NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.5541 8.3244 119.4478 57.4244 40.4176 173.3264 2 E 4.4939 8.5126 121.7723 53.3913 32.1977 174.1062 3 N 4.6310 9.4389 123.9364 53.3462 38.4236 173.9833 4 R 4.6513 8.1887 125.3455 55.9708 31.0769 179.2038 5 V 3.6535 8.6452 121.1735 66.1491 31.4024 177.5011 6 A 4.2737 7.9112 121.3491 54.6187 18.2287 179.3473 7 E 3.9649 7.9502 116.2776 59.4818 29.5185 179.6599 8 K 4.1321 8.0574 118.1459 59.4488 32.2457 179.1007 9 Q 4.1108 8.4198 118.6437 58.9210 28.4259 179.1061 10 K 4.0169 7.8805 119.3007 59.3152 32.6990 178.0384 11 L 3.9282 7.7628 120.6624 58.5184 41.7343 178.9405 12 F 4.2792 8.3702 115.0731 59.0819 39.0624 176.7112 13 Q 4.4894 7.5909 115.8444 54.3546 29.3061 175.3040 14 E 3.9190 7.4036 121.8876 56.5897 30.4860 177.3117 15 D 4.6420 8.4744 127.6985 53.2584 39.6934 175.2398 16 N 4.7496 7.8852 113.9188 51.9135 38.1205 177.4677 17 G 3.9783 8.2137 105.9898 46.3139 0.0000 174.5862 18 L 4.0978 8.0175 120.4690 53.7608 42.3167 175.3998 19 P 4.5448 0.0000 0.0000 61.9348 32.2368 177.3780 20 V 3.6573 8.5528 119.1067 65.3118 30.9659 177.6954 21 H 4.4723 8.1748 113.1794 56.6807 28.7060 175.3424 22 L 4.6232 7.8782 119.0924 54.2550 42.9637 177.7600 23 K 4.1711 7.9538 119.7127 58.0074 32.2640 177.5135 24 G 3.8538 9.3725 106.6523 45.8456 0.0000 173.5194 25 G 3.8551 7.1515 106.1232 44.6910 0.0000 176.3773 26 A 4.1570 8.7695 122.3444 55.1726 18.4846 179.6560 27 T 3.8668 7.9128 114.1123 66.6162 68.4452 176.0931 28 D 4.4702 7.7418 120.1110 57.8062 40.9201 178.9148 29 N 4.5280 8.1836 116.0181 56.3416 38.5274 177.4391 30 I 3.7044 7.5963 121.2718 64.3460 37.2897 177.9368 31 L 3.9511 8.1346 121.3582 58.6242 41.8370 178.5276 32 Y 4.2056 8.4835 119.4724 60.8400 38.7700 178.1598 33 R 3.5420 8.1565 119.0735 58.9324 30.0798 179.0450 34 V 3.5302 8.0387 118.4464 66.3520 31.4284 178.2545 35 T 3.8073 7.7344 115.2190 66.8828 68.3548 176.4321 36 M 3.9370 7.7978 120.0314 58.7758 32.1006 178.3710 37 T 3.8190 7.9083 115.9324 66.6624 68.5992 176.6483 38 L 3.9620 8.0854 121.0095 57.9012 41.5969 179.2988 39 C 4.1114 8.4133 117.0590 62.9238 28.1188 176.2001 40 L 4.1959 8.0961 120.4107 57.2543 41.3975 179.6002 41 G 3.7052 8.4159 106.1195 47.8078 0.0000 175.6964 42 G 3.9039 8.4318 109.2498 48.1034 0.0000 175.8156 43 T 3.9903 7.9898 118.0822 66.2173 68.4421 176.9966 44 L 4.0851 8.0900 121.1183 57.8515 41.5784 178.8108 45 Y 4.4445 8.7517 120.2477 60.8385 38.6832 178.3249 46 S 3.9403 8.3029 115.2550 61.1642 63.1458 176.4966 47 L 3.9685 8.1912 122.8358 57.5616 41.2450 178.5266 48 Y 4.0883 8.2007 119.5357 61.1081 38.6728 178.0755 49 C 3.9049 8.2413 117.7321 62.6675 27.8166 175.8372 50 L 4.0121 8.1210 122.0422 58.2099 41.4330 179.3206 51 G 3.6304 7.9133 104.2797 47.4701 0.0000 175.0544 52 W 4.1666 8.1900 130.8698 60.1067 30.5674 177.4184 53 A 3.8797 8.1256 117.8299 53.4491 18.1451 178.7686 54 S 4.0166 7.4798 112.4707 58.5666 63.4171 174.0744 55 F 4.6954 6.4809 119.5871 54.3809 41.1225 173.7513 56 P 4.2449 0.0000 0.0000 63.2157 32.3122 176.7182 57 H 4.6399 8.0053 118.0760 57.4252 27.8030 175.0024 58 K 5.0839 6.9412 121.6574 55.4549 31.2343 176.1737 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 F 8.32 4.55 0.00 3.03 3.15 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 2 E 8.51 4.49 0.00 1.99 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 2.20 2.39 0.00 3 N 9.44 4.63 0.00 2.75 2.78 0.00 0.00 6.94 7.65 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 4 R 8.19 4.65 0.00 1.91 1.92 0.00 3.61 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.58 0.00 5 V 8.65 3.65 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 1.10 0.00 0.00 0.95 0.00 0.00 6 A 7.91 4.27 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 7 E 7.95 3.96 0.00 2.09 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 2.34 2.37 0.00 8 K 8.06 4.13 0.00 2.03 2.11 0.00 1.94 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.75 1.58 7.81 9 Q 8.42 4.11 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.68 0.00 10 K 7.88 4.02 0.00 1.77 2.08 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 11 L 7.76 3.93 0.00 