NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1829 8.2229 123.5825 53.2984 19.8282 177.1793 1 N 4.1631 8.7951 117.0254 52.6843 35.1519 170.9076 2 Q 4.4537 7.9415 120.6008 56.2208 30.5612 175.1532 3 A 4.7694 8.6061 125.8393 50.8335 21.2852 176.1925 4 S 5.1912 8.9406 118.1173 56.3610 66.7323 173.6285 5 V 4.2262 8.4399 122.0746 62.9986 32.4101 174.9807 6 V 4.9032 8.6656 127.4620 60.5215 35.0215 174.3314 7 A 4.4682 8.8266 129.6559 52.5453 18.5132 177.7395 8 N 4.7008 9.3624 122.8772 55.9328 39.8053 174.1531 9 Q 4.5819 7.5690 114.3714 54.7509 32.0731 173.4939 10 L 4.2693 8.4269 121.6677 55.2198 42.9517 176.0408 11 I 4.3283 8.6660 128.1246 59.1984 38.4082 173.8416 12 P 4.6645 0.0000 0.0000 61.7727 32.7109 176.1771 13 I 3.6153 8.3137 121.8105 62.7711 38.3028 175.2034 14 N 4.3349 8.3406 122.1287 54.4660 37.0848 173.9388 15 T 4.6164 7.3653 114.9855 61.9600 70.6236 174.1735 16 A 4.6064 8.4501 127.3171 51.8708 19.2518 177.3610 17 L 4.3925 8.9874 123.3690 54.6972 43.3166 175.9648 18 N 5.3773 8.4477 118.3334 50.9902 40.9275 175.2422 19 L 4.1617 8.7001 119.0320 56.8855 41.9138 178.7259 20 V 3.8360 8.0354 118.3421 65.3622 31.9225 177.0890 21 M 4.2432 8.2009 118.8271 57.1765 32.1031 175.5106 22 M 5.3311 7.9286 117.8506 53.2737 35.0009 175.1472 23 R 4.8959 8.8947 119.0384 54.3465 33.5902 174.1237 24 S 5.3330 8.4815 113.2430 57.0473 65.8492 172.8989 25 E 4.6751 8.8321 119.2773 55.3314 34.6957 174.7203 26 V 4.5039 8.3082 121.8291 62.1871 31.5799 175.3535 27 V 4.5856 8.2529 120.0588 59.6288 35.2988 175.4150 28 T 4.5624 8.1101 117.0390 60.9636 71.2277 172.7555 29 P 4.4853 0.0000 0.0000 62.1339 32.2544 175.8527 30 V 3.8945 8.1559 118.9077 62.6415 32.6380 175.8487 31 G 4.3992 8.3869 115.4685 45.3521 0.0000 172.7130 32 I 4.0578 8.4085 123.5991 60.6160 38.3041 174.4083 33 P 4.6903 0.0000 0.0000 62.9146 31.9044 177.1729 34 A 3.9911 9.0500 124.7390 55.3668 18.0640 179.7343 35 E 4.1508 8.1221 113.8850 58.4415 30.0683 177.6886 36 D 4.7534 8.1661 119.7635 54.4530 40.9386 177.8733 37 I 3.6637 7.7578 122.7702 64.1765 36.9417 176.0602 38 P 4.3330 0.0000 0.0000 65.9043 31.2198 178.2529 39 R 4.1965 7.8864 112.6431 58.7087 30.1135 178.2577 40 L 4.1776 8.0780 119.4226 55.7787 41.6049 177.3178 41 V 3.7411 6.6998 117.7872 64.4544 31.6976 176.4272 42 S 4.1040 8.9289 122.0131 58.9625 61.7082 170.0801 43 M 4.5062 7.9449 120.4949 54.8881 33.6826 175.2380 44 Q 5.4763 8.3574 118.9892 53.8809 31.7465 175.6108 45 V 4.5968 8.2363 115.1493 60.9406 33.3448 176.1847 46 N 5.0842 9.1247 119.3388 52.9312 38.5495 174.3240 47 R 4.7183 7.6352 114.5741 54.3102 32.9575 174.6158 48 A 4.2236 8.6428 122.6224 52.2168 19.3191 177.1792 49 V 4.2840 8.9456 123.6220 60.0836 33.3744 173.2322 50 P 4.5993 0.0000 0.0000 62.3491 32.4418 175.5989 51 L 3.9917 8.5298 122.9285 57.2619 42.1098 177.6110 52 G 3.9688 9.0634 114.0731 45.6346 0.0000 173.6456 53 T 4.1474 7.7201 117.3785 63.6031 69.6506 174.1368 54 T 4.4915 8.3587 122.1846 63.3642 69.6967 174.1729 55 L 4.2874 8.9542 126.6673 54.5417 43.0196 176.2571 56 M 4.8463 8.3920 122.8509 52.6545 34.4387 175.0733 57 P 4.1535 0.0000 0.0000 65.8458 31.6042 178.4598 58 D 4.5360 8.0701 115.3018 55.5136 39.5514 176.7810 59 M 4.3955 8.1616 119.0859 55.3995 32.8479 175.6418 60 V 4.5557 7.2715 119.1483 60.4594 32.7245 174.8829 61 K 4.2421 8.9465 128.6054 58.0908 31.9960 177.3957 62 G 3.9357 9.1249 112.2690 45.3261 0.0000 171.9346 63 Y 4.3286 7.6008 120.2745 56.4931 39.4761 174.8197 64 A 4.1441 7.5214 128.5324 50.7172 22.3189 175.6804 65 A 4.0386 8.0806 124.6665 52.0700 19.3250 176.3610 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 0 A 8.22 4.18 1.29 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 0.00 0.00 0.00 1 N 8.80 4.16 0.00 2.96 2.74 0.00 0.00 6.78 6.57 0.00 0.00 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 Q 7.94 4.45 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 3 A 8.61 4.77 1.23 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 0.00 0.00 0.00 4 S 8.94 5.19 0.00 3.71 3.82 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 0.00 0.00 0.00 0.00 5 V 8.44 4.23 2.02 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 0.91 0.00 0.00 0.90 0.00 0.00 6 V 8.67 4.90 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 1.02 0.00 0.00 0.97 0.00 0.00 7 A 8.83 4.47 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 8 N 9.36 4.70 0.00 2.67 2.97 0.00 0.00 7.06 6.98 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 9 Q 7.57 4.58 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.71 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 10 L 8.43 4.27 0.00 1.67 1.61 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.67 4.33 1.86 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 1.22 0.59 0.90 0.00 0.00 12 P 0.00 4.66 0.00 2.07 1.96 0.00 3.60 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 