NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.5158 0.0000 0.0000 62.7244 33.7136 174.4994 2 F 5.2880 8.7029 121.8218 56.2699 41.6570 172.2771 3 I 4.1847 9.0070 128.4517 59.3210 39.8204 173.8253 4 E 4.7442 8.2457 127.6174 54.3325 31.8523 174.5062 5 C 4.8022 9.2377 124.5082 58.1859 31.5430 172.5019 6 H 5.4607 8.9145 121.0621 54.1031 30.2909 173.6034 7 I 4.8172 8.6817 116.0735 58.4793 41.5054 174.5580 8 A 4.6146 8.4851 124.0587 51.7188 18.9235 177.4748 9 T 3.9989 8.6223 116.4201 63.0759 67.5999 172.8483 10 G 3.4209 8.7091 117.9886 45.3471 0.0000 174.0630 11 L 4.3451 7.4385 120.9174 53.7711 42.8908 177.2852 12 S 4.4184 8.2942 116.5603 57.9867 65.1592 175.7736 13 V 3.5906 8.2688 122.4218 64.8299 31.0463 178.1422 14 A 3.9539 7.9738 120.9670 54.9750 18.1958 179.2422 15 R 3.8183 7.9160 117.0245 59.7132 30.1285 178.8563 16 K 3.9723 8.0150 118.0581 59.6082 32.0479 179.4498 17 Q 4.0359 8.2833 118.4174 58.8251 28.4998 178.5216 18 Q 3.9603 8.3465 120.9372 58.8753 29.0291 177.8117 19 L 3.9205 8.1711 121.6883 58.2877 42.1161 179.1517 20 I 3.6616 7.7640 119.4908 64.3669 37.0761 178.0846 21 R 3.8996 7.9497 119.5328 59.9891 29.7626 178.2325 22 D 4.3666 8.3117 118.4722 56.9539 40.7590 178.8465 23 V 3.5593 8.1625 119.4054 66.0699 31.5191 178.1182 24 I 3.6771 7.7918 119.3437 64.3592 36.9900 177.6532 25 D 4.3372 8.1565 118.7628 57.8098 41.0528 178.9846 26 V 3.6841 8.0052 112.7000 64.4613 31.4510 178.8675 27 T 3.8077 8.0820 115.6714 66.6304 68.3280 175.9313 28 N 4.7572 8.0999 120.2584 56.2873 38.6915 176.8817 29 K 4.1195 7.9849 118.3428 58.3410 32.2549 178.6518 30 S 4.5305 7.9555 113.6751 59.6802 64.0923 175.6477 31 I 4.2668 7.8051 114.0681 60.2760 38.1989 176.5858 32 G 4.1661 8.0849 108.3695 45.7474 0.0000 173.5266 33 S 4.2676 7.7496 116.1934 57.7225 63.6845 173.2911 34 D 4.6358 8.5968 124.2491 53.5482 41.9872 174.9358 35 P 4.2539 0.0000 0.0000 65.8836 31.4762 178.4837 36 K 3.9486 8.5060 116.7881 58.6204 32.0035 177.4853 37 I 4.3768 7.9046 110.1327 60.3211 38.0028 174.9222 38 I 4.4031 7.5865 122.7647 60.4499 38.3004 174.8197 39 N 5.1567 9.2453 124.4808 51.4046 41.4720 173.7436 40 V 4.9739 8.5549 122.4777 60.9561 34.8837 174.1631 41 L 4.8119 9.0681 129.2190 53.2006 44.9688 174.4351 42 L 5.0822 8.6697 128.2521 53.2839 44.1107 175.3694 43 V 4.4510 8.7918 126.0306 61.1440 34.5539 173.8207 44 E 5.2058 8.7551 126.6439 55.2083 31.6025 174.8762 45 H 5.1011 9.0097 118.9417 53.6110 33.8050 173.0421 46 A 4.4031 8.5000 122.9250 51.9000 19.3912 178.6798 47 E 3.8464 8.8911 120.5685 59.4747 29.6853 179.6931 48 A 4.0855 7.8979 120.1100 54.9356 18.5216 177.6744 49 N 4.6809 7.9633 111.1672 54.0335 38.9574 174.9175 50 M 4.6732 7.7372 117.7601 53.2275 34.9898 175.0135 51 S 4.7268 8.4302 116.0855 55.5746 64.2904 173.1103 52 I 4.1433 8.3019 129.2399 61.3660 38.2162 176.3596 53 S 3.4810 9.5985 122.3336 59.7757 60.1771 173.1544 54 G 3.9119 8.1288 103.6877 46.0895 0.0000 173.6328 55 R 4.3808 7.7897 119.2229 54.8759 31.2651 175.4481 56 I 4.6011 7.9908 122.4880 59.4584 38.7820 175.3189 57 H 4.2946 8.9595 123.9767 56.6263 29.5772 174.6014 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 P 0.00 4.52 0.00 2.17 2.29 0.00 3.75 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 2 F 8.70 5.29 0.00 2.99 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 3 I 9.01 4.18 1.78 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.61 0.80 0.00 0.00 4 E 8.25 4.74 0.00 1.20 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 1.89 2.13 0.00 5 C 9.24 4.80 0.00 2.76 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 6 H 8.91 5.46 0.00 3.01 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.68 4.82 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 0.91 0.00 0.00 8 A 8.49 4.61 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 9 T 8.62 4.00 4.23 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 1.21 0.00 0.00 10 G 8.71 3.