NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0087 8.0544 120.3818 63.0192 32.7619 176.7257 2 H 4.8101 9.0908 112.0952 54.4034 29.9617 170.6585 3 L 4.5958 8.1658 120.5763 53.8084 44.5287 177.6208 4 T 4.0939 8.4106 120.2198 62.3229 70.4497 174.0695 5 P 4.1534 0.0000 0.0000 66.6573 31.0570 178.5788 6 E 3.9633 8.0513 117.4464 59.1767 29.3465 179.0258 7 E 4.0090 7.9474 118.1029 58.9332 29.5901 179.4189 8 K 3.8776 8.5247 119.2010 59.4873 32.0703 179.3296 9 S 4.0690 8.1370 113.1826 61.2272 61.9375 175.9672 10 A 4.0034 7.8669 123.1144 55.1204 18.0195 179.7381 11 V 3.5142 7.5123 116.7671 66.3438 31.4555 177.9927 12 T 3.9379 7.8099 115.1362 67.0859 68.2149 176.3952 13 A 4.0777 8.1977 121.0797 54.9053 18.6883 179.1521 14 L 3.9508 7.9071 118.7701 57.8307 42.2051 178.7232 15 W 4.3691 8.9364 128.9898 60.6686 30.4370 178.0919 16 G 4.0743 7.9230 104.2214 47.1892 0.0000 174.6594 17 K 4.4041 7.7663 118.1476 55.5317 32.8340 176.5968 18 V 3.7539 7.3752 120.8194 61.8500 32.3100 175.7527 19 N 4.5157 8.2343 125.4502 52.2792 38.8438 175.3242 20 V 3.5163 8.1006 128.4615 65.9473 31.4750 177.0298 21 D 4.3502 8.1327 118.0617 57.5757 40.7590 178.6201 22 E 3.9027 8.4154 118.5418 59.4772 29.5247 179.6388 23 V 3.5832 7.7215 118.3975 65.8999 31.5753 178.2947 24 G 3.6956 8.3966 105.8502 47.7780 0.0000 175.9992 25 G 3.5953 7.8802 108.3472 47.3487 0.0000 175.5604 26 E 3.9078 8.3559 121.4762 58.7663 29.7110 178.5588 27 A 3.9288 8.2760 121.2676 55.2655 18.5805 179.3991 28 L 3.9892 7.9083 118.3564 58.0905 42.1625 179.2802 29 G 3.5248 8.0383 105.6899 47.9468 0.0000 175.9449 30 R 3.8905 8.3102 121.4220 58.5603 29.9988 178.8404 31 L 3.9978 7.9614 120.1351 58.3850 41.9914 179.2353 32 L 4.0268 7.7799 117.9972 57.0299 41.1832 179.5445 33 V 3.6869 7.0455 117.1797 65.4526 31.9024 177.9164 34 V 3.4625 7.6885 116.8926 64.4520 32.7620 175.7240 35 Y 3.7726 6.9328 116.5620 53.8830 37.7090 173.8612 36 P 4.4513 0.0000 0.0000 64.9900 31.3301 178.2520 37 W 4.4218 7.9836 115.2412 58.8212 28.0029 177.8750 38 T 4.2020 7.8538 111.2662 64.2434 68.3615 175.9044 39 Q 4.4342 8.1362 121.0390 57.6144 28.4607 178.0526 40 R 3.8330 7.5199 116.8669 58.3653 29.3661 177.7469 41 F 4.3673 7.1113 116.4584 56.9811 39.7628 175.6772 42 F 4.5179 7.2884 118.0045 56.6796 39.2546 177.3355 43 E 4.0534 8.1156 122.5821 59.4814 29.8149 179.5805 44 S 4.5627 8.0582 110.6508 59.7386 63.4243 174.9965 45 F 4.5702 8.0308 119.8432 59.8697 39.9420 175.0486 46 G 4.0620 6.9987 104.3386 44.4975 0.0000 175.8211 47 D 4.6153 8.8174 129.0623 53.4912 39.7799 175.2682 48 L 4.8630 8.3041 125.1762 54.5000 43.0783 178.8927 49 S 4.4146 8.0663 118.0212 61.1651 63.0825 175.0729 50 T 4.7383 7.3683 109.7451 58.1733 73.0326 172.8222 51 P 4.1791 0.0000 0.0000 66.1253 31.3940 178.4214 52 D 4.3391 8.1743 116.5860 57.6530 40.5543 178.9144 53 A 4.0459 8.0370 119.9745 54.7532 18.5815 179.7505 54 V 3.6909 8.1039 117.4221 66.5567 31.5661 178.0688 55 M 4.1209 8.4058 117.5569 58.4997 31.8466 178.6855 56 G 3.8621 7.9107 104.7660 45.7714 0.0000 173.6300 57 N 4.3323 7.7173 120.8063 53.1641 39.2913 173.7692 58 P 4.3542 0.0000 0.0000 65.5092 31.6699 178.5928 59 K 3.7534 8.1839 118.8356 58.8717 31.7600 179.5235 60 V 3.7328 7.6947 118.2231 66.0159 31.8079 178.0564 61 K 3.9194 8.0097 118.0439 59.5489 31.5585 179.2728 62 A 4.0539 8.0352 120.9794 55.1577 18.2175 179.2173 63 H 4.3676 8.2728 116.8845 59.2110 29.8831 177.6417 64 G 4.1020 8.2446 109.1101 47.2865 0.0000 175.6069 65 K 4.0033 8.0174 121.5938 58.7635 32.1846 178.9531 66 K 4.0212 7.7278 119.9947 59.1674 32.1108 179.0679 67 V 3.5969 7.9485 118.6329 66.2188 31.4931 178.1836 68 L 4.3214 8.3570 118.8859 57.4342 41.3430 179.6284 69 G 3.8843 8.2001 105.6732 48.0116 0.0000 175.5831 70 A 4.1399 7.9486 122.9956 54.3756 18.7240 179.2308 71 F 4.3255 8.5706 119.2681 61.5616 39.4323 176.9802 72 S 4.2828 9.2254 113.6615 62.0379 61.7931 176.1420 73 D 4.5093 8.5402 121.1687 57.1018 40.4923 178.9768 74 G 3.4997 8.0888 106.3868 47.2389 0.0000 175.2865 75 L 3.9389 7.2702 119.2585 56.0485 41.6585 177.9841 76 A 4.4231 7.3711 119.2277 52.3552 19.9453 176.5149 77 H 4.8342 7.9932 115.3477 54.8774 29.8421 175.1586 78 L 4.0367 8.0937 