Model quality ?
For models with atomic structures, MolProbity analysis is performed. For models with coarse-grained or multi-scale structures, excluded volume analysis is performed.
Standard geometry: bond outliers ?
There are no bond length outliers.Standard geometry: angle outliers ?
There are 240 bond angle outliers in this entry (0.52% of 46490 assessed bonds). A summary is provided below.| Chain | Res | Type | Atoms | |Z| | Observed (Å) | Ideal (Å) | Model ID (Worst) | Models (Total) |
|---|---|---|---|---|---|---|---|---|
|
A
|
354
|
GLY
|
C-N-CA
|
8.75
|
137.45
|
121.70
|
1
|
2
|
|
A
|
194
|
LYS
|
C-N-CA
|
8.48
|
136.97
|
121.70
|
1
|
1
|
|
A
|
94
|
GLN
|
OE1-CD-NE2
|
7.26
|
115.34
|
122.60
|
1
|
6
|
|
A
|
275
|
ARG
|
NE-CZ-NH2
|
7.25
|
125.72
|
119.20
|
10
|
2
|
|
A
|
430
|
GLU
|
C-N-CA
|
6.80
|
133.95
|
121.70
|
5
|
1
|
|
A
|
322
|
PHE
|
CA-CB-CG
|
6.56
|
107.24
|
113.80
|
3
|
2
|
|
A
|
191
|
SER
|
C-N-CA
|
6.49
|
133.39
|
121.70
|
6
|
1
|
|
A
|
100
|
ASN
|
OD1-CG-ND2
|
6.14
|
116.46
|
122.60
|
5
|
3
|
|
A
|
271
|
GLN
|
OE1-CD-NE2
|
6.14
|
116.46
|
122.60
|
1
|
7
|
|
A
|
109
|
GLN
|
OE1-CD-NE2
|
6.14
|
116.46
|
122.60
|
8
|
6
|
|
A
|
188
|
GLN
|
OE1-CD-NE2
|
6.02
|
116.58
|
122.60
|
4
|
8
|
|
A
|
351
|
THR
|
N-CA-CB
|
6.02
|
121.73
|
111.50
|
8
|
1
|
|
A
|
351
|
THR
|
CA-CB-CG2
|
5.73
|
120.24
|
110.50
|
8
|
2
|
|
A
|
400
|
GLN
|
OE1-CD-NE2
|
5.50
|
117.10
|
122.60
|
4
|
8
|
|
A
|
79
|
GLN
|
OE1-CD-NE2
|
5.48
|
117.12
|
122.60
|
8
|
8
|
|
A
|
238
|
ALA
|
N-CA-CB
|
5.45
|
102.22
|
110.40
|
9
|
1
|
|
A
|
76
|
GLN
|
OE1-CD-NE2
|
5.43
|
117.17
|
122.60
|
6
|
1
|
|
A
|
167
|
ASN
|
OD1-CG-ND2
|
5.41
|
117.19
|
122.60
|
2
|
3
|
|
A
|
196
|
GLY
|
C-N-CA
|
5.36
|
131.35
|
121.70
|
1
|
1
|
|
A
|
207
|
GLN
|
OE1-CD-NE2
|
5.26
|
117.34
|
122.60
|
5
|
9
|
|
A
|
319
|
SER
|
CA-C-N
|
5.26
|
124.79
|
116.90
|
6
|
1
|
|
A
|
408
|
PHE
|
CA-CB-CG
|
5.25
|
108.55
|
113.80
|
1
|
1
|
|
A
|
396
|
PHE
|
CA-CB-CG
|
5.22
|
108.58
|
113.80
|
10
|
1
|
|
A
|
184
|
HIS
|
CB-CG-CD2
|
5.20
|
124.43
|
