NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9389 8.3549 109.7370 45.1418 0.0000 173.5839 3 K 3.8993 8.5859 122.2233 55.6424 32.8835 170.7952 4 V 4.5387 8.6132 121.3169 61.4455 35.6610 173.6227 5 Y 5.0317 8.8692 123.8254 56.0760 41.2605 174.6414 6 K 4.5383 8.3840 121.7650 54.4429 35.8426 174.8118 7 K 4.9288 8.5009 124.2566 54.6879 34.7554 175.8116 8 V 4.5384 8.8160 118.1626 59.5138 34.9982 174.2526 9 E 5.0727 8.7215 124.5292 54.8028 30.8376 174.8792 10 L 4.9307 8.9741 126.3505 52.8325 46.3415 175.8421 11 V 4.7398 8.2983 119.7775 61.3033 33.6382 175.0290 12 G 4.2115 8.8713 116.2258 45.5395 0.0000 171.9482 13 T 5.7923 8.0267 110.9706 59.0566 72.3639 172.9018 14 S 4.6748 8.3070 114.4751 57.9178 65.3799 175.1808 15 E 4.5662 9.1212 124.4251 57.4572 30.0165 177.0617 16 E 4.3991 8.2257 118.0229 56.9155 30.9906 175.8950 17 G 3.4173 7.1889 105.6378 43.9565 0.0000 173.8508 18 L 3.7576 7.3547 118.3386 57.8262 41.4442 179.5788 19 E 3.8894 8.0420 117.7364 59.4249 29.4133 179.1646 20 A 3.9227 7.9003 119.9881 55.0300 18.5637 179.3959 21 A 4.0727 7.8403 118.8925 55.2656 18.4760 179.9411 22 I 3.4707 7.7407 118.2621 64.6826 37.1075 178.6804 23 Q 3.8924 8.2726 118.9106 58.8083 28.4601 178.8745 24 A 3.9106 8.1256 121.6132 55.0537 18.3793 179.5759 25 A 3.8787 7.8197 119.0322 55.3218 18.4543 179.9162 26 L 3.8403 7.9261 117.2916 57.7486 41.3943 179.6391 27 A 3.9664 8.0085 120.3761 55.0532 18.7209 179.3825 28 R 3.9174 8.0193 117.1334 59.2808 30.0596 178.5008 29 A 3.8798 8.1038 120.8187 55.2191 18.1765 179.5916 30 R 3.7503 7.7330 115.7441 59.2483 30.0774 178.5411 31 K 4.1298 7.6610 117.7396 58.6563 32.1064 177.6392 32 T 4.4844 7.7057 105.3611 60.6476 70.5076 173.5302 33 L 4.4611 7.7457 121.9729 52.8780 43.7364 175.7913 34 R 4.5265 7.8554 119.4085 55.4263 33.3508 174.8599 35 H 4.1966 8.4878 113.0695 56.8988 26.1102 175.3548 36 L 4.6135 8.1210 118.6279 55.3105 42.2845 176.3303 37 D 5.2156 9.3099 123.1113 55.3401 43.4998 176.0627 38 W 5.4555 7.8233 113.1969 55.3214 31.8403 173.2256 39 F 5.3237 8.2320 114.0507 55.3635 41.0513 173.7543 40 E 4.7404 9.3426 118.9446 54.6796 33.3929 174.9930 41 V 4.2589 8.7499 125.1529 62.9622 31.7021 175.4632 42 K 4.4880 9.2842 127.7642 58.1781 33.5092 176.8213 43 E 4.8404 7.8723 116.7076 55.0827 34.3266 174.4341 44 I 5.0434 8.3307 122.7604 59.8508 40.3505 174.8648 45 R 4.5608 8.7899 123.6728 56.8811 33.0336 173.5631 46 G 4.2314 7.9774 105.5945 47.1208 0.0000 172.2961 47 T 4.7727 7.9906 109.9416 59.9910 71.7227 173.5602 48 I 4.8630 8.2222 122.6275 59.8421 40.1050 175.4043 49 G 4.1369 9.2425 114.8271 43.9920 0.0000 172.5478 50 E 3.9194 8.9037 115.8587 58.5820 29.4375 177.2213 51 A 4.6342 8.0018 121.4956 51.9042 20.8891 176.8861 52 G 3.9426 8.0799 113.1419 45.7442 0.0000 177.9953 53 V 3.7861 8.5081 120.7542 62.7198 32.0512 173.9509 54 K 4.3243 8.7423 129.0436 57.8612 33.1246 176.1892 55 E 4.8290 7.8226 118.4782 54.7406 33.8088 174.0396 56 Y 4.6449 9.3626 122.3968 57.2557 40.0712 174.6644 57 Q 4.8800 9.5209 122.2658 54.2709 32.5606 174.4627 58 V 4.6468 8.7948 125.4997 61.0629 33.8873 174.5390 59 V 4.6944 8.8070 129.8004 62.0609 32.6971 174.7935 60 L 5.2737 9.1863 127.4435 54.3986 44.6271 174.5871 61 E 5.0058 9.3006 119.8833 54.8380 31.9982 175.1837 62 V 4.4918 8.9887 124.4928 61.0431 34.1151 174.2592 63 G 2.9645 8.1616 116.1064 44.0907 0.0000 172.3481 64 F 5.6549 8.3544 118.4618 55.0082 41.9178 173.5844 65 R 4.0880 8.8897 121.6382 56.0742 30.5416 175.9542 66 L 4.5371 8.2268 126.4950 53.8382 42.8023 176.8511 67 E 4.0585 8.6975 122.1957 56.3347 30.0572 177.8434 68 E 4.2024 8.6449 124.2055 55.3503 27.8866 176.6648 69 T 4.1046 7.8978 119.2461 63.1273 68.2738 173.6702 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 G 8.35 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 3 K 8.59 3.90 0.00 1.85 1.43 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.46 7.81 4 V 8.61 4.54 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 1.08 0.00 0.00 0.92 0.00 0.00 5 Y 8.87 5.03 0.00 3.03 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 6 K 8.38 4.54 0.00 1.43 0.74 0.00 1.57 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.16 1.27 7.81 7 K 8.50 4.93 0.00 1.62 1.79 0.00 2.09 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.08 1.43 7.81 8 V 8.82 4.54 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 0.90 0.00 0.00 1.10 0.00 0.00 9 E 8.72 5.07 0.00 2.13 1.86 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 2.22 2.46 0.00 10 L 8.97 4.93 0.00 1.55 1.47 0.87 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.30 4.74 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 0.85 0.00 0.00 0.94 0.00 0.00 12 G 8.87 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.03 5.79 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 1.22 0.00 0.00 14 S 8.31 4.67 0.00 3.90 