121.6463 57.3442 42.1677 176.6187 79 D 4.6850 7.7051 115.8710 54.7538 42.0994 176.3541 80 N 4.8632 8.0769 116.5208 51.8885 40.7411 174.9376 81 L 4.0510 7.6986 122.5006 57.4206 42.4183 178.9144 82 K 3.9734 8.1374 119.4793 59.8283 31.9424 178.9786 83 G 3.7115 8.1983 104.3228 47.7523 0.0000 175.4980 84 T 3.8123 7.5954 117.4999 65.4957 68.5557 175.8723 85 F 4.8432 8.1315 117.7363 57.0394 39.4171 177.2964 86 A 4.0656 7.6048 122.0974 56.0019 18.1699 180.8526 87 T 3.8982 7.8608 113.5292 66.5727 68.5746 176.7200 88 L 4.0945 7.9632 122.0210 57.9647 42.0916 178.7580 89 S 4.4926 8.4659 115.0180 61.0593 62.3122 176.0857 90 E 3.9040 8.3249 121.2786 59.1489 29.1331 179.0605 91 L 3.9095 7.9675 120.4530 58.6034 42.0992 178.8465 92 H 4.2693 8.3488 116.1413 59.3667 28.0897 176.6708 93 C 3.6384 7.6283 121.1926 61.9444 31.0491 175.2399 94 D 4.3524 8.4958 122.7868 56.2503 40.6904 177.4387 95 K 4.3423 7.6083 116.4931 57.5833 33.9898 177.2531 96 L 4.1680 8.1483 117.1366 55.0595 42.2880 176.3002 97 H 4.1820 7.2463 113.7758 56.6602 26.5469 175.0956 98 V 3.8904 7.9947 118.4586 61.1343 32.7168 174.7434 99 D 4.4075 8.6267 127.2064 53.3872 41.8390 175.0671 100 P 3.1989 0.0000 0.0000 64.8276 31.7660 177.9812 101 E 3.8984 8.1223 118.8013 59.1729 29.2435 178.4144 102 N 4.2556 7.9433 116.6715 56.2495 38.5531 177.2385 103 F 4.4801 7.4594 119.2133 60.6038 38.9504 178.0018 104 R 3.9638 7.8047 117.2805 59.0939 29.9389 178.7430 105 L 3.7928 7.9382 118.8297 57.7029 41.4965 179.3404 106 L 4.0462 8.2053 120.4069 58.0088 41.9847 178.9034 107 G 4.0367 7.9964 105.5579 48.2367 0.0000 175.3099 108 N 4.4044 8.2135 119.2938 55.7336 38.4861 177.6054 109 V 3.5912 8.1031 119.9430 65.9462 31.5909 177.4657 110 L 3.8528 8.7369 121.1757 58.5197 41.9710 179.1925 111 V 3.6004 7.9895 117.8189 66.2814 31.4244 177.7946 112 C 4.1739 8.0534 116.5732 62.5876 27.8902 176.2025 113 V 3.5933 7.9968 120.1266 65.9867 31.0512 178.0427 114 L 3.8641 7.8352 118.5121 57.6560 41.4381 179.4579 115 A 3.6866 7.2082 120.2456 55.1213 18.0851 178.9765 116 H 4.0903 7.9378 115.7016 59.8489 29.9634 176.9794 117 H 3.9719 8.1189 116.4070 58.4543 28.9178 177.0780 118 F 4.6231 8.3847 117.4229 55.3293 39.4996 178.9438 119 G 3.8307 8.7801 108.4050 45.5571 0.0000 175.6946 120 K 3.9160 9.4447 122.8788 59.8320 32.1500 177.3986 121 E 4.0449 8.3377 119.6116 58.3547 29.9707 177.3124 122 F 4.4874 8.0640 122.7680 56.9904 37.8683 175.2515 123 T 4.1881 7.2976 115.4452 60.2319 71.3228 173.5338 124 P 4.1675 0.0000 0.0000 65.6772 31.2105 177.2481 125 P 4.1918 0.0000 0.0000 65.3404 31.2314 178.9410 126 V 3.5474 7.4660 117.0173 65.7595 31.3586 177.8335 127 Q 3.5762 8.3354 119.8646 58.9450 28.9470 177.9005 128 A 3.9807 8.1978 121.8478 55.4548 18.4595 179.5579 129 A 3.9239 7.7734 119.0533 55.5249 18.3723 179.5361 130 Y 3.9076 8.1345 115.2967 61.0753 37.9084 178.5365 131 Q 4.1424 8.6745 119.7391 58.9391 28.7778 178.9004 132 K 4.0489 7.9234 119.1305 59.0852 32.0169 179.7427 133 V 3.4707 7.5331 118.1889 66.1152 31.4803 178.4565 134 V 3.8023 8.2903 112.3610 64.3996 31.3099 178.4650 135 A 4.0834 8.1255 120.5461 55.0704 18.2852 179.7274 136 G 3.6025 8.1608 104.2962 48.0563 0.0000 175.9727 137 V 3.3735 8.3166 121.0773 65.4589 31.6624 177.8242 138 A 3.8784 8.1045 120.5908 55.2783 18.0570 179.3722 139 N 4.2766 8.4672 114.9360 56.3760 38.4087 177.4910 140 A 4.0278 7.7855 120.9079 55.3079 18.6682 179.4887 141 L 3.9086 7.9982 117.3990 57.4913 41.5829 179.2566 142 A 4.0997 8.0183 120.0021 54.0634 18.3046 178.7022 143 H 4.0692 7.6777 117.2063 59.4504 29.8361 175.9377 144 K 4.4236 8.3747 115.7011 56.3354 31.9351 176.4452 145 Y 4.1378 8.0031 117.7899 58.4020 38.4028 175.7016 146 H 4.4409 8.3438 117.8230 56.1847 28.2283 173.3043 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 V 8.05 4.01 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 0.94 0.00 0.00 0.91 0.00 0.00 2 H 9.09 4.81 0.00 3.15 3.16 0.00 5.77 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 3 L 8.17 4.60 0.00 1.58 1.47 0.83 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.41 4.09 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 1.24 0.00 0.00 5 P 0.00 4.15 0.00 2.23 2.32 