NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
574101 | 2mjb | cing | 1-original | 17 | XPLOR/CNS | dipolar coupling |
assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 1 and name CA) ( resid 1 and name HA) -38.3410 0.0000 0.0000 ! M1-ch1 val=-38.3410 values=-38.341 ! M1-ch2 val=8.9955 values=7.990 10.001 ! M1-ch3 val=-39.6983 values=39.655 39.415 40.025 ! M1-ch2 val=9.1000 values=9.219 8.981 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 2 and name CA) ( resid 2 and name HA) 11.6620 0.0000 0.0000 ! Q2-ch1 val=11.6620 values=11.662 ! Q2-ch2 val=-10.6340 values=-10.634 ! Q2-ch2 val=-4.2070 values=-4.207 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 3 and name CA) ( resid 3 and name HA) 18.4240 0.0000 0.0000 ! I3-ch1 val=18.4240 values=18.424 ! I3-ch1 val=15.5680 values=15.568 ! I3-ch3 val=-17.5370 values=17.537 ! I3-ch3 val=-19.4550 values=19.455 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 4 and name CA) ( resid 4 and name HA) 26.7330 0.0000 0.0000 ! F4-ch1 val=26.7330 values=26.733 ! F4-ch2 val=11.2500 values=11.250 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 5 and name CA) ( resid 5 and name HA) 15.7480 0.0000 0.0000 ! V5-ch1 val=15.7480 values=15.748 ! V5-ch1 val=12.6700 values=12.670 ! V5-ch3 val=-43.6800 values=43.680 ! V5-ch3 val=9.2710 values=-9.271 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 6 and name CA) ( resid 6 and name HA) 2.5090 0.0000 0.0000 ! K6-ch1 val=2.5090 values=2.509 ! K6-ch2 val=-31.7305 values=-30.770 -32.691 ! K6-ch2 val=-17.3550 values=-17.355 ! K6-ch2 val=-19.5085 values=-19.797 -19.220 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 7 and name CA) ( resid 7 and name HA) 14.9370 0.0000 0.0000 ! T7-ch1 val=14.9370 values=14.937 ! T7-ch1 val=-48.0810 values=-48.081 ! T7-ch3 val=17.4050 values=-17.405 ! L8-ch2 val=29.4665 values=29.566 29.367 ! L8-ch3 val=-15.5190 values=15.519 ! L8-ch3 val=4.1880 values=-4.188 ! L8-ch1 val=6.0240 values=6.024 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 9 and name CA) ( resid 9 and name HA) 3.5650 0.0000 0.0000 ! T9-ch1 val=3.5650 values=3.565 ! T9-ch1 val=16.2220 values=16.222 ! T9-ch3 val=-33.9063 values=33.970 33.982 33.767 { assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 10 and name CA) ( resid 10 and name HA#) 39.0840 0.0000 0.0000 ! G10-ch2 val=39.0840 values=39.170 38.998 } assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 11 and name CA) ( resid 11 and name HA) 1.0560 0.0000 0.0000 ! K11-ch1 val=1.0560 values=1.056 ! K11-ch2 val=-23.8850 values=-22.558 -25.212 ! K11-ch2 val=-18.0700 values=-18.070 ! K11-ch2 val=-17.1395 values=-16.879 -17.400 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 12 and name CA) ( resid 12 and name HA) -6.1170 0.0000 0.0000 ! T12-ch1 val=-6.1170 values=-6.117 ! T12-ch1 val=-2.8050 values=-2.805 ! T12-ch3 val=-14.7450 values=14.745 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 13 and name CA) ( resid 13 and name HA) 4.8300 0.0000 0.0000 ! I13-ch1 val=4.8300 values=4.830 ! I13-ch1 val=14.5080 values=14.508 ! I13-ch3 val=-7.1490 values=7.149 ! I13-ch3 val=20.9390 values=-20.939 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 14 and name CA) ( resid 14 and name HA) 23.5740 0.0000 0.0000 ! T14-ch1 val=23.5740 values=23.574 ! T14-ch1 val=14.6880 values=14.688 ! T14-ch3 val=-24.5850 values=24.585 