NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
6554 | 1j7p | cing | 1-original | 1 | XPLOR/CNS | dipolar coupling |
!Dipolar couplings measured in ~16mg/ml Pf1 at 10mM KCl, pH 7.0 !No buffer was used. The quadrapolar splitting of the liquid crystal !is 18.3 Hz ! NH Couplings assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 83 and name N and segid AN1) ( resid 83 and name HN and segid AN1) -8.1130 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 84 and name N and segid AN1) ( resid 84 and name HN and segid AN1) 8.6150 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 85 and name N and segid AN1) ( resid 85 and name HN and segid AN1) 5.9600 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 86 and name N and segid AN1) ( resid 86 and name HN and segid AN1) -5.8350 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 87 and name N and segid AN1) ( resid 87 and name HN and segid AN1) -2.1700 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 88 and name N and segid AN1) ( resid 88 and name HN and segid AN1) 9.5260 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 89 and name N and segid AN1) ( resid 89 and name HN and segid AN1) 1.9210 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 90 and name N and segid AN1) ( resid 90 and name HN and segid AN1) -10.0400 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 91 and name N and segid AN1) ( resid 91 and name HN and segid AN1) 8.6830 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 92 and name N and segid AN1) ( resid 92 and name HN and segid AN1) 14.0250 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 93 and name N and segid AN1) ( resid 93 and name HN and segid AN1) -9.4440 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 94 and name N and segid AN1) ( resid 94 and name HN and segid AN1) -0.1860 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 95 and name N and segid AN1) ( resid 95 and name HN and segid AN1) 6.8960 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 96 and name N and segid AN1) ( resid 96 and name HN and segid AN1) 0.8570 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 97 and name N and segid AN1) ( resid 97 and name HN and segid AN1) 0.5240 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 98 and name N and segid AN1) ( resid 98 and name HN and segid AN1) -2.3040 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 99 and name N and segid AN1) ( resid 99 and name HN and segid AN1) 20.5230 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 100 and name N and segid AN1) ( resid 100 and name HN and segid AN1) 19.9710 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 101 and name N and segid AN1) ( resid 101 and name HN and segid AN1) 7.6810 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 102 and name N and segid AN1) ( resid 102 and name HN and segid AN1) -12.9570 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 103 and name N and segid AN1) ( resid 103 and name HN and segid AN1) -9.7430 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 104 and name N and segid AN1) ( resid 104 and name HN and segid AN1) -2.0520 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 105 and name N and segid AN1) ( resid 105 and name HN and segid AN1) -12.7760 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 106 and name N and segid AN1) ( resid 106 and name HN and segid AN1) -11.6540 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 107 and name N and segid AN1) ( resid 107 and name HN and segid AN1) -2.1050 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 108 and name N and segid AN1) ( resid 108 and name HN and segid AN1) -5.5340 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 109 and name N and segid AN1) ( resid 109 and name HN and segid AN1) -13.7360 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 110 and name N and segid AN1) ( resid 110 and name HN and segid AN1) -5.7400 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 111 and name N and segid AN1) ( resid 111 and name HN and segid AN1) -0.8690 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 112 and name N and segid AN1) ( resid 112 and name HN and segid AN1) -11.6160 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 113 and name N and segid AN1) ( resid 113 and name HN and segid AN1) -0.2810 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 114 and name N and segid AN1) ( resid 114 and name HN and segid AN1) 1.7120 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 115 and name N and segid AN1) ( resid 115 and name HN and segid AN1) 3.7710 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 116 and name N and segid AN1) ( resid 116 and name HN and segid AN1) 4.6900 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 117 and name N and segid AN1) ( resid 117 and name HN and segid AN1) 17.1370 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 118 and name N and segid AN1) ( resid 118 and name HN and segid AN1) 9.0800 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 119 and name N and segid AN1) ( resid 119 and name HN and segid AN1) 3.1220 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 120 and name N and segid AN1) ( resid 120 and name HN and segid AN1) 12.8240 