NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3871 0.0000 0.0000 61.8078 31.5323 175.9768 3 P 4.2795 0.0000 0.0000 61.8950 32.2606 175.6609 4 R 4.2735 9.1212 120.0111 54.8481 33.1365 177.2889 5 P 4.2463 0.0000 0.0000 66.2247 31.3908 178.7733 6 L 3.8201 7.9456 116.7834 58.2059 41.6465 179.3749 7 D 4.4061 7.8917 118.6716 57.2181 40.4469 178.9960 8 V 3.6340 7.5816 118.3021 65.5499 31.7754 177.9393 9 L 3.9733 7.5869 118.4185 57.8135 41.6709 178.5831 10 N 4.6787 7.7647 116.7869 56.8296 38.6082 176.0074 11 R 4.3081 7.5962 116.1802 57.2519 30.0293 176.4401 12 S 4.7226 8.0870 111.9894 58.5940 64.4941 174.1868 13 L 4.3138 7.9184 121.1482 55.4792 41.7869 177.2266 14 K 3.7625 8.6217 117.5963 57.1667 30.7428 174.8457 15 S 5.0213 7.6730 113.2186 55.4229 66.7662 171.5417 16 P 5.0791 0.0000 0.0000 63.2281 32.8494 175.5183 17 V 5.1560 9.3018 114.4137 60.6111 37.1077 173.2366 18 I 5.1652 9.1991 121.7407 59.7419 41.1230 175.4673 19 V 4.6342 8.5374 124.8305 61.2913 34.5879 173.9537 20 R 4.5939 7.8745 129.0662 55.2338 31.5811 175.4518 21 L 5.0235 8.6698 125.9823 52.5730 45.1955 175.9130 22 K 4.0572 8.6617 120.2794 60.1396 31.1191 176.1684 23 G 3.6056 9.8385 121.8952 45.0419 0.0000 172.4745 24 G 3.9940 7.5890 107.5941 45.3502 0.0000 174.5892 25 R 4.1879 8.0598 119.5619 56.3913 31.3894 175.5108 26 E 5.3338 8.5053 120.6895 54.6798 34.2064 174.6379 27 F 5.2271 8.9925 120.5018 55.7340 42.8734 173.9792 28 R 4.9314 8.5052 123.4426 54.9115 32.3512 175.3574 29 G 4.1930 8.5645 111.5999 46.6529 0.0000 171.4468 30 T 4.9211 7.7549 116.7724 61.7240 70.5326 174.7712 31 L 4.5224 8.8525 129.4810 55.2940 41.2987 176.2532 32 D 4.4526 8.8221 126.3291 56.3713 42.3236 175.6225 33 G 4.2003 7.3371 103.7223 45.7148 0.0000 171.3056 34 Y 5.7172 7.5040 115.6054 57.2729 40.1805 172.4375 35 D 5.0444 8.1471 119.2175 51.0481 42.8320 176.1476 36 I 3.7753 8.3908 118.2945 64.5696 37.7044 176.1170 37 H 4.4314 8.6705 115.6090 56.0472 28.6677 175.6433 38 M 3.2122 8.5031 118.4457 56.2635 31.3035 176.0683 39 N 4.8259 8.2788 113.9627 53.0049 40.0509 173.9990 40 L 5.3680 8.9652 121.7415 52.9576 46.4575 175.4518 41 V 4.9313 8.3235 119.1766 61.2974 34.9480 174.3308 42 L 5.9367 8.6785 125.7194 51.9069 46.1026 175.2890 43 L 4.9508 8.3536 120.7468 54.0696 45.0734 175.2357 44 D 4.4809 9.4567 121.2176 55.0873 38.5285 172.5408 45 A 5.1959 8.6162 122.0738 49.9339 23.1559 175.4446 46 E 5.0930 8.7514 118.3622 53.4358 33.3487 174.9761 47 E 3.9606 8.3623 124.0105 55.2438 30.4845 175.3076 48 I 4.7551 8.8615 129.0833 60.0392 40.9520 175.4437 49 Q 4.2514 8.4549 124.1817 55.6579 30.9066 174.4836 50 N 4.2815 9.4691 126.0430 55.1685 36.3948 175.7983 51 G 3.9318 7.7192 104.0931 44.7244 0.0000 171.8035 52 E 4.5541 7.6135 113.5424 55.3962 33.9973 175.7895 53 V 3.9301 8.4632 126.1623 63.4807 31.9165 173.8211 54 V 4.3528 7.4880 121.1831 62.4233 34.6627 177.4974 55 R 4.7974 6.7630 121.4927 55.5543 34.0268 175.1882 56 K 4.8398 8.2960 115.9138 56.6853 36.2795 175.8987 57 V 4.4134 8.7007 115.2405 60.0175 35.9891 175.5739 58 G 3.9292 9.0493 112.4563 49.7239 0.0000 172.9752 59 S 5.1012 7.7528 111.1650 57.8110 65.7111 174.9134 60 V 4.5620 8.4944 112.9904 59.9778 36.4733 174.0860 61 V 4.6285 8.3085 122.7960 61.3261 33.7033 174.6253 62 I 4.2801 8.6364 129.8866 59.1665 39.2408 175.7342 63 R 4.2890 8.6641 127.0834 56.3085 30.5175 177.7675 64 G 3.9446 10.2410 113.7888 47.8727 0.0000 174.6988 65 D 4.3994 8.1242 117.9469 56.9369 41.3995 177.0790 66 T 4.2134 8.3546 115.3787 64.7521 69.1530 175.1340 67 V 3.8879 7.3920 121.4473 62.8583 32.2105 174.9529 68 V 4.3600 8.4886 126.9355 64.1807 32.7177 175.5697 69 F 5.1301 7.4437 113.3888 55.5503 41.3540 172.6668 70 V 5.0267 8.6023 119.5809 61.3783 33.9952 174.5719 71 S 4.8909 9.3382 122.1556 55.5009 66.2203 171.1315 72 P 4.6706 0.0000 0.0000 62.9694 31.7554 175.9585 73 A 4.4428 8.3782 124.7426 51.9270 18.7819 176.0281 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 2 P 0.00 4.39 0.00 2.19 2.18 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.96 0.00 3 P 0.00 4.28 0.00 2.27 2.08 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.04 0.00 4 R 9.12 4.27 0.00 1.90 1.88 0.00 3.15 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.94 0.00 5 P 0.00 4.25 0.00 2.12 2.08 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 6 L 7.95 3.82 0.00 1.67 1.72 0.95 1.00 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 7 D 7.89 4.41 0.00 2.76 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.58 3.63 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 0.80 0.00 0.00 0.93 0.00 0.00 9 L 7.59 3.97 0.00 1.33 1.03 0.64 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 10 N 7.76 4.68 0.00 3.08 3.06 0.00 0.00 6.94 7.60 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 11 R 7.60 4.31 0.00 2.09 1.92 0.00 3.25 0.00 0.00 3.23 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 12 S 8.09 4.72 0.00 3.91 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.92 4.31 0.00 1.88 1.64 1.00 0.87 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 14 K 8.62 3.76 0.00 1.88 1.88 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.37 7.81 15 S 7.67 5.02 0.00 3.90 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 