NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 5.2345 8.3116 120.2728 53.5024 40.4163 173.1219 3 L 4.4179 8.2619 127.9158 52.8092 44.2003 173.1267 4 K 4.7975 8.6891 127.6826 54.4254 34.1378 174.6526 5 C 4.2506 8.8274 128.8349 59.4950 31.9485 172.9220 6 K 4.7449 9.3188 126.9704 56.2876 32.4045 175.6552 7 W 3.9913 8.2219 117.8276 55.0841 29.8430 177.4039 8 K 3.9567 8.6002 124.6710 59.4113 31.8166 176.9847 9 E 4.3191 8.1842 116.0911 56.2103 29.7632 174.6147 10 C 4.7388 7.8671 118.3163 57.8756 32.8093 171.3040 11 P 4.8592 0.0000 0.0000 62.3784 31.3150 174.4744 12 E 4.7030 8.0198 117.5156 54.9748 31.7699 175.3349 13 S 4.7394 8.4173 115.7441 56.4335 65.8814 172.9134 14 A 4.8430 8.7690 123.6489 50.5018 21.3488 177.5967 15 S 4.2363 8.6412 113.4622 59.5000 63.3651 173.9575 16 S 5.0499 7.5875 112.8131 55.0807 65.5749 173.7136 17 L 3.9788 8.8594 125.6198 58.7613 41.5202 179.4864 18 F 4.1146 8.5706 117.0534 60.1836 38.8258 176.9034 19 D 4.3852 8.5024 118.3636 57.4119 40.8173 178.2299 20 L 3.9656 7.9014 120.2958 57.9485 42.1846 178.3387 21 Q 4.2038 7.7311 118.2139 59.5294 29.0032 178.7991 22 R 3.9973 8.2238 118.9873 59.2134 30.0620 178.6252 23 H 4.0784 8.5287 118.5891 59.1622 29.9446 177.1941 24 L 3.7819 8.9448 123.3104 57.8600 41.6611 178.6569 25 L 3.9636 8.0320 120.3177 58.1529 41.8734 179.1058 26 K 4.0973 7.8871 117.0706 59.0395 32.2127 178.0007 27 D 4.2501 7.9865 117.8924 57.0220 41.2669 176.7058 28 H 4.3008 7.5084 112.6436 56.0801 28.8650 176.7193 29 V 4.4235 6.8405 111.8197 60.3242 34.0150 172.8098 30 S 3.9729 8.4763 119.1635 59.1726 62.6023 170.6857 31 Q 3.6045 8.1595 126.0835 55.1814 26.5992 172.7020 32 D 4.3707 8.6714 123.4640 55.1910 41.6294 177.0279 33 F 4.0379 7.8820 118.4160 58.8019 38.2682 174.8203 34 K 4.6490 7.7199 115.7180 55.7783 32.6450 175.2487 35 H 4.8293 7.8092 115.0124 53.4472 29.9375 173.2165 36 P 4.3750 0.0000 0.0000 65.9130 31.8370 177.4284 37 M 4.8307 7.3979 116.1844 53.9473 33.7108 174.2947 38 E 4.4712 7.6951 118.3888 52.8164 30.7805 172.7384 39 P 4.3852 0.0000 0.0000 62.4056 32.5430 175.2438 40 L 4.5871 8.2190 123.8000 54.1985 43.8287 175.2184 41 A 5.0405 8.2758 124.7597 49.6955 22.3168 175.4332 42 C 4.4748 9.7403 121.7559 59.5231 32.5102 173.6396 43 N 4.9202 8.8116 121.8849 52.8152 37.6883 174.8340 44 W 3.9077 7.8322 117.3996 54.7690 30.9394 177.4586 45 E 3.9830 8.7921 120.4003 59.1581 28.9430 177.7635 46 D 4.6762 7.9844 116.3982 53.3535 40.8164 176.1185 47 C 4.3897 7.4774 119.2694 59.3405 32.0306 172.6199 48 D 4.9982 8.4729 125.1107 53.8724 41.4111 175.8652 49 F 4.2869 8.1601 122.0856 58.4621 40.4899 173.6204 50 L 4.5823 7.0825 125.6882 53.2745 45.1838 175.0330 51 G 4.2286 9.0094 111.6147 44.4417 0.0000 173.0862 52 D 4.4518 8.7463 118.9889 55.1548 40.1623 175.7643 53 D 4.8328 7.6023 117.0523 51.3017 44.9508 175.4535 54 T 3.9533 8.5682 115.3891 65.1860 67.2349 175.8386 55 A 4.0704 7.9215 122.1367 55.2511 18.3541 179.7880 56 S 4.2349 7.9854 113.3790 61.6413 62.5746 177.1149 57 I 4.0893 7.7768 122.1861 64.6769 37.1448 178.5105 58 V 3.5341 8.0284 113.2825 64.5593 31.0196 178.2479 59 N 4.2668 8.1795 116.6270 56.7985 38.6632 176.5723 60 H 3.9564 7.8905 119.2875 59.0906 29.7280 177.1991 61 I 3.5892 8.5517 122.9001 64.3910 36.7522 178.1516 62 N 4.0605 7.8277 116.3612 55.7280 37.1558 176.8628 63 A 4.0474 7.3428 121.8759 54.5853 18.8712 178.9540 64 Q 4.0424 8.4097 115.2085 56.7928 29.2740 175.7974 65 H 4.1672 8.3596 122.3802 55.6200 29.5855 173.0472 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 2 D 8.31 5.23 0.00 2.71 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.26 4.42 0.00 1.91 1.58 0.98 0.19 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 K 8.69 4.80 0.00 1.82 1.74 0.00 1.87 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.43 7.81 5 C 8.83 4.25 0.00 3.01 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.32 4.74 0.00 2.07 2.52 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.53 1.74 7.81 7 W 8.22 3.99 0.00 3.20 2.95 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 8 K 8.60 3.96 0.00 1.88 1.82 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.53 7.81 9 E 8.18 4.32 0.00 2.03 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 0.00 2.31 2.32 0.00 10 C 7.87 4.74 0.00 3.11 3.05 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 0.00 0.00 0.00 11 P 0.00 4.86 0.00 2.22 2.12 0.00 3.79 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.97 0.00 12 E 8.02 4.70 0.00 1.96 1.83 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 2.20 2.25 0.00 13 S 8.42 4.74 0.00 3.94 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 14 A 8.77 