NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 970 Q 4.3090 8.2033 121.7122 56.1343 31.4351 177.1967 971 K 3.8977 7.7354 117.0865 58.3645 32.1916 177.8671 972 M 4.0404 8.7849 119.5604 58.5642 32.7645 177.7209 973 I 3.6789 7.8071 119.2012 64.4178 37.3984 177.8922 974 A 4.1233 8.3135 121.7351 55.5154 18.2170 179.7015 975 S 4.1216 8.2906 113.2668 61.9609 63.0564 177.0152 976 A 4.0539 8.3259 123.3257 54.8997 17.9934 179.5349 977 F 4.2090 8.3407 119.5242 61.4627 39.5064 177.2567 978 N 4.0394 8.8767 116.5238 56.1737 38.3878 177.0694 979 N 4.3059 8.3362 117.6539 56.2386 38.5953 176.9730 980 A 3.8715 7.6771 121.7229 55.2976 18.4344 179.3297 981 L 3.6649 7.4949 117.3856 58.0931 41.6218 180.1531 982 G 4.0264 8.0888 104.9483 47.2848 0.0000 175.4167 983 A 4.1037 7.8822 122.6073 54.5964 18.4595 179.8196 984 I 3.5247 7.8497 119.0475 64.4069 37.1320 178.6067 985 Q 4.1338 8.1380 119.0676 58.9191 28.4778 178.2631 986 D 4.4616 7.9918 119.6839 57.4044 40.8181 179.1297 987 G 3.4960 7.7909 105.6384 48.0084 0.0000 175.7829 988 F 4.4837 8.0128 120.3876 59.8657 38.7726 177.3762 989 D 4.3161 8.6551 118.1659 57.4014 41.0136 178.1958 990 A 3.9862 8.3480 121.5520 55.4204 18.3230 179.6331 991 T 3.8323 8.1682 114.4597 67.0231 68.4592 176.5480 992 N 4.3289 8.6889 118.6760 56.4366 38.4137 177.4616 993 S 4.0983 8.4492 114.5017 61.1867 62.5448 176.1100 994 A 4.0113 8.2140 123.8650 55.1537 18.2121 179.6638 995 L 4.1260 8.3049 117.7086 57.4739 41.5795 180.1322 996 G 3.5270 7.8749 106.0800 47.7450 0.0000 175.9292 997 K 3.9657 7.7742 121.5795 59.0367 31.9943 179.3985 998 I 3.6783 7.6184 119.6459 64.6198 37.0960 178.3222 999 Q 3.8118 8.0114 120.0977 59.1483 28.8353 178.1907 1000 S 4.0804 8.1249 114.3767 61.1277 62.3582 176.3324 1001 V 3.5553 7.8976 120.9763 66.0217 31.4728 177.9638 1002 V 3.6070 8.4822 118.5855 66.4453 31.2143 177.6919 1003 N 4.4175 8.2939 115.6004 55.6661 38.4092 177.4770 1004 A 3.9548 7.9350 122.4644 55.3819 18.4760 179.5275 1005 N 4.3301 8.6233 115.2421 56.0660 38.6598 177.6159 1006 A 3.9776 8.1505 122.3743 55.4121 18.5649 179.6699 1007 E 3.9777 8.2580 116.7309 59.0582 29.5351 179.5989 1008 A 3.9525 7.8677 121.1733 55.1631 18.4528 179.4823 1009 L 4.0149 8.2457 118.6933 57.6623 41.7202 178.5939 1010 N 4.3570 7.9397 117.0784 56.7363 38.7081 176.5849 1011 N 4.3520 8.0160 117.1107 56.1914 38.3662 176.8711 1012 L 4.1149 7.9007 121.5654 58.0044 42.0151 178.9573 1013 L 4.1674 7.8590 118.9089 57.0367 41.2291 177.7964 1014 N 4.8629 7.5202 114.8982 53.2442 38.9275 175.5485 1015 Q 4.5289 7.6455 117.2698 55.6421 30.3451 175.9343 1016 L 4.6385 7.6076 118.6976 54.7085 44.0620 175.5417 1017 S 4.3297 7.8200 113.7976 58.9098 60.3324 176.3588 *1229 L 3.9693 8.8479 116.3206 54.7047 42.6171 174.3774 1230 D 4.7243 8.5419 124.5480 52.4388 43.0394 174.5382 1231 L 4.8121 9.6307 127.0375 54.7858 41.9976 178.2516 1232 T 3.8452 8.0362 112.0250 65.5817 68.3360 174.9183 1233 Y 4.1679 8.1143 122.2878 60.1412 38.8091 178.0585 1234 E 3.5603 8.1140 118.4333 59.6378 29.6924 179.1411 1235 M 4.7663 8.2107 120.3138 58.1303 31.9423 178.6771 1236 N 4.2942 8.2233 116.5891 56.1074 38.5772 177.5141 1237 R 3.6722 7.6053 120.2292 59.3439 30.1209 178.6738 1238 I 3.3772 7.6332 119.6321 64.3428 37.1690 178.4560 1239 Q 3.9934 8.0543 118.9501 58.9926 28.3977 178.5917 1240 D 4.3219 8.2187 119.9817 57.1659 40.7503 178.6615 1241 A 3.8925 8.0644 121.4880 55.0993 18.2537 179.6525 1242 I 3.6884 7.7484 118.3579 64.3141 37.1928 178.4874 1243 K 3.8954 7.8913 119.9494 59.5176 31.8667 178.6044 1244 K 3.9106 8.0446 118.6254 59.5036 32.2661 178.3600 1245 L 4.0923 8.2824 119.4990 57.9415 41.3996 178.8636 1246 N 4.6051 