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 121 and name N and segid AN1) ( resid 121 and name HN and segid AN1) 7.2450 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 122 and name N and segid AN1) ( resid 122 and name HN and segid AN1) 3.3640 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 123 and name N and segid AN1) ( resid 123 and name HN and segid AN1) 4.8590 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 124 and name N and segid AN1) ( resid 124 and name HN and segid AN1) 14.1900 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 125 and name N and segid AN1) ( resid 125 and name HN and segid AN1) 4.9390 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 126 and name N and segid AN1) ( resid 126 and name HN and segid AN1) 4.0650 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 127 and name N and segid AN1) ( resid 127 and name HN and segid AN1) 9.6410 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 128 and name N and segid AN1) ( resid 128 and name HN and segid AN1) 11.9850 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 129 and name N and segid AN1) ( resid 129 and name HN and segid AN1) -3.0390 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 130 and name N and segid AN1) ( resid 130 and name HN and segid AN1) -9.3180 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 131 and name N and segid AN1) ( resid 131 and name HN and segid AN1) -0.1250 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 132 and name N and segid AN1) ( resid 132 and name HN and segid AN1) -12.0230 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 133 and name N and segid AN1) ( resid 133 and name HN and segid AN1) -9.8560 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 134 and name N and segid AN1) ( resid 134 and name HN and segid AN1) 16.9350 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 135 and name N and segid AN1) ( resid 135 and name HN and segid AN1) 10.4980 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 136 and name N and segid AN1) ( resid 136 and name HN and segid AN1) 17.2940 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 137 and name N and segid AN1) ( resid 137 and name HN and segid AN1) 12.4050 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 138 and name N and segid AN1) ( resid 138 and name HN and segid AN1) 4.4850 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 139 and name N and segid AN1) ( resid 139 and name HN and segid AN1) -4.8260 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 140 and name N and segid AN1) ( resid 140 and name HN and segid AN1) 5.7600 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 141 and name N and segid AN1) ( resid 141 and name HN and segid AN1) 5.3290 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 142 and name N and segid AN1) ( resid 142 and name HN and segid AN1) -0.7180 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 143 and name N and segid AN1) ( resid 143 and name HN and segid AN1) -4.0540 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 144 and name N and segid AN1) ( resid 144 and name HN and segid AN1) 5.6100 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 145 and name N and segid AN1) ( resid 145 and name HN and segid AN1) 2.0070 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 146 and name N and segid AN1) ( resid 146 and name HN and segid AN1) -11.8860 1.0000 1.0000 ! CAHA Couplings assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 83 and name CA and segid AN1) ( resid 83 and name HA and segid AN1) -9.8750 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 84 and name CA and segid AN1) ( resid 84 and name HA and segid AN1) 22.2420 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 85 and name CA and segid AN1) ( resid 85 and name HA and segid AN1) -1.1630 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 86 and name CA and segid AN1) ( resid 86 and name HA and segid AN1) -36.4280 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 87 and name CA and segid AN1) ( resid 87 and name HA and segid AN1) 15.1480 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 88 and name CA and segid AN1) ( resid 88 and name HA and segid AN1) 27.2610 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 89 and name CA and segid AN1) ( resid 89 and name HA and segid AN1) -20.6630 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 90 and name CA and segid AN1) ( resid 90 and name HA and segid AN1) -29.8610 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 91 and name CA and segid AN1) ( resid 91 and name HA and segid AN1) 32.3820 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 92 and name CA and segid AN1) ( resid 92 and name HA and segid AN1) 18.7220 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 94 and name CA and segid AN1) ( resid 94 and name HA and segid AN1) -34.8740 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 95 and name CA and segid AN1) ( resid 95 and name HA and segid AN1) 28.5980 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 96 and name CA and segid AN1) ( resid 96 and name HA# and segid AN1) 8.9290 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 97 and name CA and segid AN1) ( resid 97 and