NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image	mrblock_id	pdb_id	cing	stage	position	program	type	subtype	subsubtype
	15046	1xfe	cing	1-original	1	XPLOR/CNS	distance	NOE	simple

assign (resid 2 and name HA ) (resid 1 and name HN ) 4.0 2.2 2.5  !9.769e+04
assign (resid 3 and name HA ) (resid 4 and name HN ) 3.2 1.4 0.8  !2.072e+05
assign (resid 3 and name HA ) (resid 5 and name HN ) 4.0 2.2 2.5  !2.350e+04
assign (resid 3 and name HB ) (resid 3 and name HN ) 4.0 2.2 2.5  !6.192e+04
assign (resid 3 and name HB ) (resid 4 and name HN ) 4.0 2.2 2.5  !5.982e+03
assign (resid 4 and name HA ) (resid 5 and name HN ) 3.2 1.4 0.8  !1.768e+05
assign (resid 4 and name HB ) (resid 4 and name HN ) 4.0 2.2 2.5  !1.033e+05
assign (resid 4 and name HB ) (resid 5 and name HN ) 4.0 2.2 2.5  !4.214e+04
assign (resid 5 and name HA ) (resid 5 and name HG ) 4.0 2.2 2.5  !6.790e+03
assign (resid 5 and name HB1 ) (resid 5 and name HN ) 4.0 2.2 2.5  !9.994e+04
assign (resid 5 and name HB2 ) (resid 5 and name HN ) 4.0 2.2 2.5  !8.284e+04
assign (resid 5 and name HG ) (resid 5 and name HN ) 4.0 2.2 2.5  !1.377e+05
assign (resid 6 and name HA ) (resid 7 and name HN ) 3.2 1.4 0.8  !2.304e+05
assign (resid 6 and name HB1 ) (resid 7 and name HN ) 4.0 2.2 2.5  !2.729e+04
assign (resid 6 and name HB2 ) (resid 7 and name HN ) 4.0 2.2 2.5  !2.941e+04
assign (resid 7 and name HA ) (resid 8 and name HN ) 2.6 0.8 0.4  !6.455e+05
assign (resid 7 and name HB1 ) (resid 7 and name HN ) 4.0 2.2 2.5  !6.080e+04
assign (resid 7 and name HB1 ) (resid 8 and name HN ) 4.0 2.2 2.5  !1.417e+05
assign (resid 7 and name HB2 ) (resid 7 and name HN ) 4.0 2.2 2.5  !9.582e+04
assign (resid 7 and name HB2 ) (resid 8 and name HN ) 4.0 2.2 2.5  !1.212e+05
assign (resid 7 and name HN ) (resid 8 and name HN ) 4.0 2.2 2.5  !1.864e+04
assign (resid 8 and name HA1 ) (resid 9 and name HD1 ) 3.2 1.4 0.8  !1.875e+04
assign (resid 8 and name HA1 ) (resid 9 and name HD2 ) 3.2 1.4 0.8  !2.069e+04
assign (resid 8 and name HA2 ) (resid 9 and name HD1 ) 4.0 2.2 2.5  !1.666e+04
assign (resid 8 and name HA2 ) (resid 9 and name HD2 ) 3.2 1.4 0.8  !2.073e+04
assign (resid 8 and name HN ) (resid 7 and name HN ) 4.0 2.2 2.5  !5.542e+03
assign (resid 9 and name HA ) (resid 10 and name HN ) 3.2 1.4 0.8  !2.807e+05
assign (resid 9 and name HA ) (resid 11 and name HN ) 4.0 2.2 2.5  !5.865e+04
assign (resid 9 and name HA ) (resid 9 and name HG1 ) 3.2 1.4 0.8  !1.800e+04
assign (resid 9 and name HA ) (resid 9 and name HG2 ) 3.2 1.4 0.8  !2.321e+04
assign (resid 9 and name HB1 ) (resid 10 and name HN ) 4.0 2.2 2.5  !6.033e+04
assign (resid 9 and name HB2 ) (resid 10 and name HN ) 4.0 2.2 2.5  !6.002e+04
assign (resid 9 and name HD1 ) (resid 10 and name HN ) 4.0 2.2 2.5  !2.481e+04
assign (resid 9 and name HD1 ) (resid 8 and name HN ) 4.0 2.2 2.5  !5.331e+04
assign (resid 9 and name HD1 ) (resid 9 and name HB1 ) 4.0 2.2 2.5  !1.186e+04
assign (resid 9 and name HD1 ) (resid 9 and name HB2 ) 4.0 2.2 2.5  !7.011e+03
assign (resid 9 and name HD2 ) (resid 10 and name HN ) 4.0 2.2 2.5  !2.267e+04
assign (resid 9 and name HD2 ) (resid 8 and name HN ) 4.0 2.2 2.5  !5.547e+04
assign (resid 9 and name HD2 ) (resid 9 and name HB1 ) 4.0 2.2 2.5  !9.153e+03
assign (resid 9 and name HD2 ) (resid 9 and name HB2 ) 4.0 2.2 2.5  !1.034e+04
assign (resid 9 and name HG1 ) (resid 10 and name HN ) 4.0 2.2 2.5  !2.304e+04
assign (resid 9 and name HG2 ) (resid 10 and name HN ) 4.0 2.2 2.5  !3.050e+04
assign (resid 10 and name HA ) (resid 22 and name HB1 ) 3.2 1.4 0.8  !1.729e+04
assign (resid 10 and name HA ) (resid 22 and name HB2 ) 4.0 2.2 2.5  !1.560e+04
assign (resid 10 and name HB1 ) (resid 10 and name HD21 ) 4.0 2.2 2.5  !1.460e+05
assign (resid 10 and name HB1 ) (resid 10 and name HD22 ) 4.0 2.2 2.5  !6.710e+04
assign (resid 10 and name HB1 ) (resid 10 and name HN ) 4.0 2.2 2.5  !8.641e+04
assign (resid 10 and name HB1 ) (resid 11 and name HN ) 4.0 2.2 2.5  !2.316e+04
assign (resid 10 and name HB1 ) (resid 22 and name HN ) 4.0 2.2 2.5  !2.661e+04
assign (resid 10 and name HB2 ) (resid 10 and name HD21 ) 4.0 2.2 2.5  !1.410e+05
assign (resid 10 and name HB2 ) (resid 10 and name HD22 ) 4.0 2.2 2.5  !8.518e+04
assign (resid 10 and name HB2 ) (resid 10 and name HN ) 4.0 2.2 2.5  !8.971e+04
assign (resid 10 and name HB2 ) (resid 11 and name HN ) 4.0 2.2 2.5  !1.753e+04
assign (resid 10 and name HB2 ) (resid 22 and name HN ) 4.0 2.2 2.5  !1.646e+04
assign (resid 10 and name HN ) (resid 11 and name HN ) 4.0 2.2 2.5  !1.031e+05
assign (resid 11 and name HA ) (resid 11 and name HG1 ) 4.0 2.2 2.5  !1.125e+04
assign (resid 11 and name HA ) (resid 11 and name HG2 ) 4.0 2.2 2.5  !1.076e+04
assign (resid 11 and name HA ) (resid 12 and name HN ) 2.6 0.8 0.4  !4.217e+05
assign (resid 11 and name HA ) (resid 20 and name HN ) 4.0 2.2 2.5  !6.161e+04
assign (resid 11 and name HA ) (resid 22 and name HN ) 4.0 2.2 2.5  !1.152e+05
assign (resid 11 and name HB1 ) (resid 10 and name HN ) 4.0 2.2 2.5  !1.591e+04
assign (resid 11 and name HB1 ) (resid 11 and name HN ) 4.0 2.2 2.5  !1.399e+05
assign (resid 11 and name HB1 ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.636e+05
