NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 L 4.4419 8.0433 120.6468 55.3076 44.0479 178.7045 3 T 3.9367 7.5149 115.3820 64.3501 69.0094 175.7620 4 R 3.7405 8.6094 118.4310 58.6639 30.4625 176.9231 5 F 3.1859 7.3294 113.8980 56.8918 38.8445 175.7610 6 L 4.4358 6.9528 122.2253 53.8332 41.1315 176.2745 7 G 4.1743 8.1955 108.7366 42.2343 0.0000 170.0293 8 P 4.3253 0.0000 0.0000 65.7321 31.2505 178.9827 9 R 3.8085 7.9272 116.7475 59.7180 29.9419 178.0921 10 Y 4.3400 7.8689 116.0110 61.0337 37.9873 178.3057 11 R 4.0340 8.1552 118.8129 59.2805 30.1305 179.1395 12 Q 4.0059 8.1512 117.9204 58.9614 28.2318 178.5670 13 L 4.0741 8.5704 121.5213 57.9361 41.9879 178.9736 14 A 4.1558 8.5628 121.3178 55.2711 18.2044 179.5899 15 R 3.9180 7.9230 115.9037 59.6579 30.1342 178.1868 16 N 4.3722 8.2533 115.7868 55.2457 38.7804 176.4571 17 W 4.7508 7.7800 117.0874 56.6780 29.6464 178.4757 18 V 3.6634 7.6482 119.7444 65.6988 31.0298 176.0638 19 P 4.2643 0.0000 0.0000 65.7264 31.1763 178.7499 20 T 3.7307 7.9207 113.8516 66.7380 68.1862 176.5299 21 A 4.3252 8.5559 122.6934 54.7986 18.4033 179.6116 22 Q 3.9711 8.2919 118.5920 59.5623 29.2653 178.4167 23 L 3.9963 8.0492 119.9751 57.4256 41.5227 179.5544 24 W 4.7623 8.3662 119.2337 59.4443 28.8095 178.8565 25 G 3.6482 7.9476 104.6945 47.6542 0.0000 175.6393 26 A 4.0213 7.9973 123.1996 54.8446 18.4190 179.7785 27 V 3.7203 8.0800 116.8769 66.1816 31.6036 178.4745 28 G 3.6625 8.4450 105.1547 47.8328 0.0000 175.3868 29 A 4.0098 8.3441 123.8171 54.9626 18.4301 179.8416 30 V 3.8174 8.1478 116.5178 65.9372 31.5940 178.5785 31 G 3.8034 8.2703 105.5475 47.8090 0.0000 175.4805 32 L 4.0001 8.4359 123.7988 57.6427 42.2598 179.0076 33 V 3.5934 8.4294 118.5492 65.9346 31.6227 177.8461 34 W 4.2048 8.6878 128.0503 60.5151 30.3637 177.8690 35 A 3.2982 7.9285 119.8301 54.3054 17.8658 178.8221 36 T 4.0684 7.6890 106.1640 61.0130 70.0909 174.3070 37 D 4.2378 7.5049 119.4851 55.2780 38.9307 175.7927 38 S 4.2307 7.8192 113.6991 58.3573 62.0254 172.7596 39 R 3.9452 8.5073 126.7724 59.1522 28.7985 177.9893 40 L 3.8705 7.9344 119.4258 58.1747 42.3740 178.5589 41 I 3.9120 7.5771 118.6093 63.9194 37.6671 177.8970 42 L 4.3033 8.0298 118.9652 56.9389 41.2539 178.8428 43 D 4.6945 8.1720 118.4192 56.5284 40.7980 177.8866 44 W 4.5323 8.2301 118.6445 57.6067 29.6107 177.1100 45 V 4.0669 7.2738 112.4542 59.9677 31.8304 174.7722 46 P 4.2716 0.0000 0.0000 66.0396 31.3834 177.2742 47 Y 3.9461 7.9754 117.1706 60.1078 39.2881 176.5339 48 I 4.0771 7.8828 119.6284 63.1808 37.6440 177.2941 49 N 4.4033 7.8585 118.0055 56.2095 38.4979 175.9842 50 G 3.2243 7.0956 106.1851 45.2002 0.0000 173.9798 51 K 4.2834 6.8771 129.1372 55.6268 32.7908 178.6482 52 F 4.5236 7.2149 116.9894 58.1233 38.9180 176.3545 53 K 4.0925 8.9380 124.4490 56.9847 31.8355 176.9239 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 L 8.04 4.44 0.00 1.79 1.72 0.94 0.44 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 3 T 7.51 3.94 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 1.20 0.00 0.00 4 R 8.61 3.74 0.00 1.59 1.86 0.00 2.78 0.00 0.00 2.98 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.50 0.00 5 F 7.33 3.19 0.00 2.93 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 6 L 6.95 4.44 0.00 1.79 1.65 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.20 4.17 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 0.00 8 P 0.00 4.33 0.00 2.18 2.15 0.00 3.67 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.19 0.00 9 R 7.93 3.81 0.00 1.71 1.41 0.00 3.04 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 10 Y 7.87 4.34 0.00 3.31 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 11 R 8.16 4.03 0.00 2.14 2.03 0.00 3.17 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 12 Q 8.15 4.01 0.00 2.36 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 13 L 8.57 4.07 0.00 1.93 1.85 0.