NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.3103 8.3645 123.5823 52.0859 18.6808 176.3047 1 N 4.7033 8.2213 116.6671 51.2930 40.4788 172.5731 2 Q 4.2752 8.4318 120.2129 56.5803 30.6300 175.0272 3 A 4.6900 8.6612 128.2834 51.4507 20.9347 176.0061 4 S 5.1523 9.0192 116.3370 56.2765 67.0678 173.5685 5 V 4.3038 8.5821 122.1111 62.9552 32.4072 174.9920 6 V 4.8626 8.7191 127.1851 60.5741 35.0354 174.3522 7 A 4.4799 8.9525 130.2097 52.4918 18.7970 177.3923 8 N 4.7033 9.3925 121.9278 54.5910 39.5596 174.1692 9 Q 4.6052 7.5312 113.8858 55.4710 31.5891 173.5564 10 L 4.1952 8.5441 122.3714 55.5099 42.9052 175.9709 11 I 4.4021 8.7980 127.8228 58.8437 39.2010 173.6053 12 P 4.6319 0.0000 0.0000 61.9853 32.5883 176.1900 13 I 3.8843 8.2825 122.3398 62.9580 38.2531 176.0122 14 S 3.9724 8.4243 121.0920 59.3366 61.1958 171.3762 15 T 4.1852 7.5484 117.6797 63.8583 69.5413 173.2625 16 H 5.1575 8.6471 122.1720 54.6730 29.8797 175.3215 17 L 4.3097 8.8861 124.5884 55.1063 42.8744 176.4006 18 T 4.9222 8.2963 111.8316 59.4569 72.3855 174.7546 19 L 4.0145 8.6741 121.9470 57.9626 41.7555 180.1407 20 V 3.7966 7.6558 116.2466 64.0089 31.8511 176.7899 21 M 4.2582 8.0416 119.8230 56.6081 32.2686 175.2239 22 M 5.2272 7.7983 118.5900 53.2851 34.7462 175.2661 23 R 4.7372 9.0445 119.5771 54.3370 33.5435 174.0426 24 S 5.2189 8.3688 113.1299 56.7411 64.8437 172.7629 25 E 4.7344 8.8532 124.2748 55.2142 34.5622 174.5808 26 V 4.3633 8.3600 123.4450 62.1880 31.8496 175.4729 27 V 4.6066 8.2995 120.1562 59.7424 35.4980 175.1191 28 T 4.5970 8.1431 117.4452 60.9988 71.0790 172.7890 29 P 4.5170 0.0000 0.0000 62.0401 32.4082 175.7853 30 V 3.9381 8.1468 118.9147 62.5476 32.7803 175.9293 31 G 4.3332 8.2924 115.1745 45.3990 0.0000 173.0723 32 I 3.8809 8.3921 123.8741 61.0969 38.3591 174.3107 33 P 4.7309 0.0000 0.0000 62.5600 31.9320 177.4772 34 A 3.9999 9.0045 126.3431 55.0779 18.0211 179.7767 35 E 4.0587 8.1792 114.7843 59.0851 30.0388 177.9577 36 D 4.6746 8.2632 118.7406 54.6549 40.9794 177.8396 37 I 3.6832 7.7416 122.3125 64.1348 36.9178 175.8825 38 P 4.2623 0.0000 0.0000 66.1420 30.9700 178.7563 39 R 4.1336 7.7807 114.5475 58.8978 30.2842 178.7666 40 L 4.1943 7.8313 118.8336 55.9928 41.6314 177.4547 41 V 4.0060 6.7278 117.9156 64.2683 31.7865 176.3788 42 S 4.3205 9.0128 122.6279 58.8249 62.0574 169.7011 43 M 4.4368 7.8659 120.1232 55.1833 33.3905 174.8715 44 Q 4.9634 8.4476 121.5142 54.5880 31.7707 174.8683 45 V 4.5425 8.4032 119.3661 60.7921 33.2141 176.1716 46 N 5.0777 9.0638 121.3731 52.7802 37.9589 174.2022 47 R 4.7276 7.5196 114.3918 54.9372 32.8535 174.1945 48 A 4.2733 8.5087 121.8031 51.9387 19.3858 177.3830 49 V 4.1809 8.7977 123.3243 60.2434 33.3882 173.3983 50 P 4.6511 0.0000 0.0000 61.8897 32.8146 175.8837 51 L 4.0184 8.3867 123.2234 57.1268 42.1378 177.6021 52 G 3.9678 9.1122 114.6360 45.4039 0.0000 173.3506 53 T 4.2447 7.6017 117.2622 63.1973 69.7998 174.3821 54 T 4.3882 8.3963 122.9203 63.4702 69.4412 173.7168 55 L 4.2245 8.9387 129.4015 54.8518 43.3551 175.7247 56 M 4.8336 8.4048 125.3072 52.6998 34.5283 174.9190 57 P 3.9928 0.0000 0.0000 65.8906 31.5691 178.0081 58 D 4.6005 7.9803 114.4087 54.8231 39.9417 176.5447 59 M 4.2149 8.1687 119.7000 55.7370 32.3427 175.4976 60 V 4.6509 7.2280 119.9843 60.4154 33.1158 174.8255 61 K 4.2925 8.8984 128.4358 57.7705 32.1335 177.6396 62 G 3.9616 9.0080 112.5705 45.1985 0.0000 172.5631 63 Y 4.2140 7.4406 120.5804 57.1323 39.2618 174.7722 64 A 4.2076 7.3820 128.7346 50.9452 22.3161 175.6207 65 A 3.8968 7.8783 124.7609 52.8546 18.9933 175.9682 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 0 A 8.36 4.31 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 1 N 8.22 4.70 0.00 2.80 2.69 0.00 0.00 6.92 6.57 0.00 0.00 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 Q 8.43 4.28 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 3 A 8.66 4.69 1.24 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 0.00 0.00 0.00 4 S 9.02 5.15 0.00 3.69 3.73 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 5 V 8.58 4.30 2.02 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 0.95 0.00 0.00 0.93 0.00 0.00 6 V 8.72 4.86 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 1.10 0.00 0.00 0.96 0.00 0.00 7 A 8.95 4.48 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 8 N 9.39 4.70 0.00 2.67 2.96 0.00 0.00 7.08 7.08 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 9 Q 7.53 4.61 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.69 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 10 L 8.54 4.20 0.00 1.65 1.62 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 11 I 8.80 4.40 1.86 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 1.22 0.75 0.90 0.00 0.00 12 P 0.00 4.63 0.00 2.07 1.96 0.00 3.61 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 