5381 55.1778 32.3194 174.3311 51 H 5.4504 7.9497 115.2313 53.9009 31.5927 173.1451 52 S 4.5325 8.6337 115.1979 57.9585 63.9815 173.6676 53 D 4.4708 8.4948 120.0621 53.8305 41.1395 176.2947 54 L 4.0864 8.3616 125.0330 55.7456 42.8766 175.8358 55 S 4.7024 8.1963 119.0644 57.5353 66.4666 171.7832 56 F 5.1790 7.5259 113.1881 56.0794 40.3529 174.2330 57 S 4.6532 9.0645 117.1696 57.1075 64.0284 175.4628 58 K 3.6808 8.4418 122.3263 59.4535 31.7854 176.9189 59 D 4.3753 7.7953 115.4152 53.0123 39.5033 177.0187 60 W 3.6745 8.0370 119.7483 56.7131 27.4940 174.4574 61 S 4.3808 7.9885 114.2694 57.9686 64.2789 174.2165 62 F 4.7603 8.4750 121.9177 57.3760 40.9886 173.9311 63 Y 5.5198 8.2017 116.3896 56.3907 41.4657 173.7831 64 L 5.1802 9.6284 121.0258 53.2579 47.2172 174.9134 65 L 5.1348 8.9661 123.7711 53.8843 44.5452 174.7033 66 Y 5.2986 8.8935 124.4800 57.2157 40.3087 174.4785 67 Y 5.7443 8.3867 119.2186 57.8967 41.9735 173.0121 68 T 4.7208 8.1862 112.5373 60.9595 70.7285 172.5627 69 E 3.8664 8.8340 126.3860 56.5147 30.5169 175.9996 70 F 4.5562 7.6322 114.5443 56.7581 41.8921 173.1217 71 T 4.4273 7.7376 116.2719 60.8006 71.9313 171.3477 72 P 4.8454 0.0000 0.0000 63.1345 32.7123 176.5921 73 T 4.6528 8.6399 121.3402 62.1573 70.3018 174.1278 74 E 4.2304 8.9041 122.1387 57.8820 29.9273 177.0016 75 K 4.4469 7.8520 115.6843 57.1834 34.2481 176.4949 76 D 4.5140 8.0108 118.9422 54.2038 41.5779 175.0946 77 E 4.9790 8.1677 120.4529 54.9190 33.6253 174.3889 78 Y 5.9722 9.0813 118.9347 55.7425 42.8248 173.9948 79 A 5.0010 8.4214 122.1593 51.2327 23.8552 175.0440 80 C 5.1998 9.5201 118.3869 55.0358 46.0106 172.6143 81 R 5.1668 8.9327 126.8266 54.5093 32.5560 174.6016 82 V 4.7523 8.9575 125.7693 61.2625 34.6872 173.6918 83 N 5.2969 8.9855 125.5537 52.1104 41.4889 173.2950 84 H 4.9507 8.3360 119.5277 55.0730 32.7841 174.9282 85 V 3.6264 8.3758 123.6899 64.5890 31.5830 176.9171 86 T 4.3309 8.0804 109.0728 61.4224 68.8228 173.4788 87 L 4.6004 8.0900 124.4913 52.9305 43.1834 177.6411 88 S 4.3285 8.7468 119.3661 60.4997 63.3181 174.2222 89 Q 4.5919 7.3539 118.2059 53.2702 31.3942 172.5408 90 P 4.4284 0.0000 0.0000 63.3894 31.9229 175.1837 91 K 4.5782 9.1870 125.0574 55.0899 34.3629 175.1291 92 I 5.2607 8.2555 126.6091 59.6324 40.6551 174.8624 93 V 4.6643 8.8312 126.8253 59.6098 34.3547 174.8069 94 K 5.0507 8.5726 122.2302 54.7725 34.9346 175.6766 95 W 4.4836 9.4158 133.3487 57.5985 31.7013 175.1026 96 D 4.2457 8.3100 125.7988 51.8187 41.8945 176.1368 97 R 3.9469 7.2611 123.8246 58.2291 29.2459 176.9544 98 D 4.6884 7.9705 117.4107 54.8855 41.4120 176.3674 99 M 4.3904 8.4127 124.9442 55.4986 32.9228 174.9814 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 3 R 8.25 4.35 0.00 1.80 2.06 0.00 3.23 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.77 0.00 4 T 7.75 4.82 4.28 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 1.23 0.00 0.00 5 P 0.00 4.65 0.00 1.99 1.97 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.82 0.00 6 K 9.31 4.52 0.00 1.87 1.80 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.46 7.81 7 I 8.23 5.24 1.91 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 1.33 0.60 0.97 0.00 0.00 8 Q 9.23 4.73 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 9 V 8.46 5.08 2.34 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 0.96 0.00 0.00 1.11 0.00 0.00 10 Y 8.12 5.22 0.00 3.19 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 11 S 9.14 5.49 0.00 4.34 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 12 R 8.80 4.13 0.00 1.87 2.04 0.00 2.93 0.00 0.00 2.99 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.46 0.00 13 H 8.58 5.19 0.00 3.22 3.20 0.00 5.74 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.22 0.00 2.10 2.11 0.00 3.79 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 2.10 2.19 0.00 15 A 8.72 4.22 1.64 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 0.00 0.00 16 E 8.65 4.50 0.00 1.99 1.78 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 2.29 2.35 0.00 17 N 8.34 5.08 0.00 2.77 2.82 0.00 0.00 7.31 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 18 G 8.82 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 0.00 0.00 0.00 19 K 7.59 4.17 0.00 1.88 1.72 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.59 1.65 7.81 20 S 8.37 4.49 0.00 3.70 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 21 N 8.59 4.90 0.00 2.47 2.13 0.00 0.00 6.85 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 8.94 5.09 0.00 2.96 2.88 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 23 L 8.67 4.09 0.00 0.27 0.77 -0.04 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.48 5.24 0.00 1.44 2.06 0.00 0.00 5.95 8.24 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 25 C 9.21 5.18 0.00 2.94 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 26 Y 9.57 5.11 0.00 3.36 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 27 V 8.58 4.84 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 0.81 0.00 0.00 0.88 0.00 0.00 28 S 9.12 4.97 0.00 3.84 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 29 G 8.84 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 0.00 0.00 0.00 30 F 7.21 5.04 0.00 3.11 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 31 H 8.38 4.85 0.00 3.13 3.24 0.00 5.73 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 32 P 0.00 4.52 0.00 2.24 2.15 0.00 3.96 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 33 S 8.30 4.23 0.00 3.35 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 34 D 8.00 4.37 0.00 2.66 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 35 I 8.03 4.54 1.59 0.00 0.