NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8323 8.3249 119.3394 57.4184 39.6360 173.8285 2 L 4.5239 8.0947 126.3198 52.6759 43.4199 176.5171 3 D 4.4707 9.0341 122.9878 57.4341 41.8405 178.8385 4 G 3.6469 8.3579 105.4917 47.5936 0.0000 175.1510 5 I 3.5070 7.8224 122.1147 64.4571 36.8013 177.8773 6 D 4.3491 8.6217 119.9630 57.2349 40.9227 178.4224 7 K 4.1041 8.0017 119.7926 59.4377 32.0786 178.6614 8 A 3.9309 7.6792 120.5716 55.1798 18.1239 179.3753 9 Q 3.9349 7.7700 116.0628 59.1952 28.5342 178.8842 10 E 4.0262 7.7820 118.1877 59.0674 29.8274 178.3516 11 E 4.4989 7.9192 116.2778 56.3487 29.7604 177.3079 12 C 4.0493 7.9195 121.3140 62.9063 31.2684 175.2447 13 E 3.9241 8.1672 119.0005 59.1763 29.3084 178.1692 14 K 3.8423 7.8854 118.7438 59.4652 32.5627 177.7919 15 Y 4.0938 7.9784 115.0993 58.3933 38.4213 176.1486 16 H 3.8392 8.3936 117.1747 57.5047 27.7167 176.0717 17 S 4.5889 8.8595 121.4051 59.9933 62.6369 174.7141 18 N 4.7125 8.1480 119.3426 52.8283 36.6099 175.5816 19 W 4.3621 8.0818 119.8409 59.1869 28.6444 178.6673 20 R 3.0551 6.4987 118.4628 58.7688 29.4596 178.6196 21 A 3.9539 7.6465 120.0441 55.2645 18.4479 179.1772 22 M 3.4187 7.6414 115.1617 58.4826 32.2019 178.2076 23 A 4.0954 8.3161 121.1635 55.4345 18.3226 179.8302 24 S 4.1154 7.6419 112.7309 61.8288 62.9545 176.3772 25 D 4.3912 7.8127 120.4968 56.7457 40.6881 177.8901 26 F 4.3493 8.3505 115.0835 56.1197 40.1063 175.2278 27 N 4.2426 8.2927 115.9402 54.5586 36.5565 173.8738 28 L 4.8697 7.6137 115.2333 51.8967 45.2290 175.3965 29 P 4.5255 0.0000 0.0000 61.8721 32.2049 175.6436 30 P 4.2749 0.0000 0.0000 65.7413 31.1471 178.9599 31 V 3.4677 7.7026 116.7625 66.1170 31.4557 178.0868 32 V 3.6232 7.7977 117.6243 65.6309 31.2414 177.7674 33 A 3.9868 7.9263 120.0615 55.2952 18.3249 179.5555 34 K 3.5205 8.0854 117.3005 59.4278 32.0521 179.1943 35 E 3.8695 8.0041 119.3758 59.2961 29.5392 178.8889 36 I 3.6620 7.9780 120.1306 64.3891 36.9044 178.6151 37 V 3.5950 7.3818 118.0586 65.8556 31.4834 177.7660 38 A 4.1728 8.1195 119.6460 54.5445 18.1712 178.9195 39 S 4.3903 7.5533 112.6594 59.3421 64.1049 174.8670 40 C 4.1917 7.5765 122.3032 59.6558 31.7876 174.1593 41 D 4.4004 8.6319 126.4675 56.8989 40.6324 178.8357 42 K 4.1850 7.8991 118.1766 59.3136 32.4400 178.1616 43 C 4.4730 7.8183 113.0499 60.0393 28.4411 174.9734 44 Q 4.0518 7.4457 121.9283 58.1300 29.1872 176.1382 45 L 4.4237 7.2801 118.2197 53.2599 42.9372 176.2248 46 K 4.1614 8.6516 124.5498 57.0686 33.6780 177.9359 47 G 3.7897 8.5007 114.9432 47.0869 0.0000 171.2303 48 E 4.0586 9.2688 124.6593 57.0996 27.8516 177.1837 49 A 4.2811 8.3435 135.0000 53.6622 24.2249 180.3089 50 M 3.9920 8.8793 117.1183 58.5847 32.3762 175.6059 51 H 4.4604 7.5663 120.4323 55.6451 30.0754 174.4407 52 G 3.8094 7.5669 114.5365 45.8236 0.0000 171.0923 53 Q 4.2324 8.6909 119.6968 55.1334 28.8417 176.1770 54 V 4.5005 8.0617 122.1773 60.1953 34.3857 174.8311 55 D 4.2651 8.5167 122.5890 54.6972 41.7912 175.0078 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 1 F 8.32 4.83 0.00 3.14 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 2 L 8.09 4.52 0.00 1.83 1.62 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 3 D 9.03 4.47 0.00 2.72 2.74 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 0.00 0.00 0.00 0.00 4 G 8.36 3.65 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 0.00 0.00 0.00 5 I 7.82 3.51 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.95 0.84 0.00 0.00 6 D 8.62 4.35 0.00 2.67 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.00 4.10 0.00 1.94 2.10 0.00 1.74 0.00 0.00 1.84 0.00 0.00 3.08 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.62 1.55 7.81 8 A 7.68 3.93 0.48 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 0.00 0.00 0.00 9 Q 7.77 3.93 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 10 E 7.78 4.03 0.00 2.17 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 0.00 2.37 2.53 0.00 11 E 7.92 4.50 0.00 2.26 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 0.00 2.37 2.42 0.00 12 C 