8.2300 115.6665 56.8805 38.9032 175.8418 1247 E 4.3381 7.9826 117.0884 57.4156 29.8761 177.8627 1248 S 4.6101 8.4232 115.0219 58.0206 64.1825 174.0382 1249 Y 4.2518 7.6555 120.0644 58.5036 38.2650 175.2114 1250 I 4.5101 8.7496 124.3086 59.8483 38.7323 175.5932 1251 N 4.6488 8.5997 123.6516 52.4064 38.1674 175.0250 1252 L 4.0032 8.7206 127.1692 57.8057 41.7907 179.2042 1253 K 4.1701 7.7705 114.2120 58.2820 32.8424 176.7886 1254 E 4.2040 8.1786 124.9688 56.6939 29.4527 175.9073 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 970 Q 8.20 4.31 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 971 K 7.74 3.90 0.00 1.94 1.85 0.00 1.73 0.00 0.00 1.79 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.54 1.56 7.81 972 M 8.78 4.04 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.59 0.00 973 I 7.81 3.68 1.99 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 1.58 0.76 0.89 0.00 0.00 974 A 8.31 4.12 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 0.00 975 S 8.29 4.12 0.00 4.08 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 976 A 8.33 4.05 1.42 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 0.00 0.00 977 F 8.34 4.21 0.00 3.11 3.28 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 0.00 978 N 8.88 4.04 0.00 2.96 3.05 0.00 0.00 7.04 6.78 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 0.00 979 N 8.34 4.31 0.00 2.93 2.86 0.00 0.00 6.90 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 980 A 7.68 3.87 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 0.00 981 L 7.49 3.66 0.00 1.03 0.95 -0.24 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 982 G 8.09 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 0.00 0.00 0.00 983 A 7.88 4.10 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 0.00 984 I 7.85 3.52 1.89 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.72 0.81 0.00 0.00 985 Q 8.14 4.13 0.00 2.16 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.45 2.68 0.00 986 D 7.99 4.46 0.00 2.79 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 0.00 987 G 7.79 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 988 F 8.01 4.48 0.00 3.12 2.98 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 0.00 0.00 0.00 989 D 8.66 4.32 0.00 3.01 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 0.00 990 A 8.35 3.99 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 0.00 991 T 8.17 3.83 4.55 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 1.29 0.00 0.00 992 N 8.69 4.33 0.00 2.98 2.88 0.00 0.00 6.72 7.57 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 0.00 993 S 8.45 4.10 0.00 3.89 4.01 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 0.00 994 A 8.21 4.01 1.42 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 0.00 0.00 995 L 8.30 4.13 0.00 1.83 1.73 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 996 G 7.87 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 997 K 7.77 3.97 0.00 1.77 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.66 7.81 998 I 7.62 3.68 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.09 0.92 0.00 0.00 999 Q 8.01 3.81 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 1000 S 8.12 4.08 0.00 4.05 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 1001 V 7.90 3.56 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00 0.00 0.00 1002 V 8.48 3.61 2.12 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 0.98 0.00 0.00 0.96 0.00 0.00 1003 N 8.29 4.42 0.00 3.02 2.85 0.00 0.00 6.88 7.75 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 1004 A 7.93 3.95 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1005 N 8.62 4.33 0.00 2.72 