NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3774 8.3044 120.3209 55.8536 33.8406 174.9209 2 H 4.7106 8.4200 118.7580 54.7693 29.3505 172.4821 3 L 4.7278 8.0038 120.7183 53.5146 44.9209 177.4595 4 T 4.1383 8.2070 119.6847 62.3370 70.5161 174.2533 5 P 3.8972 0.0000 0.0000 66.5532 30.7836 178.6609 6 E 3.9706 8.0437 117.4797 59.2232 29.5828 178.9522 7 E 3.9612 7.9023 118.2115 59.0217 29.6309 179.2246 8 K 3.8777 8.8598 119.8579 59.5258 32.1595 179.5645 9 S 4.1439 8.1794 114.2113 61.2621 62.5649 176.4416 10 A 4.0022 7.7671 124.6177 54.9339 18.1552 179.4507 11 V 3.4206 7.6005 116.3968 66.3431 31.0591 177.9836 12 T 3.9423 7.9377 114.9666 67.0794 68.2769 176.4740 13 A 4.1180 8.0273 120.5310 54.6616 18.6546 178.9441 14 L 4.0129 7.8752 118.9141 57.5506 42.1880 178.5374 15 W 4.4214 8.6859 128.6620 60.5765 30.3719 177.9981 16 G 3.7792 7.8442 104.1235 47.4132 0.0000 174.6973 17 K 4.4083 7.7735 117.7106 55.4229 32.7686 176.5135 18 V 3.9414 7.1695 120.3389 61.4929 32.6609 175.7753 19 N 4.5467 8.1535 125.0408 52.2468 39.0242 175.6320 20 V 3.5182 8.0328 128.4998 65.6143 31.5618 177.2748 21 D 4.3258 8.0875 118.4265 57.4728 40.7746 178.4676 22 E 3.9435 8.4171 118.8042 59.4559 29.5117 179.6366 23 V 3.5742 7.9022 118.5020 65.6260 31.4502 178.2942 24 G 3.6815 8.3282 105.8335 47.8190 0.0000 175.9754 25 G 3.5834 7.7626 108.9336 47.3157 0.0000 175.4539 26 E 3.9189 8.2044 121.7254 58.7167 29.6466 178.7684 27 A 3.9159 8.1238 120.9499 55.2028 18.5889 179.4468 28 L 4.0057 7.7795 118.7037 58.1202 42.1507 179.4447 29 G 3.5486 8.1099 105.8566 47.7327 0.0000 175.9840 30 R 3.8872 8.2226 120.8629 58.7022 30.0598 178.6228 31 L 4.0310 7.9863 120.1366 58.5500 41.9451 179.3040 32 L 4.0390 7.9552 117.9136 57.0808 41.2079 179.0364 33 A 4.1358 7.3516 119.4183 54.1570 19.3531 179.3010 34 V 3.4490 7.7658 116.2161 64.6954 33.0750 176.2478 35 Y 3.7923 6.9818 117.0502 54.0935 37.4484 174.0305 36 P 4.4504 0.0000 0.0000 64.8784 31.2472 178.1960 37 W 4.4323 7.9908 115.3543 58.7657 27.7938 177.6050 38 T 4.2413 7.7922 110.8037 63.7007 68.3363 175.9125 39 Q 4.4172 8.1441 121.4287 57.7925 28.5628 177.8665 40 R 3.7663 7.3675 117.1838 58.4766 29.2531 177.7278 41 F 4.3639 6.9405 115.0334 56.9775 40.4645 175.4494 42 F 4.6265 7.6064 117.4418 56.5194 39.3366 176.5159 43 E 4.1848 7.9734 122.4193 59.1831 30.1017 179.6794 44 S 4.4910 8.0664 111.2567 59.9881 63.3859 175.0485 45 F 4.5335 7.9735 118.8547 59.0571 39.8962 175.3894 46 G 4.0438 7.2985 105.4040 44.4616 0.0000 175.0010 47 D 4.6925 8.7857 127.1752 53.4053 41.1603 175.8689 48 L 4.9275 8.2104 128.0702 54.6714 42.9368 178.3396 49 S 4.3330 8.2928 117.5487 61.0583 63.1771 175.2991 50 T 4.7318 7.4365 109.2909 58.1998 72.8602 172.5712 51 P 4.1852 0.0000 0.0000 66.1167 31.4062 178.2979 52 D 4.3672 8.2289 116.6168 57.7528 40.5565 179.0768 53 A 4.0574 8.1653 119.6254 54.6759 18.4126 179.7091 54 V 3.7307 7.9145 117.2702 66.5194 31.5894 178.2642 55 M 4.1343 8.5737 117.3802 58.1213 31.7881 178.5045 56 G 3.9297 7.9463 104.9039 45.4951 0.0000 173.3275 57 N 4.3304 7.5396 120.5923 53.0621 39.2654 173.6144 58 P 4.2821 0.0000 0.0000 65.8933 31.4053 178.5471 59 K 3.6854 8.2250 118.3528 58.9625 31.7187 179.5212 60 V 3.7340 7.7924 118.0608 66.0936 31.5867 178.1149 61 K 3.9203 8.0873 118.0372 59.4228 31.3463 179.2215 62 A 4.0475 8.1054 121.0983 55.1462 18.3338 179.1973 63 H 4.3916 8.2444 117.0622 59.2195 29.9838 177.6813 64 G 3.6323 8.3744 107.9181 47.7181 0.0000 175.6058 65 K 4.0523 7.9552 121.5983 58.8923 32.2714 178.9998 66 K 3.9988 7.8041 119.5418 59.2942 32.1686 179.0811 67 V 3.6024 7.8209 118.4483 66.2185 31.5299 178.1721 68 L 4.3720 8.2085 118.5253 57.5112 41.4187 179.1789 69 G 3.8369 8.1547 105.6360 48.0041 0.0000 175.3160 70 A 4.1557 8.0975 123.5826 54.4184 18.7638 179.3325 71 F 4.2882 8.4706 118.9983 61.6370 39.4691 176.9907 72 S 4.2452 9.1422 113.3023 62.0637 62.0419 176.1181 73 D 4.5630 8.3552 120.9798 56.9584 40.5328 178.8509 74 G 3.5090 8.1242 106.2723 47.0184 0.0000 175.0680 75 L 3.9923 7.1997 118.7281 55.6538 41.7019 177.6940 76 A 4.5991 7.4200 119.8353 51.8666 20.1534 176.1793 77 H 4.8253 8.0559 115.5882 54.7938 29.9697 175.1767 78 L 3.8826 