NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3126 8.1631 117.3743 63.1769 69.8085 173.5683 2 G 3.5495 8.5047 115.7551 44.8883 0.0000 171.8880 3 A 4.3860 8.0393 123.0080 52.5151 21.1821 177.4519 4 G 4.3351 7.4896 113.2468 44.8260 0.0000 176.1072 5 T 3.8925 9.0170 119.9760 66.2267 68.6718 173.9121 6 P 4.2573 0.0000 0.0000 65.9866 30.7683 177.5475 7 S 4.4277 8.0966 112.3949 59.0233 62.8160 175.6449 8 Q 4.3661 8.2887 122.7058 57.6486 28.5386 178.0456 9 G 3.7002 7.5596 107.4224 47.6993 0.0000 174.5090 10 K 4.2500 7.8541 117.2577 57.1766 32.9145 177.9493 11 K 4.3851 7.5556 120.3095 55.6323 29.8714 176.2950 12 N 4.9953 7.8540 113.5540 52.5898 38.2709 175.5376 13 T 4.3792 7.7478 114.4325 63.4950 69.8046 174.0697 14 T 4.6055 8.2479 120.9100 62.0713 70.4353 172.5894 15 T 4.2831 7.7529 113.5787 62.8888 70.7152 173.1803 16 H 4.8437 8.4368 117.7423 55.4031 30.0184 175.1972 17 T 4.7936 9.1841 113.2288 59.0654 72.9903 172.7141 18 K 4.1846 8.9162 123.0859 57.3678 32.7730 175.4320 19 C 4.1828 9.8023 130.4023 58.9277 31.9895 174.0886 20 R 3.7157 8.6462 126.9493 59.5621 29.8126 177.4376 21 R 3.6753 7.2097 116.4302 58.7661 30.2504 176.8333 22 C 4.1788 7.7530 110.6298 58.5404 30.4457 174.4794 23 G 3.9663 8.0598 108.3254 44.9324 0.0000 173.5590 24 E 4.1489 7.8446 118.6524 55.9056 30.9912 176.4626 25 K 4.7031 8.2837 124.4878 55.2735 30.0634 176.1808 26 S 4.7559 7.8264 113.6761 57.9390 67.1268 173.2731 27 Y 4.7309 8.7931 123.9171 56.9091 39.2627 174.3422 28 H 4.4652 8.8637 128.7731 56.0675 29.9326 175.5943 29 T 3.6449 8.6666 121.7699 63.9118 66.9551 174.8441 30 K 4.3067 8.0094 118.9516 58.7315 33.2312 177.7982 31 K 4.0103 7.9821 115.7167 56.5753 32.4741 176.7492 32 K 3.2174 8.3097 118.1364 56.7818 30.2020 175.5724 33 V 4.5270 6.7954 116.0739 61.2048 34.9300 173.0562 34 C 5.1431 9.3743 128.4378 58.6606 31.7459 174.3649 35 S 4.3895 9.0975 122.8998 60.4155 63.1140 175.3952 36 S 4.4215 8.2232 115.6152 60.4484 62.7377 174.2917 37 C 4.4190 8.1171 112.5523 57.4704 30.3628 174.8251 38 G 3.9428 8.4442 109.2523 45.7266 0.0000 173.3135 39 F 4.5941 8.0512 122.2528 59.7219 39.6837 176.1108 40 G 3.6881 8.6687 115.3445 45.1725 0.0000 173.2235 41 K 4.3956 7.9732 118.2483 57.0678 34.2221 176.0423 42 S 4.7360 8.0603 110.5188 56.0105 65.8958 173.9110 43 A 4.1486 8.7028 125.5293 55.1816 18.4471 178.6696 44 K 4.2751 7.1393 110.6297 56.1152 32.8162 176.7647 45 R 4.4153 8.1443 120.0066 55.5680 31.0006 176.6124 46 R 3.8363 8.6365 125.2663 56.6667 30.5580 175.3532 47 D 4.5709 7.5907 124.2540 53.4924 44.2473 173.8837 48 Y 4.5068 8.8358 122.6512 55.8211 41.5020 176.6104 49 E 3.9531 8.6063 121.8752 58.7713 29.6597 178.1492 50 W 4.5338 7.5712 114.3384 57.5943 28.4980 177.2015 51 Q 4.4715 7.4454 117.9586 56.9673 28.1138 175.6167 52 S 4.6913 7.5702 111.3101 56.4612 66.2866 174.3270 53 K 3.9579 8.7174 120.6790 56.6233 32.4710 177.6725 54 A 3.9993 8.9622 127.2387 55.4968 18.2470 179.3878 55 G 4.0650 7.7844 102.2053 45.2462 0.0000 173.2784 56 E 4.2775 8.0405 126.1643 56.4407 30.0374 174.4498 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 8.50 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 4.39 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 7.49 4.34 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 0.00 5 T 9.02 3.89 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 4.26 0.00 2.26 2.32 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.06 0.00 7 S 8.10 4.43 0.00 4.09 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 0.00 8 Q 8.29 4.37 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.64 2.51 0.00 9 G 7.56 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.85 4.25 0.00 1.76 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.45 7.81 11 K 7.56 4.39 0.00 1.84 1.78 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.47 1.45 7.81 12 N 7.85 5.00 0.00 2.78 2.84 0.00 