NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 D 4.6340 8.3649 120.5330 53.6688 41.1108 174.4749 12 L 3.9127 8.2080 124.4259 52.4902 42.3954 177.2720 13 S 4.5051 8.6124 118.6843 58.0713 66.2944 174.2553 14 F 4.2663 8.7652 121.8585 61.5623 39.1086 177.2576 15 E 3.9566 8.2906 117.9977 59.3642 29.2849 179.1339 16 Q 4.0391 8.2246 118.2281 58.8479 28.7724 178.3784 17 E 3.9178 8.1401 119.6954 59.4097 29.5139 179.1339 18 F 3.9708 7.7895 120.2896 61.4243 39.3891 177.1186 19 Q 3.7529 8.1726 117.5048 59.0538 28.4761 178.4250 20 M 3.9110 8.1729 120.0195 58.7336 32.1897 178.8648 21 R 3.7811 7.6954 117.6589 59.4824 30.1736 179.2968 22 V 3.4165 7.1987 117.6693 66.1569 31.3715 178.0314 23 M 4.1817 8.4570 118.8233 58.3730 31.9268 178.5140 24 E 3.9212 8.7383 119.1155 59.3856 29.3562 179.0498 25 E 3.9767 7.8530 118.2581 58.8169 29.9307 178.5899 26 Q 4.1128 7.7324 118.0587 58.5400 28.9295 178.1578 27 V 3.5709 7.8071 119.5237 66.1523 31.4181 178.0581 28 S 3.9531 7.6956 111.1133 60.2764 62.7196 174.4245 29 A 4.5864 7.5779 123.2429 51.8870 20.0536 176.3401 30 M 4.2191 8.4987 117.1041 55.0061 33.0241 176.6319 31 S 4.5131 8.2753 119.2096 57.5724 65.6597 175.0207 32 L 3.9027 8.4034 123.8528 58.2000 41.6906 179.1510 33 Q 3.9592 7.9339 119.1854 59.2041 29.1306 177.6056 34 E 3.8925 8.3046 120.0940 59.2070 29.4349 178.3926 35 A 3.9533 8.3321 121.1508 55.1575 18.2556 179.9648 36 R 3.9769 7.8746 118.8111 59.9030 30.4010 179.1607 37 E 3.9511 7.9923 118.0713 61.5857 29.7147 181.3028 38 L 4.2502 8.1830 120.0675 57.2572 41.4575 179.4909 39 L 4.0095 7.5841 120.3793 57.7557 41.8921 179.0813 40 L 3.9226 7.9111 119.1368 57.7917 41.6088 178.8399 41 Q 3.9237 8.0786 119.2489 59.5204 28.9469 178.7132 42 A 3.9966 8.1270 121.2318 55.0769 18.1722 179.8408 43 S 4.1109 7.8044 114.0161 61.4737 62.8258 176.5846 44 R 3.8560 8.1961 121.5757 59.5321 29.8935 178.2559 45 L 3.9484 8.0869 118.7460 58.2147 41.7111 179.7746 46 L 4.1152 8.0270 118.4783 57.9887 41.4371 179.5449 47 M 4.1154 7.8025 118.8011 58.3392 31.9463 178.5859 48 M 4.0410 8.2379 119.0297 58.5452 32.1636 179.0548 49 K 4.0252 8.5164 118.8389 59.4972 32.1584 179.2234 50 D 4.3715 8.1800 119.3501 57.2343 40.6835 178.5330 51 N 4.3549 8.2928 117.3446 56.2100 38.5359 177.5918 52 V 3.6043 7.8591 119.6823 66.1166 31.6098 178.1759 53 I 3.7280 7.9742 119.6600 64.3092 36.6759 178.4229 54 R 3.9085 7.9156 118.7720 59.8825 30.1987 178.0897 55 S 4.1370 8.2922 114.9560 61.5681 62.4864 176.3444 56 L 4.1470 8.2721 121.7988 58.2031 41.3364 180.0353 57 V 3.8405 7.5334 117.2505 65.3868 31.4892 177.7058 58 K 4.1482 8.6074 122.4845 59.3597 32.9855 178.1317 59 R 4.4494 7.3127 118.5313 56.2773 27.2536 179.7473 60 A 4.6731 7.5029 118.6598 51.9775 20.7081 177.9153 61 A 4.3647 7.4262 121.7458 49.7879 16.7842 178.6572 62 R 4.1567 7.4853 122.4786 56.4800 31.1596 174.9597 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 11 D 8.36 4.63 0.00 2.68 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 12 L 8.21 3.91 0.00 1.71 1.63 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 13 S 8.61 4.51 0.00 4.13 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 14 F 8.77 4.27 0.00 3.09 3.08 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 0.00 0.00 0.00 0.00 15 E 8.29 3.96 0.00 2.17 2.04 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 2.45 2.49 0.00 16 Q 8.22 4.04 0.00 2.36 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 17 E 8.14 3.92 0.00 1.91 1.97 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 2.66 2.50 0.00 18 F 7.79 3.97 0.00 2.67 3.07 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 0.00 0.00 0.00 0.00 19 Q 8.17 3.75 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.50 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 20 M 8.17 3.91 0.00 1.94 2.