NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3229 8.3044 120.3258 55.3275 33.3973 173.5699 2 V 3.8500 8.1395 119.7758 61.5453 31.5404 174.1796 3 D 4.5926 9.1909 128.8593 53.3336 43.9389 173.6332 4 Q 4.4503 8.1688 121.9688 56.1741 32.2107 175.0066 5 N 5.0628 7.6992 111.9965 52.9669 45.7800 174.0961 6 P 4.9922 0.0000 0.0000 63.2407 31.8182 177.6156 7 E 4.1907 8.1015 121.4463 60.3554 29.6705 178.3286 8 E 4.3418 8.3415 118.1498 59.5054 29.6937 178.4650 9 Y 3.9725 8.5786 116.6118 60.8144 37.8909 177.7755 10 Y 4.2954 8.1394 118.0287 59.3884 37.8434 178.2181 11 L 3.1137 7.5337 121.9319 58.3729 39.9358 178.8818 12 E 3.8834 8.2807 120.6124 59.8564 29.6268 179.1943 13 G 3.9411 7.9315 105.5483 47.7226 0.0000 175.9072 14 V 3.6387 7.5316 120.2001 66.2388 31.5804 177.4707 15 L 3.8805 7.8858 118.2611 58.2968 41.2338 179.0367 16 Q 4.0431 7.3674 118.6666 59.3222 29.1510 178.4564 17 Y 3.8694 7.5837 114.3343 62.3619 38.0241 178.3605 18 D 4.6797 9.1944 120.8461 55.7711 41.4810 176.4622 19 A 3.9577 8.5453 127.2577 52.1911 18.9199 178.5331 20 G 3.9004 8.2146 115.7444 45.3545 0.0000 173.4443 21 N 4.4102 7.0124 120.3066 51.4802 39.5587 173.9398 22 Y 4.3045 6.1246 120.1497 60.6668 38.8640 180.0275 23 T 3.8514 8.3427 116.5860 66.5163 69.0613 175.7494 24 E 4.0382 8.9395 122.4091 59.4717 29.5793 178.8803 25 S 4.1179 7.6281 113.6449 61.4749 62.5764 176.4099 26 I 3.7401 7.8310 122.5039 64.1086 37.5646 177.3942 27 D 4.3783 8.3696 120.0584 57.5193 40.6854 178.9456 28 L 4.1406 7.8911 118.8490 57.6464 41.7449 179.0737 29 F 4.1054 8.8500 120.9118 61.5010 39.3328 176.8119 30 E 3.7562 8.8802 118.4446 59.4439 29.2045 179.7558 31 K 3.7990 7.7222 118.1857 59.1614 31.9164 178.9947 32 A 3.5020 7.4715 119.7751 55.3522 18.4613 179.4921 33 I 3.5007 7.0602 117.9604 64.3791 36.8439 178.3102 34 Q 3.8993 7.6459 119.4292 59.1199 28.7457 178.4477 35 L 4.1879 7.4536 119.2127 55.7836 41.7829 177.1207 36 D 4.1701 6.9958 113.5923 52.8507 44.1423 173.2152 37 P 4.5919 0.0000 0.0000 62.0536 32.0820 175.2687 38 E 5.2574 8.3307 126.9919 56.1025 30.3582 175.8846 39 E 4.3564 7.4162 122.1071 54.8577 29.9602 176.0826 40 S 4.4132 8.8690 121.7472 61.5746 62.3959 175.4355 41 K 4.2089 8.4723 121.8490 60.1615 31.8060 177.8654 42 Y 4.1308 8.2259 116.3568 60.6512 37.8706 177.9447 43 W 4.4982 9.1117 120.5390 59.5090 28.7547 178.2325 44 L 4.1169 8.3195 120.0835 58.5136 41.6183 178.6053 45 M 4.0033 7.7486 117.7837 58.2980 32.0323 178.0038 46 K 3.5359 7.3908 118.7984 59.2175 32.3322 178.7415 47 G 3.8046 7.9884 105.4216 48.1198 0.0000 175.6781 48 K 4.2422 7.8408 120.5196 58.8726 31.9899 179.4332 49 A 3.8418 7.7416 120.7490 55.0917 18.3183 179.6897 50 L 3.8151 8.1008 117.8388 57.9612 41.7176 179.0419 51 Y 4.0703 8.4424 119.7172 60.9333 38.5641 177.8687 52 N 3.5172 7.6099 116.0869 55.9634 38.9314 175.9008 53 L 3.8443 6.9748 117.7119 54.4133 41.5179 177.0281 54 E 3.0568 7.2772 118.2916 56.8868 29.3071 176.1837 55 R 4.2461 7.1819 118.8198 55.1878 26.8162 176.3074 56 Y 4.2084 6.6783 120.2747 60.9457 38.3220 177.9673 57 E 3.9479 8.2105 118.7024 59.3435 30.3508 177.9550 58 E 4.5130 8.4411 119.9762 58.7696 29.9119 178.2360 59 A 4.0620 8.6989 121.1885 55.3578 18.3331 179.7160 60 V 3.6022 7.8654 116.5266 66.3085 31.4222 177.8133 61 D 4.4122 8.0476 118.3997 57.6750 40.5421 178.8589 62 C 4.0920 8.0348 116.8107 62.8281 28.0879 175.2902 63 Y 3.9396 8.0478 120.6498 60.8725 38.3375 177.6894 64 N 4.0476 8.6232 118.0744 56.4258 38.9082 176.1976 65 Y 3.6961 7.7655 121.1346 60.6902 39.0064 178.3471 66 V 3.3369 7.8084 119.0536 65.6795 31.2877 177.5709 67 I 3.9252 6.7095 118.2512 63.1369 37.2243 177.0268 68 N 4.3052 8.0660 118.4138 56.0155 38.9143 176.7082 69 V 3.4358 7.3521 120.1034 64.3218 32.2539 176.3129 70 I 4.3527 6.4552 118.5707 59.5558 38.6947 176.0399 71 E 4.1068 8.6012 123.7062 56.9902 29.4846 176.9483 72 D 4.6911 7.8621 118.7292 54.3762 40.8333 176.9759 73 E 4.6461 7.8891 119.9005 54.4771 28.0109 173.3058 74 Y 4.6346 8.0051 122.2894 56.4529 44.8152 173.4184 75 N 4.3761 7.8922 116.6259 53.5991 39.3799 175.4491 76 K 4.0044 8.6548 125.9708 59.6239 32.3100 178.9497 