131.20
|
6
|
7
|
|
A
|
112
|
TYR
|
CA-C-N
|
5.19
|
124.69
|
116.90
|
6
|
1
|
|
A
|
299
|
ARG
|
CD-NE-CZ
|
5.16
|
131.62
|
124.40
|
3
|
1
|
|
A
|
194
|
LYS
|
CA-C-N
|
5.13
|
126.46
|
116.20
|
1
|
1
|
|
A
|
317
|
ASN
|
OD1-CG-ND2
|
5.12
|
117.48
|
122.60
|
1
|
1
|
|
A
|
326
|
LYS
|
CA-C-N
|
5.09
|
126.39
|
116.20
|
6
|
1
|
|
A
|
383
|
GLN
|
OE1-CD-NE2
|
5.08
|
117.52
|
122.60
|
9
|
2
|
|
A
|
324
|
TRP
|
CE2-CD2-CE3
|
5.03
|
113.77
|
118.80
|
8
|
1
|
|
A
|
433
|
GLN
|
OE1-CD-NE2
|
4.96
|
117.64
|
122.60
|
6
|
10
|
|
A
|
243
|
SER
|
C-N-CA
|
4.91
|
130.53
|
121.70
|
2
|
1
|
|
A
|
293
|
PRO
|
CA-N-CD
|
4.90
|
105.14
|
112.00
|
3
|
1
|
|
A
|
67
|
ASN
|
CA-CB-CG
|
4.88
|
117.48
|
112.60
|
6
|
2
|
|
A
|
371
|
GLN
|
OE1-CD-NE2
|
4.88
|
117.72
|
122.60
|
6
|
6
|
|
A
|
133
|
GLN
|
OE1-CD-NE2
|
4.87
|
117.73
|
122.60
|
8
|
6
|
|
A
|
19
|
ARG
|
NE-CZ-NH2
|
4.87
|
123.58
|
119.20
|
2
|
3
|
|
A
|
433
|
GLN
|
C-N-CA
|
4.87
|
130.46
|
121.70
|
5
|
1
|
|
A
|
7
|
GLN
|
OE1-CD-NE2
|
4.85
|
117.75
|
122.60
|
6
|
6
|
|
A
|
401
|
GLN
|
OE1-CD-NE2
|
4.81
|
117.79
|
122.60
|
3
|
10
|
|
A
|
267
|
ALA
|
N-CA-CB
|
4.80
|
103.20
|
110.40
|
10
|
1
|
|
A
|
384
|
GLN
|
OE1-CD-NE2
|
4.80
|
117.80
|
122.60
|
5
|
4
|
|
A
|
303
|
GLN
|
OE1-CD-NE2
|
4.78
|
117.82
|
122.60
|
6
|
10
|
|
A
|
326
|
LYS
|
CA-C-O
|
4.77
|
112.69
|
120.80
|
6
|
1
|
|
A
|
190
|
ALA
|
C-CA-CB
|
4.76
|
117.64
|
110.50
|
6
|
1
|
|
A
|
337
|
GLN
|
OE1-CD-NE2
|
4.75
|
117.85
|
122.60
|
3
|
3
|
|
A
|
232
|
ARG
|
NH1-CZ-NH2
|
4.73
|
113.15
|
119.30
|
5
|
2
|
|
A
|
187
|
ASP
|
CA-CB-CG
|
4.68
|
117.28
|
112.60
|
5
|
1
|
|
A
|
17
|
GLN
|
OE1-CD-NE2
|
4.66
|
117.94
|
122.60
|
8
|
2
|
|
A
|
159
|
GLU
|
C-N-CA
|
4.64
|
130.04
|
121.70
|
9
|
1
|
|
A
|
320
|
PRO
|
CA-N-CD
|
4.58
|
105.59
|
112.00
|
6
|
1
|
|
A
|
117
|
VAL
|
CA-CB-CG2
|
4.57
|
118.16
|
110.40
|
1
|
1
|
|
A
|
416
|
GLN
|
OE1-CD-NE2
|
4.55
|
118.05
|
122.60
|
8
|
9
|
|
A
|
429
|
THR
|
C-N-CA
|
4.55
|
129.89
|
121.70
|
1
|
1
|
|
A
|
12
|
GLN
|
OE1-CD-NE2
|
4.54
|
118.06
|
122.60
|
3
|
5
|
|