assign (resid 11 and name HB1 ) (resid 7 and name HN ) 4.0 2.2 2.5  !2.523e+04
assign (resid 11 and name HB1 ) (resid 8 and name HN ) 4.0 2.2 2.5  !2.149e+04
assign (resid 11 and name HB2 ) (resid 10 and name HN ) 4.0 2.2 2.5  !1.828e+04
assign (resid 11 and name HB2 ) (resid 11 and name HN ) 3.2 1.4 0.8  !2.172e+05
assign (resid 11 and name HB2 ) (resid 12 and name HN ) 3.2 1.4 0.8  !1.821e+05
assign (resid 11 and name HB2 ) (resid 7 and name HN ) 4.0 2.2 2.5  !2.060e+04
assign (resid 11 and name HB2 ) (resid 8 and name HN ) 4.0 2.2 2.5  !3.184e+04
assign (resid 11 and name HG1 ) (resid 10 and name HN ) 4.0 2.2 2.5  !8.296e+03
assign (resid 11 and name HG1 ) (resid 11 and name HN ) 4.0 2.2 2.5  !8.585e+04
assign (resid 11 and name HG1 ) (resid 12 and name HN ) 4.0 2.2 2.5  !8.416e+04
assign (resid 11 and name HG1 ) (resid 7 and name HN ) 4.0 2.2 2.5  !1.982e+04
assign (resid 11 and name HG1 ) (resid 8 and name HN ) 4.0 2.2 2.5  !1.955e+04
assign (resid 11 and name HG2 ) (resid 10 and name HN ) 4.0 2.2 2.5  !1.150e+04
assign (resid 11 and name HG2 ) (resid 11 and name HN ) 4.0 2.2 2.5  !1.136e+05
assign (resid 11 and name HG2 ) (resid 12 and name HN ) 4.0 2.2 2.5  !5.404e+04
assign (resid 11 and name HG2 ) (resid 7 and name HN ) 4.0 2.2 2.5  !1.884e+04
assign (resid 11 and name HG2 ) (resid 8 and name HN ) 4.0 2.2 2.5  !1.359e+04
assign (resid 11 and name HN ) (resid 10 and name HN ) 4.0 2.2 2.5  !1.568e+05
assign (resid 11 and name HN ) (resid 12 and name HN ) 4.0 2.2 2.5  !5.105e+04
assign (resid 12 and name HA ) (resid 13 and name HN ) 2.6 0.8 0.4  !7.388e+05
assign (resid 12 and name HA ) (resid 14 and name HN ) 4.0 2.2 2.5  !6.922e+04
assign (resid 12 and name HB1 ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.096e+05
assign (resid 12 and name HB1 ) (resid 13 and name HN ) 4.0 2.2 2.5  !6.839e+04
assign (resid 12 and name HB1 ) (resid 20 and name HN ) 4.0 2.2 2.5  !5.021e+04
assign (resid 12 and name HB1 ) (resid 21 and name HN ) 4.0 2.2 2.5  !8.249e+03
assign (resid 12 and name HB2 ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.338e+05
assign (resid 12 and name HB2 ) (resid 13 and name HN ) 4.0 2.2 2.5  !5.260e+04
assign (resid 12 and name HB2 ) (resid 20 and name HN ) 4.0 2.2 2.5  !6.724e+04
assign (resid 12 and name HB2 ) (resid 21 and name HN ) 4.0 2.2 2.5  !7.469e+03
assign (resid 12 and name HN ) (resid 11 and name HN ) 4.0 2.2 2.5  !3.644e+04
assign (resid 12 and name HN ) (resid 13 and name HN ) 4.0 2.2 2.5  !4.321e+04
assign (resid 12 and name HN ) (resid 20 and name HN ) 4.0 2.2 2.5  !8.465e+04
assign (resid 12 and name HN ) (resid 22 and name HN ) 4.0 2.2 2.5  !1.602e+04
assign (resid 13 and name HA ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.415e+04
assign (resid 13 and name HA ) (resid 14 and name HN ) 2.6 0.8 0.4  !3.945e+05
assign (resid 13 and name HA ) (resid 19 and name HA ) 4.0 2.2 2.5  !5.050e+02
assign (resid 13 and name HA ) (resid 20 and name HN ) 4.0 2.2 2.5  !7.726e+04
assign (resid 13 and name HB1 ) (resid 13 and name HN ) 3.2 1.4 0.8  !2.731e+05
assign (resid 13 and name HB1 ) (resid 14 and name HN ) 4.0 2.2 2.5  !6.742e+04
assign (resid 13 and name HB1 ) (resid 17 and name HN ) 4.0 2.2 2.5  !1.387e+04
assign (resid 13 and name HB2 ) (resid 13 and name HN ) 3.2 1.4 0.8  !2.018e+05
assign (resid 13 and name HB2 ) (resid 14 and name HN ) 4.0 2.2 2.5  !6.064e+04
assign (resid 13 and name HB2 ) (resid 17 and name HN ) 4.0 2.2 2.5  !1.301e+04
assign (resid 13 and name HE1 ) (resid 13 and name HB1 ) 4.0 2.2 2.5  !1.068e+04
assign (resid 13 and name HE1 ) (resid 13 and name HB2 ) 4.0 2.2 2.5  !1.010e+04
assign (resid 13 and name HE1 ) (resid 13 and name HN ) 4.0 2.2 2.5  !8.638e+03
assign (resid 13 and name HE1 ) (resid 14 and name HN ) 4.0 2.2 2.5  !4.215e+04
assign (resid 13 and name HE1 ) (resid 17 and name HN ) 4.0 2.2 2.5  !3.788e+04
assign (resid 13 and name HE2 ) (resid 13 and name HN ) 4.0 2.2 2.5  !1.525e+04
assign (resid 13 and name HE2 ) (resid 14 and name HN ) 4.0 2.2 2.5  !4.858e+04
assign (resid 13 and name HE2 ) (resid 17 and name HN ) 4.0 2.2 2.5  !5.290e+04
assign (resid 13 and name HN ) (resid 12 and name HN ) 4.0 2.2 2.5  !6.229e+04
assign (resid 13 and name HN ) (resid 14 and name HN ) 4.0 2.2 2.5  !2.562e+04
assign (resid 14 and name HA ) (resid 12 and name HZ ) 4.0 2.2 2.5  !4.465e+03
assign (resid 14 and name HA ) (resid 16 and name HN ) 4.0 2.2 2.5  !2.282e+04
assign (resid 14 and name HN ) (resid 13 and name HN ) 4.0 2.2 2.5  !3.116e+04
assign (resid 14 and name HN ) (resid 16 and name HN ) 4.0 2.2 2.5  !8.314e+03
assign (resid 14 and name HN ) (resid 17 and name HN ) 4.0 2.2 2.5  !2.494e+04
assign (resid 14 and name HN ) (resid 20 and name HN ) 4.0 2.2 2.5  !3.011e+04
assign (resid 15 and name HA ) (resid 15 and name HD2 ) 4.0 2.2 2.5  !1.671e+04
assign (resid 15 and name HA ) (resid 16 and name HN ) 4.0 2.2 2.5  !4.303e+04
assign (resid 15 and name HA ) (resid 17 and name HN ) 4.0 2.2 2.5  !5.700e+04
assign (resid 15 and name HB1 ) (resid 15 and name HD2 ) 4.0 2.2 2.5  !1.355e+04
assign (resid 15 and name HB1 ) (resid 16 and name HN ) 4.0 2.2 2.5  !4.369e+04
assign (resid 15 and name HB2 ) (resid 15 and name HD2 ) 4.0 2.2 2.5  !6.228e+03
