NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 D 4.8150 8.2076 120.4811 54.4743 43.2294 173.3795 9 F 5.2452 7.8325 115.9061 55.0976 41.5258 168.4935 10 V 4.6632 8.9862 111.4322 59.6005 36.5303 176.1452 11 V 4.8086 8.7883 123.9889 61.2749 33.9319 174.3649 12 I 5.0339 8.8773 128.4562 59.3636 40.6980 174.1110 13 K 5.0073 9.0760 128.5325 54.4016 34.7549 174.6655 14 A 4.5077 8.7891 129.8604 51.8301 19.0232 178.0216 15 V 3.4496 8.5109 123.2152 63.8640 32.5456 175.2515 16 E 4.7607 7.8366 115.9872 54.2598 32.7812 174.3682 17 D 4.4562 8.4655 118.7439 55.2335 41.3333 176.1991 18 G 3.8587 8.5816 107.3280 46.6281 0.0000 174.0529 19 V 3.9606 7.4235 120.0028 62.5322 32.9670 174.3275 20 N 5.3541 9.0501 124.8152 51.4286 41.7446 173.6932 21 V 4.5640 8.8541 123.9913 61.4878 33.4667 174.2088 22 I 4.6773 8.6472 130.3613 59.4362 39.4743 175.1702 23 G 4.1496 8.8944 115.3758 45.2327 0.0000 172.3440 24 L 5.6126 8.6733 125.1366 53.0394 44.0443 176.1938 25 T 4.6386 8.7495 114.8229 61.6586 69.4196 174.2971 26 R 4.2175 7.9029 126.5414 56.4758 30.8772 175.0848 27 G 3.8208 8.8509 110.9060 44.2196 0.0000 173.0301 28 T 3.9604 8.5692 108.9243 64.2988 68.8957 174.3538 29 D 4.7376 7.7810 119.9056 53.2347 42.2658 176.2639 30 T 4.6689 8.1982 117.9591 61.6377 70.5756 173.0250 31 K 4.5202 8.9448 125.1964 54.4700 36.9217 175.5390 32 F 5.2938 8.4013 119.8198 57.4609 38.4851 175.5589 33 H 4.6320 8.9925 121.2202 58.2189 29.5538 175.4120 34 H 4.6382 7.6534 115.5487 55.2628 33.1641 172.5268 35 S 4.8650 8.4446 121.1774 56.6440 65.2862 172.8790 36 E 4.3704 8.9480 127.2140 54.5467 30.8512 174.7951 37 K 4.6474 8.6066 129.0184 56.0292 33.4078 175.6420 38 L 4.8841 8.9495 127.4224 53.0534 44.4977 176.1942 39 D 4.6896 9.1092 124.0940 52.8928 42.7712 175.9917 40 K 4.0027 8.5642 121.5061 58.5174 32.2675 177.3611 41 G 3.9928 9.6346 115.6672 45.5182 0.0000 173.4321 42 E 4.3471 7.9500 119.4476 56.1649 30.9602 175.9764 43 V 4.8980 8.1477 120.4560 61.2271 34.9190 174.4203 44 I 4.6144 8.9499 126.6356 59.2119 41.5527 173.8578 45 I 4.8888 8.4524 128.9497 59.5936 39.1358 174.6969 46 A 4.6912 8.8721 129.1535 50.1079 21.8401 175.3951 47 Q 4.8144 8.6272 121.0404 55.0179 30.5143 175.5847 48 F 4.6492 8.8399 120.7987 57.7020 39.9182 175.3860 49 T 4.7509 8.6828 111.6384 60.1148 71.9262 173.3119 50 E 4.0552 8.9393 119.8535 59.6500 29.6226 178.1861 51 H 4.5201 8.1817 114.4171 56.5217 29.9716 174.3004 52 T 5.2230 8.2773 116.9503 61.8749 70.2747 174.7370 53 S 5.0588 9.0513 119.7034 58.0387 64.8061 173.3558 54 A 5.0464 7.9601 121.2766 51.1809 22.7290 175.2228 55 I 5.0786 8.5082 119.6839 59.4227 40.8483 174.7142 56 K 4.6227 9.1059 128.3172 54.5028 34.8371 174.6717 57 V 4.8081 8.3538 126.1849 61.0474 33.8876 174.4089 58 R 4.4434 8.9410 127.7763 55.3486 33.0778 173.8079 59 G 3.9439 8.9003 110.9593 43.8974 0.0000 171.8406 60 E 4.5973 9.8880 120.5668 55.5358 30.3476 175.4541 61 A 5.0281 8.7808 127.7881 50.7667 23.6108 174.0017 62 L 4.9609 8.7767 121.4926 53.3317 44.6515 175.2053 63 I 5.0351 8.8466 127.0106 59.6217 40.1892 174.4945 64 Q 5.1602 9.4315 125.5882 54.4872 32.3843 174.8664 65 T 4.9221 8.8919 112.7641 59.8014 72.3077 174.1324 66 A 3.8570 8.3953 123.0441 55.0773 18.1706 177.9779 67 Y 4.8455 7.3714 111.5287 57.8283 38.9030 174.7790 68 G 3.9422 7.5197 106.1891 44.0799 0.0000 172.4886 69 E 5.3155 8.6403 119.3671 54.9489 32.1928 175.5335 70 M 4.8235 9.0311 122.3386 53.8895 36.0893 173.6485 71 K 5.0942 8.7148 125.0904 54.9018 34.1186 176.2118 72 S 4.6826 8.7044 119.7400 57.6512 65.1447 172.8848 73 E 5.0925 8.4731 119.9939 54.5067 32.5434 175.9632 74 K 4.1928 9.1609 125.3144 55.5669 33.4454 177.0094 75 K 4.1572 8.7037 119.4169 56.7358 31.5917 176.2973 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 8 D 8.21 4.82 0.00 2.79 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 9 F 7.83 5.25 0.00 3.12 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 10 V 8.99 4.66 2.05 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 0.60 0.00 0.00 0.85 0.00 0.00 11 V 8.79 4.81 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 0.81 0.00 0.00 1.12 0.00 0.00 12 I 8.88 5.03 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.62 0.89 0.00 0.00 13 K 9.08 5.01 0.00 1.78 1.63 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.35 7.81 14 A 8.79 4.51 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 15 V 8.51 3.45 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 0.80 0.00 0.00 0.93 0.00 0.00 16 E 7.84 4.76 0.00 2.04 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 2.15 2.30 0.00 17 D 8.47 4.46 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.58 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.42 3.96 2.21 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 0.88 0.00 0.00 0.99 0.00 0.00 20 N 9.05 5.35 0.00 2.63 2.55 0.00 0.00 6.28 7.96 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 