77 D 4.4177 8.1896 118.6161 57.3070 40.7984 178.9294 78 V 3.6594 7.8280 118.1239 65.9190 31.8238 177.8406 79 W 4.2022 8.3588 118.4753 59.8625 28.7766 178.3323 80 A 4.0721 8.5385 120.5591 55.0541 17.6801 179.4281 81 A 3.9376 8.1825 119.2617 55.2186 18.4457 179.6523 82 K 3.6024 7.9551 117.7288 59.4671 32.0992 178.4404 83 A 3.9178 7.7304 120.5413 55.6649 18.0386 179.2928 84 D 4.3050 7.5317 115.3153 57.3685 40.8509 178.8457 85 A 3.5070 6.8765 120.4952 55.0132 18.7039 179.4365 86 L 4.0204 7.9275 117.5776 57.7389 41.4757 179.5543 87 R 3.8529 7.9743 117.1376 57.9664 31.3798 176.5455 88 Y 4.5947 7.6055 115.4980 56.5857 39.0392 174.4390 89 I 4.1658 6.9497 118.6875 58.8702 41.5311 175.0723 90 E 4.3136 8.5750 126.8389 55.9214 29.0407 177.6829 91 G 4.1829 7.3449 118.2917 45.9665 0.0000 172.3807 92 K 4.1390 8.6541 124.8336 56.2620 32.4814 176.7995 93 E 4.2949 8.4962 121.4123 57.7673 30.2851 178.6656 94 V 3.7527 7.6835 111.8655 63.8124 31.5298 178.1449 95 E 3.8831 8.0794 118.2082 59.4320 29.4837 178.7802 96 A 3.9769 7.5417 119.3609 55.1707 18.2952 179.6313 97 E 3.8699 8.0086 116.5214 59.6879 29.7068 179.3128 98 I 3.6593 7.6799 119.5001 64.2258 37.1430 178.3747 99 A 4.0118 8.0405 121.4466 55.2856 18.2064 179.3439 100 E 3.8858 8.1916 116.8464 59.7092 29.3375 179.6893 101 A 3.9378 7.8856 119.3959 55.0486 18.5144 179.3166 102 R 3.7532 8.2433 116.4350 59.4259 29.8844 178.3528 103 A 4.1491 8.5590 120.9184 54.6617 18.5311 178.6978 104 K 4.4197 8.0960 115.8863 56.6169 32.0380 178.7792 105 L 3.9242 7.2444 122.8532 58.2476 42.0219 177.6031 106 E 3.7215 8.2942 118.4875 57.6322 29.8209 176.8789 107 H 3.7305 7.5920 111.5382 57.4519 29.8228 172.8582 108 H 4.8092 7.8467 110.6497 55.8742 30.7096 172.4579 109 H 4.7515 8.5386 116.6496 56.2611 32.5034 173.2757 110 H 4.1097 9.0602 117.6556 56.8164 25.4670 173.7455 111 H 4.3453 8.5949 121.4973 59.1764 30.3383 174.9762 112 H 4.2501 8.1870 119.2863 56.2909 28.4906 174.9471 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 M 8.30 4.32 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 2 V 8.14 3.85 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 0.77 0.00 0.00 0.91 0.00 0.00 3 D 9.19 4.59 0.00 2.63 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 4 Q 8.17 4.45 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 5 N 7.70 5.06 0.00 2.75 2.80 0.00 0.00 6.71 8.05 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 6 P 0.00 4.99 0.00 2.33 2.00 0.00 3.73 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.86 0.00 7 E 8.10 4.19 0.00 2.06 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 0.00 2.28 2.32 0.00 8 E 8.34 4.34 0.00 2.15 2.01 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 2.44 2.53 0.00 9 Y 8.58 3.97 0.00 3.32 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 10 Y 8.14 4.30 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 11 L 7.53 3.11 0.00 1.68 1.82 0.80 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.28 3.88 0.00 2.04 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 2.51 0.00 13 G 7.93 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 14 V 7.53 3.64 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 1.08 0.00 0.00 0.76 0.00 0.00 15 L 7.89 3.88 0.00 1.78 1.64 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.37 4.04 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.51 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 17 Y 7.58 3.87 0.00 3.25 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 18 D 9.19 4.68 0.00 2.70 2.61 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 0.00 0.00 0.00 0.00 19 A 8.55 3.96 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 20 G 8.21 3.90 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 0.00 0.00 0.00 21 N 7.01 4.41 0.00 2.48 2.49 0.00 0.00 6.67 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 22 Y 6.12 4.30 0.00 3.13 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 23 T 8.34 3.85 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 1.24 0.00 0.00 24 E 8.94 4.04 0.00 1.92 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 2.29 2.30 