NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.5564 8.1827 119.4730 55.4616 41.4046 173.5452 2 V 4.3261 7.7494 129.3897 61.6738 32.0516 173.0582 3 N 4.4264 9.0826 135.0000 53.9408 41.4352 176.1282 4 Q 4.2962 7.4986 117.0769 58.8026 28.6214 177.9907 5 H 4.4173 7.7256 118.3026 58.5963 29.9231 177.0430 6 L 4.1245 7.8216 120.3046 58.1087 41.6767 178.8069 7 C 4.2485 9.4378 119.2965 62.4924 31.4157 175.8056 8 G 3.6243 7.8536 106.5291 47.8493 0.0000 175.5926 9 S 3.9682 7.7308 114.6970 61.3128 62.3040 176.0052 10 H 4.2498 7.9752 118.5754 58.7350 28.6750 176.7652 11 L 3.9366 7.9111 120.5330 58.5397 41.3212 179.5830 12 V 3.6484 7.7947 111.9871 62.9332 31.7594 177.9324 13 Q 4.1428 7.2842 117.2414 58.7127 29.1339 177.4436 14 A 3.9793 7.9412 121.8116 55.1499 17.9776 179.5226 15 L 3.9836 7.8166 116.8262 56.8979 41.3452 178.9890 16 Y 4.2095 7.4615 119.9597 60.2955 38.7626 177.0520 17 L 3.6586 7.7751 117.8737 57.7313 41.9142 179.1541 18 V 3.6679 7.9001 117.2171 66.4347 31.6294 177.1678 19 C 4.2522 7.7277 113.8349 61.0383 30.0831 177.3644 20 G 3.4827 8.5594 105.5780 46.1948 0.0000 175.7308 21 E 3.3865 8.1380 117.7724 59.5602 30.3476 177.9943 22 R 4.0073 8.0417 124.5009 57.2459 31.4669 179.2222 23 G 3.8228 7.6426 106.8567 47.2956 0.0000 172.1626 24 F 4.6395 7.3295 115.2356 56.9371 39.5192 172.9698 25 F 4.3903 9.2054 119.9433 55.7987 40.2584 174.7679 26 Y 4.7157 8.6831 127.7632 56.4458 38.9326 175.1250 27 T 4.5049 7.3353 117.8227 58.8836 70.6295 172.9301 28 P 3.5612 0.0000 0.0000 63.6510 32.2670 177.4374 29 K 3.8912 9.2116 126.7466 60.5267 32.6578 175.7013 30 T 3.6032 7.8202 117.9970 63.8277 67.8219 171.6419 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 8.18 4.56 0.00 3.06 2.97 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 2 V 7.75 4.33 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 0.88 0.00 0.00 1.04 0.00 0.00 3 N 9.08 4.43 0.00 2.80 2.78 0.00 0.00 7.16 7.12 0.00 0.00 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 7.50 4.30 0.00 2.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.65 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 5 H 7.73 4.42 0.00 3.33 3.38 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.82 4.12 0.00 1.91 1.74 0.97 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 7 C 9.44 4.25 0.00 3.01 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 8 G 7.85 3.62 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 0.00 9 S 7.73 3.97 0.00 3.78 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 10 H 7.98 4.25 0.00 3.37 3.33 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.91 3.94 0.00 1.87 1.63 1.18 0.99 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 12 V 7.79 3.65 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.85 0.00 0.00 13 Q 7.28 4.14 0.00 2.33 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 14 A 7.94 3.98 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 15 L 7.82 3.98 0.00 0.95 0.30 0.83 0.41 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 16 Y 7.46 4.21 0.00 3.23 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 7.78 3.66 0.00 1.77 1.64 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.90 3.67 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 0.79 0.00 0.00 0.89 0.00 0.00 19 C 7.73 4.25 0.00 3.29 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 20 G 8.56 3.48 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 0.00 21 E 8.14 3.39 0.00 1.96 1.85 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 2.31 2.45 0.00 22 R 8.04 4.01 0.00 1.84 2.04 0.00 3.52 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 23 G 7.64 3.82 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 0.00 0.00 0.00 24 F 7.33 4.64 0.00 3.25 3.08 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 25 F 9.21 4.39 0.00 3.06 3.09 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 0.00 0.00 0.00 0.00 26 Y 8.68 4.72 0.00 3.24 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 27 T 7.34 4.50 4.17 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 1.25 0.00 0.00 28 P 0.00 3.56 0.00 2.04 1.42 0.00 3.61 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.35 0.00 29 K 9.21 3.89 0.00 1.67 1.79 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.13 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.49 7.81 30 T 7.82 3.60 4.19 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 1.17 0.00 0.00