NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3316 8.3001 120.3265 54.7739 33.3519 174.0165 2 A 3.8907 8.0377 123.2897 51.9188 19.5194 175.7541 3 A 4.0601 9.5480 121.6512 52.9462 16.9111 177.3747 4 E 3.9830 7.6369 120.8333 55.1919 30.6004 176.0611 5 P 4.3468 0.0000 0.0000 62.3396 31.2785 176.3457 6 L 4.1722 8.1868 123.3920 54.2816 42.5176 177.4531 7 T 4.1713 9.1922 115.3826 61.3938 69.3341 175.1297 8 E 3.9109 8.6286 123.9347 59.4253 29.5800 178.5864 9 L 3.9422 7.9157 118.2435 57.9552 41.7258 178.8165 10 E 3.9084 8.2144 117.6498 59.6838 29.4539 178.8352 11 E 3.9157 8.6136 119.4037 59.5232 29.6996 179.2005 12 S 4.1324 8.5836 114.5865 61.4897 63.0969 176.3695 13 I 3.8136 8.2468 117.5982 63.4387 37.2182 177.6555 14 E 3.8529 8.6033 121.4679 59.4940 29.4668 178.5690 15 T 3.8914 8.3205 113.3621 65.3087 67.2693 176.4509 16 V 3.2075 7.7287 114.1424 64.0388 31.6300 178.3566 17 V 3.3582 7.6076 118.3633 66.4034 31.2484 177.8850 18 T 3.9412 8.3105 112.7198 65.4585 67.1696 175.8015 19 T 3.9016 7.5105 117.2985 66.8641 68.5485 176.1793 20 F 4.2526 8.3008 119.6625 60.8199 38.7835 177.6560 21 F 4.2461 8.8243 119.2959 61.4191 39.5436 176.8289 22 T 4.0002 8.5401 109.9420 65.1117 68.4179 175.7740 23 F 4.0466 8.4352 124.1460 60.6730 39.1917 176.9013 24 A 4.2008 8.6821 120.2741 54.4151 17.8196 179.5148 25 R 3.6967 7.6948 114.3534 59.1667 29.3084 177.5765 26 Q 3.7440 7.7075 120.1680 58.6762 29.0724 176.7944 27 E 4.6664 8.2932 114.8183 54.3693 33.1789 175.6594 28 G 3.5049 7.8168 106.2712 44.7340 0.0000 171.3198 29 R 3.6835 8.8600 130.1147 55.4291 28.4807 177.4440 30 K 4.3583 8.1822 125.8644 55.2592 30.4094 174.8462 31 D 5.0632 7.0686 123.0703 55.8526 47.3800 178.1593 32 S 4.6721 7.9206 113.2822 57.9986 64.9611 172.8397 33 L 4.9479 8.3413 121.0282 53.1182 44.6713 174.7126 34 S 4.6927 8.1693 113.1662 56.2847 66.1542 173.9625 35 V 3.6972 8.9208 119.0664 66.7759 30.8370 177.2719 36 N 4.2513 8.0951 115.2987 56.8273 39.0671 176.5526 37 E 3.9151 8.8331 120.6381 59.6120 29.6102 179.5287 38 F 4.4542 8.9721 120.4682 61.3732 39.5571 176.9063 39 K 3.3481 8.1775 119.5128 59.4489 31.8666 178.1511 40 E 4.0362 8.6534 119.1813 59.5756 29.3684 179.2515 41 L 3.5865 8.1211 119.9418 58.1946 41.9658 179.5754 42 V 3.5444 7.4119 110.3273 64.6532 31.7090 178.3097 43 T 3.9575 7.9632 114.6139 66.6296 68.3593 176.2890 44 Q 4.1362 8.3420 120.5678 58.0446 30.4930 176.7210 45 Q 4.6627 7.8375 117.2692 53.8972 28.5525 178.3410 46 L 4.5397 7.0315 117.5861 54.0103 43.9334 172.1991 47 P 4.3129 0.0000 0.0000 64.7689 31.6061 176.6371 48 H 4.2294 7.3653 116.3391 54.4463 32.9078 179.7981 49 L 2.9462 7.2057 118.1290 55.1786 45.1420 176.6492 50 L 4.0395 8.5718 122.0930 55.3175 43.0725 178.4023 51 K 3.4460 8.8329 117.1323 57.8014 31.7374 173.0956 52 D 4.2722 8.3816 111.8707 56.3133 38.9101 175.5502 53 V 3.6022 7.6589 115.9672 64.2111 31.7881 176.5921 54 G 3.6876 7.0946 107.9468 48.8923 0.0000 175.2119 55 S 4.4251 8.8379 117.7086 56.6228 60.9641 174.3527 56 L 4.1623 7.6707 126.1383 57.4684 42.5396 177.0762 57 D 4.4624 8.1714 119.1424 56.5989 39.0862 178.3351 58 E 3.9879 8.2260 118.5729 59.0472 29.4367 179.1510 59 K 3.9361 8.0537 118.9120 59.3427 32.2782 178.4516 60 M 3.9298 8.6538 118.8716 59.0168 31.8547 178.4499 61 K 4.0440 8.3646 117.3648 59.4219 32.2467 178.8340 62 S 4.2187 7.7945 112.6551 62.1052 62.3500 175.3433 63 L 3.9860 7.8614 121.4346 56.1721 42.6537 178.0714 64 D 4.8818 8.3235 121.1906 52.9294 37.9871 177.6714 65 V 3.7512 7.6151 114.7068 63.6338 32.3014 177.2893 66 N 4.5178 8.1400 114.9223 52.3642 38.4756 174.5468 67 Q 3.4626 7.9885 118.5355 57.1263 26.5467 173.5931 