0.00 6.35 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 7.75 4.38 4.23 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 1.19 0.00 0.00 14 T 8.25 4.61 4.23 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 1.20 0.00 0.00 15 T 7.75 4.28 3.60 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 16 H 8.44 4.84 0.00 3.09 3.49 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 9.18 4.79 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 1.32 0.00 0.00 18 K 8.92 4.18 0.00 1.80 1.85 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.54 7.81 19 C 9.80 4.18 0.00 3.12 2.93 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 20 R 8.65 3.72 0.00 1.63 1.69 0.00 3.22 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 21 R 7.21 3.68 0.00 0.67 1.14 0.00 3.16 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.25 0.00 22 C 7.75 4.18 0.00 3.09 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 23 G 8.06 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 24 E 7.84 4.15 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 2.41 2.27 0.00 25 K 8.28 4.70 0.00 1.80 1.77 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.52 7.81 26 S 7.83 4.76 0.00 3.86 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 27 Y 8.79 4.73 0.00 3.12 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 8.86 4.47 0.00 3.20 3.00 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 8.67 3.64 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 1.18 0.00 0.00 30 K 8.01 4.31 0.00 1.87 1.83 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.41 7.81 31 K 7.98 4.01 0.00 1.55 1.72 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.54 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.24 0.94 7.81 32 K 8.31 3.22 0.00 1.73 1.83 0.00 1.73 0.00 0.00 1.52 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.29 1.47 7.81 33 V 6.80 4.53 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 1.02 0.00 0.00 1.00 0.00 0.00 34 C 9.37 5.14 0.00 3.42 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 9.10 4.39 0.00 4.08 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 8.22 4.42 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 4.42 0.00 3.15 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 38 G 8.44 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 8.05 4.59 0.00 3.05 3.08 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 0.00 0.00 0.00 40 G 8.67 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 41 K 7.97 4.40 0.00 1.70 2.00 0.00 1.78 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 1.32 1.40 7.81 42 S 8.06 4.74 0.00 3.97 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 43 A 8.70 4.15 1.32 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 0.00 0.00 44 K 7.14 4.28 0.00 1.79 1.71 0.00 1.68 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 1.46 1.40 7.81 45 R 8.14 4.42 0.00 1.64 1.81 0.00 3.35 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 46 R 8.64 3.84 0.00 1.80 1.96 0.00 3.45 0.00 0.00 3.39 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 47 D 7.59 4.57 0.00 2.51 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 8.84 4.51 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 8.61 3.95 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 7.57 4.53 0.00 3.52 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 51 Q 7.45 4.47 0.00 1.96 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.68 0.00 0.00 0.00 0.00 0.00 2.09 1.57 0.00 52 S 7.57 4.69 0.00 3.95 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 8.72 3.96 0.00 1.83 1.81 0.00 1.75 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.42 7.81 54 A 8.96 4.00 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 7.78 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.04 4.28 0.00 1.93 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 2.21 2.22 0.00