NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 168 S 4.4371 8.3344 116.7981 59.1362 64.6799 173.9569 169 H 4.5913 8.2620 119.9018 54.0996 30.9747 171.9444 170 I 4.5225 8.2839 112.0237 60.3100 39.6827 176.1391 171 R 4.6016 8.1307 117.7215 54.9650 34.1004 174.7897 172 G 4.3494 7.5198 110.7237 44.8880 0.0000 172.4331 173 L 4.7598 7.5096 117.9639 53.8984 41.8734 175.9027 174 M 4.5930 7.5133 118.2303 54.8280 33.7048 176.2498 175 C 4.4554 7.8587 119.5867 59.4264 32.4296 174.1935 176 L 4.1352 8.4612 123.3652 57.8419 41.5094 178.4343 177 E 3.9685 8.1009 117.3270 58.2721 29.8960 175.5945 178 H 4.7073 7.8943 116.3988 54.2957 28.4113 174.3872 179 E 4.2001 8.7008 123.8660 58.2706 30.1278 176.6188 180 D 4.8098 7.8387 117.5832 53.4843 41.7796 175.9116 181 E 4.6667 7.8149 117.8223 54.7647 33.2736 175.1995 182 K 4.3660 8.6924 124.6150 56.3058 33.9551 177.0621 183 V 3.8593 7.4828 112.4048 62.2410 31.8682 175.4730 184 N 4.7314 8.8684 116.7828 55.3788 41.4109 172.9512 185 M 4.6106 7.3286 114.7941 55.2554 36.1436 171.5428 186 Y 5.0859 8.4002 119.1893 56.0292 41.9288 175.0549 187 C 4.2591 8.0601 124.5917 59.0625 28.2785 174.9350 188 V 3.2013 7.9785 125.6887 65.3867 31.5531 177.7222 189 T 3.9138 7.7529 109.3086 64.7087 68.5292 175.0104 190 D 4.3600 7.7898 119.9735 53.2248 42.0309 175.3770 191 D 4.7447 7.8654 116.9782 53.4509 39.1003 173.5619 192 Q 4.6461 7.2034 118.9007 54.9404 32.9081 173.8769 193 L 4.3497 9.0236 129.1415 56.2349 43.1036 175.6078 194 I 4.7340 8.5952 116.5974 60.2474 41.6562 172.2503 195 C 5.3441 8.2730 115.3107 55.8446 32.7587 174.2272 196 A 3.9858 8.4220 119.8357 55.2624 17.8881 179.4606 197 L 3.9298 7.5809 119.1437 58.0944 42.0270 178.8887 198 C 4.3693 7.9159 116.4376 62.2968 28.1437 175.4593 199 K 4.1907 7.6332 118.2062 57.7816 31.7629 177.9882 200 L 4.4101 7.4521 119.4572 56.5668 43.1606 177.7794 201 V 4.0045 7.9921 116.9323 66.2329 32.3621 177.0982 202 G 4.1183 8.1409 114.1265 45.7286 0.0000 174.0914 203 R 4.5550 8.3197 124.4548 56.4080 30.9091 174.9739 204 H 4.4830 8.0795 111.4039 55.3184 29.3247 176.5556 205 R 4.2371 7.8921 117.4990 57.5286 30.3662 176.5994 206 D 4.7358 7.7868 115.0164 54.1603 41.2963 175.6203 207 H 4.7590 7.8072 117.1579 55.5217 30.4458 174.1735 208 Q 4.6429 8.2855 118.1014 55.2417 30.8043 176.0460 209 V 5.2075 8.2021 113.5746 59.9755 36.3628 173.8390 210 A 4.4311 8.4937 123.0199 50.9076 20.6397 175.2874 211 A 4.3185 8.5547 125.4356 52.1244 20.3123 173.4431 212 L 3.4118 8.6426 129.7979 54.2160 40.8723 174.2126 213 S 4.1287 8.6680 122.5404 58.5176 63.0007 174.6971 214 E 4.1377 8.8155 122.6283 56.6138 29.1967 176.7870 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 168 S 8.33 4.44 0.00 3.89 3.89 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 0.00 169 H 8.26 4.59 0.00 3.12 3.17 0.00 5.70 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 I 8.28 4.52 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.78 0.91 0.00 0.00 171 R 8.13 4.60 0.00 1.68 1.76 0.00 3.29 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 172 G 7.52 4.35 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 0.00 173 L 7.51 4.76 0.00 1.68 1.60 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 174 M 7.51 4.59 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.61 0.00 175 C 7.86 4.46 0.00 2.94 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 0.00 176 L 8.46 4.14 0.00 1.66 1.70 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 177 E 8.10 3.97 0.00 1.83 1.72 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 2.20 2.32 0.00 178 H 7.89 4.71 0.00 3.16 3.27 0.00 5.94 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 E 8.70 4.20 0.00 2.08 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 0.00 2.27 2.30 0.00 180 D 7.84 4.81 0.00 2.65 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 0.00 181 E 7.81 4.67 0.00 1.90 1.79 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 2.29 2.23 0.00 182 K 8.69 4.37 0.00 1.77 1.83 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.71 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.48 7.81 183 V 7.48 3.86 2.20 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 0.76 0.00 0.00 1.02 0.00 0.00 184 N 8.87 4.73 0.00 2.64 2.75 0.00 0.00 6.96 7.67 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 0.00 185 M 7.33 4.61 0.00 2.11 1.89 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 186 Y 8.40 5.09 0.00 3.06 2.79 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 0.00 187 C 8.06 4.26 0.00 2.94 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.98 3.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.99 0.00 0.00 189 T 7.75 3.91 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 1.17 0.00 0.00 190 D 7.79 4.36 0.00 2.65 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 0.00 191 D 7.87 4.74 0.00 2.88 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 7.20 4.65 0.00 2.17 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 193 L 9.02 4.35 0.00 1.79 1.63 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.60 4.73 1.76 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.37 0.77 0.00 0.00 195 C 8.27 5.34 0.00 3.32 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 0.00 196 A 8.42 3.99 1.32 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 0.00 0.00 197 L 7.58 3.93 0.00 2.03 1.30 0.88 0.91 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 0.00 198 C 7.92 4.37 0.00 3.14 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 K 7.63 4.19 0.00 1.85 1.86 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.66 7.81 200 L 7.45 4.41 0.00 1.82 1.64 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 201 V 7.99 4.00 2.23 0.00 0.00 0.00 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 0.98 0.00 0.00 202 G 8.14 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 203 R 8.32 4.55 0.00 1.64 1.70 0.00 3.19 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.55 0.00 204 H 8.08 4.48 0.00 3.14 3.26 0.00 5.74 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 R 7.89 4.24 0.00 1.89 2.22 0.00 2.99 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.60 0.00 206 D 7.79 4.74 0.00 2.66 2.72 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 0.00 207 H 7.81 4.76 0.00 3.01 3.21 0.00 5.70 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 Q 8.29 4.64 0.00 1.92 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.49 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 209 V 8.20 5.21 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 0.77 0.00 0.00 0.93 0.00 0.00 210 A 8.49 4.43 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 0.00 211 A 8.55 4.32 1.25 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 0.00 0.00 0.00 212 L 8.64 3.41 0.00 1.77 1.72 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 213 S 8.67 4.13 0.00 3.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 E 8.82 4.14 0.00 2.08 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 2.28 2.26 0.00