NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4934 0.0000 0.0000 62.7112 33.6850 174.5760 2 F 5.2793 8.7812 122.3717 56.3461 41.3903 172.5643 3 I 4.2561 9.6939 129.7743 59.4893 39.7987 174.0893 4 E 4.7953 8.3459 126.4854 54.5652 31.7878 175.0723 5 C 4.6892 9.1176 122.5920 58.2468 31.0308 172.5991 6 H 5.4711 8.8510 121.8396 54.2535 29.7952 174.1953 7 I 4.8535 8.7934 116.3320 58.5827 41.5818 174.5481 8 A 4.7982 8.5414 124.3981 51.8052 18.9112 177.6916 9 T 3.9307 8.3276 111.3921 62.2625 69.1291 173.2820 10 G 3.6094 8.9986 112.1848 45.8163 0.0000 174.8779 11 L 4.1714 7.6472 120.1965 54.2294 42.4633 177.5882 12 S 4.3672 8.3358 116.6119 58.0483 65.1445 175.5812 13 V 3.5419 8.3040 121.9861 66.2914 31.3359 178.1579 14 A 4.0009 7.9594 119.9640 55.1854 18.1825 179.4475 15 R 3.8967 7.9963 117.3104 59.1863 30.1075 178.8720 16 K 3.9382 8.2133 118.5037 59.6522 32.0831 179.1846 17 Q 4.0009 8.1582 118.2133 59.0746 28.5320 178.8946 18 Q 3.9304 8.1758 120.5258 58.8989 29.0396 177.7432 19 L 3.9290 8.2634 121.8483 58.4148 42.0893 179.1311 20 I 3.7092 7.8855 119.4714 64.4430 37.0028 178.5163 21 R 3.9431 8.1310 118.9228 59.6064 29.8697 178.9286 22 D 4.3539 8.5055 118.9113 57.0000 40.7640 178.9388 23 V 3.5612 8.1749 119.3411 66.0994 31.4979 178.0448 24 I 3.6846 7.8243 119.4523 64.3977 36.9511 177.8489 25 D 4.2984 8.2335 118.7297 57.6711 41.1508 178.8474 26 V 3.7333 8.0191 112.5648 64.1065 31.5000 178.9487 27 T 3.8262 7.8877 116.0360 66.5745 68.3545 176.0592 28 N 4.4979 8.1740 120.3725 56.2348 38.7190 177.0282 29 K 4.0423 8.0201 118.7608 59.1488 32.1680 179.0879 30 S 4.4234 7.9567 113.9525 59.9832 63.5566 174.9582 31 I 4.2902 7.5674 111.9744 59.5492 38.2884 176.2822 32 G 3.9158 8.2988 109.3304 45.6327 0.0000 174.0861 33 S 4.1557 7.7492 116.7507 57.9535 63.4888 173.2759 34 D 4.5700 8.7771 124.4810 54.0543 41.4908 175.3982 35 P 4.2727 0.0000 0.0000 65.1008 31.4932 177.5891 36 K 4.4096 8.5926 116.5684 56.7769 32.1852 177.1244 37 I 4.4292 7.9444 112.1140 60.3765 37.7098 174.7603 38 I 4.6243 7.3954 121.6370 60.3803 38.4155 174.8737 39 N 5.1854 9.3274 124.7205 51.3979 41.8319 173.7904 40 V 5.0324 8.5001 121.8251 61.0551 35.1516 174.1351 41 L 4.8105 9.0384 128.8018 53.1999 45.1992 174.4562 42 L 4.9741 8.6585 128.2757 53.4733 43.6525 175.2359 43 V 4.3962 9.0018 126.8332 61.1220 33.9331 173.8660 44 E 5.1841 8.7108 126.8723 55.0445 31.8783 175.0279 45 H 5.0739 9.0112 119.3082 53.4407 33.6037 173.0661 46 A 4.3647 8.6088 123.7171 52.2687 19.1749 178.5499 47 E 3.8166 8.9718 121.3387 59.4874 29.6721 179.5123 48 A 4.0554 7.9012 119.8632 54.8669 18.4283 177.5455 49 N 4.7733 8.1546 111.6646 53.4277 38.8535 174.7901 50 M 4.7314 7.9130 118.2662 53.3326 35.1461 174.9431 51 S 4.6604 8.5581 116.5574 56.4935 65.2462 172.7891 52 I 4.3910 8.2731 128.1129 60.8427 38.9271 175.8658 53 S 3.8090 9.6222 120.3269 59.7513 60.2601 173.4701 54 G 3.9221 8.3796 105.1739 45.8127 0.0000 174.5067 55 R 4.1770 7.8095 118.8640 55.4970 30.8149 175.9825 56 I 4.3321 8.0378 122.7300 59.3425 38.5404 175.1485 57 H 4.0414 8.8135 125.2864 58.0021 31.6018 171.9510 58 G 3.6910 8.8699 117.0149 43.5104 0.0000 172.8567 59 E 4.0453 9.2544 122.0436 56.6041 30.6537 172.9163 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 4.49 0.00 2.16 2.28 0.00 3.70 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 1.99 1.99 0.00 2 F 8.78 5.28 0.00 2.98 3.01 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 0.00 0.00 0.00 3 I 9.69 4.26 1.83 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 1.18 0.61 0.83 0.00 0.00 4 E 8.35 4.80 0.00 1.55 1.59 0.00 0.00 0.00 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 1.47 0.00 5 C 9.12 4.69 0.00 2.73 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 8.85 5.47 0.00 3.00 3.27 0.00 5.84 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.79 4.85 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 0.88 0.91 0.00 0.00 8 A 8.54 4.80 1.24 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 0.00 0.00 9 T 8.33 3.93 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 1.24 0.00 0.00 10 G 9.