NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9497 8.3549 109.7377 45.0837 0.0000 173.0782 2 S 4.0615 8.5251 115.2204 58.4305 63.1164 172.3315 3 S 4.6601 8.6681 119.2158 56.8248 67.5229 173.2085 4 G 3.9205 8.7813 107.4534 44.5243 0.0000 173.3494 5 S 4.2501 8.2810 113.3444 58.0419 62.9310 174.2101 6 S 4.1042 8.7786 120.2802 60.9397 62.7052 176.5120 7 G 3.8961 7.9624 106.7113 44.7681 0.0000 172.1260 8 Q 4.6124 8.1669 116.7511 55.7801 29.8944 178.0997 9 T 4.4743 8.1912 114.4672 66.0639 69.2643 175.9053 10 A 4.0435 8.1640 121.9240 55.6683 18.0339 178.7443 11 A 3.8941 8.1547 116.6377 56.1706 18.5679 179.3515 12 L 4.0770 8.0562 115.5709 58.1959 42.0738 179.6140 13 M 3.7999 8.2765 118.0621 58.7087 32.0159 178.5510 14 A 4.3494 8.6496 121.0381 55.8139 18.5541 179.1764 15 H 4.5911 8.0334 115.1424 58.8396 28.8277 177.4497 16 L 4.0673 7.5582 119.4081 58.1896 41.2899 179.5163 17 F 4.7015 7.7746 117.2537 60.0778 39.0282 177.5759 18 E 4.1937 8.2282 117.3478 60.0524 29.3422 178.3548 19 M 4.1361 8.2897 117.3268 56.4980 32.2139 179.0211 20 G 5.0186 6.9592 120.4987 46.5234 0.0000 171.9313 21 F 4.6805 8.1581 119.6607 55.7629 41.4215 176.0533 22 C 5.2022 8.6331 126.5621 59.9126 28.8273 175.1578 23 D 4.8652 7.4595 120.2789 51.5542 41.1700 177.0123 24 R 3.8981 8.2337 121.6060 58.8716 29.7950 178.8349 25 Q 3.9780 7.9863 118.0943 59.2855 28.5868 178.1191 26 L 4.0101 7.8615 120.6014 57.3420 41.8223 178.5310 27 N 4.0439 8.1517 115.6513 57.2010 38.5709 177.1914 28 L 3.6235 7.7315 118.6870 57.9500 41.5658 179.4397 29 R 3.7858 7.4086 117.1178 59.8041 30.2808 178.4034 30 L 3.9948 7.4886 118.3130 57.7163 41.7142 179.0229 31 L 3.5084 7.9785 119.2272 57.8550 41.5160 179.5868 32 K 4.4770 7.5199 115.1812 56.4986 32.1350 177.8837 33 K 4.3214 8.4560 120.2051 57.4281 34.8401 176.6515 34 H 4.8679 7.8472 114.4264 55.1974 29.3995 173.3973 35 N 4.4316 8.8714 114.4502 55.4478 37.0229 172.9301 36 Y 3.5223 8.1001 108.6334 59.1286 36.5067 172.7023 37 N 4.7022 7.9593 118.1529 51.8211 36.8691 174.8770 38 I 3.5960 7.8564 124.6991 64.0587 38.6206 176.2048 39 L 3.9410 7.9189 119.2574 58.0334 41.5458 179.2384 40 Q 3.8964 7.9132 117.1199 58.9994 28.5548 179.0876 41 V 3.4966 8.2096 119.5198 66.0064 31.4264 178.1648 42 V 3.2896 7.9890 118.0865 65.9918 31.2814 177.8961 43 T 3.8148 8.1239 115.0700 66.8413 68.6663 175.6843 44 E 4.0118 8.0915 120.7370 59.2706 29.8917 178.5186 45 L 3.9329 7.3481 118.9990 58.1383 41.4776 179.5259 46 L 4.1499 7.9158 117.3082 58.0146 41.5774 179.5879 47 Q 4.1238 7.8501 116.9414 59.1222 28.8131 178.0126 48 L 4.0448 7.9909 117.7802 57.3533 42.0641 177.6933 49 S 4.2461 7.5208 114.0299 58.7981 63.3012 173.6086 50 G 3.9633 8.8193 110.3339 43.3075 0.0000 172.7433 51 P 4.0397 0.0000 0.0000 64.3899 31.4300 177.2247 52 S 4.3784 7.3191 114.2010 57.5921 60.8035 172.2525 53 S 4.4997 8.5693 119.1682 58.7678 64.3979 174.1232 54 G 3.7586 7.9910 111.7991 45.5685 0.0000 173.1219 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 G 8.35 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 0.00 0.00 0.00 2 S 8.53 4.06 0.00 3.97 3.83 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 3 S 8.67 4.66 0.00 3.81 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 4 G 8.78 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 5 S 8.28 4.25 0.00 3.84 3.79 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 6 S 8.78 4.10 0.00 3.89 3.96 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 7 G 7.96 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 8 Q 8.17 4.61 0.00 1.86 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.88 0.00 0.00 0.00 0.00 0.00 2.19 2.29 0.00 9 T 8.19 4.47 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 1.30 0.00 0.00 10 A 8.16 4.04 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 11 A 8.15 3.89 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 12 L 8.06 