NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2493 8.1744 115.2425 62.0773 68.7697 172.0333 2 D 4.6660 7.9494 121.2325 49.6513 43.4593 174.0221 3 P 4.3943 0.0000 0.0000 64.1387 32.8358 176.7549 4 E 4.0064 7.6613 120.0519 59.3823 29.5321 177.3152 5 E 4.5069 8.1183 114.3874 56.1459 29.6589 175.6210 6 H 4.7845 8.0561 115.8085 54.1806 31.0554 172.3826 7 F 4.9149 8.6196 125.6404 56.6442 42.3079 174.7707 8 D 4.9431 8.3982 125.9069 53.0415 42.6314 170.7259 9 P 4.8482 0.0000 0.0000 61.7445 32.5129 176.5603 10 N 4.6283 8.9442 122.9674 51.7822 39.2008 176.2778 11 T 4.3404 8.2726 110.3197 62.3757 66.4873 173.7882 12 N 4.8905 8.3654 115.7188 52.2098 40.5363 173.5934 13 C 4.4800 7.9439 116.9389 60.2577 32.4238 171.3336 14 D 4.5183 8.2760 119.0909 55.7297 43.0773 175.0744 15 Y 4.1689 7.8126 116.2793 58.3190 38.8439 176.6108 16 T 4.7244 8.3998 113.1623 61.1933 69.0592 173.8531 17 N 5.2418 7.9700 118.1667 51.6024 42.8714 176.0214 18 S 3.9175 9.0965 118.4729 61.8112 63.1214 176.3833 19 Q 3.9245 8.0669 123.3630 58.6530 28.8938 177.7435 20 D 4.3066 8.0600 118.7889 57.2879 40.8960 178.2916 21 A 3.8317 7.5866 120.9164 55.0516 18.3319 179.2365 22 W 4.3383 8.5563 126.5874 60.9123 30.7859 177.6222 23 D 4.4245 8.8546 118.8912 57.8416 40.3655 178.5835 24 Y 4.0565 8.3604 116.8393 61.4502 37.7518 178.3000 25 C 4.1578 8.5258 118.1348 62.6846 27.9394 175.4208 26 T 4.2401 7.5031 108.5447 60.6495 67.6357 174.2369 27 N 4.1658 8.1368 117.5414 54.9427 38.2120 175.2570 28 Y 4.1505 8.1088 119.2299 59.5758 38.9071 175.9124 29 I 4.1524 6.9117 116.8645 58.6967 38.7947 175.3627 30 V 3.5602 8.1841 119.2637 62.0797 31.4563 176.5339 31 N 4.8716 8.4952 118.1696 52.1494 40.3428 174.8292 32 S 3.8369 8.3784 113.2240 59.6067 60.4983 172.3199 33 S 4.6974 8.6389 114.2652 57.9695 64.2886 174.2574 34 C 4.3339 7.8970 115.3652 57.6615 30.4787 172.0286 35 G 3.9790 8.2369 105.7764 44.5429 0.0000 173.8686 36 E 3.9698 9.0350 116.5657 59.3633 29.0293 179.1666 37 I 3.6539 7.7663 120.3304 64.6063 37.3039 177.6663 38 C 4.1790 7.9566 118.8618 62.5826 31.3914 174.9759 39 C 4.1892 8.1862 117.8493 63.3672 27.5550 175.6771 40 N 4.4755 8.3747 116.9824 56.6911 38.4633 176.8720 41 D 4.5686 8.5435 120.1357 56.7463 40.9545 177.8990 42 C 4.5115 8.2701 115.7875 59.5467 28.7558 173.3984 43 F 5.0827 7.7948 117.6793 54.6139 42.7931 174.6170 44 D 4.7340 8.7035 123.0958 54.0873 42.6863 177.4267 45 E 3.9741 8.6827 118.8659 60.0923 27.9529 179.8611 46 T 3.9210 7.9319 115.2970 66.5010 68.6940 176.6801 47 G 3.6219 8.1020 107.0368 48.2460 0.0000 175.1409 48 T 3.8570 8.0131 119.0314 66.4811 68.0565 176.4521 49 G 3.7095 8.2831 107.0276 47.8427 0.0000 175.5664 50 A 4.0825 7.4977 120.3281 55.3090 18.5766 179.3354 51 C 2.6797 7.7750 116.7532 61.9571 31.3961 175.8764 52 R 3.9809 8.5553 119.8965 59.3883 29.8170 178.6104 53 A 4.1081 7.6728 119.2308 55.4305 18.1751 178.9261 54 Q 4.0755 7.7158 114.5043 57.3929 28.8938 176.7446 55 A 4.4316 7.5286 120.4569 54.4138 20.0214 178.3669 56 F 4.0844 8.6653 118.4171 60.4432 40.5859 176.4552 57 G 3.8820 7.6879 103.7881 43.9331 0.0000 170.6814 58 N 4.8523 7.7335 117.7170 54.6072 43.2850 173.3875 59 S 4.4531 7.6271 107.7604 59.7012 64.7211 173.6281 60 C 4.2656 7.5530 119.6291 59.0046 32.0435 173.6053 61 L 4.0384 8.4796 127.3957 57.3464 42.0311 177.0833 62 N 5.0612 7.7294 113.9303 50.7491 42.2766 174.1429 63 W 4.4778 8.9298 118.0119 56.8733 28.4797 175.9857 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 T 8.17 4.25 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 1.01 0.00 0.00 2 D 7.95 4.67 0.00 2.77 2.37 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.39 0.00 2.15 1.75 0.00 3.27 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.44 0.00 4 E 7.66 4.01 0.00 2.00 1.98 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 2.32 2.27 0.00 5 E 8.12 4.51 0.00 2.00 1.90 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 2.24 2.31 0.00 6 H 8.06 4.78 0.00 3.20 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 F 8.62 4.91 0.00 2.95 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.40 4.94 0.00 2.91 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 9 P 0.00 4.85 0.00 2.13 2.21 0.00 3.80 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 10 N 8.94 4.63 0.00 2.90 3.04 0.00 0.00 6.21 6.99 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 11 T 8.27 4.34 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 12 N 8.37 4.89 0.00 2.65 2.93 0.00 0.00 7.01 7.19 