NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 4.3303 8.3545 119.0729 55.9751 31.2105 175.1140 -1 K 4.6553 8.0774 123.3493 51.7165 37.2548 174.2455 0 L 3.4939 8.9647 120.1099 56.8460 41.5996 179.6813 1 C 4.3573 9.3011 126.1809 60.4854 39.8554 174.8058 2 S 4.2614 7.9861 112.4732 58.1631 63.0925 173.8923 3 L 4.2835 7.9146 124.8930 53.9593 41.8760 175.5980 4 D 4.2828 9.3517 129.6441 55.6404 39.8258 173.1871 5 N 4.1313 8.2858 109.6589 53.3608 37.7883 174.3283 6 G 3.6393 8.7834 101.4512 45.6160 0.0000 174.3461 7 D 4.4615 8.1658 115.6997 54.7307 40.2171 173.0679 8 C 4.6546 7.8173 114.2443 55.8983 41.1953 173.8398 9 D 4.5125 8.8225 124.0034 57.0027 42.1759 177.3011 10 Q 4.3804 7.6556 111.6234 55.8697 30.6345 179.2603 11 F 4.7017 6.1195 126.2769 58.5109 40.4474 173.1517 12 C 5.5325 8.7277 121.5562 55.2999 43.3344 172.6439 13 H 5.1084 9.5155 122.0601 54.1293 33.3030 172.0524 14 E 5.0747 8.8382 120.0457 54.9051 31.0871 175.3574 15 E 4.5652 8.8766 124.8656 55.2949 32.3117 176.2373 16 Q 3.4468 8.5196 123.5228 56.9573 27.2537 173.6610 17 N 4.9067 8.5483 114.5074 53.6235 39.4002 175.0146 18 S 4.6485 7.6565 110.8298 56.5319 66.5794 173.1743 19 V 4.2809 8.1642 121.6134 62.8719 32.2495 175.2592 20 V 4.4530 9.1047 127.4333 61.4508 34.1269 173.8887 21 C 5.4726 8.8707 125.1037 56.2224 36.8121 172.4801 22 S 4.6849 8.6264 114.5706 58.0931 66.6070 171.8786 23 C 5.0450 8.5180 116.0038 54.5925 38.7569 174.0942 24 A 4.5148 8.7622 123.5745 51.4597 18.7033 177.2554 25 R 4.0635 8.4309 120.0083 58.1885 30.6079 176.9335 26 G 3.9638 9.4434 112.3380 45.2226 0.0000 171.8659 27 Y 5.2317 7.6396 115.8540 56.0719 41.6442 175.0019 28 T 4.7257 9.0256 112.4452 59.4104 71.8537 173.2088 29 L 4.4775 8.5868 126.6106 55.1976 42.7707 176.5197 30 A 4.2669 9.2879 128.4233 51.5319 19.4416 177.8849 31 D 4.3187 8.9436 119.2035 57.7888 40.8247 178.4417 32 N 4.3991 8.1467 113.3154 53.2946 37.4790 175.4812 33 G 3.9836 8.3619 107.2749 46.3189 0.0000 174.0588 34 K 4.4838 8.7616 118.9513 57.4755 35.4304 176.7635 35 A 4.6665 8.2488 120.6123 51.7817 20.1933 176.7936 36 C 5.3111 9.2300 118.0379 55.2684 38.3170 173.5619 37 I 4.6367 8.9575 125.3132 58.6496 39.1344 173.5708 38 P 4.2281 0.0000 0.0000 63.0626 31.1073 176.8349 39 T 3.9991 8.6169 114.9504 64.1478 69.5867 174.3548 40 G 3.9752 7.1491 108.4592 44.4748 0.0000 170.8777 41 P 4.1029 0.0000 0.0000 63.3351 32.3974 175.0265 42 Y 3.6147 7.5879 114.1834 58.5313 34.9806 168.9593 43 P 4.2943 0.0000 0.0000 62.3149 32.5305 176.0789 44 C 4.3926 8.3679 114.8658 59.6185 30.1327 174.0621 45 G 3.9609 8.9133 109.0370 45.7559 0.0000 173.0670 46 K 4.6095 7.3382 118.6585 54.0204 33.8567 176.5480 47 Q 4.1648 8.6678 122.9457 56.5664 29.6417 177.3020 48 T 4.4450 8.1585 112.8160 60.3418 67.7005 174.7389 49 L 4.2480 7.6173 126.4398 55.6550 41.8343 177.0905 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 R 8.35 4.33 0.00 1.85 1.81 0.00 3.18 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.00 -1 K 8.08 4.66 0.00 1.60 1.62 0.00 1.92 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.26 1.35 7.81 0 L 8.96 3.49 0.00 1.95 0.95 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 1 C 9.30 4.36 0.00 3.15 3.13 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 0.00 0.00 0.00 0.00 2 S 7.99 4.26 0.00 3.99 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 3 L 7.91 4.28 0.00 1.74 1.76 0.92 1.06 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 4 D 9.35 4.28 0.00 2.87 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.29 4.13 0.00 2.97 2.79 0.00 0.00 7.59 7.91 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 6 G 8.78 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.17 4.46 0.00 2.82 2.77 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 8 C 7.82 4.65 0.00 3.10 2.96 