13 I 8.31 3.62 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 1.41 0.74 0.91 0.00 0.00 14 N 8.34 4.33 0.00 2.84 2.88 0.00 0.00 6.94 8.51 0.00 0.00 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 T 7.37 4.62 4.38 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 1.21 0.00 0.00 16 A 8.45 4.61 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 17 L 8.99 4.39 0.00 1.78 1.58 0.95 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 18 N 8.45 5.38 0.00 2.77 2.84 0.00 0.00 6.20 6.67 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 19 L 8.70 4.16 0.00 1.66 1.77 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.04 3.84 2.20 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 0.81 0.00 0.00 0.93 0.00 0.00 21 M 8.20 4.24 0.00 2.14 2.28 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.50 0.00 22 M 7.93 5.33 0.00 1.83 1.92 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 2.46 2.46 0.00 23 R 8.89 4.90 0.00 1.84 1.98 0.00 2.71 0.00 0.00 3.42 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.52 0.00 24 S 8.48 5.33 0.00 3.92 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 0.00 25 E 8.83 4.68 0.00 1.90 1.82 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 0.00 2.23 2.25 0.00 26 V 8.31 4.50 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 0.78 0.00 0.00 0.93 0.00 0.00 27 V 8.25 4.59 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 28 T 8.11 4.56 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 29 P 0.00 4.49 0.00 2.17 2.07 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 30 V 8.16 3.89 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 0.80 0.00 0.00 0.93 0.00 0.00 31 G 8.39 4.40 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 0.00 32 I 8.41 4.06 1.71 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.42 0.75 0.00 0.00 33 P 0.00 4.69 0.00 2.44 2.21 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 34 A 9.05 3.99 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 35 E 8.12 4.15 0.00 2.14 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 2.30 2.36 0.00 36 D 8.17 4.75 0.00 2.99 2.84 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 0.00 37 I 7.76 3.66 1.93 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 1.51 1.20 0.91 0.00 0.00 38 P 0.00 4.33 0.00 2.03 2.16 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 39 R 7.89 4.20 0.00 1.98 2.10 0.00 3.25 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.99 0.00 40 L 8.08 4.18 0.00 1.88 1.75 0.83 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 41 V 6.70 3.74 2.18 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 0.76 0.00 0.00 1.03 0.00 0.00 42 S 8.93 4.10 0.00 4.08 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 43 M 7.94 4.51 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.56 0.00 44 Q 8.36 5.48 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.55 2.21 0.00 45 V 8.24 4.60 2.20 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 0.99 0.00 0.00 1.00 0.00 0.00 46 N 9.12 5.08 0.00 2.82 3.03 0.00 0.00 6.76 8.48 0.00 0.00 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 7.64 4.72 0.00 1.77 1.87 0.00 3.03 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.62 0.00 48 A 8.64 4.22 1.24 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 0.00 0.00 0.00 49 V 8.95 4.28 2.06 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 1.05 0.00 0.00 0.93 0.00 0.00 50 P 0.00 4.60 0.00 2.14 2.16 0.00 3.78 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.97 0.00 51 L 8.53 3.99 0.00 1.59 1.65 0.98 1.06 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 52 G 9.06 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.72 4.15 4.27 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 1.19 0.00 0.00 54 T 8.36 4.49 4.22 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 1.25 0.00 0.00 55 L 8.95 4.29 0.00 1.54 1.47 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.39 4.85 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 57 P 0.00 4.15 0.00 2.27 2.43 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.14 0.00 58 D 8.07 4.54 0.00 2.80 2.82 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 0.00 0.00 0.00 0.00 59 M 8.16 4.40 0.00 2.08 2.19 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 2.56 2.41 0.00 60 V 7.27 4.56 2.02 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 1.05 0.00 0.00 0.79 0.00 0.00 61 K 8.95 4.24 0.00 1.76 1.77 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.49 1.49 7.81 62 G 9.12 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 63 Y 7.60 4.33 0.00 2.93 2.99 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 0.00 0.00 0.00 64 A 7.52 4.14 1.05 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 0.00 0.00 65 A 8.08 4.04 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