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 2.06 2.07 0.00 6 E 8.05 3.96 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 7.95 4.01 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 8.52 3.88 0.00 1.93 1.80 0.00 1.65 0.00 0.00 1.52 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.40 7.81 9 S 8.14 4.07 0.00 3.89 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 10 A 7.87 4.00 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 11 V 7.51 3.51 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 0.58 0.00 0.00 0.55 0.00 0.00 12 T 7.81 3.94 4.51 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 1.29 0.00 0.00 13 A 8.20 4.08 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 14 L 7.91 3.95 0.00 1.84 2.05 0.36 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.94 4.37 0.00 3.79 3.38 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 16 G 7.92 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 17 K 7.77 4.40 0.00 2.16 2.18 0.00 2.03 0.00 0.00 1.79 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.66 7.81 18 V 7.38 3.75 1.09 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 -0.05 0.00 0.00 0.66 0.00 0.00 19 N 8.23 4.52 0.00 2.70 2.60 0.00 0.00 6.84 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 8.10 3.52 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 1.18 0.00 0.00 0.90 0.00 0.00 21 D 8.13 4.35 0.00 3.05 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 3.90 0.00 1.95 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 2.29 2.44 0.00 23 V 7.72 3.58 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 0.98 0.00 0.00 0.63 0.00 0.00 24 G 8.40 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 0.00 0.00 0.00 25 G 7.88 3.60 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 0.00 0.00 0.00 26 E 8.36 3.91 0.00 2.23 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 2.28 2.31 0.00 27 A 8.28 3.93 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 28 L 7.91 3.99 0.00 1.74 1.63 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.04 3.52 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 0.00 0.00 0.00 0.00 30 R 8.31 3.89 0.00 1.90 1.93 0.00 3.20 0.00 0.00 3.03 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 31 L 7.96 4.00 0.00 1.91 1.86 1.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.78 4.03 0.00 1.85 1.68 0.71 0.95 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 33 V 7.05 3.69 2.16 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 0.72 0.00 0.00 0.90 0.00 0.00 34 V 7.69 3.46 1.32 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 0.08 0.00 0.00 0.76 0.00 0.00 35 Y 6.93 3.77 0.00 2.51 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 2.35 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.94 0.00 37 W 7.98 4.42 0.00 3.58 3.52 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 0.00 38 T 7.85 4.20 4.43 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 1.09 0.00 0.00 39 Q 8.14 4.43 0.00 2.24 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 40 R 7.52 3.83 0.00 1.57 1.90 0.00 2.96 0.00 0.00 2.58 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 7.11 4.37 0.00 1.53 2.51 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 42 F 7.29 4.52 0.00 2.96 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 0.00 0.00 0.00 43 E 8.12 4.05 0.00 2.01 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 2.33 2.20 0.00 44 S 8.06 4.56 0.00 4.11 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 0.00 45 F 8.03 4.57 0.00 3.20 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 46 G 7.00 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 47 D 8.82 4.62 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 8.30 4.86 0.00 1.73 1.61 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.07 4.41 0.00 3.87 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 7.37 4.74 4.33 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 1.21 0.00 0.00 51 P 0.00 4.18 0.00 2.15 2.12 0.00 3.60 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 2.16 0.00 52 D 8.17 4.34 0.00 2.67 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 53 A 8.04 4.05 