NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 Q 4.4015 8.3449 121.7095 56.0525 31.7418 172.8809 3 E 4.1349 8.7240 121.3382 53.6040 28.7248 174.8922 4 S 3.5700 10.0206 126.7818 59.3433 64.8773 172.5658 5 C 4.6408 8.7939 120.7989 57.0545 40.8354 174.7028 6 K 3.9005 7.6955 120.2383 58.3874 31.7411 175.1371 7 G 3.7238 8.0887 107.7089 46.4491 0.0000 172.0870 8 R 3.9553 9.3033 128.0727 56.9144 28.6739 179.5902 9 C 4.1731 9.5885 114.2662 57.2817 43.4330 173.5961 10 T 4.6470 7.2046 113.5176 63.2949 69.7212 173.3625 11 E 4.0582 8.3061 125.5703 59.3185 30.9007 177.0526 12 G 3.7759 7.6203 103.9768 44.0314 0.0000 171.3965 13 F 4.3960 8.5309 123.8564 58.0497 39.5801 175.5624 14 N 4.4365 8.7084 128.4799 51.1989 38.0432 174.3280 15 V 3.1954 7.5957 125.2674 63.2877 31.8159 176.9151 16 D 4.6634 7.2473 120.6116 50.1558 38.1547 174.5081 17 K 4.3951 7.2863 123.6493 56.0176 36.8347 173.8901 18 K 4.3236 8.9333 127.1315 56.6438 30.7604 179.4044 19 C 4.6302 9.3199 117.6845 56.4701 38.1341 173.0021 20 Q 4.8317 8.9125 119.4411 54.7126 31.1683 175.5791 21 C 4.7673 8.5513 114.9093 56.6042 37.5297 174.0721 22 D 4.7925 7.7187 121.4222 51.7847 40.7739 176.7272 23 E 4.1643 8.7283 116.1415 58.4679 29.8280 177.5126 24 L 4.7897 7.8112 118.4195 54.5185 42.5907 175.7924 25 C 4.4722 8.3129 116.7765 57.9708 36.2951 176.1756 26 S 3.9146 8.1098 115.1341 61.0683 62.8283 175.6896 27 Y 3.9905 8.0308 120.7985 60.7954 38.4660 176.3869 28 Y 3.8720 8.1168 113.9981 57.8179 38.4990 175.1601 29 Q 3.5919 7.6642 117.8113 57.3974 26.5553 173.9932 30 S 4.6646 8.7535 108.7530 57.6755 64.7898 173.6517 31 C 5.1226 7.9412 117.5814 56.9119 37.6997 173.8351 32 C 4.7570 8.4077 118.3534 56.7794 40.6339 175.3481 33 T 3.9716 8.5367 119.2213 65.5246 68.1145 174.8217 34 D 4.8027 7.9448 120.1635 53.0971 40.0960 177.1268 35 Y 4.1627 8.3017 121.8998 61.5043 38.3406 177.9841 36 T 3.7410 8.1027 115.9613 67.4458 68.8179 175.5309 37 A 4.0185 7.9771 120.5676 55.2334 18.1986 178.7989 38 E 3.9067 9.7112 116.1283 58.0267 30.9028 174.9070 39 C 5.0950 7.6176 114.0963 51.5686 41.5502 173.7870 40 K 4.5123 6.8936 126.8498 56.8087 34.3609 172.3997 41 P 4.3925 0.0000 0.0000 62.8014 31.2850 176.8750 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 2 Q 8.34 4.40 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 3 E 8.72 4.13 0.00 2.07 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.36 0.00 4 S 10.02 3.57 0.00 4.13 3.94 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 0.00 0.00 0.00 5 C 8.79 4.64 0.00 3.19 3.29 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 6 K 7.70 3.90 0.00 1.79 1.86 0.00 1.63 0.00 0.00 1.20 0.00 0.00 3.12 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.43 1.52 7.81 7 G 8.09 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.30 3.96 0.00 2.06 2.06 0.00 3.18 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 9 C 9.59 4.17 0.00 3.18 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.20 4.65 4.28 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 1.27 0.00 0.00 11 E 8.31 4.06 0.00 1.93 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 2.27 2.30 0.00 12 G 7.62 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 0.00 0.00 0.00 13 F 8.53 4.40 0.00 2.88 2.96 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 0.00 0.00 0.00 14 N 8.71 4.44 0.00 2.48 2.47 0.00 0.00 7.29 8.35 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 15 V 7.60 3.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.06 0.00 0.00 16 D 7.25 4.66 0.00 2.74 2.67 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 0.00 0.00 0.00 0.00 17 K 7.29 4.40 0.00 1.84 1.58 0.00 1.60 0.00 0.00 1.64 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.19 1.40 7.81 18 K 8.93 4.32 0.00 1.77 1.21 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.41 7.81 19 C 9.32 4.63 0.00 3.30 3.11 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 0.00 0.00 0.00 0.00 20 Q 8.91 4.83 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.71 0.00 21 C 8.55 4.77 0.00 2.98 3.34 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 22 D 7.72 4.79 0.00 2.89 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.73 4.16 0.00 2.16 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 0.00 2.34 2.32 0.00 24 L 7.81 4.79 0.00 1.98 1.87 1.01 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.31 4.47 0.00 3.04 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 26 S 8.11 3.91 0.00 4.06 4.21 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.03 3.99 0.00 2.73 3.01 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 28 Y 8.12 3.87 0.00 3.01 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 29 Q 7.66 3.59 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 30 S 8.75 4.66 0.00 3.96 4.08 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 0.00 0.00 0.00 0.00 31 C 7.94 5.12 0.00 2.99 3.01 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 32 C 8.41 4.76 0.00 3.14 3.11 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 0.00 0.00 0.00 0.00 33 T 8.54 3.97 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 34 D 7.94 4.80 0.00 2.86 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 8.30 4.16 0.00 3.06 3.08 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 0.00 0.00 0.00 0.00 36 T 8.10 3.74 4.26 0.00 0.00 0.00 0.00 0.00 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 37 A 7.98 4.02 1.30 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 0.00 0.00 38 E 9.71 3.91 0.00 1.92 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 2.42 2.58 0.00 39 C 7.62 5.09 0.00 2.99 3.02 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 40 K 6.89 4.51 0.00 1.30 1.41 0.00 1.62 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.06 1.22 7.81 41 P 0.00 4.39 0.00 2.05 1.91 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.15 0.00