name HA and segid AN1) -0.2490 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 98 and name CA and segid AN1) ( resid 98 and name HA# and segid AN1) -35.0010 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 99 and name CA and segid AN1) ( resid 99 and name HA and segid AN1) 30.2670 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 100 and name CA and segid AN1) ( resid 100 and name HA and segid AN1) 38.4570 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 101 and name CA and segid AN1) ( resid 101 and name HA and segid AN1) 7.8490 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 102 and name CA and segid AN1) ( resid 102 and name HA and segid AN1) 4.5450 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 103 and name CA and segid AN1) ( resid 103 and name HA and segid AN1) -0.0200 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 104 and name CA and segid AN1) ( resid 104 and name HA and segid AN1) 33.7360 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 105 and name CA and segid AN1) ( resid 105 and name HA and segid AN1) -30.9290 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 106 and name CA and segid AN1) ( resid 106 and name HA and segid AN1) 22.0060 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 108 and name CA and segid AN1) ( resid 108 and name HA and segid AN1) 1.3250 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 109 and name CA and segid AN1) ( resid 109 and name HA and segid AN1) -14.7190 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 110 and name CA and segid AN1) ( resid 110 and name HA and segid AN1) 7.3440 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 111 and name CA and segid AN1) ( resid 111 and name HA and segid AN1) 6.1520 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 112 and name CA and segid AN1) ( resid 112 and name HA and segid AN1) -31.4150 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 113 and name CA and segid AN1) ( resid 113 and name HA# and segid AN1) 0.4110 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 114 and name CA and segid AN1) ( resid 114 and name HA and segid AN1) 8.9150 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 115 and name CA and segid AN1) ( resid 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resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 140 and name C and segid AN1) ( resid 140 and name CA and segid AN1) -1.1110 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 141 and name C and segid AN1) ( resid 141 and name CA and segid AN1) -0.9820 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 142 and name C and segid AN1) ( resid 142 and name CA and segid AN1) 2.4510 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 143 and name C and segid AN1) ( resid 143 and name CA and segid 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NC' Couplings assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 82 and name C and segid AN1) ( resid 83 and name N and segid AN1) -1.4240 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 83 and name C and segid AN1) ( resid 84 and name N and segid AN1) 0.4240 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 84 and name C and segid AN1) ( resid 85 and name N and segid AN1) 1.2760 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 85 and name C and segid AN1) ( resid 86 and name N 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( resid 90 and name N and segid AN1) -1.0420 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 90 and name C and segid AN1) ( resid 91 and name N and segid AN1) -0.1600 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 92 and name C and segid AN1) ( resid 93 and name N and segid AN1) -0.1760 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 93 and name C and segid AN1) ( resid 94 and name N and segid AN1) 0.3920 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 94 and name C and segid AN1) ( resid 95 and name N and segid AN1) -1.5580 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 95 and name C and segid AN1) ( resid 96 and name N and segid AN1) 0.6160 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 96 and name C and segid AN1) ( resid 97 and name N and segid AN1) -1.6820 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 97 and name C and segid AN1) ( resid 98 and name N and segid AN1) -1.0960 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 98 and name C and segid AN1) ( resid 99 and name N and segid AN1) -0.3240 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 99 and name C and segid AN1) ( resid 100 and name N and segid AN1) 1.1080 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 100 and name C and segid AN1) ( resid 101 and name N and segid AN1) 1.5480 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 101 and name C and segid AN1) ( resid 102 and name N and segid AN1) -1.6540 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 102 and name C and segid AN1) ( resid 103 and name N and segid AN1) 1.4440 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 103 and name C and segid AN1) ( resid 104 and name N and segid AN1) -0.2160 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 104 and name C and segid AN1) ( resid 105 and name