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All-Atom
Contacts
Clashscore, all atoms:108.42 0th percentile* (N=1784, 0Å - 9999Å)
Clashscore is the number of serious steric overlaps (> 0.4 Å) per 1000 atoms.
Protein
Geometry
Rotamer outliers11.18% Goal: <1%
Ramachandran outliers1.65% Goal: <0.2%
Ramachandran favored93.96% Goal: >98%
Cβ deviations >0.25Å38 Goal: 0
MolProbity score3.705th percentile* (N=27675, 0Å - 99Å)
Residues with bad bonds:20.97% Goal: <5%
Residues with bad angles:15.59% Goal: <5%
* 100th percentile is the best among structures of comparable resolution; 0th percentile is the worst.

#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
1 VAL01.674Å
CG2 with 1 VAL CA
-1.7% (p)
chi angles: 83.9
0.872Å2 OUTLIER(S)
worst is N--CA: -37.573 σ
1 OUTLIER(S)
worst is CA-C-O: 8.701 σ
2 ARG0-Favored (2.11%)
General case / -123.3,-52.9
31.3% (ttt-85)
chi angles: 170.7,194.2,186.9,245.1
0.24Å2 OUTLIER(S)
worst is C--N: -18.522 σ
1 OUTLIER(S)
worst is O-C-N: -15.93 σ
3 SER0-Favored (62.06%)
General case / -112.6,126.6
0%
chi angles: 10.3
0.049Å1 OUTLIER(S)
worst is C--N: -6.271 σ
1 OUTLIER(S)
worst is O-C-N: -4.428 σ
4 LEU00.406Å
O with 131 GLN HA
Favored (44.5%)
General case / -99.4,135.1
1.3% (tp)
chi angles: 209.6,27.1
0.104Å1 OUTLIER(S)
worst is C--N: -15.463 σ
2 OUTLIER(S)
worst is C-N-CA: 5.206 σ
5 ASN0-Favored (50.59%)
General case / -125.7,146.4
73.9% (m-20)
chi angles: 303.1,303
0.031Å--
6 CYS00.574Å
HB2 with 133 LEU HD12
Favored (59.9%)
General case / -128.6,133.2
45.2% (m)
chi angles: 283.1
0.175Å--
7 ILE0-Favored (54.58%)
General case / -122.8,121.3
17% (tt)
chi angles: 190.4,161.4
0.169Å--
8 VAL0-Favored (39.78%)
General case / -144.2,148.7
9.6% (p)
chi angles: 68
0.046Å--
9 ALA0-Favored (52.01%)
General case / -112.8,118.5
-0.112Å--
10 VAL0-Favored (50.76%)
General case / -121.2,141.9
28.5% (m)
chi angles: 295.3
0.045Å--
11 CYS01.518Å
CA with 11 CYS CB
Favored (9.5%)
General case / -84.1,174.5
14.6% (p)
chi angles: 74.9
0.985Å--
12 GLN0-Favored (69.28%)
General case / -58.8,-31.2
2% (tt0)
chi angles: 232.9,174.4,17.6
0.125Å--
13 ASN00.494Å
OD1 with 11 CYS SG
Favored (8.42%)
General case / -87.5,15.3
7.5% (p-10)
chi angles: 65,281.7
0.4Å--
14 MET0-Favored (10.09%)
General case / 66.0,23.7
0%
chi angles: 256.4,3.3,239.4
0.147Å--
15 GLY0-Favored (14.5%)
Glycine / -92.2,145.5
----
16 ILE00.623Å
HD11 with 118 SER OG
Favored (5.51%)
General case / -120.0,-24.2
35.7% (pt)
chi angles: 62.1,164.8
0.157Å--
17 GLY0-Favored (23.18%)
Glycine / -145.4,156.6
----
18 LYS01.085Å
NZ with 18 LYS HE3
Favored (21.98%)
General case / -138.9,124.8
10.5% (tttt)
chi angles: 185.8,127.9,178.7,167.3
0.125Å1 OUTLIER(S)
worst is C--N: -5.186 σ
-
19 ASP01.309Å
CB with 19 ASP CA
Allowed (0.65%)
General case / 33.7,49.6
80.4% (m-20)
chi angles: 292.6,145.4
0.855Å1 OUTLIER(S)
worst is C--N: -4.394 σ
1 OUTLIER(S)
worst is O-C-N: -4.842 σ
20 GLY0-Favored (9.79%)
Glycine / 93.4,-31.0
--2 OUTLIER(S)
worst is C--O: -11.158 σ
-
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
21 ASN00.413Å
CG with 22 LEU H
