NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3516 0.0000 0.0000 61.7171 32.6782 175.8394 3 K 3.9838 8.6743 123.3378 55.3873 32.6503 175.2299 4 K 3.9319 9.1065 127.1916 57.1490 33.6098 175.0923 5 V 4.9584 8.4125 126.4572 61.1841 33.4835 174.3493 6 L 4.8904 9.0240 126.2708 53.2107 46.2736 175.3397 7 T 4.7869 8.1753 116.3620 62.2841 71.7713 173.8716 8 G 4.0740 8.5025 111.3739 45.8148 0.0000 171.6284 9 V 4.8724 7.7898 118.1352 60.8765 35.2501 176.2554 10 V 4.1699 8.5124 126.5142 62.7263 31.5461 176.4894 11 V 4.2358 8.6590 121.8082 61.6747 32.5242 176.5472 12 S 4.5179 7.6128 115.7706 56.8410 65.7462 173.6632 13 D 5.0275 8.6090 125.5907 54.0620 41.6001 176.2767 14 K 4.2229 7.8625 115.9801 57.2030 32.1773 176.5329 15 M 4.7245 7.6020 117.7754 53.1432 34.8348 174.9213 16 Q 4.3544 8.4309 118.9634 56.6624 29.6314 176.4714 17 K 4.6934 9.2374 119.0978 56.3529 30.1796 174.1773 18 T 5.1417 7.5869 113.0236 62.1268 72.5145 173.7474 19 V 4.6968 8.9753 116.6390 60.1589 36.9321 174.7946 20 T 4.8738 8.6497 119.9714 62.3366 69.9921 173.8000 21 V 4.4868 8.8918 128.1488 61.4657 33.1690 174.7598 22 L 4.7835 9.1305 131.9032 53.5359 42.2635 173.8791 23 V 4.2765 8.5577 125.3775 62.2150 32.4869 174.5620 24 E 4.8128 8.7453 128.9703 55.6340 31.1266 174.9290 25 R 4.8569 8.6819 123.0751 55.1960 34.1116 173.5754 26 Q 4.9376 8.8013 121.7824 53.8583 33.2763 174.0502 27 F 4.8219 7.5669 116.0209 56.2226 41.5139 170.8587 28 P 4.9673 0.0000 0.0000 61.9738 32.5291 175.5710 29 H 4.2728 9.1420 124.5630 55.6941 30.2321 174.0645 30 P 4.3031 0.0000 0.0000 65.0272 31.1167 176.5378 31 L 4.3487 7.9884 118.3455 55.8738 43.9637 176.1423 32 Y 4.6394 7.7108 113.5159 56.8831 38.3227 178.1100 33 G 4.2965 8.2741 110.3408 46.8550 0.0000 174.8256 34 K 4.0241 8.1784 118.6893 57.1436 33.7994 176.8436 35 V 4.2374 8.3264 122.4415 62.8209 31.9238 175.4405 36 I 4.2594 8.1382 122.4132 59.3875 40.6235 174.8099 37 K 4.6480 8.0576 122.5508 54.4075 34.4990 175.1306 38 R 4.7737 8.4318 128.8998 55.4419 33.1129 174.2372 39 S 5.0890 8.1543 112.2325 57.3958 65.5433 174.0771 40 K 4.6128 8.8754 122.0318 54.7487 35.9746 174.7183 41 K 4.9528 8.3869 124.5860 55.0565 33.9546 175.2651 42 Y 4.6795 9.2669 122.4059 56.0926 41.2363 174.7318 43 L 5.0437 8.7292 123.0721 53.7217 42.8121 175.7538 44 A 5.1297 9.1274 126.5065 50.1757 22.1962 174.8463 45 H 4.7760 9.2071 121.6734 56.1797 31.1155 173.9967 46 D 5.0160 9.6669 127.0561 51.4740 40.5189 173.9483 47 P 4.1756 0.0000 0.0000 65.3703 32.0095 178.5026 48 E 4.0535 8.1782 115.4352 57.0199 29.4557 177.5652 49 E 4.0310 7.8446 116.4122 57.0302 27.2301 175.7755 50 K 3.7024 7.1694 119.1194 59.4791 32.5417 176.4530 51 Y 4.0579 7.3602 115.4541 58.3345 38.6903 176.4313 52 K 4.7391 9.1556 123.6237 53.7475 35.0348 175.1423 53 L 4.1851 8.4155 122.3090 58.4739 40.4757 176.4616 54 G 4.0027 8.5132 114.0994 45.5799 0.0000 172.9421 55 D 4.7029 8.3885 121.0163 54.3065 42.3561 175.4230 56 V 4.6976 8.5742 122.4098 61.7356 33.3952 175.2063 57 V 4.9611 8.7113 120.0065 59.7039 36.7114 173.9662 58 E 5.0291 9.0726 121.7222 55.0906 31.4902 175.6610 59 I 4.6724 9.3315 126.2544 60.0021 39.8022 174.6620 60 I 5.0553 8.4747 124.7042 58.8226 41.4101 174.0625 61 E 3.6146 9.3902 131.0622 57.0770 29.9407 175.9396 62 S 4.7435 7.9120 122.0204 56.5802 67.3052 173.3377 63 R 4.0831 8.4193 120.2437 55.1537 30.5167 174.2695 64 P 4.3588 0.0000 0.0000 63.5578 31.8517 175.9166 65 I 4.2566 8.0813 122.1564 62.3456 39.0893 175.3398 66 S 4.4975 7.3444 111.7372 56.9547 65.3523 173.3126 67 K 3.9587 8.4311 121.6749 57.3709 32.8390 176.2900 68 R 3.6689 8.4193 124.7350 55.1241 27.7091 176.5826 69 K 5.2591 6.6420 124.1640 56.7429 34.2787 173.7019 70 R 4.5403 7.7248 128.0793 55.2429 32.0695 174.5883 71 F 5.3490 8.2619 115.5416 56.0888 43.9582 173.8773 72 R 4.9207 8.7527 120.6270 54.0779 33.7606 175.4504 73 V 3.6088 7.9846 122.9098 63.0384 30.7335 