13 I 8.28 3.88 1.86 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 1.40 0.73 0.91 0.00 0.00 14 S 8.42 3.97 0.00 4.03 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 15 T 7.55 4.19 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 1.22 0.00 0.00 16 H 8.65 5.16 0.00 3.03 3.26 0.00 5.71 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 8.89 4.31 0.00 1.75 1.59 0.96 0.24 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 18 T 8.30 4.92 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 1.22 0.00 0.00 19 L 8.67 4.01 0.00 1.70 1.77 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.66 3.80 2.08 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 0.72 0.00 0.00 0.93 0.00 0.00 21 M 8.04 4.26 0.00 2.13 2.27 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 2.61 2.66 0.00 22 M 7.80 5.23 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 23 R 9.04 4.74 0.00 1.82 2.01 0.00 2.70 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 24 S 8.37 5.22 0.00 3.86 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 25 E 8.85 4.73 0.00 1.93 1.76 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 2.23 2.25 0.00 26 V 8.36 4.36 2.08 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 0.83 0.00 0.00 0.98 0.00 0.00 27 V 8.30 4.61 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 28 T 8.14 4.60 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 29 P 0.00 4.52 0.00 2.17 2.06 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 30 V 8.15 3.94 2.08 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 0.80 0.00 0.00 0.93 0.00 0.00 31 G 8.29 4.33 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 0.00 32 I 8.39 3.88 1.72 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.56 0.79 0.00 0.00 33 P 0.00 4.73 0.00 2.11 2.00 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.13 0.00 34 A 9.00 4.00 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 35 E 8.18 4.06 0.00 2.15 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 0.00 2.30 2.43 0.00 36 D 8.26 4.67 0.00 3.02 2.86 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 I 7.74 3.68 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 1.51 1.10 0.91 0.00 0.00 38 P 0.00 4.26 0.00 2.17 2.15 0.00 3.75 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 2.14 2.22 0.00 39 R 7.78 4.13 0.00 2.05 2.06 0.00 3.19 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 40 L 7.83 4.19 0.00 1.91 1.72 0.99 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 41 V 6.73 4.01 2.10 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 0.77 0.00 0.00 0.94 0.00 0.00 42 S 9.01 4.32 0.00 4.10 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 43 M 7.87 4.44 0.00 2.03 2.20 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.54 0.00 44 Q 8.45 4.96 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.02 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 45 V 8.40 4.54 2.15 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 0.89 0.00 0.00 1.00 0.00 0.00 46 N 9.06 5.08 0.00 2.66 2.90 0.00 0.00 6.73 7.58 0.00 0.00 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 R 7.52 4.73 0.00 1.77 1.89 0.00 3.02 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.62 0.00 48 A 8.51 4.27 1.24 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 0.00 0.00 0.00 49 V 8.80 4.18 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 0.92 0.00 0.00 0.90 0.00 0.00 50 P 0.00 4.65 0.00 2.10 1.95 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.08 0.00 51 L 8.39 4.02 0.00 1.57 1.59 1.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 52 G 9.11 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 0.00 0.00 0.00 53 T 7.60 4.24 4.30 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 1.19 0.00 0.00 54 T 8.40 4.39 4.22 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 1.23 0.00 0.00 55 L 8.94 4.22 0.00 1.70 1.44 0.87 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 56 M 8.40 4.83 0.00 2.15 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 57 P 0.00 3.99 0.00 2.26 2.42 0.00 3.58 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 2.19 2.16 0.00 58 D 7.98 4.60 0.00 2.79 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 59 M 8.17 4.21 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 60 V 7.23 4.65 1.97 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 1.02 0.00 0.00 0.80 0.00 0.00 61 K 8.90 4.29 0.00 1.75 1.76 0.00 1.87 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.38 7.81 62 G 9.01 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 7.44 4.21 0.00 2.90 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 64 A 7.38 4.21 1.08 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 0.00 0.00 65 A 7.88 3.90 0.91 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