0.00 25 S 7.63 4.12 0.00 4.30 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 26 I 7.83 3.74 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 1.76 1.37 0.95 0.00 0.00 27 D 8.37 4.38 0.00 2.81 2.73 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 0.00 0.00 0.00 0.00 28 L 7.89 4.14 0.00 1.83 1.83 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.85 4.11 0.00 3.04 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 30 E 8.88 3.76 0.00 2.20 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 2.33 2.58 0.00 31 K 7.72 3.80 0.00 1.98 1.72 0.00 1.91 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.68 7.81 32 A 7.47 3.50 1.27 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 0.00 0.00 0.00 33 I 7.06 3.50 1.34 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.28 0.75 0.00 0.00 34 Q 7.65 3.90 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.93 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 35 L 7.45 4.19 0.00 1.66 1.58 0.77 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 36 D 7.00 4.17 0.00 2.47 2.43 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 37 P 0.00 4.59 0.00 2.41 2.16 0.00 3.91 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 2.04 2.01 0.00 38 E 8.33 5.26 0.00 2.07 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 0.00 2.07 2.32 0.00 39 E 7.42 4.36 0.00 1.74 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 2.34 0.00 40 S 8.87 4.41 0.00 4.04 3.96 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 41 K 8.47 4.21 0.00 2.01 2.09 0.00 1.89 0.00 0.00 2.00 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.71 1.70 7.81 42 Y 8.23 4.13 0.00 3.29 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 43 W 9.11 4.50 0.00 3.69 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 44 L 8.32 4.12 0.00 1.89 1.97 1.02 0.97 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 45 M 7.75 4.00 0.00 2.06 1.97 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 2.46 2.58 0.00 46 K 7.39 3.54 0.00 1.44 2.09 0.00 1.34 0.00 0.00 0.99 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.60 1.54 7.81 47 G 7.99 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 48 K 7.84 4.24 0.00 1.95 1.92 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.74 7.81 49 A 7.74 3.84 1.24 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 0.00 0.00 50 L 8.10 3.82 0.00 1.83 1.71 1.11 0.79 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 51 Y 8.44 4.07 0.00 2.96 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 52 N 7.61 3.52 0.00 2.42 2.52 0.00 0.00 6.95 7.11 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 53 L 6.97 3.84 0.00 1.68 1.46 0.83 0.50 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 54 E 7.28 3.06 0.00 1.88 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 0.00 2.20 2.38 0.00 55 R 7.18 4.25 0.00 1.78 1.79 0.00 3.27 0.00 0.00 3.11 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.70 0.00 56 Y 6.68 4.21 0.00 3.09 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 57 E 8.21 3.95 0.00 2.05 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 0.00 2.34 2.41 0.00 58 E 8.44 4.51 0.00 2.05 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 2.40 2.20 0.00 59 A 8.70 4.06 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.87 3.60 2.32 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 1.22 0.00 0.00 0.96 0.00 0.00 61 D 8.05 4.41 0.00 3.13 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 62 C 8.03 4.09 0.00 3.34 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 63 Y 8.05 3.94 0.00 2.96 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 64 N 8.62 4.05 0.00 2.89 2.83 0.00 0.00 6.90 8.33 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 65 Y 7.77 3.70 0.00 2.92 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 66 V 7.81 3.34 2.01 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 0.89 0.00 0.00 1.07 0.00 0.00 67 I 6.71 3.93 1.51 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.14 0.76 0.00 0.00 68 N 8.07 4.31 0.00 2.60 2.54 0.00 0.00 7.04 8.25 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 