CPPTRAJ: Trajectory Analysis. V16.00b ___ ___ ___ ___ | \/ | \/ | \/ | _|_/\_|_/\_|_/\_|_ | Date/time: 06/20/16 18:17:55 | Available memory: 3.069 GB INPUT: Reading input from 'pt-analysis.bb.in' [parm ../../aa/tip3p/ff12sb/run1/build/noWAt.topo.hmr [apa]] Reading '../../aa/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../ag/tip3p/ff12sb/run1/build/noWAt.topo.hmr [apg]] Reading '../../ag/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../ga/tip3p/ff12sb/run1/build/noWAt.topo.hmr [gpa]] Reading '../../ga/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../gg/tip3p/ff12sb/run1/build/noWAt.topo.hmr [gpg]] Reading '../../gg/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../ac/tip3p/ff12sb/run1/build/noWAt.topo.hmr [apc]] Reading '../../ac/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../au/tip3p/ff12sb/run1/build/noWAt.topo.hmr [apu]] Reading '../../au/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../gc/tip3p/ff12sb/run1/build/noWAt.topo.hmr [gpc]] Reading '../../gc/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../gu/tip3p/ff12sb/run1/build/noWAt.topo.hmr [gpu]] Reading '../../gu/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../ca/tip3p/ff12sb/run1/build/noWAt.topo.hmr [cpa]] Reading '../../ca/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../cg/tip3p/ff12sb/run1/build/noWAt.topo.hmr [cpg]] Reading '../../cg/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../ua/tip3p/ff12sb/run1/build/noWAt.topo.hmr [upa]] Reading '../../ua/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../ug/tip3p/ff12sb/run1/build/noWAt.topo.hmr [upg]] Reading '../../ug/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../cc/tip3p/ff12sb/run1/build/noWAt.topo.hmr [cpc]] Reading '../../cc/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../cu/tip3p/ff12sb/run1/build/noWAt.topo.hmr [cpu]] Reading '../../cu/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../uc/tip3p/ff12sb/run1/build/noWAt.topo.hmr [upc]] Reading '../../uc/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [parm ../../uu/tip3p/ff12sb/run1/build/noWAt.topo.hmr [upu]] Reading '../../uu/tip3p/ff12sb/run1/build/noWAt.topo.hmr' as Amber Topology [trajin ../../aa/cluster-all/km-7/ctraj.c0 parm [apa]] Reading '../../aa/cluster-all/km-7/ctraj.c0' as Amber NetCDF [trajin ../../ag/cluster-all/km-6/ctraj.c1 parm [apg]] Reading '../../ag/cluster-all/km-6/ctraj.c1' as Amber NetCDF [trajin ../../ga/cluster-1-1/km-5/ctraj.c2 parm [gpa]] Reading '../../ga/cluster-1-1/km-5/ctraj.c2' as Amber NetCDF [trajin ../../gg/cluster-all/km-6/ctraj.c2 parm [gpg]] Reading '../../gg/cluster-all/km-6/ctraj.c2' as Amber NetCDF [trajin ../../ac/cluster-all/km-7/ctraj.c2 parm [apc]] Reading '../../ac/cluster-all/km-7/ctraj.c2' as Amber NetCDF [trajin ../../au/cluster-1-1/km-5/ctraj.c2 parm [apu]] Reading '../../au/cluster-1-1/km-5/ctraj.c2' as Amber NetCDF [trajin ../../gc/cluster-1-1/km-6-bbC2/ctraj.c2 parm [gpc]] Reading '../../gc/cluster-1-1/km-6-bbC2/ctraj.c2' as Amber NetCDF [trajin ../../gu/cluster-1-1/km-6/ctraj.c1 parm [gpu]] Reading '../../gu/cluster-1-1/km-6/ctraj.c1' as Amber NetCDF [trajin ../../ca/cluster-all/km-6/ctraj.c0 parm [cpa]] Reading '../../ca/cluster-all/km-6/ctraj.c0' as Amber NetCDF [trajin ../../cg/cluster-1-1/km-6-bbC2/ctraj.c1 parm [cpg]] Reading '../../cg/cluster-1-1/km-6-bbC2/ctraj.c1' as Amber NetCDF [trajin ../../ua/cluster-1-1/km-7/ctraj.c2 parm [upa]] Reading '../../ua/cluster-1-1/km-7/ctraj.c2' as Amber NetCDF [trajin ../../ug/cluster-1-1/km-6/ctraj.c2 parm [upg]] Reading '../../ug/cluster-1-1/km-6/ctraj.c2' as Amber NetCDF [trajin ../../cc/cluster-all/km-5/ctraj.c1 parm [cpc]] Reading '../../cc/cluster-all/km-5/ctraj.c1' as Amber NetCDF [trajin ../../cu/cluster-1-1/km-5-bbC2/ctraj.c1 parm [cpu]] Reading '../../cu/cluster-1-1/km-5-bbC2/ctraj.c1' as Amber NetCDF [trajin ../../uc/cluster-1-1/km-5/ctraj.c0 parm [upc]] Reading '../../uc/cluster-1-1/km-5/ctraj.c0' as Amber NetCDF [trajin ../../uu/cluster-all/km-5/ctraj.c0 parm [upu]] Reading '../../uu/cluster-all/km-5/ctraj.c0' as Amber NetCDF [distance dist1 :1@HO2' :2@O5'] DISTANCE: :1@HO2' to :2@O5', center of mass. [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] DIHEDRAL: [:1@C5']-[:1@C4']-[:1@C3']-[:1@O3'] Output range is -180 to 180 degrees. [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] DIHEDRAL: [:2@C5']-[:2@C4']-[:2@C3']-[:2@O3'] Output range is -180 to 180 degrees. [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] DIHEDRAL: [:1@C4']-[:1@C3']-[:1@O3']-[:2@P] Output range is -180 to 180 degrees. [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] DIHEDRAL: [:1@C3']-[:1@O3']-[:2@P]-[:2@O5'] Output range is -180 to 180 degrees. [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] DIHEDRAL: [:1@O3']-[:2@P]-[:2@O5']-[:2@C5'] Output range is -180 to 180 degrees. [run] ---------- RUN BEGIN ------------------------------------------------- PARAMETER FILES (16 total): 0: [apa] noWAt.topo.hmr, 65 atoms, 2 res, box: Orthogonal, 1 mol 1: [apg] noWAt.topo.hmr, 66 atoms, 2 res, box: Orthogonal, 1 mol 2: [gpa] noWAt.topo.hmr, 66 atoms, 2 res, box: Orthogonal, 1 mol 3: [gpg] noWAt.topo.hmr, 67 atoms, 2 res, box: Orthogonal, 1 mol 4: [apc] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 5: [apu] noWAt.topo.hmr, 62 atoms, 2 res, box: Orthogonal, 1 mol 6: [gpc] noWAt.topo.hmr, 64 atoms, 2 res, box: Orthogonal, 1 mol 7: [gpu] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 8: [cpa] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 9: [cpg] noWAt.topo.hmr, 64 atoms, 2 res, box: Orthogonal, 1 mol 10: [upa] noWAt.topo.hmr, 62 atoms, 2 res, box: Orthogonal, 1 mol 11: [upg] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 12: [cpc] noWAt.topo.hmr, 