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 15 and name CA) ( resid 15 and name HA) 23.3020 0.0000 0.0000 ! L15-ch1 val=23.3020 values=23.302 ! L15-ch2 val=61.5245 values=60.793 62.256 ! L15-ch3 val=-8.1360 values=8.136 ! L15-ch3 val=11.0130 values=-11.013 ! L15-ch1 val=49.7960 values=49.796 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 16 and name CA) ( resid 16 and name HA) 13.2060 0.0000 0.0000 ! E16-ch1 val=13.2060 values=13.206 ! E16-ch2 val=12.9725 values=12.151 13.794 ! E16-ch2 val=24.3595 values=24.397 24.322 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 17 and name CA) ( resid 17 and name HA) 35.1920 0.0000 0.0000 ! V17-ch1 val=35.1920 values=35.192 ! V17-ch3 val=-42.9800 values=42.980 ! V17-ch3 val=33.7420 values=-33.742 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 18 and name CA) ( resid 18 and name HA) -31.2130 0.0000 0.0000 ! E18-ch1 val=-31.2130 values=-31.213 ! E18-ch2 val=-51.3275 values=-50.874 -51.024 -51.469 -51.943 ! E18-ch2 val=21.6410 values=21.525 21.757 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 19 and name CA) ( resid 19 and name HA) 15.6470 0.0000 0.0000 ! P19-ch1 val=15.6470 values=15.647 ! P19-ch2 val=45.1180 values=45.792 44.444 ! P19-ch2 val=-7.5320 values=-7.532 ! S20-ch2 val=-18.8457 values=-18.665 -18.689 -19.183 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 21 and name CA) ( resid 21 and name HA) 57.9710 0.0000 0.0000 ! D21-ch1 val=57.9710 values=57.971 ! D21-ch2 val=-14.1055 values=-13.534 -14.677 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 22 and name CA) ( resid 22 and name HA) 17.7730 0.0000 0.0000 ! T22-ch1 val=17.7730 values=17.773 ! T22-ch1 val=-31.2900 values=-31.290 ! T22-ch3 val=8.7770 values=-8.777 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 23 and name CA) ( resid 23 and name HA) 0.9870 0.0000 0.0000 ! I23-ch1 val=0.9870 values=0.987 ! I23-ch1 val=7.5380 values=7.538 ! I23-ch3 val=11.7780 values=-11.778 ! I23-ch2 val=7.9175 values=8.129 7.706 ! I23-ch3 val=-17.7190 values=17.719 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 24 and name CA) ( resid 24 and name HA) -25.1210 0.0000 0.0000 ! E24-ch1 val=-25.1210 values=-25.121 ! E24-ch2 val=-24.9720 values=-24.972 ! E24-ch2 val=-9.0610 values=-9.061 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 25 and name CA) ( resid 25 and name HA) 19.7520 0.0000 0.0000 ! N25-ch1 val=19.7520 values=19.752 ! N25-ch2 val=15.4255 values=15.395 15.456 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 26 and name CA) ( resid 26 and name HA) -26.4110 0.0000 0.0000 ! V26-ch1 val=-26.4110 values=-26.411 ! V26-ch1 val=-23.0820 values=-23.082 ! V26-ch3 val=35.5400 values=-35.540 ! V26-ch3 val=-50.2690 values=50.269 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 27 and name CA) ( resid 27 and name HA) 45.4920 0.0000 0.0000 ! K27-ch1 val=45.4920 values=45.492 ! K27-ch2 val=1.1020 values=1.102 ! K27-ch2 val=-0.0350 values=-0.035 ! K27-ch2 val=26.3995 values=26.428 26.371 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 28 and name CA) ( resid 28 and name HA) -55.4750 0.0000 0.0000 ! A28-ch1 val=-55.4750 values=-55.475 ! A28-ch3 val=30.8390 values=-30.839 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 29 and name CA) ( resid 29 and name HA) 36.7620 0.0000 0.0000 ! K29-ch1 val=36.7620 values=36.762 ! K29-ch2 val=32.9330 values=34.813 31.053 ! K29-ch2 val=27.0755 values=26.197 