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.56 4.16 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.92 3.92 0.00 2.14 1.98 0.00 3.28 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 16 N 8.25 4.37 0.00 2.81 2.47 0.00 0.00 6.98 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 17 W 7.78 4.75 0.00 3.49 3.25 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.65 3.66 2.21 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 1.06 0.00 0.00 1.04 0.00 0.00 19 P 0.00 4.26 0.00 2.14 2.04 0.00 3.64 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.16 0.00 20 T 7.92 3.73 4.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 21 A 8.56 4.33 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.29 3.97 0.00 2.28 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 23 L 8.05 4.00 0.00 1.57 1.41 0.81 0.72 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 24 W 8.37 4.76 0.00 3.37 3.10 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 25 G 7.95 3.65 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 0.00 0.00 0.00 26 A 8.00 4.02 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.08 3.72 2.60 0.00 0.00 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 0.00 0.00 1.02 0.00 0.00 28 G 8.45 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.34 4.01 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.15 3.82 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 1.13 0.00 0.00 1.00 0.00 0.00 31 G 8.27 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.44 4.00 0.00 1.92 1.88 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.43 3.59 2.34 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 1.01 0.00 0.00 1.01 0.00 0.00 34 W 8.69 4.20 0.00 3.43 3.40 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 3.30 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.69 4.07 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 1.17 0.00 0.00 37 D 7.50 4.24 0.00 2.85 2.74 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 0.00 0.00 0.00 0.00 38 S 7.82 4.23 0.00 3.93 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.51 3.95 0.00 2.07 2.21 0.00 3.20 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 40 L 7.93 3.87 0.00 1.60 1.71 0.86 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.58 3.91 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.79 0.91 0.00 0.00 42 L 8.03 4.30 0.00 1.83 1.79 1.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 43 D 8.17 4.69 0.00 2.97 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 44 W 8.23 4.53 0.00 3.47 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 45 V 7.27 4.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.08 0.00 0.00 46 P 0.00 4.27 0.00 2.13 2.16 0.00 3.75 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 2.08 2.11 0.00 47 Y 7.98 3.95 0.00 3.00 3.02 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 0.00 48 I 7.88 4.08 1.97 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.98 1.00 0.00 0.00 49 N 7.86 4.40 0.00 2.94 3.04 0.00 0.00 6.93 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 50 G 7.10 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 0.00 0.00 0.00 51 K 6.88 4.28 0.00 1.77 1.71 0.00 1.58 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.45 7.81 52 F 7.21 4.52 0.00 3.09 2.92 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 0.00 0.00 0.00 53 K 8.94 4.09 0.00 1.78 1.81 0.00 1.81 0.00 0.00 1.79 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.56 7.81