NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3132 8.1631 117.3743 63.1843 69.6383 173.3683 2 G 3.5356 8.3635 115.4127 44.7981 0.0000 172.6890 3 A 4.1215 8.1223 124.8053 52.8054 21.1035 176.5616 4 G 4.4247 7.0986 111.9867 44.6717 0.0000 176.0113 5 T 3.8699 9.1169 121.7671 66.1267 67.8598 173.5430 6 P 4.3278 0.0000 0.0000 65.4764 31.1124 177.5673 7 S 4.4941 8.0680 113.3549 59.3024 63.1878 175.7381 8 Q 4.2908 8.1447 121.7112 58.0278 28.3659 178.1803 9 G 3.6904 8.0338 107.8189 47.8222 0.0000 174.3958 10 K 4.2456 7.8690 117.1688 57.2766 32.7761 178.1286 11 K 4.3946 7.5706 119.9462 55.5826 29.7779 176.1826 12 N 5.0229 7.9344 115.1010 52.4828 38.3117 175.1919 13 T 4.3935 7.8748 114.6094 63.2557 69.8915 174.2500 14 T 4.4349 8.3345 122.3208 62.4139 69.2049 172.6804 15 T 4.2840 7.5614 115.4516 63.0205 71.4121 173.0530 16 H 4.8819 8.0883 119.3186 55.1492 29.9416 174.6821 17 T 4.8180 9.2747 113.0649 59.0212 73.0237 172.9576 18 K 4.2809 8.7702 123.0648 57.2661 32.7472 175.5479 19 C 4.2156 9.4029 129.2415 58.9262 32.1026 174.3290 20 R 3.7331 8.4848 126.5949 59.4130 30.0583 177.6422 21 R 3.6586 7.3606 116.7638 58.6695 30.1100 176.5810 22 C 4.3835 7.9124 108.9280 57.4372 30.7991 174.6470 23 G 3.9311 8.1410 108.6080 45.2811 0.0000 173.4940 24 E 4.2454 7.6635 119.1681 55.2670 31.1174 176.4418 25 K 4.6576 8.2241 124.9662 55.7698 29.8636 176.4281 26 S 4.7782 7.8766 113.7898 57.8246 66.8673 173.9117 27 Y 4.7443 8.7475 123.7868 57.2535 39.3873 174.3736 28 H 4.6202 8.8846 129.1121 55.8859 29.8985 175.5800 29 T 3.6256 8.6600 121.6435 63.7967 66.8769 174.8020 30 K 4.3293 8.1210 118.7622 57.9627 33.3427 177.3992 31 K 4.1106 7.9100 116.0813 55.8050 32.7909 176.5577 32 K 3.2916 8.6324 118.7350 57.0174 30.1211 175.0494 33 V 4.5732 6.8768 116.2799 61.0641 34.8681 173.3411 34 C 5.0301 9.3542 127.9445 58.4412 31.9732 174.3910 35 S 4.4242 8.9091 122.1629 60.1828 63.1938 175.1986 36 S 4.4666 8.2117 115.5278 60.3320 62.8705 174.3291 37 C 4.3981 8.1161 112.7223 57.5637 30.3958 174.9242 38 G 3.9425 8.3885 109.2172 45.5022 0.0000 173.2049 39 F 4.5253 8.0773 122.2563 59.8950 39.6608 176.0227 40 G 3.9328 8.6562 115.3143 46.0832 0.0000 173.5635 41 K 4.4064 8.1398 119.4029 57.0921 34.0192 176.2311 42 S 4.7037 7.6723 109.8548 56.1664 65.9930 173.7639 43 A 4.1479 8.6619 125.2147 55.0503 18.4647 178.6324 44 K 4.3188 7.6910 113.5314 55.9147 33.0985 176.5238 45 R 4.4000 8.1595 120.1305 55.5754 31.0009 176.5249 46 R 3.8247 8.6894 125.3085 56.7147 30.5253 175.3756 47 D 4.5920 7.6814 125.0495 53.2839 44.2977 173.8299 48 Y 4.5007 8.7663 122.6086 55.8218 41.4011 176.6097 49 E 3.9672 8.5654 121.7159 58.7352 29.8918 178.1207 50 W 4.5444 7.5480 114.2905 57.5485 28.5615 177.1212 51 Q 4.5358 7.4956 117.9251 56.5278 28.0101 175.5602 52 S 4.6643 7.6039 111.4263 56.7037 66.1230 174.6908 53 K 3.9233 8.6566 120.7787 56.7112 32.4031 177.7332 54 A 4.0170 8.9291 126.1506 55.2362 18.2743 178.5402 55 G 4.1379 7.6429 102.9123 45.0132 0.0000 173.2146 56 E 4.3337 8.0566 126.1490 56.5078 30.1856 174.6344 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 1 T 8.16 4.31 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 2 G 8.36 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.12 4.12 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 4 G 7.10 4.42 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 5 T 9.12 3.87 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 6 P 0.00 4.33 0.00 2.22 2.19 0.00 3.65 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.06 0.00 7 S 8.07 4.49 0.00 4.07 3.93 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 0.00 0.00 0.00 8 Q 8.14 4.29 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 9 G 8.03 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.87 4.25 0.00 1.76 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.45 7.81 11 K 7.57 4.39 0.00 1.88 1.78 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.45 7.81 12 N 7.93 5.02 0.00 2.78 2.84 0.00 0.00 6.33 7.71 