NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.1480 0.0000 0.0000 63.1988 32.2840 173.4415 3 N 3.8526 9.0422 125.5783 52.8791 35.9449 171.5576 4 R 4.6410 7.7736 122.0840 54.8344 35.5600 175.6190 5 S 4.5017 8.2533 113.3296 58.9114 63.4593 172.8423 6 I 4.4695 7.5644 117.9849 60.0066 41.0005 175.6458 7 S 4.3166 8.4492 121.5884 57.8818 63.0435 171.7117 8 P 4.3159 0.0000 0.0000 63.6693 31.6227 178.8216 9 S 4.0275 8.3317 113.6806 60.8720 63.4630 176.0511 10 A 3.9682 8.3085 123.2989 55.3364 17.8639 179.5677 11 L 3.9469 9.9517 117.8365 59.3256 40.6067 179.6768 12 Q 4.0792 7.9196 118.4928 58.3065 28.6308 178.1639 13 D 4.3795 8.7422 120.7882 57.1455 40.9484 178.2890 14 L 4.0232 8.2685 121.1989 58.1359 42.0183 178.5260 15 L 3.9543 7.9073 119.6685 58.4420 42.2176 178.8493 16 R 4.0863 8.0737 118.4957 59.3396 30.0022 178.3841 17 T 4.5434 8.0075 117.4568 66.2017 68.2320 176.4283 18 L 4.1397 7.7550 119.2715 57.5805 41.6324 179.1263 19 K 4.0307 7.9108 118.2661 59.4766 32.2664 177.2418 20 S 4.3771 7.7320 112.5024 57.5801 62.9905 172.1590 21 P 4.2768 0.0000 0.0000 64.3834 31.3001 175.0907 22 S 4.2321 7.6119 114.7909 57.2739 59.5039 169.0620 23 S 5.7612 7.5067 126.2328 58.9474 62.6239 176.2454 24 P 4.1954 0.0000 0.0000 64.5911 30.4559 178.3574 25 Q 3.8623 9.5621 116.5078 59.3655 29.4805 177.5576 26 Q 3.8063 7.8295 119.6816 58.8576 29.5597 178.7662 27 Q 4.1191 7.7372 118.6657 60.0065 28.3640 179.6006 28 Q 4.0613 7.9444 119.3932 57.8724 28.9123 178.5819 29 Q 3.9346 8.5315 119.9496 58.8791 28.8601 178.8139 30 V 3.3725 8.4917 114.4156 64.5556 31.6215 178.7666 31 L 4.0411 7.7721 118.4669 57.9410 41.3540 178.8852 32 N 4.2824 8.2287 117.0487 56.4214 38.4347 177.2189 33 I 4.2156 8.1187 115.3804 64.0274 37.6703 178.1306 34 L 4.0771 8.1658 121.3663 57.0626 41.4685 179.9155 35 K 4.1411 7.7438 117.5229 59.2874 32.1908 178.9230 36 S 4.9768 7.5435 112.2532 57.3493 63.9240 174.9119 37 N 4.8183 8.5522 122.1397 50.7206 40.6031 173.7155 38 P 4.1609 0.0000 0.0000 65.8521 31.8452 177.8959 39 Q 3.9843 8.1409 119.8801 58.5785 28.7884 178.4665 40 L 3.9672 7.8489 119.1035 58.1404 41.2412 178.6794 41 M 3.9495 8.0573 117.8144 58.8186 32.0744 177.8905 42 A 4.2099 8.5379 120.7889 55.2701 18.5362 179.5172 43 A 3.8726 7.7569 118.6799 55.3523 18.5650 179.2870 44 F 3.8286 8.8760 119.3027 61.4511 39.4648 176.7241 45 I 3.7806 9.2972 118.4753 64.5952 37.6780 177.8976 46 K 4.0843 8.0875 118.7319 59.4387 31.5817 179.3818 47 Q 3.8871 8.2201 117.9523 58.9053 28.8973 178.9449 48 R 3.9723 8.6003 119.2375 59.5679 29.8876 179.0013 49 T 2.8696 8.2543 112.1615 63.7559 67.0894 175.3258 50 A 3.9602 7.5450 121.6176 53.9074 18.3640 178.2445 51 K 4.1272 6.9500 117.1870 57.3182 32.3941 176.9130 52 Y 4.7169 6.5933 115.4688 59.7851 39.2651 177.8575 53 V 4.2251 9.0341 121.8004 64.5095 30.8841 178.2446 54 A 3.9979 7.8143 119.5545 54.9856 18.4501 178.9932 55 N 4.7044 8.0828 113.1442 55.1506 39.4033 175.9010 56 Q 4.5024 9.1741 125.0184 53.3440 28.5776 172.7036 57 P 4.7595 0.0000 0.0000 62.3316 32.5137 176.6418 58 G 3.9039 8.7407 109.8654 47.2925 0.0000 173.5793 59 M 4.3518 7.7307 123.1970 55.0016 32.9471 175.2594 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 P 0.00 4.15 0.00 2.19 2.15 0.00 3.89 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 1.88 2.00 0.00 3 N 9.04 3.85 0.00 2.98 2.91 0.00 0.00 6.94 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.77 4.64 0.00 1.74 1.82 0.00 3.21 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 5 S 8.25 4.50 0.00 3.98 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 6 I 7.56 4.47 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.05 0.92 0.00 0.00 7 S 8.45 4.32 0.00 3.90 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 8 P 0.00 4.32 0.00 2.22 2.10 0.00 3.74 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 9 S 8.33 4.03 0.00 3.89 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 10 A 8.31 3.97 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 11 L 9.95 3.95 0.00 1.90 2.00 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 12 Q 7.92 4.08 0.00 2.20 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 13 D 8.74 4.38 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.27 