NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.3894 8.4293 116.7538 55.9553 30.8082 175.3947 20 E 4.0735 7.9478 121.9093 57.2367 30.7711 177.8109 21 I 4.4877 7.8794 117.6073 61.6526 42.5383 178.2372 22 D 4.5322 8.3290 124.5548 58.8284 39.5403 182.4982 23 R 4.1496 7.7587 119.4186 61.5134 29.4454 182.2170 24 L 4.1813 7.8652 120.8692 58.1538 42.1255 178.7351 25 D 4.3636 8.2806 118.7122 57.2074 40.5724 178.5732 26 A 4.1170 8.4220 123.9325 55.4540 18.2065 180.2753 27 E 4.0159 8.1619 117.1952 61.3120 29.9557 182.4711 28 I 3.8808 7.7192 114.5038 63.6056 37.3190 177.8971 29 L 3.8881 8.0120 121.7956 58.0040 41.9429 178.8533 30 A 3.9789 7.6931 120.5270 55.2679 18.2923 179.6604 31 L 3.9734 8.1927 117.6984 57.7502 41.7808 179.9432 32 V 3.5793 8.1116 118.5389 65.9885 31.4217 178.1740 33 K 3.9550 8.2740 118.4596 59.5580 31.7930 179.3299 34 R 4.1916 7.9745 120.2919 58.8188 29.9362 178.5054 35 R 3.8700 8.3006 118.5056 59.2387 30.0063 178.4021 36 A 3.9832 7.9568 120.4001 55.0238 17.8951 179.4311 37 E 3.8747 7.9740 116.8318 59.6488 29.6148 179.8367 38 V 3.6343 7.9816 118.3529 65.9964 31.4555 177.9741 39 S 4.1096 8.3987 113.2329 61.3301 62.1782 176.2869 40 K 3.9688 8.1453 121.0254 59.4376 31.9206 179.1874 41 A 3.9992 8.0309 121.0348 55.1581 18.1782 179.8194 42 I 3.8050 8.0448 118.6094 64.4117 37.2094 178.8675 43 G 3.6027 8.0872 106.6377 47.8004 0.0000 175.9609 44 K 4.0290 8.3672 120.8697 58.9262 32.1161 179.4154 45 A 3.9620 7.9017 120.7423 55.1965 18.4273 179.7296 46 R 3.9408 8.0782 118.7187 59.3219 30.1659 178.6823 47 M 4.3278 8.3278 119.6241 57.8193 31.7474 178.6156 48 A 4.0994 8.3289 120.6869 54.4984 18.8401 178.7600 49 S 4.5246 8.0390 111.0071 57.7782 64.3004 173.7485 50 G 3.6963 8.5248 109.0255 46.1651 0.0000 171.8118 51 G 4.2100 8.0635 107.1438 44.0046 0.0000 170.4217 52 T 4.4215 8.1435 108.9630 60.0879 70.1629 174.6057 53 R 4.0015 8.7991 125.6789 59.3883 30.1390 176.4310 54 L 4.5143 7.6242 116.1558 53.4836 43.0453 176.8549 55 V 4.3293 7.9563 120.7047 59.3754 33.7607 175.2949 56 H 4.1301 9.1749 125.3293 59.3288 29.6125 177.1334 57 S 4.1495 8.0723 115.2914 61.3621 62.8389 176.4384 58 R 3.9872 7.8624 121.6212 58.9106 29.9054 178.6763 59 E 4.0415 8.0781 118.1692 59.4907 29.4870 178.9670 60 M 4.0874 7.9526 118.8060 58.1537 31.9438 179.0154 61 K 3.9605 7.7495 118.9397 59.4478 32.0451 179.5292 62 V 3.7073 7.5559 117.3372 66.0579 31.6023 177.9250 63 I 3.9681 7.7787 119.3879 64.4313 36.4948 178.0547 64 E 3.9889 8.4800 120.3237 59.1249 29.1623 178.6720 65 R 3.8348 7.9086 118.2742 58.9644 30.3852 177.0913 66 Y 4.4918 7.7287 113.9932 57.8426 38.4306 177.3312 67 S 4.3600 7.8051 115.9148 60.6894 62.8598 176.0545 68 E 4.0613 8.0947 121.5931 59.1180 29.3508 178.2671 69 L 4.2174 7.7599 117.7607 57.0619 42.2348 176.7542 70 G 3.8547 8.1956 104.9391 43.4805 0.0000 172.0456 71 P 4.2491 0.0000 0.0000 65.3290 31.5887 177.1403 72 D 4.5634 8.1138 116.8312 55.3902 41.6190 178.4180 73 G 3.7700 8.3750 107.6546 47.8732 0.0000 175.8251 74 K 3.9934 8.0754 121.4090 59.6793 32.5942 178.6858 75 D 4.2905 7.9989 119.5471 56.8730 40.7025 178.3252 76 L 3.7632 7.8284 120.5700 57.8888 42.0304 178.5766 77 A 3.6820 7.9101 121.0406 55.4978 18.2907 179.7779 78 I 3.6240 7.9716 118.3255 64.3114 37.2301 178.5258 79 L 3.9273 7.8055 121.0839 58.0782 42.0280 179.0627 80 L 4.0039 8.1863 119.4047 57.6113 41.4641 179.4499 81 L 4.0253 8.1771 119.2897 57.8046 41.4676 179.6734 82 R 3.9603 8.1628 118.1034 59.3398 29.7665 179.1652 83 L 4.1532 7.7267 117.6001 57.4310 41.6330 179.6135 84 G 3.9227 8.1643 106.3791 46.5975 0.0000 174.9458 85 R 4.3817 8.0780 116.2418 54.5623 29.6860 177.2769 86 G 3.9308 7.6772 108.9979 44.8634 0.0000 173.8590 87 R 4.1948 8.0388 116.8846 55.2997 30.7598 176.7233 88 L 3.9963 8.2732 121.7270 56.4153 42.0817 177.9832 89 G 3.9213 9.0268 110.1904 45.5850 0.0000 173.2061 90 H 4.4806 7.5687 120.2793 55.9021 29.2704 173.4211 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 19 E 8.43 4.39 0.00 2.01 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 2.13 1.88 0.00 20 E 7.95 4.07 0.00 2.22 2.24 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 2.36 2.36 0.00 21 I 7.88 4.49 1.78 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 1.28 1.41 0.91 0.00 0.00 22 D 8.33 4.53 0.00 2.72 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.76 4.15 0.00 1.86 1.96 0.00 3.24 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 24 L 7.87 4.18 0.00 1.75 1.88 0.93 1.27 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 25 D 8.28 4.36 0.00 2.90 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 26 A 8.42 4.12 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 27 E 8.16 4.02 0.00 2.02 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 2.24 2.18 0.00 28 I 7.72 3.88 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.63 0.93 0.00 0.00 29 L 8.01 3.89 0.00 1.88 1.93 0.92 1.02 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 30 A 7.69 3.98 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 31 L 8.19 3.97 0.00 1.85 1.75 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.11 3.58 2.27 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 1.02 0.00 0.00 0.98 0.00 0.00 33 K 8.27 3.96 0.00 2.00 1.85 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.58 7.81 34 R 7.97 4.19 0.00 2.03 2.09 0.00 3.26 0.00 0.00 3.