61 atoms, 2 res, box: Orthogonal, 1 mol 13: [cpu] noWAt.topo.hmr, 60 atoms, 2 res, box: Orthogonal, 1 mol 14: [upc] noWAt.topo.hmr, 60 atoms, 2 res, box: Orthogonal, 1 mol 15: [upu] noWAt.topo.hmr, 59 atoms, 2 res, box: Orthogonal, 1 mol INPUT TRAJECTORIES (16 total): 0: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 174638 of 174638) 1: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 106435 of 106435) 2: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 23764 of 23764) 3: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 105190 of 105190) 4: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 85717 of 85717) 5: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 17514 of 17514) 6: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 17259 of 17259) 7: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 17391 of 17391) 8: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 172040 of 172040) 9: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 21662 of 21662) 10: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 13501 of 13501) 11: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 18784 of 18784) 12: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 134387 of 134387) 13: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 18571 of 18571) 14: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 36137 of 36137) 15: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 225909 of 225909) Coordinate processing will occur on 1188899 frames. BEGIN TRAJECTORY PROCESSING: ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c0 (1-174638, 1) ----- 0% 10% ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c1 (1-106435, 1) ----- 20% ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c2 (1-23764, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c2 (1-105190, 1) ----- 30% ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c2 (1-85717, 1) ----- 40% ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c2 (1-17514, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c2 (1-17259, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c1 (1-17391, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c0 (1-172040, 1) ----- 50% 60% ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c1 (1-21662, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c2 (1-13501, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c2 (1-18784, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c1 (1-134387, 1) ----- 70% ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c1 (1-18571, 1) ----- ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c0 (1-36137, 1) ----- 80% ..................................................... ACTION SETUP FOR PARM 'noWAt.topo.hmr' (6 actions): 0: [distance dist1 :1@HO2' :2@O5'] :1@HO2' (1 atoms) to :2@O5' (1 atoms), imaged. 1: [dihedral d1 :1@C5' :1@C4' :1@C3' :1@O3' type delta] [:1@C5'](1) [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) 2: [dihedral d2 :2@C5' :2@C4' :2@C3' :2@O3' type delta] [:2@C5'](1) [:2@C4'](1) [:2@C3'](1) [:2@O3'](1) 3: [dihedral e1 :1@C4' :1@C3' :1@O3' :2@P type epsilon] [:1@C4'](1) [:1@C3'](1) [:1@O3'](1) [:2@P](1) 4: [dihedral z1 :1@C3' :1@O3' :2@P :2@O5' type zeta] [:1@C3'](1) [:1@O3'](1) [:2@P](1) [:2@O5'](1) 5: [dihedral a2 :1@O3' :2@P :2@O5' :2@C5' type alpha] [:1@O3'](1) [:2@P](1) [:2@O5'](1) [:2@C5'](1) ----- ctraj.c0 (1-225909, 1) ----- 90% 100% Complete. Read 1188899 frames and processed 1188899 frames. TIME: Avg. throughput= 510657.7177 frames / second. ACTION OUTPUT: DATASETS (6 total): dist1 "dist1" (double, distance), size is 1188899 d1 "d1" (double, torsion(delta)), size is 1188899 d2 "d2" (double, torsion(delta)), size is 1188899 e1 "e1" (double, torsion(epsilon)), size is 1188899 z1 "z1" (double, torsion(zeta)), size is 1188899 a2 "a2" (double, torsion(alpha)), size is 1188899 RUN TIMING: TIME: Init : 0.0019 s ( 0.08%) TIME: Trajectory Process : 2.3282 s ( 99.92%) TIME: Action Post : 0.0000 s ( 0.00%) TIME: Analysis : 0.0000 s ( 0.00%) TIME: Data File Write : 0.0000 s ( 0.00%) TIME: Other : 0.0000 s ( 0.00%) TIME: Run Total 2.3301 s ---------- RUN END --------------------------------------------------- [hist e1,-180,180,0.5 dist1,0,6,0.01 out 2dhist_e1_dist1.gnu norm] Hist: 2dhist_e1_dist1.gnu: Set up for 2 dimensions using the following datasets: [ e1 dist1 ] norm: Sum over bins will be normalized to 1.0. [hist z1,-180,180,0.5 a2,-180,180,0.5 out 2dhist_z1_a2.gnu norm] Hist: 2dhist_z1_a2.gnu: Set up for 2 dimensions using the following datasets: [ z1 a2 ] norm: Sum over bins will be normalized to 1.0. ---------- RUN BEGIN ------------------------------------------------- PARAMETER FILES (16 total): 0: [apa] noWAt.topo.hmr, 65 atoms, 2 res, box: Orthogonal, 1 mol 1: [apg] noWAt.topo.hmr, 66 atoms, 2 res, box: Orthogonal, 1 mol 2: [gpa] noWAt.topo.hmr, 66 atoms, 2 res, box: Orthogonal, 1 mol 3: [gpg] noWAt.topo.hmr, 67 atoms, 2 res, box: Orthogonal, 1 mol 4: [apc] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 5: [apu] noWAt.topo.hmr, 62 atoms, 2 res, box: Orthogonal, 1 mol 6: [gpc] noWAt.topo.hmr, 64 atoms, 2 res, box: Orthogonal, 1 mol 7: [gpu] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 8: [cpa] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 9: [cpg] noWAt.topo.hmr, 64 atoms, 2 res, box: Orthogonal, 1 mol 10: [upa] noWAt.topo.hmr, 62 atoms, 2 res, box: Orthogonal, 1 mol 11: [upg] noWAt.topo.hmr, 63 atoms, 2 res, box: Orthogonal, 1 mol 12: [cpc] noWAt.topo.hmr, 61 atoms, 2 res, box: Orthogonal, 1 mol 13: [cpu] noWAt.topo.hmr, 60 atoms, 2 res, box: Orthogonal, 1 mol 14: [upc] noWAt.topo.hmr, 60 atoms, 2 res, box: Orthogonal, 1 mol 15: [upu] noWAt.topo.hmr, 59 atoms, 2 res, box: Orthogonal, 1 mol INPUT TRAJECTORIES (16 total): 