A
|
327
|
ASN
|
OD1-CG-ND2
|
4.54
|
118.06
|
122.60
|
5
|
4
|
|
A
|
275
|
ARG
|
NE-CZ-NH1
|
4.54
|
116.96
|
121.50
|
2
|
2
|
|
A
|
299
|
ARG
|
NE-CZ-NH2
|
4.52
|
123.27
|
119.20
|
8
|
1
|
|
A
|
47
|
GLN
|
OE1-CD-NE2
|
4.51
|
118.09
|
122.60
|
7
|
4
|
|
A
|
80
|
GLN
|
OE1-CD-NE2
|
4.50
|
118.10
|
122.60
|
8
|
4
|
|
A
|
67
|
ASN
|
OD1-CG-ND2
|
4.50
|
118.10
|
122.60
|
9
|
3
|
|
A
|
197
|
HIS
|
N-CA-C
|
4.44
|
123.43
|
111.00
|
1
|
1
|
|
A
|
194
|
LYS
|
O-C-N
|
4.43
|
115.91
|
123.00
|
1
|
1
|
|
A
|
211
|
GLN
|
OE1-CD-NE2
|
4.43
|
118.17
|
122.60
|
7
|
10
|
|
A
|
197
|
HIS
|
CB-CG-CD2
|
4.37
|
125.52
|
131.20
|
7
|
2
|
|
A
|
428
|
SER
|
CA-C-N
|
4.28
|
124.76
|
116.20
|
5
|
1
|
|
A
|
192
|
VAL
|
CA-CB-CG2
|
4.25
|
117.62
|
110.40
|
3
|
1
|
|
A
|
267
|
ALA
|
C-CA-CB
|
4.22
|
116.83
|
110.50
|
10
|
1
|
|
A
|
195
|
CYS
|
C-N-CA
|
4.21
|
129.28
|
121.70
|
5
|
1
|
|
A
|
221
|
ASP
|
CA-CB-CG
|
4.18
|
116.78
|
112.60
|
9
|
1
|
|
A
|
377
|
HIS
|
CB-CG-CD2
|
4.17
|
125.78
|
131.20
|
3
|
1
|
|
A
|
67
|
ASN
|
C-CA-CB
|
4.17
|
118.03
|
110.10
|
5
|
1
|
|
A
|
184
|
HIS
|
ND1-CG-CD2
|
4.17
|
110.27
|
106.10
|
2
|
1
|
|
A
|
167
|
ASN
|
CA-CB-CG
|
4.16
|
108.44
|
112.60
|
10
|
2
|
|
A
|
356
|
HIS
|
CB-CG-CD2
|
4.15
|
125.80
|
131.20
|
5
|
4
|
|
A
|
427
|
GLY
|
C-N-CA
|
4.15
|
129.17
|
121.70
|
9
|
1
|
|
A
|
325
|
GLN
|
OE1-CD-NE2
|
4.13
|
118.47
|
122.60
|
3
|
3
|
|
A
|
409
|
ASP
|
CA-CB-CG
|
4.11
|
108.49
|
112.60
|
4
|
1
|
|
A
|
320
|
PRO
|
N-CA-CB
|
4.11
|
107.52
|
103.00
|
4
|
1
|
|
A
|
387
|
PHE
|
CA-CB-CG
|
4.10
|
117.90
|
113.80
|
3
|
1
|
|
A
|
25
|
ARG
|
NE-CZ-NH2
|
4.09
|
115.52
|
119.20
|
7
|
1
|
|
A
|
329
|
ASP
|
CA-CB-CG
|
4.07
|
116.67
|
112.60
|
7
|
1
|
|
A
|
399
|
HIS
|
CB-CG-CD2
|
4.05
|
125.93
|
131.20
|
6
|
1
|
|
A
|
40
|
ASN
|
OD1-CG-ND2
|
4.04
|
118.56
|
122.60
|
9
|
1
|
|
A
|
333
|
ILE
|
CA-CB-CG2
|
4.02
|
103.66
|
110.50
|
6
|
1
|
|
A
|
73
|
THR
|
CA-CB-CG2
|
4.01
|
117.31
|
110.50
|
2
|
1
|
|
A
|
266
|
HIS
|
CB-CG-CD2
|
4.01
|
125.99
|
131.20
|
10
|
1
|
Too-close contacts ?
