NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.3497 8.1127 119.6563 56.1373 32.0935 173.8739 5 E 4.7672 8.5202 122.1450 53.2859 32.2482 173.6706 6 C 4.4319 9.8999 126.6952 59.0901 32.5906 173.7677 7 D 4.4698 8.6213 127.7549 56.3290 40.2502 175.9630 8 Y 4.4226 7.4180 118.2104 58.8536 40.7762 176.2645 9 C 4.0553 8.1243 114.1440 58.8968 30.7097 175.2681 10 G 3.8945 8.3637 108.4358 45.1428 0.0000 173.5054 11 T 4.4511 7.5311 109.3268 60.9796 70.4119 173.3325 12 D 4.9554 8.5157 121.8249 54.2056 41.9783 176.4527 13 I 4.2029 8.6973 124.2702 59.8166 37.8081 175.6169 14 E 3.8517 9.0432 128.3574 55.7578 29.7485 175.0114 15 P 4.2876 0.0000 0.0000 64.2983 31.7186 175.9084 16 G 3.8441 9.4224 107.4387 46.6931 0.0000 172.8925 17 T 4.4939 7.5119 114.4948 62.5040 72.7220 174.0455 18 G 4.1042 8.7016 111.5936 45.5132 0.0000 172.6579 19 T 4.8266 8.5878 113.8356 61.8140 72.9528 173.0517 20 M 4.9348 8.7379 123.8982 53.8848 34.3073 174.4630 21 F 4.7573 9.5338 129.5507 56.9340 41.3608 174.6096 22 V 4.3062 7.6661 126.8520 61.3899 31.7340 175.1989 23 H 4.1290 8.7029 126.0226 55.2009 29.4053 176.8725 24 K 3.8486 8.7512 122.3019 59.7578 31.8974 177.3440 25 D 4.5164 8.0018 114.7307 53.6977 39.7027 176.8221 26 G 3.9004 8.0807 108.6948 44.9592 0.0000 173.9101 27 A 4.2914 8.4438 122.0114 52.6092 19.8650 176.6046 28 T 5.0279 8.3083 114.6300 62.1629 72.4292 173.7600 29 T 4.6321 8.9560 122.6719 62.0548 71.8183 172.7959 30 H 5.0177 9.9435 125.4156 54.9271 30.2795 174.3860 31 F 5.3540 9.5572 123.3870 55.9142 40.7401 176.9525 32 C 4.3315 9.1713 117.7621 60.2545 30.5203 173.6272 33 S 4.6036 7.5803 114.1900 56.3050 66.1492 175.8600 34 S 4.3558 8.3246 118.5697 60.8134 62.7641 175.9882 35 K 3.7132 8.0743 122.9777 59.6584 31.7429 178.2153 36 C 4.1443 7.6860 115.6029 62.7866 27.9930 175.7508 37 E 2.5793 7.6062 119.9921 59.2493 28.8395 179.3403 38 N 4.1947 8.5288 116.6694 56.3474 38.6299 177.3199 39 N 4.3828 8.0591 117.6716 55.9641 38.5567 177.4374 40 A 4.0833 7.5429 122.3579 55.3347 18.3109 179.4629 41 D 4.3535 7.8713 115.9788 57.0189 40.8817 178.3924 42 L 4.2728 7.3774 118.2647 55.4805 41.8087 177.8455 43 G 3.9863 8.2608 107.4625 45.2777 0.0000 173.5495 44 R 4.3006 7.5931 117.8275 55.3181 31.1502 175.7745 45 E 4.4890 8.5635 121.0679 54.5788 31.2464 176.8614 46 A 3.3994 8.0942 126.9877 55.3190 18.4421 179.6853 47 R 3.8501 7.6098 113.1299 58.8116 30.2399 177.2088 48 N 4.4596 8.3026 113.6041 53.4124 39.1244 174.8819 49 L 4.4142 7.1786 119.5443 52.6944 41.9016 176.6306 50 E 3.8775 8.9494 124.8578 59.2747 29.4499 179.1701 51 W 4.4150 7.9007 113.1589 58.3593 28.7597 176.4112 52 T 3.9571 7.2104 117.4845 62.9852 68.5506 175.3577 53 D 4.3090 8.7543 125.1902 58.0153 41.2232 178.6765 54 T 3.7661 7.8450 114.4747 66.8617 68.5545 175.2877 55 A 3.9767 7.7623 121.8258 55.2517 18.6515 177.5118 56 R 4.0765 8.2810 118.1005 56.7744 30.1066 176.7983 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 4 R 8.11 4.35 0.00 1.77 1.89 0.00 3.00 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 5 E 8.52 4.77 0.00 1.97 1.79 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 2.47 2.57 0.00 6 C 9.90 4.43 0.00 3.04 2.90 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 7 D 8.62 4.47 0.00 2.62 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 8 Y 7.42 4.42 0.00 2.99 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 9 C 8.12 4.06 0.00 3.18 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.36 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.53 4.45 4.30 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 1.34 0.00 0.00 12 D 8.52 4.96 0.00 2.61 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 13 I 8.70 4.20 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.61 