0: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 174638 of 174638) 1: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 106435 of 106435) 2: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 23764 of 23764) 3: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 105190 of 105190) 4: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 85717 of 85717) 5: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 17514 of 17514) 6: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 17259 of 17259) 7: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 17391 of 17391) 8: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 172040 of 172040) 9: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 21662 of 21662) 10: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 13501 of 13501) 11: 'ctraj.c2' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 18784 of 18784) 12: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 134387 of 134387) 13: 'ctraj.c1' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 18571 of 18571) 14: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 36137 of 36137) 15: 'ctraj.c0' is a NetCDF AMBER trajectory, Parm noWAt.topo.hmr (Orthogonal box) (reading 225909 of 225909) Coordinate processing will occur on 1188899 frames. BEGIN TRAJECTORY PROCESSING: ----- ctraj.c0 (1-174638, 1) ----- 0% 10% ----- ctraj.c1 (1-106435, 1) ----- 20% ----- ctraj.c2 (1-23764, 1) ----- ----- ctraj.c2 (1-105190, 1) ----- 30% ----- ctraj.c2 (1-85717, 1) ----- 40% ----- ctraj.c2 (1-17514, 1) ----- ----- ctraj.c2 (1-17259, 1) ----- ----- ctraj.c1 (1-17391, 1) ----- ----- ctraj.c0 (1-172040, 1) ----- 50% 60% ----- ctraj.c1 (1-21662, 1) ----- ----- ctraj.c2 (1-13501, 1) ----- ----- ctraj.c2 (1-18784, 1) ----- ----- ctraj.c1 (1-134387, 1) ----- 70% ----- ctraj.c1 (1-18571, 1) ----- ----- ctraj.c0 (1-36137, 1) ----- 80% ----- ctraj.c0 (1-225909, 1) ----- 90% 100% Complete. Read 1188899 frames and processed 1188899 frames. TIME: Avg. throughput= 1000036.1692 frames / second. ACTION OUTPUT: ANALYSIS: Performing 2 analyses: 0: [hist e1,-180,180,0.5 dist1,0,6,0.01 out 2dhist_e1_dist1.gnu norm] Calculating bins from min=-180 max=180 step=0.5. Dim e1: -180.000000->180.000000, step 0.500000, 720 bins. Calculating bins from min=0 max=6 step=0.01. Dim dist1: 0.000000->6.000000, step 0.010000, 600 bins. Hist: 1188899 data points in each dimension. Hist: Allocating histogram, total bins = 432000 Warning: Frame 30640 Coordinates out of bounds (-1) Warning: Frame 67380 Coordinates out of bounds (-1) Warning: Frame 77026 Coordinates out of bounds (-1) Warning: Frame 78186 Coordinates out of bounds (-1) Warning: Frame 78298 Coordinates out of bounds (-1) Warning: Frame 78765 Coordinates out of bounds (-1) Warning: Frame 79539 Coordinates out of bounds (-1) Warning: Frame 79672 Coordinates out of bounds (-1) Warning: Frame 80240 Coordinates out of bounds (-1) Warning: Frame 81773 Coordinates out of bounds (-1) Warning: Frame 82820 Coordinates out of bounds (-1) Warning: Frame 84906 Coordinates out of bounds (-1) Warning: Frame 85098 Coordinates out of bounds (-1) Warning: Frame 86276 Coordinates out of bounds (-1) Warning: Frame 88979 Coordinates out of bounds (-1) Warning: Frame 91576 Coordinates out of bounds (-1) Warning: Frame 93862 Coordinates out of bounds (-1) Warning: Frame 94411 Coordinates out of bounds (-1) Warning: Frame 95547 Coordinates out of bounds (-1) Warning: Frame 95644 Coordinates out of bounds (-1) Warning: Frame 96425 Coordinates out of bounds (-1) Warning: Frame 96428 Coordinates out of bounds (-1) Warning: Frame 97171 Coordinates out of bounds (-1) Warning: Frame 98774 Coordinates out of bounds (-1) Warning: Frame 127906 Coordinates out of bounds (-1) Warning: Frame 148266 Coordinates out of bounds (-1) Warning: Frame 148267 Coordinates out of bounds (-1) Warning: Frame 160865 Coordinates out of bounds (-1) Warning: Frame 163217 Coordinates out of bounds (-1) Warning: Frame 182703 Coordinates out of bounds (-1) Warning: Frame 195692 Coordinates out of bounds (-1) Warning: Frame 199213 Coordinates out of bounds (-1) Warning: Frame 203643 Coordinates out of bounds (-1) Warning: Frame 219030 Coordinates out of bounds (-1) Warning: Frame 223732 Coordinates out of bounds (-1) Warning: Frame 242161 Coordinates out of bounds (-1) Warning: Frame 245350 Coordinates out of bounds (-1) Warning: Frame 263419 Coordinates out of bounds (-1) Warning: Frame 263944 Coordinates out of bounds (-1) Warning: Frame 274501 Coordinates out of bounds (-1) Warning: Frame 281075 Coordinates out of bounds (-1) Warning: Frame 281084 Coordinates out of bounds (-1) Warning: Frame 281093 Coordinates out of bounds (-1) Warning: Frame 281095 Coordinates out of bounds (-1) Warning: Frame 281097 Coordinates out of bounds (-1) Warning: Frame 281127 Coordinates out of bounds (-1) Warning: Frame 282167 Coordinates out of bounds (-1) Warning: Frame 282291 Coordinates out of bounds (-1) Warning: Frame 282981 Coordinates out of bounds (-1) Warning: Frame 284129 Coordinates out of bounds (-1) Warning: Frame 284150 Coordinates out of bounds (-1) Warning: Frame 285063 Coordinates out of bounds (-1) Warning: Frame 285101 Coordinates out of bounds (-1) Warning: Frame 285545 Coordinates out of bounds (-1) Warning: Frame 285546 Coordinates out of bounds (-1) Warning: Frame 285555 Coordinates out of bounds (-1) Warning: Frame 286017 Coordinates out of bounds (-1) Warning: Frame 286451 Coordinates out of bounds (-1) Warning: Frame 289562 Coordinates out of bounds (-1) Warning: Frame 289596 Coordinates out of bounds (-1) Warning: Frame 289620 Coordinates out of bounds (-1) Warning: Frame 291551 Coordinates out of bounds (-1) Warning: Frame 292513 Coordinates out