NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 T 4.3686 8.1744 110.9429 61.5325 70.3318 173.5122 6 N 4.8439 8.0348 118.9730 53.5448 39.4267 173.1918 7 S 4.5130 8.8869 113.2020 57.5783 65.0733 173.5263 8 D 4.7939 8.6689 121.8722 55.1958 41.7923 175.5451 9 F 5.3758 8.0127 114.1378 55.4128 41.5568 173.9521 10 V 4.5630 8.9522 112.3122 59.5288 35.4182 174.8196 11 V 4.8190 8.5925 123.2180 61.3083 34.1016 174.4734 12 I 4.9641 8.9193 128.2038 59.3991 40.9046 174.0261 13 K 5.0769 9.2621 128.8257 54.1613 34.5193 175.0691 14 A 4.3906 8.7403 130.3280 52.3569 19.1463 177.4038 15 L 4.7653 9.0238 122.2268 54.5061 42.4892 175.9905 16 E 4.6715 7.6612 115.5336 54.9926 32.1461 174.5143 17 D 4.5031 8.4059 119.4595 55.5981 41.3562 176.6519 18 G 3.8698 8.8414 109.0953 46.2492 0.0000 174.0599 19 V 3.9379 7.6036 119.8545 62.6588 32.9132 174.5500 20 N 5.3632 9.1606 124.8613 51.4772 41.5842 173.5282 21 V 4.4617 8.7620 124.9546 61.5546 33.2025 174.2962 22 I 4.5320 8.8063 130.1481 59.3465 39.5464 175.1104 23 G 4.0854 8.7646 115.1618 45.1217 0.0000 172.3768 24 L 5.5482 8.7122 125.3690 52.7829 44.4481 176.1972 25 T 4.5569 8.7685 114.5235 61.7618 69.2884 174.4023 26 R 4.5245 7.8446 125.7056 56.8240 31.0903 174.6558 27 G 3.7054 8.8433 108.3771 43.9760 0.0000 173.2764 28 A 4.0506 8.6434 121.0015 54.4292 18.5515 177.5898 29 D 4.7187 7.8709 114.4008 53.1908 42.4929 175.7564 30 T 4.7074 8.3827 122.8075 61.8549 70.0825 173.1059 31 R 4.7798 8.9403 122.5031 53.9611 33.8662 174.3233 32 F 5.2658 8.7905 118.6402 57.9655 39.0468 175.2988 33 H 5.0332 8.9717 117.6360 55.9681 30.7344 173.6253 34 H 4.7417 7.6818 118.0344 54.9550 33.3742 171.8766 35 S 4.7644 8.2878 120.1367 56.3734 64.2998 172.5586 36 E 4.2904 8.9331 130.2086 55.0686 30.6532 174.9136 37 K 4.7403 8.5981 129.0417 55.8338 33.5885 175.5455 38 L 4.9589 9.0642 127.5592 53.1862 44.6590 176.1687 39 D 5.0716 9.1021 123.7626 52.2406 43.5084 175.8840 40 K 3.9607 8.7616 121.5012 58.5737 32.2958 176.2057 41 G 4.0888 9.0007 115.0885 45.3234 0.0000 173.7563 42 E 4.1986 8.0047 119.0645 56.4867 30.7456 176.3228 43 V 4.9205 8.2797 121.8303 61.0194 34.4268 174.1771 44 L 4.7608 9.2639 129.7158 53.2399 44.8332 174.8197 45 I 4.9844 8.4430 126.2018 59.5670 39.4205 174.7693 46 A 4.6736 9.0091 128.9985 50.1643 22.1387 175.4391 47 Q 4.7498 8.6469 121.0032 55.0533 30.3712 175.7640 48 F 4.6929 8.4651 120.5252 57.9012 39.7398 175.1966 49 T 4.7419 8.7209 111.9674 59.6555 72.1188 173.0917 50 E 3.9985 9.0210 121.3399 59.6899 29.4767 177.5208 51 H 4.5321 8.1419 113.6902 56.5566 29.8086 174.2525 52 T 5.2401 8.1710 116.6693 61.9636 71.1936 174.4227 53 S 5.0005 9.0311 120.0493 58.0189 64.8913 173.4883 54 A 5.2017 7.9640 121.6497 50.9814 22.6890 175.0883 55 I 4.9441 8.5826 120.6483 59.3427 40.7521 174.7202 56 K 4.6133 9.0309 128.1727 54.4884 34.8918 174.5909 57 V 4.8223 8.4292 126.5928 61.1879 33.5982 174.5647 58 R 4.5478 9.1488 126.9054 55.6365 32.9272 176.4617 59 G 4.0751 9.0063 108.8915 44.1447 0.0000 172.2578 60 K 4.5489 9.7096 120.6112 56.0104 32.8865 175.5954 61 A 5.1206 8.7980 127.9274 50.8796 23.4816 173.6240 62 Y 5.0079 9.1263 121.1956 55.9267 41.5578 174.6682 63 I 4.9601 8.0141 126.3059 59.5212 41.1637 174.1731 64 Q 5.0524 8.8479 125.9631 54.2787 31.7691 174.9118 65 T 4.8527 8.6909 113.1372 59.3867 72.4433 174.4405 66 R 3.7070 8.5458 120.7054 59.4790 29.7265 176.3682 67 H 4.7443 8.8711 112.0408 55.0662 29.5701 174.6965 68 G 3.7130 6.5861 106.9329 44.2724 0.0000 173.1156 69 V 4.7908 7.7240 112.9774 60.0338 34.7508 175.0994 70 I 4.4171 8.0402 120.3026 60.2803 41.8588 172.7214 71 E 5.2598 8.6955 126.6752 54.5260 31.9351 176.1658 72 S 4.5909 8.6713 118.9596 58.1451 65.1021 172.8497 73 E 4.8902 8.4734 119.3791 54.3322 33.0518 176.1563 74 G 3.7226 8.7446 111.4805 45.9103 0.0000 173.3074 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 5 T 8.17 4.37 4.25 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 1.22 0.00 0.00 6 N 8.03 4.84 0.00 2.78 2.83 0.00 0.00 7.22 6.75 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 7 S 8.89 4.51 0.00 4.11 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 8 D 8.67 4.79 0.00 2.82 2.74 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 0.00 0.00 0.00 9 F 8.01 5.38 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 10 V 8.95 4.56 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.87 0.00 0.00 11 V 8.59 4.82 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 1.16 0.00 0.00 1.16 0.00 0.00 12 I 8.92 4.96 1.86 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 1.08 0.52 0.91 0.00 0.00 13 K 9.26 5.08 0.00 1.86 1.83 0.00 1.67 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.39 7.81 14 A 8.74 4.39 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 15 L 9.02 4.77 0.00 1.59 1.72 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.66 4.67 0.00 2.03 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 2.19 2.33 0.00 17 D 8.41 4.50 0.00 2.69 2.64 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 18 G 8.84 