NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3432 8.2893 120.3530 54.6340 33.3519 174.6924 2 K 3.6729 8.6910 124.3415 56.9284 32.4221 175.2333 3 T 4.0168 8.7776 121.9329 62.9980 70.2859 176.4528 4 G 4.7506 7.4617 119.0982 46.1428 0.0000 171.5776 5 Y 4.8049 7.7226 116.5582 56.0040 41.9174 175.7399 6 K 4.6372 8.6704 121.5779 55.0069 35.4333 176.2222 7 V 4.1669 8.3533 114.1660 60.1164 32.9679 175.2820 8 M 4.4358 8.5234 126.1603 53.3328 31.7484 174.5627 9 L 4.7302 7.6775 124.5082 53.7374 43.3165 177.4478 10 G 3.8196 7.9504 103.9767 45.2787 0.0000 172.1764 11 A 4.8012 8.5244 129.0873 49.7157 21.2888 175.7942 12 L 4.5908 8.5611 119.3523 54.7778 43.0986 175.8495 13 A 4.5238 7.9225 121.2287 50.5371 20.0156 175.7454 14 F 4.4126 8.4768 125.0828 58.3152 40.4635 174.5658 15 V 3.9691 7.7144 128.6320 60.3331 32.0376 174.8091 16 V 4.0537 7.5920 126.1331 61.1107 31.0307 174.7251 17 T 4.5837 7.8629 112.4047 60.6447 69.9390 173.4850 18 N 4.6013 8.0907 119.8120 51.5738 38.5066 174.4836 19 V 4.2314 7.8462 122.0530 59.7535 33.8264 174.6000 20 Y 4.6331 8.4560 120.7863 56.2307 40.3883 174.2688 21 A 5.0788 8.3976 122.2155 50.3152 21.2409 176.3903 22 A 5.0321 9.2651 123.7879 51.0999 19.5904 176.6537 23 E 4.7316 8.5141 121.0205 54.3446 34.0090 174.0820 24 I 4.8384 8.7907 125.6917 61.0985 37.5030 175.2887 25 M 4.6205 8.3180 126.7644 53.1897 34.4954 175.7017 26 K 3.9539 8.5445 123.6557 56.5068 33.1108 177.7951 27 K 3.7416 8.9034 124.0718 60.0772 31.8231 179.0997 28 T 3.8600 7.8043 115.2194 66.8892 68.5584 176.3352 29 D 4.3085 8.0154 120.2756 57.0678 40.8144 178.1840 30 F 3.9308 8.9629 122.4212 61.5872 39.0542 176.8331 31 D 3.7451 8.1267 117.2657 57.0171 40.7313 178.2409 32 K 3.9876 7.4037 118.2064 58.8924 32.4426 179.1692 33 V 3.8735 8.2107 112.1265 63.0596 31.6865 178.1413 34 A 3.8599 7.5196 120.9209 54.6052 17.7390 179.3924 35 S 4.2186 7.3130 108.0381 60.3351 62.4394 174.0970 36 E 4.8951 8.7279 121.8807 56.1796 30.5518 175.2143 37 Y 4.8199 8.1043 114.8577 56.7223 42.5063 174.9738 38 T 4.7737 9.4633 117.0603 61.7408 72.6161 173.1142 39 K 4.3304 8.4959 125.5929 55.0929 32.8190 176.1537 40 I 4.1086 9.3158 120.2055 60.2520 38.2680 174.4838 41 G 4.2292 7.2522 106.7349 43.7772 0.0000 172.3741 42 T 5.0067 8.0277 116.9089 61.6936 70.8607 174.2377 43 I 4.7171 8.7062 118.3987 59.5736 41.1031 174.0156 44 S 5.1585 8.3096 116.3898 57.6333 66.5845 172.9321 45 T 4.7171 8.9393 109.9142 60.1106 71.1586 173.0334 46 T 4.6105 8.6967 118.5746 62.6144 70.7778 172.8247 47 G 3.9920 11.0924 118.3528 43.8050 0.0000 175.4965 48 E 4.7835 8.7402 112.4493 55.7686 32.8810 175.7704 49 M 4.9009 8.6367 122.2459 53.6419 37.6538 173.8190 50 S 4.7829 8.4739 114.5343 57.2238 63.8999 172.7992 51 P 4.2076 0.0000 0.0000 66.2851 30.9408 178.8678 52 L 4.0221 7.8100 120.0256 57.9182 40.5444 178.4532 53 D 4.2543 8.0342 118.3657 57.0828 41.2240 177.9106 54 A 4.0222 8.5714 121.7937 54.9697 18.3371 179.6154 55 R 3.8374 8.0737 116.6183 59.7608 30.2551 179.1238 56 E 4.0371 8.4266 118.2361 59.4072 29.4139 179.1020 57 D 4.3235 8.2253 118.1400 57.2217 41.2448 178.3347 58 L 3.9708 8.3197 119.9212 57.7903 41.6665 179.4909 59 I 3.7081 8.3254 120.2456 64.3356 37.1211 178.7148 60 K 4.0322 8.1100 119.6511 59.7356 32.4161 179.1104 61 K 3.8995 8.1360 120.6706 59.1550 31.6590 178.6597 62 A 3.9869 8.3620 121.4640 55.3049 18.3356 179.1274 63 D 4.1544 8.2034 116.5542 57.5380 41.0491 178.2648 64 E 4.0291 8.4187 118.6651 59.0742 29.5337 178.5554 65 K 4.3557 7.8136 115.7278 55.6962 33.6290 176.2142 66 G 3.5503 8.0936 107.0559 45.8119 0.0000 172.7577 