of bounds (-1) Warning: Frame 292658 Coordinates out of bounds (-1) Warning: Frame 293519 Coordinates out of bounds (-1) Warning: Frame 293782 Coordinates out of bounds (-1) Warning: Frame 293793 Coordinates out of bounds (-1) Warning: Frame 294707 Coordinates out of bounds (-1) Warning: Frame 295382 Coordinates out of bounds (-1) Warning: Frame 296167 Coordinates out of bounds (-1) Warning: Frame 296346 Coordinates out of bounds (-1) Warning: Frame 296382 Coordinates out of bounds (-1) Warning: Frame 297187 Coordinates out of bounds (-1) Warning: Frame 297378 Coordinates out of bounds (-1) Warning: Frame 297505 Coordinates out of bounds (-1) Warning: Frame 297846 Coordinates out of bounds (-1) Warning: Frame 298338 Coordinates out of bounds (-1) Warning: Frame 298577 Coordinates out of bounds (-1) Warning: Frame 298580 Coordinates out of bounds (-1) Warning: Frame 299574 Coordinates out of bounds (-1) Warning: Frame 299824 Coordinates out of bounds (-1) Warning: Frame 302886 Coordinates out of bounds (-1) Warning: Frame 302890 Coordinates out of bounds (-1) Warning: Frame 304840 Coordinates out of bounds (-1) Warning: Frame 304851 Coordinates out of bounds (-1) Warning: Frame 304929 Coordinates out of bounds (-1) Warning: Frame 306686 Coordinates out of bounds (-1) Warning: Frame 306712 Coordinates out of bounds (-1) Warning: Frame 306792 Coordinates out of bounds (-1) Warning: Frame 306895 Coordinates out of bounds (-1) Warning: Frame 308417 Coordinates out of bounds (-1) Warning: Frame 308620 Coordinates out of bounds (-1) Warning: Frame 308622 Coordinates out of bounds (-1) Warning: Frame 308679 Coordinates out of bounds (-1) Warning: Frame 308974 Coordinates out of bounds (-1) Warning: Frame 309255 Coordinates out of bounds (-1) Warning: Frame 311411 Coordinates out of bounds (-1) Warning: Frame 311412 Coordinates out of bounds (-1) Warning: Frame 311912 Coordinates out of bounds (-1) Warning: Frame 311929 Coordinates out of bounds (-1) Warning: Frame 311931 Coordinates out of bounds (-1) Warning: Frame 312441 Coordinates out of bounds (-1) Warning: Frame 313002 Coordinates out of bounds (-1) Warning: Frame 313008 Coordinates out of bounds (-1) Warning: Frame 313054 Coordinates out of bounds (-1) Warning: Frame 313323 Coordinates out of bounds (-1) Warning: Frame 314141 Coordinates out of bounds (-1) Warning: Frame 314266 Coordinates out of bounds (-1) Warning: Frame 314431 Coordinates out of bounds (-1) Warning: Frame 314475 Coordinates out of bounds (-1) Warning: Frame 315671 Coordinates out of bounds (-1) Warning: Frame 315737 Coordinates out of bounds (-1) Warning: Frame 316989 Coordinates out of bounds (-1) Warning: Frame 318098 Coordinates out of bounds (-1) Warning: Frame 318130 Coordinates out of bounds (-1) Warning: Frame 318243 Coordinates out of bounds (-1) Warning: Frame 318244 Coordinates out of bounds (-1) Warning: Frame 318245 Coordinates out of bounds (-1) Warning: Frame 319576 Coordinates out of bounds (-1) Warning: Frame 319601 Coordinates out of bounds (-1) Warning: Frame 320366 Coordinates out of bounds (-1) Warning: Frame 320528 Coordinates out of bounds (-1) Warning: Frame 320566 Coordinates out of bounds (-1) Warning: Frame 320567 Coordinates out of bounds (-1) Warning: Frame 320581 Coordinates out of bounds (-1) Warning: Frame 320624 Coordinates out of bounds (-1) Warning: Frame 320995 Coordinates out of bounds (-1) Warning: Frame 321014 Coordinates out of bounds (-1) Warning: Frame 321030 Coordinates out of bounds (-1) Warning: Frame 321591 Coordinates out of bounds (-1) Warning: Frame 322367 Coordinates out of bounds (-1) Warning: Frame 322369 Coordinates out of bounds (-1) Warning: Frame 322548 Coordinates out of bounds (-1) Warning: Frame 322592 Coordinates out of bounds (-1) Warning: Frame 323004 Coordinates out of bounds (-1) Warning: Frame 323020 Coordinates out of bounds (-1) Warning: Frame 323028 Coordinates out of bounds (-1) Warning: Frame 323099 Coordinates out of bounds (-1) Warning: Frame 323101 Coordinates out of bounds (-1) Warning: Frame 323122 Coordinates out of bounds (-1) Warning: Frame 323128 Coordinates out of bounds (-1) Warning: Frame 323132 Coordinates out of bounds (-1) Warning: Frame 323142 Coordinates out of bounds (-1) Warning: Frame 324587 Coordinates out of bounds (-1) Warning: Frame 325229 Coordinates out of bounds (-1) Warning: Frame 326884 Coordinates out of bounds (-1) Warning: Frame 326896 Coordinates out of bounds (-1) Warning: Frame 326904 Coordinates out of bounds (-1) Warning: Frame 327425 Coordinates out of bounds (-1) Warning: Frame 331506 Coordinates out of bounds (-1) Warning: Frame 332233 Coordinates out of bounds (-1) Warning: Frame 332239 Coordinates out of bounds (-1) Warning: Frame 332879 Coordinates out of bounds (-1) Warning: Frame 332909 Coordinates out of bounds (-1) Warning: Frame 332918 Coordinates out of bounds (-1) Warning: Frame 332922 Coordinates out of bounds (-1) Warning: Frame 332930 Coordinates out of bounds (-1) Warning: Frame 333455 Coordinates out of bounds (-1) Warning: Frame 334488 Coordinates out of bounds (-1) Warning: Frame 334494 Coordinates out of bounds (-1) Warning: Frame 334704 Coordinates out of bounds (-1) Warning: Frame 334920 Coordinates out of bounds (-1) Warning: Frame 337465 Coordinates out of bounds (-1) Warning: Frame 337477 Coordinates out of bounds (-1) Warning: Frame 337478 Coordinates out of bounds (-1) Warning: Frame 337619 Coordinates out of bounds (-1) Warning: Frame 337773 Coordinates out of bounds (-1) Warning: Frame 337774 Coordinates out of bounds (-1) Warning: Frame 337775 Coordinates out of bounds (-1) Warning: 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bounds (-1) Warning: Frame 344703 