NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 L 4.2456 8.1844 122.4906 54.9048 42.8698 175.4303 14 V 4.1547 8.1991 125.9565 59.9476 33.6903 172.8732 15 D 4.5922 9.2931 127.9312 52.9921 42.8210 174.7544 16 P 4.3350 0.0000 0.0000 65.3108 31.1599 178.2537 17 L 4.0048 8.1728 119.6385 58.2790 41.8564 179.1655 18 T 3.8638 8.2066 116.0648 66.9859 68.4206 176.5124 19 T 3.9967 7.8994 116.9998 66.9081 68.4743 176.4435 20 V 3.7489 8.4817 120.0835 66.2434 31.5257 178.3445 21 R 3.9127 8.3622 117.9693 59.2434 29.7028 178.7639 22 E 4.0063 8.1090 117.1553 59.5760 29.8136 179.1938 23 Q 4.1627 8.2231 117.8790 59.3958 28.9411 178.4217 24 C 4.3706 8.5245 117.6638 59.8669 39.9984 175.5190 25 E 4.0799 8.1377 118.2497 58.0738 29.1269 178.3076 26 Q 4.2180 7.8757 117.6363 56.4646 29.6556 176.3477 27 L 4.1425 7.3804 121.0079 54.2758 42.5655 177.1868 28 E 3.9096 9.0994 123.6288 59.8134 29.4802 179.2909 29 K 3.8594 8.1386 118.6295 59.9208 32.0486 178.3004 30 C 4.2740 7.9286 116.4157 62.7276 28.1439 176.2502 31 V 3.6929 8.0328 114.0809 64.2879 31.1723 178.5860 32 K 3.9044 8.3618 118.2074 59.6211 31.9445 179.1707 33 A 4.0781 8.0223 120.6640 55.2728 18.2409 179.6535 34 R 3.5582 8.4787 117.5646 59.3816 29.9710 178.6910 35 E 3.9266 8.3162 118.6375 59.5124 29.5223 179.5425 36 R 3.9078 8.0978 118.0867 58.8755 30.0153 178.9792 37 L 3.9210 7.9671 120.3805 58.3173 42.0718 178.9882 38 E 4.3204 8.3052 120.0567 58.7153 29.3365 179.3423 39 L 3.9668 8.2003 119.6063 57.8269 41.5457 178.6784 40 C 4.3168 8.2443 118.5504 59.5320 41.8146 175.2557 41 D 4.2645 8.4352 121.0977 57.2200 40.3724 178.4634 42 E 3.9785 8.4437 119.9977 59.2107 29.5063 178.6874 43 R 3.8258 7.7095 117.2082 59.5921 30.4856 178.3673 44 V 3.7192 8.0690 118.2611 66.0189 31.3355 177.8454 45 S 4.1378 8.0210 112.1575 61.2029 62.2953 175.5765 46 S 4.3472 7.9446 114.3482 58.4478 63.5196 173.9796 47 R 4.6053 7.1959 122.0599 54.1672 31.5712 175.2214 48 S 3.8605 8.2944 116.4700 60.5032 62.9007 174.7816 49 Q 4.4703 8.0559 132.2634 54.4986 29.3501 174.7562 50 T 4.6735 8.0549 116.0845 59.9503 70.3095 173.5807 51 E 4.4143 8.5124 122.7136 56.3437 30.7465 176.0937 52 E 4.1570 7.6208 121.2336 56.2682 30.2018 174.8251 53 D 4.8468 8.1321 121.8782 51.7410 42.7495 175.7327 54 C 5.4816 8.2913 114.9564 56.4133 39.0194 176.5977 55 T 3.8374 8.5623 119.3799 66.9071 68.1653 175.3611 56 E 3.9288 8.2212 120.3572 59.6806 29.7241 178.6921 57 E 4.0245 8.1424 117.8583 59.1885 29.4745 179.0069 58 L 4.0519 8.3180 120.7805 58.2453 42.1437 179.0366 59 L 4.0366 8.4480 119.3942 57.7779 41.6248 179.2121 60 D 4.3613 8.2978 118.9200 57.2949 40.7232 178.5780 61 F 4.1686 8.1385 120.5017 61.4686 39.4761 177.1896 62 L 3.6870 8.2711 118.7518 57.8690 41.2312 178.9923 63 H 4.0500 8.5608 118.3539 59.0781 29.9138 177.3010 64 A 3.9107 7.8012 122.2268 55.1068 18.2866 179.6736 65 R 3.7490 7.6982 117.4194 59.6266 30.0760 178.5112 66 D 4.3210 8.5077 118.8850 57.1778 40.4874 178.2150 67 H 3.9250 7.5482 118.6383 59.2690 29.9964 176.1992 68 C 4.3331 7.7462 119.0883 59.4341 40.6447 175.6595 69 V 3.4887 7.7500 119.7121 65.9957 30.9341 177.8583 70 A 4.0447 7.8234 119.1919 55.2007 18.1651 178.6979 71 H 4.4896 7.6788 113.3654 57.1715 29.2479 176.7275 72 K 4.4093 7.5721 119.0409 57.7304 33.6604 177.5064 73 L 3.9081 8.2351 120.7285 58.8220 42.0246 179.2265 74 F 4.2161 8.5768 116.7096 60.4303 38.6417 177.0690 75 N 4.5782 8.2838 115.1794 55.1837 38.3178 175.6929 76 S 4.6672 8.0871 114.6513 57.9995 63.6278 173.6110 77 L 4.6386 7.5108 120.4458 52.7396 43.9118 176.4866 78 K 4.0869 8.2810 119.9466 56.7043 32.1501 176.3326 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 13 L 8.18 4.25 0.00 1.60 1.67 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.20 4.15 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 0.93 0.00 0.00 15 D 9.29 4.59 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.33 0.00 2.21 2.11 0.00 3.65 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 17 L 8.17 4.00 0.00 1.80 1.74 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.21 3.86 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 1.23 0.00 0.00 19 T 7.90 4.00 4.37 0.00 0.00 0.00 0.00 0.00 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 20 V 8.48 3.75 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 1.13 0.00 0.00 1.02 0.00 0.00 21 R 8.36 3.91 0.00 2.16 2.00 0.00 3.30 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 22 E 8.11 4.01 0.00 2.14 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 2.37 2.57 0.00 23 Q 8.22 4.16 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.70 0.00 24 C 8.52 4.37 0.00 3.12 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 25 E 8.14 4.08 0.00 2.27 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 2.75 2.48 0.00 26 Q 7.88 