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 15 E 9.12 4.57 0.00 2.03 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 2.51 2.36 0.00 16 E 8.23 4.40 0.00 1.96 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 2.30 2.27 0.00 17 G 7.19 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 18 L 7.35 3.76 0.00 1.56 1.63 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.04 3.89 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 20 A 7.90 3.92 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 21 A 7.84 4.07 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 22 I 7.74 3.47 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.95 0.29 0.00 0.00 23 Q 8.27 3.89 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 24 A 8.13 3.91 1.36 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 0.00 0.00 0.00 25 A 7.82 3.88 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 26 L 7.93 3.84 0.00 1.74 1.65 0.68 0.54 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 27 A 8.01 3.97 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 28 R 8.02 3.92 0.00 1.92 2.03 0.00 3.12 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 29 A 8.10 3.88 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 30 R 7.73 3.75 0.00 1.90 2.12 0.00 3.25 0.00 0.00 3.20 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 31 K 7.66 4.13 0.00 1.90 1.82 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.65 1.55 7.81 32 T 7.71 4.48 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 1.16 0.00 0.00 33 L 7.75 4.46 0.00 1.33 0.77 0.41 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 34 R 7.86 4.53 0.00 1.66 1.48 0.00 3.32 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.52 0.00 35 H 8.49 4.20 0.00 3.66 3.47 0.00 5.62 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 36 L 8.12 4.61 0.00 1.69 1.67 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 37 D 9.31 5.22 0.00 3.02 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 38 W 7.82 5.46 0.00 3.24 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 39 F 8.23 5.32 0.00 3.03 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 9.34 4.74 0.00 1.98 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 2.41 2.53 0.00 41 V 8.75 4.26 2.18 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 0.83 0.00 0.00 1.11 0.00 0.00 42 K 9.28 4.49 0.00 1.65 1.87 0.00 1.82 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.58 7.81 43 E 7.87 4.84 0.00 1.90 1.80 0.00 0.00 0.00 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 2.37 0.00 44 I 8.33 5.04 1.92 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 1.44 0.65 0.99 0.00 0.00 45 R 8.79 4.56 0.00 1.82 2.03 0.00 2.98 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 46 G 7.98 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 47 T 7.99 4.77 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 48 I 8.22 4.86 1.84 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.62 0.92 0.00 0.00 49 G 9.24 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 0.00 0.00 0.00 50 E 8.90 3.92 0.00 2.06 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 0.00 2.27 2.36 0.00 51 A 8.00 4.63 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 52 G 8.08 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 53 V 8.51 3.79 1.77 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 -0.27 0.00 0.00 0.64 0.00 0.00 54 K 8.74 4.32 0.00 1.78 1.83 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.34 1.36 7.81 55 E 7.82 4.83 0.00 1.77 1.75 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 2.18 2.39 0.00 56 Y 9.36 4.64 0.00 3.07 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 57 Q 9.52 4.88 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 58 V 8.79 4.65 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 0.94 0.00 0.00 0.94 0.00 0.00 59 V 8.81 4.69 2.18 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 0.82 0.00 0.00 0.95 0.00 0.00 60 L 9.19 5.27 0.00 1.95 1.75 0.90 0.44 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 61 E 9.30 5.01 0.00 1.90 1.87 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 2.28 2.42 0.00 62 V 8.99 4.49 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 0.95 0.00 0.00 0.91 0.00 0.00 63 G 8.16 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.35 5.65 0.00 3.39 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 65 R 8.89 4.09 0.00 1.84 1.85 0.00 3.04 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.91 0.00 66 L 8.23 4.54 0.00 1.57 1.55 0.86 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.70 4.06 0.00 1.98 1.90 0.00 0.00 0.00 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 2.30 0.00 68 E 8.64 4.20 0.00 1.89 1.87 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 2.27 2.31 0.00 69 T 7.90 4.10 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