NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 F 4.7175 8.3249 122.8169 57.9299 41.1936 175.8620 19 L 4.1579 7.5572 118.5405 53.4358 42.0007 176.7509 20 K 4.0547 8.0239 123.0263 58.9267 33.2732 178.2265 21 G 3.7713 7.9144 104.7066 46.2284 0.0000 173.6317 22 L 4.3891 7.4098 117.8477 53.7350 43.9220 176.8042 23 V 3.8245 7.2878 117.8148 64.4690 31.7835 174.7244 24 N 4.1764 8.7145 120.6744 54.4474 36.9822 173.6943 25 H 4.7782 8.1617 115.1459 54.2564 32.1314 174.1007 26 R 4.8602 8.4203 120.1540 55.5936 30.4568 175.2231 27 V 4.8151 8.8586 119.9242 59.2922 36.0116 175.1753 28 G 4.2553 9.6248 110.6952 44.6878 0.0000 172.2691 29 V 4.6635 9.1716 127.5077 61.0735 33.3917 174.3574 30 K 4.7396 8.5377 129.3375 54.6088 34.3965 175.4228 31 L 4.6285 7.6466 126.6161 53.5558 43.0003 177.3751 32 K 4.0860 8.0019 120.1246 59.3194 32.0379 177.9498 33 F 4.6791 7.0148 113.3345 56.5037 39.7710 176.9060 34 N 4.4432 8.8680 119.4935 52.8253 36.9321 173.3522 35 S 4.7255 8.0844 106.7671 58.4531 62.3412 173.7049 36 T 4.8187 7.4664 116.6652 62.9708 71.2648 175.3164 37 E 4.7138 9.2874 126.1087 54.6716 33.4885 173.4230 38 Y 5.1797 8.8068 124.9385 56.6239 40.1347 174.7198 39 R 4.9962 9.4000 124.4841 54.9892 32.9689 176.1404 40 G 4.0693 8.6583 108.5248 46.4865 0.0000 170.9696 41 T 4.9711 8.3468 117.3246 61.6268 70.8365 174.2611 42 L 4.3829 8.6689 129.4195 54.9474 41.6256 177.1978 43 V 3.7455 8.5866 128.0990 65.7090 32.0408 175.2881 44 S 4.5301 7.2432 112.5338 59.9440 65.9376 173.6452 45 T 4.7089 7.9060 113.1318 66.9295 72.6594 171.8536 46 D 4.4910 8.1990 119.3453 53.6363 41.3149 176.4969 47 N 4.2976 9.2920 118.0886 57.1042 38.5397 176.2952 48 Y 3.9480 7.7584 112.7893 59.3584 37.7194 177.0037 49 F 3.6433 8.8012 118.0900 58.2672 37.0274 173.6753 50 N 5.2787 8.3598 118.2974 52.6759 39.5676 174.2227 51 L 4.9493 9.2324 122.7453 54.1830 44.8882 174.7342 52 Q 4.4083 8.1967 121.8520 54.3505 30.8270 173.8596 53 L 5.0445 9.0044 129.7172 53.2135 45.0960 174.4288 54 N 5.2474 9.1241 123.8597 51.8719 42.1734 173.7749 55 E 3.9196 9.2745 120.0730 57.0101 29.4485 174.8610 56 A 4.5354 7.7112 120.7461 53.3404 19.8989 177.0892 57 E 5.1138 9.8070 124.3475 54.1952 32.3921 175.0005 58 E 4.8678 8.9663 128.2914 56.5977 31.4746 175.5287 59 F 4.7162 8.7507 122.9529 56.2265 44.1156 173.2835 60 V 4.5323 8.9904 124.0907 61.5649 33.8459 175.4712 61 A 3.7780 10.0943 131.1982 53.2742 16.6833 177.3918 62 G 3.9886 8.5586 104.2670 47.2223 0.0000 174.0011 63 V 4.4439 8.1498 119.8484 60.2450 33.5797 175.0747 64 S 3.6108 8.4644 121.8741 58.5522 62.6627 173.2980 65 H 4.6839 8.1738 124.9974 55.8729 29.6768 173.3202 66 G 3.7088 8.2791 105.7302 44.9892 0.0000 173.4322 67 T 4.6869 8.0548 114.4681 61.7055 70.0929 174.2386 68 L 4.5449 8.1605 126.4675 52.3090 43.5107 180.1661 69 G 4.3963 8.5141 114.5813 46.1600 0.0000 175.9254 70 E 4.6995 9.0242 125.4985 55.3531 30.1417 174.5742 71 I 4.7054 8.7540 117.5929 59.0532 41.3224 174.3042 72 F 5.0777 9.0408 122.7967 56.1442 40.5382 174.9970 73 I 4.4631 9.6810 125.8929 60.0405 39.5403 175.0466 74 R 4.8250 8.6250 126.6495 56.1071 31.3811 177.9306 75 S 4.1049 9.8412 119.8634 62.0924 63.0970 174.2084 76 N 4.1996 7.7884 118.6445 56.2979 39.0127 175.8242 77 N 4.6992 8.2871 113.3924 53.6205 39.0536 174.4827 78 V 4.3988 8.5692 120.5834 61.4872 32.0427 174.8655 79 L 4.2404 8.2104 131.9018 56.8012 41.8146 175.9809 80 Y 5.0244 6.8171 114.0610 56.1915 41.6417 172.3139 81 I 5.4547 8.7848 120.5589 59.6753 39.9635 175.4203 82 R 4.7440 8.8459 121.5245 54.2785 33.1441 173.9759 83 E 4.3772 8.7016 121.8841 56.0489 30.6382 175.9127 84 L 3.8483 10.0015 126.5489 54.1614 41.9981 174.6251 85 P 3.6590 0.0000 0.0000 65.1543 32.0795 175.8138 86 N 4.5748 8.0082 122.5935 53.1963 37.3705 174.9257 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 18 F 8.32 4.72 0.00 3.00 3.18 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 0.00 0.00 0.00 19 L 7.56 4.16 0.00 1.70 1.45 0.25 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 20 K 8.02 4.05 0.00 1.77 1.77 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.41 7.81 21 G 7.91 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.41 4.39 0.00 1.63 1.60 0.86 0.62 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 23 V 7.29 3.82 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 0.78 0.00 0.00 0.94 0.00 0.00 24 N 8.71 4.18 0.00 2.83 2.78 0.00 0.00 6.86 8.75 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 25 H 8.16 4.78 0.00 3.27 3.20 0.00 5.80 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 R 8.42 4.86 0.00 1.88 1.83 0.00 3.12 0.00 0.00 3.33 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 27 V 8.86 4.82 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 0.66 0.00 0.00 1.00 0.00 0.00 28 G 9.62 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 0.00 0.00 0.00 0.00 29 V 9.17 4.66 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 1.08 0.00 0.00 1.01 0.00 0.00 30 K 8.54 4.74 0.00 1.48 0.74 0.00 1.37 0.00 0.00 1.52 0.00 0.00 2.80 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.68 1.04 7.81 31 L 7.65 4.63 0.00 0.95 0.83 0.86 