The following all-atom clashscore is based on a MolProbity analysis. All-atom clashscore is defined as the number of clashes found per 1000 atoms (including hydrogen atoms). The table below contains clashscores for all atomic models in this entry.
| Model ID | Clash score | Number of clashes |
|---|---|---|
|
1
|
4.24
|
28
|
|
2
|
5.30
|
35
|
|
3
|
1.36
|
9
|
|
4
|
3.03
|
20
|
|
5
|
1.97
|
13
|
|
6
|
5.61
|
37
|
|
7
|
2.42
|
16
|
|
8
|
5.45
|
36
|
|
9
|
3.64
|
24
|
|
10
|
3.94
|
26
|
There are 244 clashes. The table below contains the detailed list of all clashes based on a MolProbity analysis. Bad clashes are >= 0.4 Angstrom. The output is limited to 100 rows.
| Atom 1 | Atom 2 | Clash(Å) | Model ID (Worst) | Models (Total) |
|---|---|---|---|---|
|
A:95:VAL:HG21
|
A:117:VAL:HG22
|
0.90
|
1
|
2
|
|
A:53:MET:HE1
|
A:347:PHE:CE1
|
0.85
|
2
|
1
|
|
A:291:SER:HB3
|
A:429:THR:HG23
|
0.82
|
9
|
1
|
|
A:240:LEU:HD11
|
A:425:LEU:HD21
|
0.78
|
4
|
1
|
|
A:352:LEU:HD13
|
A:362:MET:HE1
|
0.78
|
8
|
3
|
|
A:267:ALA:HB1
|
A:271:GLN:HB2
|
0.78
|
10
|
1
|
|
A:195:CYS:H
|
A:198:MET:HE2
|
0.77
|
8
|
1
|
|
A:267:ALA:HB1
|
A:271:GLN:CB
|
0.76
|
10
|
1
|
|
A:349:PHE:CE2
|
A:351:THR:HG22
|
0.73
|
8
|
1
|
|
A:72:LEU:HD21
|
A:94:GLN:HB3
|
0.70
|
10
|
3
|
|
A:333:ILE:HD13
|
A:379:VAL:HG21
|
0.70
|
7
|
1
|
|
A:161:GLY:HA2
|
A:190:ALA:HB1
|
0.70
|
8
|
1
|
|
A:203:LEU:HD13
|
A:275:ARG:HH22
|
0.69
|
1
|
1
|
|
A:356:HIS:CD2
|
A:382:VAL:HG11
|
0.68
|
1
|
1
|
|
A:105:MET:HE1
|
A:403:VAL:O
|
0.67
|
4
|
1
|
|
A:196:GLY:HA2
|
A:201:LYS:HE3
|
0.66
|
2
|
1
|
|
A:352:LEU:CD1
|
A:362:MET:HE1
|
0.66
|
8
|
3
|
|
A:53:MET:HE1
|
A:347:PHE:CD1
|
0.66
|
2
|
2
|
|
A:362:MET:HA
|
A:362:MET:HE2
|
0.66
|
8
|
1
|
|
A:352:LEU:HD11
|
A:365:LEU:CD2
|
0.66
|
8
|
1
|
|
A:328:LEU:HD22
|
A:332:THR:HG21
|
0.65
|
6
|
2
|
|
A:199:GLY:HA2
|
A:424:ALA:HB2
|
0.65
|
9
|
1
|
|
A:333:ILE:HG21
|
A:375:MET:HB2
|
0.64
|
2
|
2
|
|
A:413:THR:HG23
|
A:418:GLY:O
|
0.64
|
7
|
1
|
|
