NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3403 8.2644 123.5832 52.1078 18.6368 175.6082 3 R 4.3203 8.1564 118.5467 54.6050 31.7436 174.8490 4 K 4.1874 8.1390 120.1497 58.6069 33.4218 177.8627 5 A 3.8955 7.3088 120.0219 54.7574 18.9660 179.2036 6 L 4.1443 7.8862 117.0109 57.3361 42.1697 178.9929 7 I 3.6922 7.2351 111.6028 63.8902 37.2536 177.2552 8 E 4.2525 7.9745 119.4280 58.5775 29.8869 178.0393 9 K 3.7667 7.3505 116.7861 58.8593 32.1743 178.0993 10 A 3.7777 7.8255 120.4173 54.8891 18.3067 179.4541 11 K 4.2303 8.3454 116.6762 58.3303 32.5692 177.7162 12 R 3.9459 7.7361 119.9792 57.3767 30.0991 176.8980 13 T 4.6430 8.1155 123.2564 62.1929 69.3630 174.3520 14 P 4.3822 0.0000 0.0000 64.4601 31.3746 175.9041 15 K 4.5978 7.4481 118.5259 54.4272 33.7581 175.5248 16 F 4.3485 9.3258 118.7187 57.5600 39.3555 176.9168 17 K 4.0795 8.5881 119.9318 58.4000 33.1952 178.6381 18 V 3.7331 7.6539 120.5950 66.4814 31.5313 177.9517 19 R 4.0986 7.9996 113.8807 57.1161 29.7588 176.5448 20 A 4.0836 7.8090 123.1595 52.1435 18.5519 177.0370 21 Y 4.8843 7.8589 120.4417 55.3083 40.8427 174.6791 22 T 3.9109 8.2857 112.9021 61.5727 69.1822 173.7411 23 R 5.6111 8.1897 121.2686 55.5331 30.8532 171.9492 24 C 3.9473 7.6410 122.1309 59.3165 32.4985 174.7342 25 V 3.9261 8.3281 125.2037 64.8836 31.9792 177.2386 26 R 4.0729 8.2656 119.0765 58.7600 29.9707 175.6973 27 C 4.8968 7.7645 110.4734 55.9626 32.1685 175.5186 28 G 3.9233 8.5140 114.6532 45.3005 0.0000 173.2703 29 R 4.2283 7.7686 118.8168 55.7662 31.3329 176.0008 30 A 4.6366 8.3927 121.4780 51.9088 21.1023 176.6976 31 R 4.4657 7.9395 113.4421 55.2179 32.4855 175.8427 32 S 3.5175 8.2853 112.3704 59.3534 61.7208 171.3960 33 V 5.1299 7.1300 117.4738 62.0621 33.7346 173.8760 34 Y 4.6744 8.3126 118.7835 56.1492 40.6636 177.2007 35 R 4.3007 8.9443 120.4029 57.2162 29.6008 176.6164 36 F 4.6678 8.1309 116.6954 57.5770 40.6115 174.7718 37 F 4.8735 9.5203 115.9404 57.2575 45.6183 175.1304 38 G 4.3917 8.5747 108.4580 46.2582 0.0000 172.6675 39 L 5.0065 7.5952 118.4333 52.5588 44.9911 175.1161 40 C 5.0270 8.1623 114.2017 57.5182 32.0157 173.2343 41 R 4.1758 8.2595 114.9409 59.6582 29.3569 178.3200 42 I 3.7061 7.5629 120.4132 63.5336 37.3817 177.8008 43 C 3.8895 8.1408 117.1755 63.2309 27.9769 175.8742 44 L 3.6720 7.3862 120.4387 58.2172 41.2894 179.2785 45 R 3.7066 8.4767 118.9659 59.4313 30.0462 178.1380 46 E 4.0073 8.1757 117.8674 59.5243 29.3697 179.2505 47 L 3.9128 8.0481 118.6360 57.7546 41.5619 179.0091 48 A 3.9264 7.7415 119.6717 55.9038 18.2453 179.2507 49 H 4.3830 8.2117 113.7809 58.9289 29.2130 177.6091 50 K 4.2842 8.4234 118.2014 56.1548 31.2091 178.9022 51 G 4.0253 8.3910 107.3666 46.2992 0.0000 176.5323 52 Q 4.2625 7.8444 117.1672 55.8097 28.2997 176.8537 53 L 4.6598 9.4181 119.1982 52.1472 43.7549 174.1386 54 P 4.1500 0.0000 0.0000 64.2787 31.9197 176.1858 55 G 4.2571 8.9870 115.5344 45.9086 0.0000 173.2831 56 V 3.4814 6.8671 119.7804 62.9992 31.2018 174.9865 57 R 4.6540 8.1579 126.3484 54.0032 32.9712 176.4163 58 K 4.2334 8.3368 122.5697 55.0839 29.7886 175.6646 59 A 3.9391 7.7674 121.5897 52.7251 18.9537 177.6830 60 S 4.4582 8.6347 117.7614 56.8373 64.5522 173.6590 61 W 4.8374 8.3386 124.2837 56.8010 27.9476 174.7301 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 A 8.26 4.34 1.29 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 0.00 0.00 0.00 3 R 8.16 4.32 0.00 1.82 1.90 0.00 3.24 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 4 K 8.14 4.19 0.00 1.91 1.70 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.56 7.81 5 A 7.31 3.90 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.14 0.00 1.74 1.78 0.97 0.87 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 7 I 7.24 3.69 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 1.78 0.50 0.97 0.00 0.00 8 E 7.97 4.25 0.00 2.02 2.01 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 2.35 2.35 0.00 9 K 7.35 3.77 0.00 2.03 1.87 0.00 1.84 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.46 7.81 10 A 7.83 3.78 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 11 K 8.35 4.23 0.00 1.73 1.84 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.43 1.64 7.81 12 R 7.74 3.95 0.00 1.77 1.91 0.00 3.14 0.00 0.00 3.36 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 13 T 8.12 4.64 4.23 