NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.0687 8.4293 121.4504 55.9127 31.4662 176.4206 20 I 4.4109 7.2581 108.4255 58.9724 38.7813 172.5234 21 D 4.4696 7.3805 116.7267 54.1809 44.3061 176.3757 22 Y 4.3510 8.2132 123.6070 59.3499 38.7347 177.7466 23 K 3.4797 7.1949 119.5211 59.5043 33.1519 177.4315 24 D 4.6346 7.5075 121.0985 52.9804 40.2546 177.3824 25 I 3.7557 7.8240 114.8914 64.2446 37.2134 177.0588 26 A 3.9978 7.8601 121.4459 55.4613 18.4726 179.1685 27 T 4.2120 8.5641 114.4059 66.4035 68.6027 177.3681 28 L 4.2688 7.9504 120.7506 57.5475 41.4989 179.1038 29 K 4.1291 7.8231 116.3146 58.2928 31.9883 178.2549 30 N 4.4516 7.7002 117.0274 55.2816 39.5546 175.6365 31 Y 4.6227 7.8740 117.7287 57.5076 38.5565 175.4426 32 I 4.8141 7.3559 119.2353 59.9900 41.3857 175.7862 33 T 4.2832 8.1238 115.6683 60.9793 70.0098 174.4100 34 E 4.1085 8.7294 120.1399 59.8453 29.8044 178.5887 35 S 4.2143 8.3460 114.7181 62.3718 63.0949 175.1043 36 G 3.4161 7.6611 110.9851 45.4587 0.0000 174.8528 37 K 3.9915 8.0996 120.6537 56.5126 32.9505 176.2230 38 I 4.2606 8.1353 115.8545 61.1887 38.2630 175.9546 39 V 4.0345 8.0867 116.9373 60.3865 32.4570 174.3962 40 P 4.5384 0.0000 0.0000 62.9712 31.5268 176.2481 41 S 4.6210 8.8630 113.5908 59.6938 64.0918 176.1090 42 R 4.0891 8.0513 117.6467 59.2613 29.6588 178.9492 43 I 4.0469 7.5735 119.2980 60.6374 36.6632 175.8573 44 T 4.1823 8.1405 110.0329 60.9030 71.6211 175.1388 45 G 3.8394 7.5472 115.4150 47.4809 0.0000 174.3607 46 T 3.6628 8.4610 112.8302 59.3033 67.9211 173.6533 47 R 3.9432 8.7101 127.6922 56.4851 31.9956 176.8942 48 A 4.0052 8.2041 120.9341 54.8033 18.3094 179.4468 49 K 3.8164 7.9414 116.7952 59.6875 32.1812 178.8177 50 Y 4.2677 7.8062 116.4785 61.0727 38.0736 177.3349 51 Q 3.9015 7.9105 119.9526 59.7681 28.7320 178.5793 52 R 3.9578 7.7904 117.9768 59.7480 29.6207 178.5532 53 Q 3.9436 7.9950 118.8297 59.2477 29.0971 178.5495 54 L 3.9068 8.4702 121.2816 57.9424 42.0362 178.4393 55 A 3.9120 8.4934 121.1210 55.5387 18.1990 179.5583 56 R 3.7320 7.5817 115.5279 59.4248 30.0992 178.9027 57 A 4.0518 7.5459 119.1349 55.5126 18.4163 179.7718 58 I 3.6419 7.6009 117.9825 64.3018 36.8911 178.9665 59 K 3.5856 7.9691 118.6659 59.3880 32.1986 179.2998 60 R 3.4923 8.2143 118.3577 59.1225 30.0474 179.0919 61 A 4.0615 8.2114 120.7267 55.1515 18.1106 179.7811 62 R 4.2904 7.4708 116.8930 58.3205 30.1512 177.8628 63 Y 4.7698 7.8826 115.0830 58.9345 38.3213 176.5777 64 L 4.5399 7.6279 118.2001 53.6508 42.1162 176.4097 65 S 3.8643 8.0093 111.7798 59.0207 60.9993 172.9672 66 L 4.2107 7.7866 117.4084 56.5347 41.6459 176.8672 67 L 4.7630 7.4483 118.4850 52.4301 45.9122 173.3220 68 P 4.7356 0.0000 0.0000 62.3246 32.5826 176.0880 69 Y 4.0935 8.9037 118.9113 61.2496 38.0802 176.4213 70 T 4.7039 7.5289 111.4563 60.9079 70.1372 173.2987 71 D 4.5274 9.2663 128.1105 55.7431 41.4914 176.9392 72 R 4.0089 7.6875 118.5156 60.2728 30.2414 175.5405 73 H 4.1950 7.8481 120.6765 56.8771 30.8077 173.1866 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 19 E 8.43 4.07 0.00 1.76 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 1.87 1.86 0.00 20 I 7.26 4.41 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.86 0.83 0.00 0.00 21 D 7.38 4.47 0.00 2.50 2.39 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 0.00 0.00 0.00 0.00 22 Y 8.21 4.35 0.00 3.25 3.24 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 0.00 23 K 7.19 3.48 0.00 1.63 1.43 0.00 1.39 0.00 0.00 1.53 0.00 0.00 2.94 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.18 1.32 7.81 24 D 7.51 4.63 0.00 2.58 2.72 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 25 I 7.82 3.76 1.89 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 1.70 0.43 1.00 0.00 0.00 26 A 7.86 4.00 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 27 T 8.56 4.21 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 1.41 0.00 0.00 28 L 7.95 4.27 0.00 1.77 1.77 0.99 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.82 