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 13 T 7.87 4.39 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 1.20 0.00 0.00 14 T 8.33 4.43 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 15 T 7.56 4.28 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 1.12 0.00 0.00 16 H 8.09 4.88 0.00 3.08 3.50 0.00 5.64 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.27 4.82 4.33 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 1.33 0.00 0.00 18 K 8.77 4.28 0.00 1.80 1.81 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.52 7.81 19 C 9.40 4.22 0.00 3.18 2.90 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 0.00 0.00 0.00 20 R 8.48 3.73 0.00 1.60 1.61 0.00 3.22 0.00 0.00 3.12 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 21 R 7.36 3.66 0.00 0.67 1.32 0.00 3.18 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.26 0.00 22 C 7.91 4.38 0.00 3.08 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 23 G 8.14 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 24 E 7.66 4.25 0.00 1.95 1.91 0.00 0.00 0.00 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 2.27 0.00 25 K 8.22 4.66 0.00 1.80 1.78 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.52 7.81 26 S 7.88 4.78 0.00 3.87 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 27 Y 8.75 4.74 0.00 3.15 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 28 H 8.88 4.62 0.00 3.15 3.04 0.00 5.84 0.00 0.00 0.00 0.00 6.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.66 3.63 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 1.20 0.00 0.00 30 K 8.12 4.33 0.00 1.86 1.84 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 31 K 7.91 4.11 0.00 1.53 1.71 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.48 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.19 0.95 7.81 32 K 8.63 3.29 0.00 1.76 1.86 0.00 1.73 0.00 0.00 1.47 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.49 7.81 33 V 6.88 4.57 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.98 0.00 0.00 34 C 9.35 5.03 0.00 3.41 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.91 4.42 0.00 4.11 4.10 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 36 S 8.21 4.47 0.00 3.91 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 37 C 8.12 4.40 0.00 3.16 3.17 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 0.00 38 G 8.39 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 39 F 8.08 4.53 0.00 3.06 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 40 G 8.66 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.14 4.41 0.00 1.69 2.00 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.35 7.81 42 S 7.67 4.70 0.00 3.96 3.78 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 43 A 8.66 4.15 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 44 K 7.69 4.32 0.00 1.74 1.71 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 45 R 8.16 4.40 0.00 1.65 1.81 0.00 3.36 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 1.61 1.54 0.00 46 R 8.69 3.82 0.00 1.86 1.99 0.00 3.43 0.00 0.00 3.44 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 47 D 7.68 4.59 0.00 2.50 2.22 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 48 Y 8.77 4.50 0.00 1.43 1.43 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 49 E 8.57 3.97 0.00 2.00 2.04 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 2.29 2.25 0.00 50 W 7.55 4.54 0.00 3.51 3.34 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 51 Q 7.50 4.54 0.00 1.98 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.65 0.00 0.00 0.00 0.00 0.00 2.17 1.52 0.00 52 S 7.60 4.66 0.00 3.92 3.79 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 0.00 0.00 0.00 53 K 8.66 3.92 0.00 1.83 1.82 0.00 1.74 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.42 7.81 54 A 8.93 4.02 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 55 G 7.64 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 56 E 8.06 4.33 0.00 1.92 1.89 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 2.18 2.20 0.00