1tgq.A.THR33

Critiques

• Procheck gf value -1.290 < -1.000
• CING D1D2_CHK value -0.873 < -0.800
• whatif RAMCHK value -1.427 < -1.300

Ramachandran

Whatif.RAMCHK.valueList: -1.43 (+- 0.22)

CHK.RAMACHANDRAN_CHK.valueList: -1.52 (+- 0.04)

Janin

Whatif.C12CHK.valueList: -0.73 (+- 0.27)

CHK.CHI1CHI2_CHK.valueList: -1.24 (+- 0.10)

D1D2

CHK.D1D2_CHK.valueList: -0.87 (+- 0.06)

PHI

PHI : average: -45.9 cv: 0.005 || outliers: 5 (models [15, 7, 5, 4, 0])

PSI

PSI : average: -29.5 cv: 0.005 || outliers: 5 (models [14, 10, 7, 5, 4])

CHI1

CHI1 : average: 50.5 cv: 0.593 || outliers: 10 (models [18, 17, 15, 11, 10, 9, 7, 6, 5, 3])

CHI2

CHI2 : average: 123.3 cv: 0.329 || outliers: 3 (models [5, 3, 2])

OMEGA

OMEGA : average: 180.0 cv: 0.000 || outliers: 6 (models [18, 9, 6, 5, 2, 0])

Distance Restraints

set1

#	atom 1	atom 2	low	upp	act	viol	max	c3	Critique
1486	A THR33 MG	A GLY35 H	0.0	5.5	5.5+-0.7	0.3+-0.4	0.8	9	violMax: 0.84 violSd: 0.38
1497	A THR33 HB	A GLY35 H	0.0	5.5	6.0+-0.4	0.5+-0.4	1.3	13	violMax: 1.27 violSd: 0.38
1529	A THR33 MG	A HIS55 HD2	0.0	5.5	8.1+-1.3	2.7+-1.3	4.7	19	violMax: 4.69 violSd: 1.35
204	A THR33 HB	A GLU34 H	0.0	5.5	3.8+-0.5	0.0+-0.0	0.0	0
206	A THR33 HB	A THR33 MG	0.0	4.7	2.2+-0.0	0.0+-0.0	0.0	0
207	A THR33 HA	A THR33 HB	0.0	5.1	2.6+-0.3	0.0+-0.0	0.0	0
209	A ASN32 HA	A THR33 HA	0.0	5.5	4.4+-0.0	0.0+-0.0	0.0	0
211	A THR33 HA	A THR33 MG	0.0	5.3	2.5+-0.4	0.0+-0.0	0.0	0
566	A THR33 H	A TYR94 HA	0.0	5.5	2.7+-0.4	0.0+-0.0	0.0	0
610	A THR33 H	A THR33 MG	0.0	4.8	2.4+-0.7	0.0+-0.0	0.0	0
684	A THR33 H	A THR33 HA	0.0	5.5	2.7+-0.0	0.0+-0.0	0.0	0
686	A ASN32 QB	A THR33 H	0.0	5.5	2.6+-0.2	0.0+-0.0	0.0	0
687	A ASN32 QB	A THR33 H	0.0	5.5	2.6+-0.2	0.0+-0.0	0.0	0
689	A THR33 H	A THR33 HB	0.0	5.5	3.1+-0.4	0.0+-0.0	0.0	0
690	A ASN32 HA	A THR33 H	0.0	5.5	2.5+-0.1	0.0+-0.0	0.0	0
867	A THR33 H	A GLU34 H	0.0	5.5	2.9+-0.1	0.0+-0.0	0.0	0
868	A THR33 HA	A GLU34 H	0.0	5.5	3.5+-0.0	0.0+-0.0	0.0	0
872	A THR33 MG	A GLU34 H	0.0	5.5	3.6+-0.8	0.0+-0.0	0.0	0
1405	A THR33 H	A PHE95 H	0.0	5.5	4.5+-0.4	0.0+-0.0	0.0	0
1432	A THR33 H	A TYR94 QD	0.0	5.5	5.1+-0.3	0.0+-0.0	0.0	0
29	A THR33 MG	A PHE95 QD	0.0	5.5	4.8+-0.6	0.0+-0.0	0.0	0
18	A THR33 HA	A GLY35 H	0.0	5.5	4.8+-0.8	0.1+-0.1	0.2	0

Dihedral Restraints

dihed

#	name	low	upp	act	cv	vAv	vSd	max	c3	Critique
118	PHI	-85.1	-52.1	-45.9	0.0053	7.0	4.7	15.1	16	violSd: 4.71 violMax: 15.08
88	PSI	-33.5	7.0	-29.5	0.0046	0.8	2.0	7.7	3	violMax: 7.75