NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9479 8.3393 109.7380 44.6014 0.0000 173.1915 2 P 4.2701 0.0000 0.0000 62.0737 31.7737 174.8325 3 S 4.4023 8.5392 116.4312 58.1011 64.4517 175.1426 4 Q 3.0018 8.3231 124.1922 54.7937 29.1839 174.4830 5 P 4.4141 0.0000 0.0000 63.0397 32.0341 175.6364 6 T 4.3585 8.2624 116.8815 62.4654 69.1384 174.3437 7 Y 3.2635 8.4877 127.9968 56.8584 39.1992 174.3062 8 P 4.0622 0.0000 0.0000 62.8117 32.3922 176.7926 9 G 3.7925 5.6116 106.9154 45.1519 0.0000 174.7068 10 D 4.4114 8.5807 120.6190 57.0775 40.9723 177.3099 11 D 4.6564 7.8460 115.8119 53.8490 41.0446 176.3932 12 A 4.0947 7.4053 122.8549 51.0253 19.0906 176.9949 13 P 4.4103 0.0000 0.0000 62.5939 33.2920 177.5949 14 V 3.5656 8.4198 118.6471 66.6528 31.2697 178.1124 15 E 3.9650 8.2041 117.4381 59.7332 29.3351 178.9952 16 D 4.4544 8.0217 118.2559 57.0898 40.9227 178.6251 17 L 4.1557 8.0135 119.7737 57.7434 41.5345 179.5486 18 I 3.8109 8.1051 120.0128 64.4797 37.0787 178.6439 19 R 3.9816 8.0992 118.9363 59.2145 29.9077 178.9448 20 F 4.2151 8.4737 120.4111 61.3740 39.3687 176.2765 21 Y 3.9772 8.5044 119.5203 61.0405 38.6679 178.1237 22 N 4.1371 8.4477 117.1584 56.4234 38.6399 177.2469 23 D 4.3157 8.0886 120.3173 57.0652 40.7716 178.5830 24 L 3.7575 7.8944 121.4094 57.8136 41.9231 178.6482 25 Q 3.7473 7.7957 119.6848 59.2214 28.9455 178.2141 26 Q 3.8731 7.7882 120.0911 59.2353 29.0181 177.4921 27 Y 4.0314 7.9631 120.4352 60.9079 38.8849 178.2395 28 L 3.8143 8.2434 120.0665 57.7450 41.6057 179.2276 29 N 4.3012 8.2992 116.6528 56.2821 38.4703 177.6802 30 V 3.5043 7.6503 119.5826 65.9123 31.4348 178.2120 31 V 3.4511 7.4285 117.2714 65.6561 31.3535 177.1067 32 T 4.2392 7.6364 106.3812 60.7356 69.1594 174.6481 33 R 3.8711 7.8814 119.2420 58.0075 28.2059 176.4805 34 H 4.8001 8.3531 116.2238 54.3689 29.7695 173.1814 35 R 4.1351 7.9122 121.4246 55.8580 30.0727 176.6081 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 G 8.34 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 2 P 0.00 4.27 0.00 2.38 2.11 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 3 S 8.54 4.40 0.00 3.90 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 4 Q 8.32 3.00 0.00 1.69 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 7.00 0.00 0.00 0.00 0.00 0.00 2.04 1.43 0.00 5 P 0.00 4.41 0.00 2.35 2.04 0.00 3.12 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.96 0.00 6 T 8.26 4.36 4.27 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 1.21 0.00 0.00 7 Y 8.49 3.26 0.00 2.67 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.06 0.00 1.98 1.98 0.00 2.55 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.77 0.00 9 G 5.61 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.58 4.41 0.00 2.70 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.85 4.66 0.00 2.62 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 7.41 4.09 1.17 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 0.00 0.00 13 P 0.00 4.41 0.00 2.41 2.18 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.00 0.00 14 V 8.42 3.57 2.08 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 1.21 0.00 0.00 0.93 0.00 0.00 15 E 8.20 3.97 0.00 2.09 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 2.41 2.48 0.00 16 D 8.02 4.45 0.00 2.80 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 8.01 4.16 0.00 1.91 1.81 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.11 3.81 2.06 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.74 0.98 0.00 0.00 19 R 8.10 3.98 0.00 2.10 2.04 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 20 F 8.47 4.22 0.00 3.13 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 21 Y 8.50 3.98 0.00 3.25 3.27 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 22 N 8.45 4.14 0.00 2.94 2.84 0.00 0.00 7.17 7.70 0.00 0.00 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 D 8.09 4.32 0.00 2.73 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.89 3.76 0.00 0.87 1.33 0.88 0.61 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 25 Q 7.80 3.75 0.00 1.73 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.53 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 26 Q 7.79 3.87 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 27 Y 7.96 4.03 0.00 3.11 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.24 3.81 0.00 1.66 1.65 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.30 4.30 0.00 2.82 2.92 0.00 0.00 6.60 7.57 0.00 0.00 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 V 7.65 3.50 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 1.01 0.00 0.00 0.95 0.00 0.00 31 V 7.43 3.45 1.74 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 0.86 0.00 0.00 0.18 0.00 0.00 32 T 7.64 4.24 4.20 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 1.20 0.00 0.00 33 R 7.88 3.87 0.00 1.99 2.05 0.00 3.08 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 34 H 8.35 4.80 0.00 2.98 3.12 0.00 5.74 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 7.91 4.14 0.00 1.79 1.77 0.00 3.26 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00