NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2764 8.3027 121.7422 56.1218 31.4345 174.2850 2 Q 4.2070 8.8090 129.1924 54.9610 28.8429 173.6383 3 L 4.6736 8.8457 127.7878 54.5740 43.4657 176.5767 4 T 4.2619 9.0026 112.4570 60.3680 71.2470 175.4745 5 K 3.4798 8.6965 121.9249 60.3011 32.0563 179.3793 6 C 4.4623 7.9953 115.8145 59.3781 40.5426 175.5716 7 E 3.8318 7.6953 120.9802 59.1587 29.2530 178.8302 8 V 3.4774 8.0381 118.6672 65.8878 31.2728 177.5006 9 F 4.0144 7.9314 119.0946 61.5441 39.6228 177.1133 10 R 4.1503 8.3923 117.4472 59.5389 29.7468 179.0751 11 E 4.0846 8.1109 116.6486 58.5034 29.6820 178.2894 12 L 4.3789 7.4754 117.3497 54.0507 41.7706 178.0075 13 K 3.7126 7.6277 123.0120 59.7706 32.1618 178.3441 14 D 4.3374 8.0235 116.4666 57.2747 40.9584 177.4048 15 L 4.0532 8.1960 117.7792 55.2366 41.7458 176.3620 16 K 4.1528 7.9196 121.5061 58.3191 31.9317 176.9304 17 G 3.9776 8.7734 116.3589 45.2492 0.0000 171.8430 18 Y 4.0812 8.1969 122.5914 58.4024 39.0209 175.8457 19 G 3.9231 8.7683 114.5884 46.1295 0.0000 173.3351 20 G 3.7807 8.1798 105.3443 46.0409 0.0000 174.2453 21 V 4.0663 7.4078 120.2567 60.4018 32.4517 175.7607 22 S 4.3354 8.6093 123.1247 58.0969 64.7841 175.3521 23 L 4.0339 8.3474 122.0673 57.6525 41.4134 177.7492 24 P 4.6811 0.0000 0.0000 66.0458 31.2076 178.4352 25 E 3.8935 8.2512 117.1490 59.2010 29.2908 179.4027 26 W 4.4391 8.1209 118.5436 59.3038 29.1045 179.0050 27 V 3.7415 8.3995 119.0917 65.9555 31.0509 177.1758 28 C 2.4500 7.6949 118.1000 59.4047 38.6130 175.6576 29 T 3.7625 8.0302 117.7864 66.9220 67.9832 176.8798 30 T 3.9159 8.2743 111.7265 64.4126 68.7055 176.3741 31 F 3.3375 7.7790 123.2077 61.3030 39.2280 176.3001 32 H 4.2073 7.7236 112.0712 56.8408 28.5587 176.5454 33 T 4.4329 7.2849 118.0408 64.6352 69.7607 175.5016 34 S 4.5139 8.1273 112.6567 56.8742 64.2745 174.9769 35 G 3.5067 8.2519 108.7495 46.5606 0.0000 173.7808 36 Y 3.7988 7.6100 114.3508 58.3537 35.8713 168.3249 37 D 5.2811 7.7382 121.3033 52.7960 42.0236 177.3588 38 T 4.0886 8.5860 117.5020 63.7699 69.2053 175.8358 39 Q 4.4062 8.5680 120.3618 55.4829 29.1669 175.2250 40 A 4.2822 7.6920 121.5657 52.1161 19.5869 177.4559 41 I 4.8637 8.2282 121.7399 59.4730 40.9650 174.8331 42 V 4.4984 8.4634 127.2093 60.9737 33.8781 174.2871 43 Q 5.1202 8.6561 124.8917 54.7285 31.0527 174.5351 44 N 5.1286 8.5999 117.6851 51.9572 39.5660 174.4171 45 N 4.4818 8.8767 113.6707 55.3861 39.0000 175.1951 46 D 4.9528 7.6898 116.3290 52.8953 41.6481 176.3061 47 S 4.9304 8.2042 113.5795 56.6787 66.3395 172.7388 48 T 5.1299 9.4533 112.3375 60.0760 72.2151 172.4366 49 E 5.4059 9.1361 122.8924 54.9144 33.7541 174.4625 50 Y 4.9298 8.9573 120.1260 57.7755 41.9497 176.5912 51 G 4.4960 9.2747 112.5627 45.6391 0.0000 172.9728 52 L 3.8601 8.6021 119.3475 58.1205 42.0325 178.9216 53 F 4.7159 8.1809 113.4156 57.1384 39.8611 175.2313 54 Q 3.5250 7.7590 118.9435 57.0397 26.6578 174.2125 55 I 4.1651 8.1404 119.2129 61.1168 38.7209 177.3047 56 N 5.6656 9.0912 125.0107 51.9603 39.6252 175.1993 57 N 5.3890 8.7813 116.6144 52.7413 37.7530 176.4608 58 K 4.3488 8.5015 120.0368 59.2269 32.4817 177.7932 59 I 4.8965 7.7872 107.5872 58.5587 39.1184 176.9124 60 W 4.5047 8.0050 121.6106 58.4867 29.8446 173.3093 61 C 6.1713 7.8393 110.4184 53.9843 42.1847 172.5587 62 K 4.9256 8.8347 121.0672 54.9982 33.7549 174.7824 63 D 4.8973 8.2930 124.7108 52.1142 42.9864 175.6239 64 D 4.4303 8.9178 117.7270 57.6165 40.9619 178.0949 65 Q 4.1565 8.2902 118.7552 58.7264 29.5488 175.9298 66 N 5.0245 8.9416 116.6698 51.0821 38.9329 