N and segid AN1) 1.3420 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 105 and name C and segid AN1) ( resid 106 and name N and segid AN1) -0.8900 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 106 and name C and segid AN1) ( resid 107 and name N and segid AN1) 0.6840 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 107 and name C and segid AN1) ( resid 108 and name N and segid AN1) 1.2700 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 108 and name C and segid AN1) ( resid 109 and name N and segid AN1) -0.7260 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 109 and name C and segid AN1) ( resid 110 and name N and segid AN1) 0.8420 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 110 and name C and segid AN1) ( resid 111 and name N and segid AN1) 0.2000 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 111 and name C and segid AN1) ( resid 112 and name N and segid AN1) 2.0840 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 113 and name C and segid AN1) ( resid 114 and name N and segid AN1) -0.2460 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 115 and name C and segid AN1) ( resid 116 and name N and segid AN1) -0.5580 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 116 and name C and segid AN1) ( resid 117 and name N and segid AN1) -0.5640 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 117 and name C and segid AN1) ( resid 118 and name N and segid AN1) -1.3560 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 118 and name C and segid AN1) ( resid 119 and name N and segid AN1) 0.2300 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 120 and name C and segid AN1) ( resid 121 and name N and segid AN1) 1.7620 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 121 and name C and segid AN1) ( resid 122 and name N and segid AN1) -2.1420 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 122 and name C and segid AN1) ( resid 123 and name N and segid AN1) 0.3780 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 123 and name C and segid AN1) ( resid 124 and name N and segid AN1) -0.2760 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 124 and name C and segid AN1) ( resid 125 and name N and 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resid 133 and name C and segid AN1) ( resid 134 and name N and segid AN1) 0.0220 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 134 and name C and segid AN1) ( resid 135 and name N and segid AN1) -1.0980 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 135 and name C and segid AN1) ( resid 136 and name N and segid AN1) -2.2180 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 136 and name C and segid AN1) ( resid 137 and name N and segid AN1) 1.0540 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 137 and name C and segid AN1) ( resid 138 and name N and segid AN1) -1.2420 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 138 and name C and segid AN1) ( resid 139 and name N and segid AN1) 0.4380 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 139 and name C and segid AN1) ( resid 140 and name N and segid AN1) -1.2980 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 140 and name C and segid AN1) ( resid 141 and name N and segid AN1) 1.3120 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and 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and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 145 and name C and segid AN1) ( resid 146 and name N and segid AN1) 0.2240 0.1200 0.1200 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 146 and name C and segid AN1) ( resid 147 and name N and segid AN1) -1.5940 0.1200 0.1200 ! COHA Couplings assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 82 and name C and segid AN1) ( resid 82 and name HA and segid AN1) 2.6420 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 83 and name C and segid AN1) ( resid 83 and name HA and segid AN1) 0.0920 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 84 and name C and segid AN1) ( resid 84 and name HA and segid AN1) -2.5310 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 85 and name C and segid AN1) ( resid 85 and name 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AN1) ( resid 89 and name HA and segid AN1) 2.4530 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 90 and name C and segid AN1) ( resid 90 and name HA and segid AN1) 0.0780 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 92 and name C and segid AN1) ( resid 92 and name HA and segid AN1) -1.5930 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 93 and name C and segid AN1) ( resid 93 and name HA and segid AN1) 0.5050 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 94 and name C and segid AN1) ( resid 94 and name HA and segid AN1) -2.8870 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 95 and name C and segid AN1) ( resid 95 and name HA and segid AN1) 3.5590 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 96 and name C and segid AN1) ( resid 96 and name HA and segid AN1) 1.8340 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 97 and name C and segid AN1) ( resid 97 and name HA and segid AN1) 4.5530 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name 