NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3169 8.1127 119.7061 56.5184 32.6540 177.2605 2 M 3.8167 8.0225 116.9958 57.7273 32.1801 176.5050 3 K 4.1244 8.7945 120.6348 59.5101 32.8007 178.2840 4 Q 4.0188 7.9170 118.0938 58.8736 28.6655 178.3957 5 L 4.0044 8.1620 120.1383 57.7658 41.6041 179.4444 6 E 3.9812 8.3465 118.7975 59.1991 29.2702 179.0688 7 D 4.3405 8.2163 119.0516 57.2914 40.9356 178.8618 8 K 3.9340 8.1911 119.2627 59.3895 31.9789 179.7444 9 V 3.5954 7.9716 119.4846 64.9352 31.1855 178.2352 10 E 3.8952 8.2480 119.4909 58.9787 29.2980 178.9915 11 E 3.8719 8.4359 119.5851 59.1814 29.6979 178.7238 12 S 4.0216 8.4035 113.6170 61.4483 62.3565 176.2624 13 L 3.5628 8.0706 121.9512 57.4202 41.2960 179.2700 14 S 4.0497 8.1282 113.4301 61.3510 62.2990 176.5254 15 K 3.9678 7.9270 121.0032 59.3517 31.7648 179.2337 16 V 3.5288 7.5778 118.4756 66.4438 31.3709 177.5014 17 Y 4.4602 7.8114 116.3851 61.6244 37.7810 178.3138 18 H 4.2195 8.4573 118.9441 59.3941 29.8977 177.3305 19 L 4.0068 8.4332 121.2087 57.5782 41.3179 179.2324 20 E 3.9864 8.6418 119.1045 59.6098 29.3848 179.1725 21 N 4.3389 8.2984 116.3740 56.3306 38.5513 177.3677 22 E 3.9080 8.1600 120.0068 59.3559 29.4648 179.6306 23 V 3.5576 8.2225 118.4989 65.8914 31.4904 177.8943 24 A 3.9640 8.3273 120.9648 55.2011 18.1491 179.6497 25 R 3.8595 8.1761 117.3580 59.3848 30.0797 178.6147 26 L 3.9785 8.0818 118.9348 57.9197 41.5149 179.7412 27 K 3.8317 8.3272 118.4860 59.1270 31.6786 179.4426 28 K 3.9824 7.6756 119.5077 59.3009 32.2706 178.6272 29 L 4.1726 7.9329 119.0792 58.9081 40.5943 178.6556 30 V 3.6861 8.3626 119.7074 64.4249 31.5368 175.9187 31 G 3.4677 7.6922 112.7041 45.0938 0.0000 172.9263 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 R 8.11 4.32 0.00 1.89 2.04 0.00 3.10 0.00 0.00 3.33 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 2 M 8.02 3.82 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.71 0.00 3 K 8.79 4.12 0.00 1.90 1.78 0.00 1.66 0.00 0.00 1.82 0.00 0.00 3.22 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.50 1.59 7.81 4 Q 7.92 4.02 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.67 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 5 L 8.16 4.00 0.00 1.85 1.71 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.35 3.98 0.00 2.15 1.99 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 2.33 2.61 0.00 7 D 8.22 4.34 0.00 2.85 2.70 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 8 K 8.19 3.93 0.00 1.95 1.84 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.59 7.81 9 V 7.97 3.60 2.18 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 0.91 0.00 0.00 0.91 0.00 0.00 10 E 8.25 3.90 0.00 2.17 2.03 0.00 0.00 0.00 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 2.62 0.00 11 E 8.44 3.87 0.00 2.00 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 0.00 2.28 2.29 0.00 12 S 8.40 4.02 0.00 3.94 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 13 L 8.07 3.56 0.00 1.63 1.05 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.13 4.05 0.00 4.04 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 15 K 7.93 3.97 0.00 1.95 1.83 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.66 7.81 16 V 7.58 3.53 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 1.09 0.00 0.00 0.91 0.00 0.00 17 Y 7.81 4.46 0.00 3.20 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 18 H 8.46 4.22 0.00 3.38 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.43 4.01 0.00 1.84 1.70 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.64 3.99 0.00 2.25 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 2.38 2.63 0.00 21 N 8.30 4.34 0.00 2.84 2.86 0.00 0.00 7.08 7.16 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 22 E 8.16 3.91 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 2.24 2.35 0.00 23 V 8.22 3.56 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 1.09 0.00 0.00 1.00 0.00 0.00 24 A 8.33 3.96 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 25 R 8.18 3.86 0.00 1.88 1.92 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 1.66 0.00 26 L 8.08 3.98 0.00 1.89 1.70 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 27 K 8.33 3.83 0.00 1.92 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.70 7.81 28 K 7.68 3.98 0.00 1.70 1.94 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.44 7.81 29 L 7.93 4.17 0.00 1.82 1.78 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 30 V 8.36 3.69 2.11 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 0.83 0.00 0.00 0.94 0.00 0.00 31 G 7.69 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00