NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.5079 8.1693 120.6422 55.3001 43.1188 175.3972 8 H 4.8565 8.4126 114.6274 53.9549 31.5261 171.0532 9 K 4.6854 9.3817 120.8094 55.5228 33.6056 177.0945 10 E 4.9923 9.1354 124.3354 53.7225 33.1336 173.7447 11 P 4.8758 0.0000 0.0000 62.9533 32.5993 174.8757 12 A 5.0237 8.5611 122.2970 51.1345 23.1397 175.3376 13 T 4.6764 8.5523 114.7609 61.3075 72.3009 174.0442 14 L 4.2205 8.7152 127.4926 55.9706 42.4796 175.1254 15 I 4.4554 8.5123 123.6603 62.0955 39.5050 175.5722 16 K 4.6168 8.3058 121.4826 55.1339 35.9820 174.3419 17 A 4.5888 8.6980 130.4182 51.9150 19.4787 176.8178 18 I 4.2588 8.0064 122.3821 62.5970 39.4779 174.9911 19 D 4.5414 7.5118 117.2267 53.0933 43.8716 175.7633 20 G 3.8322 8.8100 109.8530 47.2702 0.0000 173.9399 21 D 4.9112 8.0881 116.5669 53.0533 40.8913 175.2518 22 T 5.2392 7.7156 116.1668 62.1781 72.5465 173.3743 23 V 4.7605 8.9465 118.2966 59.5103 36.7773 174.1402 24 K 5.0083 9.2292 125.4063 55.2289 33.6855 175.2985 25 L 5.3595 9.2930 127.0060 53.0867 46.3827 175.2864 26 M 4.8165 9.3430 122.4935 55.0672 33.5684 174.2698 27 Y 5.0047 9.2725 127.9685 56.1063 42.0669 175.5992 28 K 3.7589 9.6035 126.9298 57.4055 29.7810 176.0696 29 G 4.0407 8.5698 106.4139 44.8769 0.0000 173.5536 30 Q 4.9167 7.8365 117.9055 53.2369 31.7769 173.4575 31 P 4.9276 0.0000 0.0000 63.5439 32.3846 175.2198 32 M 4.7970 9.1684 121.5853 54.6857 36.4233 173.3602 33 T 4.8258 8.5000 122.2824 62.9310 70.4263 173.4340 34 F 5.0926 9.5805 125.3463 55.6269 42.0283 174.3578 35 R 4.8957 8.8864 124.0728 54.6742 31.8964 175.1900 36 L 4.4229 8.8334 127.6381 54.3426 42.2956 177.1448 37 L 3.9448 8.4641 124.6330 55.9875 42.7576 178.3227 38 L 3.8383 9.0317 120.6093 55.0356 39.3335 174.0680 39 V 5.0268 7.3543 110.5155 59.6092 35.3315 174.8105 40 D 5.0204 9.2526 124.6834 52.9373 42.8759 175.8854 41 T 4.5129 8.3890 113.8912 59.3601 70.9048 173.0634 42 P 4.4534 0.0000 0.0000 62.5685 32.3580 175.3009 43 E 4.5816 10.0351 123.1888 55.0211 31.1321 176.7015 44 T 4.5228 8.0835 113.7121 61.8657 70.7097 175.1256 45 K 4.5648 7.6366 119.5205 55.1725 32.5125 174.5886 46 H 4.5228 8.6012 122.7340 55.2878 31.1354 173.9975 47 P 4.2902 0.0000 0.0000 65.0614 31.4926 176.4456 48 K 4.4268 7.3781 112.5208 57.6719 34.8882 177.3436 49 K 4.1020 8.8912 118.2355 56.1661 33.2446 179.2034 50 G 4.3370 8.6352 111.3213 46.7082 0.0000 174.4172 51 V 4.7348 8.5289 121.5243 60.7854 31.4903 173.7706 52 E 4.1791 9.1098 125.8658 54.7831 30.3663 176.3419 53 K 4.0557 8.1680 121.8537 57.9061 32.5500 176.6469 54 Y 3.9689 8.5700 123.0486 58.3760 36.0156 171.0988 55 G 3.6994 8.0226 107.4180 47.5088 0.0000 174.1497 56 P 4.2918 0.0000 0.0000 64.8289 31.3315 178.5099 57 E 4.1041 8.1391 115.9122 59.0952 29.8465 178.7980 58 A 3.9997 8.4806 122.3072 55.0467 18.5468 179.5776 59 S 4.1738 8.4443 111.6889 61.4237 62.3957 176.2588 60 A 4.0823 8.2965 123.6535 54.7704 18.0906 179.4711 61 F 3.9768 8.3687 119.4432 61.7746 39.3557 177.4239 62 T 3.9612 8.1732 115.4048 66.5182 68.1769 176.3194 63 K 3.9674 7.9284 120.8835 59.5540 32.3018 178.8553 64 K 3.8733 8.2609 118.8918 59.7770 31.7924 179.0847 65 M 3.8614 7.6440 117.0283 58.3559 32.4501 177.5676 66 I 3.9510 7.8585 118.5975 63.6064 38.1188 177.5912 67 E 4.0621 8.7819 119.4802 58.7416 29.2470 177.9708 68 N 4.7233 7.8265 114.1205 52.1272 39.1580 174.7676 69 A 4.6799 7.0098 123.3057 51.1220 20.1390 178.5504 70 K 4.1498 8.9972 120.6866 58.5269 32.6205 178.1497 71 K 4.6030 8.8603 118.7210 54.4808 35.6366 175.2845 72 I 4.9788 8.4153 125.1744 59.3188 40.5034 173.9423 73 E 5.1957 9.1637 127.3929 54.6838 33.9139 174.8764 74 V 4.5776 9.3419 116.6222 59.4655 34.9900 174.5326 75 E 5.0198 8.9938 125.2973 54.4612 32.0537 175.1210 76 F 4.6856 8.9362 125.7435 57.4415 40.3002 175.7029 77 D 4.9466 8.5118 120.6629 53.3799 43.1821 175.6568 78 K 4.3916 8.8969 117.0845 57.5803 33.7728 177.5777 79 G 4.0861 8.2754 112.5451 44.8575 0.0000 173.4336 80 Q 4.0925 8.6107 