175.6604 74 L 4.2399 9.0513 131.2541 57.0866 42.3406 176.7759 75 R 4.6042 7.4546 112.2184 55.6168 32.6157 172.1067 76 L 4.8926 8.6772 121.5909 54.3454 42.5539 175.8983 77 V 4.2333 8.7575 126.7570 64.6410 33.0820 176.2030 78 E 4.6641 7.6213 115.9914 55.5375 32.3883 175.8535 79 S 5.3129 8.6880 118.8351 57.2766 63.5841 174.7236 80 G 3.5916 8.1175 106.5101 45.8083 0.0000 175.1275 81 R 5.3220 7.0670 131.1988 55.9813 30.9091 174.7351 82 M 4.2225 7.4487 124.8093 57.9529 31.9755 177.0047 83 D 4.6194 8.2278 119.6986 56.3802 39.0252 178.6788 84 L 3.9507 7.6443 119.8972 57.4114 41.9833 178.9547 85 V 3.6720 7.8611 117.6339 66.2328 31.1739 177.3324 86 E 3.9324 8.7609 118.3674 59.6713 29.2911 179.0951 87 K 3.9433 7.5572 117.6054 60.0418 32.2363 178.2202 88 Y 4.1305 7.8852 118.7607 61.0025 38.5902 178.6573 89 L 3.5882 8.3313 119.8156 57.8370 41.6420 179.4632 90 I 3.5993 8.4287 120.5009 64.4588 36.7562 178.5114 91 R 3.8294 7.9035 119.0133 59.2264 29.7206 178.2592 92 R 3.1431 7.3324 118.5948 58.9195 30.0539 178.2983 93 Q 3.9369 8.0328 119.8606 59.1507 28.7994 177.9443 94 N 4.4598 7.8206 116.7620 56.3516 38.5866 176.5330 95 Y 4.3043 8.0389 117.8865 60.9023 37.6226 178.4951 96 Q 4.3137 7.4610 117.4207 56.4676 30.4948 175.4558 97 S 4.2252 10.6232 120.1457 57.4779 69.4389 177.5087 98 L 3.6327 8.2921 115.3677 57.0324 38.3775 174.1140 99 S 4.5009 7.5234 116.2043 59.9313 65.1762 174.9985 100 K 4.5936 7.8599 118.2691 54.3564 34.5544 176.4679 101 R 4.2481 9.2690 115.1954 53.6096 32.3982 174.8522 102 G 3.9815 8.2817 109.5535 44.2266 0.0000 172.8311 103 G 4.3598 8.3414 113.8678 44.9099 0.0000 172.9204 104 K 4.4109 7.8083 118.4197 55.0951 31.9653 176.3059 105 A 4.0990 8.6696 130.5758 54.0423 18.9921 176.3589 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 2 P 0.00 4.35 0.00 2.06 2.06 0.00 3.65 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 1.92 2.11 0.00 3 K 8.67 3.98 0.00 1.71 1.88 0.00 1.75 0.00 0.00 1.91 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.48 7.81 4 K 9.11 3.93 0.00 1.98 1.84 0.00 1.47 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.51 1.47 7.81 5 V 8.41 4.96 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 0.87 0.00 0.00 1.00 0.00 0.00 6 L 9.02 4.89 0.00 1.09 1.19 -0.14 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.18 4.79 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 1.25 0.00 0.00 8 G 8.50 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 0.00 0.00 0.00 9 V 7.79 4.87 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 0.95 0.00 0.00 0.91 0.00 0.00 10 V 8.51 4.17 2.20 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 0.95 0.00 0.00 0.99 0.00 0.00 11 V 8.66 4.24 1.60 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 0.37 0.00 0.00 0.32 0.00 0.00 12 S 7.61 4.52 0.00 3.89 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 13 D 8.61 5.03 0.00 2.65 2.59 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 14 K 7.86 4.22 0.00 1.78 1.86 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.43 7.81 15 M 7.60 4.72 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 16 Q 8.43 4.35 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.21 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 17 K 9.24 4.69 0.00 2.01 1.89 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.43 7.81 18 T 7.59 5.14 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 1.32 0.00 0.00 19 V 8.98 4.70 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 0.77 0.00 0.00 0.94 0.00 0.00 20 T 8.65 4.87 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 1.12 0.00 0.00 21 V 8.89 4.49 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 0.83 0.00 0.00 0.85 0.00 0.00 22 L 9.13 4.78 0.00 1.45 1.49 0.87 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.56 4.28 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 0.85 0.00 0.00 0.78 0.00 0.00 