Coordinates out of bounds (-1) Warning: Frame 344707 Coordinates out of bounds (-1) Warning: Frame 345089 Coordinates out of bounds (-1) Warning: Frame 345129 Coordinates out of bounds (-1) Warning: Frame 345175 Coordinates out of bounds (-1) Warning: Frame 345176 Coordinates out of bounds (-1) Warning: Frame 345177 Coordinates out of bounds (-1) Warning: Frame 345179 Coordinates out of bounds (-1) Warning: Frame 345559 Coordinates out of bounds (-1) Warning: Frame 346149 Coordinates out of bounds (-1) Warning: Frame 346452 Coordinates out of bounds (-1) Warning: Frame 346547 Coordinates out of bounds (-1) Warning: Frame 346666 Coordinates out of bounds (-1) Warning: Frame 346822 Coordinates out of bounds (-1) Warning: Frame 347306 Coordinates out of bounds (-1) Warning: Frame 347337 Coordinates out of bounds (-1) Warning: Frame 347731 Coordinates out of bounds (-1) Warning: Frame 347919 Coordinates out of bounds (-1) Warning: Frame 347924 Coordinates out of bounds (-1) Warning: Frame 347927 Coordinates out of bounds (-1) Warning: Frame 348019 Coordinates out of bounds (-1) Warning: Frame 348243 Coordinates out of bounds (-1) Warning: Frame 348244 Coordinates out of bounds (-1) Warning: Frame 348293 Coordinates out of bounds (-1) Warning: Frame 348549 Coordinates out of bounds (-1) Warning: Frame 348725 Coordinates out of bounds (-1) Warning: Frame 349170 Coordinates out of bounds (-1) Warning: Frame 349172 Coordinates out of bounds (-1) Warning: Frame 349174 Coordinates out of bounds (-1) Warning: Frame 349175 Coordinates out of bounds (-1) Warning: Frame 349176 Coordinates out of bounds (-1) Warning: Frame 349197 Coordinates out of bounds (-1) Warning: Frame 349316 Coordinates out of bounds (-1) Warning: Frame 349812 Coordinates out of bounds (-1) Warning: Frame 350719 Coordinates out of bounds (-1) Warning: Frame 350766 Coordinates out of bounds (-1) Warning: Frame 350775 Coordinates out of bounds (-1) Warning: Frame 350780 Coordinates out of bounds (-1) Warning: Frame 351485 Coordinates out of bounds (-1) Warning: Frame 351486 Coordinates out of bounds (-1) Warning: Frame 351773 Coordinates out of bounds (-1) Warning: Frame 352166 Coordinates out of bounds (-1) Warning: Frame 354121 Coordinates out of bounds (-1) Warning: Frame 358123 Coordinates out of bounds (-1) Warning: Frame 358601 Coordinates out of bounds (-1) Warning: Frame 359877 Coordinates out of bounds (-1) Warning: Frame 361650 Coordinates out of bounds (-1) Warning: Frame 366889 Coordinates out of bounds (-1) Warning: Frame 366919 Coordinates out of bounds (-1) Warning: Frame 366955 Coordinates out of bounds (-1) Warning: Frame 369172 Coordinates out of bounds (-1) Warning: Frame 369369 Coordinates out of bounds (-1) Warning: Frame 372396 Coordinates out of bounds (-1) Warning: Frame 372397 Coordinates out of bounds (-1) Warning: Frame 372398 Coordinates out of bounds (-1) Warning: Frame 373288 Coordinates out of bounds (-1) Warning: Frame 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bounds (-1) Warning: Frame 395404 Coordinates out of bounds (-1) Warning: Frame 395416 Coordinates out of bounds (-1) Warning: Frame 395417 Coordinates out of bounds (-1) Warning: Frame 400802 Coordinates out of bounds (-1) Warning: Frame 400815 Coordinates out of bounds (-1) Warning: Frame 400817 Coordinates out of bounds (-1) Warning: Frame 401057 Coordinates out of bounds (-1) Warning: Frame 401085 Coordinates out of bounds (-1) Warning: Frame 401086 Coordinates out of bounds (-1) Warning: Frame 401087 Coordinates out of bounds (-1) Warning: Frame 401457 Coordinates out of bounds (-1) Warning: Frame 401906 Coordinates out of bounds (-1) Warning: Frame 402203 Coordinates out of bounds (-1) Warning: Frame 402344 Coordinates out of bounds (-1) Warning: Frame 402845 Coordinates out of bounds (-1) Warning: Frame 402935 Coordinates out of bounds (-1) Warning: Frame 402936 Coordinates out of bounds (-1) Warning: Frame 402937 Coordinates out of bounds (-1) Warning: Frame 403831 Coordinates out of bounds (-1) Warning: Frame 404062 Coordinates out of bounds (-1) Warning: Frame 406042 Coordinates out of bounds (-1) Warning: Frame 406249 Coordinates out of bounds (-1) Warning: Frame 406250 Coordinates out of bounds (-1) Warning: Frame 406251 Coordinates out of bounds (-1) Warning: Frame 406252 Coordinates out of bounds (-1) Warning: Frame 406886 Coordinates out of bounds (-1) Warning: Frame 407649 Coordinates out of bounds (-1) Warning: Frame 408086 Coordinates out of bounds (-1) Warning: Frame 408113 Coordinates out of bounds (-1) Warning: Frame 408130 Coordinates out of bounds (-1) Warning: Frame 408131 Coordinates out of bounds (-1) Warning: Frame 408168 Coordinates out of bounds (-1) Warning: Frame 408972 Coordinates out of bounds (-1) Warning: Frame 408973 Coordinates out of bounds (-1) Warning: Frame 408974 Coordinates out of bounds (-1) Warning: Frame 408975 Coordinates out of bounds (-1) Warning: Frame 409277 Coordinates out of bounds (-1) Warning: Frame 409459 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bounds (-1) Warning: Frame 426954 Coordinates out of bounds (-1) Warning: Frame 427074 Coordinates out of bounds (-1) Warning: Frame 427401 Coordinates out of bounds (-1) Warning: Frame 427623 Coordinates out of bounds (-1) Warning: Frame 428222 Coordinates out of bounds (-1) Warning: Frame 428275 Coordinates out of bounds (-1) Warning: Frame 428276 Coordinates out of bounds (-1) Warning: Frame 428444 Coordinates out of bounds (-1) Warning: Frame 428943 Coordinates out of bounds (-1) Warning: Frame 428947 Coordinates out of bounds (-1) Warning: Frame 429170 Coordinates out of bounds (-1) Warning: Frame 430170 Coordinates out of bounds (-1) Warning: Frame 430328 Coordinates