NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -9 Q 4.2727 8.3444 121.7150 55.3971 30.2256 174.4088 -8 F 4.9002 8.7203 124.9090 56.5465 39.8794 172.5701 -7 N 4.4069 7.8011 126.7299 50.7697 40.5640 172.7484 -6 P 4.1275 0.0000 0.0000 63.7940 31.9272 175.7372 -5 Y 3.5491 7.0254 116.8123 56.1213 40.1460 174.3474 -4 G 4.7201 6.4175 109.0959 44.2380 0.0000 171.8001 -3 D 4.8740 8.5236 117.3707 52.8618 43.4658 174.8549 -2 N 5.6849 8.6387 123.3201 51.8685 39.6441 176.2897 -1 G 3.6538 8.7969 108.1791 46.4040 0.0000 173.9705 -8 G 4.2402 8.7503 113.4090 43.9465 0.0000 171.6701 -7 T 4.0169 7.5511 121.6299 59.4697 71.4640 172.2484 -6 I 3.8775 8.3287 123.6068 61.5940 38.6272 174.8372 -5 L 3.3391 7.0654 118.3123 53.3213 44.7460 176.0474 -4 G 4.7201 6.4175 109.0959 44.2380 0.0000 171.8001 -3 I 4.4040 8.1836 116.8707 59.7618 41.1658 174.9548 -2 A 5.2649 8.4787 128.4201 51.2685 19.8441 178.8897 -1 G 3.6538 8.7969 108.1791 46.4040 0.0000 173.9705 9 E 4.0777 8.6830 119.3425 58.5428 29.8539 178.2191 10 D 4.9577 8.0350 115.3340 52.2641 40.1854 174.3135 11 F 4.8773 7.6758 112.5983 56.9734 40.6551 172.6022 12 A 4.8735 8.1693 121.8749 51.0820 21.6950 175.9301 13 V 4.6620 8.0857 112.9023 59.4825 35.7663 175.2466 14 L 5.3170 8.5410 124.2492 53.7035 44.2954 175.1288 15 A 4.8888 8.5650 127.4976 50.4183 22.0441 175.0476 16 G 4.6869 8.1960 104.9103 44.9303 0.0000 172.6356 17 D 4.8418 8.6535 121.9105 52.8906 41.2340 175.7808 18 T 4.4556 8.3004 106.4612 61.4841 70.1581 173.2569 19 R 4.6655 7.9152 122.1036 55.8003 31.6221 174.8523 20 N 5.1589 9.0121 124.5641 51.7678 41.6901 173.1049 21 I 5.1488 8.1410 118.1056 59.6148 41.7728 175.0486 22 T 4.5248 8.4727 118.3360 63.1536 72.7303 174.9461 23 D 4.2388 8.4534 128.2123 56.0999 39.8902 174.2375 24 Y 4.4644 9.0755 123.9841 58.6151 38.2904 174.9018 25 S 4.8748 8.2629 117.1770 56.8420 65.2098 173.0524 26 I 4.6442 8.0928 123.4575 60.1310 38.2824 175.7719 27 N 4.6230 9.2038 123.5392 55.4547 39.3756 175.6651 28 S 4.6116 7.5361 109.3627 57.5641 65.0779 175.0610 29 R 4.3685 8.6098 124.3754 57.1740 30.5969 176.4804 30 Y 4.6507 7.6682 117.3060 54.9836 39.2231 172.5246 31 E 4.1855 8.4475 124.1581 52.3245 30.6524 172.9141 32 P 3.8436 0.0000 0.0000 62.7643 31.8019 176.3083 33 K 4.2387 8.0674 119.9508 55.2592 33.7764 175.4247 34 V 4.3199 7.0279 117.7697 61.5817 33.3068 174.5087 35 F 5.0353 9.1950 126.2893 55.5918 42.8975 173.8624 36 D 4.8766 8.8818 121.7503 53.7771 41.4269 175.6502 37 C 4.4244 9.2415 123.6237 59.3504 28.8965 174.5987 38 G 3.9009 8.0477 106.5079 45.4951 0.0000 173.0276 39 D 4.2940 9.2595 114.1624 54.8135 38.5893 173.3962 40 N 4.2125 8.3316 112.4571 55.1463 37.1934 173.7761 41 I 4.8424 7.8073 116.7434 59.4589 41.0651 175.8257 42 V 4.9603 8.8140 120.1996 59.9824 34.6368 174.5569 43 M 5.2663 9.1034 122.7377 54.4484 36.4614 173.5913 44 S 4.9786 9.0363 117.2465 57.0741 66.7257 172.6722 45 A 4.7326 8.7835 128.6702 50.1166 20.2515 173.9159 46 N 4.5875 9.4149 119.9517 54.2598 40.9897 171.5493 47 G 3.9690 8.7693 115.9791 44.6111 0.0000 176.0580 48 F 4.8958 6.6706 135.0000 56.7245 39.4978 174.5503 49 A 3.8784 9.1442 131.2229 55.4589 18.0651 178.7215 50 A 3.6807 6.6258 118.1676 55.3531 18.4063 179.5081 51 D 4.5892 7.1444 116.9907 57.3186 41.0349 179.0264 52 G 3.6924 8.0855 107.8740 47.4040 0.0000 175.5549 53 D 4.2696 8.5146 121.6395 56.8513 40.7302 178.7048 54 A 3.9817 7.8974 121.1889 55.0185 18.4184 179.2800 55 L 3.4695 7.8263 118.7894 58.1876 42.0850 179.0804 56 V 3.6199 7.6586 118.0409 66.1301 31.4833 177.9923 57 K 3.8201 8.0513 119.0889 59.4229 32.0323 178.8339 58 R 3.9185 8.1475 119.2556 59.2765 30.0422 178.2873 59 F 4.2747 8.7878 120.8540 61.2320 39.4442 177.1163 60 K 3.5609 8.2379 118.3490 59.5436 31.8590 178.8014 61 N 4.3402 8.0396 116.8839 56.6271 38.8416 176.7874 62 S 4.1877 7.9850 114.7426 61.2927 62.4407 176.3761 63 V 3.3156 7.2917 120.9098 65.5651 31.2376 177.7274 64 K 3.4735 7.6842 119.2676 59.5008 31.9908 178.8542 65 W 4.0963 8.3081 118.6846 59.3014 28.9222 177.9938 66 Y 4.1814 8.0066 120.0659 61.0644 38.1870 177.8377 67 H 4.2352 8.0057 116.9737 58.9197 28.5806 177.6880 68 F 4.4836 7.5125 118.1425 60.8706 38.9136 177.0416 69 D 4.6624 8.5874 