NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3759 8.3344 115.2898 58.3568 61.8960 174.0991 3 I 4.3897 7.9183 117.7384 56.5933 40.0488 174.7642 4 S 4.1737 8.9732 121.5596 60.6681 64.0061 173.8377 5 A 3.9970 7.2029 124.1932 52.5431 17.9037 177.5816 6 R 4.0636 7.9208 123.5832 57.9767 30.7580 176.4227 7 N 4.8624 7.7901 115.5205 51.6864 40.2893 174.4521 8 Q 4.8327 8.6220 122.9037 54.3437 32.2829 174.6454 9 L 4.7204 8.7518 125.1804 52.6584 44.2780 176.4308 10 K 4.5793 8.7743 123.9619 56.4540 33.5373 176.6879 11 G 4.1159 8.6884 109.5894 45.8081 0.0000 171.3174 12 K 5.1193 8.3318 120.3384 54.1797 35.5335 176.0672 13 V 4.2539 8.7496 127.4848 63.3611 31.9874 176.4137 14 V 4.3812 8.9281 120.8800 61.2310 33.2941 176.0757 15 G 4.3310 7.7672 107.2365 44.5515 0.0000 171.9870 16 L 5.1712 8.2708 124.5527 53.4064 45.4191 174.7782 17 K 4.5627 9.1670 127.0790 54.7585 35.4710 174.6302 18 K 4.6365 8.8816 127.0556 54.9821 33.3803 176.8174 19 G 4.1470 8.4286 116.3857 45.3359 0.0000 173.6977 20 V 3.9704 8.5206 118.6526 64.5546 32.6433 177.4376 21 V 4.3177 7.7726 118.3705 63.6047 34.0039 175.1550 22 T 5.2169 7.7751 108.7298 59.9331 72.3994 172.8616 23 A 5.0876 8.9883 122.1152 50.4530 23.2676 174.5605 24 E 5.1129 9.2024 121.7051 54.3905 32.2126 174.8385 25 V 4.8132 8.8315 126.7680 61.0286 34.6607 174.0359 26 V 4.8569 8.6916 127.5668 61.0945 34.1324 173.9847 27 L 5.2105 8.9846 127.9049 52.9213 44.9297 174.8702 28 E 4.9504 9.2081 125.1946 55.0979 31.4133 174.9606 29 I 5.0131 8.5246 121.7838 58.6017 41.0597 174.4206 30 A 4.0731 8.5792 123.5629 54.4821 18.3640 178.9236 31 G 3.9008 9.0779 109.0226 45.3640 0.0000 174.5283 32 G 3.9070 8.1154 107.1559 45.3918 0.0000 173.8242 33 N 4.5963 7.6770 115.9912 53.0901 39.8820 174.0396 34 K 5.0473 8.5364 120.5829 54.7864 34.7730 175.4357 35 I 4.4630 8.9519 126.1685 59.9195 39.4484 174.6121 36 T 5.0138 8.5179 123.3355 61.8054 70.5819 173.6749 37 S 4.7382 9.1809 121.0241 56.4021 65.7826 172.5230 38 I 4.9992 8.4959 127.2312 59.7468 39.3453 174.3962 39 I 4.8532 8.3736 120.9944 58.7577 41.7302 174.8816 40 S 4.6829 8.4947 115.5961 57.9727 63.9272 174.8633 41 L 3.9558 8.8404 124.7433 58.4517 41.6842 179.1093 42 D 4.3933 8.1331 118.3471 57.7481 40.7734 179.0380 43 S 4.1067 8.1397 115.4330 61.4572 62.8097 176.7935 44 V 3.5938 7.6653 120.5257 66.0140 31.2077 178.0574 45 E 3.9216 8.2331 118.1596 59.6250 29.1902 179.2171 46 E 4.0322 8.2429 117.3451 58.9510 29.5901 178.5396 47 L 4.3954 8.0263 116.5008 53.7137 42.2817 176.6443 48 G 3.9048 7.9737 107.0741 46.1113 0.0000 174.5916 49 V 3.6955 7.6033 119.1930 62.6799 32.3213 175.1495 50 K 4.6544 8.2184 124.5143 54.2026 36.1532 175.1040 51 E 4.1291 8.6169 121.8278 58.0796 29.7670 177.9253 52 G 3.9294 9.0512 115.4849 44.8773 0.0000 173.5323 53 A 4.1503 7.9249 121.9603 52.1038 19.8132 176.7231 54 E 4.8280 8.6756 120.4027 55.2551 30.4639 175.1822 55 L 4.9739 8.5992 123.9211 53.1471 46.7288 175.5020 56 T 5.0612 8.3729 115.1422 61.9080 71.5624 173.8658 57 A 4.5446 8.8453 127.9771 50.9500 20.6383 176.2169 58 V 4.9301 8.3306 121.3475 61.0484 34.2650 174.9250 59 V 4.4859 8.6364 126.4998 60.7975 35.0830 174.5555 60 K 4.2424 8.6759 128.7538 56.0734 33.2539 177.6457 61 S 4.1151 8.8445 121.9592 62.0140 62.8833 176.2088 62 T 4.1790 7.8591 107.4138 63.0257 68.7441 174.3680 63 D 4.6942 8.0725 121.5233 54.1047 41.3788 175.9402 64 V 4.1501 7.4932 120.0572 61.5605 32.3670 175.3037 65 M 4.5603 8.3901 126.4751 53.9537 33.9222 175.1226 66 I 4.4626 8.0420 120.4929 59.3565 39.7554 175.0135 67 L 4.5621 8.5341 126.0638 53.1631 43.7977 175.8510 68 A 4.3345 8.5850 127.7597 52.2953 19.1923 176.0787 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 S 8.33 4.38 0.00 3.85 3.41 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 3 I 7.92 4.39 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 1.47 1.42 0.91 0.00 0.00 4 S 8.97 4.17 0.00 4.01 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 5 A 7.20 4.00 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 6 R 7.92 4.06 0.00 1.86 1.99 0.00 3.14 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 7 N 7.79 4.86 0.00 2.84 2.74 0.00 0.00 6.59 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.62 4.83 0.00 1.87 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 9 L 8.75 4.72 0.00 1.57 1.55 0.92 0.80 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 10 K 8.77 4.58 0.00 1.64 1.73 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.44 7.81 11 G 8.69 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.33 5.12 0.00 1.83 1.61 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.33 1.39 7.81 13 V 8.75 4.25 2.27 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 1.04 0.00 0.00 0.99 0.00 0.00 14 V 8.93 4.38 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 