NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 C 4.4723 8.4393 118.1361 55.7898 35.9678 173.1711 3 P 4.3954 0.0000 0.0000 62.7851 31.7526 174.8145 4 H 5.2129 9.5171 119.9729 56.7254 30.0320 177.0621 5 T 4.2259 7.6075 115.4613 63.5367 68.9868 174.0715 6 Y 4.9665 8.5779 125.8619 56.9303 39.7980 176.0323 7 K 4.5964 8.8612 132.0555 52.0794 33.0669 170.1734 8 P 4.6375 0.0000 0.0000 63.3395 32.3355 176.2702 9 V 4.4563 9.0799 115.8638 59.6902 36.3571 173.4967 10 C 4.5311 7.6232 123.3987 55.1070 45.2231 172.7956 11 G 4.4709 9.1284 113.7602 44.8234 0.0000 174.7336 12 A 4.0964 9.1438 125.5392 54.1376 18.4870 178.3374 13 N 4.6015 8.1583 111.8252 52.7063 37.6990 176.2372 14 G 3.9483 8.3786 108.1507 44.6842 0.0000 173.2976 15 E 4.3105 8.4689 121.4867 55.2000 31.4577 175.0303 16 V 4.6793 8.0642 125.8049 61.8391 32.7341 174.3838 17 Y 4.5455 8.9075 126.3626 56.3478 39.7460 176.7712 18 D 4.5824 9.0047 122.7956 57.7963 41.5012 176.0912 19 N 5.4766 8.0248 115.7206 51.4661 41.1374 174.6438 20 E 3.8915 8.7357 120.3700 59.5518 29.4282 179.0254 21 C 4.1102 8.1269 117.8781 59.8217 44.3532 175.5124 22 F 4.2049 8.3993 119.2972 60.2436 38.4030 177.4238 23 L 2.9545 7.9070 119.9504 57.9235 41.7952 178.7916 24 N 4.1963 8.1551 116.4368 56.2252 38.2794 177.2570 25 K 3.8752 8.1091 119.7810 59.3980 32.4125 178.0403 26 A 4.2600 8.0725 118.1290 51.8765 18.5080 177.1041 27 G 3.8367 8.0424 105.5874 46.8043 0.0000 173.8233 28 I 4.5176 7.0518 118.4754 58.8193 39.8343 176.3676 29 E 4.1665 8.5621 125.2797 55.5308 30.7063 174.6249 30 P 4.5595 0.0000 0.0000 62.3997 32.0629 176.2639 31 A 4.1432 8.3913 125.7142 51.7818 18.7891 177.8428 32 E 4.0266 8.7264 119.0065 59.1654 30.0044 177.5706 33 S 4.6450 7.4428 110.7133 56.4274 66.0121 174.8168 34 W 4.0642 8.9626 122.7083 59.8470 29.2570 179.1166 35 E 4.0651 8.3515 115.1114 59.1474 29.0420 184.7330 36 T 4.0060 8.1789 115.1948 66.1864 68.5778 174.9491 37 C 5.0029 8.2761 119.3281 57.2767 40.6147 175.7623 38 R 3.8721 7.8387 121.1289 57.8710 29.0250 181.8865 39 G 4.2298 9.3904 104.1030 45.7845 0.0000 173.1117 40 H 4.4206 7.5806 119.2864 55.9866 28.2788 173.1975 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 C 8.44 4.47 0.00 1.95 2.25 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 3 P 0.00 4.40 0.00 2.30 2.15 0.00 3.44 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 4 H 9.52 5.21 0.00 3.23 3.52 0.00 5.89 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 7.61 4.23 4.32 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 1.29 0.00 0.00 6 Y 8.58 4.97 0.00 2.83 2.94 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 0.00 0.00 0.00 7 K 8.86 4.60 0.00 1.40 1.62 0.00 1.89 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.27 1.28 7.81 8 P 0.00 4.64 0.00 2.01 2.03 0.00 3.36 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.44 0.00 9 V 9.08 4.46 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 0.86 0.00 0.00 1.06 0.00 0.00 10 C 7.62 4.53 0.00 1.34 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 9.13 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 9.14 4.10 1.31 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 0.00 0.00 13 N 8.16 4.60 0.00 2.88 2.97 0.00 0.00 6.21 7.00 0.00 0.00 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 G 8.38 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 0.00 0.00 0.00 15 E 8.47 4.31 0.00 2.05 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 1.58 1.47 0.00 16 V 8.06 4.68 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 1.06 0.00 0.00 1.14 0.00 0.00 17 Y 8.91 4.55 0.00 2.97 2.99 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 18 D 9.00 4.58 0.00 3.04 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 19 N 8.02 5.48 0.00 2.99 2.99 0.00 0.00 6.36 7.66 0.00 0.00 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 E 8.74 3.89 0.00 2.08 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 2.34 2.39 0.00 21 C 8.13 4.11 0.00 2.87 2.93 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 22 F 8.40 4.20 0.00 3.45 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 23 L 7.91 2.95 0.00 1.72 1.76 0.85 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.16 4.20 0.00 2.87 2.78 0.00 0.00 6.72 8.34 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 25 K 8.11 3.88 0.00 1.69 2.05 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.17 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.59 7.81 26 A 8.07 4.26 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 3.84 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 0.00 0.00 0.00 28 I 7.05 4.52 1.54 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.95 0.96 0.00 0.00 29 E 8.56 4.17 0.00 1.85 1.82 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 2.36 2.26 0.00 30 P 0.00 4.56 0.00 1.86 1.89 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 31 A 8.39 4.14 1.20 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 0.00 0.00 32 E 8.73 4.03 0.00 1.95 2.01 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 2.29 2.27 0.00 33 S 7.44 4.64 0.00 4.01 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 34 W 8.96 4.06 0.00 3.50 3.34 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 35 E 8.35 4.07 0.00 1.92 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 2.25 2.17 0.00 36 T 8.18 4.01 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 1.24 0.00 0.00 37 C 8.28 5.00 0.00 3.15 3.21 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 0.00 38 R 7.84 3.87 0.00 1.86 1.85 0.00 3.23 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.45 0.00 39 G 9.39 4.23 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 0.00 0.00 0.00 40 H 7.58 4.42 0.00 3.23 3.23 0.00 5.56 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00