68 D 4.5512 8.1558 113.8880 52.9743 40.8810 177.6397 69 S 3.7497 8.8376 115.1174 59.1729 60.8617 170.6061 70 E 4.6038 9.1574 121.6540 54.5020 31.5333 176.1007 71 L 4.5250 8.9489 129.4029 53.3249 41.7084 176.8430 72 K 4.3040 9.5989 124.2761 56.5009 33.3015 177.6082 73 F 3.9806 9.4547 124.1988 62.0209 39.1839 177.1828 74 N 4.6022 8.5521 115.7169 56.7986 38.8888 176.1323 75 E 3.9248 8.2119 120.2128 59.3569 29.7854 178.0659 76 Y 3.6277 8.5641 119.7227 60.3150 38.8382 177.2972 77 W 3.4150 8.2352 129.6788 60.5688 30.5686 177.9066 78 R 3.7988 7.6617 117.7454 59.2367 29.5089 178.0235 79 L 3.6128 6.8762 119.3250 58.5609 41.8725 179.3503 80 I 3.5839 6.9203 119.6288 63.7791 36.9292 178.7292 81 G 3.9236 6.9533 106.2482 47.8350 0.0000 175.3813 82 E 4.0380 8.3948 121.5910 59.1030 29.4589 179.1419 83 L 3.8803 8.1646 119.1034 58.1452 41.5511 179.5975 84 A 4.0065 7.7622 118.6896 54.8340 18.4491 179.3982 85 K 4.0474 7.5898 117.2760 59.6542 32.2573 178.5600 86 E 3.9859 8.3983 118.1580 59.7221 29.4987 178.8033 87 I 3.7485 7.7060 117.5932 63.8549 37.9254 176.9463 88 R 4.3102 7.6892 117.0629 57.4948 32.1560 177.1271 89 K 4.3364 8.1172 119.7746 56.0671 30.2307 176.1628 90 K 4.1017 7.8449 123.5072 59.0895 33.7874 177.3990 91 K 4.5706 7.3374 116.4556 56.0445 33.7306 175.3477 92 D 4.9468 7.7628 124.9223 52.3491 38.5465 176.0803 93 L 4.6104 7.4561 120.0654 57.9339 44.2070 178.6545 94 K 4.0349 8.2471 117.1329 57.8969 32.5303 176.7356 95 I 3.3883 7.7426 121.6643 61.2861 36.2755 174.9235 96 R 4.2969 8.7876 122.1653 55.7355 29.6448 176.8661 97 K 4.3044 7.6617 111.6202 55.8344 36.7622 174.9323 98 K 4.1433 8.6522 122.0360 57.2870 32.3433 175.7410 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 4.33 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.55 0.00 2 A 8.04 3.89 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 3 A 9.55 4.06 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 4 E 7.64 3.98 0.00 1.94 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 2.31 2.36 0.00 5 P 0.00 4.35 0.00 2.17 2.09 0.00 3.76 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 1.98 1.98 0.00 6 L 8.19 4.17 0.00 1.65 1.64 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 7 T 9.19 4.17 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 1.31 0.00 0.00 8 E 8.63 3.91 0.00 2.08 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 2.39 2.42 0.00 9 L 7.92 3.94 0.00 1.77 1.71 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.21 3.91 0.00 2.24 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 2.40 2.39 0.00 11 E 8.61 3.92 0.00 2.09 2.22 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 2.31 2.38 0.00 12 S 8.58 4.13 0.00 4.06 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 13 I 8.25 3.81 1.96 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 1.42 1.32 1.04 0.00 0.00 14 E 8.60 3.85 0.00 2.13 2.05 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 0.00 2.29 2.45 0.00 15 T 8.32 3.89 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 1.26 0.00 0.00 16 V 7.73 3.21 1.61 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 0.70 0.00 0.00 0.97 0.00 0.00 17 V 7.61 3.36 2.28 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 1.14 0.00 0.00 1.25 0.00 0.00 18 T 8.31 3.94 4.58 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 1.28 0.00 0.00 19 T 7.51 3.90 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 1.20 0.00 0.00 20 F 8.30 4.25 0.00 3.13 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 21 F 8.82 4.25 0.00 3.25 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 22 T 8.54 4.00 4.32 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 