NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2840 8.1127 117.2805 55.7853 31.2494 175.9069 2 M 3.6433 8.6028 117.1793 58.7017 31.8569 176.9218 3 K 4.0875 8.8239 119.2612 59.2329 32.6465 178.9152 4 Q 4.0260 8.0000 118.2392 58.7097 28.7399 178.2692 5 L 3.9759 7.9867 120.0879 57.8414 41.6868 179.3286 6 E 3.9633 8.2388 118.4981 59.5485 29.3812 179.2313 7 D 4.3487 7.9122 118.7866 57.0945 40.8239 178.7155 8 K 3.8835 8.2181 120.2427 59.4723 32.2282 178.8225 9 V 3.5498 7.8715 118.5314 66.2689 31.5288 177.7696 10 E 4.0007 8.2441 118.0570 59.4561 29.3813 179.3507 11 E 3.9700 8.2179 118.5881 59.3717 29.5520 179.3889 12 L 3.9597 8.2632 119.5026 57.4348 41.7196 179.0685 13 L 3.6036 8.1827 120.7875 58.2188 41.9683 178.9959 14 S 4.0734 7.7491 112.3431 61.2089 62.3023 175.9664 15 K 3.9035 7.8233 121.7717 59.5850 31.9041 177.9941 16 N 4.2308 8.5883 117.5557 57.1734 38.7803 176.3667 17 Y 4.5008 7.7169 117.7589 61.3172 37.9714 177.8471 18 H 4.2290 8.4337 119.2463 59.3633 29.9701 177.3516 19 L 3.8991 8.1079 120.7511 57.6861 41.3604 179.2002 20 E 3.9772 8.5523 118.8942 59.5927 29.4368 179.1500 21 N 4.2877 8.2491 116.2669 56.4061 38.6460 176.9814 22 E 3.9212 8.1591 120.5548 59.3711 29.6634 179.1137 23 V 3.6026 7.9454 118.1180 65.6645 31.6493 177.9678 24 A 3.9431 8.2354 120.7662 55.1448 18.2652 179.5885 25 R 3.8445 8.3194 116.9683 59.7257 30.1554 179.3926 26 L 4.0469 7.9481 118.4089 57.5534 41.4646 179.9503 27 K 3.9393 8.0381 118.5943 59.3291 31.8172 178.8339 28 K 3.8522 7.6396 118.2632 59.6685 32.1176 177.8189 29 L 4.0796 7.6912 119.3969 58.5806 42.0977 178.9887 30 V 3.8331 7.9498 117.0877 64.7780 31.6983 175.9119 31 G 3.7408 8.7194 112.1994 45.5403 0.0000 172.9991 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 R 8.11 4.28 0.00 1.97 2.15 0.00 3.13 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 2 M 8.60 3.64 0.00 2.18 2.13 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 2.68 2.92 0.00 3 K 8.82 4.09 0.00 1.84 1.84 0.00 1.71 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.52 7.81 4 Q 8.00 4.03 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 5 L 7.99 3.98 0.00 1.84 1.71 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.24 3.96 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 7 D 7.91 4.35 0.00 2.80 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 8 K 8.22 3.88 0.00 1.97 1.99 0.00 1.52 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.47 7.81 9 V 7.87 3.55 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 0.95 0.00 0.00 0.91 0.00 0.00 10 E 8.24 4.00 0.00 2.20 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 2.67 0.00 11 E 8.22 3.97 0.00 2.17 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 2.32 2.42 0.00 12 L 8.26 3.96 0.00 1.61 1.66 0.90 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.18 3.60 0.00 1.65 1.67 0.50 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.75 4.07 0.00 4.04 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 15 K 7.82 3.90 0.00 1.97 1.91 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.48 7.81 16 N 8.59 4.23 0.00 2.77 2.79 0.00 0.00 7.30 7.74 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 17 Y 7.72 4.50 0.00 3.23 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 18 H 8.43 4.23 0.00 3.25 3.52 0.00 5.59 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.11 3.90 0.00 1.88 1.69 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.55 3.98 0.00 2.20 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 2.53 2.67 0.00 21 N 8.25 4.29 0.00 2.75 2.87 0.00 0.00 6.71 7.18 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 22 E 8.16 3.92 0.00 2.02 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 2.28 2.30 0.00 23 V 7.95 3.60 2.29 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 0.95 0.00 0.00 0.92 0.00 0.00 24 A 8.24 3.94 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.32 3.84 0.00 1.99 2.00 0.00 3.14 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 26 L 7.95 4.05 0.00 1.70 1.72 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.04 3.94 0.00 2.06 1.85 0.00 1.68 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 1.46 1.44 7.81 28 K 7.64 3.85 0.00 1.87 1.99 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.46 7.81 29 L 7.69 4.08 0.00 1.67 1.76 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.95 3.83 2.29 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 0.87 0.00 0.00 0.93 0.00 0.00 31 G 8.72 3.74 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 0.00 0.00 0.00