7.92 4.05 0.00 3.08 3.04 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 0.00 0.00 0.00 13 E 8.17 3.92 0.00 2.02 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 2.31 2.41 0.00 14 K 7.89 3.84 0.00 1.68 1.78 0.00 1.72 0.00 0.00 1.43 0.00 0.00 2.73 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.87 1.26 7.81 15 Y 7.98 4.09 0.00 3.12 3.22 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 0.00 16 H 8.39 3.84 0.00 3.36 2.95 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 S 8.86 4.59 0.00 3.92 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 18 N 8.15 4.71 0.00 3.12 2.76 0.00 0.00 6.76 7.70 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 19 W 8.08 4.36 0.00 3.65 3.36 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 20 R 6.50 3.06 0.00 1.26 1.49 0.00 2.68 0.00 0.00 2.94 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 21 A 7.65 3.95 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.64 3.42 0.00 2.19 1.59 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 23 A 8.32 4.10 1.62 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 0.00 0.00 24 S 7.64 4.12 0.00 3.96 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 25 D 7.81 4.39 0.00 2.70 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.35 4.35 0.00 2.98 3.11 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 27 N 8.29 4.24 0.00 2.82 2.87 0.00 0.00 6.72 7.42 0.00 0.00 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 7.61 4.87 0.00 1.66 1.58 0.94 1.13 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 29 P 0.00 4.53 0.00 2.22 2.18 0.00 3.73 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 2.05 1.94 0.00 30 P 0.00 4.27 0.00 2.11 2.01 0.00 3.67 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.50 0.00 31 V 7.70 3.47 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 1.04 0.00 0.00 0.92 0.00 0.00 32 V 7.80 3.62 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.02 0.00 0.00 33 A 7.93 3.99 1.54 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 0.00 0.00 34 K 8.09 3.52 0.00 1.58 1.57 0.00 1.32 0.00 0.00 1.22 0.00 0.00 2.29 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.46 0.58 7.81 35 E 8.00 3.87 0.00 2.12 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 2.26 2.46 0.00 36 I 7.98 3.66 1.99 0.00 0.00 0.69 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 0.72 0.86 0.00 0.00 37 V 7.38 3.60 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.07 0.00 0.00 38 A 8.12 4.17 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 39 S 7.55 4.39 0.00 3.98 3.90 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 40 C 7.58 4.19 0.00 2.99 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.63 4.40 0.00 2.69 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 42 K 7.90 4.19 0.00 1.75 1.89 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.54 7.81 43 C 7.82 4.47 0.00 2.97 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 44 Q 7.45 4.05 0.00 2.35 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.64 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 45 L 7.28 4.42 0.00 1.68 1.58 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.65 4.16 0.00 1.74 1.73 0.00 1.96 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.47 7.81 47 G 8.50 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 0.00 0.00 0.00 48 E 9.27 4.06 0.00 1.99 1.64 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 2.31 2.31 0.00 49 A 8.34 4.28 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.88 3.99 0.00 2.04 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 51 H 7.57 4.46 0.00 3.27 3.27 0.00 6.02 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 52 G 7.57 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.69 4.23 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.61 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 54 V 8.06 4.50 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 0.81 0.00 0.00 0.93 0.00 0.00 55 D 8.52 4.27 0.00 2.62 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