NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.7751 8.1633 120.2796 55.3086 34.1765 173.9397 2 K 4.7277 8.9138 120.1561 53.7858 37.1320 173.5016 3 K 4.5968 9.9657 126.4723 55.3896 34.3591 174.8947 4 I 4.7079 8.7996 129.3318 59.8625 39.1435 174.2394 5 E 5.0595 9.3473 129.4374 54.3917 31.8088 174.2907 6 A 5.0359 9.1705 129.4691 50.0882 22.3279 174.6498 7 I 4.8330 8.4678 123.2504 59.8102 39.3088 175.4201 8 V 4.8801 8.7806 119.9940 59.0292 36.4352 175.6560 9 R 4.2941 8.4598 120.3232 55.9155 30.5466 178.1089 10 A 4.1087 8.6590 123.1365 55.4782 18.1428 180.1025 11 E 3.9764 8.2409 115.7430 58.7302 29.8657 178.4874 12 K 4.3799 8.0184 117.1152 56.7379 32.8165 178.1063 13 F 4.0905 7.8852 121.6005 61.0653 39.2242 175.2055 14 P 3.9731 0.0000 0.0000 65.5312 31.0107 178.4418 15 E 3.9255 7.9604 117.0381 59.0928 29.4086 179.2939 16 V 3.7810 7.3955 119.7232 65.2547 31.5246 177.9731 17 K 3.6947 7.5927 119.4020 59.3772 31.9009 178.5984 18 A 3.9320 7.9504 120.7629 55.0068 18.4466 179.3460 19 A 3.9290 8.2285 119.6148 55.3274 18.4569 179.8793 20 L 4.1313 8.0545 117.3854 58.1566 41.6707 179.6471 21 E 4.2206 8.5137 118.6462 59.5938 29.1856 179.2852 22 E 4.0522 8.4251 117.8448 58.7026 29.4721 178.5916 23 R 4.5353 7.4115 114.7175 55.5745 30.5564 177.1954 24 G 3.0822 8.0183 106.9905 45.0311 0.0000 174.0769 25 F 4.2206 7.7038 118.8560 56.6628 38.4332 174.7129 26 Y 4.8884 8.4730 123.8174 58.6193 39.7419 177.0670 27 G 3.9804 8.1997 109.0219 45.2585 0.0000 172.4660 28 M 4.9035 8.1371 119.4851 54.7539 34.0687 174.0222 29 T 4.7318 8.9120 117.1159 61.8415 72.2450 173.1272 30 V 4.8665 8.4468 124.9579 61.3635 34.6065 174.6030 31 T 4.6949 8.7230 123.1874 61.6972 72.5428 172.7621 32 D 4.7901 8.6412 125.2766 54.2582 41.8642 175.9393 33 V 4.6390 8.5785 115.6431 59.5928 36.4692 174.2336 34 K 5.1011 8.4791 119.2966 55.3017 35.8595 175.9601 35 G 4.3757 8.8071 108.2405 45.5419 0.0000 171.8417 36 R 5.0547 8.5003 115.8419 54.5445 31.9793 174.8356 37 G 4.3821 8.1472 108.2007 44.5392 0.0000 173.6007 38 Q 4.1250 8.6542 115.9340 58.5774 29.1998 176.2380 39 Q 4.1777 7.1911 117.8669 57.2851 29.2961 175.7172 40 G 4.0541 9.1992 113.4249 44.0468 0.0000 174.5860 41 G 3.7688 7.4241 108.1536 47.1966 0.0000 175.4652 42 M 4.2083 8.7427 121.1425 57.6333 32.6270 175.8552 43 Q 4.6993 7.3374 113.4742 55.3548 31.8410 173.3226 44 I 4.4946 8.4174 120.2386 59.3188 38.9581 175.7579 45 Q 3.9305 8.1520 120.0254 59.4274 29.0854 177.3670 46 F 4.2200 7.8902 121.9422 59.2344 40.1594 175.9949 47 R 4.0690 7.4507 121.9164 56.0489 30.7707 175.4016 48 G 3.9966 8.0996 120.2428 44.8019 0.0000 171.3402 49 R 4.6828 7.4014 115.7479 54.3796 33.7981 176.3766 50 T 4.6554 8.1826 116.5810 63.3143 70.1411 173.7768 51 M 5.0202 8.6993 122.7460 53.4216 35.8234 174.8298 52 E 4.4751 8.7571 122.1750 55.8525 31.0506 176.5546 53 V 3.7128 8.1557 120.7610 63.0001 32.1659 175.8827 54 T 4.1218 8.2513 124.0803 63.1882 69.1231 174.0631 55 L 4.4644 8.3997 125.9313 54.5965 42.2625 176.2924 56 L 4.8306 8.6268 124.0952 51.9504 44.9614 174.4432 57 P 4.8358 0.0000 0.0000 63.0888 32.2188 175.6861 58 K 4.7235 9.1074 121.8654 55.0294 37.6498 174.8339 59 V 4.6336 8.7268 120.8926 61.1052 34.0338 174.0043 60 K 4.8308 8.8992 129.9159 55.0717 33.8695 174.5380 61 L 5.0534 9.0207 130.1668 53.3475 44.6112 174.6058 62 E 5.2490 9.3539 125.6576 54.5713 32.8118 174.8312 63 I 4.7771 8.8129 124.2192 59.3377 41.5007 173.6531 64 V 4.8143 8.5465 129.2760 61.6716 32.8823 175.0638 65 V 4.7244 8.7035 119.6911 59.3477 36.6929 175.0976 66 K 4.3596 8.6523 121.0949 56.4268 32.8685 178.0083 67 D 4.3687 8.8749 121.4710 57.7778 40.7938 178.4662 68 D 4.5753 8.1368 115.0681 54.5360 39.7682 176.7514 69 A 4.6576 8.0421 121.7264 52.2331 19.8137 178.7242 70 V 3.4494 7.5442 117.2282 66.0257 31.6930 177.9044 71 E 3.9114 8.0791 117.8329 59.1212 29.3552 178.6668 72 E 3.8758 8.0997 118.9496 59.4117 29.7084 179.0153 73 V 3.2087 7.6254 118.0877 65.6768 31.4761 177.7160 74 I 3.6969 7.9300 120.1219 64.6653 37.0333 178.6472 75 G 3.6459 8.0672 106.1062 47.6668 0.0000 175.7342 76 L 3.9985 7.9340 121.2732 57.5726 41.5491 179.7337 77 I 3.6701 7.8686 119.8648 64.3172 37.2410 178.5673 78 V 3.6034 8.0992 119.4879 66.2589 31.1618 