NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2483 8.4444 120.2260 56.8270 30.8064 173.7149 2 T 4.4190 7.1363 114.1926 59.5243 70.6860 173.1663 3 S 4.1879 9.2463 120.8847 61.4971 63.6178 176.2439 4 E 4.0113 8.1995 121.0402 59.3350 28.9354 179.0768 5 E 3.9303 7.7385 117.8681 59.5165 29.7621 179.1187 6 R 4.0049 7.9845 117.9532 59.2506 30.0339 178.2296 7 A 3.9889 8.1758 120.6430 54.8702 18.3523 179.3706 8 A 3.9536 8.0253 119.2452 54.9570 18.2377 179.9089 9 R 3.8003 7.7225 117.7912 59.7297 29.8022 178.7596 10 L 3.9699 7.9285 118.0576 57.6031 41.7368 179.0326 11 A 4.3543 7.7776 122.0378 53.7789 18.5756 179.5744 12 K 3.9573 8.5310 118.8873 59.6885 32.3555 178.8608 13 M 4.1187 8.3662 119.0829 58.6767 32.0958 178.4354 14 S 4.1934 7.9172 113.7446 61.2579 63.1276 176.3677 15 A 4.0192 8.0303 124.4029 55.1505 17.8664 178.9923 16 Y 4.2008 8.1922 117.9117 60.6172 38.8620 177.7867 17 A 3.8825 8.0240 120.9337 54.3749 18.8086 179.3414 18 A 3.9902 8.2644 119.6756 54.9784 18.2481 179.4776 19 Q 3.9776 8.0433 117.5406 58.9425 29.2103 177.5542 20 R 3.9799 7.3388 119.2223 58.6957 30.2785 177.8346 21 L 3.9486 7.9444 119.7749 57.2412 42.7929 178.1766 22 A 4.3206 8.2174 117.7404 52.2744 16.0132 176.6722 23 N 4.5165 8.2133 122.2479 54.3639 37.6031 174.8649 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 E 8.44 4.25 0.00 1.97 2.01 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 2.21 2.30 0.00 2 T 7.14 4.42 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 1.21 0.00 0.00 3 S 9.25 4.19 0.00 3.90 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 4 E 8.20 4.01 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 5 E 7.74 3.93 0.00 2.11 2.01 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 2.34 2.46 0.00 6 R 7.98 4.00 0.00 1.87 2.06 0.00 3.18 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 7 A 8.18 3.99 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 0.00 0.00 0.00 0.00 0.00 8 A 8.03 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.72 3.80 0.00 1.85 2.04 0.00 3.10 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 1.67 0.00 10 L 7.93 3.97 0.00 1.87 1.71 1.04 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.78 4.35 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 12 K 8.53 3.96 0.00 1.92 1.96 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.44 7.81 13 M 8.37 4.12 0.00 2.20 2.19 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 2.67 2.63 0.00 14 S 7.92 4.19 0.00 4.11 4.12 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 0.00 0.00 0.00 0.00 15 A 8.03 4.02 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 16 Y 8.19 4.20 0.00 3.12 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 17 A 8.02 3.88 1.33 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 0.00 0.00 18 A 8.26 3.99 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 19 Q 8.04 3.98 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 20 R 7.34 3.98 0.00 1.68 1.65 0.00 3.25 0.00 0.00 2.80 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.54 0.00 21 L 7.94 3.95 0.00 1.72 1.62 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.22 4.32 1.37 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 0.00 0.00 23 N 8.21 4.52 0.00 2.81 2.79 0.00 0.00 6.11 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