67 A 4.9222 7.6997 121.2557 50.8547 22.5694 176.1833 68 D 5.0909 9.2304 119.0925 55.2055 43.5774 177.0702 69 V 5.0079 7.9942 117.0466 61.0746 35.0888 174.8316 70 V 4.8382 8.8918 119.9082 59.5496 35.8349 174.7507 71 V 4.3086 8.2358 122.8673 61.1470 34.6415 174.8341 72 L 4.6538 8.5314 128.2510 54.5417 39.8636 176.5771 73 T 4.0697 8.2782 120.3789 66.5095 69.3846 173.8302 74 S 4.4021 8.6418 114.9897 57.7665 67.3161 175.0060 75 G 3.9370 9.2060 108.3364 45.9284 0.0000 173.3140 76 Q 4.4986 7.5243 118.8494 56.1624 28.8673 176.7664 77 T 4.0632 7.3494 113.7083 62.7882 69.7843 175.3312 78 E 4.5217 7.8500 133.1014 56.4785 35.0693 176.6385 79 N 5.5096 8.9055 114.6998 54.5771 41.1789 176.3577 80 K 4.5938 7.7281 116.3176 56.5161 32.5306 177.1404 81 I 4.0419 7.5583 113.3620 61.7805 38.8271 176.1808 82 H 5.3807 8.1034 124.0048 53.5538 28.6368 172.7030 83 G 4.2441 8.0925 109.5298 45.2276 0.0000 172.5183 84 T 5.2764 8.2181 108.1299 59.7410 72.4877 172.6674 85 A 5.1508 9.2320 125.9612 50.1765 22.4782 174.1919 86 D 5.2528 8.9599 122.5317 52.5008 43.0918 175.2128 87 I 5.2019 7.9636 119.0637 59.5107 40.4837 174.5114 88 Y 5.0516 9.6132 120.3023 56.3051 42.5286 174.1390 89 K 4.9820 9.3666 123.4281 54.2228 35.1508 175.3204 90 K 2.8342 8.6386 127.8653 56.1107 32.8905 176.7451 91 K 4.3312 7.4105 126.4782 55.7524 33.3707 176.7335 92 L 4.2883 8.4335 119.0194 55.5745 42.1068 176.6293 93 E 4.7309 7.5511 117.1106 54.9179 32.8616 173.9402 94 H 5.2969 7.8351 113.9076 55.5849 31.0352 172.8175 95 H 4.0339 9.2875 116.9364 57.3679 28.7863 176.4047 96 H 3.9408 8.7161 123.6486 56.4164 27.5651 174.3902 97 H 4.9826 8.2750 109.7043 54.0066 28.1917 171.4379 98 H 4.7933 8.0336 124.1430 56.4278 32.8929 172.8450 99 H 4.4431 8.0824 122.8979 56.4991 29.9310 172.9553 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 8.29 4.34 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.51 0.00 2 K 8.69 3.67 0.00 1.96 1.85 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.39 1.47 7.81 3 T 8.78 4.02 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 1.25 0.00 0.00 4 G 7.46 4.75 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 0.00 0.00 0.00 5 Y 7.72 4.80 0.00 2.95 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 6 K 8.67 4.64 0.00 1.83 1.76 0.00 1.52 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.45 7.81 7 V 8.35 4.17 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 0.83 0.00 0.00 0.94 0.00 0.00 8 M 8.52 4.44 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 9 L 7.68 4.73 0.00 1.71 1.59 0.91 0.38 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 10 G 7.95 3.82 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 0.00 11 A 8.52 4.80 1.17 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 0.00 0.00 12 L 8.56 4.59 0.00 1.70 1.73 0.94 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 13 A 7.92 4.52 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 14 F 8.48 4.41 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 15 V 7.71 3.97 2.03 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 0.77 0.00 0.00 0.86 0.00 0.00 16 V 7.59 4.05 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 0.87 0.00 0.00 0.28 0.00 0.00 17 T 7.86 4.58 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 1.17 0.00 0.00 18 N 8.09 4.60 0.00 2.51 2.73 0.00 0.00 6.11 7.76 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 19 V 7.85 4.23 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 0.78 0.00 0.00 0.91 0.00 0.00 20 Y 8.46 4.63 0.00 3.01 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 