0.96 0.00 0.00 14 E 9.04 3.85 0.00 1.92 1.93 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 2.32 2.41 0.00 15 P 0.00 4.29 0.00 2.23 2.06 0.00 3.90 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 16 G 9.42 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 17 T 7.51 4.49 4.57 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 0.00 0.00 0.00 1.25 0.00 0.00 18 G 8.70 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.59 4.83 4.37 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 1.31 0.00 0.00 20 M 8.74 4.93 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.38 0.00 21 F 9.53 4.76 0.00 3.33 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 22 V 7.67 4.31 1.84 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 0.74 0.00 0.00 0.83 0.00 0.00 23 H 8.70 4.13 0.00 3.48 3.27 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.75 3.85 0.00 1.75 1.89 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.45 7.81 25 D 8.00 4.52 0.00 2.83 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.08 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 27 A 8.44 4.29 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 28 T 8.31 5.03 4.26 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 1.16 0.00 0.00 29 T 8.96 4.63 4.30 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 0.48 0.00 0.00 30 H 9.94 5.02 0.00 3.16 3.25 0.00 5.78 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.56 5.35 0.00 3.15 2.90 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 32 C 9.17 4.33 0.00 3.17 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 33 S 7.58 4.60 0.00 4.02 4.01 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 0.00 0.00 0.00 34 S 8.32 4.36 0.00 3.98 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.07 3.71 0.00 1.73 1.82 0.00 1.38 0.00 0.00 1.37 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.42 1.38 7.81 36 C 7.69 4.14 0.00 3.45 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 37 E 7.61 2.58 0.00 1.78 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 1.47 1.86 0.00 38 N 8.53 4.19 0.00 2.72 2.77 0.00 0.00 7.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 8.06 4.38 0.00 2.85 3.09 0.00 0.00 6.89 8.06 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 40 A 7.54 4.08 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 41 D 7.87 4.35 0.00 2.67 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 42 L 7.38 4.27 0.00 1.79 1.74 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.26 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 44 R 7.59 4.30 0.00 2.15 1.98 0.00 3.25 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 45 E 8.56 4.49 0.00 1.98 1.79 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 2.33 2.30 0.00 46 A 8.09 3.40 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 7.61 3.85 0.00 1.71 1.91 0.00 3.12 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 48 N 8.30 4.46 0.00 2.69 2.82 0.00 0.00 6.90 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.18 4.41 0.00 1.23 0.91 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.95 3.88 0.00 2.01 2.09 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 2.32 2.33 0.00 51 W 7.90 4.42 0.00 3.55 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 52 T 7.21 3.96 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 1.03 0.00 0.00 53 D 8.75 4.31 0.00 2.94 2.70 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 0.00 0.00 0.00 0.00 54 T 7.85 3.77 4.02 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 1.07 0.00 0.00 55 A 7.76 3.98 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 56 R 8.28 4.08 0.00 1.92 1.87 0.00 3.23 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00