NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2846 8.3444 121.7160 55.7080 31.0848 175.2487 2 S 4.2202 7.9388 112.3549 55.9754 62.8298 171.2960 3 P 4.5518 0.0000 0.0000 63.9901 33.2036 175.3644 4 M 4.7689 7.8009 118.1993 53.3024 31.9772 172.8604 5 P 4.3876 0.0000 0.0000 62.6491 32.6947 176.4048 6 L 4.7055 8.1464 121.2373 53.1071 43.6939 176.5977 7 T 4.0499 8.7513 120.6575 66.1641 68.8043 175.0079 8 V 4.5001 7.3698 112.6155 58.9862 35.5041 176.5604 9 A 3.9256 8.6026 124.9964 54.8759 18.4469 179.6659 10 A 4.0306 8.0762 117.5800 54.7931 18.6127 178.5269 11 A 4.0881 7.9752 118.9712 55.2547 18.6706 177.9988 12 S 4.4995 7.8617 110.2582 55.5401 63.7907 172.4370 13 P 4.3241 0.0000 0.0000 65.0870 31.1511 177.7141 14 E 3.8082 8.0136 116.9284 59.4052 29.1840 179.0400 15 L 3.9668 7.8837 121.1655 57.1897 41.9151 178.7874 16 A 3.9711 7.6868 120.1089 55.0890 18.4962 179.1233 17 S 4.2421 8.4544 109.7191 58.7001 62.7767 173.8778 18 G 3.6359 7.4401 108.4542 47.2718 0.0000 174.5297 19 K 4.0035 8.0407 119.4233 56.1565 33.0297 177.4808 20 V 3.9367 6.0636 117.1536 59.6022 34.1512 173.4702 21 W 5.0596 8.2875 120.1687 54.5211 32.7055 175.4899 22 I 3.6230 8.3879 122.2134 61.5595 36.9470 176.6347 23 R 4.2264 8.2350 124.2703 55.3331 29.1184 175.3750 24 Y 4.4181 8.3136 121.7038 55.7389 38.4912 174.4266 25 P 4.4737 0.0000 0.0000 63.0175 31.4427 176.1940 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 Q 8.34 4.28 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 2 S 7.94 4.22 0.00 4.01 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 P 0.00 4.55 0.00 2.18 2.17 0.00 3.86 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.86 0.00 4 M 7.80 4.77 0.00 1.93 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 5 P 0.00 4.39 0.00 2.22 2.05 0.00 3.79 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 6 L 8.15 4.71 0.00 1.63 1.76 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.75 4.05 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 8 V 7.37 4.50 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 0.81 0.00 0.00 0.92 0.00 0.00 9 A 8.60 3.93 1.29 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 0.00 0.00 0.00 10 A 8.08 4.03 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.98 4.09 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 12 S 7.86 4.50 0.00 3.77 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.32 0.00 2.15 2.06 0.00 3.62 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 14 E 8.01 3.81 0.00 1.95 1.84 0.00 0.00 0.00 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 2.34 0.00 15 L 7.88 3.97 0.00 1.61 1.57 0.91 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.69 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.45 4.24 0.00 3.78 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 18 G 7.44 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.04 4.00 0.00 1.47 1.67 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.27 1.39 7.81 20 V 6.06 3.94 1.85 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 0.60 0.00 0.00 0.87 0.00 0.00 21 W 8.29 5.06 0.00 3.44 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 22 I 8.39 3.62 1.45 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.42 0.23 0.00 0.00 23 R 8.24 4.23 0.00 1.77 1.91 0.00 3.22 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 24 Y 8.31 4.42 0.00 3.01 2.87 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 25 P 0.00 4.47 0.00 2.22 2.07 0.00 3.96 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00