119.4223 56.8179 29.1929 176.4019 81 R 4.7998 8.4650 117.4867 56.3641 31.6189 175.4638 82 T 5.1828 7.6743 108.5895 60.0928 72.3830 173.3626 83 D 4.9692 8.5856 123.5093 51.7501 42.3284 176.8083 84 K 4.0063 8.6192 116.2893 58.9775 32.6215 176.8432 85 Y 4.3304 8.3644 117.0499 57.6898 37.9856 176.4891 86 G 3.9215 8.2060 108.1411 45.4152 0.0000 174.0113 87 R 4.3003 7.9230 119.2148 55.1880 31.5841 176.3913 88 G 3.5688 8.6317 111.2484 46.3410 0.0000 172.4188 89 L 5.3170 8.9141 123.3252 53.0458 43.4555 175.6647 90 A 4.4634 8.4002 124.7938 50.8209 23.5322 174.0362 91 Y 4.8410 8.8472 117.4964 57.2256 39.7305 175.0751 92 I 4.7366 8.6734 124.7737 59.6614 40.2796 174.1179 93 Y 5.0937 8.9706 123.6963 56.1213 40.9820 174.3557 94 A 4.8897 9.1937 127.0330 50.3692 21.0634 176.6681 95 D 4.3474 9.9102 125.8205 55.7282 39.0470 175.3021 96 G 3.9691 8.4046 105.1452 45.2086 0.0000 173.1991 97 K 4.5442 7.9492 120.3097 54.4727 33.9666 175.2641 98 M 3.9882 8.5624 123.6703 55.1308 33.0505 176.9225 99 V 3.6715 8.7348 127.3927 66.1546 31.2516 177.7169 100 N 4.3458 7.9771 115.8684 56.2750 38.4166 176.8286 101 E 3.9375 8.0893 120.0056 58.9973 29.9937 178.1818 102 A 4.0538 8.0647 120.9242 55.4293 18.4588 179.6289 103 L 3.4850 7.9514 117.2268 57.8003 41.6936 180.0195 104 V 3.8683 7.4059 118.8814 65.5042 31.2814 178.0533 105 R 3.9426 8.4512 117.7249 59.0970 29.9508 177.5106 106 Q 4.3323 7.6926 114.9521 54.8357 29.1134 175.7878 107 G 3.9323 8.0663 108.6868 47.0130 0.0000 174.8179 108 L 4.6776 8.0072 116.7041 53.7074 42.8274 176.2665 109 A 4.6351 7.4512 119.3574 51.0538 22.5697 175.9117 110 K 5.0208 8.7263 119.3198 54.5206 35.2732 176.1280 111 V 4.2675 9.1107 123.4578 62.9269 32.0076 176.0766 112 A 4.6808 8.6932 130.4257 50.4295 19.8776 176.2789 113 Y 3.7325 8.5248 120.3491 57.8232 39.1558 175.4193 114 V 4.0739 7.0858 126.5016 61.5103 33.3010 174.5992 115 Y 4.7258 8.1049 121.8341 55.7645 40.3975 175.2880 116 K 4.4390 8.7750 126.4526 56.0691 32.9097 174.1536 117 P 4.8823 0.0000 0.0000 63.0703 32.0869 176.6316 118 N 4.9148 8.1523 118.1985 52.5380 37.0178 175.4984 119 N 5.0882 7.8160 112.6747 53.5074 39.1552 177.2866 120 T 3.8597 8.1982 118.0806 67.4848 68.7478 174.7767 121 H 4.8736 7.9257 116.7455 55.7006 29.2625 176.6074 122 E 3.9592 8.4524 122.8889 59.6143 29.2793 178.7379 123 Q 3.9372 8.0226 117.3433 59.2174 28.8839 177.7751 124 H 4.0383 8.3393 118.6981 59.7106 29.6730 176.9816 125 L 4.0072 8.0320 120.3302 57.7931 41.4348 179.7595 126 R 3.9065 8.2361 118.3503 58.9331 30.0098 179.2571 127 K 3.9455 8.3810 118.9512 59.5651 32.0134 179.5546 128 S 4.0909 7.9656 115.4683 61.4948 62.6883 176.4069 129 E 3.9229 8.5379 122.2224 59.0435 29.3565 178.6910 130 A 3.7566 7.9496 121.0025 54.9333 18.3000 179.4564 131 Q 3.7768 7.9453 117.6126 59.3348 29.2063 178.2268 132 A 3.9847 8.0660 121.7505 54.9556 18.2594 179.9373 133 K 3.3024 7.4881 117.0807 59.3482 31.9075 179.4393 134 K 3.8377 7.6709 118.4021 59.2593 32.1514 177.7051 135 E 4.2435 8.2055 116.2279 55.3787 29.9096 176.2794 136 K 4.1952 7.7919 116.9760 56.2310 30.5761 175.3611 137 L 4.3664 8.0136 118.1401 55.3380 44.4239 177.5864 138 N 3.6160 9.2911 120.1482 53.9991 37.7883 176.3416 139 I 3.0447 5.4200 125.8507 64.6186 37.6648 176.6232 140 W 4.9094 8.1309 118.6035 56.4995 29.1633 176.6314 141 S 4.4598 7.9782 119.6881 58.4152 62.6538 173.9137 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 7 L 8.17 4.51 0.00 1.74 1.81 1.08 0.88 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 8 H 8.41 4.86 0.00 3.20 3.25 0.00 5.71 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 9 K 9.38 4.69 0.00 1.57 1.68 0.00 1.31 0.00 0.00 0.69 0.00 0.00 2.38 0.00 0.00 2.28 0.00 0.00 0.00 0.00 1.18 1.28 7.81 10 E 9.14 4.99 0.00 2.15 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 2.33 2.21 0.00 11 P 0.00 4.88 0.00 2.10 2.06 0.00 3.79 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 12 A 8.56 5.02 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 13 