NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 148 T 5.2019 8.3998 116.7649 64.3235 68.9774 173.0596 149 S 4.2887 8.6706 116.5768 57.1804 64.1037 175.3549 150 I 3.5910 8.5284 123.9761 64.1393 38.6857 178.8076 151 L 4.0844 7.9039 119.0480 57.5139 41.4908 177.4615 152 D 4.5621 8.1831 116.4771 54.7276 41.1098 176.9939 153 I 4.1767 7.3925 120.8512 60.6048 35.8825 175.0309 154 R 5.0340 8.1190 123.2426 53.8858 33.4104 175.3574 155 Q 4.0266 8.5331 124.0422 55.5592 29.2236 176.2901 156 G 3.8930 9.7107 114.3520 45.3939 0.0000 172.6587 157 P 4.3592 0.0000 0.0000 64.9987 31.2245 177.3820 158 K 4.5514 7.7543 114.0153 55.3898 33.3604 175.4955 159 E 4.1314 7.6662 120.5153 55.2695 30.2757 175.4642 160 P 4.5176 0.0000 0.0000 62.1199 33.2884 177.1726 161 F 4.4647 9.1285 123.8277 61.7400 39.1373 177.3458 162 R 3.8189 8.1920 117.5115 59.7691 29.7663 177.8832 163 D 4.3832 8.1793 117.9157 57.6174 40.7118 178.1696 164 Y 4.3246 8.1341 119.8967 60.8613 38.9575 178.3319 165 V 3.1377 8.0390 119.4472 65.7322 31.3702 177.7686 166 D 4.4001 8.2468 118.8792 57.5089 40.4340 178.8417 167 R 4.0539 7.8573 117.6906 58.1511 29.9144 178.9141 168 F 3.7361 7.7704 121.0946 61.4134 39.0426 176.8780 169 Y 4.1841 7.8643 115.0780 59.9929 37.7323 177.9013 170 K 4.0508 7.8500 121.4807 59.5186 32.3418 178.9187 171 T 3.8671 7.3912 115.8476 66.4699 68.2563 176.7986 172 L 3.9400 7.5736 120.9901 57.4165 41.5634 179.7454 173 R 3.8696 7.7016 117.3107 59.2247 29.8629 178.6295 174 A 4.0323 7.4760 118.4938 55.3804 18.6214 178.8055 175 E 4.2460 8.1180 114.5653 55.6341 29.1571 177.0726 176 Q 3.3303 8.4222 116.3701 56.1984 27.2005 174.0488 177 A 4.0327 7.8864 119.7606 52.5394 19.0619 179.4591 178 S 4.4989 8.4219 117.1275 57.7235 65.7323 175.2993 179 Q 4.1931 8.5781 122.3988 59.3029 28.5427 177.9382 180 E 4.1030 8.1859 120.1432 59.1226 29.7980 178.7588 181 V 3.7431 7.8020 118.1838 65.8444 31.4275 178.2238 182 K 4.2111 8.7018 118.7228 59.2969 31.5869 179.2118 183 N 4.5065 7.9568 116.0805 56.2004 38.4111 177.1940 184 W 4.2226 8.1896 120.4207 60.1002 29.1742 178.5854 185 M 4.3928 8.2915 119.9343 58.1811 31.1274 178.9798 186 T 4.0412 7.5785 114.0261 66.2729 68.7592 176.0700 187 E 4.3091 7.8643 118.1303 57.4584 29.7015 176.5676 188 T 4.4833 7.8843 106.1307 61.4592 71.2374 175.6700 189 L 4.1278 8.7800 120.0208 57.3020 42.2481 178.6093 190 L 2.9690 8.0100 118.9893 57.9715 42.3372 179.0219 191 V 3.7824 7.6347 117.5060 66.1265 31.4105 177.6494 192 Q 4.1835 8.4813 118.4898 58.4484 29.1241 176.5511 193 N 4.8482 8.5433 116.7448 52.2095 38.7510 174.6432 194 A 4.2317 6.7719 123.0650 50.4499 20.5273 178.2341 195 N 4.5023 8.9993 118.1281 51.9873 39.4298 174.4264 196 P 4.1576 0.0000 0.0000 66.1819 31.3316 178.5158 197 D 4.2578 8.0270 116.6610 57.4900 40.8417 179.0505 198 C 4.0334 8.4337 118.7811 59.6604 41.8149 175.3917 199 K 3.4280 8.5783 121.4108 60.0390 31.4015 178.7872 200 T 3.9510 7.4669 114.7091 66.3029 68.6506 176.8467 201 I 3.8203 7.8065 121.9211 64.4523 36.6955 178.4622 202 L 3.9352 8.6401 120.8001 57.7613 41.2020 179.7088 203 K 4.0842 7.9463 116.9368 58.6260 31.8560 178.6594 204 A 4.2389 8.0081 121.2913 54.3813 18.4661 179.4734 205 L 3.9761 7.2833 116.3027 55.3643 41.9407 178.7868 206 G 3.9577 6.8954 100.8016 44.5106 0.0000 171.3407 207 P 4.2493 0.0000 0.0000 64.1126 31.3700 175.6817 208 G 3.7963 8.5094 114.8450 45.6369 0.0000 172.6503 209 A 4.8036 7.8539 122.5007 50.0338 21.1662 178.6500 210 T 4.1667 8.3503 112.5688 61.2819 71.0074 175.7697 211 L 4.0403 8.3952 123.1855 58.3769 42.1542 178.8201 212 E 4.0253 8.1581 118.8423 59.1125 29.5518 178.5410 213 E 3.9987 8.0808 118.7071 59.5886 29.3062 179.1375 214 M 4.0467 7.8840 117.7597 58.5262 32.4315 178.4678 215 M 4.6152 8.3917 118.8910 58.7587 31.9658 178.8070 216 T 3.8612 7.6927 114.3299 66.7888 68.7965 176.2943 217 A 4.0851 7.9926 120.8589 54.3066 18.3399 176.7329 218 C 4.4265 7.6372 118.5208 57.1157 41.7774 173.7497 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 148 T 8.40 5.20 4.22 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 0.00 0.00 1.17 0.00 0.00 149 S 8.67 4.29 0.00 3.97 4.06 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 0.00 0.00 0.00 0.00 150 I 8.53 3.59 1.70 0.00 0.00 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.90 0.86 0.00 0.00 151 L 7.90 4.08 0.00 1.68 1.74 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.18 4.56 0.00 2.73 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 0.00 153 I 7.39 4.18 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.60 1.13 0.00 0.00 154 R 8.12 5.03 0.00 1.68 1.79 0.00 3.22 0.00 0.00 3.16 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 155 Q 8.53 4.03 0.00 0.93 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.93 0.00 0.00 0.00 0.00 0.00 2.24 2.13 0.00 156 G 9.71 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 0.00 0.00 0.00 157 P 0.00 4.36 0.00 2.18 2.20 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 158 K 7.75 4.55 0.00 1.72 1.82 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.32 7.81 159 E 7.67 4.13 0.00 1.97 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 0.00 2.41 2.34 0.00 160 P 0.00 4.52 0.00 2.41 2.01 0.00 3.84 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 2.25 2.17 0.00 161 F 