NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.5676 0.0000 0.0000 62.3820 32.9928 176.7365 6 T 4.0043 8.5999 113.1590 61.0020 70.6671 174.3819 7 I 3.8079 8.4741 123.0190 64.4690 37.6636 179.2284 8 N 4.4474 8.0531 117.6136 56.6483 38.9766 176.5648 9 Q 3.9951 7.5932 118.4056 59.2400 28.8456 179.1912 10 L 4.2979 8.6164 119.3903 56.7877 41.2789 179.4319 11 V 3.7557 8.0322 118.3508 65.4952 32.0094 177.6272 12 R 4.0527 7.9966 115.7928 58.5959 29.9498 178.0066 13 K 4.3600 8.5094 116.6592 55.7732 33.7114 177.5948 14 G 4.0849 7.1254 103.7336 45.0968 0.0000 172.9064 15 R 4.1661 8.1835 118.5609 54.8519 30.8582 176.2608 16 E 4.0854 8.6479 124.3074 55.4674 29.7004 176.1689 17 K 4.1371 8.4730 126.9077 55.7388 32.7757 177.2167 18 V 3.6721 8.3244 124.2396 62.8913 31.9601 175.1874 19 R 4.4049 8.4032 126.4625 54.9045 31.1959 175.9272 20 K 4.2609 8.4954 122.4017 55.3869 33.0392 176.2598 21 K 4.3428 8.3996 123.6113 54.6589 33.1488 176.4925 22 S 4.1799 8.5197 120.9114 58.5107 62.7654 175.0768 23 K 4.0147 8.5998 122.8774 57.0323 31.3975 177.6756 24 V 4.1595 7.4625 119.1619 60.7897 32.3344 173.3874 25 P 4.4729 0.0000 0.0000 60.9294 29.6516 176.4135 26 A 4.4292 7.6775 124.1808 52.0847 19.4300 179.8889 27 L 3.3574 7.1412 117.0439 57.9552 42.4651 176.3241 28 K 4.2992 7.3925 115.3332 56.1177 33.3220 177.4989 29 G 3.8070 8.4222 106.5439 45.7618 0.0000 173.8857 30 A 4.0732 7.4718 122.8685 51.3876 18.8092 177.3512 31 P 4.0618 0.0000 0.0000 64.7353 31.5759 176.0254 32 F 5.8598 7.1914 113.7482 55.2304 43.6328 174.1484 33 R 4.6755 8.2958 116.1235 55.6925 33.2773 174.1317 34 R 4.7632 8.0647 122.3927 55.5676 31.7869 175.1552 35 G 4.1859 8.1394 103.8425 45.7308 0.0000 172.3510 36 V 4.7825 7.7975 121.9983 61.5131 33.2307 175.5154 37 C 5.1922 8.8334 125.1952 60.1348 28.4816 171.7281 38 T 4.5564 8.6988 113.4408 63.5249 70.4324 173.5760 39 V 4.3126 7.6083 118.8731 61.2372 34.7811 174.3763 40 V 4.6859 8.3469 127.6779 60.8423 31.5379 175.3389 41 R 4.4598 8.0067 130.7429 56.2435 33.4493 176.0446 42 T 5.7321 8.0910 111.1032 64.2641 70.5632 173.4574 43 V 3.9837 8.0801 125.4776 62.7377 33.3470 174.4871 44 T 4.7023 8.3241 116.5140 59.9456 70.3660 172.9306 45 P 4.4798 0.0000 0.0000 62.7192 32.9982 176.2184 46 K 4.6258 7.6447 125.7416 56.9125 30.1347 177.5684 47 K 4.3159 8.9626 112.9425 57.9270 32.7805 175.7614 48 P 4.3500 0.0000 0.0000 65.4332 31.6901 176.6460 49 N 4.7129 7.7994 115.6528 52.7939 39.4614 174.8917 50 S 4.7236 8.5350 114.6391 56.1327 66.6645 174.4938 51 A 4.2602 7.4810 120.9885 52.9071 23.2853 175.9156 52 L 4.6960 8.3339 116.2047 53.7978 44.8484 176.5657 53 R 4.6459 8.7873 123.6617 54.8274 32.6434 175.9484 54 K 4.6662 8.4594 121.5836 55.5041 33.3412 175.9707 55 V 4.8080 8.3104 122.5861 61.2146 35.8620 173.7320 56 A 4.9117 8.7932 123.9255 50.2464 23.0647 175.4151 57 K 4.7730 9.3007 120.3555 55.7470 34.1688 176.3985 58 V 4.8529 8.9170 123.7893 61.3632 35.2020 173.6636 59 R 4.7729 8.9773 129.0637 55.2548 31.2822 175.5251 60 L 4.9002 8.5475 126.9908 53.7773 43.2096 178.3495 61 T 3.9108 8.0573 110.3214 64.3812 68.9055 176.1091 62 S 4.2449 8.0329 116.1375 59.4595 63.6896 174.2991 63 G 3.9538 8.5354 109.0905 46.2990 0.0000 172.7818 64 Y 4.6535 7.9046 115.0594 55.8017 42.1260 175.4975 65 E 4.8267 8.8769 123.2749 55.5141 30.6544 175.7493 66 V 4.6499 8.8107 117.2817 59.8963 36.8315 174.6411 67 T 5.0793 8.6598 117.7502 62.1840 70.0200 174.0059 68 A 4.9603 9.0398 129.1102 50.3278 22.2611 174.5719 69 Y 4.8948 8.4428 121.9239 56.4961 40.9461 174.4903 70 I 4.4227 6.9909 127.0034 58.8226 39.0309 173.9456 71 P 4.3894 0.0000 0.0000 61.8261 33.1109 175.6663 