T 8.55 4.68 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 14 L 8.72 4.22 0.00 1.64 1.57 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.51 4.46 2.02 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 1.27 0.91 0.94 0.00 0.00 16 K 8.31 4.62 0.00 1.82 1.61 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.41 7.81 17 A 8.70 4.59 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 18 I 8.01 4.26 2.04 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 1.19 0.71 0.91 0.00 0.00 19 D 7.51 4.54 0.00 2.71 2.62 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 20 G 8.81 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 21 D 8.09 4.91 0.00 2.82 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 22 T 7.72 5.24 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 1.27 0.00 0.00 23 V 8.95 4.76 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 0.72 0.00 0.00 0.96 0.00 0.00 24 K 9.23 5.01 0.00 1.82 1.85 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.45 7.81 25 L 9.29 5.36 0.00 1.87 1.65 0.92 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.34 4.82 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 27 Y 9.27 5.00 0.00 3.25 3.01 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 28 K 9.60 3.76 0.00 1.58 1.62 0.00 1.63 0.00 0.00 1.49 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.63 0.21 7.81 29 G 8.57 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.84 4.92 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.28 2.63 0.00 31 P 0.00 4.93 0.00 2.14 2.14 0.00 3.81 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 2.02 2.00 0.00 32 M 9.17 4.80 0.00 1.96 2.20 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 2.63 2.39 0.00 33 T 8.50 4.83 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 1.22 0.00 0.00 34 F 9.58 5.09 0.00 3.01 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 35 R 8.89 4.90 0.00 1.93 1.94 0.00 3.35 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 36 L 8.83 4.42 0.00 1.55 1.61 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.46 3.94 0.00 1.16 1.30 0.39 0.35 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 38 L 9.03 3.84 0.00 2.04 1.92 1.11 1.02 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 39 V 7.35 5.03 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 0.78 0.00 0.00 0.96 0.00 0.00 40 D 9.25 5.02 0.00 2.56 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 41 T 8.39 4.51 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 1.25 0.00 0.00 42 P 0.00 4.45 0.00 2.31 1.99 0.00 3.55 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 2.13 2.01 0.00 43 E 10.04 4.58 0.00 2.16 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 2.40 2.45 0.00 44 T 8.08 4.52 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 1.22 0.00 0.00 45 K 7.64 4.56 0.00 1.81 1.82 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.36 7.81 46 H 8.60 4.52 0.00 3.17 3.29 0.00 5.62 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.29 0.00 1.91 2.03 0.00 3.04 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 1.85 1.98 0.00 48 K 7.38 4.43 0.00 1.81 1.83 0.00 1.57 0.00 0.00 1.55 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.36 7.81 49 K 8.89 4.10 0.00 1.68 1.58 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.33 7.81 50 G 8.64 4.34 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 0.00 51 V 8.53 4.73 2.06 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 0.84 0.00 0.00 0.96 0.00 0.00 52 E 9.11 4.18 0.00 1.98 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 2.25 2.39 0.00 53 K 8.17 4.06 0.00 1.61 1.65 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.77 1.16 7.81 54 Y 8.57 3.97 0.00 3.17 3.04 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 0.00 0.00 0.00 55 G 8.02 3.70 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 0.00 56 P 0.00 4.29 0.00 2.16 2.11 0.00 3.57 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 57 E 8.14 