4.08 0.00 1.93 1.78 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.28 3.80 0.00 2.20 2.40 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.61 0.00 14 A 8.65 4.35 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.03 4.59 0.00 3.41 3.41 0.00 5.65 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 16 L 7.56 4.07 0.00 1.86 1.63 0.52 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 17 F 7.77 4.70 0.00 3.35 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 18 E 8.23 4.19 0.00 2.29 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 19 M 8.29 4.14 0.00 2.14 2.48 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.67 0.00 20 G 6.96 5.02 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 0.00 0.00 0.00 21 F 8.16 4.68 0.00 2.98 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 22 C 8.63 5.20 0.00 3.00 3.04 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 0.00 23 D 7.46 4.87 0.00 2.73 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.23 3.90 0.00 2.09 2.39 0.00 3.27 0.00 0.00 3.45 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 25 Q 7.99 3.98 0.00 2.29 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.95 0.00 0.00 0.00 0.00 0.00 2.42 2.44 0.00 26 L 7.86 4.01 0.00 1.80 1.66 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.15 4.04 0.00 2.64 2.75 0.00 0.00 6.87 6.33 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 28 L 7.73 3.62 0.00 1.86 1.64 0.94 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.41 3.79 0.00 1.82 2.05 0.00 3.22 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 30 L 7.49 3.99 0.00 1.77 1.63 0.85 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 31 L 7.98 3.51 0.00 1.27 0.37 0.85 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.52 4.48 0.00 1.61 1.76 0.00 1.18 0.00 0.00 1.62 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.38 7.81 33 K 8.46 4.32 0.00 1.68 1.64 0.00 1.19 0.00 0.00 1.21 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.20 1.38 7.81 34 H 7.85 4.87 0.00 3.16 3.20 0.00 5.82 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 N 8.87 4.43 0.00 2.87 2.93 0.00 0.00 7.29 7.57 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 36 Y 8.10 3.52 0.00 3.03 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.96 4.70 0.00 3.00 2.76 0.00 0.00 6.68 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 7.86 3.60 1.91 0.00 0.00 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 1.62 1.44 0.91 0.00 0.00 39 L 7.92 3.94 0.00 1.67 1.65 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 7.91 3.90 0.00 1.98 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.28 0.00 41 V 8.21 3.50 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 0.78 0.00 0.00 0.87 0.00 0.00 42 V 7.99 3.29 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 1.12 0.00 0.00 0.82 0.00 0.00 43 T 8.12 3.81 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 1.18 0.00 0.00 44 E 8.09 4.01 0.00 2.13 2.05 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 2.29 2.36 0.00 45 L 7.35 3.93 0.00 1.44 1.62 0.14 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.92 4.15 0.00 1.80 1.81 0.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 7.85 4.12 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.85 0.00 0.00 0.00 0.00 0.00 2.40 2.64 0.00 48 L 7.99 4.04 0.00 1.78 1.76 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.52 4.25 0.00 3.96 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 50 G 8.82 3.96 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 0.00 0.00 0.00 51 P 0.00 4.04 0.00 2.19 2.19 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 52 S 7.32 4.38 0.00 3.83 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 53 S 8.57 4.50 0.00 3.83 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 54 G 7.99 3.76 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 0.00 0.00 0.00