NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.1856 8.0093 121.4775 61.2574 38.5363 174.4967 3 F 4.7938 7.5879 118.9937 53.7674 40.9611 171.2087 4 P 4.4579 0.0000 0.0000 64.0247 32.2291 177.9570 5 G 3.9595 8.8215 111.9568 45.2078 0.0000 173.9237 6 A 3.8458 7.1814 121.6546 51.9362 19.8773 176.4357 7 T 4.8488 8.1823 116.2744 62.2083 70.7355 174.4271 8 V 4.9595 8.7115 118.5471 59.4952 36.4065 174.3290 9 R 5.0422 8.8091 123.0387 54.4644 33.0002 174.9034 10 V 4.2787 8.6696 126.8135 63.1031 32.2746 176.1231 11 T 4.6977 8.8334 117.7198 61.5608 70.1403 174.2360 12 N 4.5210 8.2163 122.4549 53.1634 38.7335 175.7527 13 V 2.2149 8.0875 120.0925 63.3982 31.6812 176.8693 14 D 4.5938 8.2311 117.9721 54.0990 41.3857 175.9826 15 D 4.7681 7.8678 120.2722 53.2867 42.2867 177.1387 16 T 3.7051 8.5459 121.6560 66.6625 68.5962 174.6354 17 Y 4.0394 8.6104 117.9302 57.4414 38.0584 174.5520 18 Y 4.4475 7.6172 121.5917 59.6819 38.9756 177.0803 19 R 3.8798 8.8150 125.3850 56.0733 29.3764 176.6395 20 F 4.3155 8.3945 117.3219 57.3775 40.2688 174.1064 21 E 5.3797 8.9699 120.1955 54.9486 32.5602 175.4318 22 G 4.0799 9.1607 110.0377 45.0266 0.0000 170.1636 23 L 4.9931 8.1960 121.3238 53.0459 44.2316 175.9538 24 V 4.0402 8.6120 127.1955 63.2024 31.9509 176.1726 25 Q 4.4977 9.1437 126.6244 56.8908 30.9225 176.2264 26 R 4.7552 7.6142 115.6355 54.6076 35.0897 174.5107 27 V 4.8184 8.0375 120.9872 61.5297 34.4067 174.5925 28 S 4.4658 9.6221 119.9305 58.6800 65.7190 173.9727 29 D 4.3876 9.7939 124.0085 55.4694 39.6084 174.2292 30 G 3.9814 8.3660 102.1926 45.5524 0.0000 173.2634 31 K 5.2824 8.0170 117.7396 54.2977 36.8747 175.0584 32 A 5.1685 9.1607 122.8764 50.2195 22.8437 174.9510 33 A 4.7194 8.9745 124.3318 50.8851 20.4962 176.4080 34 V 4.5654 8.9681 123.1884 60.8731 34.8692 173.9245 35 L 4.7019 8.5211 129.9036 53.4552 43.9414 174.7933 36 F 5.3728 8.5625 125.4708 56.0162 41.3842 174.5443 37 E 5.2247 8.8211 122.2648 55.1818 33.2711 174.6504 38 N 4.6129 10.1386 122.9742 53.9049 41.5878 174.9097 39 G 3.9199 8.3788 118.6298 47.2647 0.0000 174.5088 40 N 4.6164 8.9957 122.1235 53.5185 39.0236 174.6956 41 W 4.5687 8.2900 130.1425 56.8589 31.6324 174.3398 42 D 4.3995 7.1304 121.9899 52.2476 41.4913 174.7805 43 K 4.3346 8.0985 119.6258 54.6640 36.9311 174.8352 44 L 4.7486 8.4048 126.4848 53.4764 43.3777 175.4502 45 V 4.3527 8.5957 126.6551 61.2931 34.9040 174.1156 46 T 4.9401 8.1357 123.2109 62.3003 69.9950 173.9944 47 F 5.0510 9.0598 123.5519 55.5128 43.7955 174.8364 48 R 4.6090 9.5520 120.1381 55.7922 30.9020 178.3355 49 L 4.0293 8.6028 121.3235 57.8235 41.7552 179.6340 50 S 4.3465 8.0831 111.3542 60.0443 63.3358 174.3643 51 E 4.5192 8.4713 120.7601 56.2851 29.7153 175.0471 52 L 5.2309 7.5647 118.5546 52.7391 45.4331 175.6845 53 E 4.6465 8.8681 121.5906 54.1310 32.4628 174.7886 54 A 4.5972 8.7724 129.3833 52.3040 19.2708 176.4207 55 V 4.5396 8.5896 114.7493 59.0218 36.3562 176.2345 56 K 4.1583 8.5096 119.4888 57.0659 31.9965 177.3923 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 I 8.01 4.19 1.91 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 1.45 1.09 0.87 0.00 0.00 3 F 7.59 4.79 0.00 3.25 3.09 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 4 P 0.00 4.46 0.00 2.12 2.22 0.00 3.81 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 2.07 2.10 0.00 5 G 8.82 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 6 A 7.18 3.85 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.18 4.85 4.21 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 1.26 0.00 0.00 8 V 8.71 4.96 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 0.60 0.00 0.00 0.83 0.00 0.00 9 R 8.81 5.04 0.00 1.80 1.73 0.00 3.17 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 10 V 8.67 4.28 2.35 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 1.03 0.00 0.00 0.62 0.00 0.00 11 T 8.83 4.70 4.34 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 1.31 0.00 0.00 12 N 8.22 4.52 0.00 2.84 2.88 0.00 0.00 7.18 7.71 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 