NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 T 4.3217 8.0333 115.2444 61.7747 68.9957 175.4312 12 D 4.3181 7.9893 121.9905 55.8373 40.6646 176.6306 13 A 4.0517 8.7772 122.2656 54.9332 18.8094 179.0718 14 T 4.0277 7.7150 114.2089 66.4332 68.5540 177.2582 15 I 3.9978 7.5944 121.4669 63.9550 37.1212 178.4290 16 K 3.9679 8.2786 119.5394 59.5538 32.0987 179.4846 17 K 4.0365 7.8497 118.7577 59.6823 32.0270 179.3159 18 E 3.9972 8.4708 118.8299 59.4704 29.3559 179.4490 19 Q 4.0046 8.3731 118.4683 58.6889 28.7225 178.7625 20 K 3.9223 8.3452 119.9001 59.3770 32.0360 178.9775 21 L 3.8260 7.7109 120.1907 58.1576 41.9173 179.2043 22 I 3.8868 7.4032 120.7413 63.9436 37.0078 178.1503 23 Q 3.9430 8.4353 119.0937 59.0406 28.5916 179.1657 24 A 3.9284 8.3111 121.6921 55.3820 18.1821 179.4526 25 Q 3.9468 8.1848 116.6503 59.3219 28.7449 179.3397 26 N 4.3608 8.6202 117.4529 56.4938 38.5877 177.6389 27 L 4.0179 8.1632 120.5418 57.5617 41.6207 179.8411 28 V 3.6667 8.3197 118.8655 66.0248 31.2940 178.0728 29 R 4.2216 7.8017 118.6484 58.8823 30.1486 177.7855 30 E 4.1005 8.4156 119.3679 59.0940 29.5579 178.4970 31 F 4.4494 8.5798 121.1610 61.5222 39.2235 176.9252 32 E 3.7138 8.3431 117.6555 58.5111 28.8939 179.0801 33 K 4.1391 7.9343 118.1898 58.0877 31.4158 178.0501 34 T 4.3908 7.8701 108.1563 60.8023 70.1830 174.3839 35 H 3.8866 8.3258 118.2290 56.7063 27.2634 174.5629 36 T 4.9214 7.2859 107.3941 60.4932 71.8301 174.8166 37 V 3.6551 8.0910 120.8683 66.0414 31.5744 178.1490 38 S 4.0364 8.1094 112.2273 61.5595 62.3273 175.9928 39 A 4.0368 8.1276 123.2869 55.1390 17.9954 179.1283 40 H 2.5800 8.0402 116.6650 58.7248 29.8060 177.2213 41 A 3.7116 7.7911 122.4385 55.1555 18.2663 179.6234 42 K 3.7621 7.7867 116.4132 59.4939 32.0733 179.4411 43 A 3.8753 7.7526 120.7641 55.1625 18.3246 179.2491 44 Q 3.7845 7.9893 118.3902 59.2489 28.8303 178.6552 45 K 3.8214 7.9170 119.0326 59.4018 32.5836 178.1376 46 A 4.0898 7.9300 121.0027 55.2490 18.3065 179.7942 47 V 3.4829 8.1103 117.0220 66.2422 31.4421 177.9744 48 N 4.3681 8.1087 114.6701 55.5864 38.3878 176.5061 49 L 4.2459 7.4212 118.8534 54.6861 42.3537 177.2805 50 V 3.6938 7.0650 119.7995 62.2325 32.2161 175.7521 51 S 4.1509 8.6533 121.2456 58.3834 62.9973 174.7311 52 F 4.3659 8.6503 122.8958 59.1234 38.9795 177.3942 53 E 3.8737 7.9608 120.7292 59.0351 29.3806 177.9358 54 Y 4.8457 7.5882 116.1962 57.9971 39.4408 178.2650 55 K 4.0230 7.8244 122.8455 60.4305 32.5022 177.8277 56 V 3.5548 7.7659 118.7040 65.7259 31.6705 177.8387 57 K 4.1111 8.0639 118.2795 58.5643 32.0091 178.5594 58 K 3.9314 8.2843 120.5558 59.7859 32.0695 178.5877 59 M 4.0429 7.9618 118.7637 58.4660 31.9158 178.9191 60 V 3.6135 7.8045 118.3326 65.9744 31.7696 178.0788 61 L 4.0026 8.2049 118.9924 57.7500 41.3699 179.3046 62 Q 3.9460 8.3438 119.7342 59.2233 29.1599 177.7764 63 E 4.0745 8.5871 120.7337 59.4780 29.6477 179.0754 64 R 3.9954 8.0372 118.1973 59.0006 30.0809 179.1135 65 I 3.9356 7.6982 119.4797 64.7541 37.3618 177.9895 66 D 4.4749 8.4414 119.9619 57.7516 40.6725 179.0559 67 N 4.3660 8.1713 116.5883 56.2767 38.7046 177.6602 68 V 3.4163 7.6486 119.1830 65.8756 31.2499 178.1085 69 L 4.0983 7.9356 118.0190 57.6231 41.4790 179.2961 70 K 4.1490 7.6583 117.4991 59.4826 32.0263 179.1205 71 Q 4.1073 7.6942 117.6882 57.6732 29.0147 176.9357 72 G 4.1373 7.0962 106.0887 44.5021 0.0000 173.2253 73 L 4.8175 8.1793 121.0103 53.3654 43.6784 177.6313 74 V 4.2012 8.0156 115.8162 60.7139 33.0368 176.8291 75 R 4.2897 8.3879 121.8942 56.2774 29.0837 175.6114 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 11 T 8.03 4.32 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 12 D 7.99 4.32 0.00 2.82 2.70 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 13 A 8.78 4.05 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 14 T 7.72 4.03 4.44 0.00 0.00 0.00 0.00 0.00 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 15 I 7.59 4.00 2.05 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 1.65 0.97 0.92 0.00 0.00 16 K 8.28 3.97 0.00 1.82 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.68 7.81 17 K 7.85 4.04 0.00 1.85 2.09 0.00 1.76 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.60 7.81 18 E 8.47 4.00 0.00 2.18 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 2.44 2.72 0.00 19 Q 8.37 4.00 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 20 K 8.35 3.92 0.00 1.92 1.85 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.76 1.61 7.81 21 L 7.71 3.83 0.00 1.51 1.63 0.69 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.40 3.89 1.93 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 1.47 1.36 0.92 0.00 0.00 23 Q 8.44 3.94 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 24 A 8.31 3.93 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.18 3.95 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.64 0.00 26 N 8.62 4.36 0.00 2.97 2.86 0.00 0.00 7.07 6.77 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 27 L 8.16 4.02 0.00 1.72 1.70 0.96 1.09 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 28 V 8.32 3.67 2.30 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 1.04 0.00 0.00 0.98 0.00 0.00 29 R 7.80 4.22 0.00 1.96 2.14 0.00 3.16 0.00 0.00 3.