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 35 R 8.30 3.87 0.00 2.09 2.03 0.00 3.22 0.00 0.00 3.20 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 36 A 7.96 3.98 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.97 3.87 0.00 2.20 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 2.33 2.49 0.00 38 V 7.98 3.63 2.09 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 1.00 0.00 0.00 0.97 0.00 0.00 39 S 8.40 4.11 0.00 4.00 3.86 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 0.00 0.00 0.00 40 K 8.15 3.97 0.00 2.01 1.85 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.49 1.67 7.81 41 A 8.03 4.00 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 42 I 8.04 3.81 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.72 0.92 0.00 0.00 43 G 8.09 3.60 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 0.00 44 K 8.37 4.03 0.00 1.81 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.68 7.81 45 A 7.90 3.96 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 46 R 8.08 3.94 0.00 2.04 1.94 0.00 3.38 0.00 0.00 3.27 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 47 M 8.33 4.33 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.53 0.00 48 A 8.33 4.10 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 49 S 8.04 4.52 0.00 4.10 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 50 G 8.52 3.70 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 0.00 0.00 0.00 51 G 8.06 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 T 8.14 4.42 4.25 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 1.21 0.00 0.00 53 R 8.80 4.00 0.00 1.79 2.02 0.00 3.23 0.00 0.00 3.38 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 54 L 7.62 4.51 0.00 1.68 1.59 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.96 4.33 2.09 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 0.81 0.00 0.00 0.94 0.00 0.00 56 H 9.17 4.13 0.00 3.26 3.37 0.00 5.87 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 8.07 4.15 0.00 4.08 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 58 R 7.86 3.99 0.00 2.00 2.02 0.00 3.13 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 59 E 8.08 4.04 0.00 2.11 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 2.40 2.58 0.00 60 M 7.95 4.09 0.00 2.02 2.19 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.65 0.00 61 K 7.75 3.96 0.00 1.90 1.85 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.53 7.81 62 V 7.56 3.71 2.13 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 0.99 0.00 0.00 1.04 0.00 0.00 63 I 7.78 3.97 2.03 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 1.43 1.30 0.94 0.00 0.00 64 E 8.48 3.99 0.00 2.20 1.95 0.00 0.00 0.00 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 2.36 0.00 65 R 7.91 3.83 0.00 2.02 1.93 0.00 3.16 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.52 0.00 66 Y 7.73 4.49 0.00 3.02 3.01 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 67 S 7.81 4.36 0.00 4.10 4.15 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 68 E 8.09 4.06 0.00 1.95 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 2.30 2.38 0.00 69 L 7.76 4.22 0.00 1.82 1.77 1.12 1.08 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 70 G 8.20 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 71 P 0.00 4.25 0.00 2.06 2.15 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 72 D 8.11 4.56 0.00 2.74 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.37 3.77 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 0.00 0.00 0.00 74 K 8.08 3.99 0.00 2.00 2.11 0.00 1.52 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.54 7.81 75 D 8.00 4.29 0.00 2.84 2.73 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 76 L 7.83 3.76 0.00 1.65 1.63 0.77 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.91 3.68 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.97 3.62 1.84 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 0.64 0.90 0.00 0.00 79 L 7.81 3.93 0.00 1.86 1.76 0.88 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.19 4.00 0.00 1.78 1.67 0.69 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.18 4.03 0.00 1.84 1.71 0.92 1.10 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 82 R 8.16 3.96 0.00 2.02 1.97 0.00 3.11 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 83 L 7.73 4.15 0.00 1.78 1.72 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.16 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 85 R 8.08 4.38 0.00 1.86 2.00 0.00 3.37 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 86 G 7.68 3.93 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 0.00 0.00 0.00 87 R 8.04 4.19 0.00 1.95 1.91 0.00 3.09 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 88 L 8.27 4.00 0.00 1.62 1.61 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 89 G 9.03 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 90 H 7.57 4.48 0.00 3.16 3.16 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00