27.954 ! K29-ch2 val=9.3200 values=9.320 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 30 and name CA) ( resid 30 and name HA) -4.6110 0.0000 0.0000 ! I30-ch1 val=-4.6110 values=-4.611 ! I30-ch1 val=6.7150 values=6.715 ! I30-ch3 val=17.1250 values=-17.125 ! I30-ch2 val=1.4610 values=3.554 -0.632 ! I30-ch3 val=-8.8730 values=8.873 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 31 and name CA) ( resid 31 and name HA) -12.9290 0.0000 0.0000 ! Q31-ch1 val=-12.9290 values=-12.929 ! Q31-ch2 val=-10.8715 values=-10.865 -10.878 ! Q31-ch2 val=-8.6350 values=-8.424 -8.846 ! D32-ch2 val=26.5700 values=26.570 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 33 and name CA) ( resid 33 and name HA) 5.5590 0.0000 0.0000 ! K33-ch1 val=5.5590 values=5.559 ! K33-ch2 val=28.3235 values=27.973 28.674 ! K33-ch2 val=31.9555 values=32.065 31.846 ! K33-ch2 val=26.8950 values=26.895 ! K33-ch2 val=37.5645 values=37.308 37.821 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 34 and name CA) ( resid 34 and name HA) 13.4690 0.0000 0.0000 ! E34-ch1 val=13.4690 values=13.469 ! E34-ch2 val=-23.8385 values=-23.255 -24.422 ! E34-ch2 val=23.2180 values=23.218 { assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 35 and name CA) ( resid 35 and name HA#) 46.3340 0.0000 0.0000 ! G35-ch2 val=46.3340 values=46.631 46.037 } assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 36 and name CA) ( resid 36 and name HA) -53.2910 0.0000 0.0000 ! I36-ch1 val=-53.2910 values=-53.291 ! I36-ch1 val=-46.3850 values=-46.385 ! I36-ch3 val=-2.0820 values=2.082 ! I36-ch3 val=-14.5350 values=14.535 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 37 and name CA) ( resid 37 and name HA) 8.5960 0.0000 0.0000 ! P37-ch1 val=8.5960 values=8.596 ! P37-ch2 val=44.3750 values=44.400 44.350 ! P37-ch2 val=-27.0470 values=-27.047 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 38 and name CA) ( resid 38 and name HA) 7.3470 0.0000 0.0000 ! P38-ch1 val=7.3470 values=7.347 ! P38-ch2 val=-11.6880 values=-11.688 ! P38-ch2 val=10.0195 values=10.281 9.758 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 39 and name CA) ( resid 39 and name HA) -3.5740 0.0000 0.0000 ! D39-ch1 val=-3.5740 values=-3.574 ! D39-ch2 val=11.0470 values=11.198 10.896 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 40 and name CA) ( resid 40 and name HA) -29.8800 0.0000 0.0000 ! Q40-ch1 val=-29.8800 values=-29.880 ! Q40-ch2 val=24.2765 values=23.825 24.728 ! Q40-ch2 val=30.0400 values=30.503 29.577 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 41 and name CA) ( resid 41 and name HA) 34.5160 0.0000 0.0000 ! Q41-ch1 val=34.5160 values=34.516 ! Q41-ch2 val=19.0030 values=19.003 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 42 and name CA) ( resid 42 and name HA) 33.3530 0.0000 0.0000 ! R42-ch1 val=33.3530 values=33.353 ! R42-ch2 val=20.0820 values=20.019 20.145 ! R42-ch2 val=10.6740 values=10.674 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 43 and name CA) ( resid 43 and name HA) 21.3540 0.0000 0.0000 ! L43-ch1 val=21.3540 values=21.354 ! L43-ch2 val=-14.1410 values=-14.428 -13.854 ! L43-ch3 val=1.0600 values=-1.060 ! L43-ch3 val=8.9550 values=-8.955 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 44 and name CA) ( resid 44 and name HA) 11.5630 0.0000 0.0000 ! I44-ch1 val=11.5630 values=11.563 ! I44-ch1 val=7.4620 values=7.462 ! I44-ch3 val=-15.0920 values=15.092 ! I44-ch2 val=47.0570 values=47.132 46.982 ! I44-ch3 val=27.1800 values=-27.180 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 45 and name CA) ( resid 45 and name HA) 14.7610 0.0000 0.0000 ! F45-ch1 val=14.7610 values=14.761 ! F45-ch2 val=44.5977 values=44.643 45.975 48.004 39.769 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 46 and name CA) ( resid 46 and name HA) 38.0110 0.0000 0.0000 ! A46-ch1 val=38.0110 values=38.011 ! A46-ch3 val=-39.0033 values=38.802 39.170 39.038 { assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 47 and name CA) ( resid 47 and name HA#) 14.9000 0.0000 0.0000 ! G47-ch2 val=14.9000 values=14.754 15.046 } assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 48 and name CA) ( resid 48 and name HA) -31.3550 0.0000 0.0000 ! K48-ch1 val=-31.3550 values=-31.355 ! K48-ch2 val=8.2030 values=8.203 ! K48-ch2 val=11.9000 values=11.900 ! K48-ch2 val=9.1590 values=9.159 ! K48-ch2 val=5.4770 values=5.477 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 49 and name CA) ( resid 49 and name HA) 6.0800 0.0000 0.0000 ! Q49-ch1 val=6.0800 values=6.080 ! Q49-ch2 val=39.3920 values=39.635 39.149 ! Q49-ch2 val=25.8180 values=25.818 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 50 and name CA) ( resid 50 and name HA) -9.5840 0.0000 0.0000 ! L50-ch1 val=-9.5840 values=-9.584 ! L50-ch2 val=5.2245 values=3.987 6.462 ! L50-ch3 val=-5.1240 values=5.124 ! L50-ch3 val=-13.9110 values=13.911 ! L50-ch1 val=-5.1980 values=-5.198 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 51 and name CA) ( resid 51 and name HA) -51.5840 0.0000 0.0000 ! E51-ch1 val=-51.5840 values=-51.584 ! E51-ch2 val=-19.5835 values=-19.915 -19.252 ! E51-ch2 val=0.7300 values=0.730 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 52 and name CA) ( resid 52 and name HA) -12.8680 0.0000 0.0000 ! D52-ch1 val=-12.8680 values=-12.868 ! D52-ch2 val=8.5385 values=8.369 8.708 { assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 53 and name CA) ( resid 53 and name HA#) 31.9180 0.0000 0.0000 ! G53-ch2 val=31.9180 values=31.918 } assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 54 and name CA) ( resid 54 and name HA) 7.4630 0.0000 0.0000 ! R54-ch1 val=7.4630 values=7.463 ! R54-ch2 val=0.9325 values=-0.087 1.952 ! R54-ch2 val=0.0160 values=0.600 -0.568 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 55 and name CA) ( resid 55 and name HA) 6.3810 0.0000 0.0000 ! T55-ch1 val=6.3810 values=6.381 ! T55-ch1 val=-17.9810 values=-17.981 ! T55-ch3 val=47.1040 values=-47.104 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 56 and name CA) ( resid 56 and name HA) -12.8750 0.0000 0.0000 ! L56-ch1 val=-12.8750 values=-12.875 ! L56-ch2 val=23.3050 values=23.470 23.140 ! L56-ch3 val=-7.7780 values=7.778 ! L56-ch3 val=-6.3150 values=6.315 ! L56-ch1 val=34.2020 values=34.202 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 57 and name CA) ( resid 57 and name HA) 18.0150 0.0000 0.0000 ! S57-ch1 val=18.0150 values=18.015 ! S57-ch2 val=-1.3465 values=-1.240 -1.453 ! D58-ch2 val=-17.2335 values=-17.450 -17.017 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 59 and name CA) ( resid 59 and name HA) 6.6070 0.0000 0.0000 ! Y59-ch1 val=6.6070 values=6.607 ! Y59-ch2 val=65.9953 values=66.285 67.221 64.130 65.110 66.990 66.236 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 