2.88 0.00 0.00 6.97 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1006 A 8.15 3.98 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1007 E 8.26 3.98 0.00 2.26 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 2.33 2.33 0.00 1008 A 7.87 3.95 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1009 L 8.25 4.01 0.00 1.75 1.91 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 1010 N 7.94 4.36 0.00 3.03 2.93 0.00 0.00 7.03 6.03 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 1011 N 8.02 4.35 0.00 2.94 2.87 0.00 0.00 7.01 7.47 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 1012 L 7.90 4.11 0.00 1.80 1.79 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 1013 L 7.86 4.17 0.00 1.82 1.70 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 1014 N 7.52 4.86 0.00 2.69 2.82 0.00 0.00 6.81 7.36 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 1015 Q 7.65 4.53 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 1016 L 7.61 4.64 0.00 1.53 1.63 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 1017 S 7.82 4.33 0.00 3.86 3.24 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 0.00 *1229 L 8.85 3.97 0.00 1.66 1.62 0.93 1.05 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 1230 D 8.54 4.72 0.00 2.62 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 1231 L 9.63 4.81 0.00 1.68 1.64 0.98 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 1232 T 8.04 3.85 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 1233 Y 8.11 4.17 0.00 3.09 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 1234 E 8.11 3.56 0.00 2.07 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 2.43 2.48 0.00 1235 M 8.21 4.77 0.00 1.99 2.08 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 2.80 2.43 0.00 1236 N 8.22 4.29 0.00 2.86 2.80 0.00 0.00 6.68 7.24 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 1237 R 7.61 3.67 0.00 1.42 1.66 0.00 3.01 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.51 0.00 1238 I 7.63 3.38 2.05 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 1.26 0.68 0.81 0.00 0.00 1239 Q 8.05 3.99 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.65 0.00 1240 D 8.22 4.32 0.00 2.78 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 1241 A 8.06 3.89 1.06 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 1242 I 7.75 3.69 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.80 1.01 0.00 0.00 1243 K 7.89 3.90 0.00 1.86 2.03 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.46 7.81 1244 K 8.04 3.91 0.00 1.86 1.96 0.00 1.85 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.50 7.81 1245 L 8.28 4.09 0.00 1.94 1.64 1.10 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 1246 N 8.23 4.61 0.00 3.07 3.08 0.00 0.00 7.36 8.34 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 1247 E 7.98 4.34 0.00 2.26 2.02 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 2.38 2.47 0.00 1248 S 8.42 4.61 0.00 3.90 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 1249 Y 7.66 4.25 0.00 3.09 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 1250 I 8.75 4.51 2.02 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 1.27 0.82 0.97 0.00 0.00 1251 N 8.60 4.65 0.00 2.76 2.87 0.00 0.00 7.20 6.66 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 1252 L 8.72 4.00 0.00 1.70 1.77 0.96 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 1253 K 7.77 4.17 0.00 1.91 1.94 0.00 1.60 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.56 1.45 7.81 1254 E 8.18 4.20 0.00 2.21 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 2.32 2.26 0.00 * Residues marked with a * may have inaccurate shift predictions.