NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 T 4.3530 8.0333 117.3750 62.6589 69.4025 174.3180 14 P 3.9424 0.0000 0.0000 62.7051 31.4805 174.1969 15 E 3.5540 8.4069 117.9763 55.9938 31.0334 169.2861 16 E 3.9683 8.2207 125.0557 54.5048 31.2459 172.4285 17 P 4.1772 0.0000 0.0000 62.4078 31.3847 175.4136 18 K 4.8230 8.0775 131.5179 56.6213 33.3294 174.4716 19 E 4.3853 7.9057 125.9144 55.5127 31.6702 175.3509 20 E 5.0297 8.3969 117.5605 55.8830 34.0153 174.9571 21 V 4.5680 8.5554 112.8649 61.2250 37.0877 173.2183 22 T 4.5045 8.3678 117.9027 62.2325 70.3721 174.9042 23 I 4.5830 8.2867 128.1447 58.5794 38.1208 174.9529 24 K 4.3612 8.4026 126.9797 56.4403 33.4106 176.3302 25 V 5.0216 8.8143 123.2512 61.6191 35.5504 173.2068 26 N 4.9277 9.3756 125.4152 51.8852 40.7106 174.0210 27 L 4.8805 9.2468 124.9418 53.3237 43.3480 174.8739 28 I 4.7387 8.6484 125.9751 59.7943 39.0043 175.6923 29 F 4.9318 8.9392 125.8447 55.9251 40.7251 177.2576 30 A 4.0449 8.8647 123.5455 55.4593 18.3309 178.6790 31 D 4.3903 8.1577 113.2106 55.7294 41.2325 176.9341 32 G 4.0017 8.0747 106.8763 45.6574 0.0000 173.7498 33 K 4.4969 7.7351 119.0417 56.3047 34.0626 175.7334 34 I 5.3784 8.0691 120.6628 60.4168 41.0854 174.9224 35 Q 4.8357 9.6682 124.7892 54.5425 33.0806 174.4091 36 T 5.1624 8.0597 116.6388 62.0902 72.2134 172.9825 37 A 4.3433 7.8916 121.4604 51.6268 23.1263 175.3237 38 E 5.2391 8.4581 118.2006 54.5331 33.6651 175.3713 39 F 4.7401 8.8943 121.4257 55.6991 42.0694 174.2225 40 K 5.1995 9.4952 122.8635 53.1306 34.5433 177.7452 41 G 3.9318 7.9985 109.3159 45.4663 0.0000 170.9811 42 T 4.5257 8.4220 112.8403 62.8281 70.5088 175.3368 43 F 3.2910 8.4912 124.7138 59.7705 40.7215 177.0070 44 E 4.0959 8.5456 116.4896 60.2002 29.5413 179.3933 45 E 4.0166 8.0328 118.4278 57.9172 29.3603 179.3162 46 A 4.0773 8.3663 121.6688 55.0799 19.0947 179.3136 47 T 3.6379 8.0916 108.4294 65.1517 68.3524 176.2281 48 A 3.7152 7.9749 123.0133 54.9926 18.5357 178.9084 49 E 3.7731 8.1862 117.7552 59.7403 29.5384 179.1538 50 A 2.5800 8.3302 120.7353 54.8260 18.3009 178.7932 51 Y 3.5642 8.0832 114.9867 61.3080 37.9756 178.9602 52 R 4.0840 8.7439 119.5988 59.9230 30.1343 177.3272 53 Y 4.5276 8.2524 118.6347 60.9988 38.7829 177.8466 54 A 3.9787 8.3645 121.4755 55.3001 17.9788 179.2973 55 A 4.2729 8.6347 119.4901 55.5669 18.3842 179.4162 56 L 3.7331 8.5629 118.5887 58.5617 42.2009 178.6456 57 H 4.3807 8.1451 115.4122 58.1300 28.9996 177.1611 58 A 5.1088 8.4059 123.6480 54.0602 17.9219 179.4314 59 K 3.9258 7.5170 116.3031 58.9809 32.2166 177.9606 60 V 4.4735 8.3882 114.0739 61.1220 32.6041 175.5108 61 N 4.9329 8.2941 117.1459 52.8948 39.7298 175.1814 62 G 4.9085 8.0335 103.0109 46.4822 0.0000 173.3287 63 E 4.4900 8.5328 118.6556 56.2579 30.6186 176.2506 64 W 5.6382 8.5647 118.9818 54.5362 31.0805 174.5467 65 T 4.4480 7.7706 109.0882 61.3707 72.1366 171.6351 66 A 4.4170 7.8816 120.3408 52.8125 20.6449 176.6730 67 D 4.6940 8.1538 118.2033 52.0614 42.6056 175.5688 68 L 4.4573 8.4217 122.5937 54.9009 43.2150 175.1757 69 E 4.5827 8.9717 117.2934 56.7452 33.2892 175.9668 70 D 4.2087 9.8239 115.7045 54.9802 39.5514 173.4224 71 G 3.8462 8.0931 103.4304 46.0806 0.0000 175.1593 72 G 4.0810 8.0964 109.5292 44.9193 0.0000 175.4392 73 N 4.2964 7.8398 117.1062 56.5520 39.1922 174.2825 74 H 4.8420 8.0917 118.6928 56.0784 31.8929 173.0681 75 M 4.9572 8.6865 123.3843 54.1700 35.6018 173.1207 76 N 5.4035 8.2778 121.0176 51.6531 42.5121 173.9816 77 I 4.9077 8.5524 122.3092 59.2117 41.4513 174.2217 78 K 4.8387 8.5735 126.8418 55.1457 34.2729 175.9616 79 F 4.6241 8.6198 123.3508 55.9230 39.2914 175.4057 80 A 3.8284 8.9025 127.9616 53.3392 18.8848 178.8352 81 G 3.8989 8.9308 103.4456 46.2898 0.0000 173.7574 82 K 4.0077 8.4367 119.7553 57.9356 31.9403 174.5058 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 13 T 8.03 4.35 4.24 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 1.25 0.00 0.00 14 P 0.00 3.94 0.00 2.12 2.14 0.00 3.83 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 15 E 8.41 3.55 0.00 2.23 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 0.00 2.23 2.27 0.00 16 E 8.22 3.97 0.00 2.07 1.96 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 2.20 2.28 0.00 17 P 0.00 4.18 0.00 2.22 2.07 0.00 3.94 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 18 K 8.08 4.82 0.00 1.89 1.96 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.23 1.18 7.81 19 E 7.91 4.39 0.00 1.99 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 0.00 2.32 2.35 0.00 20 E 8.40 5.03 0.00 1.89 1.86 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 2.31 2.31 0.00 21 V 8.56 4.57 2.04 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 0.72 0.00 0.00 0.87 0.00 0.00 22 T 8.37 4.50 4.24 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 1.21 0.00 0.00 23 I 8.29 4.58 2.06 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 2.01 0.93 0.00 0.00 24 K 8.40 4.36 0.00 1.78 1.86 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.55 1.41 7.81 25 V 8.81 5.02 