NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3162 8.1631 117.3743 63.1132 69.5119 173.5177 2 G 3.5191 8.3832 116.0221 44.9042 0.0000 172.3599 3 A 4.1595 8.0847 123.7740 52.5687 21.0288 177.1795 4 G 4.3358 7.1655 113.1068 44.8976 0.0000 176.2951 5 T 3.8841 9.0270 120.1409 66.3121 67.7128 173.6634 6 P 4.2570 0.0000 0.0000 65.6862 31.1030 177.4840 7 S 4.4377 8.1781 112.9902 59.1622 63.1328 175.7444 8 Q 4.3037 8.3102 122.5760 58.1196 28.3418 178.2269 9 G 3.6911 7.4023 108.4530 48.4792 0.0000 174.6700 10 K 4.2104 7.9026 116.4914 57.3512 32.4702 178.4667 11 K 4.3928 7.5939 119.5323 56.0692 29.4882 175.9461 12 N 5.0464 7.9968 115.9808 52.3591 38.6227 175.1846 13 T 4.3408 7.8998 114.6696 63.4180 69.7080 174.1395 14 T 4.4978 8.3265 122.0397 62.1745 69.6933 172.5195 15 T 4.2571 7.5995 115.0934 62.9018 71.4212 173.1769 16 H 4.8157 8.1362 118.7567 55.2916 29.8972 174.9792 17 T 4.7996 9.9396 113.8168 59.0550 72.8431 172.8580 18 K 4.1410 8.8509 122.8928 57.1381 32.7147 175.2013 19 C 4.2271 9.5289 129.3457 58.6928 32.0968 174.4229 20 R 3.6933 8.3691 126.5097 59.0970 30.0267 177.3630 21 R 3.7857 7.2762 116.7690 57.9526 30.3525 176.4403 22 C 4.4000 7.9772 109.4541 57.5468 31.0483 174.6597 23 G 3.9045 8.1739 108.2366 45.0109 0.0000 173.1330 24 E 4.3171 7.6657 119.1633 54.8162 31.2385 176.4391 25 K 4.6762 8.1634 125.1190 56.0330 29.8827 176.5349 26 S 4.7785 7.8400 114.1349 58.0662 66.0888 174.2926 27 Y 4.7190 8.6764 124.0007 57.3114 39.5785 174.2699 28 H 4.5628 8.8438 128.7849 55.7471 29.8788 175.5565 29 T 3.5373 8.8598 122.1494 63.8796 66.9213 174.9224 30 K 4.3200 8.1240 118.8195 57.9048 33.2289 177.4561 31 K 4.0832 7.8801 116.2289 55.8392 33.2653 176.3384 32 K 3.3190 8.5949 119.0115 56.5029 30.1159 175.2469 33 V 4.6426 6.6326 115.9946 61.5417 34.9073 172.2990 34 C 5.1643 9.3768 127.9706 58.3554 32.3479 174.5778 35 S 4.2801 8.7859 121.8137 60.5048 62.7384 175.0184 36 S 4.3976 7.7374 116.0425 59.9045 62.6775 174.2323 37 C 4.2941 8.0093 114.5431 58.5767 30.6012 175.2813 38 G 4.0388 8.2598 109.3301 44.7353 0.0000 172.9418 39 F 4.3845 8.1677 122.2961 60.0159 39.6231 175.4552 40 G 3.9578 8.5615 115.0492 45.9271 0.0000 173.5358 41 K 4.3068 8.2258 118.3445 57.1919 33.8859 175.9144 42 S 4.7145 7.7445 110.7618 55.9332 64.8095 173.3810 43 A 4.1476 8.7484 130.4374 55.1739 18.4075 178.2620 44 K 4.2984 7.3903 113.5001 56.0062 32.8543 176.7160 45 R 4.4074 8.1428 119.7058 55.5477 30.9664 176.6861 46 R 3.8650 9.3971 125.9220 56.8349 30.5184 175.3447 47 D 4.5871 7.6202 124.2708 53.5166 44.4043 173.9368 48 Y 4.4542 8.3568 122.2622 55.7569 41.5705 176.6432 49 E 4.0006 8.5456 121.8849 58.8372 29.8156 178.5740 50 W 4.7352 7.6183 113.4859 57.2373 28.3430 176.5814 51 Q 4.4371 7.6110 117.2320 56.8295 28.2475 175.3307 52 S 4.6862 7.4741 110.4239 56.4993 66.1852 174.1600 53 K 4.0587 8.5809 120.0889 56.3072 32.4917 177.8117 54 A 4.0284 8.9889 126.7665 55.5800 18.5933 179.4288 55 G 3.9401 7.7124 103.1373 44.0590 0.0000 173.2697 56 E 4.5294 7.8042 123.5747 56.8915 30.7703 175.3079 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 4.32 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 8.38 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.08 4.16 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 7.17 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 9.03 3.88 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 2.31 0.00 3.58 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 2.22 2.06 0.00 7 S 8.18 4.44 0.00 4.18 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 8.31 4.30 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.65 2.51 0.00 9 G 7.40 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 7.90 4.21 0.00 1.76 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 11 K 7.59 4.39 0.00 1.92 1.78 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.45 7.81 12 N 8.00 5.05 