4.02 0.00 1.88 1.88 1.14 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.91 3.95 0.00 1.69 1.87 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 16 R 8.07 4.09 0.00 1.94 2.20 0.00 3.17 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 17 T 8.01 4.54 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 18 L 7.75 4.14 0.00 1.82 1.73 0.99 0.93 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 19 K 7.91 4.03 0.00 1.92 1.90 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.68 1.62 7.81 20 S 7.73 4.38 0.00 4.01 4.12 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 0.00 0.00 0.00 0.00 21 P 0.00 4.28 0.00 2.21 2.23 0.00 3.79 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 2.00 1.99 0.00 22 S 7.61 4.23 0.00 4.08 4.34 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 23 S 7.51 5.76 0.00 3.94 3.91 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 0.00 0.00 0.00 24 P 0.00 4.20 0.00 2.26 2.02 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 25 Q 9.56 3.86 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 26 Q 7.83 3.81 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.84 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 27 Q 7.74 4.12 0.00 2.19 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.58 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 28 Q 7.94 4.06 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.96 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 29 Q 8.53 3.93 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 30 V 8.49 3.37 1.32 0.00 0.00 0.00 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 0.84 0.00 0.00 31 L 7.77 4.04 0.00 1.75 1.67 0.84 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.23 4.28 0.00 2.88 2.81 0.00 0.00 6.67 8.31 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 33 I 8.12 4.22 1.96 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.38 0.94 0.00 0.00 34 L 8.17 4.08 0.00 1.55 1.73 0.77 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 35 K 7.74 4.14 0.00 1.97 1.84 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.54 7.81 36 S 7.54 4.98 0.00 3.84 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 37 N 8.55 4.82 0.00 2.67 2.71 0.00 0.00 6.80 8.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.16 0.00 2.26 2.29 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 39 Q 8.14 3.98 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 40 L 7.85 3.97 0.00 1.76 1.77 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 41 M 8.06 3.95 0.00 2.30 2.07 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 42 A 8.54 4.21 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.76 3.87 1.34 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 44 F 8.88 3.83 0.00 3.13 3.06 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 0.00 0.00 0.00 0.00 45 I 9.30 3.78 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.17 1.03 0.00 0.00 46 K 8.09 4.08 0.00 2.22 1.82 0.00 1.85 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.51 7.81 47 Q 8.22 3.89 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 48 R 8.60 3.97 0.00 2.02 2.14 0.00 3.47 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.28 0.00 49 T 8.25 2.87 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 50 A 7.55 3.96 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 K 6.95 4.13 0.00 1.69 1.73 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.86 7.81 52 Y 6.59 4.72 0.00 3.02 2.84 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 53 V 9.03 4.23 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 1.30 0.00 0.00 0.94 0.00 0.00 54 A 7.81 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 N 8.08 4.70 0.00 2.82 2.93 0.00 0.00 6.84 7.99 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 56 Q 9.17 4.50 0.00 2.24 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 7.06 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 57 P 0.00 4.76 0.00 2.21 2.10 0.00 3.37 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.93 0.00 58 G 8.74 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 59 M 7.73 4.35 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00