NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3896 8.1127 119.6552 56.1661 32.3744 173.6228 5 E 4.7334 8.3678 120.0591 53.2705 32.6306 173.3171 6 C 4.4220 9.2252 127.0875 59.6987 33.2880 173.1383 7 D 4.7745 8.8221 125.6911 54.8740 39.6996 175.9588 8 Y 4.5816 7.1441 117.1462 59.0656 41.5950 176.1055 9 C 3.8833 8.1023 119.0381 60.3433 32.2449 175.5853 10 G 4.0350 8.0090 106.4998 44.8241 0.0000 173.3204 11 T 4.2446 7.5518 110.5051 61.0077 70.4464 173.8726 12 D 4.7738 8.7771 123.8999 55.3603 41.4442 175.9870 13 I 4.2598 8.2529 124.5145 59.9807 38.7102 175.5522 14 E 4.0296 8.8002 128.2173 54.9809 30.0293 174.1372 15 P 4.2413 0.0000 0.0000 64.4387 31.6059 176.3243 16 G 3.9206 10.4864 110.7359 45.7194 0.0000 172.9851 17 T 4.4769 7.5875 113.7369 62.3713 72.7748 172.9059 18 G 4.1226 8.3475 110.9968 44.0423 0.0000 172.7290 19 T 4.7045 8.5278 115.3753 61.8518 72.4765 173.5450 20 M 4.6224 8.7227 125.1399 53.6760 33.0895 174.3709 21 F 4.7644 9.2311 128.7455 57.8025 41.1668 173.9193 22 V 4.5081 7.4836 124.8538 61.2723 33.3041 175.1115 23 H 4.2432 8.4397 125.5532 54.5119 29.6752 176.4269 24 K 4.0591 8.4397 121.3862 59.4058 32.2052 177.6160 25 D 4.4324 8.0008 117.8393 55.7409 39.7611 175.8331 26 G 3.3172 7.5333 108.9534 44.9648 0.0000 173.8857 27 A 4.0772 7.8531 124.1115 53.0784 18.9038 176.0483 28 T 5.1166 8.2668 116.0694 62.0590 71.4882 174.0581 29 T 4.6894 8.7100 121.6986 61.0365 72.5122 172.5818 30 H 5.2505 8.8780 124.4220 54.8385 30.4147 174.4170 31 F 5.3338 9.0729 122.4582 55.9862 41.1806 176.5257 32 C 4.4475 9.0684 116.2851 59.5163 30.6967 173.8877 33 S 4.6967 7.6422 114.5382 56.0889 66.7164 174.9952 34 S 4.2056 8.5638 117.4172 61.0622 62.8793 176.4566 35 K 3.8572 7.9434 123.1879 59.6800 31.8892 178.4095 36 C 4.2921 7.9711 117.0652 62.7279 28.1020 175.7467 37 E 2.7544 7.5833 119.6910 59.3655 28.6607 179.4019 38 N 4.3088 7.8431 115.6908 55.8332 38.5516 177.1153 39 N 4.2810 7.9142 117.2971 55.3912 38.1629 176.8063 40 A 4.3005 7.3144 122.0356 54.2540 19.0523 178.8762 41 D 4.4007 7.8725 116.0411 56.5151 40.8408 178.3390 42 L 4.3059 7.3261 119.4154 57.7071 41.9528 176.5114 43 G 3.5478 6.9226 104.9605 45.1152 0.0000 173.9093 44 R 4.3851 7.4477 119.0965 55.3340 31.3074 175.6403 45 E 4.6777 8.4433 119.4711 54.2324 30.1853 177.1168 46 A 3.4132 8.3757 126.2411 55.0336 18.5840 179.9700 47 R 3.9667 7.7721 113.9579 59.4365 30.2846 177.9540 48 N 4.3716 7.8165 114.0237 55.5069 38.9061 175.4518 49 L 4.1002 7.1742 118.2662 54.0432 41.6272 177.4818 50 E 3.9013 8.9013 124.6887 59.1201 29.5174 178.8494 51 W 4.3663 7.9563 113.5131 58.5893 28.7680 176.3248 52 T 3.7190 6.7418 117.5803 62.9947 68.6511 175.5272 53 D 4.4033 8.5613 125.5418 57.4825 41.3300 178.8688 54 T 3.7205 7.3903 115.5471 66.4117 68.3892 175.3757 55 A 4.0918 7.4197 121.6899 53.4006 18.9631 177.4834 56 R 4.1859 7.4169 119.2560 56.2225 30.2669 176.1583 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 4 R 8.11 4.39 0.00 1.76 1.87 0.00 2.95 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 5 E 8.37 4.73 0.00 1.94 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.41 0.00 6 C 9.23 4.42 0.00 3.06 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 7 D 8.82 4.77 0.00 2.66 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 8 Y 7.14 4.58 0.00 2.71 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 9 C 8.10 3.88 0.00 3.14 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 10 G 8.01 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 0.00 0.00 0.00 0.00 11 T 7.55 4.24 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 1.31 0.00 0.00 12 D 8.78 4.77 0.00 2.60 2.68 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 13 I 8.25 4.26 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.60 