NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 L 4.3073 8.1849 122.4930 54.8657 43.1979 175.7027 14 E 4.3378 8.7023 125.6869 53.2469 31.1282 173.3614 15 T 5.0398 8.6640 114.3063 60.1800 72.2249 173.1613 16 F 4.8793 8.9828 120.8346 54.9919 43.5675 172.9526 17 P 4.3728 0.0000 0.0000 62.6763 32.1803 177.1328 18 L 3.9054 8.5952 124.5677 58.7964 41.8751 179.3166 19 D 4.3321 8.1062 117.0793 57.2439 40.8986 178.2917 20 V 3.5869 7.6754 117.7455 65.9534 31.7642 177.6247 21 L 4.1006 7.7611 117.7406 57.4877 41.4738 179.3340 22 V 4.0410 7.7301 118.9170 64.1732 32.8369 177.1601 23 N 4.9747 8.1046 115.1857 51.5141 36.5265 174.9354 24 T 4.5987 6.9795 114.9947 61.2680 73.3720 174.6878 25 A 4.0790 8.4476 127.8550 51.8249 19.4461 177.9992 26 A 3.9837 8.9216 124.0361 55.6077 18.1213 180.3812 27 E 3.9951 8.0970 113.5269 58.9646 29.8951 177.8701 28 D 4.5528 7.7446 117.7178 53.4797 41.6792 176.4859 29 L 3.9061 6.8948 122.1424 54.0262 42.9172 174.9067 30 P 4.2176 0.0000 0.0000 62.4838 31.7686 177.5598 31 R 3.8739 8.6799 118.5802 59.2869 29.2586 177.6828 32 G 3.9404 8.0072 103.8585 44.9434 0.0000 172.7960 33 V 3.6284 7.2662 120.3836 60.5237 32.8139 174.7702 34 D 4.5328 8.5383 127.0499 53.0976 41.0487 174.9439 35 P 4.2277 0.0000 0.0000 65.1807 31.4517 177.5003 36 S 4.4023 8.3019 112.1445 58.9394 63.8087 174.0040 37 A 5.0633 7.9413 123.6782 49.8877 19.0970 177.8922 38 K 4.1232 8.3057 123.5957 59.7250 32.6912 179.9638 39 E 4.1721 8.4252 116.4464 59.3075 29.5018 178.6151 40 N 4.4101 8.2848 115.9172 55.5674 38.7875 175.3083 41 H 4.8432 8.5141 114.9530 55.4048 29.1789 174.4579 42 L 4.7882 7.5497 120.1323 53.3953 42.8404 177.3808 43 S 4.4038 8.3606 116.6309 58.2969 65.0322 175.0931 44 D 4.3850 8.6130 122.0712 57.5120 40.4859 178.7808 45 E 3.9591 8.1323 119.2507 59.5158 29.6979 178.5211 46 D 4.3501 8.2996 118.9647 57.1660 40.7974 178.4978 47 F 3.9984 8.6528 121.6200 61.1466 39.4254 177.0820 48 K 4.0884 8.5226 119.1108 59.5597 31.7921 178.6613 49 A 3.9548 7.9426 120.0295 55.0068 18.3566 179.5784 50 V 3.3150 7.7066 116.0596 65.6962 30.9212 177.5660 51 F 4.4714 8.0740 116.9201 56.6525 39.2316 177.7067 52 G 3.9619 8.3264 105.1571 45.8656 0.0000 172.5002 53 M 4.9474 7.5435 116.0849 52.3523 34.6977 175.2425 54 T 4.2736 8.2816 109.6312 61.4360 71.0483 175.5641 55 R 3.4304 8.1643 120.7451 59.2886 30.1061 179.3158 56 S 4.0302 7.9460 112.2776 61.2372 62.2626 175.8903 57 A 4.0132 7.9057 122.5265 55.0789 18.4232 179.0561 58 F 4.1600 8.5632 119.0263 61.4352 39.3189 177.2659 59 A 4.0005 8.1618 118.9989 54.5678 18.2207 178.4814 60 N 4.4729 7.5863 112.7450 53.4234 39.2203 175.6753 61 L 4.0492 6.6764 120.6165 53.2513 42.6737 175.7644 62 P 4.1742 0.0000 0.0000 62.1623 33.0681 177.3361 63 L 3.8203 8.3806 122.5204 58.2882 41.9591 179.6048 64 W 4.4070 8.0532 115.8922 59.4558 27.8909 177.9941 65 K 3.7018 6.5815 119.9516 58.8961 31.6236 178.5646 66 Q 3.5644 7.6070 118.3478 58.9761 28.6202 178.9274 67 Q 4.2672 8.3120 119.0652 59.2689 28.3892 178.7635 68 N 4.3440 8.4047 117.4577 56.2469 38.7143 177.5119 69 L 4.0196 8.2777 120.5479 57.8974 41.7518 179.7816 70 K 4.3474 8.5430 118.3907 59.1221 32.0698 179.5163 71 K 4.0087 8.1956 119.0261 59.7648 31.8406 179.2656 72 E 4.0538 7.5429 116.5018 58.9906 29.5070 178.1485 73 K 4.0756 7.6316 115.0123 56.3742 31.9398 177.7012 74 G 3.9354 8.1858 107.5519 46.0543 0.0000 174.7905 75 L 4.6695 7.9910 117.0086 54.0931 42.3270 176.4830 76 F 4.5234 8.2672 126.5434 58.5013 39.3721 174.8082 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 13 L 8.18 4.31 0.00 1.62 1.65 0.97 0.57 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 14 E 8.70 4.34 0.00 2.40 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 2.33 2.42 0.00 15 T 8.66 5.04 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 1.19 0.00 0.00 16 F 8.98 4.88 0.00 2.91 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 17 P 0.00 4.37 0.00 2.13 2.00 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 18 L 8.60 3.91 0.00 1.87 1.68 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.11 4.33 0.00 2.83 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.68 3.59 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.99 0.00 0.00 21 L 7.76 4.10 0.00 1.86 1.76 1.21 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 22 V 7.73 4.04 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 1.05 0.00 0.00 1.01 0.00 0.00 23 N 8.10 4.97 0.00 2.86 2.74 0.00 0.00 6.84 8.23 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 24 T 6.98 4.60 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 1.14 0.00 0.00 25 A 8.45 4.08 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 