69 V 7.35 3.44 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 0.64 0.00 0.00 -0.08 0.00 0.00 70 I 6.46 4.35 1.98 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 1.24 0.36 0.92 0.00 0.00 71 E 8.60 4.11 0.00 1.92 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 2.28 2.31 0.00 72 D 7.86 4.69 0.00 2.71 2.61 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 0.00 0.00 0.00 0.00 73 E 7.89 4.65 0.00 2.04 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 2.67 2.64 0.00 74 Y 8.01 4.63 0.00 2.99 3.02 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 0.00 0.00 0.00 75 N 7.89 4.38 0.00 2.94 2.90 0.00 0.00 6.99 7.20 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 76 K 8.65 4.00 0.00 1.80 1.85 0.00 1.66 0.00 0.00 1.90 0.00 0.00 3.19 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.38 7.81 77 D 8.19 4.42 0.00 2.77 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 78 V 7.83 3.66 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 1.04 0.00 0.00 0.99 0.00 0.00 79 W 8.36 4.20 0.00 3.60 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 80 A 8.54 4.07 1.46 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 0.00 0.00 81 A 8.18 3.94 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 82 K 7.96 3.60 0.00 1.22 1.56 0.00 0.61 0.00 0.00 1.00 0.00 0.00 2.57 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.03 0.75 7.81 83 A 7.73 3.92 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 84 D 7.53 4.30 0.00 2.52 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 6.88 3.51 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 86 L 7.93 4.02 0.00 1.77 1.64 0.89 0.72 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 87 R 7.97 3.85 0.00 1.96 1.61 0.00 3.45 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 88 Y 7.61 4.59 0.00 3.16 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 89 I 6.95 4.17 1.79 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.87 0.88 0.00 0.00 90 E 8.57 4.31 0.00 1.96 1.89 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 2.28 2.31 0.00 91 G 7.34 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 0.00 0.00 0.00 92 K 8.65 4.14 0.00 1.74 1.73 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.41 7.81 93 E 8.50 4.29 0.00 1.96 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 2.29 0.00 94 V 7.68 3.75 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 0.81 0.00 0.00 0.91 0.00 0.00 95 E 8.08 3.88 0.00 1.93 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 2.38 2.30 0.00 96 A 7.54 3.98 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 97 E 8.01 3.87 0.00 2.14 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 2.51 2.31 0.00 98 I 7.68 3.66 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.68 0.90 0.00 0.00 99 A 8.04 4.01 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 0.00 100 E 8.19 3.89 0.00 2.16 2.01 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 2.32 2.49 0.00 101 A 7.89 3.94 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 0.00 102 R 8.24 3.75 0.00 1.63 1.93 0.00 2.93 0.00 0.00 2.92 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.82 0.00 103 A 8.56 4.15 1.46 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 0.00 0.00 104 K 8.10 4.42 0.00 1.82 1.81 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.55 7.81 105 L 7.24 3.92 0.00 1.75 1.58 0.88 0.78 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 0.00 106 E 8.29 3.72 0.00 1.87 1.92 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 2.21 2.26 0.00 107 H 7.59 3.73 0.00 3.26 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 H 7.85 4.81 0.00 3.25 3.25 0.00 5.52 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 0.00 109 H 8.54 4.75 0.00 3.11 3.02 0.00 5.85 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 H 9.06 4.11 0.00 3.29 3.33 0.00 5.72 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 H 8.59 4.35 0.00 3.03 3.27 0.00 5.94 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 0.00 112 H 8.19 4.25 0.00 3.22 3.21 0.00 5.78 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