A:357:SER:HA
|
A:362:MET:HE3
|
0.64
|
8
|
1
|
|
A:72:LEU:HD21
|
A:94:GLN:C
|
0.64
|
5
|
2
|
|
A:333:ILE:HG21
|
A:375:MET:CB
|
0.64
|
6
|
2
|
|
A:293:PRO:HD2
|
A:322:PHE:CZ
|
0.64
|
3
|
1
|
|
A:349:PHE:CZ
|
A:351:THR:HG22
|
0.63
|
8
|
1
|
|
A:320:PRO:CB
|
A:378:TYR:CE1
|
0.62
|
2
|
1
|
|
A:203:LEU:HD13
|
A:275:ARG:NH2
|
0.62
|
1
|
1
|
|
A:110:SER:HB2
|
A:162:PHE:CZ
|
0.61
|
1
|
1
|
|
A:352:LEU:HD11
|
A:365:LEU:HD22
|
0.61
|
8
|
1
|
|
A:324:TRP:CD1
|
A:328:LEU:HD12
|
0.61
|
3
|
1
|
|
A:245:CYS:SG
|
A:253:ILE:HD13
|
0.60
|
4
|
2
|
|
A:387:PHE:CD1
|
A:395:THR:HG21
|
0.60
|
2
|
1
|
|
A:293:PRO:HD2
|
A:322:PHE:CE2
|
0.60
|
3
|
1
|
|
A:199:GLY:CA
|
A:424:ALA:HB2
|
0.60
|
9
|
1
|
|
A:90:LEU:HD21
|
A:124:ILE:HD12
|
0.59
|
5
|
1
|
|
A:320:PRO:HB2
|
A:378:TYR:CE1
|
0.59
|
2
|
1
|
|
A:355:ILE:HD11
|
A:359:TRP:CZ2
|
0.59
|
7
|
1
|
|
A:320:PRO:HD3
|
A:350:ILE:HG23
|
0.59
|
1
|
1
|
|
A:293:PRO:HD3
|
A:322:PHE:HB3
|
0.59
|
4
|
2
|
|
A:162:PHE:CE2
|
A:190:ALA:HB1
|
0.58
|
6
|
1
|
|
A:114:ALA:HA
|
A:162:PHE:CE2
|
0.57
|
8
|
1
|
|
A:94:GLN:HE21
|
A:354:GLY:HA2
|
0.56
|
10
|
1
|
|
A:291:SER:C
|
A:322:PHE:CE2
|
0.56
|
6
|
1
|
|
A:291:SER:CB
|
A:429:THR:HG23
|
0.56
|
9
|
1
|
|
A:275:ARG:CG
|
A:275:ARG:HH11
|
0.56
|
10
|
1
|
|
A:97:ALA:HB1
|
A:408:PHE:CE2
|
0.55
|
7
|
1
|
|
A:158:ALA:HB1
|
A:171:LEU:HD21
|
0.55
|
6
|
1
|
|
A:72:LEU:HD21
|
A:94:GLN:CB
|
0.55
|
10
|
2
|
|
A:19:ARG:HA
|
A:54:TRP:CZ2
|
0.55
|
6
|
1
|
|
A:105:MET:HB2
|
A:408:PHE:CZ
|
0.55
|
1
|
1
|
|
A:352:LEU:HD21
|
A:365:LEU:HD21
|
0.54
|
2
|
1
|
|
A:275:ARG:HB3
|
A:275:ARG:HH11
|
0.54
|
10
|
1
|
|
A:105:MET:HE2
|
A:109:GLN:O
|
0.54
|
2
|
1
|
|
A:291:SER:HA
|
A:322:PHE:CE2
|
0.53
|
6
|
1
|
|
A:355:ILE:HG21
|
A:396:PHE:CE2
|
0.53
|
10
|
1
|
|
A:355:ILE:HG23
|
A:411:VAL:CG2
|
0.53
|
2
|
1
|
|
A:328:LEU:HD22
|
A:332:THR:CG2
|
0.53
|
6
|
2
|
|
A:157:ASP:HA
|
A:184:HIS:CD2
|
0.53
|
6
|
1
|
|
A:324:TRP:CZ3
|
A:333:ILE:HG12
|
0.53
|
6
|
1
|
|
A:324:TRP:CZ3
|
A:375:MET:HG3
|
0.53
|
1
|
1
|