26 A 8.92 3.98 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 27 E 8.10 4.00 0.00 2.11 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 0.00 2.25 2.33 0.00 28 D 7.74 4.55 0.00 2.80 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 29 L 6.89 3.91 0.00 1.58 1.47 0.79 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.22 0.00 1.41 1.57 0.00 3.22 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.65 0.00 31 R 8.68 3.87 0.00 1.91 2.07 0.00 3.04 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 32 G 8.01 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 33 V 7.27 3.63 1.98 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 0.66 0.00 0.00 0.60 0.00 0.00 34 D 8.54 4.53 0.00 2.80 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 4.23 0.00 2.01 2.04 0.00 3.69 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 36 S 8.30 4.40 0.00 3.98 3.89 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 0.00 0.00 0.00 37 A 7.94 5.06 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 38 K 8.31 4.12 0.00 2.05 1.97 0.00 1.89 0.00 0.00 1.99 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.62 7.81 39 E 8.43 4.17 0.00 2.20 2.27 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 2.51 2.25 0.00 40 N 8.28 4.41 0.00 2.79 2.81 0.00 0.00 6.94 7.45 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 41 H 8.51 4.84 0.00 3.46 3.63 0.00 5.60 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.55 4.79 0.00 1.94 1.72 1.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.36 4.40 0.00 4.06 4.02 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 0.00 0.00 0.00 0.00 44 D 8.61 4.38 0.00 2.72 2.78 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 45 E 8.13 3.96 0.00 2.05 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 2.39 2.42 0.00 46 D 8.30 4.35 0.00 2.79 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 47 F 8.65 4.00 0.00 3.30 3.23 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 48 K 8.52 4.09 0.00 2.06 2.09 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.53 7.81 49 A 7.94 3.95 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 50 V 7.71 3.32 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.32 0.00 0.00 0.75 0.00 0.00 51 F 8.07 4.47 0.00 2.51 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 52 G 8.33 3.96 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 53 M 7.54 4.95 0.00 2.39 2.13 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 2.78 2.69 0.00 54 T 8.28 4.27 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 1.24 0.00 0.00 55 R 8.16 3.43 0.00 1.57 1.63 0.00 2.81 0.00 0.00 2.85 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.82 0.00 56 S 7.95 4.03 0.00 3.85 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 57 A 7.91 4.01 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 58 F 8.56 4.16 0.00 3.25 3.35 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 59 A 8.16 4.00 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 60 N 7.59 4.47 0.00 2.85 2.82 0.00 0.00 7.03 7.13 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 61 L 6.68 4.05 0.00 1.26 1.16 0.70 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.17 0.00 0.79 1.76 0.00 3.04 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.98 0.00 63 L 8.38 3.82 0.00 1.73 1.72 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 64 W 8.05 4.41 0.00 3.63 3.32 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 65 K 6.58 3.70 0.00 0.79 1.18 0.00 1.52 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.11 1.30 7.81 66 Q 7.61 3.56 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 1.16 1.94 0.00 67 Q 8.31 4.27 0.00 2.36 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.75 2.72 0.00 68 N 8.40 4.34 0.00 2.83 2.94 0.00 0.00 7.08 6.26 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 69 L 8.28 4.02 0.00 2.16 2.05 1.10 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.54 4.35 0.00 2.28 2.11 0.00 2.09 0.00 0.00 2.09 0.00 0.00 3.20 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.82 2.00 7.81 71 K 8.20 4.01 0.00 1.90 1.79 0.00 1.42 0.00 0.00 1.31 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 1.31 7.81 72 E 7.54 4.05 0.00 1.79 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 2.35 2.28 0.00 73 K 7.63 4.08 0.00 1.89 1.67 0.00 1.75 0.00 0.00 1.09 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.41 7.81 74 G 8.19 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 75 L 7.99 4.67 0.00 1.77 1.82 0.88 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 76 F 8.27 4.52 0.00 3.06 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