24 E 8.75 4.81 0.00 2.02 1.83 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 2.27 2.32 0.00 25 R 8.68 4.86 0.00 1.98 1.79 0.00 3.13 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.73 0.00 26 Q 8.80 4.94 0.00 1.95 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.85 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 27 F 7.57 4.82 0.00 3.17 3.19 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 0.00 0.00 0.00 0.00 28 P 0.00 4.97 0.00 2.18 2.16 0.00 4.06 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 29 H 9.14 4.27 0.00 3.32 3.40 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.30 0.00 2.15 2.16 0.00 3.63 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.90 0.00 31 L 7.99 4.35 0.00 1.33 1.11 0.81 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.71 4.64 0.00 2.92 2.84 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 0.00 0.00 0.00 33 G 8.27 4.30 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 0.00 34 K 8.18 4.02 0.00 1.79 1.99 0.00 1.28 0.00 0.00 1.54 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.41 7.81 35 V 8.33 4.24 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 0.74 0.00 0.00 0.93 0.00 0.00 36 I 8.14 4.26 1.71 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 0.05 -0.19 0.88 0.00 0.00 37 K 8.06 4.65 0.00 1.66 1.65 0.00 1.58 0.00 0.00 0.61 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.32 7.81 38 R 8.43 4.77 0.00 2.19 1.94 0.00 3.51 0.00 0.00 3.48 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 39 S 8.15 5.09 0.00 3.90 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 40 K 8.88 4.61 0.00 1.75 1.58 0.00 1.49 0.00 0.00 1.52 0.00 0.00 2.22 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 1.04 7.81 41 K 8.39 4.95 0.00 1.56 1.61 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.18 1.38 7.81 42 Y 9.27 4.68 0.00 2.72 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 43 L 8.73 5.04 0.00 1.60 1.67 1.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 44 A 9.13 5.13 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 45 H 9.21 4.78 0.00 3.26 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.67 5.02 0.00 2.73 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 47 P 0.00 4.18 0.00 2.20 2.07 0.00 3.64 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 2.06 1.69 0.00 48 E 8.18 4.05 0.00 1.99 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 2.39 2.34 0.00 49 E 7.84 4.03 0.00 2.12 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 2.40 2.38 0.00 50 K 7.17 3.70 0.00 1.63 1.33 0.00 1.73 0.00 0.00 1.28 0.00 0.00 2.77 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.55 1.08 7.81 51 Y 7.36 4.06 0.00 3.09 2.96 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 52 K 9.16 4.74 0.00 1.77 1.69 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.48 7.81 53 L 8.42 4.19 0.00 1.60 1.64 1.06 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.51 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 55 D 8.39 4.70 0.00 2.84 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 56 V 8.57 4.70 2.23 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 1.00 0.00 0.00 0.93 0.00 0.00 57 V 8.71 4.96 1.88 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 0.63 0.00 0.00 0.77 0.00 0.00 58 E 9.07 5.03 0.00 1.81 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 2.19 2.23 0.00 59 I 9.33 4.67 1.48 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.68 0.51 0.00 0.00 60 I 8.47 5.06 1.89 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 1.13 1.76 0.93 0.00 0.00 61 E 9.39 3.61 0.00 2.08 1.85 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 2.13 1.94 0.00 62 S 7.91 4.74 0.00 3.65 3.68 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 63 R 8.42 4.08 0.00 1.73 1.77 0.00 3.24 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 64 P 0.00 4.36 0.00 2.04 