8.0777 121.8654 57.3780 42.1581 176.6821 79 D 4.7757 7.5231 115.9967 54.0013 41.7964 176.3212 80 N 4.6502 7.8268 114.0940 52.2069 41.3463 175.0127 81 L 4.0365 7.5154 122.6595 57.1352 41.9487 178.7135 82 K 3.9806 8.1273 119.5268 59.7731 31.9264 178.9453 83 G 3.6531 7.9603 104.1703 48.0288 0.0000 175.4693 84 T 3.8229 7.4050 116.7956 65.4515 68.5651 176.0079 85 F 4.8124 8.1315 117.7451 57.0774 39.2210 177.2964 86 A 4.0719 7.5568 121.7107 56.0818 18.1753 180.7491 87 T 3.8968 7.8508 113.2879 66.5580 68.5710 176.6946 88 L 4.1215 7.9479 121.9871 57.8398 42.2611 178.8475 89 S 4.4111 8.3821 115.1245 60.9139 62.3411 175.9104 90 E 3.8798 8.2010 121.3157 59.2397 29.2136 178.9827 91 L 3.9033 7.8608 120.2638 58.7442 42.1540 178.9006 92 H 4.2131 8.2629 115.9512 59.1855 28.1392 176.8261 93 C 3.6091 7.6442 120.4952 62.0522 31.1143 175.2751 94 D 4.3985 8.4666 122.1832 56.0974 40.6256 177.3693 95 K 4.3317 7.7895 116.8946 57.6996 33.7728 177.4699 96 L 4.1681 7.7524 116.0175 55.0485 42.4780 176.2103 97 H 4.1762 7.2414 113.3168 56.6570 26.5206 175.1128 98 V 3.8348 7.8462 118.0932 61.0927 32.7636 174.7590 99 D 4.3844 8.6161 127.1670 53.4269 41.8870 175.0123 100 P 3.2625 0.0000 0.0000 64.7983 31.7790 177.9709 101 E 3.8861 8.2069 118.9728 59.0806 29.2914 178.3017 102 N 4.2589 7.9548 116.7545 56.3094 38.4884 177.2648 103 F 4.4806 7.3287 118.9570 60.5798 39.0607 177.9240 104 R 4.0385 7.7958 117.3647 58.8526 29.9963 178.7591 105 L 3.7650 7.8162 118.8893 57.6137 41.5245 179.2121 106 L 4.0346 8.1385 120.4431 58.0923 42.0403 178.9523 107 G 3.8730 8.0374 105.6172 48.2511 0.0000 175.3202 108 N 4.4456 8.0894 118.7466 55.7911 38.4554 177.7413 109 V 3.6041 7.9661 119.7772 65.8179 31.5645 177.4311 110 L 3.8419 8.6347 121.3006 58.5453 41.8443 179.1304 111 V 3.5562 7.8656 117.6674 66.3912 31.4040 177.8030 112 C 4.1800 7.9649 116.1204 62.5682 27.8729 176.2596 113 V 3.5713 8.0640 120.2781 65.9604 31.0699 178.0304 114 L 3.8066 7.9242 118.7724 57.6840 41.3570 179.4468 115 A 3.7022 7.3622 120.5478 55.1058 18.0728 178.9501 116 H 4.0656 7.9680 115.7764 59.9222 29.9748 176.9486 117 H 3.9579 8.1527 116.3497 58.4014 28.9573 177.0939 118 F 4.6174 8.4962 117.5115 55.3442 39.5357 178.4111 119 G 3.8924 8.8570 109.0877 45.6446 0.0000 175.2621 120 K 3.9312 9.2944 121.9765 59.7578 31.9877 177.1496 121 E 4.0525 8.2648 119.4282 58.2837 29.7648 177.1411 122 F 4.5430 8.0985 122.6622 57.0386 37.9740 175.4731 123 T 4.2606 7.4076 115.5445 59.8087 71.5410 173.5760 124 P 4.1409 0.0000 0.0000 65.7685 31.2289 177.1974 125 P 4.2248 0.0000 0.0000 65.3642 31.2977 178.9123 126 V 3.5789 7.3110 117.4282 65.7029 31.4436 177.8235 127 Q 3.5265 8.0571 119.4778 58.8709 28.7305 177.9944 128 A 3.9630 8.0389 121.5360 55.4393 18.5264 179.5844 129 A 3.9364 7.7668 119.0885 55.4554 18.3843 179.5112 130 Y 3.9126 8.0368 115.2908 61.1465 37.9616 178.4529 131 Q 4.2180 8.8334 119.6347 58.9167 28.7691 178.9286 132 K 4.0475 7.9671 119.4282 59.1266 31.9511 179.7501 133 V 3.4913 7.5999 118.4243 66.0874 31.4567 178.5128 134 V 3.6929 8.3997 112.4099 64.3652 31.2902 178.4771 135 A 4.0860 8.1354 120.5650 55.0557 18.2084 179.7468 136 G 3.5925 8.1670 104.3167 47.9882 0.0000 175.8695 137 V 3.3910 8.5203 121.4069 65.5925 31.6789 177.8467 138 A 3.9142 8.1216 120.4947 55.2901 18.0651 179.3854 139 N 4.2957 8.4715 114.9086 56.2892 38.4009 177.4657 140 A 4.0193 7.9037 121.0895 55.3776 18.5743 179.5216 141 L 3.9138 8.0385 117.3128 57.2683 41.6551 178.8703 142 A 4.4232 7.8601 119.0153 52.9760 18.8174 178.4071 143 H 4.1221 7.8823 117.1686 59.2011 29.8881 176.0158 144 K 4.3497 8.2351 115.3080 56.4903 32.1774 176.6451 145 Y 4.1538 7.9908 117.8215 58.3934 38.4184 175.7161 146 H 4.4588 8.3280 117.7534 56.1509 28.3134 173.2563 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 8.30 4.38 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 2 H 8.42 4.71 0.00 3.14 3.22 0.00 5.71 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 8.00 4.73 0.00 1.57 1.46 0.80 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.21 4.14 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 1.27 0.00 0.00 5 P 0.00 3.90 0.00 2.23 2.31 0.00 3.65 