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.00 4.09 0.00 1.76 1.86 0.00 1.95 0.00 0.00 1.98 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.41 7.81 33 F 7.01 4.68 0.00 3.12 3.05 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 0.00 0.00 0.00 34 N 8.87 4.44 0.00 2.97 3.02 0.00 0.00 6.73 7.57 0.00 0.00 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 S 8.08 4.73 0.00 3.80 3.94 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 36 T 7.47 4.82 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 37 E 9.29 4.71 0.00 1.83 1.68 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 0.00 2.12 2.36 0.00 38 Y 8.81 5.18 0.00 3.06 2.89 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 0.00 0.00 0.00 39 R 9.40 5.00 0.00 1.78 1.79 0.00 2.21 0.00 0.00 2.75 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00 40 G 8.66 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 41 T 8.35 4.97 4.22 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 0.00 0.00 0.00 1.24 0.00 0.00 42 L 8.67 4.38 0.00 1.78 1.73 1.03 0.47 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 43 V 8.59 3.75 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 0.87 0.00 0.00 0.91 0.00 0.00 44 S 7.24 4.53 0.00 3.89 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 45 T 7.91 4.71 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 1.16 0.00 0.00 46 D 8.20 4.49 0.00 2.84 2.76 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 0.00 0.00 0.00 47 N 9.29 4.30 0.00 2.89 3.02 0.00 0.00 6.95 7.46 0.00 0.00 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 Y 7.76 3.95 0.00 3.34 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 49 F 8.80 3.64 0.00 3.34 3.33 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 50 N 8.36 5.28 0.00 3.13 2.84 0.00 0.00 6.50 6.74 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 51 L 9.23 4.95 0.00 1.67 1.69 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 8.20 4.41 0.00 1.72 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 1.51 1.16 0.00 53 L 9.00 5.04 0.00 1.64 1.39 0.91 0.37 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 54 N 9.12 5.25 0.00 2.74 2.64 0.00 0.00 6.97 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 55 E 9.27 3.92 0.00 2.22 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 2.21 2.24 0.00 56 A 7.71 4.54 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 57 E 9.81 5.11 0.00 2.18 2.33 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 2.04 2.31 0.00 58 E 8.97 4.87 0.00 2.38 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 2.30 2.27 0.00 59 F 8.75 4.72 0.00 3.16 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 60 V 8.99 4.53 1.72 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 0.88 0.00 0.00 0.67 0.00 0.00 61 A 10.09 3.78 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 62 G 8.56 3.99 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 0.00 0.00 0.00 63 V 8.15 4.44 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 0.94 0.00 0.00 0.98 0.00 0.00 64 S 8.46 3.61 0.00 3.10 3.47 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.17 4.68 0.00 2.97 3.20 0.00 5.69 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 66 G 8.28 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 67 T 8.05 4.69 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 1.27 0.00 0.00 68 L 8.16 4.54 0.00 1.53 1.57 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.51 4.40 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 0.00 70 E 9.02 4.70 0.00 1.91 1.80 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 0.00 2.27 2.26 0.00 71 I 8.75 4.71 1.76 0.00 0.00 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 1.11 0.82 0.83 0.00 0.00 72 F 9.04 5.08 0.00 2.85 3.06 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.68 4.46 2.03 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 1.15 0.72 1.00 0.00 0.00 74 R 8.62 4.82 0.00 1.81 1.93 0.00 3.69 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 75 S 9.84 4.10 0.00 3.65 3.80 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 0.00 0.00 0.00 0.00 76 N 7.79 4.20 0.00 2.79 2.95 0.00 0.00 6.91 8.00 0.00 0.00 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 N 8.29 4.70 0.00 2.82 2.94 0.00 0.00 6.61 8.92 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 78 V 8.57 4.40 2.13 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 0.83 0.00 0.00 1.05 0.00 0.00 79 L 8.21 4.24 0.00 1.43 1.23 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 6.82 5.02 0.00 3.13 3.08 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 81 I 8.78 5.45 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.02 0.98 0.00 0.00 82 R 8.85 4.74 0.00 1.78 1.90 0.00 2.75 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 83 E 8.70 4.38 0.00 1.97 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 2.27 2.34 0.00 84 L 10.00 3.85 0.00 1.65 1.54 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 3.66 0.00 2.01 1.95 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 86 N 8.01 4.57 0.00 2.78 2.74 0.00 0.00 5.83 7.56 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