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 9 D 8.82 4.51 0.00 2.63 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.66 4.38 0.00 1.45 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.96 0.00 0.00 0.00 0.00 0.00 1.85 1.95 0.00 11 F 6.12 4.70 0.00 3.03 2.80 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 12 C 8.73 5.53 0.00 3.11 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 13 H 9.52 5.11 0.00 3.06 3.12 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.84 5.07 0.00 1.84 1.89 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 2.23 2.32 0.00 15 E 8.88 4.57 0.00 2.01 1.83 0.00 0.00 0.00 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 2.25 0.00 16 Q 8.52 3.45 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.56 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 17 N 8.55 4.91 0.00 2.67 2.78 0.00 0.00 6.59 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 7.66 4.65 0.00 3.94 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 19 V 8.16 4.28 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 0.77 0.00 0.00 0.94 0.00 0.00 20 V 9.10 4.45 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 1.02 0.00 0.00 1.02 0.00 0.00 21 C 8.87 5.47 0.00 3.04 2.98 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 0.00 0.00 0.00 22 S 8.63 4.68 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.52 5.05 0.00 2.81 2.86 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 24 A 8.76 4.51 1.28 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 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.43 4.06 0.00 1.87 1.94 0.00 3.28 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 26 G 9.44 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 0.00 0.00 0.00 27 Y 7.64 5.23 0.00 2.88 2.78 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 28 T 9.03 4.73 4.26 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 1.23 0.00 0.00 29 L 8.59 4.48 0.00 1.68 1.64 1.01 1.10 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 30 A 9.29 4.27 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 31 D 8.94 4.32 0.00 2.68 2.77 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 32 N 8.15 4.40 0.00 2.81 2.94 0.00 0.00 6.00 7.00 0.00 0.00 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 8.36 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.76 4.48 0.00 1.76 1.95 0.00 1.66 0.00 0.00 1.89 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.53 7.81 35 A 8.25 4.67 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 36 C 9.23 5.31 0.00 2.58 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 37 I 8.96 4.64 1.90 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 1.40 1.00 0.91 0.00 0.00 38 P 0.00 4.23 0.00 1.77 1.64 0.00 3.68 0.00 0.00 3.99 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 39 T 8.62 4.00 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 1.22 0.00 0.00 40 G 7.15 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.10 0.00 1.93 1.83 0.00 3.90 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 42 Y 7.59 3.61 0.00 3.21 3.05 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 P 0.00 4.29 0.00 1.85 1.64 0.00 3.58 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 2.02 1.78 0.00 44 C 8.37 4.39 0.00 3.19 3.07 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 0.00 0.00 0.00 0.00 45 G 8.91 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 0.00 0.00 0.00 46 K 7.34 4.61 0.00 1.89 1.77 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.70 1.60 7.81 47 Q 8.67 4.16 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.38 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 48 T 8.16 4.45 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 1.38 0.00 0.00 49 L 7.62 4.25 0.00 1.67 1.62 0.99 0.94 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