NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4817 0.0000 0.0000 62.3628 33.6522 174.9629 2 I 4.8473 8.2667 122.6066 59.1627 40.1056 172.9973 3 A 4.7773 9.4316 130.1274 49.9948 22.1528 174.5173 4 Q 4.9199 8.6653 122.5820 54.3796 31.5540 174.3757 5 I 4.4579 8.7885 128.0291 59.8702 39.8653 174.3488 6 H 5.2794 8.8080 124.4445 54.3375 29.7792 174.3001 7 I 4.6266 8.2349 116.5695 58.5683 41.2607 174.9036 8 L 4.6847 8.3159 123.0017 54.2785 42.2499 176.9747 9 E 4.4988 8.0971 120.7970 56.6274 29.9458 176.1257 10 G 3.6360 8.7780 108.6046 45.6178 0.0000 174.5885 11 R 4.4408 7.6515 119.3124 55.2782 31.6224 176.7623 12 S 4.5338 8.3294 115.6324 57.7471 65.5789 175.1816 13 D 4.3856 8.5116 121.6620 57.4085 40.4838 178.9761 14 E 3.9315 8.0819 118.6101 59.5804 29.5248 179.0873 15 Q 4.0152 7.7666 118.0807 59.1533 28.8076 179.3675 16 K 3.9769 7.9954 118.8956 59.1982 31.9037 179.1160 17 E 3.9835 8.1607 119.9405 59.3676 29.4706 179.0441 18 T 3.9007 8.0242 116.0151 66.2452 68.5456 176.4520 19 L 3.9221 8.1055 122.4872 58.4239 42.1270 179.1278 20 I 3.6934 7.7467 119.5876 64.2671 36.9962 178.5114 21 R 3.8917 7.8333 119.2756 59.3551 30.0312 178.2437 22 E 3.9560 8.4850 118.8319 59.5608 29.5012 179.6616 23 V 3.6136 7.9357 118.1640 66.0864 31.5808 178.2541 24 S 4.1611 7.9555 114.5247 61.4728 62.5224 176.6609 25 E 3.9099 8.3302 121.1521 59.2841 29.2443 178.9363 26 A 3.9616 7.9522 120.8172 55.3308 18.4930 179.8252 27 I 3.6242 7.8482 118.0181 64.6072 37.3388 178.5552 28 S 4.1630 7.9791 113.9732 61.3410 62.0388 176.1262 29 R 3.8422 8.7000 121.6887 59.7066 29.7094 178.5516 30 S 4.1029 8.0123 113.5687 61.2176 62.9094 175.5036 31 L 4.4139 7.7457 116.3857 53.6286 42.0021 175.5952 32 D 4.3341 7.4962 117.2150 55.2606 40.0742 172.8708 33 A 4.7781 7.4822 118.5132 48.9150 21.5650 175.7819 34 P 4.3044 0.0000 0.0000 62.5365 32.1018 176.9369 35 L 3.9287 8.9303 125.0764 58.4996 41.9106 178.8243 36 T 4.0635 7.8780 106.4037 63.4486 68.7269 174.6810 37 S 4.4384 8.1030 116.4327 58.8967 63.8620 174.4583 38 V 4.0843 7.5388 122.4475 62.8311 32.2224 175.3979 39 R 4.6972 8.8758 125.9788 54.3385 33.4940 174.4601 40 V 4.8866 8.5134 123.0873 61.0490 34.4911 174.4477 41 I 4.5495 8.8893 128.1451 59.6015 40.1314 174.3148 42 I 4.7617 8.3915 127.6908 60.0194 39.2012 175.3353 43 T 4.4981 8.7497 122.9930 61.7402 71.7103 173.1183 44 E 4.7513 8.7584 126.4812 56.1298 31.4098 175.5770 45 M 4.9282 8.8313 122.7642 53.1823 35.3555 175.6264 46 A 4.5104 8.5604 125.4378 51.7220 19.3253 178.6771 47 K 4.1520 8.6143 121.0843 59.2047 32.2681 178.3217 48 G 4.0695 7.9948 105.3477 45.6294 0.0000 173.4689 49 H 4.9576 8.6853 114.7126 54.9215 29.7862 173.4730 50 F 5.0566 8.2296 122.5540 56.2949 41.4430 173.6470 51 G 4.1811 8.3951 116.4499 43.5494 0.0000 172.2872 52 I 4.1128 8.1214 122.6928 59.9986 39.7428 176.0676 53 G 3.9353 9.5455 113.7386 46.5156 0.0000 174.0342 54 G 3.9303 8.7219 105.7254 44.9119 0.0000 173.7874 55 E 4.6974 7.6248 117.9206 53.6217 33.3232 175.2915 56 L 4.3301 8.4345 121.1830 55.1338 42.5819 178.6022 57 A 4.0155 8.9377 126.0077 55.0128 18.7432 180.1244 58 S 4.1449 8.1987 109.9801 61.4521 62.9658 175.3790 59 K 4.3687 7.7307 117.7008 56.1615 32.1156 177.2144 60 V 4.0251 7.4966 124.4065 61.8443 31.4679 175.1310 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 P 0.00 4.48 0.00 2.09 2.03 0.00 3.60 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 2.00 2.12 0.00 2 I 8.27 4.85 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.72 0.90 0.00 0.00 3 A 9.43 4.78 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.67 4.92 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.64 0.00 0.00 0.00 0.00 0.00 2.10 2.23 0.00 5 I 8.79 4.46 1.83 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 1.21 0.64 0.88 0.00 0.00 6 H 8.81 5.28 0.00 2.91 3.09 0.00 5.84 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.23 4.63 1.82 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 1.18 1.25 0.86 0.00 0.00 8 L 8.32 4.68 0.00 1.53 1.63 1.01 1.02 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 9 E 8.10 4.50 0.00 1.96 2.06 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 2.31 2.11 0.00 10 G 8.78 3.64 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 0.00 0.00 0.00 11 R 7.65 4.44 0.00 1.78 1.85 0.00 3.25 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.85 