NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 39 E 4.4220 8.3033 120.1805 54.3941 31.4824 173.9963 40 I 4.8185 7.6469 121.6640 59.3083 39.9866 173.4061 41 L 4.8599 8.7885 125.6072 52.8748 46.0504 174.9358 42 I 5.0724 8.3716 122.6803 58.2175 40.8695 174.3809 43 E 4.5961 8.5915 127.5723 55.3593 33.2040 174.9176 44 G 4.1813 8.8782 111.0339 46.1544 0.0000 173.3798 45 N 4.9850 8.4687 116.4048 52.1000 43.6078 174.3860 46 R 4.7642 8.0596 116.0921 54.5239 31.9252 175.1442 47 T 5.6223 8.3595 117.6310 61.0448 72.4598 172.7842 48 I 4.6265 8.3417 125.4930 59.6002 40.2032 174.4247 49 I 4.9284 8.5077 126.5188 58.8239 40.1632 176.1933 50 R 4.4864 8.1502 129.6694 55.1760 27.7543 175.9396 51 N 4.8308 7.7970 113.7937 53.9340 40.2370 175.0757 52 F 5.1890 8.3894 124.3127 61.4053 38.9321 175.7329 53 R 3.5621 8.3672 115.5083 60.2162 29.5126 177.4128 54 E 3.8557 8.0521 116.4873 59.6460 29.7788 179.2298 55 L 3.9777 8.1917 118.7691 58.0080 41.6588 179.2854 56 A 4.1901 8.6848 121.1313 55.3539 18.0283 179.6097 57 K 3.8085 7.3927 114.5611 59.6365 32.4673 178.7546 58 A 4.1565 8.3761 121.0852 55.4787 18.1635 179.7439 59 V 3.7498 8.4105 111.3551 65.1559 31.5061 178.3651 60 N 4.0100 7.6050 114.3792 55.7179 38.3726 176.3333 61 R 4.5871 8.1587 118.3771 55.3883 32.6853 174.3613 62 D 4.5725 8.9174 118.7810 54.0825 37.8748 174.7477 63 E 4.0864 8.3314 121.2624 59.4508 29.6718 178.7902 64 E 3.9879 8.4000 119.1798 59.2707 29.3563 178.7726 65 F 4.1567 8.4729 118.3974 61.8310 39.5692 176.1556 66 F 4.0762 8.5724 119.5010 61.3305 39.0842 176.5942 67 A 3.5632 7.9944 119.6161 55.1319 18.2482 179.1636 68 K 3.5270 7.4666 117.7612 60.0696 31.9887 177.8165 69 Y 3.6571 8.2828 117.6731 61.0369 37.8227 178.4439 70 L 3.9608 6.9306 120.6862 58.3461 42.0786 178.9049 71 L 3.8565 7.5836 119.1720 58.0733 41.9011 178.4993 72 K 3.6827 7.8241 117.3508 59.6986 32.0693 178.5573 73 E 4.1322 8.6743 117.8429 60.5050 29.5236 179.1218 74 T 4.0594 7.7470 114.8988 64.1752 68.5412 174.2467 75 G 3.6151 8.6891 115.3174 45.9412 0.0000 175.4297 76 S 4.0689 8.5122 111.2027 59.7755 61.5340 174.9251 77 A 4.7542 5.8000 116.7859 50.3099 23.5341 177.5554 78 G 4.4203 8.5406 105.5723 44.3704 0.0000 171.5085 79 N 5.3006 8.7186 118.7172 51.2605 42.4570 173.0061 80 L 5.1509 8.5713 124.8414 53.9960 43.4739 175.5987 81 E 4.6837 8.6203 120.5000 54.2040 33.3417 175.7241 82 G 4.7863 8.7190 112.6169 43.6860 0.0000 172.8188 83 G 3.3830 6.9137 120.8867 45.8697 0.0000 170.5107 84 R 5.0698 7.3728 116.6880 54.1890 32.7525 174.6062 85 L 4.9105 8.5043 121.7029 54.2966 43.2476 175.2321 86 I 4.9097 8.4175 121.9848 59.3512 40.9928 174.0460 87 L 4.8601 8.5312 127.2072 53.2093 45.1398 174.8690 88 Q 4.5875 8.3706 127.0975 54.2469 30.1854 175.1973 89 R 4.1790 8.4470 126.1943 56.1103 31.1546 177.3841 90 R 4.1071 8.3495 117.6745 56.9953 30.2461 176.7193 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 39 E 8.30 4.42 0.00 1.96 1.94 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 2.32 2.37 0.00 40 I 7.65 4.82 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.71 0.93 0.00 0.00 41 L 8.79 4.86 0.00 1.56 1.51 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.37 5.07 1.88 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 1.36 1.54 0.91 0.00 0.00 43 E 8.59 4.60 0.00 2.05 1.76 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 2.21 2.22 0.00 44 G 8.88 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 N 8.47 4.98 0.00 2.66 2.78 0.00 0.00 6.68 7.66 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 46 R 8.06 4.76 0.00 1.85 2.00 0.00 2.87 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.71 0.00 47 T 8.36 5.62 4.41 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 1.22 0.00 0.00 48 I 8.34 4.63 1.88 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 1.34 0.92 0.92 0.00 0.00 49 I 8.51 4.93 2.09 