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.64 0.84 0.00 0.00 36 E 9.01 4.48 0.00 2.00 1.70 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 2.11 2.16 0.00 37 V 8.12 4.57 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.50 0.00 0.00 38 D 8.96 5.01 0.00 2.51 2.46 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 39 L 8.34 4.99 0.00 1.60 1.54 0.89 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.86 5.11 0.00 1.58 1.54 0.91 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.94 4.38 0.00 1.85 1.67 0.00 1.91 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.15 0.88 7.81 42 N 9.50 4.22 0.00 2.81 2.84 0.00 0.00 7.06 7.24 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 43 G 8.38 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 44 E 8.07 4.35 0.00 2.14 1.88 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 2.24 2.35 0.00 45 R 8.70 4.29 0.00 1.80 1.88 0.00 3.38 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 46 I 8.95 4.14 1.95 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.82 0.92 0.00 0.00 47 E 8.72 4.42 0.00 1.88 1.85 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 2.33 2.27 0.00 48 K 8.59 3.75 0.00 1.90 1.89 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.40 7.81 49 V 7.15 3.74 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 0.79 0.00 0.00 0.95 0.00 0.00 50 E 8.20 4.69 0.00 1.16 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 2.13 2.08 0.00 51 H 7.95 5.45 0.00 2.05 2.14 0.00 5.72 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.63 4.53 0.00 3.98 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 53 D 8.49 4.47 0.00 2.69 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 54 L 8.36 4.09 0.00 1.63 1.60 0.82 0.47 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 55 S 8.20 4.70 0.00 3.72 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 7.53 5.18 0.00 2.92 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 57 S 9.06 4.65 0.00 4.17 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 58 K 8.44 3.68 0.00 1.57 1.74 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.28 1.20 7.81 59 D 7.80 4.38 0.00 2.81 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 60 W 8.04 3.67 0.00 3.20 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 61 S 7.99 4.38 0.00 3.98 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 62 F 8.47 4.76 0.00 1.51 2.53 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 63 Y 8.20 5.52 0.00 2.90 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 64 L 9.63 5.18 0.00 1.90 1.63 1.14 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.97 5.13 0.00 2.04 1.65 1.10 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.89 5.30 0.00 3.02 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.39 5.74 0.00 3.09 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 8.19 4.72 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 69 E 8.83 3.87 0.00 1.73 1.50 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 0.00 1.56 2.28 0.00 70 F 7.63 4.56 0.00 2.67 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 71 T 7.74 4.43 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 1.15 0.00 0.00 72 P 0.00 4.85 0.00 2.34 2.18 0.00 3.42 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.74 0.00 73 T 8.64 4.65 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 1.28 0.00 0.00 74 E 8.90 4.23 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 2.30 2.32 0.00 75 K 7.85 4.45 0.00 1.89 1.92 0.00 1.64 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.44 7.81 76 D 8.01 4.51 0.00 2.82 2.41 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 0.00 77 E 8.17 4.98 0.00 1.81 1.81 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 2.31 2.48 0.00 78 Y 9.08 5.97 0.00 2.88 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 79 A 8.42 5.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 C 9.52 5.20 0.00 2.93 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 81 R 8.93 5.17 0.00 1.87 1.69 0.00 3.17 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 82 V 8.96 4.75 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 0.73 0.00 0.00 0.78 0.00 0.00 83 N 8.99 5.30 0.00 2.56 2.63 0.00 0.00 6.00 8.10 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 84 H 8.34 4.95 0.00 3.04 3.03 0.00 5.68 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.38 3.63 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 0.69 0.00 0.00 0.92 0.00 0.00 86 T 8.08 4.33 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 87 L 8.09 4.60 0.00 1.84 1.80 0.90 0.67 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 88 S 8.75 4.33 0.00 3.98 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 89 Q 7.35 4.59 0.00 2.29 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.83 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 90 P 0.00 4.43 0.00 2.07 2.09 0.00 3.74 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 1.98 1.96 0.00 91 K 9.19 4.58 0.00 1.80 1.67 0.00 1.58 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.40 7.81 92 I 8.26 5.26 1.87 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 1.39 0.77 0.93 0.00 0.00 93 V 8.83 4.66 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 0.94 0.00 0.00 1.02 0.00 0.00 94 K 8.57 5.05 0.00 1.85 1.90 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.44 7.81 95 W 9.42 4.48 0.00 3.32 3.53 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 96 D 8.31 4.25 0.00 2.54 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 0.00 0.00 0.00 0.00 97 R 7.26 3.95 0.00 2.01 1.26 0.00 3.05 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.58 0.00 98 D 7.97 4.69 0.00 2.80 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 99 M 8.41 4.39 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00