9.13 4.46 0.00 3.10 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 R 8.19 3.82 0.00 1.97 1.97 0.00 3.27 0.00 0.00 3.37 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.74 0.00 163 D 8.18 4.38 0.00 2.99 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 Y 8.13 4.32 0.00 3.01 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 0.00 165 V 8.04 3.14 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 1.04 0.00 0.00 -0.05 0.00 0.00 166 D 8.25 4.40 0.00 2.91 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 R 7.86 4.05 0.00 1.87 2.00 0.00 3.16 0.00 0.00 3.14 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.98 0.00 168 F 7.77 3.74 0.00 2.67 2.66 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 0.00 169 Y 7.86 4.18 0.00 3.08 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 0.00 170 K 7.85 4.05 0.00 2.00 1.78 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.48 7.81 171 T 7.39 3.87 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 1.09 0.00 0.00 172 L 7.57 3.94 0.00 1.52 1.69 0.62 0.97 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 0.00 173 R 7.70 3.87 0.00 2.08 1.98 0.00 3.16 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.94 0.00 174 A 7.48 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 0.00 175 E 8.12 4.25 0.00 1.98 1.92 0.00 0.00 0.00 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 2.52 0.00 176 Q 8.42 3.33 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.44 0.00 177 A 7.89 4.03 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 S 8.42 4.50 0.00 4.09 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 8.58 4.19 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 180 E 8.19 4.10 0.00 2.16 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 2.65 2.52 0.00 181 V 7.80 3.74 2.36 0.00 0.00 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 0.94 0.00 0.00 182 K 8.70 4.21 0.00 2.10 2.08 0.00 1.95 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.60 1.81 7.81 183 N 7.96 4.51 0.00 3.02 2.85 0.00 0.00 7.04 7.23 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 0.00 184 W 8.19 4.22 0.00 3.37 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 0.00 185 M 8.29 4.39 0.00 2.34 2.30 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 2.68 2.89 0.00 186 T 7.58 4.04 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 187 E 7.86 4.31 0.00 2.00 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 2.52 2.21 0.00 188 T 7.88 4.48 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 189 L 8.78 4.13 0.00 2.01 2.23 1.13 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 190 L 8.01 2.97 0.00 0.76 1.66 -0.25 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 191 V 7.63 3.78 2.27 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 0.99 0.00 0.00 1.01 0.00 0.00 192 Q 8.48 4.18 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.08 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 193 N 8.54 4.85 0.00 3.25 3.11 0.00 0.00 6.72 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 A 6.77 4.23 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 N 9.00 4.50 0.00 2.91 2.88 0.00 0.00 7.33 7.65 0.00 0.00 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 P 0.00 4.16 0.00 2.14 2.16 0.00 3.56 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 197 D 8.03 4.26 0.00 2.87 2.66 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 0.00 198 C 8.43 4.03 0.00 2.94 2.94 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 0.00 199 K 8.58 3.43 0.00 1.99 1.94 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.61 7.81 200 T 7.47 3.95 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 201 I 7.81 3.82 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.83 0.89 0.00 0.00 202 L 8.64 3.94 0.00 1.57 1.68 0.83 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 203 K 7.95 4.08 0.00 1.97 1.86 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.62 7.81 204 A 8.01 4.24 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 L 7.28 3.98 0.00 1.83 1.73 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 206 G 6.90 3.96 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 0.00 0.00 0.00 207 P 0.00 4.25 0.00 2.14 2.07 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 208 G 8.51 3.80 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 0.00 0.00 0.00 209 A 7.85 4.80 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 210 T 8.35 4.17 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 1.26 0.00 0.00 211 L 8.40 4.04 0.00 1.81 1.70 1.05 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 212 E 8.16 4.03 0.00 2.08 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 2.39 2.41 0.00 213 E 8.08 4.00 0.00 2.29 1.98 0.00 0.00 0.00 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 2.35 0.00 214 M 7.88 4.05 0.00 2.15 2.48 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.61 0.00 215 M 8.39 4.62 0.00 2.21 2.34 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.81 0.00 216 T 7.69 3.86 4.48 0.00 0.00 0.00 0.00 0.00 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 0.00 217 A 7.99 4.09 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 0.00 218 C 7.64 4.43 0.00 2.48 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