NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2471 8.3149 120.1339 56.5455 32.5704 175.1159 2 K 4.0659 7.8378 121.9929 54.8539 34.9993 173.7132 3 K 3.6686 9.1438 116.1536 56.3895 29.9283 172.3091 4 C 4.7067 7.2621 112.7769 55.1616 45.4040 173.7262 5 I 4.3012 8.0413 120.3315 59.8803 37.4561 175.9137 6 A 4.2365 8.4985 127.1538 52.2633 18.4992 177.1586 7 K 4.2644 7.8205 117.9672 55.5540 32.0148 176.0852 8 D 4.3812 8.7548 123.6329 56.3603 41.3852 176.6778 9 Y 3.3721 8.2158 119.4531 58.9257 36.1139 171.4889 10 G 3.9705 7.8078 107.8199 45.0166 0.0000 174.3219 11 R 4.5121 8.6785 125.0050 56.2262 30.5122 176.5130 12 C 5.1866 8.7468 122.6862 55.0167 45.5977 172.5491 13 K 4.8196 8.3719 117.6046 54.4429 34.9302 177.4904 14 W 4.5425 8.7018 119.9033 58.8080 29.1243 177.1096 15 G 4.3074 8.2233 105.2780 44.9563 0.0000 173.0010 16 G 4.1024 7.6395 108.9266 45.9001 0.0000 176.6935 17 T 4.4279 8.6478 123.2437 61.5946 70.0897 172.1142 18 P 4.8266 0.0000 0.0000 63.1016 34.4673 175.3033 19 C 5.0688 8.7254 115.9060 56.0999 38.2430 173.9682 20 C 4.3861 9.1221 118.9034 57.9931 39.2856 176.3530 21 R 3.5862 7.8895 122.2325 59.1356 30.3020 176.7181 22 G 4.0442 7.4900 107.0219 45.6966 0.0000 174.2905 23 R 4.2889 8.0562 118.3380 55.3809 31.9185 176.2093 24 G 3.8839 8.4395 108.0419 44.5405 0.0000 172.6187 25 C 4.7871 8.8914 126.8601 57.1124 40.1677 171.3858 26 I 4.4862 8.7391 125.1409 59.9647 39.0492 174.5438 27 C 5.4515 8.9250 126.4772 55.3931 41.9677 173.3863 28 S 4.8114 8.2962 114.7930 59.2957 62.5438 174.7166 29 I 3.5268 7.6985 116.6329 61.9550 36.7847 173.5850 30 M 4.5951 8.0833 115.9034 54.0112 33.5326 176.1254 31 G 3.9009 9.3075 106.2514 45.5056 0.0000 172.9036 32 T 4.5227 7.1774 107.8942 60.7164 71.8504 172.5905 33 N 4.5072 8.6170 116.0140 54.6989 35.8063 175.5784 34 C 4.8642 7.9069 114.6831 57.3690 42.9648 173.4003 35 E 5.0314 9.0411 120.4998 55.5614 34.6825 173.9763 36 C 5.0494 8.9262 120.6664 56.1456 42.1456 173.2469 37 K 4.1991 8.2172 123.8135 53.8345 34.1722 175.3412 38 P 4.7806 0.0000 0.0000 64.4769 28.9186 175.1669 39 R 3.2620 7.7022 117.2803 58.1904 27.8009 174.5528 40 L 4.7975 8.0032 126.3858 52.9920 44.6552 178.0531 41 I 4.4727 8.0582 124.0162 59.8607 38.4591 172.5051 42 M 4.4150 7.9517 119.7464 53.7111 32.9154 174.6770 43 E 4.5791 8.5563 128.6610 57.0908 32.4214 176.4118 44 G 5.0959 8.6025 118.2836 47.9719 0.0000 174.5781 45 L 3.9764 7.9309 119.8239 58.0268 40.2718 178.2142 46 G 3.8123 7.8708 106.3094 46.6931 0.0000 174.5455 47 L 3.9260 7.6811 121.0090 57.6215 42.5830 176.3659 48 A 4.1779 7.9820 125.5242 52.7485 18.2303 177.0995 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 K 8.31 4.25 0.00 1.76 1.85 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.41 7.81 2 K 7.84 4.07 0.00 1.82 1.78 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.49 7.81 3 K 9.14 3.67 0.00 1.89 1.88 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.36 7.81 4 C 7.26 4.71 0.00 3.14 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 5 I 8.04 4.30 1.97 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.03 0.96 0.00 0.00 6 A 8.50 4.24 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 7 K 7.82 4.26 0.00 1.86 1.81 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.47 7.81 8 D 8.75 4.38 0.00 2.73 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 9 Y 8.22 3.37 0.00 3.20 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 10 G 7.81 3.97 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 0.00 0.00 0.00 11 R 8.68 4.51 0.00 1.73 1.97 0.00 3.24 0.00 0.00 3.83 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.54 0.00 12 C 8.75 5.19 0.00 3.08 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 13 K 8.37 4.82 0.00 1.97 1.76 0.00 1.33 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.39 7.81 14 W 8.70 4.54 0.00 3.40 3.20 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 15 G 8.22 4.31 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 0.00 16 G 7.64 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 17 T 8.65 4.43 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 1.23 0.00 0.00 18 P 0.00 4.83 0.00 2.12 2.15 0.00 3.76 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.01 0.00 19 C 8.73 5.07 0.00 2.95 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 20 C 9.12 4.39 0.00 2.96 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 21 R 7.89 3.59 0.00 1.79 2.01 0.00 3.35 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 1.65 1.63 0.00 22 G 7.49 4.04 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 0.00 0.00 0.00 23 R 8.06 4.29 0.00 1.67 1.91 0.00 3.29 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 24 G 8.44 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.89 4.79 0.00 3.07 3.24 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 26 I 8.74 4.49 1.87 0.00 0.00 0.78 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 0.31 0.97 0.00 0.00 27 C 8.92 5.45 0.00 3.25 3.07 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.30 4.81 0.00 4.22 3.86 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 29 I 7.70 3.53 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.72 0.95 0.00 0.00 30 M 8.08 4.60 0.00 1.88 2.13 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 31 G 9.31 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 32 T 7.18 4.52 4.21 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 1.16 0.00 0.00 33 N 8.62 4.51 0.00 2.91 3.00 0.00 0.00 6.99 7.67 0.00 0.00 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 C 7.91 4.86 0.00 2.86 3.16 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 0.00 0.00 0.00 0.00 35 E 9.04 5.03 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 36 C 8.93 5.05 0.00 3.05 3.01 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 37 K 8.22 4.20 0.00 1.49 1.37 0.00 1.48 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.30 0.76 7.81 38 P 0.00 4.78 0.00 2.05 2.24 0.00 3.42 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 39 R 7.70 3.26 0.00 1.83 2.12 0.00 3.15 0.00 0.00 3.20 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 40 L 8.00 4.80 0.00 1.57 1.51 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.06 4.47 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.29 0.89 0.00 0.00 42 M 7.95 4.42 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 43 E 8.56 4.58 0.00 1.99 1.90 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 2.26 2.29 0.00 44 G 8.60 5.10 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 45 L 7.93 3.98 0.00 1.76 1.84 0.92 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.87 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.68 3.93 0.00 1.62 1.67 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.98 4.18 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