NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.3534 8.1233 123.5839 51.5963 18.9170 177.0415 5 L 3.8482 8.4993 122.3138 58.3796 41.7026 177.7339 6 L 4.1462 8.7530 119.7090 57.8459 41.9477 179.5106 7 R 3.9934 7.9024 117.4123 59.3639 30.2347 178.8616 8 Q 3.9477 8.8666 118.5728 58.8588 28.6460 178.5928 9 A 3.6391 9.3825 121.6771 55.6417 18.3993 178.4884 10 Y 4.0718 8.1389 117.6319 61.0449 38.5892 178.0788 11 S 4.0121 8.9493 114.3344 61.0804 62.6306 175.6301 12 A 4.5249 8.2216 120.5580 51.7704 19.7334 176.3870 13 L 4.4479 8.0718 115.4665 56.4045 43.8539 179.1404 14 F 5.0113 7.3864 114.9687 60.2263 38.9713 176.8089 15 R 3.6193 7.1966 121.0421 58.9359 30.3236 176.4700 16 R 4.0851 7.6122 116.1165 56.0270 30.8649 177.8275 17 T 3.8657 8.7808 120.5859 66.8656 68.2079 176.3350 18 S 4.1784 8.0491 116.1530 61.5755 63.3344 176.2592 19 T 3.8373 7.9829 114.0422 63.9259 68.2122 175.7565 20 F 4.2219 8.8085 124.4645 60.5794 39.5347 176.7104 21 A 4.1169 8.0771 119.8430 55.5151 18.1604 179.5383 22 L 3.9726 8.2602 117.5476 58.3711 41.6348 180.0245 23 T 3.8249 8.0684 115.8507 66.4999 68.2480 176.9377 24 V 3.4557 7.6340 120.2729 65.8514 31.4999 178.0388 25 V 3.5343 7.8529 118.0402 65.8111 31.4045 177.3675 26 L 4.0052 8.3464 120.3477 58.7675 41.8822 178.8032 27 G 3.6581 8.6805 105.0641 47.6968 0.0000 174.9267 28 A 4.0465 8.4244 123.0164 54.8340 18.4411 179.4311 29 V 3.5531 7.7837 115.9708 66.7187 31.5200 178.2537 30 L 3.9947 8.0795 117.9804 57.7198 41.5184 179.1899 31 F 4.1547 8.8854 120.9393 61.7691 39.2990 176.1125 32 E 3.9035 9.6496 119.0404 59.5734 29.2469 178.6084 33 R 3.8202 8.0608 116.7750 59.7242 30.3996 178.3619 34 A 3.9136 8.0479 119.7015 55.5644 18.3901 179.1188 35 F 3.7723 8.4674 118.5175 61.5203 39.3868 176.8597 36 D 4.2900 8.5600 118.5063 57.7700 40.6859 179.0048 37 Q 3.9864 8.2161 118.2456 58.9915 28.7050 178.9733 38 G 3.6385 8.0950 106.1706 47.8229 0.0000 175.1994 39 A 3.7240 8.0489 123.1504 54.9695 18.2969 179.3460 40 D 4.2958 7.8912 116.9565 57.4720 40.8416 178.6281 41 A 4.0556 8.2654 121.5531 55.6750 18.3946 179.6788 42 I 3.6196 8.0764 118.1831 64.4214 36.9170 178.5686 43 F 4.0624 8.1792 120.5586 61.5249 39.5562 176.8026 44 E 4.0651 9.0710 118.6986 59.5046 28.9575 179.0510 45 H 4.0667 8.2892 117.8344 59.2547 30.1941 177.1448 46 L 4.1678 7.6140 117.9573 56.1612 41.9187 176.7506 47 N 4.9839 7.6485 117.0798 52.2530 39.6156 174.4039 48 E 3.7750 8.1816 117.0319 57.6623 30.2107 178.1926 49 G 3.9218 8.2318 109.3194 46.1338 0.0000 174.1225 50 K 4.3730 7.7683 118.0709 56.6214 33.4426 176.8471 51 L 4.5174 7.5383 118.7777 53.1656 42.8855 177.4320 52 W 4.1591 8.7787 130.6191 59.8596 30.2483 178.3424 53 K 3.8568 7.8960 118.6647 59.9592 31.8198 177.9839 54 H 4.3581 7.8338 115.1713 58.9801 29.0077 177.6197 55 I 3.5923 8.0066 120.9943 65.9478 37.0396 179.9789 56 K 2.8944 7.3060 116.5264 56.0516 34.1952 176.2961 57 H 4.0049 7.7913 114.3035 58.6412 28.7478 177.5551 58 K 3.8651 7.5748 118.4188 58.4550 31.7437 177.0384 59 Y 4.7985 7.6823 113.3861 57.2830 40.0737 177.4343 60 E 4.5780 7.6022 121.9421 56.4880 30.9972 174.6416 61 A 4.7061 8.4366 132.4630 53.0985 17.0673 177.6532 62 S 4.2769 8.9383 116.6902 60.2319 63.2536 173.7467 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 4 A 8.12 4.35 1.32 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 0.00 0.00 5 L 8.50 3.85 0.00 1.81 1.77 0.94 0.34 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 6 L 8.75 4.15 0.00 1.73 1.79 0.95 1.06 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 7 R 7.90 3.99 0.00 2.04 2.01 0.00 3.13 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 8 Q 8.87 3.95 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 9 A 9.38 3.64 1.10 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 0.00 0.00 10 Y 8.14 4.07 0.00 3.31 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 11 S 8.95 4.01 0.00 4.02 4.11 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 0.00 0.00 0.00 12 A 8.22 4.52 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 13 L 8.07 4.45 0.00 0.83 1.41 0.64 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 14 F 7.39 5.01 0.00 3.10 3.21 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 