NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.3624 8.1849 120.6390 53.7876 43.9461 176.6132 5 L 4.6178 7.8866 117.1620 51.1980 43.9013 174.2463 6 T 4.6956 8.0225 112.4267 59.6121 72.2232 174.2652 7 E 4.2516 8.8354 119.7921 58.8569 29.7314 176.4678 8 T 4.8770 7.8844 115.6271 61.7450 70.9090 173.4535 9 M 4.8491 9.1142 127.4969 53.0286 34.8211 173.2121 10 P 5.1325 0.0000 0.0000 62.3614 33.3538 174.9984 11 F 5.2525 8.5136 115.3173 55.4912 41.6551 173.3328 12 R 5.2639 8.7111 115.4044 54.8150 32.6340 174.0675 13 M 5.0764 9.3060 120.3998 54.0833 36.0634 173.8504 14 T 5.1865 8.6074 114.3424 60.1585 71.9666 172.7648 15 M 4.8878 9.2362 123.7994 53.9101 35.9824 173.3224 16 E 4.7866 8.5258 125.4875 54.6813 33.2624 174.2093 17 G 3.8175 7.5724 111.8226 46.0779 0.0000 171.8719 18 T 5.3746 8.3620 115.5396 61.8216 72.3297 174.2406 19 V 4.1514 8.7565 125.6834 61.9492 33.6148 175.0437 20 N 4.2703 9.9977 125.2368 54.2462 36.0493 175.4510 21 G 3.8268 8.5107 106.1123 45.4327 0.0000 173.7205 22 H 4.7010 7.9839 118.1122 54.9368 29.1539 174.1614 23 H 5.3837 8.6121 122.3211 55.5974 30.3413 174.4137 24 F 5.2389 8.7848 115.7468 55.7578 41.8661 173.2033 25 K 5.1541 9.2475 118.3487 55.0430 36.2755 175.2859 26 C 5.6166 9.6164 120.8483 58.2497 32.5887 173.1133 27 T 5.1837 8.9389 111.0600 60.1040 72.0165 173.0381 28 G 4.6361 9.3001 109.2887 44.7970 0.0000 171.6398 29 K 5.0465 9.0312 121.1888 54.7333 36.7844 175.9624 30 G 3.7151 8.1040 110.2114 46.0770 0.0000 171.2269 31 E 5.0601 8.2369 116.1221 55.9517 33.3814 174.6392 32 G 4.4299 8.6309 106.5851 46.2607 0.0000 171.3371 33 N 5.7806 8.4513 119.2358 50.6656 39.3096 174.2548 34 P 4.1307 0.0000 0.0000 65.0645 31.6195 177.8523 35 F 4.5515 8.1368 115.8882 58.5224 39.4033 176.3481 36 E 4.3690 8.5553 116.0362 55.4413 30.1260 175.9224 37 G 3.8766 8.0602 107.9586 47.2036 0.0000 173.5079 38 T 4.9161 7.4269 108.1855 59.7965 72.2073 172.5585 39 Q 5.2102 8.2135 118.0523 55.7697 31.2277 172.8522 40 D 5.2752 9.1722 120.6211 53.0531 45.0407 174.5879 41 M 5.2400 8.5949 117.1733 54.0595 34.7600 173.8131 42 K 4.6759 9.3017 119.5700 54.7266 35.0900 175.2690 43 I 4.9784 8.3054 124.4933 59.4134 40.1421 174.3333 44 E 4.5939 9.1529 127.8797 54.1898 32.4058 174.8837 45 V 4.4917 8.5022 127.3893 62.7518 31.3404 175.1898 46 I 4.3753 8.7393 122.3557 61.6089 39.1436 175.8572 47 E 4.5802 7.8775 121.5804 55.4575 33.8924 176.2983 48 G 3.9848 8.6078 110.1167 46.6546 0.0000 173.6827 49 G 3.9671 7.7256 107.7332 43.1451 0.0000 172.4000 50 P 4.2954 0.0000 0.0000 61.7683 32.0012 176.3750 51 L 3.5840 8.3179 121.1575 55.0552 41.6558 175.0385 52 P 4.6383 0.0000 0.0000 62.3321 31.4042 175.2412 53 F 4.8552 6.7819 111.7731 55.2151 40.8354 173.6664 54 A 4.0689 8.6991 124.3750 52.2249 18.5535 178.5177 55 F 4.0836 9.0128 125.4528 61.4151 39.2665 176.5560 56 D 4.5681 8.4668 118.5253 57.4919 40.3449 178.4058 57 I 3.8811 7.4700 111.5712 62.6065 37.9036 177.0713 58 L 4.3273 7.7249 120.4814 54.7637 42.2213 178.2647 59 S 4.0630 7.3132 116.1876 61.9371 62.8364 176.5982 60 T 4.1431 7.8019 106.4272 63.1454 68.6406 174.7051 61 S 4.5817 7.8454 117.6071 58.8657 63.9785 173.9468 62 C 4.3766 7.7771 122.8520 59.9841 27.8751 173.3046 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 4 L 8.18 4.36 0.00 1.67 1.83 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 5 L 7.89 4.62 0.00 1.81 1.56 0.79 0.52 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 6 T 8.02 4.70 4.30 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 1.26 0.00 0.00 7 E 8.84 4.25 0.00 2.23 2.32 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 2.43 2.32 0.00 8 T 7.88 4.88 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 1.23 0.00 0.00 9 M 9.11 4.85 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 10 P 0.00 5.13 0.00 2.06 1.97 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 1.97 1.96 0.00 11 F 8.51 5.25 0.00 3.10 3.12 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 0.00 0.00 0.00 12 R 8.71 5.26 0.00 1.81 1.91 0.00 3.00 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 13 M 9.31 5.08 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.67 0.00 14 T 8.61 5.19 4.26 0.00 0.00 0.00 0.00 0.00 