Favored (2.87%)
General case / -115.7,-176.6
15.9% (t30)
chi angles: 208.9,52.1
0.481Å1 OUTLIER(S)
worst is C--N: -7.927 σ
1 OUTLIER(S)
worst is O-C-N: -6.564 σ
22 LEU00.413Å
H with 21 ASN CG
Favored (75.33%)
Pre-proline / -81.3,145.7
75.9% (mt)
chi angles: 295.2,182.2
0.082Å--
23 PRO0-Favored (38.27%)
Proline / -65.9,-36.6
31.7% (Cg_exo)
chi angles: 339.1
0.063Å--
24 TRP0-Favored (33.91%)
Pre-proline / -94.9,146.0
21.5% (p90)
chi angles: 46.2,85
0.072Å--
25 PRO0-Favored (9.28%)
Proline / -62.6,173.1
48.8% (Cg_exo)
chi angles: 337
0.061Å1 OUTLIER(S)
worst is C--O: -9.034 σ
-
26 PRO01.392Å
C with 27 LEU N
Favored (14.11%)
Proline / -60.3,121.8
6.1% (Cg_exo)
chi angles: 357.2
0.107Å1 OUTLIER(S)
worst is C--N: 15.761 σ
1 OUTLIER(S)
worst is O-C-N: -8.947 σ
27 LEU01.392Å
N with 26 PRO C
Favored (26.88%)
General case / -109.3,109.8
82.1% (mt)
chi angles: 296.6,169.7
0.047Å1 OUTLIER(S)
worst is C--N: 19.528 σ
3 OUTLIER(S)
worst is O-C-N: 11.885 σ
28 ARG01.538Å
CB with 28 ARG CD
Favored (99.8%)
General case / -62.9,-42.5
5.5% (ttt180)
chi angles: 239,183.5,180.6,167.1
0.071Å--
29 ASN0-Favored (77.42%)
General case / -70.2,-36.9
66% (m-80)
chi angles: 289.3,280.8
0.109Å--
30 GLU00.522Å
HG2 with 136 THR HG21
Favored (87.4%)
General case / -62.4,-47.2
2.1% (tm-20)
chi angles: 204.8,295.4,113.5
0.081Å--
31 PHE0-Favored (88.87%)
General case / -61.3,-38.5
11.1% (m-30)
chi angles: 283.7,1.8
0.163Å--
32 LYS0-Favored (88.3%)
General case / -58.6,-43.2
8.9% (mttp)
chi angles: 289.5,193.8,222.1,101.5
0.096Å--
33 TYR0-Favored (85.17%)
General case / -62.3,-47.8
69.6% (t80)
chi angles: 170,77.8
0.195Å--
34 PHE0-Favored (76.89%)
General case / -57.0,-49.1
58.6% (t80)
chi angles: 168,76.4
0.109Å--
35 GLN0-Favored (78.84%)
General case / -64.2,-48.5
0%
chi angles: 241.3,205.9,169.9
0.028Å--
36 ARG0-Favored (78.76%)
General case / -62.5,-49.4
57.4% (ttp85)
chi angles: 175.9,186.7,50.2,84.7
0.076Å--
37 MET0-Favored (97.52%)
General case / -62.3,-44.0
98.2% (mmm)
chi angles: 297,295.7,291.1
0.096Å--
38 THR0-Favored (66.41%)
General case / -73.9,-32.2
82.3% (p)
chi angles: 60.7
0.172Å--
39 THR0-Favored (56.66%)
General case / -76.9,-39.2
5.6% (m)
chi angles: 285.1
0.325Å--
40 THR0-Favored (36.38%)
General case / -71.8,128.3
41.2% (m)
chi angles: 305.6
0.081Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
41 SER0-Favored (19.28%)
General case / -110.3,159.6
36.5% (t)
chi angles: 175.9
0.092Å--
42 SER00.799Å
CA with 42 SER CB
Favored (30.38%)
General case / -100.8,-1.2
11.6% (p)
chi angles: 83
1.252Å1 OUTLIER(S)
worst is C--N: -10.664 σ
1 OUTLIER(S)
worst is O-C-N: -5.255 σ
43 VAL00.597Å
O with 44 GLU C
Favored (2.46%)
General case / -129.3,88.5
72% (t)
chi angles: 179.4
0.374Å-1 OUTLIER(S)
worst is CA-C-O: 4.435 σ
44 GLU00.781Å
HG3 with 44 GLU C
Favored (19.45%)
General case / -53.2,140.8
9% (tp10)
chi angles: 177.6,76.3,66.4
0.218Å3 OUTLIER(S)
worst is C--N: -16.09 σ
3 OUTLIER(S)
worst is CA-C-N: -10.432 σ
45 GLY0-Favored (27.67%)
Glycine / 88.4,-23.0
--1 OUTLIER(S)
worst is C--N: 13.201 σ
3 OUTLIER(S)
