NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3941 8.2649 123.5825 51.5504 20.9865 176.2645 3 K 4.4120 7.4815 114.1505 56.2629 36.7965 173.7440 4 H 3.5889 9.6338 113.3954 57.4092 29.8609 175.5661 5 P 4.4553 0.0000 0.0000 63.5836 32.3545 175.8025 6 V 4.3883 7.9335 118.8831 60.9397 34.3795 171.6954 7 P 4.2338 0.0000 0.0000 63.3578 31.5123 176.1667 8 K 4.3082 8.4505 122.0007 56.5303 32.7049 176.3783 9 K 4.2904 7.6275 113.6470 55.7056 35.7793 174.6573 10 K 3.7283 8.9883 124.1358 57.0121 32.2768 176.2060 11 T 4.0618 8.4254 117.0671 61.1236 69.5794 175.0733 12 S 4.2939 8.6491 120.4545 58.4147 65.0185 174.9302 13 K 3.8870 8.6804 122.0725 59.7835 31.8169 178.5482 14 A 3.9610 8.0140 120.0483 55.7826 18.1705 179.6834 15 R 3.8777 8.1279 115.7233 59.5917 30.4087 178.0642 16 R 3.9460 8.4224 119.4301 59.0089 29.9327 177.7616 17 D 4.3841 8.6515 118.2519 57.6028 41.0795 178.8975 18 A 4.0709 8.2465 121.2985 55.6095 18.1029 179.5652 19 R 3.8996 7.8173 115.2549 59.1691 30.1632 177.7848 20 R 4.1444 8.5956 117.3220 55.7100 30.1219 178.1902 21 S 4.0252 7.8399 115.2826 60.9536 63.0291 174.8100 22 H 4.8178 7.8435 116.3403 55.9764 28.5714 175.1295 23 H 4.6712 8.2270 118.0478 56.6585 29.1880 175.9142 24 A 4.0578 8.0077 122.0456 52.3834 18.5773 177.1675 25 L 4.2037 8.3019 121.9931 54.6831 42.5414 176.4431 26 T 4.3709 8.2066 117.0590 59.9393 68.3357 172.9059 27 P 4.4817 0.0000 0.0000 61.5127 32.1768 174.3605 28 P 4.2513 0.0000 0.0000 63.3616 31.9977 175.4142 29 T 4.4434 8.3822 115.7912 61.0944 68.5166 173.2872 30 L 5.2541 8.3592 127.3475 53.5170 46.1550 175.7616 31 V 4.0563 9.0869 111.9253 60.7520 36.0578 173.2485 32 P 3.4477 0.0000 0.0000 61.3941 32.4894 173.3395 33 C 3.5319 8.2566 131.7580 58.6189 29.8115 171.9131 34 P 4.2279 0.0000 0.0000 65.9530 30.4554 177.5942 35 E 4.1107 7.3820 116.5403 58.8531 29.8840 177.0746 36 C 4.4984 7.5967 116.4827 59.0283 29.1664 174.0455 37 K 4.2610 8.4493 118.1519 57.3858 32.0502 177.2401 38 A 4.5619 7.5851 124.4987 52.6068 20.9977 177.2733 39 M 4.9726 8.3214 116.9585 54.6945 34.9930 174.5736 40 K 4.8818 9.0647 123.4157 53.5736 36.7738 173.8284 41 P 4.8374 0.0000 0.0000 61.6870 31.5976 174.5215 42 P 4.2026 0.0000 0.0000 64.7473 32.1491 175.2222 43 H 4.0487 9.6555 115.3745 56.1108 24.9845 175.7880 44 T 4.5047 7.6966 106.0840 60.3816 71.5591 173.7229 45 V 4.0142 8.6433 125.6413 63.7434 32.1523 174.6838 46 C 4.6285 8.6733 124.3047 59.0444 34.1253 174.1816 47 P 4.3752 0.0000 0.0000 63.7078 30.6014 174.7600 48 E 4.6986 9.5474 126.2707 56.9551 37.1235 179.7681 49 C 3.8279 9.5808 126.2109 60.5941 32.1698 176.8525 50 G 3.9406 8.1957 107.4343 46.0051 0.0000 176.1461 51 Y 4.8858 8.1120 122.7790 56.0352 41.6319 173.7095 52 Y 3.9848 8.6314 119.8330 57.3075 37.6596 176.0705 53 A 3.7057 8.8357 129.4958 52.2445 16.1835 176.6563 54 G 3.7855 7.4987 105.7885 45.2441 0.0000 173.4837 55 R 4.1634 8.0674 121.5711 54.9002 31.2104 174.9434 56 K 4.3020 8.1490 118.3110 56.2490 33.3227 174.1213 57 V 3.0990 7.4775 108.4251 64.1506 32.0163 176.2210 58 L 4.4303 7.4457 118.2976 54.4801 45.7917 174.0642 59 E 4.7221 8.6211 119.5421 55.0147 32.4625 175.2100 60 V 3.9684 8.2834 119.9122 63.1229 31.8334 175.0753 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 A 8.26 4.39 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 3 K 7.48 4.41 0.00 1.74 1.70 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.53 7.81 4 H 9.63 3.59 0.00 3.16 2.81 0.00 5.72 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.46 0.00 2.05 1.98 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 6 V 7.93 4.39 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 0.72 0.00 0.00 1.04 0.00 0.00 7 P 0.00 4.23 0.00 2.08 2.00 0.00 3.72 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 2.04 2.10 0.00 8 K 8.45 4.31 0.00 1.71 1.81 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.45 7.81 9 K 7.63 4.29 0.00 1.72 1.64 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.29 1.30 7.81 10 K 8.99 3.73 0.00 1.71 1.77 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.47 7.81 11 T 8.43 4.06 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 12 S 8.65 4.29 0.00 4.07 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 13 K 8.68 3.89 0.00 1.82 1.89 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.56 7.81 14 A 