0.77 0.00 0.00 0.97 0.00 0.00 15 G 7.77 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 0.00 0.00 0.00 0.00 16 L 8.27 5.17 0.00 1.59 1.50 0.98 0.53 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 17 K 9.17 4.56 0.00 1.82 1.58 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.39 7.81 18 K 8.88 4.64 0.00 1.67 1.72 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.42 7.81 19 G 8.43 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.52 3.97 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 0.81 0.00 0.00 0.93 0.00 0.00 21 V 7.77 4.32 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 1.06 0.00 0.00 0.93 0.00 0.00 22 T 7.78 5.22 4.31 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 1.21 0.00 0.00 23 A 8.99 5.09 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 24 E 9.20 5.11 0.00 2.02 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 2.20 2.22 0.00 25 V 8.83 4.81 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 0.98 0.00 0.00 0.93 0.00 0.00 26 V 8.69 4.86 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 1.01 0.00 0.00 0.93 0.00 0.00 27 L 8.98 5.21 0.00 1.58 1.52 0.92 0.49 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 28 E 9.21 4.95 0.00 2.01 1.81 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 2.24 2.24 0.00 29 I 8.52 5.01 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 1.31 0.61 0.95 0.00 0.00 30 A 8.58 4.07 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 31 G 9.08 3.90 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 0.00 0.00 0.00 32 G 8.12 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 33 N 7.68 4.60 0.00 2.71 2.75 0.00 0.00 6.82 7.56 0.00 0.00 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 8.54 5.05 0.00 1.60 1.70 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.42 7.81 35 I 8.95 4.46 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 1.23 1.04 0.91 0.00 0.00 36 T 8.52 5.01 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 37 S 9.18 4.74 0.00 3.83 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 38 I 8.50 5.00 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 1.40 0.79 0.91 0.00 0.00 39 I 8.37 4.85 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 1.28 1.23 0.91 0.00 0.00 40 S 8.49 4.68 0.00 4.02 4.03 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 41 L 8.84 3.96 0.00 1.76 1.70 0.92 1.60 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 42 D 8.13 4.39 0.00 2.72 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 43 S 8.14 4.11 0.00 3.88 3.91 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 0.00 0.00 0.00 44 V 7.67 3.59 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 1.03 0.00 0.00 0.93 0.00 0.00 45 E 8.23 3.92 0.00 2.19 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 2.33 2.53 0.00 46 E 8.24 4.03 0.00 1.92 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 2.35 2.53 0.00 47 L 8.03 4.40 0.00 1.66 1.70 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.97 3.90 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 0.00 0.00 0.00 49 V 7.60 3.70 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 0.97 0.00 0.00 50 K 8.22 4.65 0.00 1.79 1.61 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.66 7.81 51 E 8.62 4.13 0.00 1.99 1.84 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 2.38 2.32 0.00 52 G 9.05 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 53 A 7.92 4.15 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 54 E 8.68 4.83 0.00 1.86 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 2.24 2.32 0.00 55 L 8.60 4.97 0.00 1.58 1.53 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 56 T 8.37 5.06 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 57 A 8.85 4.54 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 0.00 0.00 0.00 0.00 0.00 58 V 8.33 4.93 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 0.85 0.00 0.00 0.93 0.00 0.00 59 V 8.64 4.49 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 0.88 0.00 0.00 0.93 0.00 0.00 60 K 8.68 4.24 0.00 1.83 1.65 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.46 7.81 61 S 8.84 4.12 0.00 3.92 3.91 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 0.00 0.00 0.00 62 T 7.86 4.18 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 63 D 8.07 4.69 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 64 V 7.49 4.15 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 0.78 0.00 0.00 0.93 0.00 0.00 65 M 8.39 4.56 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 66 I 8.04 4.46 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 1.30 0.87 0.91 0.00 0.00 67 L 8.53 4.56 0.00 1.54 1.53 0.92 1.01 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 68 A 8.59 4.33 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