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segid SSS) ( resid 500 and name Y and segid SSS) ( resid 103 and name C and segid AN1) ( resid 103 and name HA and segid AN1) -3.6950 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 104 and name C and segid AN1) ( resid 104 and name HA and segid AN1) 4.2430 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 105 and name C and segid AN1) ( resid 105 and name HA and segid AN1) 0.1190 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 106 and name C and segid AN1) ( resid 106 and name HA and segid AN1) 3.4180 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 107 and name C and segid AN1) ( resid 107 and name HA and segid AN1) -0.6190 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 108 and name C and segid AN1) ( resid 108 and name HA and segid AN1) 2.3410 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 109 and name C and segid AN1) ( resid 109 and name HA and segid AN1) 1.8490 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 110 and name C and segid AN1) ( resid 110 and name HA and segid AN1) -1.0450 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 111 and name C and segid AN1) ( resid 111 and name HA and segid AN1) 2.0350 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 112 and name C and segid AN1) ( resid 112 and name HA and segid AN1) 0.2110 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 113 and name C and segid AN1) ( resid 113 and name HA and segid AN1) 1.6700 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 114 and name C and segid AN1) ( resid 114 and name HA and segid AN1) -1.7730 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 115 and name C and segid AN1) ( resid 115 and name HA and segid AN1) 1.8090 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 116 and name C and segid AN1) ( resid 116 and name HA and segid AN1) 1.0640 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 117 and name C and segid AN1) ( resid 117 and name HA and segid AN1) 1.7750 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 118 and name C and segid AN1) ( resid 118 and name HA and segid AN1) 1.9080 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 119 and name C and segid AN1) ( resid 119 and name HA and segid AN1) -3.4710 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 120 and name C and segid AN1) ( resid 120 and name HA and segid AN1) 1.7060 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 121 and name C and segid AN1) ( resid 121 and name HA and segid AN1) -4.7640 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 122 and name C and segid AN1) ( resid 122 and name HA and segid AN1) 3.8460 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 123 and name C and segid AN1) ( resid 123 and name HA and segid AN1) -5.4390 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 124 and name C and segid AN1) ( resid 124 and name HA and segid AN1) 0.9970 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 125 and name C and segid AN1) ( resid 125 and name HA and segid AN1) -1.7490 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 126 and name C and segid AN1) ( resid 126 and name HA and segid AN1) 0.5160 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 127 and name C and segid AN1) ( resid 127 and name HA and segid AN1) -1.7560 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 128 and name C and segid AN1) ( resid 128 and name HA and segid AN1) -0.9350 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 129 and name C and segid AN1) ( resid 129 and name HA and segid AN1) 0.7970 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 130 and name C and segid AN1) ( resid 130 and name HA and segid AN1) 0.0490 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 131 and name C and segid AN1) ( resid 131 and name HA and segid AN1) 3.5610 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 132 and name C and segid AN1) ( resid 132 and name HA and segid AN1) -0.9950 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 133 and name C and segid AN1) ( resid 133 and name HA and segid AN1) -0.0020 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 134 and name C and segid AN1) ( resid 134 and name HA and segid AN1) 3.1520 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 135 and name C and segid AN1) ( resid 135 and name HA and segid AN1) 1.8400 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 136 and name C and segid AN1) ( resid 136 and name HA and segid AN1) 1.5980 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 137 and name C and segid AN1) ( resid 137 and name HA and segid AN1) 1.2360 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 138 and name C and segid AN1) ( resid 138 and name HA and segid AN1) 4.6350 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 139 and name C and segid AN1) ( resid 139 and name HA and segid AN1) -3.0970 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 140 and name C and segid AN1) ( resid 140 and name HA and segid AN1) 1.7870 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 141 and name C and segid AN1) ( resid 141 and name HA and segid AN1) -1.4310 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 142 and name C and segid AN1) ( resid 