NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9643 8.3549 109.7353 45.0110 0.0000 173.7043 3 R 3.8503 8.6053 117.6954 58.2865 30.0972 176.6704 4 K 4.6975 7.6709 116.5766 52.1916 36.6975 178.5339 5 K 4.2696 8.5213 121.9369 56.1826 32.8837 176.2327 6 I 4.6259 7.9436 117.1361 58.9899 40.3537 175.0170 7 Q 4.3792 8.3361 120.2358 55.4215 29.7257 176.8007 8 I 4.1968 7.9055 122.5218 60.0685 35.8717 174.8883 9 T 4.5682 7.6585 116.6917 59.8129 70.4575 173.1832 10 R 3.8284 8.6292 125.2421 56.9389 30.2372 176.0597 11 I 3.9879 8.2836 126.3266 61.5048 37.5285 176.0425 12 M 4.1630 8.6121 125.1662 56.9842 32.5588 176.3613 13 D 4.6379 7.9007 118.9990 52.8415 42.5462 175.9176 14 E 3.9097 8.8314 127.7176 59.5600 29.7074 178.9565 15 R 3.8934 7.8956 117.3063 59.4665 30.2102 178.4957 16 N 4.3535 8.5733 116.7565 56.5044 38.8074 176.8356 17 R 3.8898 8.3225 120.6667 59.4564 30.1249 178.3666 18 Q 4.0021 8.4243 119.6647 59.0234 29.0782 178.2284 19 V 3.5905 7.9222 119.3169 66.3999 31.6013 178.1353 20 T 3.8823 8.1953 115.7172 66.4372 68.1677 176.3375 21 F 4.0089 8.5328 122.7358 61.6115 39.5966 177.1879 22 T 3.6277 8.1406 115.2871 66.5289 68.2881 176.7537 23 K 3.8824 7.9432 120.0449 59.7317 32.0836 179.8576 24 R 3.9507 8.2983 118.5544 58.7848 29.8180 179.1166 25 K 3.6189 7.9648 120.2281 59.0540 31.9833 178.6117 26 F 3.9032 7.9920 120.8686 61.2472 39.3391 177.3396 27 G 3.6354 8.2333 105.3516 47.7178 0.0000 175.4405 28 L 3.9043 8.1052 122.9568 58.1954 42.0453 179.0201 29 M 3.7695 8.0011 118.8100 57.7535 31.7098 178.6981 30 K 3.6669 7.7618 120.0154 59.5023 32.4457 179.1570 31 K 3.9118 8.0432 118.4183 59.0984 31.8353 179.3709 32 A 3.8974 7.7205 121.3154 55.1442 18.2920 178.8911 33 Y 4.2421 7.6131 119.7103 60.3936 38.7957 178.3528 34 E 3.5497 8.2134 119.4337 59.1117 29.5285 179.1229 35 L 3.9381 7.9435 120.6945 57.9648 42.2577 179.1141 36 S 4.2049 8.0983 114.3828 61.3994 62.8657 176.8148 37 V 3.4577 7.4149 121.7587 65.5556 31.1377 177.9933 38 L 4.0108 7.9517 117.6138 57.4782 41.5255 177.9488 39 C 4.5052 7.9359 112.6071 58.4464 29.0774 173.3738 40 D 4.3727 7.4591 117.1528 55.7765 39.3081 171.7418 41 C 5.0213 7.9181 112.5717 56.5167 33.5955 174.8216 42 E 4.6328 8.6446 119.0605 55.1424 30.5590 175.7799 43 I 4.7769 8.9381 124.8226 59.3727 41.4797 174.2283 44 A 5.0441 8.6361 126.8590 49.9814 22.0270 175.1219 45 L 4.7029 9.1993 123.3350 53.3917 45.4400 175.0823 46 I 4.7703 8.5262 126.5615 59.5098 40.0342 175.0172 47 I 4.7038 8.8576 127.3914 59.4886 40.9272 174.2262 48 F 5.3733 8.9600 125.4117 55.6047 41.2576 175.5914 49 N 4.6065 9.2486 122.2831 51.6223 38.5970 176.0919 50 S 4.0705 8.2778 112.2127 61.6345 62.9879 175.4863 51 S 4.1884 7.8698 113.8437 58.8744 62.5875 173.9853 52 N 4.5497 8.3842 118.4117 53.6952 37.9454 173.8031 53 K 4.2073 8.9605 118.2303 55.8054 33.0005 175.0813 54 L 4.5913 7.9319 126.4386 53.7092 43.5171 175.5280 55 F 5.0334 9.0786 124.1184 55.9197 43.2317 173.7369 56 Q 5.1296 8.6262 118.7596 55.4200 31.7758 173.0364 57 Y 4.9249 8.9967 120.2762 56.2968 41.5649 173.5373 58 A 4.5221 7.3500 126.0479 50.2511 22.4609 176.9193 59 S 4.0936 8.5246 116.0408 60.4557 63.7880 174.0397 60 T 4.3819 6.9883 112.1234 60.4206 70.9719 173.6953 61 D 4.4430 8.5556 122.8575 55.7526 41.3498 172.3753 62 M 4.1749 8.7440 126.5302 58.8609 32.3926 178.8005 63 D 4.4816 8.3079 123.0146 58.9655 39.7288 181.1759 64 K 4.1880 7.8235 123.6855 59.9392 31.8212 182.0664 65 V 3.7899 7.5475 119.5503 65.8655 31.3464 178.1558 66 L 4.1261 8.3174 121.1947 58.1931 41.3330 180.1749 67 L 4.2538 7.9245 123.8548 58.8385 40.8661 182.0937 68 K 4.1720 8.3536 121.1083 59.3985 32.1654 178.1522 69 Y 4.0612 8.3041 120.2230 60.9012 38.6643 177.8730 70 T 3.8606 8.5592 113.4659 65.8449 68.4404 176.6173 71 E 3.9935 8.2157 120.0847 60.6118 29.7902 179.7361 72 Y 4.2667 7.9593 119.5487 60.7068 38.9401 176.3692 73 N 4.6421 7.8591 120.3003 53.5157 38.8095 174.7837 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 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.61 3.85 0.00 1.89 2.01 0.00 3.32 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 4 K 7.67 4.70 0.00 1.70 1.50 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 0.98 7.81 5 K 8.52 4.27 0.00 1.71 1.73 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.42 7.81 6 I 7.94 4.63 1.87 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 1.41 0.86 0.96 0.00 0.00 7 Q 8.34 4.38 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.31 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 8 I 7.91 4.20 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 1.30 0.78 0.92 0.00 0.00 9 T 7.66 4.57 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 10 R 8.63 3.83 0.00 1.82 1.87 0.00 3.30 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 11 I 8.28 3.99 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 0.99 0.00 0.00 12 M 8.61 4.16 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 13 D 7.90 4.64 0.00 2.78 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 14 E 8.83 3.91 0.00 2.07 1.94 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 2.38 2.41 0.00 15 R 7.90 3.89 0.00 2.04 1.97 0.00 3.19 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 16 N 8.57 4.35 0.00 2.85 2.82 0.00 0.00 6.93 7.19 