NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1226 S 4.5645 8.3193 116.8141 59.1156 63.8934 173.6628 1227 D 4.6568 8.8354 125.1386 53.7359 39.8213 174.8696 1228 A 3.3946 8.8516 123.9752 52.0094 19.9868 177.8892 1229 P 4.0150 0.0000 0.0000 62.5862 32.0579 177.0868 1230 D 4.3665 8.7256 122.0433 57.5226 40.8593 178.8967 1231 E 3.9741 7.9252 115.1241 58.5821 29.7849 177.4529 1232 F 4.6765 8.4246 118.0235 57.9370 39.6068 175.4380 1233 R 4.9800 7.6987 120.2844 54.1155 31.7859 175.6686 1234 D 4.5153 9.3254 122.7220 53.3703 41.6814 175.7589 1235 P 4.2511 0.0000 0.0000 64.9868 31.6591 176.8189 1236 L 4.5404 8.3689 119.4905 56.6093 42.5484 176.6133 1237 M 4.3837 8.7154 115.8967 54.2974 32.6515 175.7503 1238 D 4.4811 8.1858 117.1769 54.9496 40.6734 173.1458 1239 T 4.4807 7.2054 105.6124 59.1346 70.4907 173.7633 1240 L 4.4530 8.2837 124.7708 55.4547 42.5480 176.4364 1241 M 4.4475 8.9654 127.3102 55.2824 32.4704 176.2925 1242 T 4.4959 8.6602 112.0095 61.7329 71.1134 174.0379 1243 D 4.8630 8.5293 122.4479 51.9205 41.3759 171.6277 1244 P 4.8159 0.0000 0.0000 62.8667 32.8411 177.0760 1245 V 4.8436 9.2150 117.6402 59.3483 35.8443 174.3317 1246 R 4.9178 9.1771 124.5396 54.7692 31.7553 175.8906 1247 L 4.6304 9.3281 127.1765 53.5302 42.5716 176.2822 1248 P 3.9618 0.0000 0.0000 65.6245 31.3966 178.2138 1249 S 4.1638 7.9900 111.6484 59.6806 63.0314 175.0847 1250 G 4.0629 8.6613 109.2460 45.2365 0.0000 174.0403 1251 T 4.0963 7.8212 117.7093 63.6628 69.6038 173.4026 1252 I 4.9094 8.3359 126.5533 60.0772 39.1885 174.7573 1253 M 5.0768 9.0341 125.6127 53.1187 37.1946 174.1624 1254 D 4.7755 9.3160 120.4008 53.9154 42.1848 176.6184 1255 R 3.9046 9.0417 127.7203 59.7443 30.0122 178.5570 1256 S 4.1140 8.0946 113.1777 61.6742 62.9278 176.3438 1257 I 3.6743 7.6946 123.1787 64.0383 36.8834 178.1959 1258 I 3.7461 7.7948 119.3452 63.9990 37.5689 177.9141 1259 L 4.0055 7.9909 119.3186 57.3490 41.5645 179.1241 1260 R 4.0136 8.0985 119.0154 59.6876 29.9855 178.0873 1261 H 4.1134 8.0657 117.5338 59.2435 29.7032 177.1124 1262 L 4.8154 8.0320 120.7820 56.5371 41.4191 178.7905 1263 L 4.0904 7.4789 120.3907 57.3133 42.0946 177.0234 1264 N 4.6362 7.9363 114.2324 53.4263 38.9078 175.0809 1265 S 4.3783 8.1359 114.3680 56.0953 65.9342 172.2306 1266 P 5.2071 0.0000 0.0000 62.0192 29.2376 174.7149 1267 T 5.2055 7.2838 109.3297 60.5293 73.2352 174.7318 1268 D 4.4548 9.3472 123.2719 53.6501 41.5598 175.6295 1269 P 4.0000 0.0000 0.0000 64.5108 31.7047 176.8792 1270 F 4.7887 8.7167 116.0064 58.7367 40.2424 176.3831 1271 N 4.6683 8.4470 113.6594 52.2401 37.7813 175.8350 1272 R 4.0761 8.0138 117.0480 56.4808 28.9066 176.4163 1273 Q 4.3898 8.3356 118.0867 55.6741 30.0093 175.9395 1274 T 4.5046 8.3424 111.9944 62.1247 69.5761 173.3709 1275 L 4.7608 8.8871 125.7329 54.0521 45.5918 174.8782 1276 T 4.6932 8.3278 118.2045 59.7444 71.0136 173.8600 1277 E 3.9238 9.0242 127.1369 59.4538 29.5627 179.4035 1278 S 4.1553 8.1104 111.1439 61.2593 62.8354 174.8676 1279 M 4.2803 7.9016 119.0025 56.2050 32.1564 176.3460 1280 L 4.4799 7.8940 120.2450 54.3930 42.8247 176.0779 1281 E 4.6380 8.7871 123.7466 53.5421 32.1439 173.4569 1282 P 4.6088 0.0000 0.0000 62.9897 32.5005 176.9482 1283 V 4.1950 8.4732 123.9092 60.3868 30.6456 174.1256 1284 P 4.2701 0.0000 0.0000 64.9808 31.6783 177.5267 1285 E 3.9344 8.0983 116.9350 59.5026 29.4009 179.1024 1286 L 3.9486 7.8061 119.7374 57.6895 42.1426 178.6813 1287 K 3.8266 7.9617 119.8705 59.5327 32.1549 178.7565 1288 E 3.9501 8.3537 118.9750 59.2076 29.3058 179.1197 1289 Q 3.9803 7.8027 119.3783 59.1754 29.1434 178.4217 1290 I 3.1810 7.6217 120.9613 64.2324 37.0651 178.3444 1291 Q 4.0396 8.2316 118.8257 58.8847 28.5202 178.9041 1292 A 4.0004 8.2048 121.7285 55.0297 17.9741 179.4395 