NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3562 0.0000 0.0000 61.8298 32.6084 175.9339 2 K 3.7024 8.8192 120.6574 56.4383 32.2806 175.2910 3 I 3.7655 9.4193 126.3182 61.8037 38.4983 175.2579 4 K 4.4267 8.5404 124.3672 55.4042 32.8234 177.0369 5 T 4.1955 8.4272 114.4706 61.3216 69.6591 175.8203 6 V 3.9335 8.7037 124.3083 62.6314 29.3604 177.0765 7 R 3.8049 8.0741 124.7173 58.8239 30.9036 177.3230 8 G 3.7263 8.1313 106.5101 48.5190 0.0000 174.8606 9 A 4.3080 8.2970 122.8785 54.7379 18.4815 178.9264 10 A 4.4337 7.8798 115.6327 53.5492 18.2341 177.8436 11 K 4.6338 8.5719 114.6011 56.1248 33.0636 176.9114 12 R 4.4166 8.2550 117.2851 55.0505 32.2190 174.7735 13 F 5.3836 7.9858 114.7495 54.6115 42.6304 175.3756 14 K 4.3591 9.8077 123.9291 54.5654 34.1096 175.4201 15 K 3.2696 8.4500 128.4015 57.3308 32.0272 176.6215 16 T 4.4016 9.2041 122.1390 61.1693 70.2442 175.9017 17 G 3.7846 8.8311 108.0551 47.9574 0.0000 173.3743 18 K 4.5881 7.5307 120.7677 55.6494 33.3595 176.7210 19 G 3.8657 9.6430 104.6186 49.6624 0.0000 173.0626 20 G 3.9734 6.5876 108.0722 44.7201 0.0000 174.6199 21 F 3.7130 9.0855 120.1153 55.7467 40.6593 173.0444 22 K 4.0090 8.4553 125.6518 56.5598 32.0144 173.0890 23 H 5.1649 8.1517 119.1912 52.6588 32.7143 171.9568 24 K 4.5838 8.4325 119.5715 56.0487 33.0966 175.6576 25 H 4.9137 8.6267 122.5543 55.2011 29.7294 175.1942 26 A 4.2442 8.6006 124.6556 52.8170 20.0924 176.0829 27 N 4.2121 9.5992 113.9359 52.9095 34.4395 175.3738 28 L 4.4539 7.2994 112.9073 53.1594 42.8769 175.5456 29 R 4.5933 8.1005 108.8673 56.9345 31.8766 173.5573 30 H 4.7486 8.2104 116.7727 56.5266 32.6647 173.2782 31 I 3.1854 7.9381 118.2506 62.1824 35.2081 172.6249 32 L 4.6222 7.7807 123.4824 54.6320 44.2364 177.6962 33 T 3.9150 8.2024 112.8068 64.4411 67.6473 174.5074 34 K 4.5719 7.6901 119.6800 55.1579 31.9331 175.9409 35 K 4.5489 7.3295 116.1261 54.8764 36.8852 176.7769 36 A 4.0470 8.6084 125.6497 52.5505 18.7236 178.8144 37 T 3.9465 8.5883 114.1890 64.0813 68.7354 176.1807 38 K 4.0081 7.8801 122.3518 58.6182 32.2160 178.4082 39 R 3.8577 7.7792 118.5581 59.3240 30.2888 178.3904 40 K 4.1217 7.9314 117.7935 59.5192 31.9574 179.0564 41 R 3.9172 7.5777 117.3959 59.2442 30.0318 176.7952 42 H 5.0422 7.9362 114.5503 55.9961 30.2936 176.1156 43 L 4.7849 8.1606 120.0131 55.1361 45.1408 178.5999 44 R 3.9721 8.3604 117.1254 58.5072 30.0477 175.1928 45 P 4.2955 0.0000 0.0000 62.1776 31.0850 176.1529 46 K 3.8015 8.4097 123.0058 56.8508 33.0613 177.2093 47 A 3.9250 8.5626 123.2188 52.7833 20.2224 176.1234 48 M 3.1266 7.9418 116.5833 55.0835 34.2461 177.3479 49 V 4.1329 8.1566 116.1922 61.2539 32.7444 175.7952 50 S 4.6600 8.4139 113.2543 58.5136 63.4383 177.2129 51 K 4.1161 8.3565 119.9315 58.3213 30.9013 176.7130 52 G 3.9352 8.3026 105.9222 45.6911 0.0000 174.0110 53 D 4.7950 7.7018 117.2699 53.7454 43.0226 177.6344 54 L 3.6190 7.9113 121.9993 58.0778 42.1255 178.6409 55 G 3.7735 7.9384 102.8297 46.5107 0.0000 173.1518 56 L 4.4913 7.4944 120.1177 54.4045 42.6155 176.6778 57 V 3.8433 7.4648 116.8525 63.3169 33.2283 176.6058 58 I 4.1600 7.3820 117.7559 61.0826 36.8995 175.6918 59 A 4.6159 7.5770 121.9915 51.8619 20.8392 177.1500 60 C 4.4508 7.7665 112.6567 60.3473 29.5776 173.0272 61 L 5.1096 7.7503 119.9157 51.8406 40.9401 174.0712 62 P 4.1785 0.0000 0.0000 65.3611 32.2927 177.6553 63 Y 4.4807 7.6826 115.1436 57.0859 36.8770 175.4758 64 A 4.3793 7.6242 126.0277 52.2885 19.3831 176.6355 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 4.36 0.00 2.21 2.14 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.01 0.00 2 K 8.82 3.70 0.00 1.86 1.88 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.54 7.81 3 I 9.42 3.77 1.95 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.54 0.93 0.00 0.00 4 K 8.54 4.43 0.00 1.78 1.79 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.45 7.81 5 T 8.43 4.20 4.37 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 1.48 0.00 0.00 6 V 8.70 3.93 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 0.95 0.00 0.00 0.95 0.00 0.00 7 R 8.07 3.80 0.00 1.83 1.95 0.00 3.39 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 8 G 8.13 3.73 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 0.00 0.00 0.00 9 A 8.30 4.31 1.53 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 0.00 0.00 10 A 7.88 4.43 1.43 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 11 K 8.57 4.63 0.00 1.76 1.80 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.38 1.72 7.81 12 R 8.25 4.42 0.00 0.87 1.46 0.00 2.98 0.00 0.00 3.06 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.60 0.00 13 F 7.99 5.38 0.00 3.17 3.36 