1.37 0.00 0.00 23 F 8.44 4.05 0.00 3.31 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 24 A 8.68 4.20 1.33 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 0.00 0.00 0.00 25 R 7.69 3.70 0.00 1.85 1.96 0.00 3.06 0.00 0.00 3.08 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 26 Q 7.71 3.74 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.57 5.43 0.00 0.00 0.00 0.00 0.00 2.01 2.18 0.00 27 E 8.29 4.67 0.00 2.03 1.80 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 2.17 2.13 0.00 28 G 7.82 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.86 3.68 0.00 2.10 2.02 0.00 3.19 0.00 0.00 3.40 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 30 K 8.18 4.36 0.00 1.49 1.70 0.00 1.16 0.00 0.00 0.61 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.36 7.81 31 D 7.07 5.06 0.00 2.65 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 32 S 7.92 4.67 0.00 4.03 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 33 L 8.34 4.95 0.00 1.63 1.73 0.95 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.17 4.69 0.00 3.86 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 35 V 8.92 3.70 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 1.06 0.00 0.00 0.98 0.00 0.00 36 N 8.10 4.25 0.00 2.87 3.13 0.00 0.00 7.43 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 37 E 8.83 3.92 0.00 2.17 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 0.00 2.30 2.41 0.00 38 F 8.97 4.45 0.00 3.15 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 39 K 8.18 3.35 0.00 1.66 1.79 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.27 7.81 40 E 8.65 4.04 0.00 2.41 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 0.00 2.35 2.45 0.00 41 L 8.12 3.59 0.00 1.76 1.84 0.53 0.95 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 42 V 7.41 3.54 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 0.73 0.00 0.00 0.61 0.00 0.00 43 T 7.96 3.96 4.26 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 1.19 0.00 0.00 44 Q 8.34 4.14 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 7.49 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 45 Q 7.84 4.66 0.00 1.90 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.99 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 46 L 7.03 4.54 0.00 1.51 1.56 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.31 0.00 2.23 2.16 0.00 3.77 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 2.00 1.95 0.00 48 H 7.37 4.23 0.00 3.17 3.19 0.00 5.67 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 49 L 7.21 2.95 0.00 1.68 1.67 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.57 4.04 0.00 1.64 1.68 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.83 3.45 0.00 1.75 1.77 0.00 1.81 0.00 0.00 1.53 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.24 1.36 7.81 52 D 8.38 4.27 0.00 2.88 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 53 V 7.66 3.60 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 0.87 0.00 0.00 0.89 0.00 0.00 54 G 7.09 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 0.00 0.00 0.00 55 S 8.84 4.43 0.00 3.81 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 56 L 7.67 4.16 0.00 1.62 1.57 0.76 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 57 D 8.17 4.46 0.00 2.93 2.95 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 58 E 8.23 3.99 0.00 2.22 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 0.00 2.36 2.54 0.00 59 K 8.05 3.94 0.00 2.24 2.14 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.61 1.60 7.81 60 M 8.65 3.93 0.00 2.31 2.40 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.63 