1293 W 4.2112 8.3467 126.8900 60.8371 30.6826 178.2156 1294 M 3.8471 8.3603 118.6672 58.4781 31.7483 178.9863 1295 R 4.0639 8.3627 118.3665 58.9965 29.9101 178.5895 1296 E 4.0680 8.0179 118.4076 58.4754 29.6504 178.6120 1297 K 3.8780 6.9978 117.1838 59.4314 32.2135 178.9908 1298 Q 4.1494 7.6937 116.8812 57.8081 29.7639 177.8699 1299 N 4.7539 7.1606 117.7197 51.4671 36.5413 175.2222 1300 S 4.1553 7.7165 117.7144 58.2743 63.3136 174.8990 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 1226 S 8.32 4.56 0.00 4.21 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 1227 D 8.84 4.66 0.00 2.95 2.84 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 0.00 0.00 0.00 1228 A 8.85 3.39 1.07 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 0.00 0.00 1229 P 0.00 4.02 0.00 0.88 1.38 0.00 2.20 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.52 0.00 1230 D 8.73 4.37 0.00 2.60 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 1231 E 7.93 3.97 0.00 2.15 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 0.00 2.00 2.03 0.00 1232 F 8.42 4.68 0.00 2.90 2.85 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 1233 R 7.70 4.98 0.00 1.90 1.85 0.00 3.12 0.00 0.00 3.37 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 1234 D 9.33 4.52 0.00 2.71 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1235 P 0.00 4.25 0.00 2.14 2.06 0.00 3.86 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 2.22 2.15 0.00 1236 L 8.37 4.54 0.00 1.71 1.99 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 1237 M 8.72 4.38 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.61 0.00 1238 D 8.19 4.48 0.00 2.75 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1239 T 7.21 4.48 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 1.29 0.00 0.00 1240 L 8.28 4.45 0.00 1.69 1.70 1.05 1.17 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 1241 M 8.97 4.45 0.00 1.99 2.04 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 2.73 2.55 0.00 1242 T 8.66 4.50 4.25 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 1.23 0.00 0.00 1243 D 8.53 4.86 0.00 2.75 2.51 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 1244 P 0.00 4.82 0.00 2.13 2.14 0.00 3.65 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 2.13 1.93 0.00 1245 V 9.22 4.84 2.09 0.00 0.00 0.00 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 1.02 0.00 0.00 1246 R 9.18 4.92 0.00 1.82 1.91 0.00 3.09 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 1247 L 9.33 4.63 0.00 1.92 1.59 1.02 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 1248 P 0.00 3.96 0.00 2.05 2.14 0.00 3.70 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 2.04 2.23 0.00 1249 S 7.99 4.16 0.00 4.01 4.10 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 0.00 0.00 0.00 0.00 1250 G 8.66 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 0.00 0.00 0.00 1251 T 7.82 4.10 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 1.36 0.00 0.00 1252 I 8.34 4.91 1.88 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 1.35 0.57 0.95 0.00 0.00 1253 M 9.03 5.08 0.00 2.04 1.95 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 2.61 2.60 0.00 1254 D 9.32 4.78 0.00 2.75 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1255 R 9.04 3.90 0.00 2.03 1.93 0.00 3.16 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 1256 S 8.09 4.11 0.00 4.09 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 1257 I 7.69 3.67 2.04 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.91 0.92 0.00 0.00 1258 I 7.79 3.75 1.87 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 1.53 1.50 1.03 0.00 0.00 1259 L 7.99 4.01 0.00 1.86 1.72 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 1260 R 8.10 4.01 0.00 2.05 2.10 0.00 3.10 