NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9667 8.3549 109.7360 45.6913 0.0000 173.7802 3 E 3.9484 9.4781 119.4540 58.3601 29.8322 176.1595 4 L 4.1888 7.8897 119.4906 53.5377 43.1299 174.9230 5 P 4.4938 0.0000 0.0000 62.6750 32.3807 177.4245 6 I 3.8652 8.2840 120.6893 63.7772 37.2939 178.5214 7 A 3.9545 7.9264 121.5053 54.9026 18.3529 177.8030 8 P 4.2628 0.0000 0.0000 65.5602 31.1838 178.9252 9 I 3.9293 7.2042 119.8435 64.0658 37.0864 178.5047 10 G 3.6313 8.1695 106.6698 47.8227 0.0000 175.9969 11 R 3.9978 7.9679 119.9203 59.0306 29.7808 179.0738 12 I 3.6863 7.3838 118.6297 64.5032 37.2441 178.2264 13 I 3.9008 7.5736 120.6727 64.2136 36.9488 178.6015 14 K 4.1294 8.0889 119.4210 59.5345 31.7070 178.7427 15 N 4.5709 8.2549 114.4907 54.7746 38.7117 176.3661 16 A 4.3195 7.4038 121.2340 51.8938 18.9488 177.4842 17 G 3.8902 7.7184 104.2025 44.8546 0.0000 174.4135 18 A 4.0626 7.8557 123.7861 51.8318 18.9573 177.2392 19 E 4.0854 8.9741 124.7440 58.6427 30.0173 176.9718 20 R 4.6389 7.5764 115.7124 54.3830 33.2964 173.8826 21 V 4.3528 8.1343 122.8510 60.2149 34.0248 176.0864 22 S 4.4600 8.6008 124.5909 58.8510 65.1167 175.5413 23 D 4.4302 8.6631 127.3270 59.2722 39.5747 179.9321 24 D 4.6168 8.2309 121.7843 58.3979 39.6630 180.8137 25 A 4.1618 7.9789 121.5023 55.1265 18.3728 179.8127 26 R 3.8696 7.6872 116.7190 59.6933 30.2068 179.4358 27 I 3.6983 7.9002 119.1528 64.1796 37.0837 178.3134 28 A 3.9813 8.2870 122.0218 55.1415 18.1911 179.5166 29 L 3.8849 8.1039 118.5867 58.1175 42.1936 178.9171 30 A 3.9835 8.1702 120.8777 55.1554 18.2873 179.8310 31 K 3.9392 8.2111 117.0085 59.4491 32.0501 179.8031 32 V 3.5484 7.8336 118.5404 66.0517 31.4197 178.1770 33 L 3.8979 8.0376 118.7946 57.5987 41.3517 179.0919 34 E 3.9220 8.2942 119.4224 59.1088 29.5935 178.4954 35 E 3.9251 8.2976 119.3963 59.5584 29.6557 178.6553 36 M 4.0776 8.2247 119.0068 58.2717 31.8596 178.8873 37 G 3.6664 8.4193 106.2036 48.0178 0.0000 175.5491 38 E 4.0156 8.5655 121.5718 59.1140 29.5062 179.4090 39 E 4.0270 8.4536 118.6584 59.3718 29.5043 179.3746 40 I 3.7478 8.2603 119.8906 64.4979 37.1968 178.4113 41 A 4.0582 8.4012 121.8400 55.1712 18.0250 179.8532 42 S 4.0893 8.4464 114.1055 61.8801 62.9227 176.8219 43 E 3.9719 8.2615 120.9743 59.2126 29.1626 179.1156 44 A 4.0273 8.4459 121.3746 55.1568 18.3938 179.8484 45 V 3.5488 8.0267 116.8452 66.1337 31.6183 178.5030 46 K 4.0814 7.8905 118.4070 59.3040 31.7394 179.4089 47 L 3.9918 8.1233 119.1658 57.7303 41.4782 179.4384 48 A 4.0681 8.3608 123.2716 55.7147 18.3249 180.4277 49 K 3.9093 8.1993 122.2318 60.2187 31.5341 180.5571 50 H 4.6063 8.1072 114.8478 57.4168 28.9010 176.6927 51 A 4.3504 7.6034 121.1323 51.9702 18.5985 177.4806 52 G 3.8014 7.9586 105.2850 46.2986 0.0000 173.8253 53 R 4.7084 8.1069 117.2940 54.0527 32.9510 176.2550 54 K 4.3315 8.4847 118.7291 57.0755 33.2161 176.8876 55 T 4.3159 7.6142 116.1161 62.3221 69.3082 174.3431 56 I 4.1182 8.2904 127.6487 60.9596 38.1509 175.6031 57 K 4.5936 9.1331 124.4515 54.1429 34.8020 177.0435 58 A 4.0216 8.6046 122.0734 55.8362 18.0714 180.0201 59 E 3.9208 8.1616 116.2116 59.4501 29.5105 179.2221 60 D 4.3651 7.9802 119.0945 57.2960 40.9160 178.7743 61 I 3.7463 7.6666 119.8537 64.5434 37.0044 178.2678 62 E 4.0556 8.2604 118.3765 58.8912 29.5208 178.9183 63 L 4.1005 8.0045 120.5527 58.0467 42.2844 178.7662 64 A 4.0505 8.1830 120.9522 54.9411 18.2451 179.6226 65 R 4.1132 8.2102 114.4322 58.9517 29.4365 178.8657 66 K 4.1231 8.1828 119.4179 58.6092 31.7269 178.6212 67 M 4.0151 7.8813 117.1454 57.3929 30.8630 176.9658 68 F 4.8596 7.7993 116.9514 57.1019 39.4453 175.8723 69 K 4.2339 7.9158 126.6146 56.6875 31.9352 176.6002 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 2 G 8.35 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 0.00 0.00 0.00 0.00 3 E 9.48 3.95 0.00 1.97 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 2.49 2.49 0.00 4 L 7.89 4.19 0.00 1.64 1.59 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.49 0.00 2.21 2.17 0.00 3.68 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 2.06 1.98 0.00 6 I 8.28 3.87 1.87 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 1.57 0.91 0.90 0.00 0.00 7 A 7.93 3.95 1.31 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 0.00 0.00 8 P 0.00 4.26 0.00 2.16 2.11 0.00 3.61 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 9 I 7.20 3.93 1.97 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 1.62 1.28 0.92 0.00 0.00 10 G 8.17 3.63 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 0.00 0.00 0.00 11 R 7.97 4.00 0.00 2.05 1.99 0.00 3.13 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 12 I 7.38 3.69 2.02 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 1.51 0.67 0.90 0.00 0.00 13 I 7.57 3.90 1.97 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 1.51 1.41 0.90 0.00 0.00 14 K 8.09 4.13 0.00 1.81 1.85 