NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.2482 8.3149 122.0464 56.5054 35.7833 176.4956 7 E 4.2506 8.6129 120.0861 55.0918 31.5771 172.8004 8 L 5.2501 8.8347 120.2654 53.4414 45.6799 176.3534 9 V 4.9824 9.0340 114.9534 59.6874 36.1920 174.2341 10 L 4.9776 9.2536 126.9333 53.3659 43.8959 175.2978 11 A 4.4848 9.0721 129.6403 52.2996 18.6363 177.7579 12 L 4.2346 9.0570 123.4426 56.7979 42.3622 176.5524 13 Y 4.8590 7.4488 114.2450 56.4381 42.2675 174.4553 14 D 4.8230 8.7580 120.4559 54.6737 42.1025 176.0151 15 Y 4.6965 9.2137 123.2365 56.9129 42.3712 173.0245 16 Q 4.7098 8.1321 128.8130 54.1535 30.3986 174.9291 17 E 4.1902 8.9528 125.2544 57.0297 29.9237 177.0999 18 K 4.5798 9.0800 119.0037 56.0124 34.1695 175.8615 19 S 4.6524 7.5403 112.6808 55.9780 65.3815 172.8919 20 P 4.3172 0.0000 0.0000 65.0011 31.3127 177.6602 21 R 4.3205 7.8490 113.0690 56.5122 29.9171 175.8971 22 E 5.4615 8.0227 119.0284 55.6459 31.2907 175.5670 23 V 4.7015 8.6649 119.7109 60.4847 34.7029 175.0685 24 T 5.0146 8.5797 118.5478 62.8074 70.0557 173.8863 25 M 5.0358 9.6286 122.1757 53.8680 35.6289 173.7863 26 K 5.0768 8.5397 118.2729 53.9953 35.6425 176.2100 27 K 4.1902 9.8014 125.5679 58.1129 32.5854 177.1477 28 G 4.0411 9.1487 114.3420 45.2745 0.0000 173.7727 29 D 4.4868 7.8487 119.9997 54.9403 42.0423 175.6504 30 I 4.8454 8.3496 123.3209 59.8514 38.7500 174.9767 31 L 5.0034 9.0390 127.2686 53.1120 45.6505 175.6915 32 T 4.7023 8.3235 118.4986 62.5425 70.0038 174.0139 33 L 4.2542 8.6284 129.9711 54.9659 41.6520 176.4477 34 L 4.2252 8.9102 128.1227 57.1669 42.6003 177.6325 35 N 4.8424 7.8114 117.3347 51.7765 42.2569 174.6097 36 S 4.1539 8.2595 120.1204 57.8356 63.4889 175.2324 37 T 3.9429 8.5564 114.3006 64.6040 69.2265 174.0480 38 N 4.8528 8.1604 121.0909 51.9260 39.9480 175.5392 39 K 4.0074 8.8908 126.3835 58.7058 32.8761 176.7010 40 D 4.5802 9.0323 118.3897 54.3127 43.4161 176.4986 41 W 5.0412 7.9811 115.6805 54.4354 32.1053 175.3896 42 W 5.3668 8.9897 123.7170 54.8219 32.2584 174.4928 43 K 4.1098 8.7896 125.9530 55.7359 32.9069 176.0443 44 V 4.9807 8.6979 119.9867 59.4396 36.4811 173.8445 45 E 5.1001 8.8890 121.6733 54.6392 32.3930 174.6559 46 V 4.5056 8.7548 126.1788 61.9672 35.2595 176.1319 47 N 3.8305 8.8659 123.6526 54.1639 35.5872 174.5462 48 G 4.0229 8.1360 109.8740 45.7041 0.0000 172.3455 49 R 4.6303 8.2511 119.3978 54.4200 32.1266 175.3533 50 Q 5.6123 8.9769 119.6644 52.6320 31.8062 175.2968 51 G 4.0683 7.5057 106.5316 45.7146 0.0000 171.0300 52 F 5.6027 8.4866 117.8313 55.7993 41.4774 175.9770 53 V 5.0348 8.3879 112.6824 59.1249 36.7224 172.5979 54 P 3.3246 0.0000 0.0000 61.8398 31.3144 177.6805 55 A 2.7842 8.0290 127.8211 54.7805 18.2194 179.0150 56 A 4.0453 7.1463 115.8917 53.7690 18.9410 177.3561 57 Y 4.9247 7.7661 113.3302 58.2457 38.7408 175.4327 58 V 4.9538 7.0406 112.4178 59.2936 35.1070 175.0251 59 K 4.6902 8.7413 122.3390 54.5463 35.4667 175.5783 60 K 4.6595 9.0575 126.7996 56.4975 32.9218 176.2943 61 L 4.6379 8.9521 124.7826 53.0754 44.0270 176.6712 62 D 4.4800 8.6595 123.0378 54.4742 40.9804 176.5879 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 6 K 8.31 4.25 0.00 1.70 1.54 0.00 1.79 0.00 0.00 1.56 0.00 0.00 2.65 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.24 1.41 7.81 7 E 8.61 4.25 0.00 1.98 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 2.35 2.33 0.00 8 L 8.83 5.25 0.00 1.44 1.53 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 9 V 9.03 4.98 2.26 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 0.88 0.00 0.00 1.11 0.00 0.00 10 L 9.25 4.98 0.00 1.72 1.54 0.96 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 11 A 9.07 4.48 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 0.00 0.00 0.00 0.00 0.00 0.00 12 L 9.06 4.23 0.00 0.95 1.03 0.88 0.70 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 13 Y 7.45 4.86 0.00 2.64 2.64 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 14 D 8.76 4.82 0.00 2.73 2.65 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 0.00 0.00 0.00 15 Y 9.21 4.70 0.00 3.33 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 16 Q 8.13 4.71 0.00 2.