1.97 0.00 3.64 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 2.00 2.08 0.00 65 I 8.08 4.26 1.82 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 1.26 0.73 0.70 0.00 0.00 66 S 7.34 4.50 0.00 3.93 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 67 K 8.43 3.96 0.00 1.74 1.75 0.00 1.93 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.43 7.81 68 R 8.42 3.67 0.00 1.98 1.93 0.00 3.41 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 69 K 6.64 5.26 0.00 1.90 1.86 0.00 1.75 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.28 1.50 7.81 70 R 7.72 4.54 0.00 1.61 1.41 0.00 3.18 0.00 0.00 3.34 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 71 F 8.26 5.35 0.00 2.94 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 72 R 8.75 4.92 0.00 1.76 1.81 0.00 3.17 0.00 0.00 3.12 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 73 V 7.98 3.61 1.65 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 -0.74 0.00 0.00 0.67 0.00 0.00 74 L 9.05 4.24 0.00 1.66 1.72 0.96 0.95 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 75 R 7.45 4.60 0.00 1.93 2.02 0.00 3.02 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 76 L 8.68 4.89 0.00 1.97 1.71 1.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 77 V 8.76 4.23 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 0.92 0.00 0.00 78 E 7.62 4.66 0.00 2.04 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 2.24 2.28 0.00 79 S 8.69 5.31 0.00 3.86 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 80 G 8.12 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 81 R 7.07 5.32 0.00 2.34 2.11 0.00 3.03 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.36 0.00 82 M 7.45 4.22 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.55 0.00 83 D 8.23 4.62 0.00 2.87 2.96 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 84 L 7.64 3.95 0.00 1.70 1.75 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.86 3.67 2.23 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 1.17 0.00 0.00 0.95 0.00 0.00 86 E 8.76 3.93 0.00 2.19 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 2.60 2.52 0.00 87 K 7.56 3.94 0.00 1.83 1.92 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.65 7.81 88 Y 7.89 4.13 0.00 3.02 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 89 L 8.33 3.59 0.00 1.79 1.61 0.95 0.72 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 90 I 8.43 3.60 2.05 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 1.38 1.34 0.89 0.00 0.00 91 R 7.90 3.83 0.00 1.86 1.78 0.00 3.26 0.00 0.00 3.21 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 92 R 7.33 3.14 0.00 1.34 1.69 0.00 2.99 0.00 0.00 2.98 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 93 Q 8.03 3.94 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 94 N 7.82 4.46 0.00 2.86 2.96 0.00 0.00 7.07 8.04 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 95 Y 8.04 4.30 0.00 3.21 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 96 Q 7.46 4.31 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.67 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 97 S 10.62 4.23 0.00 4.07 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 98 L 8.29 3.63 0.00 1.79 2.16 0.85 0.36 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 99 S 7.52 4.50 0.00 3.92 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 0.00 100 K 7.86 4.59 0.00 1.70 1.81 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.42 7.81 101 R 9.27 4.25 0.00 1.76 1.71 0.00 3.42 0.00 0.00 3.23 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 102 G 8.28 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 0.00 103 G 8.34 4.36 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 0.00 104 K 7.81 4.41 0.00 1.76 1.33 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 105 A 8.67 4.10 1.28 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 0.00 0.00