72 G 3.8785 8.6469 105.1917 44.6855 0.0000 174.6387 73 E 4.0675 8.4769 118.1506 57.2328 29.5363 176.1403 74 G 4.0097 6.4426 106.6054 44.0333 0.0000 173.1901 75 H 5.2126 8.3173 120.4268 54.4781 30.8402 174.2519 76 N 4.7223 8.3147 111.1862 51.7925 36.8777 175.5527 77 L 4.3659 7.5602 118.6821 54.4671 42.3102 177.3158 78 Q 4.3457 8.3722 123.8438 54.2334 30.0810 176.8396 79 E 3.8914 8.7007 119.4626 59.6303 29.2558 177.3993 80 H 5.3281 7.7520 113.0849 55.5544 30.1752 174.3429 81 S 4.3855 8.1272 114.1672 58.5768 63.6685 174.0743 82 V 4.5324 8.3134 123.0356 62.6638 32.9524 175.0827 83 V 4.8113 8.4945 124.3021 60.7237 35.4550 172.7307 84 L 5.0426 8.5461 120.5132 53.4792 45.6984 175.1011 85 I 5.9189 8.7233 124.8213 59.0424 39.7898 176.2368 86 R 4.7405 9.2133 121.4937 55.3551 31.9831 174.8573 87 G 3.9684 8.7705 111.1958 44.5293 0.0000 172.9438 88 G 4.5730 7.7358 119.3680 45.1617 0.0000 172.8041 89 R 4.7128 8.2158 124.5434 55.4171 30.9299 176.5718 90 V 4.1281 7.8553 118.5154 60.8482 32.7497 175.4320 91 K 3.6971 8.5455 128.7816 60.1411 32.4028 176.3195 92 D 4.6172 7.9119 115.2407 53.2241 39.7017 175.5841 93 L 4.7520 7.3756 120.4149 52.1455 42.3204 174.5115 94 P 4.2633 0.0000 0.0000 63.5507 31.8870 178.4376 95 G 3.9474 8.6735 108.0162 46.0004 0.0000 174.6868 96 V 4.2761 7.1552 120.7413 61.9234 30.2996 175.6886 97 R 4.2246 8.2015 123.0655 56.5667 31.7282 174.6375 98 Y 5.4835 7.7983 116.2937 56.8243 42.4452 173.5177 99 H 5.4348 8.9506 114.8669 55.5029 34.0141 172.4493 100 I 5.0385 8.0942 120.3330 59.7071 38.6646 176.1842 101 V 3.7893 9.2015 128.6143 62.4034 32.2628 175.3689 102 R 4.2517 8.4399 128.5460 56.7255 30.6139 177.5566 103 G 4.0486 8.0047 109.3637 45.2139 0.0000 173.7202 104 V 4.0935 6.8730 118.9690 62.0473 33.6705 176.7394 105 Y 3.8432 7.9888 121.7521 59.2296 35.2195 170.6011 106 D 4.7431 8.3958 127.6848 55.5402 41.2330 175.5440 107 A 4.5995 7.7849 122.8697 50.3989 20.5860 177.3415 108 A 4.6657 8.5554 125.4047 50.6965 21.1604 176.1988 109 G 4.1938 8.1007 106.2831 43.7453 0.0000 174.3151 110 V 3.8952 8.4368 121.5415 63.2026 31.1695 175.2465 111 K 4.4108 8.4944 123.7738 55.6401 34.4770 176.5901 112 D 4.3911 8.6737 121.1012 55.2469 38.1434 174.0296 113 R 4.2523 7.2549 116.0601 55.9936 30.5796 176.7198 114 K 4.8531 8.5297 120.8502 56.0011 35.1830 176.1824 115 K 4.6537 8.1296 119.3008 56.8579 30.7555 180.5176 116 S 4.6148 9.1090 122.8811 59.8157 60.1154 174.5950 117 R 4.1434 8.3324 123.6551 59.5338 30.8042 179.4160 118 S 4.1164 7.8755 110.9307 60.8454 62.6545 174.4733 119 K 4.3041 7.1773 117.3548 56.0398 33.0981 176.2596 120 Y 3.9874 7.9804 117.8057 56.8581 35.9330 170.1922 121 G 4.0789 7.4743 106.7812 45.9015 0.0000 175.1407 122 T 4.3841 7.8508 112.8218 61.0509 70.2427 173.3715 123 K 4.4859 7.9505 118.9102 54.8209 36.3301 175.3500 124 K 3.7777 8.6670 123.3284 55.8742 31.5619 174.5672 125 P 4.1801 0.0000 0.0000 62.2856 31.1497 176.4822 126 K 4.0084 8.5688 123.9177 56.2152 32.2578 176.6471 127 E 4.1739 8.5337 121.9564 56.4308 30.4106 176.8374 128 A 4.1131 8.1269 120.7926 52.9022 18.9851 176.2464 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 5 P 0.00 4.57 0.00 2.06 2.05 0.00 3.64 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 2.08 0.00 6 T 8.60 4.00 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 7 I 8.47 3.81 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 1.52 0.80 0.91 0.00 0.00 8 N 8.05 4.45 0.00 2.83 2.80 0.00 0.00 7.23 7.12 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 9 Q 7.59 4.00 0.00 2.41 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 10 L 8.62 4.30 0.00 1.81 1.72 0.92 0.86 