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 1261 H 8.07 4.11 0.00 3.27 3.41 0.00 5.84 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 1262 L 8.03 4.82 0.00 1.63 1.71 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 1263 L 7.48 4.09 0.00 1.84 1.73 0.91 1.43 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 1264 N 7.94 4.64 0.00 2.79 2.88 0.00 0.00 5.70 7.64 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 1265 S 8.14 4.38 0.00 3.70 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1266 P 0.00 5.21 0.00 2.15 2.18 0.00 3.67 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 1267 T 7.28 5.21 4.32 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 1.21 0.00 0.00 1268 D 9.35 4.45 0.00 2.73 2.78 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 1269 P 0.00 4.00 0.00 0.71 1.41 0.00 3.46 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 1270 F 8.72 4.79 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1271 N 8.45 4.67 0.00 2.84 2.98 0.00 0.00 6.11 7.66 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 1272 R 8.01 4.08 0.00 2.06 2.17 0.00 3.18 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 1273 Q 8.34 4.39 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 1274 T 8.34 4.50 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 1275 L 8.89 4.76 0.00 1.56 1.44 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 1276 T 8.33 4.69 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 1277 E 9.02 3.92 0.00 2.03 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 2.38 2.33 0.00 1278 S 8.11 4.16 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1279 M 7.90 4.28 0.00 2.03 2.27 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 2.68 2.51 0.00 1280 L 7.89 4.48 0.00 1.58 1.60 0.93 0.70 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 1281 E 8.79 4.64 0.00 2.07 1.77 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 2.18 2.29 0.00 1282 P 0.00 4.61 0.00 1.97 1.96 0.00 3.68 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 1283 V 8.47 4.19 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 1.01 0.00 0.00 0.98 0.00 0.00 1284 P 0.00 4.27 0.00 2.19 2.08 0.00 3.65 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 1285 E 8.10 3.93 0.00 2.04 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 0.00 2.40 2.43 0.00 1286 L 7.81 3.95 0.00 1.72 1.76 0.80 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 1287 K 7.96 3.83 0.00 1.93 1.92 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.44 7.81 1288 E 8.35 3.95 0.00 2.00 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 2.31 2.45 0.00 1289 Q 7.80 3.98 0.00 2.33 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 1290 I 7.62 3.18 1.61 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.16 0.84 0.00 0.00 1291 Q 8.23 4.04 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 1292 A 8.20 4.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1293 W 8.35 4.21 0.00 3.77 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1294 M 8.36 3.85 0.00 2.15 2.31 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.19 2.89 0.00 1295 R 8.36 4.06 0.00 1.90 1.97 0.00 3.11 0.00 0.00 3.09 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 1296 E 8.02 4.07 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 1297 K 7.00 3.88 0.00 1.53 1.56 0.00 1.20 0.00 0.00 0.88 0.00 0.00 2.71 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.48 1.11 7.81 1298 Q 7.69 4.15 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.23 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 1299 N 7.16 4.75 0.00 2.86 2.74 0.00 0.00 6.75 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1300 S 7.72 4.16 0.00 3.86 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00