4.10 0.00 2.25 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 2.64 2.59 0.00 58 A 8.48 4.00 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 59 S 8.44 4.17 0.00 3.92 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 60 A 8.30 4.08 1.41 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 0.00 0.00 61 F 8.37 3.98 0.00 3.20 3.20 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 0.00 0.00 0.00 62 T 8.17 3.96 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 1.28 0.00 0.00 63 K 7.93 3.97 0.00 1.92 2.07 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.48 7.81 64 K 8.26 3.87 0.00 1.91 1.71 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.45 7.81 65 M 7.64 3.86 0.00 1.87 1.60 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 66 I 7.86 3.95 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.06 1.03 0.00 0.00 67 E 8.78 4.06 0.00 1.94 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 2.34 2.50 0.00 68 N 7.83 4.72 0.00 2.75 2.79 0.00 0.00 6.94 6.65 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 69 A 7.01 4.68 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 70 K 9.00 4.15 0.00 1.90 1.87 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.40 7.81 71 K 8.86 4.60 0.00 1.77 1.67 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.34 7.81 72 I 8.42 4.98 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.41 0.92 0.00 0.00 73 E 9.16 5.20 0.00 1.94 1.83 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 2.21 2.26 0.00 74 V 9.34 4.58 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 -0.05 0.00 0.00 0.69 0.00 0.00 75 E 8.99 5.02 0.00 2.25 2.33 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 2.52 2.41 0.00 76 F 8.94 4.69 0.00 3.02 2.94 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 77 D 8.51 4.95 0.00 2.67 3.01 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 78 K 8.90 4.39 0.00 1.89 1.96 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.48 7.81 79 G 8.28 4.09 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 0.00 0.00 0.00 80 Q 8.61 4.09 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.83 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 81 R 8.46 4.80 0.00 1.50 1.50 0.00 2.26 0.00 0.00 2.59 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.45 0.00 82 T 7.67 5.18 4.20 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 0.00 0.00 1.15 0.00 0.00 83 D 8.59 4.97 0.00 2.83 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 84 K 8.62 4.01 0.00 1.59 1.77 0.00 1.33 0.00 0.00 1.54 0.00 0.00 2.55 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.87 0.45 7.81 85 Y 8.36 4.33 0.00 3.11 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 86 G 8.21 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 87 R 7.92 4.30 0.00 2.09 1.82 0.00 3.14 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 88 G 8.63 3.57 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 0.00 89 L 8.91 5.32 0.00 1.57 1.61 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.40 4.46 0.82 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 91 Y 8.85 4.84 0.00 2.96 2.62 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 92 I 8.67 4.74 1.76 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.77 0.80 0.00 0.00 93 Y 8.97 5.09 0.00 2.90 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 94 A 9.19 4.89 1.20 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 0.00 0.00 0.00 0.00 0.00 95 D 9.91 4.35 0.00 2.73 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 96 G 8.40 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 97 K 7.95 4.54 0.00 2.01 1.76 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.37 7.81 98 M 8.56 3.99 0.00 1.92 1.62 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.48 0.00 99 V 8.73 3.67 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 1.04 0.00 0.00 0.92 0.00 0.00 100 N 7.98 4.35 0.00 2.90 2.92 0.00 0.00 6.80 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 