115.9352 55.4464 41.9003 176.1007 70 H 4.6609 8.0564 117.1441 56.4741 30.0970 172.9697 70A N 4.3276 8.9314 114.0824 56.0630 37.1916 172.5100 71 D 4.4108 8.5180 111.2555 54.7655 39.9570 174.6444 72 K 4.0530 7.8433 119.4473 56.1591 32.6426 176.6002 73 K 4.2778 8.5462 127.1060 56.1845 32.7521 176.1012 74 L 3.9320 10.1782 129.5252 53.7888 41.6766 177.1752 75 S 4.2900 8.3280 122.2973 58.1606 64.9978 174.6911 76 I 3.6718 8.4399 123.9216 64.3954 37.7831 177.9553 77 N 4.3369 8.0595 117.5041 55.9882 37.2788 177.3964 78 S 4.1023 7.5673 117.2287 61.1367 62.8305 176.3842 79 A 4.0729 8.3810 123.7392 55.0467 18.1255 179.4344 80 A 3.8053 8.0767 119.3033 55.4322 18.3606 179.8654 81 R 3.8571 7.8660 116.7754 59.3691 30.0743 178.2234 82 N 4.3247 8.1646 116.9198 56.8885 38.9533 176.8078 83 I 3.6502 8.0139 121.5293 64.3681 37.0480 178.0734 84 Q 3.9480 8.0673 120.3068 59.7524 28.9075 178.3438 85 H 4.2467 8.1586 116.8688 58.5768 28.4318 177.9043 86 L 4.0880 7.7261 120.3068 57.7664 41.7284 179.2953 87 L 4.3478 8.2033 119.0253 58.1629 41.7260 178.9840 88 Y 3.8994 8.5706 119.3583 59.8490 38.4026 178.0462 89 G 3.7992 7.8740 105.5649 46.7480 0.0000 174.0282 90 K 4.5698 8.0179 120.9825 55.3895 32.7855 178.3215 91 R 3.3920 7.2064 121.7503 58.6630 29.7843 176.7222 92 F 5.0629 7.3862 114.8435 56.4698 40.0482 175.4598 93 F 5.6689 7.7411 122.4726 57.5748 41.9238 171.5884 94 P 4.3356 0.0000 0.0000 63.0092 32.2923 176.3322 95 Y 4.4776 8.3657 118.6323 57.8692 38.6485 176.5229 96 Y 4.5139 10.0299 131.2031 56.9470 36.3889 174.6040 97 V 4.9811 7.3623 112.6539 60.0696 37.2050 175.7479 98 H 4.7622 9.3789 123.5146 55.0137 31.3462 172.9316 99 T 5.0592 8.5541 120.5718 60.5068 69.5774 173.4928 100 I 4.8241 8.7866 127.8577 59.4591 41.3712 174.3619 101 I 5.1318 8.3324 117.9485 59.1992 40.7283 174.2952 102 A 4.6130 9.1440 124.3708 50.4466 22.6873 176.2678 103 G 4.1105 7.5805 106.0200 46.2709 0.0000 172.2241 104 L 4.7403 8.4505 121.5011 52.6945 44.6877 176.5793 105 D 4.6856 8.3120 121.7621 52.4587 41.3757 176.1833 106 E 4.1356 8.5862 117.8732 57.1198 29.4597 176.9198 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 -9 Q 8.34 4.27 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 -8 F 8.72 4.90 0.00 3.00 2.97 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 -7 N 7.80 4.41 0.00 2.57 2.39 0.00 0.00 6.97 7.71 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 -6 P 0.00 4.13 0.00 1.88 1.97 0.00 3.03 0.00 0.00 5.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.61 0.00 -5 Y 7.03 3.55 0.00 2.61 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 0.00 0.00 0.00 -4 G 6.42 4.72 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 0.00 0.00 0.00 -3 D 8.52 4.87 0.00 2.76 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 -2 N 8.64 5.68 0.00 2.95 2.83 0.00 0.00 6.74 7.79 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 -1 G 8.80 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -8 G 8.75 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 0.00 0.00 0.00 0.00 -7 T 7.55 4.02 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 1.21 0.00 0.00 -6 I 8.33 3.88 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 1.43 2.09 0.91 0.00 0.00 -5 L 7.07 3.34 0.00 1.20 0.69 0.92 0.86 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 -4 G 6.42 4.72 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 0.00 0.00 0.00 -3 I 8.18 4.40 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 1.41 1.46 0.91 0.00 0.00 -2 A 8.48 5.26 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 -1 G 8.80 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.68 4.08 0.00 1.97 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 0.00 2.30 2.29 0.00 10 D 8.04 4.96 0.00 2.83 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 11 F 7.68 4.88 0.00 3.14 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 12 A 8.17 4.87 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 13 V 8.09 4.66 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 0.92 0.00 0.00 1.04 0.00 0.00 14 L 8.54 5.32 0.00 1.57 1.48 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.57 4.89 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 16 G 8.20 