172.4991 67 P 4.5284 0.0000 0.0000 64.3600 32.1636 177.6209 68 H 4.7325 8.1287 115.2060 55.4314 28.8426 174.8494 69 S 4.1207 7.7759 114.3766 58.5717 62.7451 174.5058 70 S 3.9807 8.8724 121.0582 59.9174 63.2351 173.7652 71 N 4.3314 8.0960 117.6434 54.6458 36.6856 174.8665 72 I 3.8166 8.0333 119.9591 64.5907 37.8314 177.6038 73 C 4.4624 8.5838 116.0489 57.2179 40.7471 172.5552 74 N 4.0532 8.0142 117.5028 53.4776 37.1450 173.4072 75 I 4.2876 7.0428 116.2382 59.7662 41.6699 172.9926 76 S 4.5258 8.2281 121.2996 58.0711 63.1189 175.8331 77 C 3.9071 8.9639 125.4115 59.9168 34.3356 176.1052 78 D 4.1357 7.3508 118.9816 56.9815 40.1267 178.4142 79 K 4.1269 7.3942 117.1668 57.7318 32.2522 177.2865 80 F 5.5331 7.7601 118.0233 56.5828 38.9848 176.8248 81 L 5.5299 7.9619 119.4956 53.7654 43.3102 176.3511 82 D 4.8363 7.8396 117.8595 52.5808 41.7247 175.1517 83 D 4.6340 8.5558 116.7020 54.7912 41.8051 175.7160 84 D 4.6509 8.2876 119.9020 53.2445 41.3640 176.2471 85 L 4.6829 8.3774 125.9768 55.0865 41.9987 178.3061 86 T 3.8460 8.3206 118.4711 67.0268 68.4843 175.9375 87 D 4.4527 8.0842 120.0667 56.0919 39.1994 177.8123 88 D 4.2598 8.3811 120.0519 57.6854 40.9237 178.9532 89 I 3.1991 7.7947 119.9339 64.2249 36.8569 178.4028 90 M 3.8744 7.7984 119.5168 58.5442 31.7829 177.9967 91 C 4.2028 8.0707 118.5207 59.5383 42.0251 175.4490 92 V 3.2843 7.3382 119.9001 65.9221 30.7332 178.1540 93 K 3.6669 7.6777 117.7646 59.3855 31.7493 179.3631 94 K 3.9918 7.6473 118.5387 59.5217 31.9913 179.3677 95 I 2.8346 7.7471 120.2551 64.2087 36.7873 178.3762 96 L 4.1938 8.5878 119.9738 58.1976 41.2446 179.4836 97 D 4.4591 8.5251 118.1650 56.4753 40.7629 178.1180 98 K 4.4716 7.6397 117.7936 57.7838 33.2146 177.8505 99 V 4.3141 8.0151 108.2614 60.0212 33.8011 176.5278 100 G 4.0596 8.1355 107.6895 45.1601 0.0000 173.6593 101 I 4.0250 8.2054 116.9735 63.9960 37.9916 177.1347 102 N 4.8891 8.1762 114.9973 53.7654 38.5672 174.9184 103 Y 3.8143 7.8314 121.1911 60.0955 38.9170 176.5293 104 W 4.4010 8.5651 122.2709 55.2021 28.4502 176.7797 105 L 4.0321 8.3170 124.8337 57.5012 40.9665 179.0920 106 A 4.0970 8.1259 120.4222 55.0530 18.2208 178.7962 107 H 3.9231 8.3779 117.0177 59.4466 29.7196 177.3781 108 K 3.9618 8.2259 120.3987 59.0115 32.2522 178.1284 109 A 4.1936 7.4561 118.6155 53.9293 18.5482 177.9660 110 L 4.6860 8.2140 114.6184 54.7765 43.8769 176.3747 111 C 5.0461 8.3038 115.2797 56.8218 40.8312 174.5584 112 S 4.5173 8.7191 113.9407 58.0262 64.0578 173.6924 113 E 4.5811 7.9546 119.3168 55.9070 33.2361 176.6549 114 K 3.8399 8.5083 116.7331 58.2363 32.7105 174.2422 115 L 5.0941 8.1201 121.5374 54.4384 44.1580 177.3505 116 D 4.5370 8.2321 118.3311 54.8748 39.4571 176.6852 117 Q 4.0207 7.6110 116.8770 56.2278 29.0870 175.8642 118 W 4.8694 7.8559 118.4379 56.5645 29.8174 175.0308 119 L 4.6090 7.7880 117.9390 53.7987 43.0457 177.8484 120 C 4.5007 7.6599 121.8325 62.7295 40.4126 176.2172 121 E 3.5303 8.0938 110.8116 57.6561 27.2825 178.9209 122 K 4.2478 8.2584 130.5924 55.8608 32.2660 177.5753 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 E 8.30 4.28 0.00 2.34 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 2.29 2.34 0.00 2 Q 8.81 4.21 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.87 0.00 0.00 0.00 0.00 0.00 2.39 2.61 0.00 3 L 8.85 4.67 0.00 1.55 1.44 0.88 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 4 T 9.00 4.26 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 1.21 0.00 0.00 5 K 8.70 3.48 0.00 1.90 1.84 0.00 1.77 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.68 