177.8012 79 N 4.4445 8.2003 114.7554 55.3520 38.7386 176.7296 80 S 4.4978 7.9478 114.8327 59.5685 63.6202 175.7269 81 A 4.2637 8.2645 123.4676 52.4288 19.0569 177.4861 82 F 4.3820 7.6551 120.0244 58.6802 39.9112 174.8751 83 T 4.0482 8.9888 116.0132 60.4858 70.2214 175.0860 84 G 3.5863 7.6543 108.6841 44.7666 0.0000 173.0998 85 S 4.7052 7.2409 115.8768 55.5952 64.9014 171.9433 86 P 4.1536 0.0000 0.0000 64.5610 31.5073 176.6639 87 G 4.1090 9.0198 108.9050 45.4470 0.0000 175.2179 88 D 4.1085 7.4811 118.9255 55.8835 40.9191 175.4489 89 G 4.2338 7.1007 100.0993 44.8815 0.0000 172.4011 90 K 4.6346 8.1199 115.9623 54.5468 36.7990 175.7010 91 I 4.5676 7.9419 121.7427 59.4341 40.2230 174.9236 92 F 5.0888 8.8864 125.1208 55.7697 41.8866 174.2962 93 I 4.8274 8.5672 124.1797 59.8441 38.7495 174.9754 94 I 4.6961 8.6599 128.7658 58.3450 40.0427 173.6436 95 P 4.6476 0.0000 0.0000 62.9918 32.0435 175.6961 96 V 4.3922 8.0236 121.7917 61.4436 33.0993 175.4031 97 E 4.2202 9.0455 127.1493 58.6779 30.0514 175.8447 98 D 4.6036 7.4160 114.6767 53.2292 44.1954 174.1096 99 V 4.5612 8.0317 121.8407 61.0653 35.2575 173.9608 100 V 4.9064 8.3774 126.2272 61.1360 34.1764 174.6870 101 R 4.3038 8.9917 127.6775 55.3614 30.6900 177.7109 102 I 3.6694 8.6084 125.6833 64.3625 37.5510 178.4637 103 R 3.9360 8.1098 119.5776 58.5875 30.0266 176.8143 104 T 4.3906 7.1920 102.2732 60.2260 70.2642 175.1512 105 G 3.9201 8.5117 109.8322 45.6459 0.0000 173.8627 106 E 4.1708 7.8307 119.6658 56.3230 30.2773 176.0052 107 R 5.6393 7.2537 115.8420 54.5155 34.0797 176.8754 108 G 3.8797 8.4915 107.8253 46.5910 0.0000 177.4775 109 D 4.3941 8.9768 123.5959 56.8392 40.6104 176.5400 110 D 4.7188 7.8294 116.3110 54.3659 41.0671 177.0848 111 S 4.5504 7.7581 113.5347 58.7342 63.8935 174.2517 112 L 4.8917 7.4554 119.6743 52.5183 45.2368 176.0293 113 E 4.0688 8.5854 121.0110 56.4553 30.0775 176.2351 114 H 4.2790 8.5930 122.2825 56.1242 30.5704 174.9263 115 H 4.3038 8.7625 122.8894 55.9263 28.7296 174.7983 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 8.16 4.78 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 2 K 8.91 4.73 0.00 1.61 1.63 0.00 1.67 0.00 0.00 1.62 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.60 7.81 3 K 9.97 4.60 0.00 1.80 1.82 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.43 7.81 4 I 8.80 4.71 1.93 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.48 0.85 0.00 0.00 5 E 9.35 5.06 0.00 2.08 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 2.39 2.31 0.00 6 A 9.17 5.04 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 7 I 8.47 4.83 1.83 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.02 0.91 0.00 0.00 8 V 8.78 4.88 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 0.79 0.00 0.00 1.14 0.00 0.00 9 R 8.46 4.29 0.00 1.88 2.04 0.00 3.10 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 10 A 8.66 4.11 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 11 E 8.24 3.98 0.00 1.94 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 2.31 2.47 0.00 12 K 8.02 4.38 0.00 1.80 1.85 0.00 1.70 0.00 0.00 1.57 0.00 0.00 3.08 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.38 1.75 7.81 13 F 7.89 4.09 0.00 3.19 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 14 P 0.00 3.97 0.00 2.16 2.06 0.00 3.78 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.26 0.00 15 E 7.96 3.93 0.00 2.13 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 2.37 2.33 0.00 16 V 7.40 3.78 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 1.34 0.00 0.00 0.92 0.00 0.00 17 K 7.59 3.69 0.00 0.96 1.51 0.00 1.76 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.46 7.81 18 A 7.95 3.93 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 19 A 8.23 3.