21 A 8.40 5.08 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 22 A 9.27 5.03 1.29 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 0.00 0.00 0.00 0.00 0.00 23 E 8.51 4.73 0.00 2.07 1.76 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 2.28 2.40 0.00 24 I 8.79 4.84 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.87 0.84 0.00 0.00 25 M 8.32 4.62 0.00 2.01 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 2.58 0.00 26 K 8.54 3.95 0.00 1.99 1.73 0.00 1.73 0.00 0.00 1.92 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.43 7.81 27 K 8.90 3.74 0.00 1.85 1.83 0.00 1.73 0.00 0.00 2.04 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.67 7.81 28 T 7.80 3.86 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 1.20 0.00 0.00 29 D 8.02 4.31 0.00 2.87 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 30 F 8.96 3.93 0.00 2.91 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 D 8.13 3.75 0.00 2.77 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 32 K 7.40 3.99 0.00 1.85 1.78 0.00 1.56 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.47 7.81 33 V 8.21 3.87 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 0.83 0.00 0.00 0.49 0.00 0.00 34 A 7.52 3.86 0.59 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 0.00 0.00 35 S 7.31 4.22 0.00 3.93 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 36 E 8.73 4.90 0.00 2.03 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 2.24 2.35 0.00 37 Y 8.10 4.82 0.00 2.84 3.15 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 0.00 38 T 9.46 4.77 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 1.20 0.00 0.00 39 K 8.50 4.33 0.00 1.41 1.58 0.00 1.47 0.00 0.00 1.30 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.23 1.42 7.81 40 I 9.32 4.11 1.87 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 1.34 0.77 0.91 0.00 0.00 41 G 7.25 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 0.00 0.00 0.00 0.00 42 T 8.03 5.01 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 43 I 8.71 4.72 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 1.50 0.90 0.92 0.00 0.00 44 S 8.31 5.16 0.00 3.90 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.94 4.72 4.22 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 1.20 0.00 0.00 46 T 8.70 4.61 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 1.22 0.00 0.00 47 G 11.09 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 48 E 8.74 4.78 0.00 1.91 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 2.15 2.30 0.00 49 M 8.64 4.90 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 50 S 8.47 4.78 0.00 3.90 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 51 P 0.00 4.21 0.00 2.29 2.29 0.00 3.74 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 2.07 2.02 0.00 52 L 7.81 4.02 0.00 1.93 1.96 0.92 0.64 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 53 D 8.03 4.25 0.00 2.80 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 54 A 8.57 4.02 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 55 R 8.07 3.84 0.00 2.07 1.98 0.00 3.12 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.92 0.00 56 E 8.43 4.04 0.00 2.00 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 2.33 2.49 0.00 57 D 8.23 4.32 0.00 2.89 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 58 L 8.32 3.97 0.00 1.93 1.70 0.92 0.70 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 59 I 8.33 3.71 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 1.57 0.96 0.92 0.00 0.00 60 K 8.11 4.03 0.00 2.00 2.07 0.00 1.32 