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.73 0.00 21 R 7.70 3.78 0.00 1.63 1.84 0.00 3.24 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 22 V 7.20 3.42 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 0.97 0.00 0.00 0.34 0.00 0.00 23 M 8.46 4.18 0.00 2.00 2.21 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 2.57 2.54 0.00 24 E 8.74 3.92 0.00 1.91 1.96 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 2.50 2.34 0.00 25 E 7.85 3.98 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 26 Q 7.73 4.11 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.54 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 27 V 7.81 3.57 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 1.03 0.00 0.00 0.94 0.00 0.00 28 S 7.70 3.95 0.00 4.08 4.16 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 29 A 7.58 4.59 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 30 M 8.50 4.22 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.47 0.00 31 S 8.28 4.51 0.00 4.08 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 32 L 8.40 3.90 0.00 1.77 1.71 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 7.93 3.96 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 34 E 8.30 3.89 0.00 2.08 1.92 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 2.30 2.32 0.00 35 A 8.33 3.95 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.87 3.98 0.00 2.03 1.97 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 37 E 7.99 3.95 0.00 1.99 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 2.25 2.25 0.00 38 L 8.18 4.25 0.00 1.94 1.74 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.58 4.01 0.00 2.00 1.74 0.92 0.52 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 40 L 7.91 3.92 0.00 1.98 1.69 0.92 0.94 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 41 Q 8.08 3.92 0.00 2.13 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 42 A 8.13 4.00 1.35 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 0.00 0.00 0.00 43 S 7.80 4.11 0.00 4.02 3.91 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 44 R 8.20 3.86 0.00 1.87 2.14 0.00 3.12 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 45 L 8.09 3.95 0.00 1.94 1.73 0.92 0.63 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 46 L 8.03 4.12 0.00 1.85 1.72 0.92 0.85 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 47 M 7.80 4.12 0.00 2.01 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.57 0.00 48 M 8.24 4.04 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.59 0.00 49 K 8.52 4.03 0.00 1.75 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.60 7.81 50 D 8.18 4.37 0.00 2.93 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.29 4.35 0.00 2.94 2.86 0.00 0.00 6.58 7.23 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 52 V 7.86 3.60 2.23 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 1.03 0.00 0.00 0.93 0.00 0.00 53 I 7.97 3.73 2.01 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 1.60 0.70 0.91 0.00 0.00 54 R 7.92 3.91 0.00 1.95 2.16 0.00 3.27 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 55 S 8.29 4.14 0.00 4.16 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 56 L 8.27 4.15 0.00 1.75 1.75 0.92 0.93 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 57 V 7.53 3.84 2.25 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 0.79 0.00 0.00 0.99 0.00 0.00 58 K 8.61 4.15 0.00 1.95 1.89 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.44 1.45 7.81 59 R 7.31 4.45 0.00 1.95 1.75 0.00 3.26 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.45 0.00 60 A 7.50 4.67 1.35 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 0.00 0.00 0.00 61 A 7.43 4.36 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 62 R 7.49 4.16 0.00 1.77 1.80 0.00 3.29 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.47 0.00