4.69 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 17 D 8.65 4.84 0.00 2.70 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 18 T 8.30 4.46 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 1.25 0.00 0.00 19 R 7.92 4.67 0.00 1.86 1.86 0.00 3.18 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 20 N 9.01 5.16 0.00 2.76 2.61 0.00 0.00 6.48 7.62 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 21 I 8.14 5.15 2.04 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.84 0.91 0.00 0.00 22 T 8.47 4.52 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 1.26 0.00 0.00 23 D 8.45 4.24 0.00 2.87 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 0.00 0.00 0.00 24 Y 9.08 4.46 0.00 2.98 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 25 S 8.26 4.87 0.00 4.03 3.79 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 26 I 8.09 4.64 1.90 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 1.44 0.57 0.96 0.00 0.00 27 N 9.20 4.62 0.00 2.88 2.89 0.00 0.00 6.80 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 28 S 7.54 4.61 0.00 3.82 3.64 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 29 R 8.61 4.37 0.00 1.90 2.02 0.00 3.25 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 30 Y 7.67 4.65 0.00 2.89 2.87 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 31 E 8.45 4.19 0.00 1.83 1.71 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 2.18 2.23 0.00 32 P 0.00 3.84 0.00 1.89 1.73 0.00 3.42 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.38 0.00 33 K 8.07 4.24 0.00 1.52 1.58 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 1.34 7.81 34 V 7.03 4.32 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 0.80 0.00 0.00 0.80 0.00 0.00 35 F 9.20 5.04 0.00 2.96 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 36 D 8.88 4.88 0.00 2.74 2.65 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 0.00 0.00 0.00 0.00 37 C 9.24 4.42 0.00 3.16 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 38 G 8.05 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 39 D 9.26 4.29 0.00 2.77 2.74 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 0.00 0.00 0.00 0.00 40 N 8.33 4.21 0.00 2.86 2.89 0.00 0.00 6.97 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 41 I 7.81 4.84 2.10 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 1.27 0.86 1.03 0.00 0.00 42 V 8.81 4.96 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 0.69 0.00 0.00 1.01 0.00 0.00 43 M 9.10 5.27 0.00 2.12 1.75 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 44 S 9.04 4.98 0.00 3.83 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 45 A 8.78 4.73 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 46 N 9.41 4.59 0.00 2.77 2.63 0.00 0.00 7.02 7.92 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 47 G 8.77 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 48 F 6.67 4.90 0.00 3.50 3.43 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 49 A 9.14 3.88 1.31 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 0.00 0.00 50 A 6.63 3.68 0.74 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 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.14 4.59 0.00 3.21 3.09 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 52 G 8.09 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 53 D 8.51 4.27 0.00 2.81 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 A 7.90 3.98 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 55 L 7.83 3.47 0.00 1.26 1.56 0.22 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.66 3.62 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 0.73 0.00 0.00 1.08 0.00 0.00 57 K 8.05 3.82 0.00 1.89 1.92 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.39 7.81 58 R 8.15 3.92 0.00 2.17 1.97 0.00 3.23 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 59 F 8.79 4.27 0.00 3.01 3.17 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 0.00 60 K 8.24 3.56 0.00 1.90 1.74 0.00 1.60 0.00 0.00 1.49 0.00 0.00 3.04 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.59 7.81 61 N 8.04 4.34 0.00 3.04 3.00 0.00 0.00 6.88 7.27 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 62 S 7.98 4.19 0.00 4.12 