NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.2735 8.0427 122.4908 54.9173 44.5226 178.6655 4 K 3.7364 8.0868 119.4513 58.7834 32.0402 177.0055 5 Q 4.0181 8.2103 119.3288 58.6596 29.4416 177.5879 6 V 3.5538 7.7504 119.0517 65.8618 31.6630 177.5983 7 A 4.0148 8.0234 120.5352 55.3974 18.2220 179.3669 8 D 4.3268 8.3242 117.6218 57.1208 40.7685 178.8966 9 K 4.2695 7.9240 119.1128 59.3250 32.9719 179.2362 10 L 3.9504 7.9738 120.4637 57.6599 41.5036 179.0023 11 E 4.0024 8.4595 119.4389 58.8972 29.6131 178.4204 12 E 3.9475 8.1601 119.8740 59.3315 29.6943 179.3096 13 V 3.6182 8.1120 119.2083 64.5112 31.5066 177.9367 14 A 3.7940 8.0250 121.4661 55.2297 18.2307 179.7771 15 S 4.3892 8.2448 113.4123 61.8245 62.8588 177.1760 16 K 4.0256 8.0423 120.9483 59.4486 31.7081 179.4105 17 L 3.9431 8.2595 119.6971 57.8392 41.3944 179.1908 18 Y 4.1902 7.8281 116.6799 61.3140 37.8708 177.8748 19 H 4.0737 8.2959 119.0924 59.5931 29.9387 176.9335 20 N 4.3820 8.4735 117.8828 56.2886 38.3476 177.2300 21 A 4.0346 8.4117 122.5491 55.3004 18.4680 179.4967 22 N 4.2964 8.4584 115.1359 56.3698 38.6033 177.3155 23 E 3.9310 8.2740 120.7552 59.2455 29.7274 178.8389 24 L 3.9866 8.0649 118.8679 57.7161 41.7088 179.3643 25 A 4.0471 8.1358 120.8022 55.2000 18.2763 179.9807 26 R 3.8707 8.0662 116.6448 59.3617 30.1045 179.4656 27 V 3.5716 8.0135 117.9254 65.8412 31.5178 177.9113 28 A 3.9713 8.4855 121.0572 54.9592 17.9752 179.5350 29 K 3.8640 8.0074 118.0264 59.4156 32.0711 178.5842 30 L 3.9753 7.7726 119.4482 58.4877 42.4721 178.8824 31 L 4.2756 8.2499 118.4171 57.0231 41.3940 179.1077 32 G 3.7883 7.8858 104.3548 46.3985 0.0000 174.7918 33 E 4.2114 7.7857 119.1448 56.1290 29.9452 176.4392 34 R 4.3075 7.5691 122.2941 56.6235 30.7096 175.8558 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 3 L 8.04 4.27 0.00 1.74 1.73 0.92 0.07 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 4 K 8.09 3.74 0.00 1.91 1.79 0.00 1.79 0.00 0.00 1.92 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.50 7.81 5 Q 8.21 4.02 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.69 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 6 V 7.75 3.55 2.24 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 0.99 0.00 0.00 0.93 0.00 0.00 7 A 8.02 4.01 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 8 D 8.32 4.33 0.00 2.87 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.92 4.27 0.00 2.02 2.06 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.72 1.47 7.81 10 L 7.97 3.95 0.00 1.91 1.76 0.92 0.62 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 11 E 8.46 4.00 0.00 2.10 2.12 0.00 0.00 0.00 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 2.39 0.00 12 E 8.16 3.95 0.00 2.21 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 2.31 2.33 0.00 13 V 8.11 3.62 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.90 0.00 0.00 14 A 8.02 3.79 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.24 4.39 0.00 4.11 4.01 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 0.00 0.00 0.00 0.00 16 K 8.04 4.03 0.00 1.98 1.85 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.66 7.81 17 L 8.26 3.94 0.00 1.56 1.52 0.81 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 7.83 4.19 0.00 3.29 2.95 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 0.00 0.00 0.00 19 H 8.30 4.07 0.00 3.34 3.52 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.47 4.38 0.00 2.95 2.86 0.00 0.00 6.96 6.93 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 21 A 8.41 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.46 4.30 0.00 2.87 2.85 0.00 0.00 6.66 7.54 0.00 0.00 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 E 8.27 3.93 0.00 2.07 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 2.32 2.40 0.00 24 L 8.06 3.99 0.00 1.91 1.71 0.92 0.79 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 25 A 8.14 4.05 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 26 R 8.07 3.87 0.00 2.01 1.98 0.00 3.12 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 27 V 8.01 3.57 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 0.98 0.00 0.00 28 A 8.49 3.97 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 29 K 8.01 3.86 0.00 1.95 1.97 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.59 7.81 30 L 7.77 3.98 0.00 1.94 1.77 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.25 4.28 0.00 1.73 1.70 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 G 7.89 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 33 E 7.79 4.21 0.00 2.06 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 0.00 2.30 2.59 0.00 34 R 7.57 4.31 0.00 2.01 1.96 0.00 3.19 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00