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.44 4.35 0.00 1.63 1.60 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.29 4.42 0.00 4.04 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 13 V 8.27 3.59 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 0.86 0.00 0.00 0.93 0.00 0.00 14 A 7.97 3.95 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 15 R 7.92 3.82 0.00 1.95 2.09 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 16 K 8.02 3.97 0.00 2.00 1.84 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.58 7.81 17 Q 8.28 4.04 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 18 Q 8.35 3.96 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 19 L 8.17 3.92 0.00 1.89 1.91 0.91 1.32 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 20 I 7.76 3.66 2.02 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 1.41 0.91 0.92 0.00 0.00 21 R 7.95 3.90 0.00 2.09 2.10 0.00 3.09 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 22 D 8.31 4.37 0.00 2.90 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.16 3.56 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 1.01 0.00 0.00 0.99 0.00 0.00 24 I 7.79 3.68 2.04 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 1.42 0.67 0.92 0.00 0.00 25 D 8.16 4.34 0.00 2.79 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.01 3.68 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 0.73 0.00 0.00 1.02 0.00 0.00 27 T 8.08 3.81 4.38 0.00 0.00 0.00 0.00 0.00 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 28 N 8.10 4.76 0.00 2.84 3.08 0.00 0.00 6.78 5.62 0.00 0.00 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 K 7.98 4.12 0.00 1.78 1.85 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.61 7.81 30 S 7.96 4.53 0.00 4.03 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 31 I 7.81 4.27 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 1.70 0.67 0.91 0.00 0.00 32 G 8.08 4.17 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 0.00 0.00 0.00 33 S 7.75 4.27 0.00 3.91 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 34 D 8.60 4.64 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.25 0.00 2.21 2.12 0.00 3.67 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 36 K 8.51 3.95 0.00 2.01 1.90 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.40 7.81 37 I 7.90 4.38 1.88 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 1.50 0.66 0.92 0.00 0.00 38 I 7.59 4.40 1.89 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 1.25 0.74 0.94 0.00 0.00 39 N 9.25 5.16 0.00 2.81 2.78 0.00 0.00 6.01 8.41 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 40 V 8.55 4.97 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 0.77 0.00 0.00 0.95 0.00 0.00 41 L 9.07 4.81 0.00 2.06 1.62 0.99 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.67 5.08 0.00 1.66 1.52 0.91 0.92 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 43 V 8.79 4.45 2.15 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 0.91 0.00 0.00 0.91 0.00 0.00 44 E 8.76 5.21 0.00 1.83 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 2.21 2.29 0.00 45 H 9.01 5.10 0.00 3.02 3.13 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.50 4.40 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 47 E 8.89 3.85 0.00 1.62 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.15 0.00 48 A 7.90 4.09 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 49 N 7.96 4.68 0.00 2.88 2.85 0.00 0.00 6.78 7.09 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 50 M 7.74 4.67 0.00 1.96 1.89 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.33 0.00 51 S 8.43 4.73 0.00 3.77 3.72 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 52 I 8.30 4.14 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.69 0.91 0.00 0.00 53 S 9.60 3.48 0.00 3.97 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 54 G 8.13 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 55 R 7.79 4.38 0.00 2.02 1.85 0.00 3.10 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.85 0.00 56 I 7.99 4.60 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 0.82 0.92 0.00 0.00 57 H 8.96 4.29 0.00 3.06 3.22 0.00 5.95 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00