NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 T 4.2940 8.0285 117.3744 63.7099 70.9989 175.8907 30 A 3.8394 7.9077 123.0192 54.7317 18.4634 176.2678 31 E 3.9411 8.2922 116.9114 59.3248 29.9864 177.5922 32 L 3.9573 7.7239 120.0588 58.0240 42.2668 178.4571 33 Q 3.9302 8.4995 119.7918 59.1470 28.9844 178.1809 34 A 3.9729 7.9548 121.6786 55.2476 18.4586 179.2405 35 E 3.8913 8.0715 117.4152 59.4765 29.6256 179.0854 36 I 3.7311 7.9246 119.8899 64.5365 37.1777 178.1930 37 D 4.3514 8.2996 119.7751 57.3666 40.5324 178.5730 38 D 4.3712 8.2377 119.4610 57.7783 40.7524 179.0252 39 T 3.8771 8.0755 116.2373 66.3742 68.3178 176.9445 40 V 3.6735 8.2161 120.8356 65.8361 31.5230 178.2681 41 G 3.6155 8.0300 105.3306 48.0335 0.0000 175.6016 42 I 3.7366 7.9207 122.9899 64.3662 37.1241 178.5456 43 M 4.1168 8.4317 119.7760 58.2080 31.8744 178.9819 44 R 3.9333 8.3870 118.7760 59.3687 30.2648 178.6256 45 D 4.3995 8.2020 118.5827 57.6903 40.7771 178.8159 46 N 4.3794 8.2508 116.7603 56.2484 38.5023 177.5398 47 I 3.7023 7.8966 121.3424 64.3470 37.1755 177.9532 48 N 4.3173 8.0535 117.4137 56.6582 38.7593 177.1119 49 K 4.0135 8.1452 120.1928 59.4047 32.0677 179.7419 50 V 3.6653 8.3220 119.6065 64.3529 31.3934 178.4150 51 A 3.9424 8.0724 121.7577 55.0164 18.2544 179.1398 52 E 3.8698 8.1859 117.9158 59.3088 29.5993 178.9827 53 R 3.9798 8.1886 118.9766 59.4941 30.1723 178.7719 54 G 3.6109 8.3391 105.6518 47.8192 0.0000 175.5588 55 E 4.0124 8.2389 120.8962 59.3050 29.3892 179.6588 56 R 3.9699 8.1222 118.1738 59.1780 30.0308 179.0896 57 L 3.9977 8.2994 119.2264 57.9534 41.6878 179.7856 58 T 3.8507 7.9212 115.7910 66.6928 68.5051 176.7204 59 S 4.1175 8.1108 115.0338 61.4778 62.3559 176.3405 60 I 3.7480 8.1408 122.9009 64.1883 36.8565 177.7754 61 E 3.9112 8.4720 120.5839 59.3299 29.3754 178.4876 62 D 4.2578 7.9743 117.3892 57.5227 41.3672 178.5544 63 K 4.0545 8.0517 118.4025 58.9752 31.9462 179.4082 64 A 3.9472 8.6339 121.8335 55.0243 18.3307 178.9310 65 D 4.2735 8.0030 116.5559 57.8545 41.2448 178.2717 66 N 4.3409 8.1930 116.7503 56.2341 38.4840 177.1599 67 L 3.9184 8.1109 121.5928 58.0265 42.1256 178.8609 68 A 3.9974 8.1170 120.7327 55.0930 18.3403 179.6104 69 V 3.5208 7.7880 116.6386 66.4832 31.5832 178.2512 70 S 4.1966 8.4281 114.8407 61.6718 62.6155 176.7909 71 A 4.0820 8.5386 123.6944 55.2010 18.1707 179.3918 72 Q 4.0340 8.4521 118.4495 59.2670 29.0320 178.6756 73 G 3.6972 8.6653 107.0659 47.8504 0.0000 175.2689 74 F 4.2430 8.6263 123.6786 60.8013 39.3370 176.9644 75 K 3.5402 8.3534 119.5259 59.5572 31.9135 178.9619 76 R 3.9377 8.4298 118.6708 59.1659 30.0362 179.1456 77 G 3.6017 8.2526 105.5348 47.8680 0.0000 175.5054 78 A 3.8583 7.8793 123.4239 54.6061 18.2331 179.2363 79 N 4.1346 8.2165 115.8581 57.1030 39.1720 177.5130 80 R 3.9107 8.7584 120.3350 58.8719 29.9595 179.3804 81 V 3.6118 7.8851 118.5332 65.8935 31.3463 178.0528 82 R 3.7306 8.0357 117.8040 59.3057 30.1423 178.4027 83 K 4.2500 8.4233 118.4404 59.3164 31.8645 179.2032 84 A 4.0395 7.8926 120.0650 55.5350 18.4281 179.4482 85 M 4.2010 8.6735 116.5219 57.5801 32.0453 177.0157 86 W 4.8803 7.9755 132.8659 57.7230 31.0875 175.3986 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 29 T 8.03 4.29 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 30 A 7.91 3.84 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 31 E 8.29 3.94 0.00 2.07 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 0.00 2.40 2.42 0.00 32 L 7.72 3.96 0.00 1.75 1.85 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 33 Q 8.50 3.93 0.00 2.25 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 34 A 7.95 3.97 1.39 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 0.00 0.00 35 E 8.07 3.89 0.00 2.09 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 0.00 2.30 2.35 0.00 36 I 7.92 3.73 1.99 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 1.52 0.67 0.91 0.00 0.00 37 D 8.30 4.35 0.00 2.82 2.71 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 38 D 8.24 4.37 0.00 2.87 2.71 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 39 T 8.08 3.88 4.37 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 1.21 0.00 0.00 40 V 8.22 3.67 2.26 