NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3589 8.2649 123.5867 51.9673 20.0082 176.9948 3 R 4.1190 7.5179 122.0397 54.8806 31.5172 176.6382 4 K 3.8712 9.3788 123.8191 60.0400 32.7854 178.8043 5 A 4.0481 8.1259 118.6067 54.7663 18.1063 178.4115 6 L 4.5944 8.4490 116.3706 54.7885 42.4191 177.3802 7 I 4.5661 8.8679 121.5350 61.0639 38.4537 176.3653 8 E 4.4460 7.8969 115.9604 56.3556 30.1298 177.8792 9 K 3.5024 7.8185 121.7067 59.3411 32.5149 177.6556 10 A 3.8928 7.4040 119.9403 54.7238 18.2908 175.8338 11 K 3.7116 7.2744 117.5611 56.4766 31.7204 176.0553 12 R 3.8490 8.6462 125.9191 59.6647 29.9164 176.4837 13 T 3.8140 7.8518 117.4996 63.7373 68.3952 171.6563 14 P 4.4617 0.0000 0.0000 63.6240 32.6269 175.5783 15 K 3.9053 9.1357 117.4481 56.2068 31.0325 176.1534 16 F 4.8695 7.8687 116.4630 56.0750 42.6286 174.6686 17 K 3.9111 9.1614 126.0332 60.2915 32.5605 178.2970 18 V 3.7719 8.1710 112.3755 64.7150 31.4678 178.2706 19 R 3.9006 7.9054 114.2610 57.4615 30.0742 176.4799 20 A 4.3519 8.4373 123.0486 51.1510 18.6400 176.8704 21 Y 4.8828 7.7606 120.2163 55.9589 40.5194 176.4942 22 T 3.8971 8.6273 117.2260 66.6033 68.8703 172.2375 23 R 4.0392 8.1005 125.4966 55.1760 30.0882 175.8660 24 C 4.5008 8.2854 121.8396 59.5142 32.1419 173.9489 25 V 3.9800 8.5049 126.7358 61.7057 31.4670 176.2722 26 R 4.5713 7.5298 123.0006 58.4254 37.6920 174.9290 27 C 4.2453 7.9326 112.2360 58.4861 30.5280 175.3517 28 G 3.8129 8.2977 107.6914 44.8939 0.0000 172.9177 29 R 3.7463 7.4280 120.0536 56.6513 29.7225 175.7303 30 A 4.2590 8.0369 130.9766 53.5411 19.0503 176.2215 31 R 3.9720 7.8566 116.8822 57.8574 31.0368 176.5668 32 S 4.7857 9.3133 118.9464 58.5034 60.7697 171.0587 33 V 4.1615 7.5761 114.4936 62.3008 31.9944 175.8970 34 Y 4.6999 9.0720 122.2646 57.2246 40.0575 173.4374 35 R 4.5606 8.6525 114.9836 58.9507 32.4838 180.1252 36 F 4.3360 8.1945 118.6286 57.4197 38.3021 174.5227 37 F 4.9101 10.4667 120.8157 56.4513 46.5737 176.5824 38 G 4.0171 8.2920 107.2854 45.5627 0.0000 173.2297 39 L 4.6706 7.5982 120.1576 53.8457 43.3036 175.1648 40 C 5.1202 8.0983 113.9080 56.2167 31.8847 174.7222 41 R 3.7634 8.0307 117.6921 60.5289 28.8312 178.4542 42 I 3.8496 7.7865 120.2740 63.5909 37.2387 177.5511 43 C 4.5464 7.8969 116.0698 60.7521 29.3384 175.4964 44 L 3.6249 7.7572 122.6679 58.2015 41.3375 179.1137 45 R 3.7047 7.4778 116.7028 59.7757 30.3187 177.5627 46 E 4.0026 8.0407 118.0887 59.0830 29.3498 178.6986 47 L 3.9017 8.2564 118.1465 58.1510 41.7623 179.4481 48 A 3.8072 7.6805 119.1964 55.9473 18.2718 179.2225 49 H 4.4011 8.0104 112.9119 58.1694 28.8026 178.0353 50 K 4.1934 7.7935 119.7050 60.3524 32.7214 176.7331 51 G 3.4331 8.3995 107.7467 45.3164 0.0000 175.0244 52 Q 4.1817 7.9868 118.0717 56.8053 28.4935 176.1630 53 L 4.6549 7.4014 118.7982 51.5682 42.3496 174.1895 54 P 4.1763 0.0000 0.0000 64.2119 31.8092 176.9181 55 G 4.0224 8.7935 109.9421 47.1203 0.0000 174.9179 56 V 4.3540 7.2579 114.8952 60.8570 31.6882 173.7736 57 R 4.2593 7.7442 123.2258 55.2098 31.7763 174.8078 58 K 4.4183 8.3045 118.2355 54.7957 33.1448 176.6882 59 A 4.4854 8.5582 127.1816 51.9941 19.3861 176.7592 60 S 4.7899 8.6491 114.3377 57.3716 65.7381 174.8232 61 W 4.5900 8.3347 119.8644 57.2137 27.2882 174.0676 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 4.36 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 R 7.52 4.12 0.00 2.04 1.86 0.00 3.22 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 4 K 9.38 3.87 0.00 1.80 1.90 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.55 7.81 5 A 8.13 4.05 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 6 L 8.45 4.59 0.00 1.68 1.77 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.87 4.57 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.52 0.92 0.00 0.00 8 E 7.90 4.45 0.00 2.14 2.34 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 2.40 2.31 0.00 9 K 7.82 3.50 0.00 1.11 1.68 0.00 1.70 0.00 0.00 1.55 0.00 0.00 3.14 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.88 1.01 7.81 10 A 7.40 3.89 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 11 K 7.27 3.71 0.00 1.67 1.94 0.00 1.82 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.38 7.81 12 R 8.65 3.85 0.00 1.78 1.95 0.00 3.45 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 13 T 7.85 3.81 4.20 