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.48 7.81 15 N 8.25 4.57 0.00 2.77 2.86 0.00 0.00 7.03 7.44 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 16 A 7.40 4.32 1.35 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 0.00 0.00 0.00 17 G 7.72 3.89 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 0.00 0.00 0.00 18 A 7.86 4.06 1.33 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 0.00 0.00 19 E 8.97 4.09 0.00 1.94 1.99 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 2.29 2.30 0.00 20 R 7.58 4.64 0.00 1.74 1.71 0.00 3.23 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 21 V 8.13 4.35 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 0.91 0.00 0.00 0.93 0.00 0.00 22 S 8.60 4.46 0.00 4.08 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 0.00 23 D 8.66 4.43 0.00 2.71 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 24 D 8.23 4.62 0.00 2.67 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 25 A 7.98 4.16 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 26 R 7.69 3.87 0.00 1.97 1.99 0.00 3.13 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 1.65 1.68 0.00 27 I 7.90 3.70 1.86 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 1.45 0.85 0.90 0.00 0.00 28 A 8.29 3.98 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 29 L 8.10 3.88 0.00 1.76 1.65 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.17 3.98 1.35 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 0.00 0.00 0.00 31 K 8.21 3.94 0.00 1.97 1.86 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.54 7.81 32 V 7.83 3.55 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 1.02 0.00 0.00 0.97 0.00 0.00 33 L 8.04 3.90 0.00 1.70 1.65 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 34 E 8.29 3.92 0.00 2.10 1.93 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 2.30 2.31 0.00 35 E 8.30 3.93 0.00 2.18 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 2.34 2.38 0.00 36 M 8.22 4.08 0.00 1.54 1.87 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 1.81 0.00 37 G 8.42 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.57 4.02 0.00 2.18 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 0.00 2.34 2.54 0.00 39 E 8.45 4.03 0.00 2.41 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 0.00 2.67 2.69 0.00 40 I 8.26 3.75 1.96 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.14 0.97 0.00 0.00 41 A 8.40 4.06 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 42 S 8.45 4.09 0.00 4.07 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 43 E 8.26 3.97 0.00 2.13 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 2.54 2.41 0.00 44 A 8.45 4.03 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 45 V 8.03 3.55 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 1.03 0.00 0.00 0.98 0.00 0.00 46 K 7.89 4.08 0.00 2.07 1.88 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.46 1.35 7.81 47 L 8.12 3.99 0.00 1.86 1.72 0.96 0.54 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 48 A 8.36 4.07 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 49 K 8.20 3.91 0.00 1.79 1.84 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.36 7.81 50 H 8.11 4.61 0.00 3.16 3.39 0.00 5.62 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.60 4.35 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 52 G 7.96 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 0.00 0.00 0.00 53 R 8.11 4.71 0.00 1.75 1.81 0.00 3.15 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 54 K 8.48 4.33 0.00 1.73 1.85 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.38 7.81 55 T 7.61 4.32 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 56 I 8.29 4.12 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.74 0.92 0.00 0.00 57 K 9.13 4.59 0.00 1.86 1.85 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.22 7.81 58 A 8.60 4.02 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 59 E 8.16 3.92 0.00 2.07 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 2.40 2.47 0.00 60 D 7.98 4.37 0.00 2.86 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 61 I 7.67 3.75 2.02 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 1.81 1.20 0.93 0.00 0.00 62 E 8.26 4.06 0.00 1.94 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 2.55 2.46 0.00 63 L 8.00 4.10 0.00 1.88 1.65 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.18 4.05 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 65 R 8.21 4.11 0.00 2.15 2.37 0.00 2.87 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 66 K 8.18 4.12 0.00 1.87 1.89 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.70 7.81 67 M 7.88 4.02 0.00 1.95 1.80 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 2.34 0.00 68 F 7.80 4.86 0.00 3.07 3.03 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 69 K 7.92 4.23 0.00 1.78 1.74 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.48 7.81