NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3106 8.2649 123.5811 51.5807 21.0087 176.6559 3 K 4.2941 7.7720 115.1358 56.0146 33.7717 173.6574 4 H 3.3903 7.5798 110.1676 59.4566 30.4509 172.7562 5 P 4.3648 0.0000 0.0000 63.2470 32.2268 176.6301 6 V 4.3949 8.0178 120.8912 60.4561 34.5283 172.0435 7 P 4.2560 0.0000 0.0000 62.9886 31.4846 176.4283 8 K 4.1735 8.6675 124.7010 58.4860 32.6241 176.8175 9 K 4.6163 7.5472 115.5919 53.8925 36.0516 175.6130 10 K 3.9162 8.6333 123.4026 56.5655 32.3394 176.6801 11 T 3.9967 8.4609 117.6968 61.1421 69.3475 174.9980 12 S 4.2787 8.6897 121.6518 58.3551 64.7776 175.4692 13 K 3.9104 8.6405 122.4952 60.1484 32.1688 179.0669 14 A 3.9338 7.9042 121.4879 55.1426 18.3826 179.3842 15 R 3.8210 8.1556 116.7709 59.3588 29.8239 178.7231 16 R 3.9035 8.0777 118.3523 59.5463 30.6156 177.7199 17 D 4.4764 8.3927 118.4782 57.2373 40.8500 178.6478 18 A 3.9710 8.1604 121.3245 55.4933 18.1874 179.4967 19 R 3.9536 7.4919 115.5223 59.6098 30.0309 177.6510 20 R 4.5088 7.4862 115.5115 56.5284 30.5302 178.6963 21 S 4.2112 8.1307 114.7730 61.8907 61.8348 174.7272 22 H 4.6706 7.9298 116.0903 56.3182 28.6471 176.6826 23 H 4.1917 7.7544 120.1715 58.2634 29.9374 175.7650 24 A 4.1029 7.1389 122.6253 52.1438 18.6068 177.2426 25 L 4.3729 8.2564 121.6002 54.5274 42.6475 176.5628 26 T 4.6196 7.9939 109.4696 58.8203 71.1031 172.2708 27 P 4.3299 0.0000 0.0000 62.1767 31.6967 174.1590 28 P 4.4965 0.0000 0.0000 62.7019 31.7912 175.4559 29 I 4.5818 8.0909 119.7431 59.7939 39.3010 175.1240 30 L 5.0166 8.4370 125.2716 53.3235 46.0468 176.0639 31 V 4.6097 9.1087 113.5368 58.9564 36.3250 173.3362 32 P 4.9238 0.0000 0.0000 63.0254 31.8843 175.8417 33 C 4.6996 8.2846 118.3732 56.1815 31.3166 172.2031 34 P 4.5365 0.0000 0.0000 66.0118 32.5550 178.0633 35 E 4.2525 8.4183 116.9368 56.1704 27.7872 179.4548 36 C 4.3409 9.1665 130.4287 59.7504 32.5243 172.6097 37 K 3.9058 8.4465 121.4964 57.1624 32.3815 176.5171 38 A 4.1348 7.2597 120.4300 53.6543 19.6825 176.4940 39 M 4.7786 8.5377 119.5551 54.2704 33.0335 175.8848 40 K 4.7652 8.9686 124.3903 53.6399 35.2345 174.2419 41 P 4.8586 0.0000 0.0000 61.3690 32.0069 174.4796 42 P 4.0750 0.0000 0.0000 64.6165 32.3252 175.4950 43 H 3.9548 8.7942 116.2808 56.1871 25.2183 173.5250 44 T 4.3950 6.9075 113.5949 62.7367 73.3888 174.9246 45 V 3.6052 7.6329 125.9081 63.9614 32.1687 174.5178 46 C 5.1599 8.0034 119.5004 58.2543 33.8110 172.2450 47 P 4.3148 0.0000 0.0000 63.7651 31.4702 175.0132 48 E 3.8060 8.6954 117.8268 56.8958 28.0056 173.8025 49 C 4.7549 8.4762 116.2517 58.8061 39.2268 174.7441 50 G 3.8197 8.1216 107.8953 47.1124 0.0000 170.3350 51 Y 4.7097 7.7129 120.2382 57.7436 41.7331 172.9560 52 Y 4.6316 6.0155 117.2837 55.7077 40.9045 175.1568 53 A 4.1219 8.7881 123.2416 52.9661 18.8392 177.1216 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 A 8.26 4.31 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 3 K 7.77 4.29 0.00 1.78 1.70 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.50 7.81 4 H 7.58 3.39 0.00 3.16 3.14 0.00 5.73 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.36 0.00 2.18 2.08 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 6 V 8.02 4.39 2.09 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 0.79 0.00 0.00 1.01 0.00 0.00 7 P 0.00 4.26 0.00 2.08 2.00 0.00 3.73 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 2.03 2.09 0.00 8 K 8.67 4.17 0.00 1.70 1.83 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.08 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.52 7.81 9 K 7.55 4.62 0.00 1.72 1.63 0.00 1.83 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.36 7.81 10 K 8.63 3.92 0.00 1.71 1.74 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.43 7.81 11 T 8.46 4.00 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 12 S 8.69 