assign (resid 15 and name HB2 ) (resid 16 and name HN ) 4.0 2.2 2.5  !7.239e+04
assign (resid 16 and name HA ) (resid 17 and name HN ) 4.0 2.2 2.5  !9.459e+04
assign (resid 16 and name HA ) (resid 34 and name HB2 ) 4.0 2.2 2.5  !1.316e+04
assign (resid 16 and name HA ) (resid 34 and name HB1 ) 4.0 2.2 2.5  !1.120e+04
assign (resid 16 and name HA ) (resid 34 and name HN ) 4.0 2.2 2.5  !7.460e+04
assign (resid 16 and name HN ) (resid 14 and name HN ) 4.0 2.2 2.5  !3.158e+03
assign (resid 16 and name HN ) (resid 17 and name HN ) 4.0 2.2 2.5  !1.040e+05
assign (resid 17 and name HA1 ) (resid 13 and name HB1 ) 4.0 2.2 2.5  !9.054e+03
assign (resid 17 and name HA1 ) (resid 13 and name HE2 ) 4.0 2.2 2.5  !8.682e+03
assign (resid 17 and name HA2 ) (resid 13 and name HE2 ) 4.0 2.2 2.5  !6.034e+03
assign (resid 17 and name HN ) (resid 14 and name HN ) 4.0 2.2 2.5  !1.816e+04
assign (resid 17 and name HN ) (resid 16 and name HN ) 4.0 2.2 2.5  !1.604e+05
assign (resid 18 and name HA ) (resid 18 and name HG1 ) 4.0 2.2 2.5  !9.911e+03
assign (resid 18 and name HA ) (resid 18 and name HG2 ) 4.0 2.2 2.5  !1.607e+04
assign (resid 18 and name HA ) (resid 19 and name HN ) 2.6 0.8 0.4  !3.666e+05
assign (resid 18 and name HB1 ) (resid 19 and name HN ) 4.0 2.2 2.5  !1.044e+05
assign (resid 18 and name HB2 ) (resid 19 and name HN ) 4.0 2.2 2.5  !1.692e+05
assign (resid 18 and name HG1 ) (resid 17 and name HN ) 4.0 2.2 2.5  !8.845e+03
assign (resid 18 and name HG1 ) (resid 19 and name HN ) 4.0 2.2 2.5  !7.323e+04
assign (resid 18 and name HG2 ) (resid 17 and name HN ) 4.0 2.2 2.5  !1.201e+04
assign (resid 18 and name HG2 ) (resid 19 and name HN ) 4.0 2.2 2.5  !9.340e+04
assign (resid 19 and name HA ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.886e+04
assign (resid 19 and name HA ) (resid 13 and name HB1 ) 4.0 2.2 2.5  !2.385e+03
assign (resid 19 and name HA ) (resid 13 and name HB2 ) 4.0 2.2 2.5  !4.116e+03
assign (resid 19 and name HA ) (resid 13 and name HN ) 4.0 2.2 2.5  !1.154e+04
assign (resid 19 and name HA ) (resid 14 and name HN ) 4.0 2.2 2.5  !9.136e+04
assign (resid 19 and name HA ) (resid 20 and name HN ) 2.6 0.8 0.4  !4.310e+05
assign (resid 19 and name HB1 ) (resid 19 and name HN ) 3.2 1.4 0.8  !2.252e+05
assign (resid 19 and name HB1 ) (resid 20 and name HN ) 4.0 2.2 2.5  !6.653e+04
assign (resid 19 and name HB2 ) (resid 19 and name HN ) 3.2 1.4 0.8  !2.220e+05
assign (resid 19 and name HB2 ) (resid 20 and name HN ) 4.0 2.2 2.5  !6.369e+04
assign (resid 19 and name HN ) (resid 20 and name HN ) 4.0 2.2 2.5  !2.667e+04
assign (resid 20 and name HA ) (resid 20 and name HG11 ) 4.0 2.2 2.5  !2.591e+03
assign (resid 20 and name HA ) (resid 20 and name HG12 ) 4.0 2.2 2.5  !1.761e+03
assign (resid 20 and name HA ) (resid 21 and name HN ) 2.6 0.8 0.4  !3.746e+05
assign (resid 20 and name HB ) (resid 20 and name HN ) 4.0 2.2 2.5  !4.648e+04
assign (resid 20 and name HB ) (resid 21 and name HN ) 2.6 0.8 0.4  !3.922e+05
assign (resid 20 and name HG11 ) (resid 20 and name HN ) 3.2 1.4 0.8  !1.745e+05
assign (resid 20 and name HG11 ) (resid 21 and name HN ) 4.0 2.2 2.5  !1.493e+05
assign (resid 20 and name HG12 ) (resid 20 and name HN ) 3.2 1.4 0.8  !1.791e+05
assign (resid 20 and name HG12 ) (resid 21 and name HN ) 4.0 2.2 2.5  !7.404e+04
assign (resid 20 and name HN ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.031e+05
assign (resid 20 and name HN ) (resid 14 and name HN ) 4.0 2.2 2.5  !3.592e+04
assign (resid 20 and name HN ) (resid 19 and name HN ) 4.0 2.2 2.5  !2.223e+04
assign (resid 20 and name HN ) (resid 21 and name HN ) 4.0 2.2 2.5  !2.236e+04
assign (resid 21 and name HA ) (resid 11 and name HB1 ) 4.0 2.2 2.5  !4.387e+03
assign (resid 21 and name HA ) (resid 11 and name HB2 ) 4.0 2.2 2.5  !5.823e+03
assign (resid 21 and name HA ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.126e+05
assign (resid 21 and name HA ) (resid 22 and name HB1 ) 4.0 2.2 2.5  !6.516e+03
assign (resid 21 and name HA ) (resid 22 and name HB2 ) 4.0 2.2 2.5  !6.036e+03
assign (resid 21 and name HA ) (resid 22 and name HN ) 3.2 1.4 0.8  !2.990e+05
assign (resid 21 and name HA ) (resid 23 and name HN ) 4.0 2.2 2.5  !3.585e+04
assign (resid 21 and name HB ) (resid 10 and name HD21 ) 4.0 2.2 2.5  !2.708e+04
assign (resid 21 and name HB ) (resid 10 and name HD22 ) 4.0 2.2 2.5  !2.801e+04
assign (resid 21 and name HB ) (resid 20 and name HN ) 4.0 2.2 2.5  !3.860e+04
assign (resid 21 and name HB ) (resid 21 and name HN ) 4.0 2.2 2.5  !1.044e+05
assign (resid 21 and name HB ) (resid 22 and name HN ) 3.2 1.4 0.8  !1.706e+05
assign (resid 21 and name HB ) (resid 23 and name HN ) 4.0 2.2 2.5  !1.150e+05
assign (resid 21 and name HN ) (resid 20 and name HN ) 4.0 2.2 2.5  !2.278e+04
assign (resid 21 and name HN ) (resid 22 and name HN ) 4.0 2.2 2.5  !3.675e+04
assign (resid 22 and name HA ) (resid 12 and name HB1 ) 4.0 2.2 2.5  !2.634e+03
assign (resid 22 and name HA ) (resid 12 and name HB2 ) 4.0 2.2 2.5  !4.513e+03
assign (resid 22 and name HA ) (resid 12 and name HN ) 4.0 2.2 2.5  !1.506e+04
assign (resid 22 and name HA ) (resid 22 and name HG ) 4.0 2.2 2.5  !1.008e+04
assign (resid 22 and name HA ) (resid 23 and name HN ) 4.0 2.2 2.5  !7.561e+04
