NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.9281 8.2876 117.8744 55.5529 30.5129 175.0650 2 P 4.3042 0.0000 0.0000 64.0069 30.7456 172.5505 3 V 3.5167 8.5231 119.1268 65.1127 32.0391 178.0293 4 Y 4.1683 7.7959 115.7363 60.5064 37.7124 177.6661 5 T 4.0727 8.5358 117.3184 66.2227 68.4893 177.0028 6 I 3.9567 7.3832 121.5068 64.0139 36.9605 178.3477 7 L 4.0088 7.7213 119.5481 57.3952 41.0851 179.4422 8 A 4.0412 7.7653 120.7436 55.2456 18.3746 179.7119 9 V 3.4860 7.5257 114.1373 64.8681 31.2524 178.0045 10 A 4.0399 7.7571 120.9199 55.0712 17.9839 178.7543 11 S 4.7736 7.6605 109.9250 58.5774 63.1603 175.5449 12 A 4.4147 7.2703 125.5294 54.5291 19.5818 180.1627 13 T 3.9149 7.6397 114.0783 66.5627 68.7066 177.1608 14 V 3.6943 7.4540 119.1893 64.8424 31.5130 178.0438 15 A 4.0180 7.3330 121.0786 55.4374 18.3419 178.8487 16 M 4.2962 7.8886 113.7178 56.7305 32.5300 177.7508 17 M 4.3104 7.6377 119.5196 57.7102 33.0955 178.4230 18 I 4.0314 7.7662 119.5556 64.1780 36.7438 178.9396 19 G 3.5840 8.1511 106.9748 47.4988 0.0000 175.7723 20 V 3.8596 7.6672 119.5754 65.2032 31.7259 178.1587 21 T 3.9216 8.3658 116.2717 66.4825 67.9748 176.8200 22 V 3.6405 7.8688 119.5794 65.2832 31.1689 177.6264 23 A 4.1330 7.7057 119.4424 53.6931 18.4341 179.1312 24 V 3.9921 7.7191 116.4766 65.1189 32.2220 178.0361 25 L 4.0148 8.0164 118.8544 57.9396 41.4443 179.0245 26 C 4.1125 7.9427 118.0136 62.0013 31.5149 175.3840 27 A 4.0888 7.4627 122.9856 54.8981 17.9152 179.4494 28 C 4.1152 8.5159 115.9180 62.9854 28.2289 176.2904 29 L 3.9906 8.2266 120.4660 57.5378 40.9156 179.3726 30 A 4.0157 7.8741 120.2558 54.7161 18.6009 179.2692 31 R 4.1685 7.8196 115.6206 58.1758 30.0290 179.0457 32 R 4.1343 8.1709 118.4036 58.3874 30.1899 177.6676 33 E 4.4976 8.1586 115.7164 56.6743 29.4177 176.7730 34 C 4.7144 7.8280 116.8796 61.0644 30.8014 175.5414 35 L 4.1512 7.7157 118.0710 57.4743 41.5690 177.1796 36 T 4.1055 7.4550 119.0590 63.7576 68.3322 174.2193 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 H 8.29 4.93 0.00 3.25 3.47 0.00 5.59 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 4.30 0.00 2.36 2.34 0.00 3.79 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 3 V 8.52 3.52 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.87 0.00 0.00 4 Y 7.80 4.17 0.00 3.21 2.97 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 5 T 8.54 4.07 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 1.24 0.00 0.00 6 I 7.38 3.96 1.94 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.41 0.90 0.00 0.00 7 L 7.72 4.01 0.00 1.72 1.68 0.79 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 8 A 7.77 4.04 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 9 V 7.53 3.49 2.09 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 1.01 0.00 0.00 0.97 0.00 0.00 10 A 7.76 4.04 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 7.66 4.77 0.00 3.92 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 12 A 7.27 4.41 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.64 3.91 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 14 V 7.45 3.69 2.16 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 1.01 0.00 0.00 0.95 0.00 0.00 15 A 7.33 4.02 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.89 4.30 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.57 0.00 17 M 7.64 4.31 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.56 0.00 18 I 7.77 4.03 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.08 0.91 0.00 0.00 19 G 8.15 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.67 3.86 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 1.07 0.00 0.00 0.95 0.00 0.00 21 T 8.37 3.92 4.25 0.00 0.00 0.00 0.00 0.00 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 22 V 7.87 3.64 2.15 0.00 0.00 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 23 A 7.71 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.72 3.99 2.16 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 1.10 0.00 0.00 0.94 0.00 0.00 25 L 8.02 4.01 0.00 1.85 1.70 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 26 C 7.94 4.11 0.00 3.06 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 27 A 7.46 4.09 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.52 4.12 0.00 3.12 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 29 L 8.23 3.99 0.00 1.68 1.71 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.87 4.02 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.82 4.17 0.00 1.94 1.98 0.00 3.12 0.00 0.00 3.17 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 32 R 8.17 4.13 0.00 1.89 1.96 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 33 E 8.16 4.50 0.00 2.08 1.96 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 2.33 2.36 0.00 34 C 7.83 4.71 0.00 2.99 2.91 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 35 L 7.72 4.15 0.00 1.70 1.73 0.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.45 4.11 4.35 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 1.21 0.00 0.00