4.22 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.85 0.00 0.00 0.00 0.00 0.00 2.65 2.51 0.00 27 L 7.38 4.14 0.00 1.75 1.59 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 28 E 9.10 3.91 0.00 2.04 1.98 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 2.40 2.41 0.00 29 K 8.14 3.86 0.00 1.86 1.80 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.56 7.81 30 C 7.93 4.27 0.00 3.22 3.11 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 31 V 8.03 3.69 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 0.90 0.00 0.00 1.06 0.00 0.00 32 K 8.36 3.90 0.00 1.93 1.89 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.69 1.63 7.81 33 A 8.02 4.08 1.60 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 34 R 8.48 3.56 0.00 1.76 2.05 0.00 3.04 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.28 0.00 35 E 8.32 3.93 0.00 2.26 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 2.32 2.60 0.00 36 R 8.10 3.91 0.00 2.02 1.99 0.00 3.14 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 37 L 7.97 3.92 0.00 1.78 1.65 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.31 4.32 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 39 L 8.20 3.97 0.00 1.97 1.71 0.97 1.06 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 40 C 8.24 4.32 0.00 3.00 3.23 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 41 D 8.44 4.26 0.00 2.84 2.68 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 42 E 8.44 3.98 0.00 2.20 1.93 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 2.29 2.30 0.00 43 R 7.71 3.83 0.00 1.90 2.11 0.00 3.31 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 44 V 8.07 3.72 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 0.97 0.00 0.00 1.02 0.00 0.00 45 S 8.02 4.14 0.00 4.04 4.01 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 0.00 0.00 0.00 46 S 7.94 4.35 0.00 4.08 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 0.00 47 R 7.20 4.61 0.00 1.82 1.86 0.00 3.18 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 48 S 8.29 3.86 0.00 3.85 3.75 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 49 Q 8.06 4.47 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 50 T 8.05 4.67 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 51 E 8.51 4.41 0.00 2.10 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 2.20 2.27 0.00 52 E 7.62 4.16 0.00 1.90 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 2.32 2.24 0.00 53 D 8.13 4.85 0.00 2.74 2.58 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 0.00 0.00 0.00 0.00 54 C 8.29 5.48 0.00 2.97 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 55 T 8.56 3.84 4.27 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 1.22 0.00 0.00 56 E 8.22 3.93 0.00 2.03 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 2.39 2.42 0.00 57 E 8.14 4.02 0.00 2.24 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 2.58 2.44 0.00 58 L 8.32 4.05 0.00 1.82 1.86 1.02 0.79 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 59 L 8.45 4.04 0.00 1.71 1.73 0.94 1.05 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 60 D 8.30 4.36 0.00 2.93 2.77 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 61 F 8.14 4.17 0.00 3.18 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 62 L 8.27 3.69 0.00 1.87 1.68 0.99 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.56 4.05 0.00 3.27 3.43 0.00 5.58 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 64 A 7.80 3.91 1.30 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 0.00 0.00 0.00 65 R 7.70 3.75 0.00 1.17 1.47 0.00 3.11 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 66 D 8.51 4.32 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 67 H 7.55 3.93 0.00 3.00 3.36 0.00 5.95 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 C 7.75 4.33 0.00 3.07 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 69 V 7.75 3.49 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 0.92 0.00 0.00 0.95 0.00 0.00 70 A 7.82 4.04 1.19 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 0.00 0.00 71 H 7.68 4.49 0.00 3.16 3.28 0.00 5.63 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.57 4.41 0.00 1.77 1.82 0.00 1.71 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.61 7.81 73 L 8.24 3.91 0.00 1.88 1.86 0.97 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.58 4.22 0.00 3.01 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 75 N 8.28 4.58 0.00 2.97 2.91 0.00 0.00 6.85 7.38 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 76 S 8.09 4.67 0.00 3.84 3.86 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 77 L 7.51 4.64 0.00 1.38 1.36 0.62 0.68 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 78 K 8.28 4.09 0.00 1.67 1.62 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.39 7.81