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 11 V 8.03 3.76 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 0.84 0.00 0.00 0.96 0.00 0.00 12 R 8.00 4.05 0.00 1.82 1.99 0.00 3.23 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.95 0.00 13 K 8.51 4.36 0.00 1.77 1.83 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.42 7.81 14 G 7.13 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 0.00 0.00 0.00 15 R 8.18 4.17 0.00 1.81 1.88 0.00 3.37 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 16 E 8.65 4.09 0.00 1.92 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 0.00 2.29 2.33 0.00 17 K 8.47 4.14 0.00 1.78 1.73 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.36 7.81 18 V 8.32 3.67 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 0.79 0.00 0.00 0.93 0.00 0.00 19 R 8.40 4.40 0.00 1.83 1.84 0.00 3.25 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 20 K 8.50 4.26 0.00 1.73 1.73 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.44 7.81 21 K 8.40 4.34 0.00 1.73 1.74 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.44 7.81 22 S 8.52 4.18 0.00 3.87 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 23 K 8.60 4.01 0.00 1.67 1.75 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.38 7.81 24 V 7.46 4.16 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 0.90 0.00 0.00 0.82 0.00 0.00 25 P 0.00 4.47 0.00 1.91 1.88 0.00 3.89 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 2.07 2.09 0.00 26 A 7.68 4.43 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 27 L 7.14 3.36 0.00 1.70 1.62 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 28 K 7.39 4.30 0.00 1.81 1.73 0.00 1.67 0.00 0.00 1.83 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.53 1.44 7.81 29 G 8.42 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 0.00 0.00 0.00 0.00 30 A 7.47 4.07 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 31 P 0.00 4.06 0.00 0.96 1.55 0.00 3.54 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.93 0.00 32 F 7.19 5.86 0.00 2.93 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 33 R 8.30 4.68 0.00 1.88 1.72 0.00 3.16 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 34 R 8.06 4.76 0.00 1.84 2.19 0.00 2.98 0.00 0.00 3.11 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.43 0.00 35 G 8.14 4.19 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 0.00 0.00 0.00 36 V 7.80 4.78 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 1.10 0.00 0.00 0.89 0.00 0.00 37 C 8.83 5.19 0.00 2.90 2.87 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 38 T 8.70 4.56 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 39 V 7.61 4.31 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 0.99 0.00 0.00 0.95 0.00 0.00 40 V 8.35 4.69 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 1.24 0.00 0.00 0.95 0.00 0.00 41 R 8.01 4.46 0.00 1.83 1.86 0.00 3.21 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 42 T 8.09 5.73 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 1.28 0.00 0.00 43 V 8.08 3.98 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 1.02 0.00 0.00 0.97 0.00 0.00 44 T 8.32 4.70 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 1.23 0.00 0.00 45 P 0.00 4.48 0.00 2.20 2.26 0.00 3.68 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 2.03 2.12 0.00 46 K 7.64 4.63 0.00 1.88 0.86 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.40 7.81 47 K 8.96 4.32 0.00 1.77 1.83 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.43 7.81 48 P 0.00 4.35 0.00 2.03 2.08 0.00 3.66 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 2.02 