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.02 0.00 0.00 26 N 9.38 4.93 0.00 2.63 2.74 0.00 0.00 6.62 6.73 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 27 L 9.25 4.88 0.00 1.76 1.27 1.12 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.65 4.74 1.87 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 1.25 0.83 0.96 0.00 0.00 29 F 8.94 4.93 0.00 3.08 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.86 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.39 0.00 2.66 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 32 G 8.07 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.74 4.50 0.00 1.64 1.70 0.00 1.42 0.00 0.00 1.62 0.00 0.00 2.76 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.48 1.59 7.81 34 I 8.07 5.38 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.55 0.99 0.00 0.00 35 Q 9.67 4.84 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.61 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 36 T 8.06 5.16 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 1.29 0.00 0.00 37 A 7.89 4.34 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 38 E 8.46 5.24 0.00 1.70 1.77 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 2.19 2.26 0.00 39 F 8.89 4.74 0.00 2.81 2.87 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 40 K 9.50 5.20 0.00 1.60 1.70 0.00 1.88 0.00 0.00 0.61 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.24 7.81 41 G 8.00 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 0.00 0.00 0.00 42 T 8.42 4.53 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 1.24 0.00 0.00 43 F 8.49 3.29 0.00 3.17 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 44 E 8.55 4.10 0.00 2.25 2.25 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 2.43 2.46 0.00 45 E 8.03 4.02 0.00 2.11 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 2.34 2.35 0.00 46 A 8.37 4.08 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.09 3.64 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 1.14 0.00 0.00 48 A 7.97 3.72 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 49 E 8.19 3.77 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 50 A 8.33 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 8.08 3.56 0.00 3.15 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 R 8.74 4.08 0.00 2.15 2.11 0.00 3.18 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 53 Y 8.25 4.53 0.00 3.46 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 54 A 8.36 3.98 0.08 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 55 A 8.63 4.27 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 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.56 3.73 0.00 1.79 1.85 1.03 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.15 4.38 0.00 3.24 2.85 0.00 5.70 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.41 5.11 1.69 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 0.00 0.00 0.00 0.00 0.00 0.00 59 K 7.52 3.93 0.00 1.94 1.94 0.00 1.68 0.00 0.00 1.88 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.61 7.81 60 V 8.39 4.47 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 0.78 0.00 0.00 0.94 0.00 0.00 61 N 8.29 4.93 0.00 2.86 2.96 0.00 0.00 7.18 7.58 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 62 G 8.03 4.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 8.53 4.49 0.00 1.89 1.76 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 2.37 2.32 0.00 64 W 8.56 5.64 0.00 2.65 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 65 T 7.77 4.45 4.14 0.00 0.00 0.00 0.00 0.00 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 66 A 7.88 4.42 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 67 D 8.15 4.69 0.00 2.62 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.42 4.46 0.00 1.57 1.65 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.97 4.58 0.00 2.06 2.05 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 2.13 2.22 0.00 70 D 9.82 4.21 0.00 2.86 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 71 G 8.09 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 72 G 8.10 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 73 N 7.84 4.30 0.00 2.92 2.89 0.00 0.00 6.77 8.16 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 74 H 8.09 4.84 0.00 3.26 3.18 0.00 5.84 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 75 M 8.69 4.96 0.00 1.98 1.73 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 76 N 8.28 5.40 0.00 2.69 2.63 0.00 0.00 6.58 7.20 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 77 I 8.55 4.91 1.82 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.41 0.19 0.00 0.00 78 K 8.57 4.84 0.00 1.69 1.69 0.00 1.47 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.45 1.50 7.81 79 F 8.62 4.62 0.00 2.79 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 80 A 8.90 3.83 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 81 G 8.93 3.90 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 0.00 0.00 0.00 82 K 8.44 4.01 0.00 1.91 1.81 0.00 1.64 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.20 1.24 7.81