0.00 12 S 8.33 4.53 0.00 4.02 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 13 D 8.51 4.39 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.08 3.93 0.00 2.05 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 2.40 2.46 0.00 15 Q 7.77 4.02 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 16 K 8.00 3.98 0.00 1.83 1.84 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.68 7.81 17 E 8.16 3.98 0.00 2.26 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 2.30 2.34 0.00 18 T 8.02 3.90 4.40 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 1.21 0.00 0.00 19 L 8.11 3.92 0.00 1.82 1.84 0.91 1.28 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 20 I 7.75 3.69 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.98 0.90 0.00 0.00 21 R 7.83 3.89 0.00 1.94 1.90 0.00 3.10 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 22 E 8.49 3.96 0.00 2.02 1.98 0.00 0.00 0.00 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 2.46 0.00 23 V 7.94 3.61 2.24 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 1.02 0.00 0.00 0.92 0.00 0.00 24 S 7.96 4.16 0.00 4.12 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 25 E 8.33 3.91 0.00 2.10 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 2.47 2.48 0.00 26 A 7.95 3.96 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 27 I 7.85 3.62 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.20 0.91 0.00 0.00 28 S 7.98 4.16 0.00 3.90 4.09 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 0.00 0.00 0.00 29 R 8.70 3.84 0.00 2.12 1.90 0.00 3.16 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 30 S 8.01 4.10 0.00 3.93 3.92 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 31 L 7.75 4.41 0.00 1.66 1.69 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.50 4.33 0.00 2.73 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 33 A 7.48 4.78 1.23 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 0.00 0.00 34 P 0.00 4.30 0.00 2.23 2.21 0.00 3.73 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 1.95 0.00 35 L 8.93 3.93 0.00 1.73 1.73 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.88 4.06 4.24 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 1.21 0.00 0.00 37 S 8.10 4.44 0.00 3.95 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 38 V 7.54 4.08 2.16 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 0.75 0.00 0.00 0.98 0.00 0.00 39 R 8.88 4.70 0.00 1.93 1.76 0.00 3.16 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 40 V 8.51 4.89 2.07 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 0.80 0.00 0.00 0.92 0.00 0.00 41 I 8.89 4.55 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.61 0.87 0.00 0.00 42 I 8.39 4.76 1.84 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 1.31 0.51 0.87 0.00 0.00 43 T 8.75 4.50 3.95 0.00 0.00 0.00 0.00 0.00 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 44 E 8.76 4.75 0.00 1.91 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 0.00 2.36 2.31 0.00 45 M 8.83 4.93 0.00 1.94 1.86 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 46 A 8.56 4.51 1.10 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 47 K 8.61 4.15 0.00 1.82 1.95 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.46 7.81 48 G 7.99 4.07 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 0.00 0.00 0.00 49 H 8.69 4.96 0.00 3.30 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 8.23 5.06 0.00 2.96 2.91 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 51 G 8.40 4.18 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 0.00 52 I 8.12 4.11 1.68 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.37 0.82 0.00 0.00 53 G 9.55 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.72 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 55 E 7.62 4.70 0.00 1.93 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 56 L 8.43 4.33 0.00 1.69 1.61 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.94 4.02 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.20 4.14 0.00 4.00 4.18 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 59 K 7.73 4.37 0.00 1.70 1.87 0.00 1.63 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.36 7.81 60 V 7.50 4.03 2.05 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 0.65 0.00 0.00 0.91 0.00 0.00