NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9535 8.3549 109.7366 45.4944 0.0000 173.5774 2 S 4.2925 8.4535 120.8325 55.7670 66.7007 172.2015 3 S 4.5444 8.6541 120.5521 57.2355 65.4274 174.0332 4 G 4.1033 8.9622 113.6182 46.0267 0.0000 172.1708 5 S 4.6809 8.2555 119.1683 55.9612 65.4872 173.4859 6 S 4.7881 8.4809 121.9655 56.9256 66.4547 174.2737 7 G 4.4936 8.3154 110.4611 45.2298 0.0000 173.8486 8 R 4.2695 7.7563 119.2982 56.2157 31.8636 175.0800 9 T 5.7908 8.2282 118.9953 61.0283 73.2672 173.2115 10 V 4.9604 8.1726 116.1237 59.6822 36.6057 173.9198 11 K 5.0206 9.0153 125.3710 54.3947 35.0090 174.9651 12 A 4.7830 8.6440 129.2930 52.1363 19.0046 177.9390 13 L 4.0846 8.4532 122.4888 55.6558 42.1795 176.6338 14 Y 4.8944 7.4556 114.9177 56.3278 41.8174 173.8424 15 D 4.7519 8.7590 122.5833 53.9867 39.9110 174.6926 16 Y 4.6103 8.5942 121.6185 55.9913 43.1701 173.4467 17 K 4.6604 6.5858 122.3474 54.4006 35.4365 175.2310 18 A 4.2675 8.8409 129.5331 51.6365 18.8645 177.0697 19 K 4.4697 8.5236 124.8472 55.6867 32.1591 175.1510 20 R 4.5861 7.4952 115.1756 54.4878 32.9844 175.3110 21 S 4.2396 8.6703 115.2722 60.4169 62.4317 173.5608 22 D 4.8654 6.8488 117.1000 51.8018 40.3795 174.4946 23 E 4.9896 7.9409 121.2666 55.1500 32.5663 174.0549 24 L 5.0417 8.4822 124.7638 53.7061 44.5402 175.4758 25 T 4.8562 8.4074 121.1674 62.0663 70.7030 173.6094 26 F 4.7425 7.5872 118.5048 56.4230 41.6060 172.3515 27 C 5.1280 8.3742 114.0717 55.7436 33.2626 172.6729 28 R 4.1026 8.6673 119.8042 59.2446 29.2376 175.2703 29 G 4.0359 9.6505 116.2995 45.8009 0.0000 173.3974 30 A 4.3359 8.2652 121.7753 52.5046 19.6792 176.4873 31 L 5.1467 8.3849 116.9498 53.2395 46.0960 176.3780 32 I 4.5971 8.5540 122.9412 58.8827 40.3654 174.9773 33 H 5.0370 8.7619 123.5880 54.3680 31.3740 174.1389 34 N 4.5603 8.0898 113.2679 53.7872 35.8454 175.1172 35 V 4.3828 7.5778 117.1144 62.7082 32.1900 177.1489 36 S 4.4260 8.8850 125.8990 56.1730 62.4304 170.4719 37 K 2.4800 7.8741 121.4988 55.7451 31.8465 176.1524 38 E 4.3014 8.3976 123.9050 55.0742 30.3604 175.9963 39 P 4.4649 0.0000 0.0000 65.3193 32.6115 177.6246 40 G 3.4861 8.4126 107.6200 46.7318 0.0000 173.7474 41 G 3.9147 8.1183 107.9177 45.4603 0.0000 172.7003 42 W 4.1497 7.8768 121.3026 56.4005 30.3231 175.3189 43 W 5.1065 7.8995 121.7389 54.9968 32.4459 174.3680 44 K 4.9035 8.3217 122.7458 54.9853 33.9902 175.2743 45 G 4.9170 8.6362 112.0154 45.2765 0.0000 170.7698 46 D 5.4158 8.5670 118.6764 51.9093 42.7989 175.4503 47 Y 4.2658 9.3144 121.9602 56.8509 41.4056 174.3963 48 G 3.6761 8.6856 119.9695 46.2160 0.0000 174.7286 49 T 3.9100 8.5671 112.0623 63.9784 68.7655 174.7248 50 R 4.5050 8.1832 121.8191 55.3981 31.2870 175.4647 51 I 4.7519 7.9444 120.3725 61.4020 41.5623 175.4060 52 Q 3.2950 8.4277 122.3843 57.1965 24.8330 174.1115 53 Q 4.6732 8.1449 117.1449 53.9032 31.8793 176.9496 54 Y 5.4201 8.6046 120.9814 58.5082 38.8459 175.3073 55 F 5.4072 8.5537 115.4191 55.0531 41.8040 171.6078 56 P 3.9611 0.0000 0.0000 62.6160 31.3857 177.5565 57 S 3.7405 7.7029 119.7791 60.5239 62.7978 175.7266 58 N 4.4637 7.7855 116.0795 55.0903 38.7758 174.9290 59 Y 4.8920 8.0144 115.5063 57.6909 39.2619 175.4527 60 V 5.1817 7.7872 112.0327 59.9224 36.3306 174.1072 61 E 4.9501 9.4043 120.8063 54.1577 32.9716 174.7047 62 D 5.0886 9.0484 122.8060 53.8195 39.4579 175.9334 63 I 4.3641 8.4159 115.2722 60.6336 39.5825 175.8173 64 S 4.2087 8.0071 116.4699 56.7636 62.7502 172.9125 65 G 4.4042 8.4429 114.3871 42.3492 0.0000 170.5462 66 P 4.3631 0.0000 0.0000 62.8465 31.7575 176.2970 67 S 4.4618 8.7714 119.1325 59.7584 64.0097 174.2849 68 S 4.3967 8.1510 110.9462 59.6095 63.9242 173.7104 69 G 4.3799 8.1305 111.6801 46.0201 0.0000 172.5892 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 G 8.35 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 0.00 0.00 0.00 0.00 2 S 8.45 4.29 0.00 3.91 3.74 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 3 S 8.65 4.54 0.00 3.95 3.84 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 4 G 8.96 4.10 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 0.00 5 S 8.26 4.68 0.00 3.78 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.48 4.79 0.00 3.82 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 8.32 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.76 4.27 0.00 1.89 1.90 0.00 3.14 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 9 T 8.23 5.79 4.28 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 1.29 0.00 0.00 10 V 8.17 4.96 2.22 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 1.00 0.00 0.00 0.89 0.00 0.00 11 K 9.02 5.02 0.00 1.76 1.60 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.60 7.81 12 A 8.64 4.78 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.45 4.08 0.00 0.40 0.85 0.88 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.46 4.89 0.00 2.93 2.80 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 