13 V 8.09 2.21 1.63 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 0.35 0.00 0.00 0.77 0.00 0.00 14 D 8.23 4.59 0.00 2.75 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 15 D 7.87 4.77 0.00 2.94 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 16 T 8.55 3.71 3.60 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 0.00 0.00 0.00 0.52 0.00 0.00 17 Y 8.61 4.04 0.00 3.13 2.19 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 18 Y 7.62 4.45 0.00 3.12 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 19 R 8.82 3.88 0.00 1.72 1.86 0.00 2.92 0.00 0.00 2.95 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.50 0.00 20 F 8.39 4.32 0.00 2.81 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.97 5.38 0.00 1.87 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 2.22 2.28 0.00 22 G 9.16 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 23 L 8.20 4.99 0.00 1.70 1.41 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 24 V 8.61 4.04 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 0.84 0.00 0.00 0.81 0.00 0.00 25 Q 9.14 4.50 0.00 1.83 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.40 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 26 R 7.61 4.76 0.00 1.65 1.74 0.00 3.22 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 27 V 8.04 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 0.81 0.00 0.00 0.94 0.00 0.00 28 S 9.62 4.47 0.00 3.82 3.62 0.00 0.00 0.00 0.00 0.00 0.00 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 9.79 4.39 0.00 2.78 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 30 G 8.37 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 31 K 8.02 5.28 0.00 1.82 1.75 0.00 1.61 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.53 7.81 32 A 9.16 5.17 1.20 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 33 A 8.97 4.72 1.19 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 34 V 8.97 4.57 1.95 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 0.41 0.00 0.00 0.98 0.00 0.00 35 L 8.52 4.70 0.00 1.60 1.33 0.75 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.56 5.37 0.00 2.85 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 37 E 8.82 5.22 0.00 1.92 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 2.26 2.43 0.00 38 N 10.14 4.61 0.00 3.04 3.02 0.00 0.00 7.12 8.69 0.00 0.00 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 G 8.38 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 40 N 9.00 4.62 0.00 2.82 2.94 0.00 0.00 6.70 7.68 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 41 W 8.29 4.57 0.00 3.44 3.37 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 42 D 7.13 4.40 0.00 2.48 2.39 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.10 4.33 0.00 1.34 1.55 0.00 1.70 0.00 0.00 1.43 0.00 0.00 2.80 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.58 1.76 7.81 44 L 8.40 4.75 0.00 1.48 1.46 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 45 V 8.60 4.35 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 0.36 0.00 0.00 0.78 0.00 0.00 46 T 8.14 4.94 4.12 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 1.18 0.00 0.00 47 F 9.06 5.05 0.00 2.94 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 48 R 9.55 4.61 0.00 1.92 1.90 0.00 3.18 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 49 L 8.60 4.03 0.00 1.76 1.76 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.08 4.35 0.00 4.01 4.02 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 51 E 8.47 4.52 0.00 2.34 2.10 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 2.37 2.37 0.00 52 L 7.56 5.23 0.00 1.51 1.48 0.94 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.87 4.65 0.00 2.02 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 2.24 0.00 54 A 8.77 4.60 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 55 V 8.59 4.54 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 0.81 0.00 0.00 1.01 0.00 0.00 56 K 8.51 4.16 0.00 1.73 1.73 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.50 7.81