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 6 E 8.04 3.97 0.00 2.05 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 2.38 2.44 0.00 7 E 7.90 3.96 0.00 2.16 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 2.35 2.34 0.00 8 K 8.86 3.88 0.00 1.85 1.79 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.46 7.81 9 S 8.18 4.14 0.00 4.05 4.32 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 10 A 7.77 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.60 3.42 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 0.54 0.00 0.00 0.57 0.00 0.00 12 T 7.94 3.94 4.52 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 1.29 0.00 0.00 13 A 8.03 4.12 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.88 4.01 0.00 1.84 2.06 0.43 0.06 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 15 W 8.69 4.42 0.00 3.80 3.36 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 16 G 7.84 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 17 K 7.77 4.41 0.00 2.08 2.18 0.00 1.97 0.00 0.00 1.76 0.00 0.00 3.18 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.48 7.81 18 V 7.17 3.94 1.24 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 -0.11 0.00 0.00 0.80 0.00 0.00 19 N 8.15 4.55 0.00 2.70 2.61 0.00 0.00 6.83 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 20 V 8.03 3.52 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 1.25 0.00 0.00 0.87 0.00 0.00 21 D 8.09 4.33 0.00 3.01 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 22 E 8.42 3.94 0.00 1.96 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 2.29 2.40 0.00 23 V 7.90 3.57 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 0.97 0.00 0.00 0.67 0.00 0.00 24 G 8.33 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 0.00 0.00 0.00 25 G 7.76 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.20 3.92 0.00 2.28 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 2.32 0.00 27 A 8.12 3.92 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 28 L 7.78 4.01 0.00 1.72 1.63 0.93 1.44 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 29 G 8.11 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 30 R 8.22 3.89 0.00 1.90 1.95 0.00 3.11 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 31 L 7.99 4.03 0.00 1.91 1.91 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.96 4.04 0.00 1.85 1.71 0.79 0.96 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 33 A 7.35 4.14 1.22 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 0.00 0.00 34 V 7.77 3.45 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.80 0.00 0.00 35 Y 6.98 3.79 0.00 2.46 1.43 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 36 P 0.00 4.45 0.00 2.36 2.36 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.93 0.00 37 W 7.99 4.43 0.00 3.57 3.50 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 38 T 7.79 4.24 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 39 Q 8.14 4.42 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.48 0.00 40 R 7.37 3.77 0.00 1.56 1.82 0.00 2.90 0.00 0.00 2.45 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 41 F 6.94 4.36 0.00 1.58 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.61 4.63 0.00 2.83 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 0.00 0.00 0.00 43 E 7.97 4.18 0.00 2.02 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 2.34 2.21 0.00 44 S 8.07 4.49 0.00 4.11 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 45 F 7.97 4.53 0.00 3.20 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 46 G 7.30 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 0.00 0.00 0.00 47 D 8.79 4.69 0.00 2.67 2.63 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 0.00 0.00 0.00 48 L 8.21 4.93 0.00 1.65 1.62 1.05 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.29 4.33 0.00 3.93 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 50 T 7.44 4.73 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 51 P 0.00 4.19 0.00 2.15 2.12 0.00 3.61 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 52 D 8.23 4.37 0.00 2.67 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 53 A 8.17 4.06 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 54 V 7.91 