assign (resid 22 and name HA ) (resid 24 and name HN ) 4.0 2.2 2.5  !6.344e+04
assign (resid 22 and name HA ) (resid 25 and name HB ) 4.0 2.2 2.5  !2.534e+03
assign (resid 22 and name HA ) (resid 25 and name HN ) 4.0 2.2 2.5  !8.002e+04
assign (resid 22 and name HA ) (resid 26 and name HN ) 4.0 2.2 2.5  !4.669e+04
assign (resid 22 and name HB1 ) (resid 22 and name HN ) 3.2 1.4 0.8  !2.014e+05
assign (resid 22 and name HB1 ) (resid 23 and name HN ) 4.0 2.2 2.5  !9.820e+04
assign (resid 22 and name HB1 ) (resid 24 and name HN ) 4.0 2.2 2.5  !3.308e+04
assign (resid 22 and name HB1 ) (resid 25 and name HN ) 4.0 2.2 2.5  !2.267e+04
!assign (resid 22 and name HB2 ) (resid 22 and name HN ) 2.6 0.8 0.4  !3.106e+05
assign (resid 22 and name HB2 ) (resid 22 and name HN ) 3.2 1.4 0.8
assign (resid 22 and name HB2 ) (resid 23 and name HN ) 4.0 2.2 2.5  !8.765e+04
assign (resid 22 and name HG ) (resid 21 and name HN ) 4.0 2.2 2.5  !9.569e+04
assign (resid 22 and name HG ) (resid 22 and name HN ) 4.0 2.2 2.5  !1.199e+05
assign (resid 22 and name HG ) (resid 23 and name HN ) 4.0 2.2 2.5  !4.388e+04
assign (resid 22 and name HN ) (resid 21 and name HN ) 4.0 2.2 2.5  !2.897e+04
assign (resid 22 and name HN ) (resid 23 and name HN ) 3.2 1.4 0.8  !1.901e+05
assign (resid 23 and name HB1 ) (resid 23 and name HN ) 4.0 2.2 2.5  !1.332e+05
assign (resid 23 and name HB1 ) (resid 24 and name HN ) 4.0 2.2 2.5  !3.688e+04
assign (resid 23 and name HB1 ) (resid 25 and name HN ) 4.0 2.2 2.5  !2.958e+04
assign (resid 23 and name HB2 ) (resid 23 and name HN ) 3.2 1.4 0.8  !2.157e+05
assign (resid 23 and name HB2 ) (resid 24 and name HN ) 4.0 2.2 2.5  !5.239e+04
assign (resid 23 and name HB2 ) (resid 25 and name HN ) 4.0 2.2 2.5  !2.301e+04
assign (resid 23 and name HN ) (resid 22 and name HN ) 4.0 2.2 2.5  !6.847e+04
assign (resid 23 and name HN ) (resid 24 and name HN ) 4.0 2.2 2.5  !1.341e+05
assign (resid 23 and name HN ) (resid 25 and name HN ) 4.0 2.2 2.5  !1.366e+04
assign (resid 24 and name HA ) (resid 23 and name HB1 ) 3.2 1.4 0.8  !2.559e+04
assign (resid 24 and name HA ) (resid 23 and name HB2 ) 3.2 1.4 0.8  !2.586e+04
assign (resid 24 and name HA ) (resid 24 and name HD2 ) 3.2 1.4 0.8  !2.677e+04
assign (resid 24 and name HA ) (resid 24 and name HG1 ) 3.2 1.4 0.8  !1.719e+04
assign (resid 24 and name HA ) (resid 24 and name HG2 ) 4.0 2.2 2.5  !1.086e+04
assign (resid 24 and name HA ) (resid 25 and name HN ) 4.0 2.2 2.5  !1.286e+05
assign (resid 24 and name HA ) (resid 27 and name HB2 ) 4.0 2.2 2.5  !7.519e+03
assign (resid 24 and name HA ) (resid 27 and name HD21 ) 4.0 2.2 2.5  !8.064e+04
assign (resid 24 and name HA ) (resid 27 and name HD22 ) 4.0 2.2 2.5  !1.032e+05
assign (resid 24 and name HB1 ) (resid 21 and name HN ) 4.0 2.2 2.5  !1.304e+04
assign (resid 24 and name HB1 ) (resid 23 and name HN ) 4.0 2.2 2.5  !6.788e+03
assign (resid 24 and name HB1 ) (resid 24 and name HN ) 4.0 2.2 2.5  !1.556e+05
assign (resid 24 and name HB1 ) (resid 25 and name HN ) 4.0 2.2 2.5  !2.680e+04
assign (resid 24 and name HB1 ) (resid 27 and name HD21 ) 4.0 2.2 2.5  !4.711e+04
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assign (resid 24 and name HN ) (resid 25 and name HN ) 3.2 1.4 0.8  !2.784e+05
assign (resid 25 and name HA ) (resid 26 and name HB2 ) 4.0 2.2 2.5  !4.865e+03
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assign (resid 12 and name HA ) (resid 12 and name HD# ) 2.6 0.8 0.9  !3.443e+04
assign (resid 12 and name HA ) (resid 12 and name HE# ) 4.0 2.2 3.0  !1.030e+04
assign (resid 12 and name HB1 ) (resid 12 and name HD# ) 2.6 0.8 0.9  !4.050e+04
assign (resid 12 and name HB1 ) (resid 12 and name HE# ) 4.0 2.2 3.0  !6.733e+03
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assign (resid 12 and name HB1 ) (resid 22 and name HD# ) 4.0 2.2 3.5
assign (resid 12 and name HB1 ) (resid 25 and name HG2# ) 4.0 2.2 3.0  !4.629e+03
assign (resid 12 and name HB2 ) (resid 12 and name HD# ) 2.6 0.8 0.9  !4.199e+04
assign (resid 12 and name HB2 ) (resid 12 and name HE# ) 4.0 2.2 3.0  !9.350e+03
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assign (resid 12 and name HB2 ) (resid 22 and name HD# ) 4.0 2.2 3.5
assign (resid 12 and name HB2 ) (resid 25 and name HG2# ) 4.0 2.2 3.0  !9.118e+03
assign (resid 12 and name HD# ) (resid 12 and name HN ) 4.0 2.2 3.0  !5.789e+04
assign (resid 12 and name HD# ) (resid 13 and name HN ) 4.0 2.2 3.0  !7.910e+04
assign (resid 12 and name HD# ) (resid 14 and name HN ) 4.0 2.2 3.0  !1.857e+04
assign (resid 12 and name HD# ) (resid 20 and name HN ) 4.0 2.2 3.0  !6.277e+04
assign (resid 12 and name HE# ) (resid 12 and name HN ) 4.0 2.2 3.0  !7.624e+03
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assign (resid 12 and name HE# ) (resid 14 and name HN ) 4.0 2.2 3.0  !1.129e+04
assign (resid 13 and name HA ) (resid 13 and name HG# ) 4.0 2.2 3.0  !1.243e+04
assign (resid 13 and name HB1 ) (resid 13 and name HG# ) 2.6 0.8 0.9  !6.454e+04
assign (resid 13 and name HB2 ) (resid 13 and name HG# ) 2.6 0.8 0.9  !2.317e+05
assign (resid 13 and name HD# ) (resid 13 and name HB2 ) 2.6 0.8 0.9  !7.520e+04
assign (resid 13 and name HD# ) (resid 13 and name HN ) 4.0 2.2 3.0  !6.023e+04
