NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.5622 8.3093 122.8212 57.3902 40.5883 174.4940 2 V 3.4052 7.1006 125.5780 60.5964 31.6326 174.6557 3 N 5.0529 9.1458 119.4119 51.0536 37.6038 173.9626 4 Q 4.5825 7.5086 120.7548 54.7056 33.6983 174.7794 5 H 4.2045 8.7095 116.7582 55.9537 29.1304 175.2299 6 L 4.6795 8.5189 124.0153 53.2848 43.1362 175.5137 7 C 4.9960 8.2224 120.4551 58.0777 33.1520 175.1630 8 G 3.7919 8.5640 109.6268 46.6277 0.0000 176.5671 9 S 4.1029 8.3964 115.0299 60.8101 63.4682 176.4381 10 H 4.2943 8.0392 119.2837 58.5883 28.3057 177.2435 11 L 4.0378 7.8777 122.1548 57.8214 41.8364 179.1388 12 V 3.2343 7.3176 118.0402 65.6166 31.5350 177.5057 13 E 3.9129 8.2520 118.9407 58.8747 29.4104 178.6764 14 A 4.1072 7.8301 120.6981 55.0644 18.3867 179.6042 15 L 3.6875 7.6273 117.5576 57.7658 41.2628 178.9254 16 Y 4.2223 7.6982 119.5539 60.8606 38.4888 177.9483 17 L 3.9500 7.8910 119.6446 58.1322 42.3768 178.4527 18 V 3.6402 8.0330 117.9190 66.4132 31.7642 177.5681 19 C 4.2930 8.6581 116.1646 60.4863 28.5372 175.1505 20 G 3.6323 8.1977 110.1994 46.2396 0.0000 176.4001 21 E 4.0580 8.8065 121.4036 58.8456 29.5615 178.3906 22 R 3.8676 7.8357 117.7617 57.0836 30.1907 177.9245 23 G 3.9984 9.1757 104.2414 45.2982 0.0000 171.5116 24 F 4.9584 7.5085 112.6281 55.5661 40.5995 173.3045 25 F 4.8704 8.2789 115.1019 55.0994 39.8160 173.7648 26 Y 4.6628 9.0414 126.5015 56.0363 39.0220 174.7648 27 T 4.3983 7.8730 117.4717 58.6936 68.8895 172.3071 28 P 4.0747 0.0000 0.0000 66.3492 31.7988 178.6706 29 K 4.1095 8.1917 118.0962 56.4494 32.0553 176.4715 30 T 3.9610 7.2985 112.7866 61.8210 70.6002 172.1637 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 F 8.31 4.56 0.00 2.98 3.04 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 2 V 7.10 3.41 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.80 0.00 0.00 3 N 9.15 5.05 0.00 2.78 2.86 0.00 0.00 5.85 7.39 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 4 Q 7.51 4.58 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 6.95 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 5 H 8.71 4.20 0.00 3.16 3.27 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.52 4.68 0.00 1.65 1.63 1.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.22 5.00 0.00 2.98 2.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.56 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 0.00 0.00 0.00 9 S 8.40 4.10 0.00 3.88 4.02 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 0.00 0.00 0.00 10 H 8.04 4.29 0.00 3.42 3.35 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.88 4.04 0.00 1.92 1.84 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.32 3.23 1.98 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 0.96 0.00 0.00 0.18 0.00 0.00 13 E 8.25 3.91 0.00 2.08 1.92 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 2.31 2.40 0.00 14 A 7.83 4.11 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.63 3.69 0.00 0.83 0.64 0.73 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.70 4.22 0.00 3.15 3.30 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 17 L 7.89 3.95 0.00 1.78 1.92 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 18 V 8.03 3.64 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 0.70 0.00 0.00 0.64 0.00 0.00 19 C 8.66 4.29 0.00 3.19 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 20 G 8.20 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.81 4.06 0.00 1.95 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 2.29 2.31 0.00 22 R 7.84 3.87 0.00 2.01 2.03 0.00 3.23 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 23 G 9.18 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.51 4.96 0.00 2.99 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 25 F 8.28 4.87 0.00 3.15 3.07 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 0.00 0.00 0.00 26 Y 9.04 4.66 0.00 3.18 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 27 T 7.87 4.40 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 1.31 0.00 0.00 28 P 0.00 4.07 0.00 2.14 2.02 0.00 3.49 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.81 0.00 29 K 8.19 4.11 0.00 1.72 1.81 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.41 7.81 30 T 7.30 3.96 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 1.31 0.00 0.00