142 and name HA and segid AN1) 1.2580 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 143 and name C and segid AN1) ( resid 143 and name HA and segid AN1) 0.5840 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 144 and name C and segid AN1) ( resid 144 and name HA and segid AN1) -3.1130 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 145 and name C and segid AN1) ( resid 145 and name HA and segid AN1) 1.8750 1.0000 1.0000 !CBHB Couplings assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 84 and name CB and segid AN1) ( resid 84 and name HB# and segid AN1) 15.188 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 86 and name CB and segid AN1) ( resid 86 and name HB# and segid AN1) -0.3740 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 89 and name CB and segid AN1) ( resid 89 and name HB# and segid AN1) 17.1680 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 92 and name CB and segid AN1) ( resid 92 and name HB# and segid AN1) -33.781 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 99 and name CB and segid AN1) ( resid 99 and name HB# and segid AN1) 37.8010 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 100 and name CB and segid AN1) ( resid 100 and name HB and segid AN1) 31.8310 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 104 and name CB and segid AN1) ( resid 104 and name HB# and segid AN1) -21.5920 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 105 and name CB and segid AN1) ( resid 105 and name HB# and segid AN1) -23.3950 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 109 and name CB and segid AN1) ( resid 109 and name HB# and segid AN1) -16.1190 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 117 and name CB and segid AN1) ( resid 117 and name HB and segid AN1) -18.6030 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 118 and name CB and segid AN1) ( resid 118 and name HB# and segid AN1) -16.6470 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 120 and name CB and segid AN1) ( resid 120 and name HB# and segid AN1) 17.8320 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 121 and name CB and segid AN1) ( resid 121 and name HB and segid AN1) -24.0230 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 124 and name CB and segid AN1) ( resid 124 and name HB# and segid AN1) 12.2660 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 125 and name CB and segid AN1) ( resid 125 and name HB and segid AN1) -11.879 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 130 and name CB and segid AN1) ( resid 130 and name HB and segid AN1) 12.7490 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 136 and name CB and segid AN1) ( resid 136 and name HB and segid AN1) 22.7090 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 137 and name CB and segid AN1) ( resid 137 and name HB# and segid AN1) -24.153 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 138 and name CB and segid AN1) ( resid 138 and name HB# and segid AN1) 40.8540 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 139 and name CB and segid AN1) ( resid 139 and name HB# and segid AN1) -0.388 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 140 and name CB and segid AN1) ( resid 140 and name HB# and segid AN1) 33.1460 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 141 and name CB and segid AN1) ( resid 141 and name HB# and segid AN1) -23.810 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 142 and name CB and segid AN1) ( resid 142 and name HB and segid AN1) -16.442 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 144 and name CB and segid AN1) ( resid 144 and name HB# and segid AN1) -25.7160 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 145 and name CB and segid AN1) ( resid 145 and name HB# and segid AN1) -16.175 1.0000 1.0000 !Couplings derived from Methyl CH3 dipolar couplings assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 91 and name CB and segid AN1) ( resid 91 and name CG1 and segid AN1) -0.327 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 91 and name CB and segid AN1) ( resid 91 and name CG2 and segid AN1) -2.020 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 100 and name CB and segid AN1) ( resid 100 and name CG2 and segid AN1) 1.027 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 121 and name CB and segid AN1) ( resid 121 and name CG1 and segid AN1) -0.320 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 121 and name CB and segid AN1) ( resid 121 and name CG2 and segid AN1) -0.830 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 125 and name CB and segid AN1) ( resid 125 and name CG2 and segid AN1) -0.703 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 125 and name CB and segid AN1) ( resid 125 and name CD1 and segid AN1) 0.401 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 130 and name CB and segid AN1) ( resid 130 and name CD1 and segid AN1) -1.138 1.0000 1.0000 assign ( resid 500 and name OO and segid SSS) ( resid 500 and name Z and segid SSS) ( resid 500 and name X and segid SSS) ( resid 500 and name Y and segid SSS) ( resid 142 and name CB and segid AN1) ( resid 142 and name CG1 and segid AN1) 0.050 1.0000 1.0000
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