NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2673 8.1749 115.2411 60.8892 68.7041 175.0956 2 P 4.2814 0.0000 0.0000 61.6435 31.1970 174.8572 3 D 4.4814 8.3748 117.9888 55.4838 40.1622 175.4524 4 V 4.1885 7.8562 124.9536 59.2102 30.0933 175.8910 5 S 5.6015 7.6663 132.1000 60.4218 63.1349 178.0113 6 S 4.6177 7.7024 116.9059 57.1568 63.8472 174.6247 7 A 4.3843 8.0004 124.1856 53.3867 20.3900 179.9841 8 L 3.8692 7.8088 117.6081 57.8459 42.9458 178.1160 9 D 4.3712 8.3934 117.8272 57.5277 40.7590 178.3093 10 K 3.9673 7.5863 119.2576 59.4713 31.3224 178.5780 11 L 4.1255 7.8526 118.1885 56.2867 42.4746 177.4225 12 K 4.5601 7.5702 120.5139 54.1740 29.4129 175.8141 13 E 5.2029 8.1465 129.4796 55.4591 31.5047 177.3871 14 F 4.2105 7.9044 127.4547 61.0624 40.2858 177.4521 15 G 3.8337 7.8251 105.4980 47.5735 0.0000 175.1329 16 N 4.2710 8.0010 119.1685 57.1641 38.9027 176.9849 17 T 3.9120 7.7769 116.0848 66.0106 68.6575 176.2532 18 L 3.9588 7.5321 122.0976 57.4392 41.9759 177.7776 19 E 4.1588 7.6405 116.6500 57.5800 29.8680 176.7605 20 D 4.7995 7.9219 115.8705 55.0259 42.6323 176.6221 21 K 4.5061 7.6093 116.4405 56.3633 32.3333 176.5990 22 A 4.7765 7.7436 121.4978 51.6911 19.9179 177.1988 23 R 4.4862 8.1054 118.1165 58.3960 33.5758 176.2888 24 E 4.2874 8.0675 116.4388 58.3194 29.9340 178.4222 25 L 4.0792 7.7942 119.9491 57.9232 42.2279 178.8257 26 I 3.7911 7.6935 119.4243 64.0190 36.7229 177.9652 27 S 4.1758 7.7827 113.0275 60.9662 61.9899 175.9347 28 R 3.7591 7.8210 120.0433 58.7116 29.9538 177.7155 29 I 4.0476 7.3397 118.9920 63.5608 37.4263 177.8576 30 K 4.1550 7.7976 118.7198 59.1951 32.5855 176.9413 31 Q 4.5385 7.3030 120.0292 55.7753 29.4103 175.4260 32 S 4.7262 7.3400 104.9256 57.5706 63.2861 175.2960 33 E 4.7586 8.4397 116.7524 57.2548 29.4682 177.0269 34 L 4.3631 8.1005 120.9926 55.5712 42.0673 177.0587 35 S 3.6662 8.0688 110.3348 58.9518 60.7794 171.9816 36 A 4.5607 7.3565 120.6702 52.9598 20.2152 179.2661 37 K 4.4750 7.6100 116.2886 54.1652 32.3148 174.9290 38 M 4.1365 8.4025 122.6661 56.0347 31.9659 175.3461 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 8.17 4.27 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 2 P 0.00 4.28 0.00 2.12 2.00 0.00 3.71 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 3 D 8.37 4.48 0.00 2.65 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.86 4.19 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 0.69 0.00 0.00 0.92 0.00 0.00 5 S 7.67 5.60 0.00 3.88 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 6 S 7.70 4.62 0.00 3.79 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 A 8.00 4.38 1.35 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 0.00 0.00 8 L 7.81 3.87 0.00 1.64 1.66 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 9 D 8.39 4.37 0.00 2.81 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 10 K 7.59 3.97 0.00 1.91 1.65 0.00 1.43 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 11 L 7.85 4.13 0.00 1.85 1.72 0.78 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 12 K 7.57 4.56 0.00 1.86 1.80 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.49 7.81 13 E 8.15 5.20 0.00 2.11 2.02 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 2.17 2.19 0.00 14 F 7.90 4.21 0.00 3.02 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 15 G 7.83 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.00 4.27 0.00 2.89 3.07 0.00 0.00 7.27 6.70 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 17 T 7.78 3.91 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 1.13 0.00 0.00 18 L 7.53 3.96 0.00 1.51 1.67 0.81 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 19 E 7.64 4.16 0.00 2.10 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 0.00 2.31 2.34 0.00 20 D 7.92 4.80 0.00 2.77 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.61 4.51 0.00 1.93 1.76 0.00 1.55 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.44 7.81 22 A 7.74 4.78 1.24 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 0.00 0.00 0.00 23 R 8.11 4.49 0.00 1.78 2.02 0.00 3.38 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.69 0.00 24 E 8.07 4.29 0.00 2.15 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 0.00 2.27 2.32 0.00 25 L 7.79 4.08 0.00 1.73 1.65 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.69 3.79 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.80 0.90 0.00 0.00 27 S 7.78 4.18 0.00 3.93 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 28 R 7.82 3.76 0.00 1.84 2.15 0.00 3.27 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 29 I 7.34 4.05 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.93 0.90 0.00 0.00 30 K 7.80 4.16 0.00 1.89 1.94 0.00 1.54 0.00 0.00 1.63 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.62 7.81 31 Q 7.30 4.54 0.00 2.24 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.51 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 32 S 7.34 4.73 0.00 3.95 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 33 E 8.44 4.76 0.00 1.92 1.93 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 2.19 2.39 0.00 34 L 8.10 4.36 0.00 1.80 1.88 0.94 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.07 3.67 0.00 4.00 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 36 A 7.36 4.56 1.26 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 0.00 0.00 0.00 37 K 7.61 4.47 0.00 1.68 1.72 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.42 7.81 38 M 8.40 4.14 0.00 2.01 1.96 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00