4.84 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 15 S 8.64 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 16 S 7.59 5.05 0.00 3.86 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.86 3.98 0.00 1.85 1.83 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 18 F 8.57 4.11 0.00 3.12 3.14 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 19 D 8.50 4.39 0.00 2.77 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 20 L 7.90 3.97 0.00 1.76 1.70 1.06 0.65 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 21 Q 7.73 4.20 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.34 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 22 R 8.22 4.00 0.00 1.96 1.99 0.00 3.23 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 23 H 8.53 4.08 0.00 3.20 3.56 0.00 5.78 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.94 3.78 0.00 1.92 1.68 1.27 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.03 3.96 0.00 1.99 1.66 0.96 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 26 K 7.89 4.10 0.00 1.75 1.81 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.57 7.81 27 D 7.99 4.25 0.00 2.27 2.19 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 28 H 7.51 4.30 0.00 2.90 2.51 0.00 5.75 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 V 6.84 4.42 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 0.60 0.00 0.00 1.06 0.00 0.00 30 S 8.48 3.97 0.00 3.82 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 31 Q 8.16 3.60 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 32 D 8.67 4.37 0.00 2.77 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 33 F 7.88 4.04 0.00 3.26 3.08 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 34 K 7.72 4.65 0.00 1.81 1.78 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.66 1.52 7.81 35 H 7.81 4.83 0.00 3.20 3.29 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.37 0.00 2.20 2.21 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 37 M 7.40 4.83 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 38 E 7.70 4.47 0.00 1.85 1.73 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 2.16 2.22 0.00 39 P 0.00 4.39 0.00 1.92 2.00 0.00 3.68 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 1.99 2.06 0.00 40 L 8.22 4.59 0.00 1.75 1.56 0.88 1.07 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 41 A 8.28 5.04 1.18 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 0.00 0.00 42 C 9.74 4.47 0.00 3.48 3.09 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 0.00 0.00 0.00 0.00 43 N 8.81 4.92 0.00 2.73 2.67 0.00 0.00 7.20 7.88 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 44 W 7.83 3.91 0.00 3.33 2.92 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 45 E 8.79 3.98 0.00 2.05 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 2.37 2.36 0.00 46 D 7.98 4.68 0.00 2.81 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 47 C 7.48 4.39 0.00 3.00 3.07 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 0.00 0.00 0.00 0.00 48 D 8.47 5.00 0.00 2.68 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.16 4.29 0.00 2.89 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 50 L 7.08 4.58 0.00 1.43 1.17 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 51 G 9.01 4.23 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 0.00 0.00 0.00 52 D 8.75 4.45 0.00 2.78 2.78 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 D 7.60 4.83 0.00 2.63 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.57 3.95 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 1.30 0.00 0.00 55 A 7.92 4.07 1.42 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 0.00 0.00 0.00 56 S 7.99 4.23 0.00 4.12 4.07 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 0.00 0.00 0.00 0.00 57 I 7.78 4.09 2.21 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.26 1.19 0.00 0.00 58 V 8.03 3.53 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 0.91 0.00 0.00 0.97 0.00 0.00 59 N 8.18 4.27 0.00 2.88 3.03 0.00 0.00 6.81 7.77 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 60 H 7.89 3.96 0.00 2.68 2.62 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 8.55 3.59 1.94 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.05 1.23 0.00 0.00 62 N 7.83 4.06 0.00 2.78 3.03 0.00 0.00 7.12 7.12 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 63 A 7.34 4.05 1.23 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 0.00 0.00 64 Q 8.41 4.04 0.00 1.19 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.61 0.00 0.00 0.00 0.00 0.00 2.21 2.46 0.00 65 H 8.36 4.17 0.00 2.83 2.66 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00