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.65 4.17 0.00 1.62 1.61 0.92 0.87 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 12 S 8.34 4.37 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 8.30 3.54 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 1.04 0.00 0.00 0.93 0.00 0.00 14 A 7.96 4.00 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 8.00 3.90 0.00 1.95 2.05 0.00 3.15 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 16 K 8.21 3.94 0.00 2.05 1.84 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.66 7.81 17 Q 8.16 4.00 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 18 Q 8.18 3.93 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 19 L 8.26 3.93 0.00 1.87 1.87 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.89 3.71 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 1.53 0.75 0.92 0.00 0.00 21 R 8.13 3.94 0.00 2.02 1.99 0.00 3.28 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.93 0.00 22 D 8.51 4.35 0.00 2.86 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 23 V 8.17 3.56 2.22 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 1.02 0.00 0.00 0.95 0.00 0.00 24 I 7.82 3.68 2.03 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 0.50 0.92 0.00 0.00 25 D 8.23 4.30 0.00 2.87 2.81 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 26 V 8.02 3.73 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 1.02 0.00 0.00 27 T 7.89 3.83 4.42 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 1.22 0.00 0.00 28 N 8.17 4.50 0.00 2.89 3.03 0.00 0.00 6.77 5.90 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 29 K 8.02 4.04 0.00 1.78 1.86 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.55 7.81 30 S 7.96 4.42 0.00 4.04 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 31 I 7.57 4.29 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 1.45 0.75 0.91 0.00 0.00 32 G 8.30 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 4.16 0.00 3.91 3.82 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 34 D 8.78 4.57 0.00 2.67 2.56 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 0.00 0.00 0.00 0.00 35 P 0.00 4.27 0.00 2.22 2.10 0.00 3.64 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 36 K 8.59 4.41 0.00 1.73 1.84 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.52 7.81 37 I 7.94 4.43 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 1.39 0.67 0.91 0.00 0.00 38 I 7.40 4.62 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 0.81 0.94 0.00 0.00 39 N 9.33 5.19 0.00 2.74 2.72 0.00 0.00 5.95 7.97 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 40 V 8.50 5.03 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 0.83 0.00 0.00 0.96 0.00 0.00 41 L 9.04 4.81 0.00 2.01 1.56 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.66 4.97 0.00 1.65 1.54 0.95 0.91 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 43 V 9.00 4.40 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 0.96 0.00 0.00 0.90 0.00 0.00 44 E 8.71 5.18 0.00 1.82 1.80 0.00 0.00 0.00 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 2.27 0.00 45 H 9.01 5.07 0.00 3.03 3.12 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 8.61 4.36 1.25 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 0.00 0.00 0.00 47 E 8.97 3.82 0.00 1.63 1.67 0.00 0.00 0.00 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 2.19 0.00 48 A 7.90 4.06 1.30 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 0.00 0.00 0.00 49 N 8.15 4.77 0.00 2.85 2.84 0.00 0.00 6.77 8.05 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 50 M 7.91 4.73 0.00 1.94 1.90 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 2.67 2.35 0.00 51 S 8.56 4.66 0.00 3.78 3.68 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 4.39 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 0.89 0.91 0.00 0.00 53 S 9.62 3.81 0.00 3.98 3.92 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 4.18 0.00 1.95 1.87 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 1.65 1.83 0.00 56 I 8.04 4.33 2.02 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 0.83 0.92 0.00 0.00 57 H 8.81 4.04 0.00 3.07 3.26 0.00 5.90 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 58 G 8.87 3.69 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 0.00 0.00 0.00 59 E 9.25 4.05 0.00 2.28 1.86 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 2.19 2.33 0.00