21 V 8.85 4.56 2.03 0.00 0.00 0.00 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 0.89 0.00 0.00 22 I 8.65 4.68 1.48 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.41 0.02 0.00 0.00 23 G 8.89 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.67 5.61 0.00 1.91 1.72 1.13 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.75 4.64 4.31 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 1.36 0.00 0.00 26 R 7.90 4.22 0.00 1.92 1.99 0.00 3.23 0.00 0.00 3.08 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.45 0.00 27 G 8.85 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 28 T 8.57 3.96 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 29 D 7.78 4.74 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.20 4.67 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 1.23 0.00 0.00 31 K 8.94 4.52 0.00 1.76 1.79 0.00 1.30 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.41 7.81 32 F 8.40 5.29 0.00 2.96 2.86 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 0.00 0.00 0.00 33 H 8.99 4.63 0.00 3.20 3.51 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 7.65 4.64 0.00 3.29 3.14 0.00 5.81 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.44 4.86 0.00 3.62 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 8.95 4.37 0.00 2.08 1.79 0.00 0.00 0.00 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 2.28 0.00 37 K 8.61 4.65 0.00 1.77 1.67 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.54 7.81 38 L 8.95 4.88 0.00 1.68 1.51 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 39 D 9.11 4.69 0.00 2.60 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.56 4.00 0.00 1.79 1.74 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.45 1.48 7.81 41 G 9.63 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.95 4.35 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 2.31 2.33 0.00 43 V 8.15 4.90 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 0.81 0.00 0.00 0.92 0.00 0.00 44 I 8.95 4.61 1.84 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 1.19 1.56 0.88 0.00 0.00 45 I 8.45 4.89 1.70 0.00 0.00 0.79 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 0.60 0.61 0.00 0.00 46 A 8.87 4.69 1.11 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 0.00 0.00 47 Q 8.63 4.81 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 48 F 8.84 4.65 0.00 2.96 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.68 4.75 4.29 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 1.29 0.00 0.00 50 E 8.94 4.06 0.00 1.90 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 0.00 2.31 2.41 0.00 51 H 8.18 4.52 0.00 3.25 3.23 0.00 5.75 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 8.28 5.22 4.35 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 1.32 0.00 0.00 53 S 9.05 5.06 0.00 3.90 4.09 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 0.00 0.00 0.00 0.00 54 A 7.96 5.05 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.51 5.08 1.83 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.61 0.84 0.00 0.00 56 K 9.11 4.62 0.00 1.80 1.48 0.00 1.71 0.00 0.00 1.48 0.00 0.00 2.84 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.36 7.81 57 V 8.35 4.81 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 0.81 0.00 0.00 0.90 0.00 0.00 58 R 8.94 4.44 0.00 1.83 1.64 0.00 3.06 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 59 G 8.90 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 60 E 9.89 4.60 0.00 2.22 1.84 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 2.27 2.30 0.00 61 A 8.78 5.03 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 62 L 8.78 4.96 0.00 1.76 1.51 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 63 I 8.85 5.04 2.01 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 1.22 0.65 0.91 0.00 0.00 64 Q 9.43 5.16 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.52 0.00 0.00 0.00 0.00 0.00 2.37 2.27 0.00 65 T 8.89 4.92 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 1.14 0.00 0.00 66 A 8.40 3.86 0.94 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 67 Y 7.37 4.85 0.00 2.99 2.85 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 0.00 0.00 0.00 68 G 7.52 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 69 E 8.64 5.32 0.00 1.85 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 2.23 2.28 0.00 70 M 9.03 4.82 0.00 2.08 1.86 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 71 K 8.71 5.09 0.00 1.67 1.72 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.42 7.81 72 S 8.70 4.68 0.00 3.95 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 73 E 8.47 5.09 0.00 1.82 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 2.19 2.26 0.00 74 K 9.16 4.19 0.00 1.99 1.73 0.00 2.08 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.40 7.81 75 K 8.70 4.16 0.00 1.85 2.07 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.26 1.28 7.81