NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.7854 8.3027 120.6722 56.0840 31.8791 171.2229 3 V 4.7263 7.8031 123.1561 60.4645 33.6567 173.0165 4 W 4.6876 10.2451 129.8478 54.0546 31.8772 173.3239 5 P 4.9291 0.0000 0.0000 62.0284 31.8815 177.6686 6 V 3.5426 8.6730 123.9548 65.4874 31.0138 178.9816 7 Q 4.0524 8.0424 117.6049 58.5542 28.4077 177.9252 8 D 4.4259 7.9881 120.4073 57.0076 41.3109 178.2284 9 A 3.4378 8.2358 121.4988 54.6590 17.9205 179.6890 10 K 3.8753 7.8736 117.0169 59.8024 32.4921 178.7714 11 A 4.2242 8.1018 119.6462 53.9998 18.7462 178.0492 12 R 4.7318 8.3288 117.1239 55.3001 31.3243 178.0609 13 F 4.4915 8.8833 123.1359 60.9214 39.3254 175.7850 14 S 4.1301 8.1968 113.1803 61.4716 62.7078 175.9829 15 E 3.9342 8.1171 122.4608 58.7303 29.5192 178.3111 16 F 3.1239 7.9578 120.8728 60.8540 39.3289 176.8790 17 L 3.3187 7.5176 120.2562 57.8890 41.7047 178.3428 18 D 4.2067 8.0912 117.8808 57.2925 41.1256 178.1303 19 A 3.9780 8.2906 121.7042 55.0483 18.3217 178.9251 20 C 4.5788 7.6241 118.5891 62.2822 31.3137 176.1404 21 I 3.7298 7.3488 119.9407 64.2919 36.8009 178.0132 22 T 4.2047 8.0685 109.5472 63.1490 69.0923 175.3220 23 E 4.3613 9.1906 120.1253 57.3504 31.8892 175.3400 24 G 3.9977 7.7165 103.1600 42.0451 0.0000 170.3398 25 P 4.6720 0.0000 0.0000 63.4506 31.8869 176.1021 26 Q 4.8510 8.8006 122.7307 54.1757 31.5941 175.0743 27 I 4.6675 9.0310 125.3837 60.9085 39.0446 174.9062 28 V 5.0912 9.0549 126.1609 61.2121 33.8959 174.6355 29 S 5.3680 9.0386 121.9044 56.7016 66.5062 173.0155 30 R 4.5883 8.2533 118.8583 55.0976 34.1182 175.8365 31 R 3.8932 9.6430 119.5754 57.2579 27.7562 176.8489 32 G 3.8704 8.5139 102.3274 46.0352 0.0000 173.7413 33 A 4.7351 7.8255 122.0481 49.4264 21.4990 176.5984 34 E 4.4178 8.8337 122.3319 56.7610 30.1947 176.3439 35 E 4.6814 9.0940 121.8867 57.5907 32.5566 175.6078 36 A 4.8020 7.6799 118.6419 50.9510 23.2382 175.3304 37 V 4.8654 8.0112 117.6853 60.1495 34.6472 174.6008 38 L 4.3179 9.2356 127.2760 53.9186 43.1487 175.1711 39 V 4.6972 7.9728 125.8826 60.0530 34.3243 173.4711 40 P 4.2847 0.0000 0.0000 62.7267 32.0158 177.3138 41 I 3.8945 8.5459 122.1196 64.1913 37.9539 178.5125 42 G 3.6150 8.0746 106.2832 47.6268 0.0000 175.1851 43 E 3.9829 8.1717 121.2092 58.7336 29.7018 178.4442 44 W 4.3324 8.2911 128.4538 60.7259 30.7926 178.0786 45 R 3.8977 8.4391 118.2439 59.4370 29.5292 179.3559 46 R 3.8899 8.0850 117.8021 58.8405 30.0217 178.8167 47 L 3.8351 7.9234 120.2671 58.1875 41.8593 178.9571 48 Q 3.6129 7.5881 116.7255 58.9735 28.6859 178.6836 49 A 4.0163 7.7678 120.0722 54.8157 18.4333 179.0696 50 A 4.0915 7.6401 118.1052 54.1384 18.8120 177.8608 51 A 4.2547 7.7904 123.3232 52.4274 19.0393 176.9533 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 H 8.30 4.79 0.00 3.31 3.66 0.00 5.78 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 7.80 4.73 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 0.87 0.00 0.00 0.94 0.00 0.00 4 W 10.25 4.69 0.00 3.07 2.98 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 0.00 0.00 0.00 5 P 0.00 4.93 0.00 2.09 1.99 0.00 4.06 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 6 V 8.67 3.54 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 0.85 0.00 0.00 0.90 0.00 0.00 7 Q 8.04 4.05 0.00 2.27 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 8 D 7.99 4.43 0.00 3.01 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 9 A 8.24 3.44 0.34 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 10 K 7.87 3.88 0.00 1.75 2.00 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.41 7.81 11 A 8.10 4.22 