NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2846 8.1127 119.7060 55.8494 33.0208 176.8184 2 M 3.7201 8.0685 117.0554 58.2745 32.4716 176.8470 3 K 3.8190 8.2582 119.4265 59.6202 32.7321 177.6034 4 Q 3.9338 8.0447 118.9612 59.2883 28.9984 177.9114 5 L 3.9470 7.7570 119.5695 58.1501 41.5273 179.1921 6 E 3.9563 8.2801 117.3885 59.9235 29.6531 179.1984 7 D 4.4310 8.1820 118.5827 57.3223 40.6746 178.6706 8 K 3.8901 8.2579 119.9486 59.2567 32.0659 178.6276 9 V 3.7441 7.6541 118.2208 65.3589 31.6427 177.6233 10 E 4.0211 8.0081 117.8836 58.5589 29.2274 178.8902 11 E 3.8356 7.9492 119.3260 59.2830 29.9469 178.5489 12 L 3.9941 7.5098 118.6481 57.7609 41.4195 179.5391 13 L 3.8402 7.8056 118.9504 57.1764 41.2835 179.5188 14 S 3.6255 7.5668 113.2551 61.2324 62.3380 176.2124 15 K 4.0034 8.2185 121.6120 59.5474 31.7534 179.0367 16 Q 3.9551 8.0790 119.7108 59.3649 29.0683 177.9300 17 Y 4.3592 7.5925 117.6669 61.4078 37.9451 178.2431 18 H 4.2499 8.0308 117.5845 59.3878 30.1302 176.9897 19 L 3.9421 8.1474 121.0089 58.2202 41.4622 179.6253 20 E 4.0053 8.3006 118.1620 59.4451 29.4276 179.1035 21 N 4.3504 8.0933 116.1196 56.2742 38.4912 177.3329 22 E 3.9226 8.1601 119.9811 59.4742 29.6028 179.6387 23 V 3.5827 7.7729 117.9429 65.7265 31.5467 177.9860 24 A 3.9768 8.1481 120.7315 55.2281 18.4090 179.6760 25 R 3.9038 8.1227 117.1729 59.3876 29.5669 178.7368 26 L 4.0499 8.2462 119.4918 57.5342 41.6719 179.5350 27 K 4.0262 8.1711 118.6546 59.0735 31.7144 179.2226 28 K 3.9104 7.6346 118.5599 59.5818 32.3618 178.1904 29 L 3.7891 8.2837 116.0138 57.7764 41.3356 180.1005 30 V 2.9401 5.8432 119.2836 62.7833 33.9035 175.3802 31 G 4.5094 6.9950 118.0654 45.1073 0.0000 171.9108 32 E 4.2425 8.3380 120.0446 56.1157 29.8267 175.7765 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 4.28 0.00 1.89 1.89 0.00 3.12 0.00 0.00 3.33 7.90 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 8.07 3.72 0.00 2.20 2.08 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 2.67 2.71 0.00 3 K 8.26 3.82 0.00 1.90 1.80 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.57 7.81 4 Q 8.04 3.93 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.65 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 5 L 7.76 3.95 0.00 1.96 1.70 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.28 3.96 0.00 2.04 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 2.30 2.58 0.00 7 D 8.18 4.43 0.00 2.88 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 8.26 3.89 0.00 2.02 1.92 0.00 1.49 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 9 V 7.65 3.74 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 0.97 0.00 0.00 0.92 0.00 0.00 10 E 8.01 4.02 0.00 1.97 1.94 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 2.30 2.44 0.00 11 E 7.95 3.84 0.00 2.00 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 2.34 2.36 0.00 12 L 7.51 3.99 0.00 1.82 1.65 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.81 3.84 0.00 1.72 1.23 0.96 0.95 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 14 S 7.57 3.63 0.00 3.99 3.85 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 15 K 8.22 4.00 0.00 1.88 1.84 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.69 7.81 16 Q 8.08 3.96 0.00 2.32 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 17 Y 7.59 4.36 0.00 3.11 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 18 H 8.03 4.25 0.00 3.29 3.48 0.00 5.63 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 19 L 8.15 3.94 0.00 1.99 1.74 0.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.30 4.01 0.00 2.23 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 2.37 2.64 0.00 21 N 8.09 4.35 0.00 2.92 2.87 0.00 0.00 7.04 7.12 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 22 E 8.16 3.92 0.00 2.09 1.94 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 2.18 2.23 0.00 23 V 7.77 3.58 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 1.01 0.00 0.00 0.95 0.00 0.00 24 A 8.15 3.98 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 25 R 8.12 3.90 0.00 1.90 2.08 0.00 3.10 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 26 L 8.25 4.05 0.00 1.89 1.70 0.92 0.73 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 27 K 8.17 4.03 0.00 2.10 1.85 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.44 7.81 28 K 7.63 3.91 0.00 1.72 2.00 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.53 7.81 29 L 8.28 3.79 0.00 1.82 1.52 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 30 V 5.84 2.94 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.98 0.00 0.00 31 G 6.99 4.51 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 0.00 32 E 8.34 4.24 0.00 2.06 1.91 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 2.18 2.27 0.00