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.05 4.13 0.00 1.89 1.96 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.51 4.22 0.00 2.22 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 2.60 2.62 0.00 22 E 8.43 4.05 0.00 2.14 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 2.37 2.63 0.00 23 R 7.41 4.54 0.00 2.11 2.07 0.00 3.40 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 24 G 8.02 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 0.00 0.00 0.00 25 F 7.70 4.22 0.00 3.17 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 26 Y 8.47 4.89 0.00 2.98 2.81 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 0.00 0.00 0.00 27 G 8.20 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 28 M 8.14 4.90 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.81 0.00 29 T 8.91 4.73 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 1.21 0.00 0.00 30 V 8.45 4.87 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 0.32 0.00 0.00 0.84 0.00 0.00 31 T 8.72 4.69 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 1.19 0.00 0.00 32 D 8.64 4.79 0.00 2.52 2.57 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 33 V 8.58 4.64 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 0.78 0.00 0.00 0.95 0.00 0.00 34 K 8.48 5.10 0.00 1.57 1.65 0.00 1.76 0.00 0.00 1.85 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.39 7.81 35 G 8.81 4.38 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 0.00 36 R 8.50 5.05 0.00 1.76 1.86 0.00 2.98 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.61 0.00 37 G 8.15 4.38 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 0.00 38 Q 8.65 4.13 0.00 2.25 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.71 7.03 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 39 Q 7.19 4.18 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.65 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 40 G 9.20 4.05 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 0.00 0.00 0.00 41 G 7.42 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.74 4.21 0.00 2.00 2.10 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 2.58 2.52 0.00 43 Q 7.34 4.70 0.00 2.36 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.47 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 44 I 8.42 4.49 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 1.29 1.25 0.90 0.00 0.00 45 Q 8.15 3.93 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.97 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 46 F 7.89 4.22 0.00 2.99 2.85 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 47 R 7.45 4.07 0.00 1.09 0.66 0.00 3.25 0.00 0.00 3.09 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.36 0.00 48 G 8.10 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.40 4.68 0.00 1.77 1.81 0.00 3.34 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.49 0.00 50 T 8.18 4.66 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 1.23 0.00 0.00 51 M 8.70 5.02 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 52 E 8.76 4.48 0.00 2.01 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 53 V 8.16 3.71 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 0.81 0.00 0.00 1.00 0.00 0.00 54 T 8.25 4.12 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 1.18 0.00 0.00 55 L 8.40 4.46 0.00 1.52 1.61 0.92 0.91 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 56 L 8.63 4.83 0.00 1.56 1.52 0.90 0.75 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 57 P 0.00 4.84 0.00 1.92 1.96 0.00 3.60 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 58 K 9.11 4.72 0.00 1.59 1.79 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.51 7.81 59 V 8.73 4.63 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 0.34 0.00 0.00 0.80 0.00 0.00 60 K 8.90 4.83 0.00 1.85 1.73 0.00 1.65 0.00 0.00 1.59 0.00 0.00 3.16 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.39 7.81 61 L 9.02 5.05 0.00 1.92 1.55 1.08 0.80 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 62 E 9.35 5.25 0.00 1.89 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 0.00 2.23 2.22 0.00 63 I 8.81 4.78 1.90 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.87 0.86 0.00 0.00 64 V 8.55 4.81 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 0.94 0.00 0.00 0.95 0.00 0.00 65 V 8.70 4.72 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 0.69 0.00 0.00 0.89 0.00 0.00 66 K 8.65 4.36 0.00 1.89 1.70 0.00 1.39 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.45 7.81 67 D 8.87 4.37 0.00 2.71 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 68 D 8.14 4.58 0.00 2.83 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 69 A 