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 54 V 8.10 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 1.06 0.00 0.00 0.95 0.00 0.00 55 M 8.41 4.12 0.00 1.94 2.11 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 7.91 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 0.00 0.00 0.00 57 N 7.72 4.33 0.00 2.99 2.92 0.00 0.00 6.85 7.74 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 58 P 0.00 4.35 0.00 2.25 2.26 0.00 3.73 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 59 K 8.18 3.75 0.00 1.86 0.87 0.00 1.53 0.00 0.00 1.13 0.00 0.00 2.79 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.01 1.22 7.81 60 V 7.69 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 1.05 0.00 0.00 1.09 0.00 0.00 61 K 8.01 3.92 0.00 1.88 1.82 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.17 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.49 7.81 62 A 8.04 4.05 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 63 H 8.27 4.37 0.00 3.59 3.49 0.00 5.80 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 8.24 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 0.00 0.00 0.00 0.00 65 K 8.02 4.00 0.00 1.88 1.83 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.47 1.57 7.81 66 K 7.73 4.02 0.00 1.91 1.98 0.00 1.77 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.50 7.81 67 V 7.95 3.60 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 1.01 0.00 0.00 0.90 0.00 0.00 68 L 8.36 4.32 0.00 1.96 1.87 1.24 1.02 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 69 G 8.20 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 70 A 7.95 4.14 1.50 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 71 F 8.57 4.33 0.00 3.22 3.35 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 72 S 9.23 4.28 0.00 4.58 4.34 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 73 D 8.54 4.51 0.00 2.86 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 8.09 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 0.00 0.00 0.00 75 L 7.27 3.94 0.00 1.44 1.44 -0.40 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.37 4.42 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 7.99 4.83 0.00 3.05 3.14 0.00 5.82 0.00 0.00 0.00 0.00 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.09 4.04 0.00 1.47 1.61 0.74 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.71 4.69 0.00 2.66 2.65 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 80 N 8.08 4.86 0.00 2.68 2.61 0.00 0.00 7.15 6.39 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 81 L 7.70 4.05 0.00 1.78 1.90 0.86 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.14 3.97 0.00 1.81 1.75 0.00 1.54 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.22 1.35 7.81 83 G 8.20 3.71 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 0.00 0.00 0.00 84 T 7.60 3.81 3.81 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 0.41 0.00 0.00 85 F 8.13 4.84 0.00 3.07 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 7.60 4.07 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 87 T 7.86 3.90 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 1.22 0.00 0.00 88 L 7.96 4.09 0.00 1.90 1.99 1.05 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.47 4.49 0.00 4.19 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 90 E 8.32 3.90 0.00 2.16 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 2.65 0.00 91 L 7.97 3.91 0.00 1.87 1.86 0.91 1.12 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 92 H 8.35 4.27 0.00 3.63 3.82 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 7.63 3.64 0.00 1.58 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.50 4.35 0.00 2.76 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 95 K 7.61 4.34 0.00 1.85 1.78 0.00 1.58 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.46 7.81 96 L 8.15 4.17 0.00 1.70 1.65 0.71 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.25 4.18 0.00 3.46 3.44 0.00 5.64 0.00 0.00 0.00 0.00 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.99 3.89 1.72 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 0.13 0.00 0.00 0.58 0.00 0.00 99 D 8.63 4.41 0.00 2.81 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 0.00 100 P 