NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4969 0.0000 0.0000 62.6588 33.3708 174.8058 2 I 4.8965 8.3012 121.7727 59.0045 40.4470 173.0785 3 A 4.7411 9.3129 128.9757 50.0412 22.1315 174.2030 4 Q 4.9964 8.7724 123.6936 54.2619 31.4896 174.5371 5 I 4.5105 8.9486 127.3680 59.8503 40.1679 174.1083 6 H 5.7693 9.0996 124.6383 53.8811 29.8734 174.7019 7 I 4.6403 7.9530 115.3609 58.7616 41.3294 174.6567 8 L 4.6219 8.3257 123.1825 54.4114 42.2885 176.8808 9 E 4.1527 8.6335 120.2915 57.0489 29.8320 175.5142 10 G 3.5296 9.0365 112.9782 46.0921 0.0000 175.0059 11 R 4.1915 7.6371 118.5342 55.9014 30.8980 176.7128 12 S 4.5858 8.2486 115.2962 57.7188 65.6573 175.1886 13 D 4.4132 8.4695 121.7642 57.3228 40.5158 178.9774 14 E 3.9624 8.0654 119.0260 59.4638 29.5111 179.1052 15 Q 4.0297 7.9232 117.7876 58.8283 28.6531 178.9550 16 K 3.9745 8.1217 119.6876 59.2353 32.0566 178.9739 17 E 3.9029 8.4275 119.8704 59.6327 29.4789 179.0814 18 T 3.8433 7.9830 115.6816 66.3784 68.4394 176.1837 19 L 3.9592 8.1823 122.6260 58.4263 42.0740 179.0844 20 I 3.6738 7.9402 119.6877 64.3654 37.0283 178.4939 21 R 3.8360 8.1150 119.3616 59.4429 29.9378 178.3517 22 E 3.9224 8.8638 118.9844 59.5374 29.4186 179.5988 23 V 3.6140 8.1403 118.5841 66.0463 31.4888 178.2042 24 S 4.1112 8.0667 114.9533 61.7024 62.5863 176.5991 25 E 3.9463 8.2760 121.0856 59.1401 29.1987 179.1859 26 A 3.9778 8.3959 121.3066 55.2361 18.4895 179.7775 27 I 3.6452 8.0134 118.5351 64.4981 37.1825 178.5177 28 S 4.1958 8.2166 114.0542 61.5119 61.9750 176.5555 29 R 3.8706 8.0022 119.4724 59.4445 29.9649 178.2057 30 S 4.2574 7.8880 113.3633 61.3419 62.8673 175.5953 31 L 4.3126 7.8623 116.7603 53.8257 42.4735 175.5579 32 D 4.3489 7.9078 117.0056 55.5837 39.6754 172.7958 33 A 4.8389 7.5402 119.8846 49.0660 22.2931 174.9355 34 P 4.3296 0.0000 0.0000 62.5010 31.9268 177.3512 35 L 3.9150 8.7234 124.2210 58.2689 42.1151 178.8025 36 T 4.0216 7.8664 107.3133 63.5010 68.9089 174.9323 37 S 4.4368 7.9230 115.7640 58.5298 63.7715 174.0497 38 V 4.1913 7.3574 122.8358 62.5617 32.0242 175.2506 39 R 4.7617 8.6439 126.4515 54.3516 33.1670 175.0102 40 V 4.8489 8.3368 122.0680 61.1651 34.7434 174.3081 41 I 4.5068 8.9867 128.5904 59.5658 39.8915 174.3681 42 I 4.7334 8.3825 127.7322 59.9712 38.9753 175.0467 43 T 4.4716 8.8664 124.7571 61.7561 70.5367 173.4625 44 E 4.7750 8.7646 126.4786 55.8742 30.9703 175.7754 45 M 4.7832 8.8435 123.3317 53.3130 34.9826 175.6285 46 A 4.4977 8.5172 125.5905 51.5601 19.4462 178.7125 47 K 4.1224 9.1672 121.8600 59.3542 32.2231 178.4301 48 G 3.9167 7.9724 104.9300 46.1745 0.0000 173.4429 49 H 5.0142 8.7351 115.7063 55.0491 29.8100 173.2839 50 F 5.0964 8.2282 122.4707 56.1412 41.7390 173.8573 51 G 4.2050 8.1298 115.7596 43.5117 0.0000 172.0334 52 I 4.1452 8.0302 122.7639 60.0622 39.9624 176.1243 53 G 3.7335 9.8881 112.8451 46.3445 0.0000 174.3320 54 G 3.9401 8.4611 109.1318 44.6842 0.0000 174.1669 55 E 4.5622 7.5795 118.8099 54.3642 31.3920 175.7130 56 L 4.4270 8.0959 120.7709 54.5760 42.4995 178.5254 57 A 4.1194 8.8143 125.2304 55.0087 18.5818 180.3542 58 S 4.1598 8.0733 109.6563 60.7513 63.2642 175.3116 59 K 4.3132 7.7148 119.0326 57.0387 32.2967 177.4045 60 V 4.4586 7.4888 114.9891 60.8900 32.5048 174.7810 61 R 4.6907 8.2465 118.6878 54.5387 34.4010 175.0203 62 R 4.0690 8.4920 118.0310 56.8524 30.0651 176.1196 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 4.50 0.00 2.13 2.24 0.00 3.60 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 1.97 2.01 0.00 2 I 8.30 4.90 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.79 0.90 0.00 0.00 3 A 9.31 4.74 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 4 Q 8.77 5.00 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.64 0.00 0.00 0.00 0.00 0.00 2.14 2.28 0.00 5 I 8.95 4.51 1.83 0.00 0.00 0.84 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 0.48 0.88 0.00 0.00 6 H 9.10 5.77 0.00 2.92 3.08 0.00 5.89 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.95 4.64 1.81 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 1.29 1.27 0.86 0.00 0.00 8 L 8.33 4.62 0.00 1.51 1.63 1.00 1.02 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 9 E 8.63 4.15 0.00 1.96 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 2.27 0.00 10 G 9.04 3.53 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 0.00 11 R 7.64 4.19 0.00 1.78 1.87 0.00 3.24 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 12 S 8.25 4.59 0.00 4.22 