0.00 2.76 2.81 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 7.90 4.34 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 14 T 8.33 4.50 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 7.60 4.26 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 1.09 0.00 0.00 16 H 8.14 4.82 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 9.94 4.80 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 8.85 4.14 0.00 1.79 1.85 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.53 7.81 19 C 9.53 4.23 0.00 3.16 2.87 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 20 R 8.37 3.69 0.00 1.51 1.43 0.00 3.07 0.00 0.00 3.07 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.49 0.00 21 R 7.28 3.79 0.00 0.67 1.41 0.00 3.30 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.39 0.00 22 C 7.98 4.40 0.00 3.08 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 23 G 8.17 3.90 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 0.00 0.00 0.00 24 E 7.67 4.32 0.00 1.94 1.90 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 2.38 2.27 0.00 25 K 8.16 4.68 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.52 7.81 26 S 7.84 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 8.68 4.72 0.00 3.11 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 28 H 8.84 4.56 0.00 3.22 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 8.86 3.54 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 1.20 0.00 0.00 30 K 8.12 4.32 0.00 1.87 1.84 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 1.37 1.42 7.81 31 K 7.88 4.08 0.00 1.54 1.71 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.59 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.19 0.88 7.81 32 K 8.59 3.32 0.00 1.75 1.87 0.00 1.79 0.00 0.00 1.49 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.50 7.81 33 V 6.63 4.64 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 0.97 0.00 0.00 0.94 0.00 0.00 34 C 9.38 5.16 0.00 3.41 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 8.79 4.28 0.00 4.10 4.08 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 36 S 7.74 4.40 0.00 3.91 3.91 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 0.00 0.00 0.00 37 C 8.01 4.29 0.00 3.18 3.20 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 38 G 8.26 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 39 F 8.17 4.38 0.00 3.08 3.11 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 40 G 8.56 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 41 K 8.23 4.31 0.00 1.68 1.97 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.34 7.81 42 S 7.74 4.71 0.00 3.84 3.71 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 43 A 8.75 4.15 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 44 K 7.39 4.30 0.00 1.72 1.72 0.00 1.67 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 4.41 0.00 1.65 1.82 0.00 3.37 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 46 R 9.40 3.86 0.00 1.75 2.02 0.00 3.47 0.00 0.00 3.50 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.85 0.00 47 D 7.62 4.59 0.00 2.52 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 8.36 4.45 0.00 1.43 1.52 0.00 0.00 0.00 0.00 0.00 0.00 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 8.55 4.00 0.00 2.05 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 2.37 2.25 0.00 50 W 7.62 4.74 0.00 3.47 3.22 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 51 Q 7.61 4.44 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.05 1.62 0.00 52 S 7.47 4.69 0.00 3.99 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 8.58 4.06 0.00 1.83 1.80 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 1.41 7.81 54 A 8.99 4.03 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 7.71 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 56 E 7.80 4.53 0.00 1.87 1.90 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 2.09 2.10 0.00