NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3145 8.1631 117.3743 63.1993 69.6934 173.4256 2 G 3.5422 8.3519 115.3577 44.8260 0.0000 172.5920 3 A 4.1994 8.1333 124.0598 52.5133 21.2137 176.3531 4 G 4.3224 7.0953 108.1897 44.8766 0.0000 175.9459 5 T 3.8929 9.1712 122.4269 66.1456 67.6573 173.3310 6 P 4.3932 0.0000 0.0000 65.2115 31.0244 177.6538 7 S 4.1901 8.1338 114.1382 59.8152 63.0922 175.8161 8 Q 3.9739 8.0995 121.5572 58.1566 28.3190 178.2666 9 G 3.7039 7.4495 108.0359 47.9181 0.0000 174.8579 10 K 4.1680 7.3750 117.9869 58.2184 32.6529 178.5102 11 K 4.4545 7.5652 119.3761 56.3666 29.1585 176.2382 12 N 5.0517 7.8347 115.0787 52.5451 38.4256 175.1468 13 T 4.4352 7.9429 114.5883 63.3128 70.0120 174.2579 14 T 4.4698 8.3444 122.2707 62.3795 69.3941 172.6699 15 T 4.3553 7.6499 114.9560 63.0276 71.3574 172.7963 16 H 5.0600 7.9654 120.8601 54.7199 29.8651 174.3089 17 T 4.8133 9.3547 113.7204 58.9235 72.8063 173.0815 18 K 4.3606 8.6553 123.1803 57.0521 32.8677 175.4665 19 C 4.2062 9.0084 128.4636 58.5539 32.2659 174.5529 20 R 3.6859 8.2078 126.0955 58.9878 30.1240 177.4752 21 R 3.8092 7.2396 116.9873 57.8949 30.3445 176.3884 22 C 4.4859 7.9824 109.2768 57.3756 31.3503 174.7329 23 G 3.8813 8.1283 107.9271 45.1303 0.0000 172.8323 24 E 4.4487 7.6518 118.8947 54.1991 31.5569 176.2633 25 K 4.5843 8.1460 124.8776 56.2230 29.6761 176.6082 26 S 4.7728 7.8572 114.0172 58.0198 66.5810 174.4953 27 Y 4.7645 8.6619 123.7527 57.1452 39.5775 174.2622 28 H 4.5023 9.0237 129.2959 55.9676 29.9401 175.6744 29 T 4.0138 9.0704 122.3865 64.1509 67.0232 175.2244 30 K 4.2468 8.1997 119.3079 58.2608 32.8919 177.6435 31 K 4.0873 7.7846 115.8573 55.8317 32.6149 176.4576 32 K 3.2884 8.2927 118.1308 57.0365 30.2606 174.6611 33 V 4.7489 6.8472 115.8931 61.2735 35.7163 173.2376 34 C 5.2543 9.0714 128.0883 58.5884 32.3648 174.2800 35 S 4.3948 9.2778 121.4694 60.5073 62.9431 175.2671 36 S 4.5221 8.4154 114.6515 60.0389 62.9912 174.2673 37 C 4.4922 8.1104 112.6615 57.3626 30.7491 174.8239 38 G 4.0648 8.3281 108.7574 45.9668 0.0000 172.8263 39 F 4.4782 8.1818 122.7231 59.0682 39.7161 174.8779 40 G 3.8416 8.4892 116.5675 46.3753 0.0000 174.3980 41 K 4.2299 8.0106 119.2927 57.5498 32.9785 176.2232 42 S 4.7744 7.9929 110.9669 56.0685 65.8862 173.8950 43 A 4.1796 8.5568 124.4978 54.7848 18.6030 178.7232 44 K 4.2921 7.7151 114.0461 55.7798 33.0337 176.9464 45 R 4.2438 8.2632 121.6393 56.0320 30.8452 176.4299 46 R 3.8833 8.5582 125.0598 56.5297 30.4694 175.2655 47 D 4.6795 7.7280 124.7029 53.3773 44.3340 173.8538 48 Y 4.5203 8.7345 121.7475 56.0351 41.6927 176.2832 49 E 4.1136 8.6900 121.4893 57.8704 29.7250 177.7062 50 W 4.7011 7.4889 115.4180 56.9201 28.8220 177.6970 51 Q 4.1399 7.5034 118.6616 57.7182 28.3563 175.7478 52 S 4.7845 7.3658 111.2214 55.8102 66.5493 173.9873 53 K 4.1025 8.4819 119.8493 56.2878 32.4943 177.9396 54 A 4.0094 8.8924 125.0565 55.3959 18.2110 178.9122 55 G 4.1183 7.9590 101.8258 45.2433 0.0000 173.2308 56 E 4.1842 8.2298 126.6370 56.1028 29.9554 174.7894 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 T 8.16 4.31 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 2 G 8.35 3.54 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 0.00 0.00 0.00 3 A 8.13 4.20 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 4 G 7.10 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 5 T 9.17 3.89 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 6 P 0.00 4.39 0.00 2.26 2.31 0.00 3.61 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 2.26 2.05 0.00 7 S 8.13 4.19 0.00 4.19 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 8 Q 8.10 3.97 0.00 2.20 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.66 2.51 0.00 9 G 7.45 3.70 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 0.00 0.00 0.00 10 K 7.37 4.17 0.00 1.59 1.88 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.41 7.81 11 K 7.57 4.45 0.00 1.88 1.79 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.45 7.81 12 N 