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 1.15 1.53 1.03 0.00 0.00 50 R 8.15 4.49 0.00 1.85 1.91 0.00 3.33 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 51 N 7.80 4.83 0.00 2.86 2.81 0.00 0.00 6.65 7.82 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 52 F 8.39 5.19 0.00 3.14 3.02 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 53 R 8.37 3.56 0.00 1.87 1.76 0.00 3.22 0.00 0.00 3.29 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 54 E 8.05 3.86 0.00 2.14 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 2.21 2.36 0.00 55 L 8.19 3.98 0.00 1.99 2.14 1.17 1.13 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 56 A 8.68 4.19 1.06 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 0.00 0.00 57 K 7.39 3.81 0.00 1.87 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.41 7.81 58 A 8.38 4.16 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 59 V 8.41 3.75 2.39 0.00 0.00 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 0.00 0.00 1.02 0.00 0.00 60 N 7.61 4.01 0.00 2.83 2.91 0.00 0.00 6.90 7.52 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 61 R 8.16 4.59 0.00 1.73 1.89 0.00 3.28 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 62 D 8.92 4.57 0.00 2.95 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 63 E 8.33 4.09 0.00 2.33 2.60 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 2.45 2.50 0.00 64 E 8.40 3.99 0.00 2.13 2.17 0.00 0.00 0.00 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 2.39 0.00 65 F 8.47 4.16 0.00 3.07 3.37 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 66 F 8.57 4.08 0.00 3.27 3.33 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 67 A 7.99 3.56 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 68 K 7.47 3.53 0.00 1.62 1.61 0.00 1.42 0.00 0.00 1.51 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.04 1.29 7.81 69 Y 8.28 3.66 0.00 2.29 2.90 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 70 L 6.93 3.96 0.00 1.62 1.64 0.97 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 71 L 7.58 3.86 0.00 1.84 1.61 0.84 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.82 3.68 0.00 1.59 1.66 0.00 0.89 0.00 0.00 1.21 0.00 0.00 2.64 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.19 1.19 7.81 73 E 8.67 4.13 0.00 2.12 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 2.41 2.47 0.00 74 T 7.75 4.06 4.31 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 1.22 0.00 0.00 75 G 8.69 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 8.51 4.07 0.00 3.82 3.74 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 0.00 0.00 0.00 77 A 5.80 4.75 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.54 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 0.00 0.00 0.00 0.00 79 N 8.72 5.30 0.00 2.75 2.60 0.00 0.00 6.95 7.08 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 80 L 8.57 5.15 0.00 1.65 1.65 1.06 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.62 4.68 0.00 1.94 1.77 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 2.26 2.18 0.00 82 G 8.72 4.79 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 0.00 0.00 0.00 83 G 6.91 3.38 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 0.00 84 R 7.37 5.07 0.00 1.92 1.79 0.00 3.00 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.52 0.00 85 L 8.50 4.91 0.00 2.12 2.06 1.11 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.42 4.91 1.97 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 1.12 0.97 0.93 0.00 0.00 87 L 8.53 4.86 0.00 1.67 1.48 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.37 4.59 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.59 0.00 0.00 0.00 0.00 0.00 2.49 2.29 0.00 89 R 8.45 4.18 0.00 1.71 1.91 0.00 3.31 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 90 R 8.35 4.11 0.00 1.79 1.83 0.00 3.23 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 1.61 1.61 0.00