0.00 3.20 0.00 1.95 1.89 0.00 3.36 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.54 0.00 101 E 8.12 3.90 0.00 2.05 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 2.31 2.38 0.00 102 N 7.94 4.26 0.00 2.51 2.69 0.00 0.00 6.91 7.58 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 0.00 103 F 7.46 4.48 0.00 3.11 2.90 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 0.00 0.00 0.00 104 R 7.80 3.96 0.00 2.05 1.96 0.00 3.22 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 1.73 1.75 0.00 105 L 7.94 3.79 0.00 1.74 1.41 0.68 -0.21 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 8.21 4.05 0.00 1.80 1.72 0.93 1.21 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 8.00 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 0.00 108 N 8.21 4.40 0.00 2.94 2.95 0.00 0.00 6.73 7.42 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 0.00 109 V 8.10 3.59 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 1.14 0.00 0.00 1.15 0.00 0.00 110 L 8.74 3.85 0.00 1.67 1.90 0.87 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.99 3.60 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 1.24 0.00 0.00 1.16 0.00 0.00 112 C 8.05 4.17 0.00 3.21 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 8.00 3.59 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 1.10 0.00 0.00 0.96 0.00 0.00 114 L 7.84 3.86 0.00 1.09 0.89 0.72 0.70 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 0.00 115 A 7.21 3.69 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 0.00 116 H 7.94 4.09 0.00 3.20 3.55 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 8.12 3.97 0.00 3.20 2.70 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 8.38 4.62 0.00 3.25 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 0.00 119 G 8.78 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 0.00 0.00 0.00 120 K 9.44 3.92 0.00 1.93 2.05 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.53 7.81 121 E 8.34 4.04 0.00 2.33 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 0.00 2.38 2.34 0.00 122 F 8.06 4.49 0.00 3.09 3.17 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 0.00 123 T 7.30 4.19 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 4.17 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 2.11 2.20 0.00 125 P 0.00 4.19 0.00 2.11 2.06 0.00 3.46 0.00 0.00 3.66 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 7.47 3.55 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 0.95 0.00 0.00 0.89 0.00 0.00 127 Q 8.34 3.58 0.00 1.67 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 128 A 8.20 3.98 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 0.00 129 A 7.77 3.92 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 0.00 130 Y 8.13 3.91 0.00 3.22 3.25 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 0.00 131 Q 8.67 4.14 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.74 2.61 0.00 132 K 7.92 4.05 0.00 1.78 1.83 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.46 1.66 7.81 133 V 7.53 3.47 2.13 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 0.82 0.00 0.00 0.73 0.00 0.00 134 V 8.29 3.80 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 1.00 0.00 0.00 1.10 0.00 0.00 135 A 8.13 4.08 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 8.16 3.60 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 0.00 0.00 0.00 137 V 8.32 3.37 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 0.66 0.00 0.00 0.74 0.00 0.00 138 A 8.10 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.47 4.28 0.00 2.97 2.88 0.00 0.00 6.92 7.78 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 0.00 140 A 7.79 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 141 L 8.00 3.91 0.00 1.25 0.63 -0.10 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.02 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.68 4.07 0.00 3.24 3.69 0.00 5.75 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.37 4.42 0.00 1.79 1.80 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.78 7.81 145 Y 8.00 4.14 0.00 3.20 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 0.00 146 H 8.34 4.44 0.00 3.23 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