7.83 5.05 0.00 2.78 2.83 0.00 0.00 6.32 7.71 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 13 T 7.94 4.44 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 14 T 8.34 4.47 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 1.23 0.00 0.00 15 T 7.65 4.36 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 1.15 0.00 0.00 16 H 7.97 5.06 0.00 3.07 3.50 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.35 4.81 4.34 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 0.00 0.00 0.00 1.27 0.00 0.00 18 K 8.66 4.36 0.00 1.81 1.77 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.77 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.40 1.44 7.81 19 C 9.01 4.21 0.00 3.19 2.75 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 0.00 0.00 0.00 20 R 8.21 3.69 0.00 1.45 1.32 0.00 3.08 0.00 0.00 3.08 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.47 0.00 21 R 7.24 3.81 0.00 0.67 1.52 0.00 3.28 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.37 0.00 22 C 7.98 4.49 0.00 3.06 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 23 G 8.13 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 24 E 7.65 4.45 0.00 1.94 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 2.35 2.26 0.00 25 K 8.15 4.58 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.51 7.81 26 S 7.86 4.77 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 27 Y 8.66 4.76 0.00 3.12 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 28 H 9.02 4.50 0.00 3.10 2.97 0.00 5.66 0.00 0.00 0.00 0.00 6.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 9.07 4.01 4.31 0.00 0.00 0.00 0.00 0.00 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 30 K 8.20 4.25 0.00 1.77 1.82 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.44 7.81 31 K 7.78 4.09 0.00 1.51 1.70 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 0.89 7.81 32 K 8.29 3.29 0.00 1.79 1.87 0.00 1.75 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.50 7.81 33 V 6.85 4.75 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 1.10 0.00 0.00 0.89 0.00 0.00 34 C 9.07 5.25 0.00 3.50 3.19 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 35 S 9.28 4.39 0.00 4.00 4.11 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 0.00 0.00 0.00 0.00 36 S 8.42 4.52 0.00 3.90 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 37 C 8.11 4.49 0.00 3.16 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 8.33 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 39 F 8.18 4.48 0.00 3.13 3.13 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 0.00 0.00 0.00 0.00 40 G 8.49 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 0.00 0.00 0.00 41 K 8.01 4.23 0.00 1.74 2.00 0.00 1.78 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.42 7.81 42 S 7.99 4.77 0.00 3.95 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 43 A 8.56 4.18 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.72 4.29 0.00 1.73 1.71 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 R 8.26 4.24 0.00 1.65 1.83 0.00 3.36 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.55 0.00 46 R 8.56 3.88 0.00 1.87 1.97 0.00 3.42 0.00 0.00 3.39 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 47 D 7.73 4.68 0.00 2.52 2.23 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 48 Y 8.73 4.52 0.00 1.61 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 49 E 8.69 4.11 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 2.29 2.25 0.00 50 W 7.49 4.70 0.00 3.48 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 7.50 4.14 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.08 1.64 0.00 52 S 7.37 4.78 0.00 3.81 3.78 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.48 4.10 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.89 4.01 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 55 G 7.96 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 0.00 0.00 0.00 56 E 8.23 4.18 0.00 1.90 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 2.22 2.25 0.00