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 1.15 0.00 0.00 14 P 0.00 4.46 0.00 2.36 2.14 0.00 3.67 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 1.94 1.92 0.00 15 K 9.14 3.91 0.00 1.60 1.89 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.45 1.03 7.81 16 F 7.87 4.87 0.00 3.20 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 17 K 9.16 3.91 0.00 1.89 2.04 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.57 7.81 18 V 8.17 3.77 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 0.72 0.00 0.00 1.06 0.00 0.00 19 R 7.91 3.90 0.00 2.05 2.13 0.00 3.34 0.00 0.00 3.37 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.85 0.00 20 A 8.44 4.35 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 21 Y 7.76 4.88 0.00 3.11 2.89 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 22 T 8.63 3.90 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 23 R 8.10 4.04 0.00 1.99 2.00 0.00 3.53 0.00 0.00 3.40 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.57 0.00 24 C 8.29 4.50 0.00 3.21 2.97 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 25 V 8.50 3.98 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 0.79 0.00 0.00 0.95 0.00 0.00 26 R 7.53 4.57 0.00 1.74 1.88 0.00 3.22 0.00 0.00 3.27 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 27 C 7.93 4.25 0.00 3.15 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 28 G 8.30 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 29 R 7.43 3.75 0.00 2.04 1.92 0.00 3.17 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 30 A 8.04 4.26 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 31 R 7.86 3.97 0.00 1.78 1.91 0.00 3.22 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 32 S 9.31 4.79 0.00 4.22 4.53 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 33 V 7.58 4.16 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 0.82 0.00 0.00 1.06 0.00 0.00 34 Y 9.07 4.70 0.00 2.99 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 35 R 8.65 4.56 0.00 1.91 1.95 0.00 3.15 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 36 F 8.19 4.34 0.00 2.89 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 37 F 10.47 4.91 0.00 3.25 2.97 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 38 G 8.29 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.60 4.67 0.00 1.74 1.58 0.71 0.67 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 40 C 8.10 5.12 0.00 3.15 3.08 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 41 R 8.03 3.76 0.00 2.20 2.33 0.00 3.13 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 42 I 7.79 3.85 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.52 0.91 0.00 0.00 43 C 7.90 4.55 0.00 3.10 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 44 L 7.76 3.62 0.00 1.48 1.82 0.35 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.48 3.70 0.00 1.92 2.01 0.00 3.33 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 46 E 8.04 4.00 0.00 2.15 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 2.39 2.62 0.00 47 L 8.26 3.90 0.00 1.55 1.66 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.68 3.81 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 49 H 8.01 4.40 0.00 3.34 3.32 0.00 5.65 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.79 4.19 0.00 1.81 1.85 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.63 7.81 51 G 8.40 3.43 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 0.00 52 Q 7.99 4.18 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.91 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 53 L 7.40 4.65 0.00 1.57 1.67 0.02 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.18 0.00 2.23 2.13 0.00 4.04 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 2.11 2.04 0.00 55 G 8.79 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 56 V 7.26 4.35 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 0.85 0.00 0.00 1.23 0.00 0.00 57 R 7.74 4.26 0.00 1.83 1.87 0.00 3.29 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 58 K 8.30 4.42 0.00 1.82 1.77 0.00 1.84 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.45 7.81 59 A 8.56 4.49 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 60 S 8.65 4.79 0.00 4.00 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 61 W 8.33 4.59 0.00 3.34 3.04 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