NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3538 8.1133 119.7065 56.3537 32.7299 177.6174 2 M 3.8947 8.0186 118.0383 57.2861 31.8463 176.7822 3 K 3.9444 8.7690 120.6205 59.3933 32.8705 178.1375 4 Q 4.0699 8.1241 117.9148 59.1523 28.6404 178.9744 5 L 3.9623 7.9136 119.4464 58.0805 41.7213 179.5781 6 E 3.9908 8.3425 118.6371 59.3544 29.3333 179.1677 7 D 4.3929 8.4893 119.5930 56.2003 39.5097 178.8831 8 K 3.9998 8.1307 120.1346 59.2180 32.0464 179.4794 9 V 3.6260 8.0448 118.7330 65.8581 31.5352 177.9489 10 E 3.9790 8.3665 118.4701 59.4860 29.2440 179.2045 11 E 4.0017 8.2475 118.5424 59.4588 29.4637 179.4103 12 L 3.9905 8.3376 119.4439 57.6725 41.7503 179.3813 13 L 3.9588 8.0900 120.4088 58.1808 41.9473 179.0214 14 S 4.2539 8.0913 112.8441 60.9792 62.2529 176.0114 15 K 3.9748 8.4336 123.0686 59.7968 31.9223 179.0001 16 T 3.9662 8.2588 110.2914 64.8436 68.6463 176.0109 17 Y 4.3154 8.0701 122.1003 60.7046 38.7720 177.2907 18 H 3.9137 8.5618 119.4509 59.3345 29.9811 177.3379 19 L 3.8825 8.3084 121.1067 57.6107 41.2829 179.3639 20 E 3.9593 8.3748 118.9968 59.4640 29.4415 179.1244 21 N 4.1883 8.0485 116.5209 56.3060 38.5609 177.3276 22 E 3.8878 8.1307 120.0741 59.2949 29.4293 179.7136 23 V 3.5014 8.1884 118.4432 65.8591 31.7285 177.7127 24 A 3.9517 8.1482 120.8556 55.4074 18.1726 179.6401 25 R 3.8344 8.0379 116.9260 59.4662 30.1399 178.6681 26 L 3.9874 7.8682 118.8221 57.8639 41.4060 179.6973 27 K 4.0192 8.0938 117.4541 59.2058 31.9641 179.3579 28 K 4.1304 7.5717 117.7109 59.5485 32.1255 179.2522 29 L 4.1578 7.9962 117.9942 55.7413 41.5454 177.6026 30 V 3.9086 7.2454 122.6190 62.5016 32.1960 170.7960 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 R 8.11 4.35 0.00 1.89 2.05 0.00 3.09 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 2 M 8.02 3.89 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.60 0.00 3 K 8.77 3.94 0.00 1.82 1.80 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.53 7.81 4 Q 8.12 4.07 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 5 L 7.91 3.96 0.00 1.99 1.72 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.34 3.99 0.00 2.13 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 2.33 2.45 0.00 7 D 8.49 4.39 0.00 2.86 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 8 K 8.13 4.00 0.00 1.99 1.90 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.57 7.81 9 V 8.04 3.63 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 1.03 0.00 0.00 0.96 0.00 0.00 10 E 8.37 3.98 0.00 2.24 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 0.00 2.33 2.55 0.00 11 E 8.25 4.00 0.00 2.13 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 2.62 2.50 0.00 12 L 8.34 3.99 0.00 1.83 1.73 0.93 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.09 3.96 0.00 1.86 1.80 0.92 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.09 4.25 0.00 4.02 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 15 K 8.43 3.97 0.00 2.13 1.82 0.00 1.58 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.52 7.81 16 T 8.26 3.97 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 17 Y 8.07 4.32 0.00 3.14 3.22 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 18 H 8.56 3.91 0.00 3.30 3.55 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.31 3.88 0.00 1.84 1.68 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.37 3.96 0.00 2.26 2.03 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 2.36 2.55 0.00 21 N 8.05 4.19 0.00 2.60 2.67 0.00 0.00 7.07 7.27 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 22 E 8.13 3.89 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.30 0.00 23 V 8.19 3.50 2.11 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 1.07 0.00 0.00 0.94 0.00 0.00 24 A 8.15 3.95 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 25 R 8.04 3.83 0.00 1.87 2.03 0.00 3.08 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 26 L 7.87 3.99 0.00 1.91 1.69 0.90 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.09 4.02 0.00 1.88 1.87 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.65 7.81 28 K 7.57 4.13 0.00 1.90 1.86 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.77 1.61 7.81 29 L 8.00 4.16 0.00 1.78 1.72 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.25 3.91 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 0.55 0.00 0.00 0.93 0.00 0.00