NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 E 4.2874 8.4444 121.4696 54.4540 32.1136 175.6978 10 E 4.1742 8.2249 120.3420 54.8410 31.7699 173.1443 11 E 5.5772 8.5213 125.5834 56.3366 32.8597 175.9536 12 E 5.9800 7.8148 135.0000 57.1524 29.3579 177.1224 13 L 4.6560 7.4210 118.6084 52.7914 43.7027 177.3820 14 V 3.8653 8.1941 118.1784 60.0503 30.1354 174.4022 15 D 4.3639 8.2831 123.0321 53.8421 41.6857 174.8741 16 P 4.2334 0.0000 0.0000 65.1875 31.4010 178.1123 17 L 3.8374 7.8872 118.8904 58.6745 42.0564 178.8647 18 T 3.8625 7.8620 114.6767 67.3343 68.1422 176.0391 19 T 3.9688 8.0142 117.3025 67.1061 68.4940 176.7886 20 V 3.7801 8.4505 120.2507 65.9442 31.5258 178.5096 21 R 3.9264 8.5161 118.5053 59.4729 29.8015 178.1205 22 E 4.0518 8.1049 117.6792 59.7797 29.5986 178.9318 23 Q 3.9427 7.8492 119.1953 60.0790 28.9167 177.9214 24 C 4.3203 8.0668 118.5959 58.8830 43.7587 174.3733 25 E 3.9037 8.8462 122.3719 60.0331 29.4572 178.0992 26 Q 3.6120 8.8619 113.1313 58.7379 29.3535 177.6130 27 L 3.4827 8.0532 114.7981 53.2019 43.4760 178.7258 28 E 3.3397 8.0140 120.8864 57.4231 31.7951 178.8582 29 K 3.8848 7.9015 116.7323 60.0306 32.3592 179.0346 30 C 4.1679 8.3669 116.7518 62.0807 28.0480 176.2425 31 V 3.6583 7.6968 119.7146 66.0700 31.2895 178.0576 32 K 3.9996 8.1152 117.8837 59.4249 31.8969 179.3047 33 A 4.0689 7.9892 120.6228 55.2477 18.2777 179.7256 34 R 3.8331 8.7097 117.5776 59.1200 30.0669 178.2937 35 E 3.9139 8.2359 119.4372 59.5572 29.6841 179.1385 36 R 4.0961 7.8966 117.4156 59.2056 29.8665 178.3208 37 L 3.8998 8.0177 120.3050 58.3272 41.9768 178.6726 38 E 3.8969 8.6537 118.3243 59.5905 29.4178 179.3144 39 L 3.9437 8.3877 119.1146 58.2578 41.8486 179.2038 40 C 4.0867 8.6181 118.6864 62.3123 31.4951 174.9201 41 D 4.3105 8.9506 120.9237 57.7908 40.8762 178.5368 42 E 4.0689 8.6059 118.7774 58.8825 29.1129 179.7788 43 R 3.8684 7.3663 118.0750 59.3701 30.3135 178.7886 44 V 3.7207 7.4437 116.2524 66.0526 31.7355 177.9630 45 S 4.3280 7.9343 114.6235 61.5307 62.4201 176.7273 46 S 4.3423 7.5202 112.2161 60.5434 62.5695 174.2478 47 R 4.5282 8.0979 120.8116 55.3918 33.5502 172.7179 48 S 4.4452 8.1503 109.2042 60.2554 64.1425 176.3113 49 Q 4.2223 8.4890 117.6436 56.6093 28.7913 176.0598 50 T 4.4338 7.9898 111.6029 60.9252 68.4535 174.1799 51 E 4.7223 8.2046 118.4201 56.0468 33.2952 176.0287 52 E 4.1263 7.6307 119.6355 56.5340 27.9251 175.0593 53 D 4.6706 8.4574 123.7873 53.7156 40.8523 177.5394 54 C 4.8197 8.2046 114.1867 60.6767 25.7604 175.1840 55 T 3.7265 7.5236 118.8592 66.5653 67.9600 176.0508 56 E 3.9647 8.1362 120.6704 59.5988 29.9009 178.4323 57 E 4.0166 8.2900 117.9446 59.3456 29.3711 179.2027 58 L 3.9479 7.5052 119.9068 58.2549 42.2053 178.9191 59 L 4.0638 7.5885 117.5764 58.0012 41.6912 179.2980 60 D 4.3567 8.1228 118.5543 57.2751 40.7411 178.6171 61 F 4.0606 8.1673 120.4936 61.3102 39.3620 176.8801 62 L 3.9855 8.5397 118.9754 58.4008 41.4227 178.6153 63 H 4.2636 8.9413 117.8654 59.6038 29.1871 176.6395 64 A 3.9635 7.9934 121.5822 55.2757 18.1826 179.5780 65 R 3.6288 7.7646 116.8368 59.7827 30.2256 178.5209 66 D 4.3974 8.8667 119.7800 57.3689 40.7948 178.4935 67 H 4.0028 8.4656 119.2731 59.5019 30.0439 176.5467 68 C 4.3037 7.8788 119.4787 59.6051 41.1495 175.3360 69 V 3.4785 8.1204 120.1958 65.8873 30.8670 177.5029 70 A 4.0180 7.9009 119.7458 55.6704 18.3435 178.6086 71 H 4.0865 7.7611 114.4815 59.3375 30.0320 176.9340 72 K 4.3397 7.7061 117.0367 55.9399 32.7682 178.2121 73 L 3.9922 9.1213 121.7215 56.3666 39.9142 179.4289 74 F 3.9435 8.6603 121.2654 60.3019 40.4118 177.5815 75 N 4.3053 8.3051 118.5083 56.7283 38.5482 176.6156 76 S 4.2494 8.1469 111.8528 61.2390 63.2291 175.2219 77 L 3.8384 6.8864 118.8779 55.3726 41.8464 177.3303 78 K 4.1845 8.6086 122.9723 56.4987 32.3367 175.4008 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 9 E 8.44 4.29 0.00 1.94 1.91 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 2.19 2.30 0.00 10 E 8.22 4.17 0.00 2.01 1.91 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 2.18 2.36 0.00 11 E 8.52 5.58 0.00 2.00 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 2.04 2.08 0.00 12 E 7.81 5.98 0.00 2.11 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 2.08 2.00 0.00 13 L 7.42 4.66 0.00 1.58 1.55 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.19 3.87 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 0.70 0.00 0.00 0.92 0.00 0.00 15 D 8.28 4.36 0.00 2.75 2.68 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 0.00 0.00 0.00 16 P 0.00 4.23 0.00 2.07 2.05 0.00 3.56 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 17 L 7.89 3.84 0.00 1.68 1.63 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 18 T 7.86 3.86 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 1.21 0.00 0.00 19 T 8.01 3.97 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 20 V 8.45 3.78 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 1.01 0.00 0.00 0.96 0.00 0.00 21 R 8.52 3.93 0.00 2.12 1.98 0.00 3.19 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 22 E 8.10 4.05 0.00 2.18 1.97 