NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 F 4.9516 8.3249 122.8590 58.2147 41.5424 175.3994 9 S 3.9932 8.0077 116.7977 58.2542 63.6116 172.5739 10 G 3.9220 8.0614 111.6550 45.5670 0.0000 173.5285 11 A 4.4865 7.6427 124.2138 50.9436 21.0281 176.7666 12 K 4.5341 8.5644 115.5839 54.8692 33.8758 175.6687 13 I 4.2296 8.2893 124.5179 60.3954 38.9403 174.7366 14 Y 4.5092 8.4171 124.4653 56.4028 39.2305 174.5830 15 P 4.5324 0.0000 0.0000 59.8448 29.8617 174.3630 16 G 3.4370 7.6220 116.5408 45.4716 0.0000 171.0130 17 R 4.4150 7.8114 117.9636 55.5667 32.7765 173.0607 18 G 3.8531 8.8590 111.9008 44.5878 0.0000 173.6349 19 T 4.2107 8.7061 123.2770 63.1471 69.9043 173.6372 20 L 5.0573 8.4127 125.5727 52.8295 44.4515 175.3708 21 F 5.0425 8.3759 124.6697 55.9645 41.5505 176.3533 22 V 4.7897 8.2342 118.6032 59.6507 32.1983 176.9336 23 R 3.8515 7.4813 120.2562 59.2830 30.5885 173.6845 24 G 3.9397 8.2503 116.2818 44.7243 0.0000 173.5869 25 D 4.5407 8.4433 118.0750 53.5884 40.2051 176.6993 26 S 3.5020 7.7683 109.7820 60.5006 59.6829 174.4141 27 K 3.9755 7.1854 120.2309 55.2426 32.6622 177.4577 28 I 3.9872 7.7573 125.8448 60.6700 38.6848 174.6906 29 F 5.2261 8.4330 129.2014 56.2382 42.4146 174.4178 30 R 4.6438 8.1621 113.3147 55.8615 31.4202 174.5955 31 F 4.9777 8.2426 119.3692 57.7391 40.1711 175.0210 32 Q 4.6765 8.8737 116.9222 56.0466 34.7348 175.6990 33 N 5.0463 8.2035 114.2481 51.5031 42.3242 176.6472 34 S 3.9064 8.3209 117.5505 61.9005 62.9530 176.7162 35 K 3.8911 8.2096 120.5563 59.6164 31.5190 177.9663 36 S 4.4803 7.7917 113.3431 60.4821 63.1481 176.3038 37 A 3.5921 7.5863 124.0433 54.8539 18.2375 179.3116 38 S 4.2044 7.8991 113.3381 61.3851 62.6371 175.3943 39 L 4.1679 7.4401 120.1028 55.1385 41.3076 178.0784 40 F 4.4888 7.8481 121.7078 58.4004 40.2141 176.3611 41 K 4.1293 7.7888 120.3393 59.4258 32.2654 178.7126 42 Q 3.8522 7.7143 120.2520 57.2599 29.3651 177.1741 43 R 3.7325 7.2911 115.1572 56.5487 27.9499 176.1787 44 K 3.8219 6.9412 119.2917 56.8590 32.2291 176.7110 45 N 4.8044 8.4606 121.5579 52.0974 40.0289 174.0911 46 P 4.7455 0.0000 0.0000 62.1072 30.2529 174.4510 47 R 4.4394 7.6179 119.4644 58.8171 32.7965 178.0917 48 R 3.9847 7.8097 115.0341 59.1062 30.4897 177.1784 49 I 3.8125 7.5840 120.8552 61.4549 37.2050 175.7790 50 A 4.3339 8.6745 129.3987 53.7710 19.4137 178.3727 51 W 4.6207 7.9700 110.3672 57.6084 28.9276 176.3228 52 T 3.6201 7.1479 114.4219 61.8675 68.3499 174.3976 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 8 F 8.32 4.95 0.00 3.13 3.24 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 9 S 8.01 3.99 0.00 4.09 3.73 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 10 G 8.06 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 11 A 7.64 4.49 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 12 K 8.56 4.53 0.00 1.82 1.81 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.50 7.81 13 I 8.29 4.23 2.10 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.88 0.95 0.00 0.00 14 Y 8.42 4.51 0.00 2.91 2.95 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 0.00 0.00 0.00 15 P 0.00 4.53 0.00 2.15 2.03 0.00 3.37 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.80 0.00 16 G 7.62 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.81 4.42 0.00 1.77 1.86 0.00 3.15 0.00 0.00 3.08 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 18 G 8.86 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 19 T 8.71 4.21 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 1.06 0.00 0.00 20 L 8.41 5.06 0.00 1.47 1.53 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 21 F 8.38 5.04 0.00 2.71 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 22 V 8.23 4.79 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.98 0.00 0.00 23 R 7.48 3.85 0.00 0.67 1.58 0.00 2.87 0.00 0.00 3.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.45 0.00 24 G 8.25 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 25 D 8.44 4.54 0.00 2.77 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 26 S 7.77 3.50 0.00 3.99 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 27 K 7.19 3.98 0.00 1.40 1.14 0.00 1.90 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.34 7.81 28 I 7.76 3.99 1.74 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.95 0.79 0.00 0.00 29 F 8.43 5.23 0.00 3.03 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 30 R 8.16 4.64 0.00 1.91 1.83 0.00 3.21 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 31 F 8.24 4.98 0.00 3.02 2.85 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 32 Q 8.87 4.68 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.62 0.00 33 N 8.20 5.05 0.00 3.04 2.87 0.00 0.00 7.18 7.57 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 34 S 8.32 3.91 0.00 3.86 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 35 K 8.21 3.89 0.00 1.81 2.01 0.00 2.09 0.00 0.00 1.86 0.00 0.00 3.08 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.83 1.70 7.81 36 S 7.79 4.48 0.00 4.34 4.32 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.59 3.59 0.41 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 38 S 7.90 4.20 0.00 3.99 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 7.44 4.17 0.00 1.05 0.96 0.62 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.85 4.49 0.00 3.23 3.27 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 0.00 41 K 7.79 4.13 0.00 1.99 1.77 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.45 7.81 42 Q 7.71 3.85 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.43 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 43 R 7.29 3.73 0.00 2.07 1.92 0.00 3.23 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.42 0.00 44 K 6.94 3.82 0.00 1.47 1.62 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.29 7.81 45 N 8.46 4.80 0.00 2.72 2.77 0.00 0.00 7.16 8.02 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 46 P 0.00 4.75 0.00 2.12 2.01 0.00 3.80 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 47 R 7.62 4.44 0.00 1.78 1.97 0.00 3.21 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 48 R 7.81 3.98 0.00 1.79 1.98 0.00 3.26 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 49 I 7.58 3.81 1.79 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.36 0.69 0.00 0.00 50 A 8.67 4.33 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 51 W 7.97 4.62 0.00 3.58 3.23 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 52 T 7.15 3.62 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 0.03 0.00 0.00