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 14 K 9.81 4.36 0.00 1.67 1.71 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.51 7.81 15 K 8.45 3.27 0.00 1.29 1.49 0.00 1.40 0.00 0.00 1.65 0.00 0.00 2.73 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.18 0.99 7.81 16 T 9.20 4.40 4.22 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 1.25 0.00 0.00 17 G 8.83 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.53 4.59 0.00 1.81 1.63 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.45 7.81 19 G 9.64 3.87 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 0.00 0.00 0.00 20 G 6.59 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 0.00 0.00 0.00 21 F 9.09 3.71 0.00 3.17 3.33 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 22 K 8.46 4.01 0.00 2.00 1.98 0.00 1.66 0.00 0.00 1.87 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.47 7.81 23 H 8.15 5.16 0.00 3.12 3.46 0.00 5.86 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.43 4.58 0.00 1.73 1.71 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.73 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.38 7.81 25 H 8.63 4.91 0.00 3.28 3.18 0.00 5.75 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.60 4.24 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 27 N 9.60 4.21 0.00 2.91 2.96 0.00 0.00 6.69 7.85 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 28 L 7.30 4.45 0.00 1.55 1.58 0.93 1.00 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 29 R 8.10 4.59 0.00 1.91 1.94 0.00 3.10 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 30 H 8.21 4.75 0.00 3.05 3.14 0.00 5.86 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.94 3.19 1.75 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.81 0.82 0.00 0.00 32 L 7.78 4.62 0.00 1.64 1.67 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.20 3.91 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 1.20 0.00 0.00 34 K 7.69 4.57 0.00 1.88 1.82 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.30 1.42 7.81 35 K 7.33 4.55 0.00 1.89 1.68 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.33 1.50 7.81 36 A 8.61 4.05 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 37 T 8.59 3.95 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 1.20 0.00 0.00 38 K 7.88 4.01 0.00 1.80 1.80 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.34 7.81 39 R 7.78 3.86 0.00 1.85 2.16 0.00 3.32 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 40 K 7.93 4.12 0.00 1.84 1.84 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.49 7.81 41 R 7.58 3.92 0.00 1.84 2.12 0.00 3.23 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 42 H 7.94 5.04 0.00 3.34 3.26 0.00 5.67 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.16 4.78 0.00 1.75 1.66 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.36 3.97 0.00 1.81 2.00 0.00 3.22 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 45 P 0.00 4.30 0.00 2.17 2.10 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 46 K 8.41 3.80 0.00 1.97 1.79 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.40 7.81 47 A 8.56 3.92 1.19 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 0.00 0.00 48 M 7.94 3.13 0.00 2.42 2.55 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 49 V 8.16 4.13 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 0.89 0.00 0.00 0.90 0.00 0.00 50 S 8.41 4.66 0.00 4.01 4.09 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 0.00 0.00 0.00 0.00 51 K 8.36 4.12 0.00 1.91 1.98 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.48 7.81 52 G 8.30 3.94 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 0.00 0.00 0.00 53 D 7.70 4.80 0.00 2.63 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 54 L 7.91 3.62 0.00 1.74 1.58 0.84 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.94 3.77 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 0.00 0.00 0.00 56 L 7.49 4.49 0.00 1.58 1.49 0.86 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.46 3.84 0.89 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 -0.25 0.00 0.00 0.24 0.00 0.00 58 I 7.38 4.16 1.80 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 1.22 0.56 0.99 0.00 0.00 59 A 7.58 4.62 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 60 C 7.77 4.45 0.00 2.97 2.93 0.00 0.00 0.00 0.00 0.00 0.00 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 7.75 5.11 0.00 1.82 1.75 1.30 1.04 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 62 P 0.00 4.18 0.00 1.56 1.77 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 63 Y 7.68 4.48 0.00 3.00 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 64 A 7.62 4.38 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