1.89 7.81 6 C 8.00 4.46 0.00 2.95 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 7 E 7.70 3.83 0.00 2.12 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 2.27 2.30 0.00 8 V 8.04 3.48 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 0.91 0.00 0.00 0.51 0.00 0.00 9 F 7.93 4.01 0.00 3.10 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 10 R 8.39 4.15 0.00 2.21 2.00 0.00 3.23 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 11 E 8.11 4.08 0.00 2.03 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 2.33 2.33 0.00 12 L 7.48 4.38 0.00 1.55 1.46 0.70 0.75 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 K 7.63 3.71 0.00 1.91 1.79 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.39 7.81 14 D 8.02 4.34 0.00 2.60 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 15 L 8.20 4.05 0.00 1.56 1.56 -0.17 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.92 4.15 0.00 1.68 1.78 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.37 7.81 17 G 8.77 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 18 Y 8.20 4.08 0.00 3.11 2.89 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 0.00 0.00 0.00 19 G 8.77 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 20 G 8.18 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.41 4.07 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 0.11 0.00 0.00 0.77 0.00 0.00 22 S 8.61 4.34 0.00 4.16 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 23 L 8.35 4.03 0.00 1.62 1.50 0.82 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 24 P 0.00 4.68 0.00 2.28 2.33 0.00 3.71 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 25 E 8.25 3.89 0.00 2.11 1.79 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 2.43 2.34 0.00 26 W 8.12 4.44 0.00 3.37 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 27 V 8.40 3.74 2.41 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 1.39 0.00 0.00 1.24 0.00 0.00 28 C 7.69 2.45 0.00 1.64 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 29 T 8.03 3.76 4.10 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 0.92 0.00 0.00 30 T 8.27 3.92 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 0.89 0.00 0.00 31 F 7.78 3.34 0.00 2.52 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 32 H 7.72 4.21 0.00 3.10 3.22 0.00 5.70 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.28 4.43 4.47 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 1.46 0.00 0.00 34 S 8.13 4.51 0.00 4.09 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 0.00 35 G 8.25 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.61 3.80 0.00 3.44 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 37 D 7.74 5.28 0.00 2.67 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 38 T 8.59 4.09 4.46 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 1.29 0.00 0.00 39 Q 8.57 4.41 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.36 0.00 40 A 7.69 4.28 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 41 I 8.23 4.86 1.82 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 1.19 0.94 0.70 0.00 0.00 42 V 8.46 4.50 2.19 0.00 0.00 0.00 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 0.93 0.00 0.00 43 Q 8.66 5.12 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.47 0.00 0.00 0.00 0.00 0.00 2.16 2.30 0.00 44 N 8.60 5.13 0.00 2.83 2.95 0.00 0.00 7.17 6.58 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 45 N 8.88 4.48 0.00 2.72 2.92 0.00 0.00 6.54 8.06 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 46 D 7.69 4.95 0.00 2.91 