NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8996 8.3549 109.7354 44.3289 0.0000 173.6685 2 P 3.9676 0.0000 0.0000 61.8094 31.5661 174.9186 3 L 4.2627 8.5950 124.4830 53.8713 42.2587 176.8214 4 G 3.7652 8.5424 112.7505 46.7951 0.0000 172.8351 5 S 4.5321 7.6255 116.6990 58.4558 63.4296 175.3618 6 M 4.7811 7.2570 117.3313 52.2117 33.3320 174.4039 7 P 3.6873 0.0000 0.0000 65.5839 31.7986 178.0733 8 E 3.6250 7.8652 116.0704 58.5904 29.2023 179.0679 9 V 3.5964 7.9462 118.2966 64.9794 31.7705 177.2017 10 R 4.4523 7.5839 116.6159 58.0531 31.1120 178.2501 11 F 4.2690 9.0341 118.5883 60.9195 39.0416 177.6559 12 Q 4.1313 8.4654 119.3224 59.1397 28.8575 178.4440 13 Q 4.2998 7.9475 120.1756 58.5502 28.9377 178.3365 14 Q 4.1014 8.1372 118.7652 58.7043 28.6235 178.8882 15 L 4.0930 8.3751 120.8864 57.6649 41.1111 179.1954 16 E 4.1205 8.2931 118.7309 59.1580 29.3920 179.2029 17 Q 3.9907 7.9592 119.5825 59.3097 29.1874 178.3227 18 L 4.1716 8.3929 120.4376 57.6878 41.3906 178.8427 19 N 5.0767 8.2409 118.1609 56.1621 38.8503 176.5424 20 S 4.3848 7.8562 115.0440 60.3382 63.1523 175.2138 21 M 4.4867 8.2439 120.0495 54.6935 32.1222 176.6022 22 G 3.5955 8.0696 106.9824 45.3131 0.0000 173.4898 23 F 4.7381 7.9225 119.0741 55.8140 39.1221 175.7318 24 I 4.5109 8.1961 117.3308 60.1433 38.5667 177.0925 25 N 4.6560 7.9761 121.0971 52.2582 36.6245 174.5756 26 R 3.9104 8.2378 124.6396 59.1335 30.5328 177.1713 27 E 3.9188 8.4112 117.1284 59.7636 29.4796 179.3934 28 A 3.9256 7.8384 119.4655 55.5186 18.6139 178.6185 29 N 4.0427 8.6168 115.3372 57.0476 38.6347 177.4892 30 L 3.8224 8.5459 120.9942 58.5287 40.9307 179.1943 31 Q 3.9784 8.2611 119.1539 58.6811 28.4727 178.4325 32 A 3.9144 7.9495 122.0187 54.9802 18.4187 179.5951 33 L 4.2792 7.3562 118.4030 56.5287 41.2426 179.8403 34 I 3.8583 7.3427 119.7987 64.3905 37.2705 177.8961 35 A 4.1954 7.7030 118.8756 53.8469 18.4807 178.4967 36 T 4.3535 7.6403 107.1794 60.4017 69.7644 175.2108 37 G 4.3170 9.0803 109.9901 47.0561 0.0000 174.4053 38 G 4.0334 8.6321 105.8895 45.1406 0.0000 175.3661 39 D 4.5999 7.4500 120.5435 52.7203 39.8982 176.3238 40 I 3.7150 7.8725 125.3921 63.0644 38.3013 176.8483 41 N 4.2581 8.1301 117.0861 56.4296 38.4584 177.0354 42 A 3.9790 8.7024 122.1972 54.6239 18.4090 179.2599 43 A 3.7885 8.1596 120.0482 55.5713 18.3822 179.9039 44 I 3.2930 7.8065 118.0889 64.5963 37.1681 178.6724 45 E 4.1639 8.1817 118.8198 58.9690 29.0876 179.5194 46 R 3.9358 8.0053 118.7702 58.8120 29.9821 178.7894 47 L 3.9005 7.3475 118.1354 57.4143 41.5699 179.0221 48 L 4.3904 8.2155 118.7666 57.0555 41.8257 179.0507 49 G 3.8823 8.0418 104.6672 46.2048 0.0000 175.0320 50 S 4.6006 7.8341 119.9518 56.3485 61.3324 173.1840 51 Q 4.4292 7.7132 119.2817 53.8852 28.4451 175.0789 52 L 4.3976 7.9545 124.6501 54.0223 40.9289 177.1889 53 S 4.3259 8.1994 118.1754 58.4167 63.4635 174.3682 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 3.90 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 0.00 0.00 0.00 2 P 0.00 3.97 0.00 2.13 2.01 0.00 3.67 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 2.02 2.16 0.00 3 L 8.59 4.26 0.00 1.61 1.60 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 4 G 8.54 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 0.00 0.00 0.00 5 S 7.63 4.53 0.00 3.83 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 6 M 7.26 4.78 0.00 1.96 1.87 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 2.54 2.51 0.00 7 P 0.00 3.69 0.00 1.52 0.91 0.00 3.42 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.91 0.00 8 E 7.87 3.63 0.00 1.97 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 2.48 2.36 0.00 9 V 7.95 3.60 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 0.91 0.00 0.00 0.94 0.00 0.00 10 R 7.58 4.45 0.00 2.13 2.08 0.00 3.39 