15 R 7.20 3.62 0.00 1.04 1.62 0.00 3.22 0.00 0.00 3.12 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.47 0.00 16 R 7.61 4.09 0.00 1.90 1.85 0.00 3.19 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 17 T 8.78 3.87 4.23 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 1.18 0.00 0.00 18 S 8.05 4.18 0.00 4.07 4.11 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 0.00 0.00 0.00 19 T 7.98 3.84 4.23 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 1.20 0.00 0.00 20 F 8.81 4.22 0.00 3.35 3.29 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 21 A 8.08 4.12 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.26 3.97 0.00 1.68 1.73 0.92 0.86 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 23 T 8.07 3.82 4.30 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 24 V 7.63 3.46 2.16 0.00 0.00 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 0.67 0.00 0.00 25 V 7.85 3.53 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 0.94 0.00 0.00 0.93 0.00 0.00 26 L 8.35 4.01 0.00 1.88 1.82 0.93 1.07 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 27 G 8.68 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.42 4.05 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 29 V 7.78 3.55 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.00 0.00 0.00 30 L 8.08 3.99 0.00 1.83 1.74 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.89 4.15 0.00 3.09 3.32 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 32 E 9.65 3.90 0.00 2.32 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 0.00 2.57 2.44 0.00 33 R 8.06 3.82 0.00 1.97 1.99 0.00 3.21 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 34 A 8.05 3.91 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 8.47 3.77 0.00 1.94 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 36 D 8.56 4.29 0.00 2.75 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 37 Q 8.22 3.99 0.00 2.16 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 38 G 8.10 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 39 A 8.05 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 7.89 4.30 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 4.06 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.08 3.62 2.02 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 1.37 1.21 0.92 0.00 0.00 43 F 8.18 4.06 0.00 2.96 3.25 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 0.00 44 E 9.07 4.07 0.00 2.07 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 0.00 2.48 2.62 0.00 45 H 8.29 4.07 0.00 3.17 3.51 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 7.61 4.17 0.00 1.61 1.61 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 47 N 7.65 4.98 0.00 2.37 2.55 0.00 0.00 6.88 8.97 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 48 E 8.18 3.77 0.00 1.84 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.12 0.00 49 G 8.23 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 50 K 7.77 4.37 0.00 1.84 1.88 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.56 7.81 51 L 7.54 4.52 0.00 1.38 1.55 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 52 W 8.78 4.16 0.00 3.45 3.12 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 53 K 7.90 3.86 0.00 1.78 1.65 0.00 1.86 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.54 7.81 54 H 7.83 4.36 0.00 3.22 3.26 0.00 5.73 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.01 3.59 1.62 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 1.70 1.04 1.06 0.00 0.00 56 K 7.31 2.89 0.00 1.32 1.45 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.28 1.42 7.81 57 H 7.79 4.00 0.00 3.30 3.54 0.00 5.71 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 58 K 7.57 3.87 0.00 0.79 1.04 0.00 1.52 0.00 0.00 1.52 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.34 1.25 7.81 59 Y 7.68 4.80 0.00 3.09 3.08 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 0.00 0.00 0.00 0.00 60 E 7.60 4.58 0.00 2.15 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 2.55 2.40 0.00 61 A 8.44 4.71 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 S 8.94 4.28 0.00 3.92 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