assign (resid 13 and name HD# ) (resid 14 and name HN ) 4.0 2.2 3.0  !3.545e+04
assign (resid 13 and name HE1 ) (resid 13 and name HG# ) 4.0 2.2 3.0  !4.904e+03
assign (resid 13 and name HG# ) (resid 13 and name HN ) 4.0 2.2 3.0  !1.069e+05
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assign (resid 14 and name HA ) (resid 12 and name HD# ) 4.0 2.2 3.0  !2.419e+03
assign (resid 14 and name HA ) (resid 12 and name HE# ) 2.6 0.8 0.9  !3.124e+04
assign (resid 14 and name HB# ) (resid 14 and name HN ) 4.0 2.2 3.0  !1.414e+05
assign (resid 16 and name HB# ) (resid 16 and name HN ) 4.0 2.2 3.0  !7.344e+04
assign (resid 16 and name HB# ) (resid 34 and name HB2 ) 4.0 2.2 3.0  !4.634e+03
assign (resid 16 and name HB# ) (resid 34 and name HB1 ) 4.0 2.2 3.0  !4.268e+03
assign (resid 16 and name HB# ) (resid 34 and name HN ) 4.0 2.2 3.0  !3.693e+04
assign (resid 17 and name HA1 ) (resid 13 and name HG# ) 4.0 2.2 3.0  !4.938e+03
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assign (resid 19 and name HA ) (resid 20 and name HG2# ) 4.0 2.2 3.0  !2.791e+03
assign (resid 20 and name HA ) (resid 20 and name HD1# ) 4.0 2.2 3.0  !9.033e+03
assign (resid 20 and name HA ) (resid 20 and name HG2# ) 2.6 0.8 0.9  !4.249e+04
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assign (resid 20 and name HB ) (resid 20 and name HD1# ) 2.6 0.8 0.9  !3.286e+04
assign (resid 20 and name HB ) (resid 20 and name HG2# ) 2.6 0.8 0.9  !3.305e+04
assign (resid 20 and name HD1# ) (resid 12 and name HD# ) 2.6 0.8 1.4  !5.853e+04
assign (resid 20 and name HD1# ) (resid 12 and name HN ) 4.0 2.2 3.0  !3.783e+04
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assign (resid 20 and name HG11 ) (resid 12 and name HE# ) 4.0 2.2 3.0  !3.569e+03
assign (resid 20 and name HG11 ) (resid 20 and name HD1# ) 2.6 0.8 0.9  !4.065e+04
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assign (resid 20 and name HG12 ) (resid 20 and name HD1# ) 2.6 0.8 0.9  !6.911e+04
assign (resid 20 and name HG2# ) (resid 12 and name HD# ) 3.2 1.4 1.8  !1.706e+04
assign (resid 20 and name HG2# ) (resid 12 and name HN ) 4.0 2.2 3.0  !1.803e+04
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assign (resid 20 and name HG2# ) (resid 20 and name HN ) 3.2 1.4 1.3  !1.788e+05
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assign (resid 21 and name HA ) (resid 21 and name HG2# ) 2.6 0.8 0.9  !4.315e+04
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assign (resid 21 and name HA ) (resid 22 and name HD# ) 4.0 2.2 3.5
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assign (resid 21 and name HB ) (resid 22 and name HD# ) 4.0 2.2 3.5
assign (resid 21 and name HB ) (resid 25 and name HG2# ) 4.0 2.2 3.0  !3.658e+03
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assign (resid 21 and name HG2# ) (resid 20 and name HN ) 4.0 2.2 3.0  !5.791e+04
assign (resid 21 and name HG2# ) (resid 21 and name HN ) 3.2 1.4 1.3  !2.846e+05
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assign (resid 22 and name HA ) (resid 12 and name HD# ) 4.0 2.2 3.0  !5.400e+03
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assign (resid 22 and name HA ) (resid 22 and name HD# ) 2.6 0.8 1.4
assign (resid 22 and name HA ) (resid 25 and name HG1#  ) 4.0 2.2 3.0  !4.534e+03
assign (resid 22 and name HA ) (resid 25 and name HG2# ) 2.6 0.8 0.9  !3.003e+04
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assign (resid 22 and name HB1 ) (resid 22 and name HD# ) 2.6 0.8 1.4
assign (resid 22 and name HB1 ) (resid 25 and name HG2# ) 4.0 2.2 3.0  !2.222e+03
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assign (resid 22 and name HD# ) (resid 11 and name HN ) 4.0 2.2 3.5
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assign (resid 22 and name HD# ) (resid 12 and name HD# ) 3.2 1.4 2.3
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assign (resid 22 and name HD# ) (resid 12 and name HN ) 4.0 2.2 3.5
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assign (resid 22 and name HD# ) (resid 12 and name HZ ) 4.0 2.2 3.5
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assign (resid 22 and name HD# ) (resid 22 and name HN ) 4.0 2.2 3.5
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assign (resid 22 and name HD# ) (resid 23 and name HN ) 4.0 2.2 3.5
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assign (resid 22 and name HD# ) (resid 24 and name HN ) 4.0 2.2 3.5
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assign (resid 22 and name HD# ) (resid 25 and name HG1#  ) 4.0 2.2 4.0
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assign (resid 22 and name HD# ) (resid 25 and name HG2# ) 2.6 0.8 1.9
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assign (resid 22 and name HD# ) (resid 25 and name HN ) 4.0 2.2 3.5
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assign (resid 22 and name HD# ) (resid 64 and name HD1# ) 4.0 2.2 4.0
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assign (resid 22 and name HD# ) (resid 64 and name HG2# ) 2.6 0.8 1.9
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assign (resid 25 and name HG1#  ) (resid 25 and name HG2# ) 2.6 0.8 1.4  !6.185e+04