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 11 F 9.03 4.27 0.00 2.98 3.04 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 12 Q 8.47 4.13 0.00 2.18 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 13 Q 7.95 4.30 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.66 0.00 0.00 0.00 0.00 0.00 2.66 2.27 0.00 14 Q 8.14 4.10 0.00 2.46 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 15 L 8.38 4.09 0.00 1.84 1.74 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.29 4.12 0.00 2.17 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 0.00 2.35 2.63 0.00 17 Q 7.96 3.99 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 18 L 8.39 4.17 0.00 1.90 1.85 0.77 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.24 5.08 0.00 2.90 3.10 0.00 0.00 7.21 7.51 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 20 S 7.86 4.38 0.00 4.19 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 21 M 8.24 4.49 0.00 2.12 2.53 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.83 0.00 22 G 8.07 3.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 7.92 4.74 0.00 3.19 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 24 I 8.20 4.51 1.89 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 1.31 0.94 0.99 0.00 0.00 25 N 7.98 4.66 0.00 2.88 2.82 0.00 0.00 7.19 7.92 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 26 R 8.24 3.91 0.00 1.88 2.03 0.00 3.41 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 27 E 8.41 3.92 0.00 2.01 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 2.43 2.43 0.00 28 A 7.84 3.93 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 29 N 8.62 4.04 0.00 2.93 2.83 0.00 0.00 7.02 7.13 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 30 L 8.55 3.82 0.00 2.04 1.99 1.03 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 31 Q 8.26 3.98 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 32 A 7.95 3.91 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 33 L 7.36 4.28 0.00 0.99 0.13 0.76 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.34 3.86 2.03 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.69 1.00 0.00 0.00 35 A 7.70 4.20 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 36 T 7.64 4.35 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 1.19 0.00 0.00 37 G 9.08 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 0.00 0.00 0.00 0.00 38 G 8.63 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 39 D 7.45 4.60 0.00 2.89 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.87 3.71 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 1.56 1.69 0.90 0.00 0.00 41 N 8.13 4.26 0.00 2.85 2.83 0.00 0.00 7.44 7.28 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 42 A 8.70 3.98 1.26 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 43 A 8.16 3.79 1.20 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 0.00 0.00 0.00 44 I 7.81 3.29 1.92 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 1.47 0.80 0.95 0.00 0.00 45 E 8.18 4.16 0.00 2.11 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 0.00 2.31 2.55 0.00 46 R 8.01 3.94 0.00 1.93 1.88 0.00 3.06 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.81 0.00 47 L 7.35 3.90 0.00 1.05 1.13 -0.17 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.22 4.39 0.00 1.59 1.77 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.04 3.88 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 0.00 0.00 0.00 50 S 7.83 4.60 0.00 3.90 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.71 4.43 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.25 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 52 L 7.95 4.40 0.00 1.65 1.68 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.20 4.33 0.00 3.81 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00