out of bounds (-1) Warning: Frame 430370 Coordinates out of bounds (-1) Warning: Frame 430371 Coordinates out of bounds (-1) Warning: Frame 431639 Coordinates out of bounds (-1) Warning: Frame 432243 Coordinates out of bounds (-1) Warning: Frame 432478 Coordinates out of bounds (-1) Warning: Frame 432903 Coordinates out of bounds (-1) Warning: Frame 433235 Coordinates out of bounds (-1) Warning: Frame 433369 Coordinates out of bounds (-1) Warning: Frame 433768 Coordinates out of bounds (-1) Warning: Frame 434190 Coordinates out of bounds (-1) Warning: Frame 434300 Coordinates out of bounds (-1) Warning: Frame 434592 Coordinates out of bounds (-1) Warning: Frame 434901 Coordinates out of bounds (-1) Warning: Frame 434921 Coordinates out of bounds (-1) Warning: Frame 435109 Coordinates out of bounds (-1) Warning: Frame 435436 Coordinates out of bounds (-1) Warning: Frame 435439 Coordinates out of bounds (-1) Warning: Frame 435441 Coordinates out of bounds (-1) Warning: Frame 435448 Coordinates out of bounds (-1) Warning: Frame 435557 Coordinates out of bounds (-1) Warning: Frame 435766 Coordinates out of bounds (-1) Warning: Frame 436222 Coordinates out of bounds (-1) Warning: Frame 436381 Coordinates out of bounds (-1) Warning: Frame 436484 Coordinates out of bounds (-1) Warning: Frame 437339 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bounds (-1) Warning: Frame 456563 Coordinates out of bounds (-1) Warning: Frame 456564 Coordinates out of bounds (-1) Warning: Frame 456693 Coordinates out of bounds (-1) Warning: Frame 456861 Coordinates out of bounds (-1) Warning: Frame 456862 Coordinates out of bounds (-1) Warning: Frame 456866 Coordinates out of bounds (-1) Warning: Frame 457055 Coordinates out of bounds (-1) Warning: Frame 457195 Coordinates out of bounds (-1) Warning: Frame 457390 Coordinates out of bounds (-1) Warning: Frame 457496 Coordinates out of bounds (-1) Warning: Frame 458049 Coordinates out of bounds (-1) Warning: Frame 458051 Coordinates out of bounds (-1) Warning: Frame 458052 Coordinates out of bounds (-1) Warning: Frame 458054 Coordinates out of bounds (-1) Warning: Frame 458263 Coordinates out of bounds (-1) Warning: Frame 458361 Coordinates out of bounds (-1) Warning: Frame 458366 Coordinates out of bounds (-1) Warning: Frame 458515 Coordinates out of bounds (-1) Warning: Frame 458574 Coordinates out of bounds (-1) Warning: Frame 458608 Coordinates out of bounds (-1) Warning: Frame 458609 Coordinates out of bounds (-1) Warning: Frame 458659 Coordinates out of bounds (-1) Warning: Frame 458840 Coordinates out of bounds (-1) Warning: Frame 458945 Coordinates out of bounds (-1) Warning: Frame 458948 Coordinates out of bounds (-1) Warning: Frame 458955 Coordinates out of bounds (-1) Warning: Frame 458985 Coordinates out of bounds (-1) Warning: Frame 458986 Coordinates out of bounds (-1) Warning: Frame 459114 Coordinates out of bounds (-1) Warning: Frame 459115 Coordinates out of bounds (-1) Warning: Frame 459116 Coordinates out of bounds (-1) Warning: Frame 459117 Coordinates out of bounds (-1) Warning: Frame 459230 Coordinates out of bounds (-1) Warning: Frame 459358 Coordinates out of bounds (-1) Warning: Frame 459732 Coordinates out of bounds (-1) Warning: Frame 460069 Coordinates out of bounds (-1) Warning: Frame 460215 Coordinates out of bounds (-1) Warning: Frame 460222 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bounds (-1) Warning: Frame 843863 Coordinates out of bounds (-1) Warning: Frame 844102 Coordinates out of bounds (-1) Warning: Frame 844490 Coordinates out of bounds (-1) Warning: Frame 844632 Coordinates out of bounds (-1) Warning: Frame 844738 Coordinates out of bounds (-1) Warning: Frame 844739 Coordinates out of bounds (-1) Warning: Frame 844836 Coordinates out of bounds (-1) Warning: Frame 845034 Coordinates out of bounds (-1) Warning: Frame 845086 Coordinates out of bounds (-1) Warning: Frame 845139 Coordinates out of bounds (-1) Warning: Frame 845750 Coordinates out of bounds (-1) Warning: Frame 845924 Coordinates out of bounds (-1) Warning: Frame 845931 Coordinates out of bounds (-1) Warning: Frame 846194 Coordinates out of bounds (-1) Warning: Frame 846195 Coordinates out of bounds (-1) Warning: Frame 846276 Coordinates out of bounds (-1) Warning: Frame 846311 Coordinates out of bounds (-1) Warning: Frame 846898 Coordinates out of bounds (-1) Warning: Frame 846967 Coordinates 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Coordinates out of bounds (-1) Warning: Frame 851851 Coordinates out of bounds (-1) Warning: Frame 852045 Coordinates out of bounds (-1) Warning: Frame 852092 Coordinates out of bounds (-1) Warning: Frame 852097 Coordinates out of bounds (-1) Warning: Frame 852187 Coordinates out of bounds (-1) Warning: Frame 852192 Coordinates out of bounds (-1) Warning: Frame 852235 Coordinates out of bounds (-1) Warning: Frame 852236 Coordinates out of bounds (-1) Warning: Frame 852238 Coordinates out of bounds (-1) Warning: Frame 852239 Coordinates out of bounds (-1) Warning: Frame 852295 Coordinates out of bounds (-1) Warning: Frame 852296 Coordinates out of bounds (-1) Warning: Frame 852297 Coordinates out of bounds (-1) Warning: Frame 852345 Coordinates out of bounds (-1) Warning: Frame 852397 Coordinates out of bounds (-1) Warning: Frame 852399 Coordinates out of bounds (-1) Warning: Frame 852499 Coordinates out of bounds (-1) Warning: Frame 852502 Coordinates out of bounds (-1) Warning: Frame 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Coordinates out of bounds (-1) Warning: Frame 869932 Coordinates out of bounds (-1) Warning: Frame 870100 Coordinates out of bounds (-1) Warning: Frame 870102 Coordinates out of bounds (-1) Warning: Frame 870814 