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.70 1.47 7.81 61 K 8.14 3.90 0.00 2.21 1.92 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.46 7.81 62 A 8.36 3.99 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 63 D 8.20 4.15 0.00 2.91 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.42 4.03 0.00 2.09 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 2.35 2.47 0.00 65 K 7.81 4.36 0.00 1.97 1.85 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.46 7.81 66 G 8.09 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.70 4.92 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 68 D 9.23 5.09 0.00 3.00 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 69 V 7.99 5.01 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 1.15 0.00 0.00 0.82 0.00 0.00 70 V 8.89 4.84 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 0.67 0.00 0.00 0.94 0.00 0.00 71 V 8.24 4.31 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 0.62 0.00 0.00 -0.39 0.00 0.00 72 L 8.53 4.65 0.00 1.52 1.59 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.28 4.07 4.39 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 1.23 0.00 0.00 74 S 8.64 4.40 0.00 3.75 3.76 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 75 G 9.21 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 76 Q 7.52 4.50 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 7.08 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 77 T 7.35 4.06 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 78 E 7.85 4.52 0.00 1.86 1.63 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 2.05 2.08 0.00 79 N 8.91 5.51 0.00 2.77 2.75 0.00 0.00 7.70 5.96 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 80 K 7.73 4.59 0.00 1.92 1.88 0.00 1.63 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.43 7.81 81 I 7.56 4.04 1.85 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 1.58 0.57 0.97 0.00 0.00 82 H 8.10 5.38 0.00 3.10 3.27 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.09 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 84 T 8.22 5.28 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 1.22 0.00 0.00 85 A 9.23 5.15 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 86 D 8.96 5.25 0.00 2.88 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 87 I 7.96 5.20 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 1.43 0.86 0.95 0.00 0.00 88 Y 9.61 5.05 0.00 3.07 3.23 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 89 K 9.37 4.98 0.00 1.86 1.65 0.00 1.73 0.00 0.00 1.92 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.36 7.81 90 K 8.64 2.83 0.00 1.47 1.40 0.00 1.19 0.00 0.00 1.35 0.00 0.00 2.56 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.02 0.90 7.81 91 K 7.41 4.33 0.00 1.77 1.69 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.42 1.43 7.81 92 L 8.43 4.29 0.00 1.60 1.68 0.91 0.78 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 93 E 7.55 4.73 0.00 1.84 1.75 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 2.15 2.27 0.00 94 H 7.84 5.30 0.00 3.34 3.25 0.00 5.34 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 H 9.29 4.03 0.00 3.22 3.44 0.00 6.05 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 H 8.72 3.94 0.00 3.32 3.32 0.00 5.64 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 97 H 8.28 4.98 0.00 3.21 3.27 0.00 5.76 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 H 8.03 4.79 0.00 3.06 3.18 0.00 5.69 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 99 H 8.08 4.44 0.00 3.00 3.01 0.00 5.83 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