4.28 0.00 4.07 4.05 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 13 K 8.64 3.91 0.00 2.00 2.11 0.00 1.50 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.49 1.51 7.81 14 A 7.90 3.93 1.33 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 0.00 0.00 0.00 15 R 8.16 3.82 0.00 1.91 1.95 0.00 3.10 0.00 0.00 3.10 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 16 R 8.08 3.90 0.00 1.85 2.08 0.00 3.32 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 17 D 8.39 4.48 0.00 2.72 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.16 3.97 1.39 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 0.00 0.00 19 R 7.49 3.95 0.00 1.78 2.21 0.00 3.29 0.00 0.00 3.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 20 R 7.49 4.51 0.00 2.02 1.90 0.00 3.19 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 21 S 8.13 4.21 0.00 4.07 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.93 4.67 0.00 3.27 3.32 0.00 5.87 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 7.75 4.19 0.00 3.21 3.32 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.14 4.10 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 25 L 8.26 4.37 0.00 1.66 1.63 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.99 4.62 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 1.22 0.00 0.00 27 P 0.00 4.33 0.00 2.20 2.11 0.00 3.77 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 2.00 0.00 28 P 0.00 4.50 0.00 2.06 2.04 0.00 3.63 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 2.10 0.00 29 I 8.09 4.58 1.88 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 1.35 1.38 0.92 0.00 0.00 30 L 8.44 5.02 0.00 1.46 1.50 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 31 V 9.11 4.61 2.09 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 0.73 0.00 0.00 0.95 0.00 0.00 32 P 0.00 4.92 0.00 1.95 1.99 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 33 C 8.28 4.70 0.00 3.08 2.97 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 34 P 0.00 4.54 0.00 2.28 2.30 0.00 3.89 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.22 0.00 35 E 8.42 4.25 0.00 2.02 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.43 0.00 36 C 9.17 4.34 0.00 2.97 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 37 K 8.45 3.91 0.00 1.77 1.81 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.44 7.81 38 A 7.26 4.13 1.22 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 0.00 0.00 39 M 8.54 4.78 0.00 1.91 2.03 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 2.55 2.51 0.00 40 K 8.97 4.77 0.00 1.65 1.66 0.00 1.67 0.00 0.00 1.89 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.36 7.81 41 P 0.00 4.86 0.00 2.06 2.04 0.00 3.37 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.82 0.00 42 P 0.00 4.07 0.00 2.13 2.02 0.00 3.83 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 2.13 0.00 43 H 8.79 3.95 0.00 3.29 3.34 0.00 5.74 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 6.91 4.39 4.17 0.00 0.00 0.00 0.00 0.00 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 45 V 7.63 3.61 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 0.62 0.00 0.00 0.65 0.00 0.00 46 C 8.00 5.16 0.00 2.97 2.73 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 0.00 0.00 0.00 47 P 0.00 4.31 0.00 2.21 2.03 0.00 3.95 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 48 E 8.70 3.81 0.00 2.08 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 2.34 0.00 49 C 8.48 4.75 0.00 2.95 3.01 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 50 G 8.12 3.82 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 0.00 0.00 0.00 51 Y 7.71 4.71 0.00 2.68 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 52 Y 6.02 4.63 0.00 2.87 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.79 4.12 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