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 1.08 0.00 0.00 1.01 0.00 0.00 41 G 8.03 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 0.00 0.00 0.00 42 I 7.92 3.74 2.00 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 1.52 0.88 0.91 0.00 0.00 43 M 8.43 4.12 0.00 2.01 2.18 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.82 0.00 44 R 8.39 3.93 0.00 1.99 1.98 0.00 3.14 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 45 D 8.20 4.40 0.00 2.92 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 46 N 8.25 4.38 0.00 2.91 2.86 0.00 0.00 7.06 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 7.90 3.70 2.04 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 1.64 1.17 0.91 0.00 0.00 48 N 8.05 4.32 0.00 2.87 2.99 0.00 0.00 7.25 5.54 0.00 0.00 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 K 8.15 4.01 0.00 2.00 1.84 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.66 7.81 50 V 8.32 3.67 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 0.83 0.00 0.00 0.93 0.00 0.00 51 A 8.07 3.94 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.19 3.87 0.00 2.24 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 0.00 2.30 2.32 0.00 53 R 8.19 3.98 0.00 2.01 2.12 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 54 G 8.34 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.24 4.01 0.00 2.21 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 0.00 2.33 2.49 0.00 56 R 8.12 3.97 0.00 2.02 1.97 0.00 3.13 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 57 L 8.30 4.00 0.00 1.82 1.71 0.92 0.75 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 58 T 7.92 3.85 4.39 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 1.21 0.00 0.00 59 S 8.11 4.12 0.00 3.90 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 60 I 8.14 3.75 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 1.40 0.68 0.91 0.00 0.00 61 E 8.47 3.91 0.00 2.10 2.12 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 2.31 2.33 0.00 62 D 7.97 4.26 0.00 2.87 2.84 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.05 4.05 0.00 1.87 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.56 7.81 64 A 8.63 3.95 1.37 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 0.00 0.00 65 D 8.00 4.27 0.00 2.85 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.19 4.34 0.00 2.93 2.86 0.00 0.00 6.75 6.13 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 67 L 8.11 3.92 0.00 1.89 1.87 0.90 0.99 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 68 A 8.12 4.00 1.39 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 0.00 0.00 69 V 7.79 3.52 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 0.89 0.00 0.00 0.94 0.00 0.00 70 S 8.43 4.20 0.00 4.03 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 71 A 8.54 4.08 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.45 4.03 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 73 G 8.67 3.70 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 0.00 0.00 0.00 74 F 8.63 4.24 0.00 3.08 3.31 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 0.00 75 K 8.35 3.54 0.00 1.82 1.90 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.42 7.81 76 R 8.43 3.94 0.00 1.82 1.93 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 77 G 8.25 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 0.00 0.00 0.00 0.00 78 A 7.88 3.86 0.93 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 79 N 8.22 4.13 0.00 2.84 2.91 0.00 0.00 7.25 7.24 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 80 R 8.76 3.91 0.00 1.88 1.96 0.00 3.31 0.00 0.00 3.08 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 81 V 7.89 3.61 2.30 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 1.00 0.00 0.00 0.96 0.00 0.00 82 R 8.04 3.73 0.00 1.94 2.02 0.00 3.17 0.00 0.00 3.13 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 83 K 8.42 4.25 0.00 1.83 1.90 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.61 7.81 84 A 7.89 4.04 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 85 M 8.67 4.20 0.00 2.04 2.38 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.93 0.00 86 W 7.98 4.88 0.00 3.49 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00