8.04 4.66 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 70 V 7.54 3.45 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 1.09 0.00 0.00 0.98 0.00 0.00 71 E 8.08 3.91 0.00 2.00 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 2.39 2.30 0.00 72 E 8.10 3.88 0.00 2.06 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 0.00 2.38 2.41 0.00 73 V 7.63 3.21 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 0.77 0.00 0.00 -0.14 0.00 0.00 74 I 7.93 3.70 1.95 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.50 0.87 0.00 0.00 75 G 8.07 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 76 L 7.93 4.00 0.00 1.75 1.67 0.91 0.57 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 77 I 7.87 3.67 1.94 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.70 0.89 0.00 0.00 78 V 8.10 3.60 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 1.02 0.00 0.00 0.95 0.00 0.00 79 N 8.20 4.44 0.00 2.84 2.82 0.00 0.00 7.04 7.18 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 80 S 7.95 4.50 0.00 3.96 4.08 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 81 A 8.26 4.26 1.39 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 0.00 0.00 0.00 82 F 7.66 4.38 0.00 3.14 2.93 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 83 T 8.99 4.05 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 1.16 0.00 0.00 84 G 7.65 3.59 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 0.00 85 S 7.24 4.71 0.00 3.73 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 86 P 0.00 4.15 0.00 2.16 2.00 0.00 3.61 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 2.01 2.09 0.00 87 G 9.02 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 0.00 0.00 0.00 88 D 7.48 4.11 0.00 2.75 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 G 7.10 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 90 K 8.12 4.63 0.00 1.28 1.18 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.43 7.81 91 I 7.94 4.57 1.75 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 1.22 0.48 0.82 0.00 0.00 92 F 8.89 5.09 0.00 2.93 2.85 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 93 I 8.57 4.83 1.90 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 1.37 0.83 0.92 0.00 0.00 94 I 8.66 4.70 1.91 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 1.30 0.74 0.92 0.00 0.00 95 P 0.00 4.65 0.00 2.08 2.06 0.00 3.71 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 96 V 8.02 4.39 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 0.86 0.00 0.00 0.96 0.00 0.00 97 E 9.05 4.22 0.00 2.00 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 2.30 2.29 0.00 98 D 7.42 4.60 0.00 2.57 2.48 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 99 V 8.03 4.56 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 0.94 0.00 0.00 0.95 0.00 0.00 100 V 8.38 4.91 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 0.89 0.00 0.00 0.94 0.00 0.00 101 R 8.99 4.30 0.00 1.79 1.86 0.00 3.20 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 102 I 8.61 3.67 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 1.31 0.86 0.92 0.00 0.00 103 R 8.11 3.94 0.00 1.78 1.97 0.00 3.18 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 104 T 7.19 4.39 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 0.00 105 G 8.51 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 0.00 106 E 7.83 4.17 0.00 2.10 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 2.33 2.26 0.00 107 R 7.25 5.64 0.00 2.22 2.04 0.00 3.26 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 108 G 8.49 3.88 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 0.00 0.00 0.00 109 D 8.98 4.39 0.00 2.69 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.83 4.72 0.00 2.69 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 0.00 111 S 7.76 4.55 0.00 3.98 4.05 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 0.00 112 L 7.46 4.89 0.00 1.62 1.60 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.59 4.07 0.00 1.87 1.69 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 2.28 2.14 0.00 114 H 8.59 4.28 0.00 3.12 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 H 8.76 4.30 0.00 3.14 2.90 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