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 2.35 2.55 0.00 23 Q 7.85 3.94 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 24 C 8.07 4.32 0.00 3.29 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 25 E 8.85 3.90 0.00 2.05 2.32 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 2.51 2.88 0.00 26 Q 8.86 3.61 0.00 2.31 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.13 0.00 0.00 0.00 0.00 0.00 2.43 2.55 0.00 27 L 8.05 3.48 0.00 1.95 1.57 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.01 3.34 0.00 2.06 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 2.36 2.45 0.00 29 K 7.90 3.88 0.00 1.79 1.84 0.00 1.69 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.52 7.81 30 C 8.37 4.17 0.00 3.14 2.54 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 0.00 0.00 0.00 0.00 31 V 7.70 3.66 2.27 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 1.10 0.00 0.00 1.02 0.00 0.00 32 K 8.12 4.00 0.00 2.02 1.87 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.47 7.81 33 A 7.99 4.07 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.71 3.83 0.00 2.18 2.04 0.00 2.69 0.00 0.00 3.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.39 0.00 35 E 8.24 3.91 0.00 2.29 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 2.32 2.37 0.00 36 R 7.90 4.10 0.00 2.12 1.98 0.00 3.21 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 37 L 8.02 3.90 0.00 1.88 1.73 0.83 0.56 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 38 E 8.65 3.90 0.00 2.16 1.98 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 2.29 2.41 0.00 39 L 8.39 3.94 0.00 1.82 1.71 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.62 4.09 0.00 3.05 3.07 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 41 D 8.95 4.31 0.00 2.67 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.61 4.07 0.00 2.11 1.98 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 2.32 2.33 0.00 43 R 7.37 3.87 0.00 1.87 1.98 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 44 V 7.44 3.72 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 0.86 0.00 0.00 1.06 0.00 0.00 45 S 7.93 4.33 0.00 4.03 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 46 S 7.52 4.34 0.00 3.99 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 47 R 8.10 4.53 0.00 1.75 1.81 0.00 3.10 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 48 S 8.15 4.45 0.00 3.78 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 49 Q 8.49 4.22 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 50 T 7.99 4.43 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 51 E 8.20 4.72 0.00 1.94 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 2.21 2.29 0.00 52 E 7.63 4.13 0.00 2.06 1.90 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 2.32 2.28 0.00 53 D 8.46 4.67 0.00 2.74 2.64 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 54 C 8.20 4.82 0.00 3.14 3.01 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 55 T 7.52 3.73 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 1.22 0.00 0.00 56 E 8.14 3.96 0.00 2.04 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 2.39 2.42 0.00 57 E 8.29 4.02 0.00 2.10 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 2.42 2.46 0.00 58 L 7.51 3.95 0.00 1.65 1.85 0.86 0.61 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 59 L 7.59 4.06 0.00 1.91 1.75 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 60 D 8.12 4.36 0.00 3.01 2.75 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 0.00 0.00 0.00 0.00 61 F 8.17 4.06 0.00 3.21 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 62 L 8.54 3.99 0.00 1.99 1.79 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.94 4.26 0.00 3.24 3.47 0.00 5.60 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 64 A 7.99 3.96 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 65 R 7.76 3.63 0.00 1.26 1.84 0.00 3.10 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 66 D 8.87 4.40 0.00 2.66 2.68 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 0.00 0.00 0.00 67 H 8.47 4.00 0.00 3.12 3.24 0.00 5.79 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 68 C 7.88 4.30 0.00 3.04 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 69 V 8.12 3.48 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 0.94 0.00 0.00 0.98 0.00 0.00 70 A 7.90 4.02 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 71 H 7.76 4.09 0.00 3.30 3.34 0.00 5.94 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.71 4.34 0.00 1.79 1.85 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.44 7.81 73 L 9.12 3.99 0.00 1.84 1.27 0.80 0.38 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 74 F 8.66 3.94 0.00 3.22 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 75 N 8.31 4.31 0.00 2.72 2.93 0.00 0.00 7.03 7.17 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 76 S 8.15 4.25 0.00 3.84 3.91 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 77 L 6.89 3.84 0.00 2.03 1.75 0.58 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.61 4.18 0.00 1.69 1.64 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.40 7.81