16 P 0.00 5.08 0.00 2.16 2.23 0.00 3.70 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.01 0.00 17 V 9.30 5.16 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 0.77 0.00 0.00 0.97 0.00 0.00 18 I 9.20 5.17 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.82 0.97 0.00 0.00 19 V 8.54 4.63 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 0.85 0.00 0.00 0.93 0.00 0.00 20 R 7.87 4.59 0.00 1.09 0.66 0.00 3.05 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.42 0.00 21 L 8.67 5.02 0.00 1.60 1.54 0.95 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.66 4.06 0.00 1.62 1.80 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.54 7.81 23 G 9.84 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.59 3.99 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 0.00 0.00 0.00 25 R 8.06 4.19 0.00 1.84 1.91 0.00 3.31 0.00 0.00 3.34 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 26 E 8.51 5.33 0.00 1.77 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 2.12 2.37 0.00 27 F 8.99 5.23 0.00 2.92 2.93 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 28 R 8.51 4.93 0.00 1.94 1.78 0.00 3.21 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 29 G 8.56 4.19 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 0.00 30 T 7.75 4.92 4.35 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 1.23 0.00 0.00 31 L 8.85 4.52 0.00 1.82 1.79 1.06 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.82 4.45 0.00 2.76 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 33 G 7.34 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 7.50 5.72 0.00 2.89 2.92 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 35 D 8.15 5.04 0.00 2.89 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.39 3.78 1.84 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 1.37 0.66 0.69 0.00 0.00 37 H 8.67 4.43 0.00 3.45 3.30 0.00 5.79 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 M 8.50 3.21 0.00 2.12 2.16 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 2.47 2.48 0.00 39 N 8.28 4.83 0.00 3.02 2.73 0.00 0.00 6.80 6.74 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 40 L 8.97 5.37 0.00 1.49 1.53 0.90 0.89 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 41 V 8.32 4.93 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 0.97 0.00 0.00 0.92 0.00 0.00 42 L 8.68 5.94 0.00 1.60 1.52 0.94 0.61 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 43 L 8.35 4.95 0.00 1.58 1.54 1.07 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 44 D 9.46 4.48 0.00 2.65 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.62 5.20 1.42 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 46 E 8.75 5.09 0.00 1.86 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 2.19 2.05 0.00 47 E 8.36 3.96 0.00 1.56 1.57 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 0.00 2.08 1.75 0.00 48 I 8.86 4.76 1.82 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 1.05 0.69 0.98 0.00 0.00 49 Q 8.45 4.25 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.28 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 50 N 9.47 4.28 0.00 2.85 2.83 0.00 0.00 7.21 7.65 0.00 0.00 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 7.72 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 52 E 7.61 4.55 0.00 1.98 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 2.08 2.10 0.00 53 V 8.46 3.93 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 0.85 0.00 0.00 0.96 0.00 0.00 54 V 7.49 4.35 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 0.79 0.00 0.00 0.93 0.00 0.00 55 R 6.76 4.80 0.00 1.75 1.81 0.00 3.19 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 56 K 8.30 4.84 0.00 1.59 1.66 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.33 1.42 7.81 57 V 8.70 4.41 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.08 0.00 0.00 58 G 9.05 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 59 S 7.75 5.10 0.00 3.89 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.49 4.56 1.91 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 0.73 0.00 0.00 0.83 0.00 0.00 61 V 8.31 4.63 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 0.80 0.00 0.00 0.91 0.00 0.00 62 I 8.64 4.28 1.74 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.36 0.78 0.00 0.00 63 R 8.66 4.29 0.00 1.80 1.86 0.00 3.44 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.56 0.00 64 G 10.24 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 65 D 8.12 4.40 0.00 2.63 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 66 T 8.35 4.21 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 1.18 0.00 0.00 67 V 7.39 3.89 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 0.70 0.00 0.00 0.88 0.00 0.00 68 V 8.49 4.36 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 0.97 0.00 0.00 0.92 0.00 0.00 69 F 7.44 5.13 0.00 3.01 3.10 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.60 5.03 2.12 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 0.83 0.00 0.00 0.94 0.00 0.00 71 S 9.34 4.89 0.00 3.90 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.67 0.00 2.12 2.06 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 73 A 8.38 4.44 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