8.01 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.13 3.88 0.00 1.78 1.97 0.00 3.27 0.00 0.00 3.15 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 16 R 8.42 3.95 0.00 1.90 2.17 0.00 3.18 0.00 0.00 3.17 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 17 D 8.65 4.38 0.00 2.83 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 18 A 8.25 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 19 R 7.82 3.90 0.00 1.98 2.11 0.00 3.29 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 20 R 8.60 4.14 0.00 1.89 2.01 0.00 3.21 0.00 0.00 3.28 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 21 S 7.84 4.03 0.00 3.87 3.99 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 0.00 0.00 0.00 0.00 22 H 7.84 4.82 0.00 3.12 3.32 0.00 5.69 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.23 4.67 0.00 3.28 3.33 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.01 4.06 1.26 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 0.00 0.00 0.00 25 L 8.30 4.20 0.00 1.66 1.62 0.92 0.86 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 26 T 8.21 4.37 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 27 P 0.00 4.48 0.00 2.22 2.04 0.00 3.83 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 1.99 1.95 0.00 28 P 0.00 4.25 0.00 2.21 2.11 0.00 3.75 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 1.99 1.96 0.00 29 T 8.38 4.44 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 30 L 8.36 5.25 0.00 1.52 1.52 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 31 V 9.09 4.06 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 0.64 0.00 0.00 1.05 0.00 0.00 32 P 0.00 3.45 0.00 2.02 1.89 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 33 C 8.26 3.53 0.00 3.10 3.11 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 34 P 0.00 4.23 0.00 2.13 2.11 0.00 3.73 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.86 0.00 35 E 7.38 4.11 0.00 2.08 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 2.39 2.60 0.00 36 C 7.60 4.50 0.00 3.04 2.86 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 37 K 8.45 4.26 0.00 1.86 1.90 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.43 7.81 38 A 7.59 4.56 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 39 M 8.32 4.97 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.48 0.00 40 K 9.06 4.88 0.00 1.79 1.89 0.00 1.33 0.00 0.00 1.96 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.36 7.81 41 P 0.00 4.84 0.00 2.13 2.13 0.00 3.42 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.87 0.00 42 P 0.00 4.20 0.00 2.22 2.14 0.00 3.82 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 2.08 2.16 0.00 43 H 9.66 4.05 0.00 3.36 3.50 0.00 5.74 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 7.70 4.50 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 1.26 0.00 0.00 45 V 8.64 4.01 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 0.75 0.00 0.00 0.88 0.00 0.00 46 C 8.67 4.63 0.00 2.97 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 47 P 0.00 4.38 0.00 2.14 2.17 0.00 3.80 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 2.02 2.16 0.00 48 E 9.55 4.70 0.00 2.01 1.23 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 2.25 2.28 0.00 49 C 9.58 3.83 0.00 3.14 3.05 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 50 G 8.20 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 0.00 0.00 0.00 51 Y 8.11 4.89 0.00 2.34 1.45 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.63 3.98 0.00 3.17 3.03 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 0.00 0.00 0.00 0.00 53 A 8.84 3.71 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 54 G 7.50 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 0.00 0.00 0.00 55 R 8.07 4.16 0.00 1.81 1.74 0.00 3.27 0.00 0.00 3.35 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 56 K 8.15 4.30 0.00 1.86 1.76 0.00 1.55 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.17 1.44 7.81 57 V 7.48 3.10 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 0.75 0.00 0.00 0.99 0.00 0.00 58 L 7.45 4.43 0.00 1.55 1.51 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.62 4.72 0.00 2.03 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 2.19 2.31 0.00 60 V 8.28 3.97 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 0.83 0.00 0.00 0.94 0.00 0.00