|
A:159:GLU:OE2
|
A:193:LYS:HE2
|
0.52
|
2
|
1
|
|
A:355:ILE:HG23
|
A:359:TRP:HE1
|
0.52
|
10
|
1
|
|
A:232:ARG:HD2
|
A:287:TRP:CZ3
|
0.52
|
5
|
3
|
|
A:320:PRO:HG2
|
A:375:MET:HE2
|
0.52
|
8
|
1
|
|
A:109:GLN:HB2
|
A:160:ALA:HB1
|
0.52
|
4
|
1
|
|
A:165:VAL:HG13
|
A:215:ALA:HB2
|
0.51
|
1
|
1
|
|
A:319:SER:HB3
|
A:322:PHE:CD2
|
0.51
|
10
|
1
|
|
A:399:HIS:O
|
A:403:VAL:HG23
|
0.51
|
10
|
1
|
|
A:296:GLU:CD
|
A:299:ARG:HH12
|
0.51
|
1
|
3
|
|
A:355:ILE:HG21
|
A:396:PHE:CD2
|
0.51
|
10
|
1
|
|
A:394:TYR:HB3
|
A:396:PHE:CE2
|
0.51
|
9
|
1
|
|
A:114:ALA:HA
|
A:162:PHE:CZ
|
0.51
|
8
|
1
|
|
A:245:CYS:CB
|
A:253:ILE:HD11
|
0.50
|
1
|
1
|
|
A:337:GLN:HE22
|
A:350:ILE:HD11
|
0.50
|
8
|
1
|
|
A:198:MET:SD
|
A:404:GLY:HA2
|
0.50
|
8
|
1
|
|
A:117:VAL:HB
|
A:175:MET:HE1
|
0.50
|
4
|
4
|
|
A:14:GLU:CD
|
A:19:ARG:HH21
|
0.49
|
2
|
1
|
|
A:357:SER:CB
|
A:362:MET:HE2
|
0.49
|
9
|
1
|
|
A:241:ILE:CD1
|
A:263:PHE:HB2
|
0.49
|
10
|
1
|
|
A:203:LEU:HD11
|
A:238:ALA:CB
|
0.49
|
1
|
1
|
|
A:97:ALA:HB2
|
A:105:MET:HE3
|
0.49
|
8
|
1
|
|
A:54:TRP:CZ2
|
A:58:HIS:CE1
|
0.49
|
6
|
1
|
|
A:275:ARG:CB
|
A:275:ARG:HH11
|
0.49
|
10
|
1
|
|
A:325:GLN:HB2
|
A:379:VAL:HG11
|
0.49
|
1
|
1
|
|
A:293:PRO:HD2
|
A:322:PHE:CE1
|
0.49
|
3
|
1
|
|
A:196:GLY:HA2
|
A:201:LYS:CE
|
0.49
|
2
|
1
|
|
A:105:MET:CE
|
A:405:THR:HB
|
0.49
|
5
|
1
|
|
A:70:GLY:C
|
A:94:GLN:HE22
|
0.49
|
7
|
1
|
|
A:97:ALA:CB
|
A:105:MET:HE3
|
0.49
|
8
|
1
|
|
A:349:PHE:CE2
|
A:351:THR:CG2
|
0.48
|
8
|
1
|
|
A:357:SER:OG
|
A:362:MET:HE2
|
0.48
|
9
|
1
|
|
A:100:ASN:OD1
|
A:105:MET:HG2
|
0.48
|
4
|
1
|
|
A:355:ILE:HG23
|
A:411:VAL:HG22
|
0.48
|
2
|
1
|
|
A:161:GLY:CA
|
A:190:ALA:HB1
|
0.48
|
8
|
1
|
|
A:120:VAL:HG22
|
A:123:ARG:HH21
|
0.48
|
9
|
1
|
|
A:324:TRP:CE3
|
A:328:LEU:CD1
|
0.48
|
8
|
1
|
Torsion angles: Protein backbone ?
In the following table, Ramachandran outliers are listed. The Analysed column shows the number of residues for which the backbone conformation was analysed.