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.60 3.94 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 0.91 0.00 0.00 1.06 0.00 0.00 20 N 9.16 5.36 0.00 2.58 2.58 0.00 0.00 6.35 8.36 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 21 V 8.76 4.46 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 0.97 0.00 0.00 0.89 0.00 0.00 22 I 8.81 4.53 1.52 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.36 -0.61 0.00 0.00 23 G 8.76 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.71 5.55 0.00 1.90 1.70 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.77 4.56 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 26 R 7.84 4.52 0.00 1.91 2.00 0.00 3.19 0.00 0.00 3.08 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.44 0.00 27 G 8.84 3.71 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 0.00 0.00 0.00 28 A 8.64 4.05 1.30 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 0.00 0.00 0.00 29 D 7.87 4.72 0.00 2.64 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 30 T 8.38 4.71 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 1.27 0.00 0.00 31 R 8.94 4.78 0.00 1.85 1.99 0.00 2.81 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 32 F 8.79 5.27 0.00 2.87 2.94 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 33 H 8.97 5.03 0.00 3.13 3.47 0.00 5.78 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.68 4.74 0.00 3.26 3.05 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.29 4.76 0.00 3.67 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.93 4.29 0.00 2.15 1.78 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 2.27 2.29 0.00 37 K 8.60 4.74 0.00 1.78 1.67 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.45 7.81 38 L 9.06 4.96 0.00 1.55 1.52 0.92 0.96 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 39 D 9.10 5.07 0.00 2.59 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 40 K 8.76 3.96 0.00 1.70 1.75 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.46 1.41 7.81 41 G 9.00 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.00 4.20 0.00 2.08 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 43 V 8.28 4.92 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 0.81 0.00 0.00 0.96 0.00 0.00 44 L 9.26 4.76 0.00 1.71 1.45 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.44 4.98 1.76 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.77 0.72 0.00 0.00 46 A 9.01 4.67 1.11 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 0.00 0.00 47 Q 8.65 4.75 0.00 1.96 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.90 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 48 F 8.47 4.69 0.00 3.05 3.02 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 0.00 0.00 0.00 0.00 49 T 8.72 4.74 4.29 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 1.25 0.00 0.00 50 E 9.02 4.00 0.00 1.92 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.27 0.00 51 H 8.14 4.53 0.00 3.24 3.18 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.17 5.24 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 1.34 0.00 0.00 53 S 9.03 5.00 0.00 3.81 4.08 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 54 A 7.96 5.20 1.30 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 0.00 0.00 0.00 55 I 8.58 4.94 1.87 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 1.13 0.71 0.84 0.00 0.00 56 K 9.03 4.61 0.00 1.83 1.57 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.38 7.81 57 V 8.43 4.82 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 0.86 0.00 0.00 0.90 0.00 0.00 58 R 9.15 4.55 0.00 1.76 1.79 0.00 3.18 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 59 G 9.01 4.08 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 0.00 0.00 0.00 60 K 9.71 4.55 0.00 2.08 1.73 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.41 7.81 61 A 8.80 5.12 1.25 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 0.00 0.00 62 Y 9.13 5.01 0.00 3.04 2.83 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 0.00 0.00 0.00 63 I 8.01 4.96 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.83 0.86 0.00 0.00 64 Q 8.85 5.05 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 65 T 8.69 4.85 4.13 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 1.15 0.00 0.00 66 R 8.55 3.71 0.00 1.56 1.68 0.00 3.29 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 67 H 8.87 4.74 0.00 3.18 3.26 0.00 5.70 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 6.59 3.71 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 0.00 0.00 0.00 69 V 7.72 4.79 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 0.71 0.00 0.00 1.01 0.00 0.00 70 I 8.04 4.42 1.84 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 1.22 1.32 0.86 0.00 0.00 71 E 8.70 5.26 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.52 0.00 72 S 8.67 4.59 0.00 3.93 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 73 E 8.47 4.89 0.00 1.82 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 2.22 2.30 0.00 74 G 8.74 3.72 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 0.00 0.00 0.00