NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 D 4.5525 8.3644 120.1926 54.1223 42.2680 175.4499 21 D 4.4211 7.5915 121.3802 53.2506 43.3421 174.0712 22 G 3.6383 8.6013 114.4150 48.3844 0.0000 175.6486 23 T 3.5942 7.8711 112.5932 64.1231 68.7350 176.5712 24 Q 3.9810 8.1307 120.6270 58.9185 28.8016 178.4839 25 T 3.8841 7.7770 116.7942 66.6521 68.5243 176.8288 26 L 3.9958 8.0914 121.0948 57.8516 41.5449 179.4301 27 Q 3.9780 8.1533 119.6969 58.7594 28.9161 178.4807 28 G 3.5493 7.8427 106.6178 47.7978 0.0000 175.6429 29 E 4.0240 8.3255 121.2761 58.9205 29.3699 179.2439 30 L 4.0037 8.1019 120.4977 58.4566 42.1477 179.1470 31 T 3.8908 8.1258 115.8048 66.7346 68.3714 176.6900 32 L 4.0220 8.1105 120.6878 57.5745 41.6851 179.4149 33 A 4.0824 8.2187 121.0147 54.9688 18.3276 179.4567 34 L 3.6002 8.3424 119.1707 58.0896 42.0936 178.6143 35 D 4.2978 8.2492 118.0901 57.3373 41.0171 178.4846 36 K 3.9730 8.0379 118.9475 59.3460 31.8335 179.1424 37 L 3.9175 7.6467 119.1253 58.1088 42.0946 178.5430 38 A 4.0580 8.1961 120.0610 54.9956 18.3315 179.3180 39 K 4.2079 7.7318 115.5694 58.0162 33.8769 177.4647 40 N 5.0377 7.7654 116.2283 51.1245 39.2347 173.3497 41 P 4.4676 0.0000 0.0000 64.3598 32.0695 178.0368 42 S 4.3525 7.8280 112.5860 58.6520 63.3240 173.9922 43 N 4.6021 8.0705 121.7380 52.2797 39.1945 173.4326 44 P 4.3577 0.0000 0.0000 65.6386 31.4557 178.1416 45 Q 3.9983 8.5743 120.1315 59.0844 28.9508 177.9932 46 L 4.0379 8.0682 119.6695 57.3425 41.5975 179.0951 47 L 3.9839 7.7118 119.4608 58.1703 42.0334 178.8356 48 A 4.2871 7.9884 122.0501 54.7592 18.2737 179.4944 49 E 3.9175 8.4831 117.2504 59.5959 29.4303 178.9820 50 Y 4.0014 8.1481 119.6735 60.6621 38.4117 177.8633 51 Q 3.8574 8.4012 119.2797 59.0667 28.7729 178.8794 52 S 4.0969 8.2531 114.2551 61.2333 62.5396 176.1262 53 K 3.8782 8.0872 122.4206 59.2854 31.8206 178.6016 54 L 3.8477 7.8379 121.0460 58.1457 41.9344 179.1400 55 S 4.1846 8.1589 116.6479 61.0291 62.8969 176.0917 56 E 3.9993 8.4337 122.2310 59.5870 28.7203 178.3948 57 Y 4.0975 7.8881 119.3441 60.7785 38.9282 177.9758 58 T 3.6323 7.7172 110.5976 64.6326 68.8777 176.6540 59 L 4.0514 8.3690 122.2911 57.5604 41.3473 178.7546 60 Y 3.9041 7.6000 118.4338 60.8545 38.8625 178.2302 61 R 4.1291 7.6316 118.0620 59.2498 30.1384 178.7749 62 N 4.2946 8.3224 116.1782 56.1160 38.3260 177.3233 63 A 3.9598 8.1419 122.4649 55.0626 17.9128 179.7444 64 Q 3.8669 7.6223 117.0842 59.0437 28.8189 178.9449 65 S 3.9393 7.9403 114.5635 61.0622 63.2663 176.0822 66 N 4.3495 8.0272 120.5435 56.3949 38.2107 177.4175 67 T 3.8230 7.6519 117.3973 66.5567 68.5113 176.9113 68 V 3.5945 7.3229 119.8685 65.8829 31.5470 178.1793 69 K 3.9333 8.1443 118.2926 59.3853 31.8144 179.4265 70 V 3.5606 7.9701 118.5401 66.1244 31.4002 178.0765 71 I 3.7092 7.7863 119.4631 64.4150 36.8798 178.5660 72 K 3.9459 8.2282 119.3266 59.4353 31.8425 178.9312 73 D 4.2793 8.0742 118.4195 57.1910 41.1565 178.3786 74 V 3.5626 8.0861 119.2623 66.0547 31.5435 177.5096 75 D 4.2832 8.3641 117.6624 57.2513 41.0873 177.9367 76 A 3.9651 8.2009 121.1504 55.2466 18.1415 179.5138 77 A 3.9486 7.9329 118.1451 55.2787 18.8456 179.5872 78 I 3.7976 7.8130 118.4086 64.4498 36.9118 178.7172 79 L 3.9033 7.7691 119.1818 57.4861 41.6232 178.8180 80 E 3.9948 7.8723 113.9493 56.9024 29.4994 176.5848 81 H 4.4705 7.5101 122.3232 56.6757 29.6434 174.2165 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 20 D 8.36 4.55 0.00 2.66 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 21 D 7.59 4.42 0.00 2.84 2.52 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 22 G 8.60 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 23 T 7.87 3.59 4.10 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 0.68 0.00 0.00 24 Q 8.13 3.98 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 25 T 7.78 3.88 4.41 0.00 0.00 0.00 0.00 0.00 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 26 L 8.09 4.00 0.00 1.70 1.72 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 27 Q 8.15 3.98 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.28 2.24 0.00 28 G 7.84 3.55 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 0.00 0.00 0.00 29 E 8.33 4.02 0.00 2.20 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 0.00 2.34 2.49 0.00 30 L 8.10 4.00 0.00 1.85 1.83 0.61 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.13 3.89 4.38 0.00 0.00 0.00 0.00 0.00 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 