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 17 R 8.32 3.89 0.00 2.04 2.08 0.00 3.15 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 18 Q 8.42 4.00 0.00 2.27 2.25 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 2.39 2.46 0.00 19 V 7.92 3.59 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 0.97 0.00 0.00 0.99 0.00 0.00 20 T 8.20 3.88 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 21 F 8.53 4.01 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 22 T 8.14 3.63 4.36 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 1.19 0.00 0.00 23 K 7.94 3.88 0.00 1.77 1.80 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.57 7.81 24 R 8.30 3.95 0.00 1.86 1.90 0.00 3.11 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 1.62 1.60 0.00 25 K 7.96 3.62 0.00 0.79 1.15 0.00 1.30 0.00 0.00 0.83 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.11 1.11 7.81 26 F 7.99 3.90 0.00 3.23 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 27 G 8.23 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 28 L 8.11 3.90 0.00 1.74 1.73 0.87 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.00 3.77 0.00 1.73 1.74 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.43 0.00 30 K 7.76 3.67 0.00 1.45 1.82 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.15 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.43 7.81 31 K 8.04 3.91 0.00 1.77 1.78 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.41 7.81 32 A 7.72 3.90 1.18 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 0.00 0.00 33 Y 7.61 4.24 0.00 2.70 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.21 3.55 0.00 2.09 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 2.31 2.55 0.00 35 L 7.94 3.94 0.00 1.79 1.76 0.89 0.67 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 36 S 8.10 4.20 0.00 4.27 4.31 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 37 V 7.41 3.46 1.70 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 0.92 0.00 0.00 0.54 0.00 0.00 38 L 7.95 4.01 0.00 1.61 1.67 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 39 C 7.94 4.51 0.00 3.05 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 40 D 7.46 4.37 0.00 2.76 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 41 C 7.92 5.02 0.00 3.00 2.84 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 0.00 0.00 0.00 42 E 8.64 4.63 0.00 1.87 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 2.24 2.32 0.00 43 I 8.94 4.78 2.04 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.75 1.05 0.00 0.00 44 A 8.64 5.04 1.11 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 0.00 0.00 0.00 0.00 0.00 45 L 9.20 4.70 0.00 1.81 1.80 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.53 4.77 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 1.28 0.76 0.79 0.00 0.00 47 I 8.86 4.70 2.04 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.84 1.18 0.00 0.00 48 F 8.96 5.37 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.25 4.61 0.00 2.30 2.32 0.00 0.00 6.32 7.93 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 50 S 8.28 4.07 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.87 4.19 0.00 3.99 3.95 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 0.00 0.00 0.00 52 N 8.38 4.55 0.00 2.85 2.99 0.00 0.00 7.07 7.54 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 53 K 8.96 4.21 0.00 1.77 1.69 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.28 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.79 1.16 7.81 54 L 7.93 4.59 0.00 1.45 1.36 0.23 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 55 F 9.08 5.03 0.00 3.03 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 56 Q 8.63 5.13 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.69 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 57 Y 9.00 4.92 0.00 3.05 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 58 A 7.35 4.52 1.03 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 0.00 0.00 59 S 8.52 4.09 0.00 3.92 4.08 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 60 T 6.99 4.38 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 1.19 0.00 0.00 61 D 8.56 4.44 0.00 2.71 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.74 4.17 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.64 0.00 63 D 8.31 4.48 0.00 2.72 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 64 K 7.82 4.19 0.00 1.75 1.84 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.44 1.06 7.81 65 V 7.55 3.79 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 1.03 0.00 0.00 0.90 0.00 0.00 66 L 8.32 4.13 0.00 1.76 1.75 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.92 4.25 0.00 1.67 1.67 0.92 0.59 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 68 K 8.35 4.17 0.00 2.02 2.01 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.51 7.81 69 Y 8.30 4.06 0.00 3.16 3.19 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 0.00 70 T 8.56 3.86 4.27 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 0.00 0.00 0.00 1.37 0.00 0.00 71 E 8.22 3.99 0.00 2.09 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 2.26 2.19 0.00 72 Y 7.96 4.27 0.00 3.10 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 73 N 7.86 4.64 0.00 2.73 2.61 0.00 0.00 6.93 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00