NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 14 I 4.1246 7.8833 121.4457 60.1368 38.1529 174.8072 15 P 4.1829 0.0000 0.0000 63.9480 31.5187 174.9125 16 N 4.3962 9.2166 119.0229 53.4652 36.7604 173.7874 17 F 4.2643 7.8478 120.7497 57.9952 38.9275 174.4758 18 E 4.3021 6.6641 123.1290 55.1045 32.2079 175.7931 19 Y 4.0263 8.3479 118.7971 60.5666 38.6354 177.8897 20 A 3.9780 7.9956 122.6924 55.0768 18.9813 179.4917 21 R 3.8339 7.3944 115.1639 59.5726 30.1547 178.9035 22 R 4.0638 7.5791 114.7347 57.8555 30.2277 177.2298 23 L 4.2602 7.8173 117.8854 54.8925 42.2995 176.3828 24 N 4.3528 7.7217 116.5088 55.1866 38.8327 174.9081 25 G 4.0727 9.1186 111.9280 45.2835 0.0000 173.8837 26 K 4.4255 7.7670 118.6210 55.5483 34.0702 175.7548 27 K 4.9200 8.4546 123.3547 55.6132 33.4240 175.9032 28 V 4.8267 8.9997 119.5703 59.9281 37.1669 173.9772 29 K 4.9310 9.2695 121.4668 54.9091 34.5468 175.5313 30 I 4.6608 8.4250 126.4998 59.6443 39.5139 174.7776 31 F 4.8500 8.9003 126.9137 55.8031 40.1395 175.7691 32 L 4.8223 8.7838 125.2214 53.8763 42.5688 178.9057 33 R 4.3035 9.2813 118.3804 58.5535 29.3902 177.1922 34 N 4.6354 8.1272 114.6993 52.6409 37.8001 175.3548 35 G 4.0650 8.2362 108.3940 45.4362 0.0000 174.2960 36 E 4.1039 8.7417 119.6824 56.7704 30.7132 176.3285 37 V 4.4697 8.1259 121.7787 60.9371 34.4633 174.3757 38 L 4.5635 8.5737 127.8838 52.9945 44.0353 175.4706 39 D 4.9013 8.7185 124.4631 53.6400 40.9152 175.5529 40 A 4.9718 8.9985 125.1365 49.9126 23.4448 173.8326 41 E 4.9500 8.6213 120.5251 54.2711 32.2651 175.1710 42 V 4.4018 8.4484 127.8789 62.9956 32.2987 176.0735 43 T 4.4754 8.8066 117.8793 61.2346 70.1040 174.5255 44 G 4.0699 7.3776 106.8212 45.8573 0.0000 172.7531 45 V 4.9677 8.4402 122.2016 61.1060 34.5465 174.3927 46 S 4.8530 8.6176 122.5383 56.1121 65.9309 173.1699 47 N 4.1530 8.8214 116.6656 56.5914 38.1819 175.8111 48 Y 4.7964 7.7939 112.2193 57.7226 39.7343 174.7200 49 E 5.1381 8.0135 118.7239 54.4711 34.4977 174.6872 50 I 4.8806 8.5976 121.5144 60.0161 41.4218 174.2890 51 M 4.9142 9.0827 127.1877 54.2130 33.7292 175.7966 52 V 5.0044 8.5841 115.7163 59.6237 36.9926 174.3032 53 K 4.9102 8.7494 121.9887 54.9069 34.4598 175.7943 54 V 4.0941 8.7683 125.2139 60.3181 33.6690 176.1772 55 G 3.7793 8.7703 120.4322 47.2257 0.0000 173.9137 56 D 4.5706 8.8546 124.5422 54.6438 41.2754 176.0540 57 R 4.4424 7.9312 119.9233 54.9951 31.4124 174.6932 58 N 5.3859 8.5304 118.9422 51.6739 40.5299 174.2788 59 L 4.7580 8.7603 123.0463 52.7427 45.8389 175.4407 60 L 4.5670 8.5188 125.1030 53.7249 43.0091 175.3015 61 V 4.2792 8.4711 127.9520 61.1371 33.5714 174.9816 62 F 4.6626 8.7037 126.7817 56.6529 39.8642 176.6401 63 K 3.9578 8.8932 125.8225 59.7903 32.0704 178.8458 64 H 4.3817 8.2272 112.5054 57.5966 28.7956 175.7704 65 A 4.4549 8.3713 122.9035 52.6032 19.3117 176.5265 66 I 4.5304 7.4327 117.3832 60.2991 38.4631 175.3267 67 D 4.8280 8.9617 126.5634 56.5297 41.2495 176.1139 68 Y 5.0357 7.2600 114.0080 56.0179 41.8066 172.7206 69 I 5.2985 8.5501 119.8982 59.6280 40.5880 174.5516 70 E 4.8716 9.7077 128.3252 54.6623 31.7670 175.5194 71 Y 4.4757 7.8318 123.4778 57.3057 38.2851 174.8224 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 14 I 7.88 4.12 1.84 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.78 0.93 0.00 0.00 15 P 0.00 4.18 0.00 2.12 2.02 0.00 3.75 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 2.03 2.17 0.00 16 N 9.22 4.40 0.00 2.89 2.95 0.00 0.00 7.04 7.45 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 17 F 7.85 4.26 0.00 2.92 2.90 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 18 E 6.66 4.30 0.00 1.96 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 1.97 2.10 0.00 19 Y 8.35 4.03 0.00 2.96 2.92 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 0.00 0.00 0.00 0.00 20 A 8.00 3.98 1.25 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 0.00 0.00 21 R 7.39 3.83 0.00 1.86 1.90 0.00 2.98 0.00 0.00 3.07 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 22 R 7.58 4.06 0.00 1.84 1.95 0.00 3.26 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 23 L 7.82 4.26 0.00 1.77 1.65 0.87 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 24 N 7.72 4.35 0.00 2.86 2.77 0.00 0.00 7.07 7.13 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 25 G 9.12 