Coordinates out of bounds (-1) Warning: Frame 870824 Coordinates out of bounds (-1) Warning: Frame 871092 Coordinates out of bounds (-1) Warning: Frame 871413 Coordinates out of bounds (-1) Warning: Frame 871421 Coordinates out of bounds (-1) Warning: Frame 871549 Coordinates out of bounds (-1) Warning: Frame 871553 Coordinates out of bounds (-1) Warning: Frame 871733 Coordinates out of bounds (-1) Warning: Frame 872303 Coordinates out of bounds (-1) Warning: Frame 872310 Coordinates out of bounds (-1) Warning: Frame 873122 Coordinates out of bounds (-1) Warning: Frame 873123 Coordinates out of bounds (-1) Warning: Frame 873302 Coordinates out of bounds (-1) Warning: Frame 873459 Coordinates out of bounds (-1) Warning: Frame 873511 Coordinates out of bounds (-1) Warning: Frame 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out of bounds (-1) Warning: Frame 886625 Coordinates out of bounds (-1) Warning: Frame 886931 Coordinates out of bounds (-1) Warning: Frame 887177 Coordinates out of bounds (-1) Warning: Frame 887809 Coordinates out of bounds (-1) Warning: Frame 888188 Coordinates out of bounds (-1) Warning: Frame 888191 Coordinates out of bounds (-1) Warning: Frame 888285 Coordinates out of bounds (-1) Warning: Frame 888552 Coordinates out of bounds (-1) Warning: Frame 888564 Coordinates out of bounds (-1) Warning: Frame 888565 Coordinates out of bounds (-1) Warning: Frame 888638 Coordinates out of bounds (-1) Warning: Frame 888641 Coordinates out of bounds (-1) Warning: Frame 888668 Coordinates out of bounds (-1) Warning: Frame 888673 Coordinates out of bounds (-1) Warning: Frame 889253 Coordinates out of bounds (-1) Warning: Frame 889577 Coordinates out of bounds (-1) Warning: Frame 889578 Coordinates out of bounds (-1) Warning: Frame 889704 Coordinates out of bounds (-1) Warning: Frame 889875 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Warning: Frame 902825 Coordinates out of bounds (-1) Warning: Frame 903039 Coordinates out of bounds (-1) Warning: Frame 903052 Coordinates out of bounds (-1) Warning: Frame 903071 Coordinates out of bounds (-1) Warning: Frame 903072 Coordinates out of bounds (-1) Warning: Frame 903079 Coordinates out of bounds (-1) Warning: Frame 903086 Coordinates out of bounds (-1) Warning: Frame 903251 Coordinates out of bounds (-1) Warning: Frame 903480 Coordinates out of bounds (-1) Warning: Frame 903492 Coordinates out of bounds (-1) Warning: Frame 903523 Coordinates out of bounds (-1) Warning: Frame 903742 Coordinates out of bounds (-1) Warning: Frame 903856 Coordinates out of bounds (-1) Warning: Frame 903954 Coordinates out of bounds (-1) Warning: Frame 904411 Coordinates out of bounds (-1) Warning: Frame 905124 Coordinates out of bounds (-1) Warning: Frame 905144 Coordinates out of bounds (-1) Warning: Frame 905145 Coordinates out of bounds (-1) Warning: Frame 905146 Coordinates out of 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out of bounds (-1) Warning: Frame 908663 Coordinates out of bounds (-1) Warning: Frame 908669 Coordinates out of bounds (-1) Warning: Frame 908728 Coordinates out of bounds (-1) Warning: Frame 908930 Coordinates out of bounds (-1) Warning: Frame 908985 Coordinates out of bounds (-1) Warning: Frame 909030 Coordinates out of bounds (-1) Warning: Frame 909399 Coordinates out of bounds (-1) Warning: Frame 909704 Coordinates out of bounds (-1) Warning: Frame 910035 Coordinates out of bounds (-1) Warning: Frame 910193 Coordinates out of bounds (-1) Warning: Frame 910202 Coordinates out of bounds (-1) Warning: Frame 910441 Coordinates out of bounds (-1) Warning: Frame 910443 Coordinates out of bounds (-1) Warning: Frame 910879 Coordinates out of bounds (-1) Warning: Frame 910929 Coordinates out of bounds (-1) Warning: Frame 910932 Coordinates out of bounds (-1) Warning: Frame 911019 Coordinates out of bounds (-1) Warning: Frame 911880 Coordinates out of bounds (-1) Warning: Frame 912095 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915131 Coordinates out of bounds (-1) Warning: Frame 915138 Coordinates out of bounds (-1) Warning: Frame 915192 Coordinates out of bounds (-1) Warning: Frame 915542 Coordinates out of bounds (-1) Warning: Frame 915593 Coordinates out of bounds (-1) Warning: Frame 915611 Coordinates out of bounds (-1) Warning: Frame 916066 Coordinates out of bounds (-1) Warning: Frame 916149 Coordinates out of bounds (-1) Warning: Frame 916652 Coordinates out of bounds (-1) Warning: Frame 916909 Coordinates out of bounds (-1) Warning: Frame 917037 Coordinates out of bounds (-1) Warning: Frame 917056 Coordinates out of bounds (-1) Warning: Frame 917098 Coordinates out of bounds (-1) Warning: Frame 917499 Coordinates out of bounds (-1) Warning: Frame 917910 Coordinates out of bounds (-1) Warning: Frame 917980 Coordinates out of bounds (-1) Warning: Frame 918176 Coordinates out of bounds (-1) Warning: Frame 918277 Coordinates out of bounds (-1) Warning: Frame 918458 Coordinates out of bounds (-1) Warning: 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bounds (-1) Warning: Frame 925550 Coordinates out of bounds (-1) Warning: Frame 925725 Coordinates out of bounds (-1) Warning: Frame 925727 Coordinates out of bounds (-1) Warning: Frame 925739 Coordinates out of bounds (-1) Warning: Frame 925783 Coordinates out of bounds (-1) Warning: Frame 926099 Coordinates out of bounds (-1) Warning: Frame 926132 Coordinates out of bounds (-1) Warning: Frame 926308 Coordinates out of bounds (-1) Warning: Frame 926310 Coordinates out of bounds (-1) Warning: Frame 926431 Coordinates out of bounds (-1) Warning: Frame 926828 Coordinates out of bounds (-1) Warning: Frame 926832 Coordinates out of bounds (-1) Warning: Frame 926834 Coordinates out of bounds (-1) Warning: Frame 926851 Coordinates out of bounds (-1) Warning: Frame 926890 Coordinates out of bounds (-1) Warning: Frame 926907 Coordinates out of bounds (-1) Warning: Frame 927282 Coordinates out of bounds (-1) Warning: Frame 927609 Coordinates out of bounds (-1) Warning: Frame 927610 Coordinates out of bounds (-1) Warning: Frame 927729 Coordinates out of bounds (-1) Warning: Frame 927743 Coordinates out of bounds (-1) Warning: Frame 927853 Coordinates out of bounds (-1) Warning: Frame 927959 Coordinates out of bounds (-1) Warning: Frame 928210 Coordinates out of bounds (-1) Warning: Frame 928211 Coordinates out of bounds (-1) Warning: Frame 928212 Coordinates out of bounds (-1) Warning: Frame 928444 Coordinates out of bounds (-1) Warning: Frame 928482 Coordinates out of bounds (-1) Warning: Frame 928483 Coordinates out of bounds (-1) Warning: Frame 928485 Coordinates out of bounds (-1) Warning: Frame 928489 Coordinates out of bounds (-1) Warning: Frame 928811 Coordinates out of bounds (-1) Warning: Frame 929668 Coordinates out of bounds (-1) Warning: Frame 929674 Coordinates out of bounds (-1) Warning: Frame 930289 Coordinates out of bounds (-1) Warning: Frame 930330 Coordinates out of bounds (-1) Warning: Frame 930343 Coordinates out of bounds (-1) Warning: Frame 930513 Coordinates out of bounds (-1) Warning: Frame 930759 Coordinates out of bounds (-1) Warning: Frame 930815 Coordinates out of bounds (-1) Warning: Frame 930887 Coordinates out of bounds (-1) Warning: Frame 931418 Coordinates out of bounds (-1) Warning: Frame 931420 Coordinates out of bounds (-1) Warning: Frame 931661 Coordinates out of bounds (-1) Warning: Frame 931708 Coordinates out of bounds (-1) Warning: Frame 931789 Coordinates out of bounds (-1) Warning: Frame 931876 Coordinates out of bounds (-1) Warning: Frame 932211 Coordinates out of bounds (-1) Warning: Frame 932223 Coordinates out of bounds (-1) Warning: Frame 932375 Coordinates out of bounds (-1) Warning: Frame 932518 Coordinates out of bounds (-1) Warning: Frame 932538 Coordinates out of bounds (-1) Warning: Frame 932727 Coordinates out of bounds (-1) Warning: Frame 933105 Coordinates out of bounds (-1) Warning: Frame 933108 Coordinates out of bounds (-1) Warning: Frame 933204 Coordinates out of bounds (-1) Warning: Frame 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out of bounds (-1) Warning: Frame 1181759 Coordinates out of bounds (-1) Warning: Frame 1181760 Coordinates out of bounds (-1) Warning: Frame 1182013 Coordinates out of bounds (-1) Warning: Frame 1182055 Coordinates out of bounds (-1) Warning: Frame 1182192 Coordinates out of bounds (-1) Warning: Frame 1182433 Coordinates out of bounds (-1) Warning: Frame 1182594 Coordinates out of bounds (-1) Warning: Frame 1182598 Coordinates out of bounds (-1) Warning: Frame 1183747 Coordinates out of bounds (-1) Warning: Frame 1183756 Coordinates out of bounds (-1) Warning: Frame 1183999 Coordinates out of bounds (-1) Warning: Frame 1184000 Coordinates out of bounds (-1) Warning: Frame 1184001 Coordinates out of bounds (-1) Warning: Frame 1184022 Coordinates out of bounds (-1) Warning: Frame 1184035 Coordinates out of bounds (-1) Warning: Frame 1184088 Coordinates out of bounds (-1) Warning: Frame 1184089 Coordinates out of bounds (-1) Warning: Frame 1184144 Coordinates out of bounds (-1) Warning: Frame 1184285 Coordinates out of bounds (-1) Warning: Frame 1184767 Coordinates out of bounds (-1) Warning: Frame 1185217 Coordinates out of bounds (-1) Warning: Frame 1185578 Coordinates out of bounds (-1) Warning: Frame 1185792 Coordinates out of bounds (-1) Warning: Frame 1187139 Coordinates out of bounds (-1) Warning: Frame 1187831 Coordinates out of bounds (-1) Warning: Frame 1187832 Coordinates out of bounds (-1) Warning: Frame 1188112 Coordinates out of bounds (-1) Warning: Frame 1188154 Coordinates out of bounds (-1) Warning: Frame 1188166 Coordinates out of bounds (-1) Histogram: Normalizing sum of bin populations to 1.0 Sum over all bins is 1.186e+06 1: [hist z1,-180,180,0.5 a2,-180,180,0.5 out 2dhist_z1_a2.gnu norm] Calculating bins from min=-180 max=180 step=0.5. Dim z1: -180.000000->180.000000, step 0.500000, 720 bins. Calculating bins from min=-180 max=180 step=0.5. Dim a2: -180.000000->180.000000, step 0.500000, 720 bins. Hist: 1188899 data points in each dimension. Hist: Allocating histogram, total bins = 518400 Histogram: Normalizing sum of bin populations to 1.0 Sum over all bins is 1.1889e+06 TIME: Analyses took 0.0512 seconds. DATASETS (8 total): dist1 "dist1" (double, distance), size is 1188899 d1 "d1" (double, torsion(delta)), size is 1188899 d2 "d2" (double, torsion(delta)), size is 1188899 e1 "e1" (double, torsion(epsilon)), size is 1188899 z1 "z1" (double, torsion(zeta)), size is 1188899 a2 "a2" (double, torsion(alpha)), size is 1188899 Hist_00022 "Hist_00022" (double matrix), size is 432000 Hist_00023 "Hist_00023" (double matrix), size is 518400 DATAFILES (2 total): 2dhist_e1_dist1.gnu (Gnuplot File): Hist_00022 2dhist_z1_a2.gnu (Gnuplot File): Hist_00023 RUN TIMING: TIME: Init : 0.0000 s ( 0.00%) TIME: Trajectory Process : 1.1889 s ( 40.61%) TIME: Action Post : 0.0000 s ( 0.00%) TIME: Analysis : 0.0512 s ( 1.75%) TIME: Data File Write : 1.6871 s ( 57.63%) TIME: Other : 0.0003 s ( 0.00%) TIME: Run Total 2.9274 s ---------- RUN END --------------------------------------------------- TIME: Total execution time: 5.3913 seconds. -------------------------------------------------------------------------------- To cite CPPTRAJ use: Daniel R. Roe and Thomas E. Cheatham, III, "PTRAJ and CPPTRAJ: Software for Processing and Analysis of Molecular Dynamics Trajectory Data". J. Chem. Theory Comput., 2013, 9 (7), pp 3084-3095.