2.10 0.00 49 N 7.80 4.71 0.00 2.71 2.74 0.00 0.00 6.64 7.57 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 50 S 8.54 4.72 0.00 3.91 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 51 A 7.48 4.26 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 4.70 0.00 1.50 1.59 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.79 4.65 0.00 2.08 2.07 0.00 3.22 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.84 0.00 54 K 8.46 4.67 0.00 1.57 1.56 0.00 1.50 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.51 7.81 55 V 8.31 4.81 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 1.09 0.00 0.00 1.10 0.00 0.00 56 A 8.79 4.91 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 57 K 9.30 4.77 0.00 1.82 1.75 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.57 1.54 7.81 58 V 8.92 4.85 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 1.03 0.00 0.00 0.95 0.00 0.00 59 R 8.98 4.77 0.00 1.97 1.78 0.00 3.17 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 60 L 8.55 4.90 0.00 1.68 1.57 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.06 3.91 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 1.25 0.00 0.00 62 S 8.03 4.24 0.00 4.11 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 63 G 8.54 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.90 4.65 0.00 2.82 2.80 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 65 E 8.88 4.83 0.00 1.85 1.92 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 2.26 2.39 0.00 66 V 8.81 4.65 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 0.67 0.00 0.00 0.73 0.00 0.00 67 T 8.66 5.08 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 1.28 0.00 0.00 68 A 9.04 4.96 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 69 Y 8.44 4.89 0.00 2.92 2.55 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 70 I 6.99 4.42 1.49 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.67 0.74 0.00 0.00 71 P 0.00 4.39 0.00 2.62 2.29 0.00 3.66 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 72 G 8.65 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 73 E 8.48 4.07 0.00 1.90 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 74 G 6.44 4.01 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 0.00 0.00 0.00 75 H 8.32 5.21 0.00 3.24 3.25 0.00 5.54 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.31 4.72 0.00 2.74 2.81 0.00 0.00 5.84 7.79 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 77 L 7.56 4.37 0.00 1.82 1.73 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.37 4.35 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.67 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 79 E 8.70 3.89 0.00 1.82 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 1.89 2.38 0.00 80 H 7.75 5.33 0.00 3.03 3.20 0.00 5.75 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.13 4.39 0.00 3.83 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 82 V 8.31 4.53 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 0.65 0.00 0.00 0.82 0.00 0.00 83 V 8.49 4.81 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 0.77 0.00 0.00 0.98 0.00 0.00 84 L 8.55 5.04 0.00 1.65 1.36 1.19 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 85 I 8.72 5.92 2.10 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.02 1.12 0.00 0.00 86 R 9.21 4.74 0.00 2.05 2.40 0.00 3.15 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.71 0.00 87 G 8.77 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.74 4.57 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 0.00 0.00 0.00 89 R 8.22 4.71 0.00 1.74 1.83 0.00 3.13 0.00 0.00 3.74 