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 15 M 9.24 4.89 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 16 E 8.53 4.79 0.00 1.87 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.16 0.00 17 G 7.57 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 18 T 8.36 5.37 4.26 0.00 0.00 0.00 0.00 0.00 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 19 V 8.76 4.15 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.69 0.00 0.00 20 N 10.00 4.27 0.00 2.86 2.87 0.00 0.00 7.34 7.65 0.00 0.00 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 G 8.51 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 H 7.98 4.70 0.00 3.57 3.42 0.00 5.61 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.61 5.38 0.00 3.15 3.21 0.00 5.61 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 8.78 5.24 0.00 3.32 3.22 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 25 K 9.25 5.15 0.00 1.73 1.70 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.27 1.37 7.81 26 C 9.62 5.62 0.00 2.99 2.94 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 27 T 8.94 5.18 4.28 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 1.25 0.00 0.00 28 G 9.30 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 9.03 5.05 0.00 1.61 1.54 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.35 7.81 30 G 8.10 3.72 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 0.00 0.00 0.00 31 E 8.24 5.06 0.00 2.08 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 2.11 2.23 0.00 32 G 8.63 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 N 8.45 5.78 0.00 2.84 2.77 0.00 0.00 7.15 7.02 0.00 0.00 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 4.13 0.00 1.06 1.71 0.00 3.81 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 35 F 8.14 4.55 0.00 3.08 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 36 E 8.56 4.37 0.00 2.11 2.13 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 2.27 2.33 0.00 37 G 8.06 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.43 4.92 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 1.23 0.00 0.00 39 Q 8.21 5.21 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.78 0.00 0.00 0.00 0.00 0.00 2.22 2.42 0.00 40 D 9.17 5.28 0.00 2.65 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.59 5.24 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.74 0.00 42 K 9.30 4.68 0.00 1.62 1.69 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.35 7.81 43 I 8.31 4.98 1.78 0.00 0.00 1.00 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 0.62 1.19 0.00 0.00 44 E 9.15 4.59 0.00 1.98 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 0.00 2.19 2.19 0.00 45 V 8.50 4.49 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 0.92 0.00 0.00 0.93 0.00 0.00 46 I 8.74 4.38 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 1.35 0.83 0.94 0.00 0.00 47 E 7.88 4.58 0.00 2.02 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 2.32 2.33 0.00 48 G 8.61 3.98 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 0.00 0.00 0.00 49 G 7.73 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 0.00 0.00 0.00 50 P 0.00 4.30 0.00 2.12 2.02 0.00 3.77 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 51 L 8.32 3.58 0.00 1.36 1.20 0.56 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 52 P 0.00 4.64 0.00 2.01 2.01 0.00 3.34 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 1.83 1.78 0.00 53 F 6.78 4.86 0.00 3.03 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 54 A 8.70 4.07 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.01 4.08 0.00 3.06 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 56 D 8.47 4.57 0.00 2.76 2.75 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 57 I 7.47 3.88 1.79 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.44 0.89 0.00 0.00 58 L 7.72 4.33 0.00 0.81 1.46 0.65 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.31 4.06 0.00 3.91 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 60 T 7.80 4.14 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 61 S 7.85 4.58 0.00 4.00 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 62 C 7.78 4.38 0.00 3.22 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