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 30 E 8.42 4.10 0.00 2.33 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 31 F 8.58 4.45 0.00 3.15 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 32 E 8.34 3.71 0.00 2.26 1.95 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 2.24 2.29 0.00 33 K 7.93 4.14 0.00 1.92 1.86 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.75 7.81 34 T 7.87 4.39 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 1.24 0.00 0.00 35 H 8.33 3.89 0.00 3.27 3.32 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.29 4.92 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 1.27 0.00 0.00 37 V 8.09 3.66 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 1.00 0.00 0.00 1.01 0.00 0.00 38 S 8.11 4.04 0.00 3.94 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 39 A 8.13 4.04 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.04 2.58 0.00 2.67 3.38 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.79 3.71 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 42 K 7.79 3.76 0.00 1.79 1.83 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.67 7.81 43 A 7.75 3.88 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 44 Q 7.99 3.78 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 45 K 7.92 3.82 0.00 1.71 1.76 0.00 1.83 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.42 7.81 46 A 7.93 4.09 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 47 V 8.11 3.48 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 1.03 0.00 0.00 0.93 0.00 0.00 48 N 8.11 4.37 0.00 2.84 2.83 0.00 0.00 7.09 7.39 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 49 L 7.42 4.25 0.00 1.79 1.69 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 50 V 7.07 3.69 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 0.83 0.00 0.00 0.93 0.00 0.00 51 S 8.65 4.15 0.00 3.91 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 52 F 8.65 4.37 0.00 3.17 3.06 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 53 E 7.96 3.87 0.00 1.46 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 2.18 2.15 0.00 54 Y 7.59 4.85 0.00 3.02 2.89 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 0.00 0.00 0.00 55 K 7.82 4.02 0.00 2.10 2.37 0.00 1.36 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.55 7.81 56 V 7.77 3.55 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.97 0.00 0.00 57 K 8.06 4.11 0.00 1.92 1.80 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.51 7.81 58 K 8.28 3.93 0.00 2.01 1.97 0.00 1.65 0.00 0.00 1.49 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.42 7.81 59 M 7.96 4.04 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.58 0.00 60 V 7.80 3.61 2.20 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 1.04 0.00 0.00 1.02 0.00 0.00 61 L 8.20 4.00 0.00 1.91 1.70 0.88 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 8.34 3.95 0.00 2.23 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 63 E 8.59 4.07 0.00 2.22 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 0.00 2.32 2.41 0.00 64 R 8.04 4.00 0.00 2.18 2.12 0.00 3.18 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 65 I 7.70 3.94 2.14 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 1.66 1.11 1.01 0.00 0.00 66 D 8.44 4.47 0.00 2.84 2.76 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 0.00 0.00 0.00 67 N 8.17 4.37 0.00 2.93 2.84 0.00 0.00 6.60 7.32 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 68 V 7.65 3.42 1.90 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 -0.33 0.00 0.00 0.69 0.00 0.00 69 L 7.94 4.10 0.00 1.92 1.74 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 70 K 7.66 4.15 0.00 1.92 1.87 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.74 7.81 71 Q 7.69 4.11 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.97 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 72 G 7.10 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.18 4.82 0.00 1.69 1.77 1.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.02 4.20 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 0.65 0.00 0.00 0.98 0.00 0.00 75 R 8.39 4.29 0.00 1.93 1.96 0.00 3.28 0.00 0.00 3.37 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.17 0.00