60 and name CA) ( resid 60 and name HA) -11.8130 0.0000 0.0000 ! N60-ch1 val=-11.8130 values=-11.813 ! N60-ch2 val=-6.2847 values=-6.328 -5.654 -6.537 -6.620 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 61 and name CA) ( resid 61 and name HA) 55.0880 0.0000 0.0000 ! I61-ch1 val=55.0880 values=55.088 ! I61-ch1 val=50.1380 values=50.138 ! I61-ch3 val=-18.9290 values=18.929 ! I61-ch2 val=51.8505 values=51.983 51.718 ! I61-ch3 val=7.2580 values=-7.258 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 62 and name CA) ( resid 62 and name HA) 35.2320 0.0000 0.0000 ! Q62-ch1 val=35.2320 values=35.232 ! Q62-ch2 val=-20.1045 values=-19.974 -20.235 ! Q62-ch2 val=-18.6033 values=-18.335 -18.397 -19.078 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 63 and name CA) ( resid 63 and name HA) 9.2590 0.0000 0.0000 ! K63-ch1 val=9.2590 values=9.259 ! K63-ch2 val=49.0485 values=47.978 50.119 ! K63-ch2 val=41.3515 values=40.695 42.008 ! K63-ch2 val=19.2710 values=19.271 ! K63-ch2 val=46.2715 values=46.230 46.313 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 64 and name CA) ( resid 64 and name HA) -0.6980 0.0000 0.0000 ! E64-ch1 val=-0.6980 values=-0.698 ! E64-ch2 val=20.0455 values=20.062 20.029 ! E64-ch2 val=-8.9150 values=-8.752 -9.078 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 65 and name CA) ( resid 65 and name HA) 52.6300 0.0000 0.0000 ! S65-ch1 val=52.6300 values=52.630 ! S65-ch2 val=5.0125 values=4.913 5.112 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 66 and name CA) ( resid 66 and name HA) 34.1840 0.0000 0.0000 ! T66-ch1 val=34.1840 values=34.184 ! T66-ch1 val=29.2560 values=29.256 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 67 and name CA) ( resid 67 and name HA) 21.6690 0.0000 0.0000 ! L67-ch1 val=21.6690 values=21.669 ! L67-ch3 val=-7.1930 values=7.193 ! L67-ch3 val=25.1860 values=-25.186 ! L67-ch1 val=-10.3030 values=-10.303 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 68 and name CA) ( resid 68 and name HA) 3.3730 0.0000 0.0000 ! H68-ch1 val=3.3730 values=3.373 ! H68-ch2 val=-44.1967 values=-43.501 -45.223 -44.443 -43.620 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 69 and name CA) ( resid 69 and name HA) 22.0290 0.0000 0.0000 ! L69-ch1 val=22.0290 values=22.029 ! L69-ch2 val=-20.0400 values=-20.040 ! L69-ch3 val=14.4860 values=-14.486 ! L69-ch3 val=11.6200 values=-11.620 ! L69-ch1 val=-30.6190 values=-30.619 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 70 and name CA) ( resid 70 and name HA) 23.5720 0.0000 0.0000 ! V70-ch1 val=23.5720 values=23.572 ! V70-ch1 val=-5.5000 values=-5.500 ! V70-ch3 val=10.9620 values=-10.962 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 2 and name N) ( resid 1 and name C) 2.6510 0.0000 0.0000 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 3 and name N) ( resid 2 and name C) -3.7680 0.0000 0.0000 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 4 and name N) ( resid 3 and name C) 1.4630 0.0000 0.0000 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 5 and name N) ( resid 4 and name C) -1.7260 0.0000 0.0000 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 6 and name N) ( resid 5 and name C) 1.3520 0.0000 0.0000 assign ( resid 501 and name OO) ( resid 501 and name Z) ( resid 501 and name X) ( resid 501 and name Y) ( resid 7 and 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