# VALIDATION summary for ensemble refined_*.pdb #


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# Restraint violation averages; Acceptance criterium; RMSD: #
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NOE :   0.00 +-   0.00        ;                <0.5 ;  0.0167 +-  0.0012
CDIH:   0.00 +-   0.00        ;                  <5 ;  0.7357 +-  0.1076
COUP:   0.00 +-   0.00        ;                  <1 ;  0.0000 +-  0.0000
SANI:   0.00 +-   0.00        ;                  <0 ;  0.0000 +-  0.0000
VEAN:   0.00 +-   0.00        ;                  <5 ;  0.0000 +-  0.0000


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# Coordinate Root Mean Square Deviations of the ensemble: #
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Residue ZONES used for fitting the structures:
ZONES:
*

RMSD's for specified zones:
Backbone RMSD   :   2.16 +-   0.44
Heavy atom RMSD :   2.80 +-   0.32


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# PROCHECK Ramachandran plot regions: #
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Most favoured regions      : 87.10 +- 2.28
Allowed regions            : 11.13 +- 2.50
Generously allowed regions : 1.52 +- 0.78
Disallowed regions         : 0.23 +- 0.59


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# WHATCHECK analysis: #
#######################

Structure Z-scores, positive is better than average
1st generation packing quality            :	-1.35 +- 0.43
2nd generation packing quality            :	-2.31 +- 0.37
Ramachandran plot appearance              :	-1.39 +- 0.55
chi-1/chi-2 rotamer normality             :	-0.65 +- 0.57
Backbone conformation                     :	-7.25 +- 1.65
Overall Quality (According to E.Krieger)  :	-29.54 +- 6.70
RMS Z-scores, should be close to 1.0:
Bond lengths                              :	0.77 +- 0.03
Bond angles                               :	0.69 +- 0.02
Omega angle restraints                    :	0.77 +- 0.05
Side chain planarity                      :	0.54 +- 0.09
Improper dihedral distribution            :	4.82 +- 0.47
Inside/Outside distribution               :	1.12 +- 0.02
Counts:
Average number of bumps                   :	0.00 +- 0.00
Average sum of bumps                      :	0.00 +- 0.00
Number of bumps per 100 residues          :	0.00 +- 0.00
Unsatisfied buried hydrogen donors        :	11.55 +- 2.14
Unsatisfied buried hydrogen acceptors     :	0.30 +- 0.57