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 26 K 7.77 4.43 0.00 1.86 1.78 0.00 1.70 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.52 7.81 27 K 8.45 4.92 0.00 1.78 1.72 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.60 7.81 28 V 9.00 4.83 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 0.75 0.00 0.00 1.01 0.00 0.00 29 K 9.27 4.93 0.00 1.82 1.48 0.00 1.73 0.00 0.00 1.58 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.42 7.81 30 I 8.42 4.66 1.80 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 1.25 0.71 0.90 0.00 0.00 31 F 8.90 4.85 0.00 2.12 2.63 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 32 L 8.78 4.82 0.00 1.73 1.59 0.94 0.70 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 33 R 9.28 4.30 0.00 1.91 2.22 0.00 3.08 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.60 0.00 34 N 8.13 4.64 0.00 2.84 2.97 0.00 0.00 6.35 7.00 0.00 0.00 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 G 8.24 4.06 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 0.00 0.00 0.00 36 E 8.74 4.10 0.00 1.99 1.84 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 2.31 2.32 0.00 37 V 8.13 4.47 1.83 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 -0.03 0.00 0.00 0.65 0.00 0.00 38 L 8.57 4.56 0.00 1.49 1.48 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 39 D 8.72 4.90 0.00 2.51 2.62 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 40 A 9.00 4.97 1.16 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 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.62 4.95 0.00 2.05 1.78 0.00 0.00 0.00 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 2.21 0.00 42 V 8.45 4.40 2.24 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 1.06 0.00 0.00 0.92 0.00 0.00 43 T 8.81 4.48 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 1.25 0.00 0.00 44 G 7.38 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 45 V 8.44 4.97 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 0.83 0.00 0.00 0.91 0.00 0.00 46 S 8.62 4.85 0.00 3.92 3.79 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 47 N 8.82 4.15 0.00 2.33 2.01 0.00 0.00 6.65 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 7.79 4.80 0.00 3.10 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 49 E 8.01 5.14 0.00 1.69 1.46 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 0.00 1.71 2.25 0.00 50 I 8.60 4.88 1.82 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 1.18 0.76 0.87 0.00 0.00 51 M 9.08 4.91 0.00 1.83 2.01 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.58 0.00 52 V 8.58 5.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.90 0.00 0.00 53 K 8.75 4.91 0.00 1.68 1.69 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.34 7.81 54 V 8.77 4.09 2.06 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 1.00 0.00 0.00 0.90 0.00 0.00 55 G 8.77 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.85 4.57 0.00 2.67 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 57 R 7.93 4.44 0.00 1.99 1.81 0.00 3.08 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 58 N 8.53 5.39 0.00 2.57 2.71 0.00 0.00 6.77 7.85 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 59 L 8.76 4.76 0.00 1.52 1.48 0.90 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.52 4.57 0.00 1.54 1.48 0.84 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.47 4.28 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 0.97 0.00 0.00 0.89 0.00 0.00 62 F 8.70 4.66 0.00 2.96 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 8.89 3.96 0.00 1.94 1.95 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.48 1.41 7.81 64 H 8.23 4.38 0.00 3.28 3.53 0.00 5.53 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 65 A 8.37 4.45 1.47 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 0.00 0.00 66 I 7.43 4.53 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.82 0.98 0.00 0.00 67 D 8.96 4.83 0.00 2.61 2.88 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 68 Y 7.26 5.04 0.00 3.03 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 69 I 8.55 5.30 2.04 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 1.32 0.78 1.10 0.00 0.00 70 E 9.71 4.87 0.00 2.28 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 2.25 2.22 0.00 71 Y 7.83 4.48 0.00 3.08 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