# VALIDATION summary for ensemble analyzed_*.pdb #


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# Restraint violation averages; Acceptance criterium; RMSD: #
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NOE :   0.00 +-   0.00        ;                <0.5 ;  0.0228 +-  0.0017
CDIH:   0.00 +-   0.00        ;                  <5 ;  0.3320 +-  0.0567
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   :   2.63 +-   0.58
Heavy atom RMSD :   3.45 +-   0.55


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# PROCHECK Ramachandran plot regions: #
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Most favoured regions      : 80.97 +- 2.16
Allowed regions            : 14.83 +- 3.34
Generously allowed regions : 3.62 +- 1.74
Disallowed regions         : 0.55 +- 0.68


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

Structure Z-scores, positive is better than average
1st generation packing quality            :	-3.35 +- 0.19
2nd generation packing quality            :	-2.76 +- 0.21
Ramachandran plot appearance              :	-2.42 +- 0.43
chi-1/chi-2 rotamer normality             :	-5.67 +- 0.35
Backbone conformation                     :	-5.63 +- 1.08
Overall Quality (According to E.Krieger)  :	-27.02 +- 4.26
RMS Z-scores, should be close to 1.0:
Bond lengths                              :	0.42 +- 0.00
Bond angles                               :	0.95 +- 0.00
Omega angle restraints                    :	0.02 +- 0.01
Side chain planarity                      :	0.03 +- 0.00
Improper dihedral distribution            :	3.98 +- 0.01
Inside/Outside distribution               :	1.10 +- 0.03
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        :	11.90 +- 2.15
Unsatisfied buried hydrogen acceptors     :	0.70 +- 0.80