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 63 V 7.29 3.32 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 0.69 0.00 0.00 0.21 0.00 0.00 64 K 7.68 3.47 0.00 1.67 1.85 0.00 1.53 0.00 0.00 1.48 0.00 0.00 2.79 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.50 0.92 7.81 65 W 8.31 4.10 0.00 3.55 3.44 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 66 Y 8.01 4.18 0.00 3.17 3.03 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 67 H 8.01 4.24 0.00 3.12 3.36 0.00 5.68 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 68 F 7.51 4.48 0.00 3.12 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 69 D 8.59 4.66 0.00 2.69 2.65 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 0.00 0.00 0.00 0.00 70 H 8.06 4.66 0.00 2.67 2.96 0.00 5.96 0.00 0.00 0.00 0.00 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70A N 8.93 4.33 0.00 2.75 2.76 0.00 0.00 7.43 8.47 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 71 D 8.52 4.41 0.00 2.78 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 72 K 7.84 4.05 0.00 1.84 1.71 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.70 1.48 7.81 73 K 8.55 4.28 0.00 1.80 1.75 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.58 7.81 74 L 10.18 3.93 0.00 1.18 1.48 -0.08 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.33 4.29 0.00 4.23 4.07 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 0.00 0.00 0.00 76 I 8.44 3.67 1.87 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 1.66 1.31 0.94 0.00 0.00 77 N 8.06 4.34 0.00 2.94 3.04 0.00 0.00 6.30 7.17 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 78 S 7.57 4.10 0.00 3.89 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 79 A 8.38 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 80 A 8.08 3.81 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.87 3.86 0.00 1.98 2.10 0.00 3.25 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 82 N 8.16 4.32 0.00 3.00 3.14 0.00 0.00 7.18 7.47 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 83 I 8.01 3.65 1.87 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.37 0.74 0.00 0.00 84 Q 8.07 3.95 0.00 2.11 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.26 2.38 0.00 85 H 8.16 4.25 0.00 3.44 3.42 0.00 5.87 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.73 4.09 0.00 1.86 1.75 1.02 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.20 4.35 0.00 1.87 1.79 0.90 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 8.57 3.90 0.00 3.05 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 89 G 7.87 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 90 K 8.02 4.57 0.00 1.59 1.74 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.14 0.00 0.00 0.00 0.00 1.16 1.20 7.81 91 R 7.21 3.39 0.00 0.67 0.81 0.00 2.75 0.00 0.00 2.41 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 92 F 7.39 5.06 0.00 3.12 2.97 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 93 F 7.74 5.67 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 94 P 0.00 4.34 0.00 2.17 2.02 0.00 4.02 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.27 0.00 95 Y 8.37 4.48 0.00 2.98 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 96 Y 10.03 4.51 0.00 2.99 3.17 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 0.00 97 V 7.36 4.98 2.17 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 0.86 0.00 0.00 0.95 0.00 0.00 98 H 9.38 4.76 0.00 3.01 3.08 0.00 5.55 0.00 0.00 0.00 0.00 6.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.55 5.06 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 1.15 0.00 0.00 100 I 8.79 4.82 1.79 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.42 0.86 0.00 0.00 101 I 8.33 5.13 1.83 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.58 0.67 0.00 0.00 102 A 9.14 4.61 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 0.00 103 G 7.58 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 0.00 0.00 0.00 104 L 8.45 4.74 0.00 1.61 1.55 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 105 D 8.31 4.69 0.00 2.75 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 0.00 106 E 8.59 4.14 0.00 1.98 1.91 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 2.32 2.31 0.00