3.73 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 1.07 0.00 0.00 0.96 0.00 0.00 55 M 8.57 4.13 0.00 1.96 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 2.61 2.92 0.00 56 G 7.95 3.93 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 0.00 0.00 0.00 57 N 7.54 4.33 0.00 2.91 2.93 0.00 0.00 6.82 7.60 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 58 P 0.00 4.28 0.00 2.25 2.26 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.03 0.00 59 K 8.22 3.69 0.00 1.80 0.74 0.00 1.42 0.00 0.00 0.83 0.00 0.00 2.78 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.02 1.22 7.81 60 V 7.79 3.73 2.31 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 1.13 0.00 0.00 1.06 0.00 0.00 61 K 8.09 3.92 0.00 1.83 1.82 0.00 1.82 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.44 7.81 62 A 8.11 4.05 1.34 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 0.00 0.00 63 H 8.24 4.39 0.00 3.56 3.58 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.37 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 65 K 7.96 4.05 0.00 1.95 1.82 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.44 7.81 66 K 7.80 4.00 0.00 2.06 1.97 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 7.82 3.60 2.12 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 1.00 0.00 0.00 0.88 0.00 0.00 68 L 8.21 4.37 0.00 1.94 1.88 1.15 0.65 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 69 G 8.15 3.84 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 0.00 0.00 0.00 70 A 8.10 4.16 1.54 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 0.00 0.00 71 F 8.47 4.29 0.00 3.28 3.21 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 0.00 72 S 9.14 4.25 0.00 4.59 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 0.00 73 D 8.36 4.56 0.00 2.76 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 74 G 8.12 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 75 L 7.20 3.99 0.00 1.52 1.42 -0.37 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.42 4.60 1.24 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 77 H 8.06 4.83 0.00 3.03 3.13 0.00 5.83 0.00 0.00 0.00 0.00 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.08 3.88 0.00 1.47 1.61 0.72 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.52 4.78 0.00 2.64 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 80 N 7.83 4.65 0.00 2.68 2.59 0.00 0.00 7.22 6.50 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 81 L 7.52 4.04 0.00 1.78 1.88 0.88 0.87 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 82 K 8.13 3.98 0.00 1.82 1.76 0.00 1.52 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.22 1.41 7.81 83 G 7.96 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 84 T 7.40 3.82 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 0.45 0.00 0.00 85 F 8.13 4.81 0.00 3.17 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 86 A 7.56 4.07 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.85 3.90 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 88 L 7.95 4.12 0.00 1.90 1.99 1.05 1.11 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 89 S 8.38 4.41 0.00 4.10 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 90 E 8.20 3.88 0.00 2.17 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 2.33 2.54 0.00 91 L 7.86 3.90 0.00 1.87 1.89 0.90 1.11 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 92 H 8.26 4.21 0.00 3.61 3.79 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.64 3.61 0.00 1.62 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 94 D 8.47 4.40 0.00 2.72 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 95 K 7.79 4.33 0.00 1.88 1.78 0.00 1.54 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.39 7.81 96 L 7.75 4.17 0.00 1.73 1.64 0.72 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.24 4.18 0.00 3.46 3.43 0.00 5.64 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.85 3.83 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 0.14 0.00 0.00 0.53 0.00 0.00 99 D 8.62 4.38 0.00 2.80 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 0.00 100 P 0.00 3.26 0.00 1.92 1.80 0.00 3.35 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.44 