32 L 8.11 4.02 0.00 1.86 1.73 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.22 4.08 1.56 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 34 L 8.34 3.60 0.00 1.80 1.81 0.31 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.25 4.30 0.00 2.92 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 36 K 8.04 3.97 0.00 2.01 1.85 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.66 7.81 37 L 7.65 3.92 0.00 1.63 1.76 0.93 0.88 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 38 A 8.20 4.06 1.29 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 0.00 0.00 39 K 7.73 4.21 0.00 1.72 1.87 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.55 7.81 40 N 7.77 5.04 0.00 2.62 2.68 0.00 0.00 6.61 8.44 0.00 0.00 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 P 0.00 4.47 0.00 2.16 2.14 0.00 3.74 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 42 S 7.83 4.35 0.00 3.99 4.01 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 0.00 0.00 0.00 43 N 8.07 4.60 0.00 2.80 2.87 0.00 0.00 6.88 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.36 0.00 2.31 2.30 0.00 3.75 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 45 Q 8.57 4.00 0.00 2.19 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 46 L 8.07 4.04 0.00 1.88 1.72 0.99 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.71 3.98 0.00 1.81 1.87 0.98 1.06 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 48 A 7.99 4.29 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 49 E 8.48 3.92 0.00 2.20 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 2.35 2.45 0.00 50 Y 8.15 4.00 0.00 3.14 3.14 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 0.00 51 Q 8.40 3.86 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.44 2.60 0.00 52 S 8.25 4.10 0.00 3.86 4.03 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 3.88 0.00 1.94 1.74 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.42 7.81 54 L 7.84 3.85 0.00 1.22 1.51 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.16 4.18 0.00 4.02 3.88 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 0.00 0.00 0.00 56 E 8.43 4.00 0.00 2.14 2.18 0.00 0.00 0.00 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 57 Y 7.89 4.10 0.00 3.10 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 58 T 7.72 3.63 4.19 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 1.35 0.00 0.00 59 L 8.37 4.05 0.00 1.84 1.75 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 7.60 3.90 0.00 3.06 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 61 R 7.63 4.13 0.00 1.87 1.89 0.00 3.36 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.50 0.00 62 N 8.32 4.29 0.00 2.92 2.83 0.00 0.00 6.88 7.27 0.00 0.00 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 A 8.14 3.96 1.23 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 0.00 0.00 64 Q 7.62 3.87 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 65 S 7.94 3.94 0.00 4.03 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 66 N 8.03 4.35 0.00 2.86 2.87 0.00 0.00 6.86 7.21 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 67 T 7.65 3.82 4.33 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 1.18 0.00 0.00 68 V 7.32 3.59 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 1.02 0.00 0.00 0.92 0.00 0.00 69 K 8.14 3.93 0.00 2.01 1.83 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.53 7.81 70 V 7.97 3.56 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.94 0.00 0.00 71 I 7.79 3.71 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.70 0.90 0.00 0.00 72 K 8.23 3.95 0.00 1.92 1.85 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.58 7.81 73 D 8.07 4.28 0.00 2.89 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.09 3.56 2.23 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 0.93 0.00 0.00 0.95 0.00 0.00 75 D 8.36 4.28 0.00 2.81 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.20 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 3.95 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 78 I 7.81 3.80 2.02 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 1.26 0.91 0.00 0.00 79 L 7.77 3.90 0.00 1.72 1.65 0.90 0.71 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 80 E 7.87 3.99 0.00 2.12 2.03 0.00 0.00 0.00 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 2.33 0.00 81 H 7.51 4.47 0.00 3.27 3.25 0.00 5.88 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00