| Model ID | Analysed | Favored | Allowed | Outliers |
|---|---|---|---|---|
|
1
|
432
|
404
|
23
|
5
|
|
2
|
432
|
405
|
19
|
8
|
|
3
|
432
|
408
|
14
|
10
|
|
4
|
432
|
421
|
10
|
1
|
|
5
|
432
|
407
|
16
|
9
|
|
6
|
432
|
407
|
19
|
6
|
|
7
|
432
|
414
|
14
|
4
|
|
8
|
432
|
410
|
20
|
2
|
|
9
|
432
|
406
|
23
|
3
|
|
10
|
432
|
413
|
17
|
2
|
| Chain | Res | Type | Models (Total) |
|---|---|---|---|
|
A
|
161
|
GLY
|
3
|
|
A
|
323
|
ASN
|
3
|
|
A
|
103
|
ALA
|
2
|
|
A
|
105
|
MET
|
2
|
|
A
|
159
|
GLU
|
2
|
|
A
|
160
|
ALA
|
2
|
|
A
|
162
|
PHE
|
2
|
|
A
|
195
|
CYS
|
2
|
|
A
|
196
|
GLY
|
2
|
|
A
|
244
|
ASP
|
2
|
|
A
|
327
|
ASN
|
2
|
|
A
|
417
|
GLY
|
2
|
|
A
|
41
|
PRO
|
1
|
|
A
|
102
|
ALA
|
1
|
|
A
|
106
|
TYR
|
1
|
|
A
|
107
|
PRO
|
1
|
|
A
|
108
|
ASP
|
1
|
|
A
|
192
|
VAL
|
1
|
|
A
|
193
|
LYS
|
1
|
|
A
|
197
|
HIS
|
1
|
|
A
|
200
|
GLY
|
1
|
|
A
|
242
|
THR
|
1
|
|
A
|
245
|
CYS
|
1
|
|
A
|
293
|
PRO
|
1
|
|
A
|
322
|
PHE
|
1
|
|
A
|
325
|
GLN
|
1
|
|
A
|
352
|
LEU
|
1
|
|
A
|
354
|
GLY
|
1
|
|
A
|
355
|
ILE
|
1
|
|
A
|
356
|
HIS
|
1
|
|
A
|
358
|
MET
|
1
|
|
A
|
390
|
ALA
|
1
|
|
A
|
418
|
GLY
|
1
|
|
A
|
421
|
SER
|
1
|
|
A
|
428
|
SER
|
1
|
|
A
|
431
|
GLU
|
1
|
Torsion angles : Protein sidechains ?
In the following table, sidechain rotameric outliers are listed. The Analysed column shows the number of residues for which the sidechain conformation was analysed.| Model ID | Analysed | Favored | Allowed | Outliers |
|---|---|---|---|---|
|
1
|
343
|
332
|
6
|
5
|
|
2
|
343
|
335
|
4
|
4
|
|
3
|
343
|
323
|
4
|
16
|
|
4
|
343
|
333
|
7
|
3
|
|
5
|
343
|
331
|
5
|
7
|
|
6
|
343
|
328
|
10
|
5
|
|
7
|
343
|
332
|
7
|
4
|
|
8
|
343
|
333
|
8
|
2
|
|
9
|
343
|
330
|
9
|
4
|
|
10
|
343
|
331
|
5
|
7
|
| Chain | Res | Type | Models (Total) |
|---|---|---|---|
|
A
|
259
|
SER
|
9
|
|
A
|
419
|
THR
|
6
|
|
A
|
184
|
HIS
|
5
|
|
A
|
429
|
THR
|
4
|
|
A
|
192
|
VAL
|
3
|
|
A
|
423
|
THR
|
3
|
|
A
|
93
|
TRP
|
2
|
|
A
|
420
|
SER
|
2
|
|
A
|
422
|
VAL
|
2
|
|
A
|
72
|
LEU
|
1
|
|
A
|
73
|
THR
|
1
|
|
A
|
104
|
SER
|
1
|
|
A
|
110
|
SER
|
1
|
|
A
|
159
|
GLU
|
1
|
|
A
|
165
|
VAL
|
1
|
|
A
|
197
|
HIS
|
1
|
|
A
|
234
|
ASP
|
1
|
|
A
|
265
|
THR
|
1
|
|
A
|
266
|
HIS
|
1
|
|
A
|
275
|
ARG
|
1
|
|
A
|
287
|
TRP
|
1
|
|
A
|
299
|
ARG
|
1
|
|
A
|
321
|
SER
|
1
|
|
A
|
324
|
TRP
|
1
|
|
A
|
352
|
LEU
|
1
|
|
A
|
355
|
ILE
|
1
|
|
A
|
382
|
VAL
|
1
|
|
A
|
408
|
PHE
|
1
|
|
A
|
413
|
THR
|
1
|
|
A
|
428
|
SER
|
1
|