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 47 S 8.20 4.93 0.00 4.03 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 48 T 9.45 5.13 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 1.27 0.00 0.00 49 E 9.14 5.41 0.00 1.91 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 2.33 2.30 0.00 50 Y 8.96 4.93 0.00 3.26 3.07 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 51 G 9.27 4.50 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 52 L 8.60 3.86 0.00 1.51 1.44 0.92 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.18 4.72 0.00 3.05 3.32 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 0.00 54 Q 7.76 3.53 0.00 2.35 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.84 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 55 I 8.14 4.17 1.63 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.63 0.86 0.00 0.00 56 N 9.09 5.67 0.00 2.99 3.20 0.00 0.00 6.28 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 57 N 8.78 5.39 0.00 2.93 3.33 0.00 0.00 6.97 7.30 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 58 K 8.50 4.35 0.00 1.94 1.90 0.00 1.75 0.00 0.00 1.83 0.00 0.00 3.09 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.48 7.81 59 I 7.79 4.90 1.26 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 -0.36 0.71 0.00 0.00 60 W 8.00 4.50 0.00 3.61 3.20 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 61 C 7.84 6.17 0.00 3.15 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 62 K 8.83 4.93 0.00 1.82 1.64 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.34 7.81 63 D 8.29 4.90 0.00 2.84 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 64 D 8.92 4.43 0.00 2.73 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 65 Q 8.29 4.16 0.00 2.08 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.27 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 66 N 8.94 5.02 0.00 2.73 2.78 0.00 0.00 6.97 7.41 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 67 P 0.00 4.53 0.00 2.21 2.18 0.00 3.48 0.00 0.00 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 68 H 8.13 4.73 0.00 3.10 3.36 0.00 5.92 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.78 4.12 0.00 4.11 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 70 S 8.87 3.98 0.00 3.92 4.04 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 71 N 8.10 4.33 0.00 2.94 2.80 0.00 0.00 7.25 7.90 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 72 I 8.03 3.82 1.77 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.55 1.03 0.00 0.00 73 C 8.58 4.46 0.00 3.41 3.34 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 4.05 0.00 2.87 2.85 0.00 0.00 6.87 8.11 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 75 I 7.04 4.29 1.97 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.96 0.80 0.00 0.00 76 S 8.23 4.53 0.00 3.78 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 77 C 8.96 3.91 0.00 2.11 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 78 D 7.35 4.14 0.00 2.60 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.39 4.13 0.00 1.35 1.78 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.43 7.81 80 F 7.76 5.53 0.00 3.29 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 81 L 7.96 5.53 0.00 1.80 1.77 1.16 1.68 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 82 D 7.84 4.84 0.00 2.78 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 83 D 8.56 4.63 0.00 2.69 2.76 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 84 D 8.29 4.65 0.00 2.65 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.38 4.68 0.00 1.74 1.74 