0.95 0.00 0.00 14 E 8.80 4.03 0.00 2.06 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 2.39 2.37 0.00 15 P 0.00 4.24 0.00 2.22 2.06 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 16 G 10.49 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 17 T 7.59 4.48 4.50 0.00 0.00 0.00 0.00 0.00 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 18 G 8.35 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 0.00 0.00 0.00 19 T 8.53 4.70 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 20 M 8.72 4.62 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 21 F 9.23 4.76 0.00 3.31 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.48 4.51 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 0.77 0.00 0.00 0.92 0.00 0.00 23 H 8.44 4.24 0.00 3.41 3.16 0.00 5.67 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.44 4.06 0.00 1.72 1.85 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.42 7.81 25 D 8.00 4.43 0.00 2.81 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 26 G 7.53 3.32 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 0.00 27 A 7.85 4.08 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 28 T 8.27 5.12 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 1.10 0.00 0.00 29 T 8.71 4.69 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 0.75 0.00 0.00 30 H 8.88 5.25 0.00 3.13 3.26 0.00 5.77 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.07 5.33 0.00 3.05 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 32 C 9.07 4.45 0.00 3.15 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 7.64 4.70 0.00 4.05 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 34 S 8.56 4.21 0.00 3.98 4.10 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 35 K 7.94 3.86 0.00 1.79 1.86 0.00 1.46 0.00 0.00 1.62 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.63 1.38 7.81 36 C 7.97 4.29 0.00 3.37 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.58 2.75 0.00 1.69 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 1.47 2.22 0.00 38 N 7.84 4.31 0.00 2.67 2.79 0.00 0.00 7.15 6.94 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 39 N 7.91 4.28 0.00 3.19 3.12 0.00 0.00 6.68 7.13 0.00 0.00 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 A 7.31 4.30 1.20 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 0.00 0.00 41 D 7.87 4.40 0.00 2.56 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 42 L 7.33 4.31 0.00 1.48 1.74 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 43 G 6.92 3.55 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 0.00 0.00 0.00 44 R 7.45 4.39 0.00 2.33 1.98 0.00 3.28 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 45 E 8.44 4.68 0.00 1.98 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 2.33 2.29 0.00 46 A 8.38 3.41 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.77 3.97 0.00 1.74 1.92 0.00 3.16 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 48 N 7.82 4.37 0.00 2.71 2.85 0.00 0.00 7.13 7.87 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 49 L 7.17 4.10 0.00 1.11 0.93 1.03 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.90 3.90 0.00 2.03 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 2.31 2.31 0.00 51 W 7.96 4.37 0.00 3.58 3.25 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 52 T 6.74 3.72 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 0.86 0.00 0.00 53 D 8.56 4.40 0.00 2.93 2.68 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 54 T 7.39 3.72 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 55 A 7.42 4.09 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 56 R 7.42 4.19 0.00 1.93 1.82 0.00 3.21 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00