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.67 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 17 E 8.95 4.19 0.00 2.02 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 2.35 2.31 0.00 18 K 9.08 4.58 0.00 1.85 1.86 0.00 1.89 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.45 7.81 19 S 7.54 4.65 0.00 3.69 3.75 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 20 P 0.00 4.32 0.00 2.06 2.10 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 21 R 7.85 4.32 0.00 2.07 2.13 0.00 2.21 0.00 0.00 2.76 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.40 0.00 22 E 8.02 5.46 0.00 2.15 2.30 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 2.48 2.15 0.00 23 V 8.66 4.70 2.17 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 0.87 0.00 0.00 1.00 0.00 0.00 24 T 8.58 5.01 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 1.28 0.00 0.00 25 M 9.63 5.04 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.76 0.00 26 K 8.54 5.08 0.00 1.85 1.74 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.38 7.81 27 K 9.80 4.19 0.00 1.80 1.72 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.44 7.81 28 G 9.15 4.04 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 0.00 0.00 0.00 29 D 7.85 4.49 0.00 2.92 2.65 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 0.00 0.00 0.00 30 I 8.35 4.85 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.83 0.92 0.00 0.00 31 L 9.04 5.00 0.00 1.62 1.72 1.07 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.32 4.70 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 1.19 0.00 0.00 33 L 8.63 4.25 0.00 1.60 1.52 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.91 4.23 0.00 1.50 1.62 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 35 N 7.81 4.84 0.00 2.66 2.56 0.00 0.00 6.67 7.63 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 36 S 8.26 4.15 0.00 2.93 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 37 T 8.56 3.94 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 1.24 0.00 0.00 38 N 8.16 4.85 0.00 2.94 3.28 0.00 0.00 6.87 6.75 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 39 K 8.89 4.01 0.00 1.83 1.88 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.50 7.81 40 D 9.03 4.58 0.00 2.77 2.41 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 41 W 7.98 5.04 0.00 3.27 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 42 W 8.99 5.37 0.00 3.26 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 K 8.79 4.11 0.00 0.79 1.35 0.00 1.19 0.00 0.00 1.46 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.11 0.77 7.81 44 V 8.70 4.98 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 0.74 0.00 0.00 1.04 0.00 0.00 45 E 8.89 5.10 0.00 2.00 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 2.19 2.21 0.00 46 V 8.75 4.51 2.12 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 1.01 0.00 0.00 0.99 0.00 0.00 47 N 8.87 3.83 0.00 2.95 3.24 0.00 0.00 6.27 7.00 0.00 0.00 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 G 8.14 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 0.00 0.00 0.00 49 R 8.25 4.63 0.00 1.85 1.86 0.00 3.10 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 50 Q 8.98 5.61 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.18 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 51 G 7.51 4.07 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 0.00 0.00 0.00 52 F 8.49 5.60 0.00 3.12 3.47 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 0.00 0.00 0.00 53 V 8.39 5.03 1.95 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 1.00 0.00 0.00 0.96 0.00 0.00 54 P 0.00 3.32 0.00 0.49 0.49 0.00 2.28 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 55 A 8.03 2.78 0.11 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 56 A 7.15 4.05 1.20 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 0.00 0.00 0.00 57 Y 7.77 4.92 0.00 2.94 3.10 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 0.00 0.00 0.00 58 V 7.04 4.95 2.17 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 0.70 0.00 0.00 0.92 0.00 0.00 59 K 8.74 4.69 0.00 1.77 1.59 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.41 7.81 60 K 9.06 4.66 0.00 1.80 1.92 0.00 1.80 0.00 0.00 1.85 0.00 0.00 2.39 0.00 0.00 2.32 0.00 0.00 0.00 0.00 1.44 1.63 7.81 61 L 8.95 4.64 0.00 1.56 1.58 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 62 D 8.66 4.48 0.00 2.64 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