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.32 3.85 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 1.18 0.00 0.00 87 D 8.08 4.45 0.00 3.01 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 88 D 8.38 4.26 0.00 3.07 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 89 I 7.79 3.20 1.83 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.75 0.63 0.00 0.00 90 M 7.80 3.87 0.00 2.04 2.09 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 2.68 2.47 0.00 91 C 8.07 4.20 0.00 3.13 2.89 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 0.00 0.00 0.00 92 V 7.34 3.28 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 0.38 0.00 0.00 -0.59 0.00 0.00 93 K 7.68 3.67 0.00 1.72 1.45 0.00 1.33 0.00 0.00 0.80 0.00 0.00 2.30 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 1.04 7.81 94 K 7.65 3.99 0.00 1.94 2.03 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.51 7.81 95 I 7.75 2.83 1.54 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.29 -0.16 0.00 0.00 96 L 8.59 4.19 0.00 2.09 1.94 1.33 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.53 4.46 0.00 2.74 2.82 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 98 K 7.64 4.47 0.00 2.17 2.13 0.00 1.84 0.00 0.00 1.83 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.60 7.81 99 V 8.02 4.31 2.25 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 0.96 0.00 0.00 1.20 0.00 0.00 100 G 8.14 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 0.00 0.00 0.00 101 I 8.21 4.02 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 0.63 1.19 0.84 0.00 0.00 102 N 8.18 4.89 0.00 2.80 2.86 0.00 0.00 6.84 7.46 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 0.00 103 Y 7.83 3.81 0.00 2.52 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 0.00 0.00 0.00 104 W 8.57 4.40 0.00 3.67 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 0.00 105 L 8.32 4.03 0.00 1.68 1.70 0.88 0.78 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 0.00 106 A 8.13 4.10 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 0.00 107 H 8.38 3.92 0.00 3.13 3.31 0.00 5.59 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 0.00 108 K 8.23 3.96 0.00 1.82 1.84 0.00 1.66 0.00 0.00 2.37 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.37 7.81 109 A 7.46 4.19 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 0.00 110 L 8.21 4.69 0.00 1.68 1.60 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.30 5.05 0.00 2.77 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 0.00 112 S 8.72 4.52 0.00 3.92 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 0.00 113 E 7.95 4.58 0.00 1.89 1.79 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 2.21 2.34 0.00 114 K 8.51 3.84 0.00 1.96 2.10 0.00 1.43 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.38 1.56 7.81 115 L 8.12 5.09 0.00 1.81 1.78 1.03 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.23 4.54 0.00 2.74 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 7.61 4.02 0.00 1.56 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.51 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 118 W 7.86 4.87 0.00 3.43 3.27 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 0.00 119 L 7.79 4.61 0.00 1.56 1.53 0.92 0.99 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 0.00 120 C 7.66 4.50 0.00 1.23 2.33 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 0.00 121 E 8.09 3.53 0.00 2.06 2.15 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 2.19 1.89 0.00 122 K 8.26 4.25 0.00 1.87 1.66 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.29 1.23 7.81