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.45 0.00 90 V 7.86 4.13 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 0.77 0.00 0.00 0.55 0.00 0.00 91 K 8.55 3.70 0.00 1.69 1.78 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.51 7.81 92 D 7.91 4.62 0.00 2.84 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 93 L 7.38 4.75 0.00 1.51 1.61 0.90 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.26 0.00 2.18 1.97 0.00 3.68 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 95 G 8.67 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 96 V 7.16 4.28 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 1.09 0.00 0.00 1.04 0.00 0.00 97 R 8.20 4.22 0.00 1.30 1.38 0.00 3.11 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.63 0.00 98 Y 7.80 5.48 0.00 3.00 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 99 H 8.95 5.43 0.00 3.17 3.27 0.00 5.77 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.09 5.04 1.88 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 1.16 0.72 0.93 0.00 0.00 101 V 9.20 3.79 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 0.68 0.00 0.00 0.81 0.00 0.00 102 R 8.44 4.25 0.00 1.99 2.09 0.00 3.41 0.00 0.00 3.51 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 103 G 8.00 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 0.00 104 V 6.87 4.09 1.67 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 -0.01 0.00 0.00 0.65 0.00 0.00 105 Y 7.99 3.84 0.00 3.25 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 0.00 106 D 8.40 4.74 0.00 2.80 2.71 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 0.00 107 A 7.78 4.60 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 0.00 108 A 8.56 4.67 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 109 G 8.10 4.19 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 0.00 0.00 0.00 110 V 8.44 3.90 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 0.71 0.00 0.00 0.82 0.00 0.00 111 K 8.49 4.41 0.00 1.72 1.67 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.44 7.81 112 D 8.67 4.39 0.00 2.79 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 0.00 113 R 7.25 4.25 0.00 1.75 1.86 0.00 3.25 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 114 K 8.53 4.85 0.00 1.68 1.74 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.32 1.58 7.81 115 K 8.13 4.65 0.00 1.71 1.10 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.33 1.37 7.81 116 S 9.11 4.61 0.00 4.16 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 0.00 117 R 8.33 4.14 0.00 1.91 2.00 0.00 3.18 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 118 S 7.88 4.12 0.00 3.83 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 0.00 119 K 7.18 4.30 0.00 1.36 1.13 0.00 1.58 0.00 0.00 1.51 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.26 1.28 7.81 120 Y 7.98 3.99 0.00 3.23 3.30 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 0.00 121 G 7.47 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 0.00 0.00 0.00 122 T 7.85 4.38 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 1.33 0.00 0.00 123 K 7.95 4.49 0.00 1.69 1.69 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.37 1.52 7.81 124 K 8.67 3.78 0.00 1.69 1.79 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.51 7.81 125 P 0.00 4.18 0.00 2.22 2.08 0.00 3.83 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 126 K 8.57 4.01 0.00 1.86 1.90 0.00 1.47 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.49 7.81 127 E 8.53 4.17 0.00 2.10 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 2.28 2.31 0.00 128 A 8.13 4.11 1.21 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 0.00 0.00