4.13 0.00 1.77 1.88 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.77 7.81 30 N 7.70 4.45 0.00 2.13 2.40 0.00 0.00 6.92 7.70 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 31 Y 7.87 4.62 0.00 3.10 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 32 I 7.36 4.81 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.57 0.99 0.00 0.00 33 T 8.12 4.28 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 1.26 0.00 0.00 34 E 8.73 4.11 0.00 1.97 2.06 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 2.32 2.39 0.00 35 S 8.35 4.21 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 36 G 7.66 3.42 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 0.00 37 K 8.10 3.99 0.00 1.97 2.00 0.00 1.53 0.00 0.00 1.89 0.00 0.00 3.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.46 7.81 38 I 8.14 4.26 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.88 0.91 0.00 0.00 39 V 8.09 4.03 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 0.72 0.00 0.00 1.00 0.00 0.00 40 P 0.00 4.54 0.00 1.95 2.05 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 41 S 8.86 4.62 0.00 3.99 4.09 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 42 R 8.05 4.09 0.00 2.02 2.23 0.00 2.97 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 43 I 7.57 4.05 1.89 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 1.48 0.55 0.92 0.00 0.00 44 T 8.14 4.18 4.38 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 1.23 0.00 0.00 45 G 7.55 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 46 T 8.46 3.66 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 47 R 8.71 3.94 0.00 0.67 1.27 0.00 2.88 0.00 0.00 2.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.26 0.00 48 A 8.20 4.01 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 49 K 7.94 3.82 0.00 1.80 1.85 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.59 7.81 50 Y 7.81 4.27 0.00 3.14 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 51 Q 7.91 3.90 0.00 2.35 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 52 R 7.79 3.96 0.00 2.07 1.95 0.00 3.19 0.00 0.00 3.09 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 53 Q 7.99 3.94 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 54 L 8.47 3.91 0.00 1.65 1.76 -0.17 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.49 3.91 1.37 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 0.00 0.00 0.00 56 R 7.58 3.73 0.00 2.02 1.95 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 57 A 7.55 4.05 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 58 I 7.60 3.64 1.95 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.87 0.87 0.00 0.00 59 K 7.97 3.59 0.00 1.57 1.37 0.00 1.61 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.34 1.51 7.81 60 R 8.21 3.49 0.00 1.58 1.42 0.00 2.99 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.33 0.00 61 A 8.21 4.06 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.47 4.29 0.00 1.87 1.57 0.00 2.79 0.00 0.00 2.46 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 63 Y 7.88 4.77 0.00 2.96 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 64 L 7.63 4.54 0.00 1.64 1.75 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 65 S 8.01 3.86 0.00 4.08 3.95 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 66 L 7.79 4.21 0.00 1.89 1.78 1.15 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 67 L 7.45 4.76 0.00 1.64 1.50 0.94 0.90 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 68 P 0.00 4.74 0.00 2.24 2.10 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 69 Y 8.90 4.09 0.00 2.95 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 70 T 7.53 4.70 4.33 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 1.29 0.00 0.00 71 D 9.27 4.53 0.00 2.85 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 72 R 7.69 4.01 0.00 1.88 2.01 0.00 3.37 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 73 H 7.85 4.20 0.00 3.10 3.07 0.00 5.84 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