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.33 4.73 0.00 2.32 2.14 0.00 3.59 0.00 0.00 3.19 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 13 F 8.88 4.49 0.00 3.36 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 14 S 8.20 4.13 0.00 4.11 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 0.00 15 E 8.12 3.93 0.00 2.17 2.34 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 2.67 2.50 0.00 16 F 7.96 3.12 0.00 1.66 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 3.32 0.00 0.96 1.44 0.69 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.09 4.21 0.00 2.87 2.76 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 0.00 0.00 0.00 0.00 19 A 8.29 3.98 1.53 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 0.00 0.00 20 C 7.62 4.58 0.00 2.54 2.86 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.35 3.73 1.80 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.85 0.88 0.00 0.00 22 T 8.07 4.20 4.24 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 0.00 0.00 1.26 0.00 0.00 23 E 9.19 4.36 0.00 2.06 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 2.24 2.22 0.00 24 G 7.72 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 0.00 0.00 0.00 25 P 0.00 4.67 0.00 1.97 2.06 0.00 3.64 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 2.07 2.17 0.00 26 Q 8.80 4.85 0.00 1.62 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.96 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 27 I 9.03 4.67 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.66 1.02 0.00 0.00 28 V 9.05 5.09 2.15 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 1.05 0.00 0.00 1.06 0.00 0.00 29 S 9.04 5.37 0.00 4.08 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 30 R 8.25 4.59 0.00 1.76 1.80 0.00 3.27 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 31 R 9.64 3.89 0.00 1.94 2.00 0.00 3.30 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 32 G 8.51 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 7.83 4.74 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.83 4.42 0.00 1.99 1.94 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 2.34 2.35 0.00 35 E 9.09 4.68 0.00 1.93 1.95 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 2.45 2.37 0.00 36 A 7.68 4.80 1.22 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 0.00 0.00 37 V 8.01 4.87 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 0.74 0.00 0.00 1.00 0.00 0.00 38 L 9.24 4.32 0.00 1.47 1.02 0.81 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.97 4.70 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 1.00 0.00 0.00 0.97 0.00 0.00 40 P 0.00 4.28 0.00 2.22 1.94 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.23 0.00 41 I 8.55 3.89 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.94 0.00 0.00 42 G 8.07 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.17 3.98 0.00 2.08 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 0.00 2.46 2.40 0.00 44 W 8.29 4.33 0.00 3.41 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.44 3.90 0.00 1.98 1.93 0.00 3.37 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.87 0.00 46 R 8.08 3.89 0.00 1.85 1.94 0.00 3.12 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 47 L 7.92 3.84 0.00 1.83 1.67 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 7.59 3.61 0.00 1.88 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.77 0.00 0.00 0.00 0.00 0.00 1.54 1.16 0.00 49 A 7.77 4.02 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.64 4.09 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.79 4.25 1.24 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 0.00 0.00 0.00 0.00 0.00