15 D 8.76 4.75 0.00 2.69 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 16 Y 8.59 4.61 0.00 2.63 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 17 K 6.59 4.66 0.00 1.55 1.30 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.20 1.39 7.81 18 A 8.84 4.27 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 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.52 4.47 0.00 1.60 1.73 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.35 7.81 20 R 7.50 4.59 0.00 1.83 1.68 0.00 3.20 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 1.55 1.58 0.00 21 S 8.67 4.24 0.00 3.87 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 22 D 6.85 4.87 0.00 2.60 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 23 E 7.94 4.99 0.00 1.92 1.89 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 2.51 2.58 0.00 24 L 8.48 5.04 0.00 2.02 1.84 1.15 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.41 4.86 4.42 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 1.25 0.00 0.00 26 F 7.59 4.74 0.00 2.40 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 0.00 0.00 0.00 27 C 8.37 5.13 0.00 3.06 3.12 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 28 R 8.67 4.10 0.00 1.87 1.99 0.00 3.35 0.00 0.00 3.22 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 29 G 9.65 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 4.34 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.38 5.15 0.00 1.42 1.47 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 32 I 8.55 4.60 1.42 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.61 0.65 0.00 0.00 33 H 8.76 5.04 0.00 3.24 3.18 0.00 5.76 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.09 4.56 0.00 3.14 2.89 0.00 0.00 6.55 7.23 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 35 V 7.58 4.38 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 0.83 0.00 0.00 1.09 0.00 0.00 36 S 8.89 4.43 0.00 3.84 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 37 K 7.87 2.48 0.00 1.22 1.42 0.00 1.49 0.00 0.00 1.47 0.00 0.00 2.73 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 0.69 7.81 38 E 8.40 4.30 0.00 2.41 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.62 0.00 39 P 0.00 4.46 0.00 2.21 2.21 0.00 3.84 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.00 0.00 40 G 8.41 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.12 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 0.00 0.00 0.00 42 W 7.88 4.15 0.00 2.98 3.18 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 43 W 7.90 5.11 0.00 2.34 2.88 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.32 4.90 0.00 2.12 1.70 0.00 1.31 0.00 0.00 1.14 0.00 0.00 2.66 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.28 1.36 7.81 45 G 8.64 4.92 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 46 D 8.57 5.42 0.00 2.82 2.77 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 47 Y 9.31 4.27 0.00 2.91 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 48 G 8.69 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.57 3.91 4.25 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 1.20 0.00 0.00 50 R 8.18 4.51 0.00 2.15 1.99 0.00 3.34 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.94 0.00 51 I 7.94 4.75 1.88 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 1.43 0.79 0.92 0.00 0.00 52 Q 8.43 3.29 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 53 Q 8.14 4.67 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.38 6.88 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 54 Y 8.60 5.42 0.00 2.86 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.55 5.41 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 56 P 0.00 3.96 0.00 2.03 1.74 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.57 0.00 57 S 7.70 3.74 0.00 2.91 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.79 4.46 0.00 2.74 2.84 0.00 0.00 6.73 7.34 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 59 Y 8.01 4.89 0.00 3.19 3.28 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 60 V 7.79 5.18 2.09 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 0.52 0.00 0.00 1.25 0.00 0.00 61 E 9.40 4.95 0.00 1.95 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 2.15 2.23 0.00 62 D 9.05 5.09 0.00 2.73 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 63 I 8.42 4.36 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 1.29 0.75 0.98 0.00 0.00 64 S 8.01 4.21 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 65 G 8.44 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 0.00 0.00 0.00 0.00 66 P 0.00 4.36 0.00 2.19 2.08 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 1.98 1.98 0.00 67 S 8.77 4.46 0.00 3.87 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 0.00 68 S 8.15 4.40 0.00 3.79 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.13 4.38 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00