0.00 101 E 8.09 3.94 0.00 2.00 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 2.30 0.00 102 A 8.06 4.05 1.67 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 0.00 103 L 7.95 3.48 0.00 1.82 1.61 1.05 0.85 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 0.00 104 V 7.41 3.87 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 1.17 0.00 0.00 1.01 0.00 0.00 105 R 8.45 3.94 0.00 2.00 2.08 0.00 3.33 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.69 4.33 0.00 1.80 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.46 0.00 0.00 0.00 0.00 0.00 2.39 2.14 0.00 107 G 8.07 3.93 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 0.00 108 L 8.01 4.68 0.00 1.24 1.46 0.53 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.45 4.64 1.16 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 0.00 0.00 110 K 8.73 5.02 0.00 1.71 1.80 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.34 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.89 1.18 7.81 111 V 9.11 4.27 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 0.76 0.00 0.00 1.02 0.00 0.00 112 A 8.69 4.68 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.52 3.73 0.00 2.89 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 0.00 114 V 7.09 4.07 1.82 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 0.85 0.00 0.00 0.95 0.00 0.00 115 Y 8.10 4.73 0.00 3.04 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 0.00 116 K 8.78 4.44 0.00 1.76 1.76 0.00 1.79 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.55 7.81 117 P 0.00 4.88 0.00 2.25 2.14 0.00 3.86 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 118 N 8.15 4.91 0.00 2.94 2.89 0.00 0.00 6.62 8.78 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 0.00 119 N 7.82 5.09 0.00 3.00 2.98 0.00 0.00 6.08 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 0.00 120 T 8.20 3.86 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 1.10 0.00 0.00 121 H 7.93 4.87 0.00 2.86 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.45 3.96 0.00 2.17 1.96 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 2.30 2.35 0.00 123 Q 8.02 3.94 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.60 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 124 H 8.34 4.04 0.00 3.22 3.49 0.00 5.87 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 0.00 125 L 8.03 4.01 0.00 1.91 1.72 1.03 0.87 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 0.00 126 R 8.24 3.91 0.00 2.04 1.94 0.00 3.10 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 127 K 8.38 3.95 0.00 1.87 1.80 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.52 7.81 128 S 7.97 4.09 0.00 3.95 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 0.00 129 E 8.54 3.92 0.00 2.04 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 2.10 2.54 0.00 130 A 7.95 3.76 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 0.00 131 Q 7.95 3.78 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 132 A 8.07 3.98 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 0.00 133 K 7.49 3.30 0.00 1.60 1.35 0.00 0.85 0.00 0.00 0.85 0.00 0.00 2.58 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.30 0.21 7.81 134 K 7.67 3.84 0.00 1.67 1.93 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.44 7.81 135 E 8.21 4.24 0.00 1.96 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 2.30 2.50 0.00 136 K 7.79 4.20 0.00 1.92 1.93 0.00 1.69 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.36 7.81 137 L 8.01 4.37 0.00 1.80 1.67 1.04 0.78 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 0.00 138 N 9.29 3.62 0.00 2.64 1.57 0.00 0.00 7.12 7.40 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 0.00 139 I 5.42 3.04 0.96 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 -0.17 -1.15 0.00 0.00 140 W 8.13 4.91 0.00 3.52 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 0.00 141 S 7.98 4.46 0.00 4.02 4.11 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