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 13 D 8.47 4.41 0.00 2.70 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.07 3.96 0.00 2.05 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 2.39 2.45 0.00 15 Q 7.92 4.03 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 16 K 8.12 3.97 0.00 1.93 1.84 0.00 1.65 0.00 0.00 1.55 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.68 7.81 17 E 8.43 3.90 0.00 2.25 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 2.30 2.35 0.00 18 T 7.98 3.84 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 1.21 0.00 0.00 19 L 8.18 3.96 0.00 1.80 1.89 0.91 0.93 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 20 I 7.94 3.67 2.02 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.58 0.90 0.00 0.00 21 R 8.11 3.84 0.00 1.97 2.06 0.00 3.09 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 1.62 1.66 0.00 22 E 8.86 3.92 0.00 2.02 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 2.51 2.46 0.00 23 V 8.14 3.61 2.14 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 1.11 0.00 0.00 0.94 0.00 0.00 24 S 8.07 4.11 0.00 4.10 3.89 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 0.00 0.00 0.00 0.00 25 E 8.28 3.95 0.00 1.99 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 2.36 2.56 0.00 26 A 8.40 3.98 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 27 I 8.01 3.65 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.98 0.91 0.00 0.00 28 S 8.22 4.20 0.00 3.95 4.05 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 29 R 8.00 3.87 0.00 1.81 1.97 0.00 3.23 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 1.66 1.87 0.00 30 S 7.89 4.26 0.00 4.01 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 31 L 7.86 4.31 0.00 1.72 1.70 0.92 0.83 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 32 D 7.91 4.35 0.00 2.82 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 33 A 7.54 4.84 1.21 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 0.00 0.00 34 P 0.00 4.33 0.00 2.23 2.20 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 35 L 8.72 3.91 0.00 1.74 1.72 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.87 4.02 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 37 S 7.92 4.44 0.00 3.99 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 0.00 38 V 7.36 4.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.98 0.00 0.00 39 R 8.64 4.76 0.00 1.80 1.77 0.00 3.11 0.00 0.00 3.09 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 40 V 8.34 4.85 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 8.99 4.51 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.51 0.87 0.00 0.00 42 I 8.38 4.73 1.84 0.00 0.00 0.84 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 0.53 0.87 0.00 0.00 43 T 8.87 4.47 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 44 E 8.76 4.78 0.00 1.83 1.85 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 2.25 2.30 0.00 45 M 8.84 4.78 0.00 1.94 1.83 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.47 0.00 46 A 8.52 4.50 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 47 K 9.17 4.12 0.00 1.86 1.93 0.00 1.82 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.44 7.81 48 G 7.97 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 49 H 8.74 5.01 0.00 3.23 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.23 5.10 0.00 2.99 2.89 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 0.00 0.00 0.00 0.00 51 G 8.13 4.21 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 0.00 0.00 0.00 52 I 8.03 4.15 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.35 0.84 0.00 0.00 53 G 9.89 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 54 G 8.46 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 55 E 7.58 4.56 0.00 2.03 1.83 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 2.24 2.23 0.00 56 L 8.10 4.43 0.00 1.70 1.59 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.81 4.12 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.07 4.16 0.00 4.00 4.03 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 59 K 7.71 4.31 0.00 1.88 1.89 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.36 7.81 60 V 7.49 4.46 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 0.76 0.00 0.00 0.92 0.00 0.00 61 R 8.25 4.69 0.00 1.98 1.87 0.00 3.39 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 62 R 8.49 4.07 0.00 1.78 1.82 0.00 3.27 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 1.62 1.63 0.00