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assign (resid 29 and name HB# ) (resid 27 and name HN ) 4.0 2.2 3.0  !1.789e+04
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assign (resid 29 and name HB# ) (resid 29 and name HN ) 2.6 0.8 0.9  !6.127e+05
assign (resid 29 and name HB# ) (resid 30 and name HN ) 4.0 2.2 3.0  !7.068e+04
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assign (resid 40 and name HA ) (resid 40 and name HD1# ) 3.2 1.4 1.3  !2.208e+04
assign (resid 40 and name HA ) (resid 40 and name HG2# ) 3.2 1.4 1.3  !2.994e+04
assign (resid 40 and name HB ) (resid 40 and name HD1# ) 2.6 0.8 0.9  !7.540e+04
assign (resid 40 and name HB ) (resid 40 and name HG2# ) 2.6 0.8 0.9  !1.378e+05
assign (resid 40 and name HD1# ) (resid 40 and name HN ) 4.0 2.2 3.0  !1.110e+05
assign (resid 40 and name HD1# ) (resid 41 and name HN ) 4.0 2.2 3.0  !5.283e+04
assign (resid 40 and name HD1# ) (resid 43 and name HN ) 4.0 2.2 3.0  !2.475e+04
assign (resid 40 and name HG11 ) (resid 40 and name HD1# ) 2.6 0.8 0.9  !6.093e+04
assign (resid 40 and name HG11 ) (resid 40 and name HG2# ) 2.6 0.8 0.9  !3.432e+04
assign (resid 40 and name HG12 ) (resid 40 and name HD1# ) 2.6 0.8 0.9  !3.671e+04
assign (resid 40 and name HG12 ) (resid 40 and name HG2# ) 4.0 2.2 3.0  !9.846e+03
assign (resid 40 and name HG2# ) (resid 40 and name HN ) 3.2 1.4 1.3  !2.214e+05
assign (resid 40 and name HG2# ) (resid 41 and name HN ) 3.2 1.4 1.3  !1.822e+05
assign (resid 40 and name HG2# ) (resid 42 and name HN ) 4.0 2.2 3.0  !4.185e+04
assign (resid 40 and name HG2# ) (resid 43 and name HN ) 4.0 2.2 3.0  !4.158e+04
assign (resid 41 and name HA ) (resid 40 and name HG2# ) 3.2 1.4 1.3  !1.793e+04
assign (resid 41 and name HA ) (resid 41 and name HD# ) 4.0 2.2 3.0  !1.345e+04
assign (resid 41 and name HB# ) (resid 41 and name HD# ) 2.6 0.8 1.4  !6.505e+04
assign (resid 41 and name HB# ) (resid 41 and name HN ) 2.6 0.8 0.9  !7.680e+05
assign (resid 41 and name HB# ) (resid 42 and name HN ) 3.2 1.4 1.3  !2.768e+05
assign (resid 41 and name HD# ) (resid 41 and name HG2 ) 2.6 0.8 0.9  !6.163e+04
assign (resid 41 and name HD# ) (resid 41 and name HN ) 4.0 2.2 3.0  !8.892e+04
assign (resid 41 and name HD# ) (resid 42 and name HN ) 4.0 2.2 3.0  !3.332e+04
assign (resid 41 and name HE# ) (resid 41 and name HB# ) 4.0 2.2 3.5  !8.207e+03
assign (resid 42 and name HA ) (resid 45 and name HG2# ) 4.0 2.2 3.0  !6.711e+03
assign (resid 42 and name HB# ) (resid 42 and name HN ) 3.2 1.4 1.3  !1.883e+05
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assign (resid 42 and name HG# ) (resid 41 and name HN ) 4.0 2.2 3.0  !3.832e+04
assign (resid 43 and name HA ) (resid 44 and name HA# ) 4.0 2.2 3.0  !2.954e+03
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assign (resid 44 and name HA# ) (resid 45 and name HN ) 2.6 0.8 0.9  !3.092e+05
assign (resid 45 and name HA ) (resid 45 and name HG2# ) 2.6 0.8 0.9  !3.440e+04
assign (resid 45 and name HB ) (resid 42 and name HB# ) 4.0 2.2 3.0  !8.275e+03
assign (resid 45 and name HB ) (resid 45 and name HG2# ) 2.6 0.8 0.9  !4.861e+04
assign (resid 45 and name HG2# ) (resid 45 and name HN ) 3.2 1.4 1.3  !1.712e+05
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assign (resid 45 and name HG2# ) (resid 47 and name HN ) 3.2 1.4 1.3  !1.823e+05
assign (resid 45 and name HG2# ) (resid 66 and name HD# ) 3.2 1.4 1.8  !2.132e+04
assign (resid 46 and name HA ) (resid 45 and name HG2# ) 4.0 2.2 3.0  !3.145e+03
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assign (resid 46 and name HA ) (resid 49 and name HD1# ) 4.0 2.2 3.0  !1.581e+03
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assign (resid 47 and name HG# ) (resid 47 and name HB1 ) 2.6 0.8 0.9  !4.750e+04
assign (resid 47 and name HG# ) (resid 47 and name HB2 ) 2.6 0.8 0.9  !4.077e+04
assign (resid 47 and name HG# ) (resid 47 and name HN ) 4.0 2.2 3.0  !9.735e+04
assign (resid 47 and name HG# ) (resid 48 and name HN ) 4.0 2.2 3.0  !1.070e+05
assign (resid 47 and name HG# ) (resid 66 and name HD# ) 2.6 0.8 1.4  !3.610e+04
assign (resid 49 and name HA ) (resid 49 and name HD1# ) 3.2 1.4 1.3  !2.948e+04
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assign (resid 49 and name HB1 ) (resid 49 and name HD1# ) 2.6 0.8 0.9  !6.407e+04
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assign (resid 49 and name HD1# ) (resid 48 and name HN ) 4.0 2.2 3.0  !6.660e+04
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assign (resid 49 and name HD2# ) (resid 48 and name HN ) 4.0 2.2 3.0  !3.511e+04
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assign (resid 49 and name HD2# ) (resid 50 and name HN ) 4.0 2.2 3.0  !2.796e+04
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assign (resid 58 and name HA ) (resid 58 and name HG1#  ) 2.6 0.8 0.9  !5.492e+04
assign (resid 58 and name HA ) (resid 58 and name HG2# ) 2.6 0.8 0.9  !6.818e+04
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assign (resid 58 and name HG#  ) (resid 52 and name HD21 ) 4.0 2.2 3.5
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assign (resid 58 and name HG#  ) (resid 52 and name HD22 ) 4.0 2.2 3.5
assign (resid 58 and name HG1#  ) (resid 57 and name HD2 ) 4.0 2.2 3.0  !8.836e+03
