NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8120 8.3249 115.8577 56.3513 39.8775 175.4315 2 V 3.3650 7.0794 113.8387 62.3132 32.3671 175.2028 3 N 4.6048 7.5455 119.6300 51.0580 37.7950 172.3170 4 Q 4.4213 7.0588 116.3441 55.2249 32.0579 174.0573 5 H 4.3689 8.6254 115.3985 55.1343 29.0854 175.0561 6 L 4.5825 8.4731 124.8425 53.2266 42.9772 175.5410 7 C 4.9978 8.2754 121.0118 58.5465 33.0344 176.6936 8 G 3.8549 8.4321 112.0005 46.7683 0.0000 177.7623 9 S 4.0911 8.7922 121.6042 60.8263 63.5593 175.7340 10 H 4.2274 8.3498 121.0684 59.0263 29.5139 177.0491 11 L 3.8416 7.7419 121.6717 58.2198 42.0587 178.9444 12 V 3.2890 7.4099 117.9231 65.7043 31.3463 177.6166 13 E 3.9326 8.4117 119.2738 58.9626 29.3879 178.6406 14 A 4.1872 7.9374 120.7426 55.1818 18.4601 179.5653 15 L 3.6177 7.6316 117.4877 57.8192 41.0038 179.0981 16 Y 4.1667 7.7544 119.4686 60.8850 38.5502 178.2795 17 L 3.9031 7.8319 118.4770 57.4372 41.8453 179.3517 18 V 3.7716 7.9546 117.9058 66.2646 31.3423 177.7469 19 C 4.2956 8.2178 116.5720 61.4614 28.4250 174.7810 20 G 3.9029 8.2013 109.2540 45.9252 0.0000 175.6139 21 E 4.0076 8.9343 121.3738 59.0917 29.8967 178.6258 22 R 3.9065 7.5676 116.8531 57.5455 30.1619 177.7157 23 G 3.9870 9.7281 104.0327 45.3609 0.0000 171.1143 24 F 4.8972 7.4336 112.4253 56.1199 40.1464 172.8578 25 F 4.9298 8.3998 114.9791 55.0258 39.9749 173.7067 26 Y 4.7070 8.9152 124.8553 56.0713 40.1122 175.0020 27 T 4.2949 8.0137 118.2741 58.8563 69.4748 171.9311 28 P 3.9217 0.0000 0.0000 66.2286 31.6282 178.1318 29 K 4.0471 7.8621 121.6462 54.4579 30.0998 178.2017 30 A 4.1561 8.0629 127.0462 52.4132 18.9896 176.2924 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 4.81 0.00 3.18 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.08 3.36 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 -0.23 0.00 0.00 0.63 0.00 0.00 3 N 7.55 4.60 0.00 2.63 2.72 0.00 0.00 6.71 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 7.06 4.42 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.14 6.92 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 5 H 8.63 4.37 0.00 3.19 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.47 4.58 0.00 1.54 1.50 0.79 0.65 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 7 C 8.28 5.00 0.00 2.97 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 8 G 8.43 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.79 4.09 0.00 3.97 4.11 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 10 H 8.35 4.23 0.00 3.27 3.46 0.00 5.78 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.74 3.84 0.00 1.91 1.79 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.41 3.29 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 1.00 0.00 0.00 0.17 0.00 0.00 13 E 8.41 3.93 0.00 2.10 2.23 0.00 0.00 0.00 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 2.38 0.00 14 A 7.94 4.19 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 15 L 7.63 3.62 0.00 0.96 0.13 0.75 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.75 4.17 0.00 3.11 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.83 3.90 0.00 1.80 1.76 0.87 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.95 3.77 2.14 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 0.77 0.00 0.00 0.88 0.00 0.00 19 C 8.22 4.30 0.00 3.24 3.20 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 0.00 0.00 0.00 0.00 20 G 8.20 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 0.00 0.00 0.00 21 E 8.93 4.01 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 2.30 2.35 0.00 22 R 7.57 3.91 0.00 2.06 2.05 0.00 3.29 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 23 G 9.73 3.99 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 0.00 0.00 0.00 24 F 7.43 4.90 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 25 F 8.40 4.93 0.00 3.16 3.02 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 0.00 0.00 0.00 26 Y 8.92 4.71 0.00 3.23 3.13 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 0.00 0.00 0.00 0.00 27 T 8.01 4.29 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 1.38 0.00 0.00 28 P 0.00 3.92 0.00 2.13 1.94 0.00 3.53 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.88 0.00 29 K 7.86 4.05 0.00 1.80 1.70 0.00 1.87 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.01 7.81 30 A 8.06 4.16 1.19 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 0.00 0.00