1.63 1.56 0.69 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 12 F 8.37 4.28 0.00 3.16 3.10 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 13 Q 7.59 4.49 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.63 0.00 14 E 7.40 3.92 0.00 2.09 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 2.30 2.22 0.00 15 D 8.47 4.64 0.00 2.67 2.58 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 0.00 0.00 0.00 0.00 16 N 7.89 4.75 0.00 2.80 2.83 0.00 0.00 6.36 7.00 0.00 0.00 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 G 8.21 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.02 4.10 0.00 1.74 1.57 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.54 0.00 2.23 2.16 0.00 3.62 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 20 V 8.55 3.66 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 0.84 0.00 0.00 0.90 0.00 0.00 21 H 8.17 4.47 0.00 3.26 3.41 0.00 5.46 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.88 4.62 0.00 1.53 1.57 0.71 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 23 K 7.95 4.17 0.00 1.98 2.13 0.00 2.04 0.00 0.00 1.85 0.00 0.00 3.14 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.37 7.81 24 G 9.37 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.15 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 26 A 8.77 4.16 1.33 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 27 T 7.91 3.87 4.28 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 1.24 0.00 0.00 28 D 7.74 4.47 0.00 3.12 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 29 N 8.18 4.53 0.00 3.01 2.95 0.00 0.00 7.08 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 30 I 7.60 3.70 2.06 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.89 0.93 0.00 0.00 31 L 8.13 3.95 0.00 2.04 1.86 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 8.48 4.21 0.00 3.18 3.29 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 33 R 8.16 3.54 0.00 1.93 1.88 0.00 3.28 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.77 0.00 34 V 8.04 3.53 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 1.09 0.00 0.00 0.93 0.00 0.00 35 T 7.73 3.81 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 1.22 0.00 0.00 36 M 7.80 3.94 0.00 1.76 1.66 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 37 T 7.91 3.82 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 1.17 0.00 0.00 38 L 8.09 3.96 0.00 1.81 1.71 0.91 1.06 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 39 C 8.41 4.11 0.00 2.92 2.99 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 40 L 8.10 4.20 0.00 1.75 1.70 0.93 0.65 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 41 G 8.42 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 42 G 8.43 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 43 T 7.99 3.99 4.40 0.00 0.00 0.00 0.00 0.00 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 44 L 8.09 4.09 0.00 1.97 1.79 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 8.75 4.44 0.00 2.97 3.22 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 46 S 8.30 3.94 0.00 4.05 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 0.00 47 L 8.19 3.97 0.00 1.96 1.81 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.20 4.09 0.00 3.26 3.34 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 49 C 8.24 3.90 0.00 2.95 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 50 L 8.12 4.01 0.00 1.78 1.85 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 51 G 7.91 3.63 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 0.00 0.00 0.00 52 W 8.19 4.17 0.00 2.95 3.22 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 53 A 8.13 3.88 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 54 S 7.48 4.02 0.00 3.66 3.31 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 55 F 6.48 4.70 0.00 2.90 2.79 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 56 P 0.00 4.24 0.00 2.09 1.96 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 57 H 8.01 4.64 0.00 2.98 3.32 0.00 5.92 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 6.94 5.08 0.00 1.76 1.69 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.42 7.81