0.00 61 K 8.36 4.04 0.00 1.88 1.86 0.00 1.86 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.57 7.81 62 S 7.79 4.22 0.00 3.86 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 63 L 7.86 3.99 0.00 1.50 1.37 -0.35 0.63 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 64 D 8.32 4.88 0.00 2.68 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 65 V 7.62 3.75 2.07 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 0.98 0.00 0.00 0.92 0.00 0.00 66 N 8.14 4.52 0.00 2.81 2.93 0.00 0.00 6.21 7.83 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 67 Q 7.99 3.46 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 68 D 8.16 4.55 0.00 2.79 2.79 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 0.00 0.00 0.00 69 S 8.84 3.75 0.00 4.03 4.02 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 70 E 9.16 4.60 0.00 1.90 1.84 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 2.22 2.26 0.00 71 L 8.95 4.52 0.00 1.65 1.65 0.67 0.57 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 72 K 9.60 4.30 0.00 1.95 1.85 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.17 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.55 7.81 73 F 9.45 3.98 0.00 3.24 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 74 N 8.55 4.60 0.00 3.03 2.93 0.00 0.00 6.78 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 75 E 8.21 3.92 0.00 2.14 2.07 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 2.45 2.37 0.00 76 Y 8.56 3.63 0.00 2.96 2.92 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 77 W 8.24 3.41 0.00 3.51 3.28 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 78 R 7.66 3.80 0.00 1.81 1.84 0.00 3.35 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 79 L 6.88 3.61 0.00 1.22 1.01 0.91 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 80 I 6.92 3.58 0.56 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 1.28 -0.20 0.60 0.00 0.00 81 G 6.95 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 82 E 8.39 4.04 0.00 2.04 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 2.32 0.00 83 L 8.16 3.88 0.00 1.73 1.69 0.83 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.76 4.01 1.45 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 0.00 0.00 0.00 85 K 7.59 4.05 0.00 1.96 1.93 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.48 7.81 86 E 8.40 3.99 0.00 2.01 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 2.43 2.46 0.00 87 I 7.71 3.75 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.75 0.94 0.00 0.00 88 R 7.69 4.31 0.00 1.85 2.03 0.00 3.30 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 89 K 8.12 4.34 0.00 1.71 1.81 0.00 1.85 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.58 7.81 90 K 7.84 4.10 0.00 1.74 1.82 0.00 1.77 0.00 0.00 1.65 0.00 0.00 3.04 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.43 1.49 7.81 91 K 7.34 4.57 0.00 1.82 1.62 0.00 1.66 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.40 1.46 7.81 92 D 7.76 4.95 0.00 2.83 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 93 L 7.46 4.61 0.00 1.70 1.74 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.25 4.03 0.00 1.77 1.90 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.45 7.81 95 I 7.74 3.39 1.87 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 1.18 0.46 0.91 0.00 0.00 96 R 8.79 4.30 0.00 1.96 2.12 0.00 3.45 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 97 K 7.66 4.30 0.00 1.73 1.65 0.00 1.75 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.23 1.21 7.81 98 K 8.65 4.14 0.00 1.78 1.71 0.00 1.49 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.49 7.81