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assign (resid 58 and name HG1#  ) (resid 59 and name HN ) 2.6 0.8 0.9  !3.167e+05
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assign (resid 62 and name HD2# ) (resid 60 and name HD21 ) 3.2 1.4 1.3 
assign (resid 62 and name HD2# ) (resid 60 and name HD22 ) 3.2 1.4 1.3
assign (resid 62 and name HD2# ) (resid 60 and name HN ) 4.0 2.2 3.0  !1.344e+05
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assign (resid 62 and name HG ) (resid 62 and name HD1# ) 2.6 0.8 0.9  !5.633e+04
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assign (resid 64 and name HG2# ) (resid 12 and name HE# ) 4.0 2.2 3.5  !1.094e+04
assign (resid 64 and name HG2# ) (resid 12 and name HZ ) 4.0 2.2 3.0  !6.389e+03
assign (resid 64 and name HG2# ) (resid 25 and name HG1#  ) 4.0 2.2 3.5  !9.093e+03
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assign (resid 66 and name HB2 ) (resid 66 and name HD# ) 2.6 0.8 0.9  !3.902e+04
assign (resid 66 and name HB1 ) (resid 47 and name HB# ) 4.0 2.2 3.0  !5.218e+03
assign (resid 66 and name HB1 ) (resid 66 and name HD# ) 2.6 0.8 0.9  !3.938e+04
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assign (resid 66 and name HD# ) (resid 66 and name HN ) 3.2 1.4 1.3  !2.721e+05
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assign (resid 67 and name HG1 ) (resid 69 and name HD2# ) 4.0 2.2 3.0  !7.738e+03
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assign (resid 75 and name HG# ) (resid 75 and name HE21 ) 4.0 2.2 3.0  !6.974e+04
assign (resid 75 and name HG# ) (resid 75 and name HE22 ) 4.0 2.2 3.0  !3.793e+04
assign (resid 75 and name HG# ) (resid 75 and name HN ) 3.2 1.4 1.3  !2.103e+05
assign (resid 75 and name HG# ) (resid 76 and name HN ) 4.0 2.2 3.0  !9.471e+04
assign (resid 76 and name HA ) (resid 76 and name HD1# ) 2.6 0.8 0.9  !4.708e+04
assign (resid 76 and name HA ) (resid 76 and name HD2# ) 4.0 2.2 3.0  !1.273e+04
!assign (resid 76 and name HA ) (resid 77 and name HG#  ) 4.0 2.2 3.0  !1.681e+04
assign (resid 76 and name HA ) (resid 77 and name HG#  ) 4.0 2.2 3.5
assign (resid 76 and name HB1 ) (resid 76 and name HD1# ) 3.2 1.4 1.3  !2.445e+04
assign (resid 76 and name HB1 ) (resid 76 and name HD1# ) 3.2 1.4 1.3  !2.993e+04
assign (resid 76 and name HB1 ) (resid 76 and name HD2# ) 2.6 0.8 0.9  !4.313e+04
assign (resid 76 and name HB2 ) (resid 76 and name HD2# ) 2.6 0.8 0.9  !3.738e+04
assign (resid 76 and name HD1# ) (resid 56 and name HN ) 4.0 2.2 3.0  !8.112e+03
assign (resid 76 and name HD1# ) (resid 68 and name HN ) 4.0 2.2 3.0  !8.394e+04
assign (resid 76 and name HD1# ) (resid 69 and name HN ) 4.0 2.2 3.0  !3.630e+04
assign (resid 76 and name HD1# ) (resid 70 and name HN ) 4.0 2.2 3.0  !3.819e+04
!assign (resid 76 and name HD1# ) (resid 74 and name HD# ) 4.0 2.2 3.5  !1.125e+03
assign (resid 76 and name HD1# ) (resid 76 and name HN ) 4.0 2.2 3.0  !1.213e+05
assign (resid 76 and name HD1# ) (resid 77 and name HN ) 4.0 2.2 3.0  !1.359e+05
assign (resid 76 and name HD1# ) (resid 78 and name HN ) 4.0 2.2 3.0  !1.271e+04
assign (resid 76 and name HD1# ) (resid 79 and name HN ) 4.0 2.2 3.0  !3.939e+04
assign (resid 76 and name HD1# ) (resid 80 and name HN ) 4.0 2.2 3.0  !1.017e+05
assign (resid 76 and name HD1# ) (resid 81 and name HN ) 4.0 2.2 3.0  !1.265e+05
assign (resid 76 and name HD1# ) (resid 82 and name HN ) 4.0 2.2 3.0  !4.951e+04
assign (resid 76 and name HD1# ) (resid 83 and name HN ) 4.0 2.2 3.0  !3.582e+04
assign (resid 76 and name HD2# ) (resid 68 and name HN ) 4.0 2.2 3.0  !5.931e+04
!assign (resid 76 and name HD2# ) (resid 74 and name HD# ) 4.0 2.2 3.5  !1.867e+03
assign (resid 76 and name HD2# ) (resid 76 and name HD1# ) 2.6 0.8 1.4  !7.874e+04
assign (resid 76 and name HD2# ) (resid 76 and name HN ) 3.2 1.4 1.3  !1.728e+05
assign (resid 76 and name HD2# ) (resid 77 and name HN ) 4.0 2.2 3.0  !5.185e+04
assign (resid 76 and name HD2# ) (resid 78 and name HN ) 4.0 2.2 3.0  !6.250e+04
assign (resid 76 and name HD2# ) (resid 79 and name HN ) 4.0 2.2 3.0  !1.029e+05
assign (resid 76 and name HD2# ) (resid 80 and name HN ) 4.0 2.2 3.0  !5.643e+04
assign (resid 76 and name HD2# ) (resid 81 and name HN ) 4.0 2.2 3.0  !4.767e+04
assign (resid 76 and name HD2# ) (resid 82 and name HN ) 4.0 2.2 3.0  !9.673e+03
assign (resid 76 and name HD2# ) (resid 83 and name HN ) 4.0 2.2 3.0  !1.000e+04
assign (resid 76 and name HG ) (resid 76 and name HD1# ) 2.6 0.8 0.9  !4.766e+04
assign (resid 76 and name HG ) (resid 76 and name HD2# ) 2.6 0.8 0.9  !4.289e+04
!assign (resid 77 and name HA ) (resid 77 and name HG#  ) 2.6 0.8 0.9  !7.438e+04
assign (resid 77 and name HA ) (resid 77 and name HG#  ) 2.6 0.8 1.4
assign (resid 77 and name HB ) (resid 76 and name HD1# ) 4.0 2.2 3.0  !3.626e+03
!assign (resid 77 and name HB ) (resid 77 and name HG#  ) 2.6 0.8 0.9  !1.290e+05
assign (resid 77 and name HB ) (resid 77 and name HG#  ) 2.6 0.8 1.4
!assign (resid 77 and name HG#  ) (resid 75 and name HE21 ) 4.0 2.2 3.0  !1.059e+04
assign (resid 77 and name HG#  ) (resid 75 and name HE21 ) 4.0 2.2 3.5
!assign (resid 77 and name HG#  ) (resid 75 and name HN ) 4.0 2.2 3.0  !1.992e+04
assign (resid 77 and name HG#  ) (resid 75 and name HN ) 4.0 2.2 3.5