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 13 C 7.94 4.48 0.00 3.22 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 D 8.28 4.52 0.00 2.48 2.31 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 15 Y 7.81 4.17 0.00 3.05 2.91 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 16 T 8.40 4.72 4.01 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 1.11 0.00 0.00 17 N 7.97 5.24 0.00 2.81 2.78 0.00 0.00 6.94 7.54 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 18 S 9.10 3.92 0.00 4.03 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 0.00 19 Q 8.07 3.92 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.77 0.00 0.00 0.00 0.00 0.00 2.44 2.70 0.00 20 D 8.06 4.31 0.00 2.61 1.98 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 21 A 7.59 3.83 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 22 W 8.56 4.34 0.00 3.61 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 23 D 8.85 4.42 0.00 3.09 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 24 Y 8.36 4.06 0.00 3.06 3.05 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 0.00 0.00 0.00 0.00 25 C 8.53 4.16 0.00 3.05 2.94 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.50 4.24 4.04 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 0.12 0.00 0.00 27 N 8.14 4.17 0.00 2.99 2.89 0.00 0.00 6.82 7.67 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 28 Y 8.11 4.15 0.00 2.93 3.03 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 29 I 6.91 4.15 1.06 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.11 0.30 0.00 0.00 30 V 8.18 3.56 2.03 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 0.74 0.00 0.00 0.85 0.00 0.00 31 N 8.50 4.87 0.00 2.97 2.81 0.00 0.00 6.57 7.99 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 32 S 8.38 3.84 0.00 4.08 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 33 S 8.64 4.70 0.00 4.02 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 34 C 7.90 4.33 0.00 3.32 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 35 G 8.24 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 36 E 9.03 3.97 0.00 1.95 1.99 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 2.14 2.20 0.00 37 I 7.77 3.65 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 1.51 0.52 0.94 0.00 0.00 38 C 7.96 4.18 0.00 3.20 3.07 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 0.00 0.00 0.00 0.00 39 C 8.19 4.19 0.00 3.15 2.92 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 40 N 8.37 4.48 0.00 2.93 2.91 0.00 0.00 7.19 7.54 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 41 D 8.54 4.57 0.00 2.95 2.76 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 0.00 0.00 0.00 0.00 42 C 8.27 4.51 0.00 2.85 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.79 5.08 0.00 3.10 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 44 D 8.70 4.73 0.00 2.80 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.68 3.97 0.00 2.02 1.99 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 2.38 2.41 0.00 46 T 7.93 3.92 4.29 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 1.14 0.00 0.00 47 G 8.10 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.01 3.86 4.36 0.00 0.00 0.00 0.00 0.00 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 49 G 8.28 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 50 A 7.50 4.08 1.58 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 0.00 0.00 51 C 7.77 2.68 0.00 2.55 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 52 R 8.56 3.98 0.00 2.13 2.41 0.00 3.00 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 53 A 7.67 4.11 1.42 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 54 Q 7.72 4.08 0.00 1.87 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 55 A 7.53 4.43 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.67 4.08 0.00 2.67 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 7.69 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 0.00 0.00 0.00 58 N 7.73 4.85 0.00 2.59 2.80 0.00 0.00 7.36 7.73 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 59 S 7.63 4.45 0.00 3.82 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.55 4.27 0.00 3.01 2.96 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.48 4.04 0.00 1.60 1.64 0.83 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 62 N 7.73 5.06 0.00 2.76 2.80 0.00 0.00 6.93 7.68 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 63 W 8.93 4.48 0.00 3.55 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