0.00 101 E 8.21 3.89 0.00 2.09 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 2.31 2.38 0.00 102 N 7.95 4.26 0.00 2.49 2.67 0.00 0.00 6.91 7.75 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 0.00 103 F 7.33 4.48 0.00 3.11 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 0.00 104 R 7.80 4.04 0.00 2.01 1.96 0.00 3.23 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 105 L 7.82 3.76 0.00 1.69 1.27 0.63 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.14 4.03 0.00 1.79 1.72 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.04 3.87 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 0.00 0.00 0.00 108 N 8.09 4.45 0.00 2.97 2.94 0.00 0.00 6.71 7.04 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 0.00 109 V 7.97 3.60 2.24 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 1.16 0.00 0.00 1.14 0.00 0.00 110 L 8.63 3.84 0.00 1.71 1.88 0.86 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.87 3.56 2.32 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 1.28 0.00 0.00 1.18 0.00 0.00 112 C 7.96 4.18 0.00 3.22 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 0.00 113 V 8.06 3.57 2.12 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 1.04 0.00 0.00 0.95 0.00 0.00 114 L 7.92 3.81 0.00 0.96 0.92 0.66 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.36 3.70 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 0.00 116 H 7.97 4.07 0.00 3.22 3.59 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.15 3.96 0.00 2.89 2.71 0.00 5.69 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.50 4.62 0.00 3.29 3.14 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 0.00 0.00 0.00 0.00 119 G 8.86 3.89 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 0.00 0.00 0.00 120 K 9.29 3.93 0.00 1.92 2.05 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.55 7.81 121 E 8.26 4.05 0.00 2.36 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 0.00 2.34 2.33 0.00 122 F 8.10 4.54 0.00 3.06 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 0.00 123 T 7.41 4.26 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 1.31 0.00 0.00 124 P 0.00 4.14 0.00 2.15 2.15 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.22 0.00 2.11 2.06 0.00 3.46 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 2.08 2.11 0.00 126 V 7.31 3.58 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 0.96 0.00 0.00 0.90 0.00 0.00 127 Q 8.06 3.53 0.00 1.60 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 128 A 8.04 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.77 3.94 1.22 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 0.00 0.00 130 Y 8.04 3.91 0.00 3.45 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 0.00 131 Q 8.83 4.22 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.78 2.61 0.00 132 K 7.97 4.05 0.00 1.89 1.83 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.46 1.62 7.81 133 V 7.60 3.49 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 0.82 0.00 0.00 0.76 0.00 0.00 134 V 8.40 3.69 2.18 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 0.99 0.00 0.00 1.12 0.00 0.00 135 A 8.14 4.09 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 0.00 136 G 8.17 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 0.00 137 V 8.52 3.39 2.21 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 0.77 0.00 0.00 0.70 0.00 0.00 138 A 8.12 3.91 1.43 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 0.00 0.00 139 N 8.47 4.30 0.00 2.86 2.89 0.00 0.00 6.92 8.10 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 0.00 140 A 7.90 4.02 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 0.00 141 L 8.04 3.91 0.00 1.28 0.78 -0.10 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.86 4.42 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 0.00 143 H 7.88 4.12 0.00 3.25 3.65 0.00 5.75 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.24 4.35 0.00 1.82 1.82 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.79 7.81 145 Y 7.99 4.15 0.00 3.13 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 0.00 146 H 8.33 4.46 0.00 3.22 3.23 0.00 5.75 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