!assign (resid 77 and name HG#  ) (resid 76 and name HD1# ) 4.0 2.2 3.5  !3.647e+03
assign (resid 77 and name HG#  ) (resid 76 and name HD1# ) 4.0 2.2 4.0
!assign (resid 77 and name HG#  ) (resid 76 and name HN ) 4.0 2.2 3.0  !5.288e+04
assign (resid 77 and name HG#  ) (resid 76 and name HN ) 4.0 2.2 3.5
!assign (resid 77 and name HG#  ) (resid 77 and name HN ) 3.2 1.4 1.3  !2.379e+05
assign (resid 77 and name HG#  ) (resid 77 and name HN ) 3.2 1.4 1.8
!assign (resid 77 and name HG#  ) (resid 78 and name HN ) 2.6 0.8 0.9  !3.695e+05
assign (resid 77 and name HG#  ) (resid 78 and name HN ) 2.6 0.8 1.4
!assign (resid 77 and name HG#  ) (resid 79 and name HN ) 4.0 2.2 3.0  !4.644e+04
assign (resid 77 and name HG#  ) (resid 79 and name HN ) 4.0 2.2 3.5
!assign (resid 77 and name HG#  ) (resid 80 and name HN ) 4.0 2.2 3.0  !3.215e+04
assign (resid 77 and name HG#  ) (resid 80 and name HN ) 4.0 2.2 3.5
!assign (resid 77 and name HG#  ) (resid 81 and name HN ) 4.0 2.2 3.0  !7.736e+04
assign (resid 77 and name HG#  ) (resid 81 and name HN ) 4.0 2.2 3.5
!assign (resid 77 and name HG#  ) (resid 82 and name HN ) 4.0 2.2 3.0  !3.615e+04
assign (resid 77 and name HG#  ) (resid 82 and name HN ) 4.0 2.2 3.5
assign (resid 78 and name HA ) (resid 79 and name HG# ) 4.0 2.2 3.0  !1.060e+04
assign (resid 78 and name HB# ) (resid 77 and name HN ) 4.0 2.2 3.0  !1.194e+04
assign (resid 78 and name HB# ) (resid 78 and name HN ) 3.2 1.4 1.3  !2.544e+05
assign (resid 78 and name HB# ) (resid 79 and name HN ) 4.0 2.2 3.0  !1.030e+05
assign (resid 78 and name HB# ) (resid 80 and name HN ) 4.0 2.2 3.0  !1.099e+05
assign (resid 78 and name HB# ) (resid 81 and name HN ) 4.0 2.2 3.0  !7.436e+04
assign (resid 79 and name HA ) (resid 76 and name HD1# ) 4.0 2.2 3.0  !9.776e+03
assign (resid 79 and name HA ) (resid 76 and name HD2# ) 3.2 1.4 1.3  !2.890e+04
assign (resid 79 and name HA ) (resid 78 and name HB# ) 4.0 2.2 3.0  !1.933e+03
assign (resid 79 and name HA ) (resid 79 and name HG# ) 2.6 0.8 0.9  !3.830e+04
assign (resid 79 and name HG# ) (resid 78 and name HN ) 4.0 2.2 3.0  !2.471e+04
assign (resid 79 and name HG# ) (resid 79 and name HE21 ) 4.0 2.2 3.0  !4.069e+04
assign (resid 79 and name HG# ) (resid 79 and name HE22 ) 4.0 2.2 3.0  !1.898e+04
assign (resid 79 and name HG# ) (resid 79 and name HN ) 3.2 1.4 1.3  !2.554e+05
assign (resid 79 and name HG# ) (resid 80 and name HN ) 4.0 2.2 3.0  !5.312e+04
assign (resid 79 and name HG# ) (resid 81 and name HN ) 4.0 2.2 3.0  !1.855e+04
assign (resid 80 and name HA ) (resid 76 and name HD1# ) 4.0 2.2 3.0  !8.372e+03
!assign (resid 81 and name HA ) (resid 77 and name HG#  ) 4.0 2.2 3.0  !1.325e+03
assign (resid 81 and name HA ) (resid 77 and name HG#  ) 4.0 2.2 3.5
assign (resid 81 and name HA ) (resid 81 and name HD# ) 4.0 2.2 3.0  !4.270e+03
assign (resid 81 and name HA ) (resid 81 and name HG# ) 4.0 2.2 3.0  !8.601e+03
assign (resid 81 and name HB# ) (resid 56 and name HN ) 4.0 2.2 3.0  !3.071e+04
assign (resid 81 and name HB# ) (resid 77 and name HN ) 4.0 2.2 3.0  !3.050e+04
assign (resid 81 and name HB# ) (resid 80 and name HN ) 4.0 2.2 3.0  !1.043e+05
assign (resid 81 and name HB# ) (resid 81 and name HN ) 3.2 1.4 1.3  !2.522e+05
assign (resid 81 and name HB# ) (resid 82 and name HN ) 4.0 2.2 3.0  !1.442e+05
assign (resid 81 and name HD# ) (resid 56 and name HN ) 4.0 2.2 3.0  !2.275e+04
assign (resid 81 and name HD# ) (resid 81 and name HB# ) 2.6 0.8 1.4  !3.014e+04
assign (resid 81 and name HD# ) (resid 81 and name HN ) 4.0 2.2 3.0  !5.200e+04
assign (resid 81 and name HD# ) (resid 82 and name HN ) 4.0 2.2 3.0  !5.299e+04
assign (resid 81 and name HG# ) (resid 56 and name HN ) 4.0 2.2 3.0  !1.986e+04
assign (resid 81 and name HG# ) (resid 80 and name HN ) 4.0 2.2 3.0  !9.141e+04
assign (resid 81 and name HG# ) (resid 81 and name HN ) 4.0 2.2 3.0  !1.648e+05
assign (resid 81 and name HG# ) (resid 82 and name HN ) 4.0 2.2 3.0  !1.246e+05
assign (resid 82 and name HA ) (resid 76 and name HD1# ) 4.0 2.2 3.0  !7.503e+03
!assign (resid 82 and name HA ) (resid 77 and name HG#  ) 4.0 2.2 3.0  !6.836e+03
assign (resid 82 and name HA ) (resid 77 and name HG#  ) 4.0 2.2 3.5
assign (resid 82 and name HB1 ) (resid 74 and name HE# ) 4.0 2.2 3.0  !6.956e+03
assign (resid 82 and name HB2 ) (resid 74 and name HE# ) 4.0 2.2 3.0  !4.595e+03
assign (resid 83 and name HA ) (resid 74 and name HD# ) 3.2 1.4 1.3  !2.955e+04
assign (resid 83 and name HA ) (resid 74 and name HE# ) 4.0 2.2 3.0  !1.180e+04
assign (resid 83 and name HA ) (resid 83 and name HG# ) 4.0 2.2 3.0  !1.532e+04
!assign (resid 83 and name HB1 ) (resid 77 and name HG#  ) 3.2 1.4 1.3  !2.254e+04
assign (resid 83 and name HB1 ) (resid 77 and name HG#  ) 3.2 1.4 1.8
assign (resid 83 and name HB1 ) (resid 83 and name HG# ) 2.6 0.8 0.9  !3.260e+04
!assign (resid 83 and name HB2 ) (resid 77 and name HG#  ) 2.6 0.8 0.9  !3.580e+04
assign (resid 83 and name HB2 ) (resid 77 and name HG#  ) 2.6 0.8 1.4
assign (resid 83 and name HB2 ) (resid 83 and name HG# ) 2.6 0.8 0.9  !2.020e+05
assign (resid 83 and name HG# ) (resid 83 and name HN ) 3.2 1.4 1.3  !1.832e+05

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