NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 T 4.2835 8.1744 117.3745 62.5017 69.0748 174.9082 8 L 4.8786 7.9136 135.0000 56.8494 41.8538 173.3702 9 A 3.9677 7.9782 124.0296 54.4556 19.2724 177.2324 10 K 4.2986 8.0290 116.2324 56.0431 32.1647 175.7282 11 A 4.1969 8.1797 121.7937 53.1300 18.6030 178.2420 12 G 4.0114 8.8724 110.7976 46.2050 0.0000 175.2560 13 K 3.7782 7.7120 121.3862 60.0621 32.2654 177.5457 14 V 3.5761 7.9230 117.4238 65.9795 31.2990 177.5423 15 R 3.9139 7.9520 116.5305 59.5930 29.9422 179.0033 16 K 3.9444 7.6295 116.3156 59.6589 32.1971 178.9185 17 Q 4.2182 7.7929 115.7709 56.6101 28.9888 176.3972 18 T 4.1324 7.1707 118.4108 61.9198 69.1146 172.5947 19 P 4.2191 0.0000 0.0000 62.0335 31.3503 176.1509 20 K 3.9863 8.5063 125.4629 56.1758 31.5107 176.3106 21 V 3.9756 8.0372 126.0852 62.2010 32.4864 175.1971 22 E 4.5674 8.3439 123.9258 54.9024 31.2952 175.5372 23 K 4.3581 8.1412 119.7346 54.6663 33.3444 176.5584 24 K 3.8004 8.6185 123.3539 56.2420 31.0415 174.7325 25 D 4.2229 9.1057 123.5069 54.0716 38.6295 177.5809 26 K 4.7074 7.5883 122.6175 54.6333 30.1757 174.0473 27 P 4.4419 0.0000 0.0000 65.0790 32.6456 177.1246 28 R 4.2537 8.0792 112.7186 55.4750 31.3332 176.9782 29 K 4.4136 8.6100 118.1046 56.9774 35.8631 176.2891 30 T 4.4158 8.1441 116.4406 60.6236 69.2655 172.2793 31 P 4.1483 0.0000 0.0000 63.1764 31.2344 176.0007 32 K 4.4044 10.1346 123.2535 55.1720 33.5721 176.6214 33 G 3.7791 8.6448 112.6652 44.7347 0.0000 172.1629 34 R 3.9987 8.5377 119.4034 59.2721 29.6959 179.6918 35 S 4.1335 8.0284 113.7428 61.7049 63.1045 175.6041 36 Y 3.9571 8.0842 123.6444 60.2642 38.6074 178.2689 37 K 4.0174 8.2335 118.7118 59.0952 32.0829 179.3104 38 R 3.9061 8.0393 119.2894 59.5325 30.1449 178.2710 39 I 3.6328 8.0370 120.0076 64.4589 37.0898 178.2737 40 L 3.6977 7.7186 119.4318 58.0135 41.4941 178.6489 41 Y 4.2771 7.8845 119.3113 61.1759 38.3415 178.3608 42 N 4.0295 7.9367 116.1664 56.1489 38.8575 177.5181 43 R 4.0673 8.2922 116.1763 57.9645 29.5404 177.0565 44 R 4.2028 7.4759 113.3876 57.8141 31.0261 175.8948 45 Y 4.7773 7.2382 113.2712 56.9813 38.1899 175.6027 46 A 3.7088 7.3479 124.4040 50.7631 18.7624 177.4758 47 P 4.2327 0.0000 0.0000 66.3313 30.9541 178.2377 48 H 4.3628 8.2757 114.1786 58.0161 28.4605 176.9554 49 I 3.9628 7.4544 121.5425 62.9791 37.5021 177.2176 50 L 4.2732 7.7748 116.9867 55.9303 41.8155 178.4479 51 A 4.1266 7.4204 120.6706 54.4848 18.8572 178.1072 52 T 4.0269 7.0331 112.6796 63.3678 69.4274 173.9610 53 D 4.3464 8.1842 122.5337 53.2324 41.6062 176.3152 54 P 4.6438 0.0000 0.0000 63.5916 31.9806 176.6372 55 K 4.3964 7.8336 117.1434 56.7589 32.9956 176.8462 56 K 4.5681 7.5150 116.3308 55.6940 32.9706 175.7095 57 R 4.3891 7.7899 115.1772 54.2445 30.8552 176.3168 58 K 3.8869 8.1793 120.2499 56.3647 32.8219 176.4837 59 S 4.4614 8.4616 116.8825 57.4905 63.1869 173.8484 60 P 4.4497 0.0000 0.0000 64.2271 30.2989 176.7489 61 N 4.8341 9.0468 116.0801 54.2211 40.0417 176.1955 62 W 4.3747 8.3722 115.7841 58.7915 28.8681 176.0787 63 H 3.7609 6.8780 118.6044 54.6796 27.4298 176.6355 64 A 3.8333 7.7588 121.3727 53.8047 18.8090 178.6845 65 G 3.9351 8.8397 105.8354 45.4945 0.0000 175.1899 66 K 4.1998 7.9587 120.3597 54.9135 32.2977 177.1917 67 K 3.8862 8.6462 125.9954 60.1310 31.9400 178.5762 68 E 4.0867 8.1635 119.1178 58.4641 29.1251 178.1623 69 K 4.3221 7.8829 116.4815 57.3855 32.7737 178.3775 70 M 4.0439 8.3253 119.9553 58.6527 31.9499 177.7071 71 D 4.5029 7.5970 117.0138 56.9223 41.2293 178.2382 72 A 4.1508 7.4673 120.5657 54.9247 18.3676 179.4184 73 A 4.1962 7.6784 117.4051 55.2711 18.8472 177.3798 74 A 4.1612 7.5028 121.8512 52.5336 18.5516 177.1794 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 7 T 8.17 4.28 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 1.23 0.00 0.00 8 L 7.91 4.88 0.00 1.87 1.58 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.98 3.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.03 4.30 0.00 1.80 1.76 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.43 7.81 11 A 8.18 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 12 G 8.87 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 0.00 0.00 0.00 13 K 7.71 3.78 0.00 1.78 1.89 0.00 1.82 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.52 7.81 14 V 7.92 3.58 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 1.01 0.00 0.00 0.93 0.00 0.00 15 R 7.95 3.91 0.00 1.89 1.99 0.00 3.19 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 16 K 7.63 3.94 0.00 1.85 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.67 7.81 17 Q 7.79 4.22 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 18 T 7.17 4.13 4.36 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 1.21 0.00 0.00 19 P 0.00 4.22 0.00 2.17 2.08 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 20 K 8.51 3.99 0.00 1.73 1.80 0.00 1.76 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.42 7.81 21 V 8.04 3.98 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 0.86 0.00 