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 1.25 0.00 0.00 14 P 0.00 4.38 0.00 2.20 2.19 0.00 3.86 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 15 K 7.45 4.60 0.00 1.77 1.68 0.00 1.33 0.00 0.00 1.91 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.38 7.81 16 F 9.33 4.35 0.00 2.98 2.97 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 17 K 8.59 4.08 0.00 1.90 1.97 0.00 1.60 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 18 V 7.65 3.73 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 1.00 0.00 0.00 1.11 0.00 0.00 19 R 8.00 4.10 0.00 1.85 2.05 0.00 3.10 0.00 0.00 3.18 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 20 A 7.81 4.08 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.86 4.88 0.00 2.99 2.90 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 22 T 8.29 3.91 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 1.26 0.00 0.00 23 R 8.19 5.61 0.00 1.83 1.87 0.00 3.21 0.00 0.00 4.01 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 24 C 7.64 3.95 0.00 3.17 3.08 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 0.00 0.00 0.00 0.00 25 V 8.33 3.93 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 0.81 0.00 0.00 0.96 0.00 0.00 26 R 8.27 4.07 0.00 1.83 1.97 0.00 3.39 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 27 C 7.76 4.90 0.00 3.09 2.87 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 28 G 8.51 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 0.00 0.00 0.00 29 R 7.77 4.23 0.00 1.94 1.86 0.00 3.19 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 30 A 8.39 4.64 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.94 4.47 0.00 1.82 1.86 0.00 3.35 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 1.55 1.60 0.00 32 S 8.29 3.52 0.00 4.18 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 33 V 7.13 5.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.10 0.00 0.00 34 Y 8.31 4.67 0.00 3.36 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.94 4.30 0.00 1.90 2.03 0.00 3.34 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 36 F 8.13 4.67 0.00 2.98 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.52 4.87 0.00 3.20 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.57 4.39 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 0.00 39 L 7.60 5.01 0.00 1.87 1.58 0.76 0.83 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 40 C 8.16 5.03 0.00 3.13 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 41 R 8.26 4.18 0.00 2.12 2.33 0.00 3.01 0.00 0.00 3.40 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 42 I 7.56 3.71 1.87 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 1.64 1.11 0.90 0.00 0.00 43 C 8.14 3.89 0.00 2.94 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 44 L 7.39 3.67 0.00 1.57 1.71 0.13 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.48 3.71 0.00 1.80 1.99 0.00 3.21 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.50 0.00 46 E 8.18 4.01 0.00 2.20 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 2.41 2.42 0.00 47 L 8.05 3.91 0.00 1.76 1.66 0.88 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.74 3.93 1.22 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 49 H 8.21 4.38 0.00 3.31 3.33 0.00 5.66 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.42 4.28 0.00 1.94 1.84 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.64 7.81 51 G 8.39 4.03 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 0.00 0.00 0.00 52 Q 7.84 4.26 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 53 L 9.42 4.66 0.00 1.67 1.73 0.59 1.24 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 54 P 0.00 4.15 0.00 2.09 2.06 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 55 G 8.99 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 0.00 0.00 0.00 0.00 56 V 6.87 3.48 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.20 0.00 0.00 57 R 8.16 4.65 0.00 1.94 1.79 0.00 3.31 0.00 0.00 3.18 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 58 K 8.34 4.23 0.00 1.77 1.75 0.00 1.89 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.40 7.81 59 A 7.77 3.94 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 60 S 8.63 4.46 0.00 3.80 3.77 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 61 W 8.34 4.84 0.00 3.29 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