0.00 0.97 0.00 0.00 22 E 8.34 4.57 0.00 1.98 1.85 0.00 0.00 0.00 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 2.25 0.00 23 K 8.14 4.36 0.00 1.73 1.72 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.44 7.81 24 K 8.62 3.80 0.00 1.73 1.81 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.44 7.81 25 D 9.11 4.22 0.00 2.77 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 26 K 7.59 4.71 0.00 1.79 1.83 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.51 7.81 27 P 0.00 4.44 0.00 2.03 2.11 0.00 3.61 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 28 R 8.08 4.25 0.00 1.76 1.66 0.00 3.41 0.00 0.00 3.28 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 29 K 8.61 4.41 0.00 1.82 1.75 0.00 1.52 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.46 7.81 30 T 8.14 4.42 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 1.24 0.00 0.00 31 P 0.00 4.15 0.00 2.25 2.15 0.00 3.83 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 2.16 2.07 0.00 32 K 10.13 4.40 0.00 1.73 1.76 0.00 1.72 0.00 0.00 1.53 0.00 0.00 2.71 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.25 1.27 7.81 33 G 8.64 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 0.00 0.00 0.00 34 R 8.54 4.00 0.00 1.90 1.99 0.00 3.21 0.00 0.00 3.40 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 35 S 8.03 4.13 0.00 4.14 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 36 Y 8.08 3.96 0.00 3.39 3.04 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 0.00 0.00 0.00 37 K 8.23 4.02 0.00 2.00 1.90 0.00 1.82 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.51 7.81 38 R 8.04 3.91 0.00 2.08 2.11 0.00 3.15 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 39 I 8.04 3.63 1.68 0.00 0.00 0.85 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 0.70 0.79 0.00 0.00 40 L 7.72 3.70 0.00 1.72 1.56 0.90 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 7.88 4.28 0.00 3.17 3.27 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 42 N 7.94 4.03 0.00 2.83 2.79 0.00 0.00 7.10 7.28 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 43 R 8.29 4.07 0.00 1.83 1.96 0.00 2.86 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.47 0.00 44 R 7.48 4.20 0.00 1.49 1.71 0.00 2.21 0.00 0.00 2.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.50 0.00 45 Y 7.24 4.78 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 46 A 7.35 3.71 1.08 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 0.00 0.00 47 P 0.00 4.23 0.00 2.29 2.41 0.00 3.63 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.11 0.00 48 H 8.28 4.36 0.00 3.37 3.56 0.00 5.44 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.45 3.96 1.94 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 1.42 0.18 0.93 0.00 0.00 50 L 7.77 4.27 0.00 1.63 1.73 1.06 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.42 4.13 1.45 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 0.00 0.00 0.00 52 T 7.03 4.03 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 1.19 0.00 0.00 53 D 8.18 4.35 0.00 2.76 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.64 0.00 2.18 2.16 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 55 K 7.83 4.40 0.00 1.74 1.87 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.36 1.43 7.81 56 K 7.52 4.57 0.00 1.80 1.70 0.00 1.98 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.30 7.81 57 R 7.79 4.39 0.00 1.89 1.89 0.00 3.07 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 58 K 8.18 3.89 0.00 1.56 1.13 0.00 1.29 0.00 0.00 0.61 0.00 0.00 2.51 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.62 1.07 7.81 59 S 8.46 4.46 0.00 4.07 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 60 P 0.00 4.45 0.00 2.19 2.18 0.00 3.86 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 2.04 2.01 0.00 61 N 9.05 4.83 0.00 2.75 2.76 0.00 0.00 6.96 8.51 0.00 0.00 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 W 8.37 4.37 0.00 3.39 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 H 6.88 3.76 0.00 2.96 2.90 0.00 5.65 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 7.76 3.83 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 65 G 8.84 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.96 4.20 0.00 1.79 1.79 0.00 1.74 0.00 0.00 1.90 0.00 0.00 3.09 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.51 1.44 7.81 67 K 8.65 3.89 0.00 1.96 2.07 0.00 1.49 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.55 7.81 68 E 8.16 4.09 0.00 2.10 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 2.41 2.47 0.00 69 K 7.88 4.32 0.00 1.87 2.10 0.00 1.80 0.00 0.00 1.98 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.58 1.55 7.81 70 M 8.33 4.04 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 71 D 7.60 4.50 0.00 2.84 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 72 A 7.47 4.15 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.68 4.20 1.70 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 74 A 7.50 4.16 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