worst is O-C-N: -12.018 σ
46 LYS00.577Å
HE2 with 107 ASP O
Favored (19.53%)
General case / -90.0,151.7
71.8% (mttt)
chi angles: 290.6,187.8,159.2,195.1
0.035Å1 OUTLIER(S)
worst is C--N: -8.254 σ
-
47 GLN00.413Å
O with 109 VAL HA
Favored (28.29%)
General case / -112.1,152.7
60.2% (mt-30)
chi angles: 273.5,175.4,334.7
0.093Å--
48 ASN0-Favored (26.23%)
General case / -81.8,154.3
76.9% (m-20)
chi angles: 287.7,311.6
0.047Å--
49 ALA0-Favored (45.74%)
General case / -102.0,135.5
-0.375Å--
50 VAL0-Favored (60.41%)
General case / -117.1,124.5
10.4% (m)
chi angles: 287.5
0.112Å--
51 ILE0-Favored (62.17%)
General case / -112.2,130.1
76.8% (mt)
chi angles: 302.4,171.8
0.128Å--
52 MET00.445Å
SD with 57 TRP HE3
Favored (42.63%)
General case / -142.4,150.9
13% (ptp)
chi angles: 75.5,184.1,89.5
0.475Å--
53 GLY0-Favored (42.83%)
Glycine / -69.5,169.7
----
54 ARG0-Favored (89.45%)
General case / -65.7,-44.3
55.1% (ttt-85)
chi angles: 191.6,181.6,194.2,258.9
0.226Å--
55 LYS01.333Å
CD with 55 LYS NZ
Favored (86.18%)
General case / -67.7,-41.9
11% (tttp)
chi angles: 199.7,179.6,203.1,26.5
0.083Å--
56 THR0-Favored (88.13%)
General case / -58.8,-45.8
97.5% (m)
chi angles: 299.3
0.06Å--
57 TRP00.445Å
HE3 with 52 MET SD
Favored (84.55%)
General case / -57.7,-43.8
73.9% (t-105)
chi angles: 181.1,247.1
0.02Å--
58 PHE01.396Å
CD1 with 58 PHE CB
Favored (62.51%)
General case / -72.9,-20.7
8.6% (m-85)
chi angles: 291.4,63.3
0.148Å--
59 SER01.113Å
OG with 59 SER HB2
Favored (73.76%)
General case / -70.7,-34.0
0.1%
chi angles: 18.1
0.04Å--
60 ILE0-Favored (73.5%)
Pre-proline / -69.3,121.2
97.1% (mt)
chi angles: 295.8,170.5
0.101Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
61 PRO0-Favored (33.23%)
Proline / -51.0,143.9
87.3% (Cg_exo)
chi angles: 330.1
0.093Å-1 OUTLIER(S)
worst is C-N-CA: 4.962 σ
62 GLU0-Favored (70.59%)
General case / -55.4,-38.6
27.1% (tt0)
chi angles: 195.2,184.6,100.9
0.048Å--
63 LYS01.341Å
C with 63 LYS CB
Favored (64.41%)
General case / -64.0,-18.1
0.4%
chi angles: 22.4,220.3,195.9,180
1.51Å--
64 ASN01.204Å
OD1 with 63 LYS HG3
Favored (20.01%)
General case / -102.3,17.6
74.8% (m-20)
chi angles: 298.1,344.2
0.057Å--
65 ARG0-Favored (35.92%)
Pre-proline / -109.9,125.5
68.6% (mtt180)
chi angles: 292.6,175.5,193,138.2
0.214Å--
66 PRO0-Favored (26.48%)
Proline / -80.4,162.9
14.6% (Cg_endo)
chi angles: 39.4
0.027Å--
67 LEU00.59Å
H with 72 ASN HD21
Allowed (1.54%)
General case / -60.3,108.5
87.1% (mt)
chi angles: 289.7,171.8
0.048Å--
68 LYS01.51Å
CB with 68 LYS CD
Favored (5.28%)
General case / -46.8,139.1
1%
chi angles: 111.3,186.3,166.3,211.4
0.078Å-1 OUTLIER(S)
worst is O-C-N: 4.24 σ
69 ASP0-Favored (8.64%)
General case / 62.8,19.2
68.6% (m-20)
chi angles: 296.6,126.7
0.117Å--
70 ARG0-Favored (52.28%)
General case / -135.6,157.3
39.1% (mtm180)
chi angles: 284.7,150.3,284.1,193.4
0.125Å--
71 ILE0-Favored (44.19%)
General case / -93.2,127.4
59.9% (mt)
chi angles: 295.6,159.3
0.074Å--
72 ASN00.59Å
HD21 with 67 LEU H
Favored (53.28%)
General case / -104.1,120.3
19.4% (m120)
chi angles: 291.6,91.4
0.434Å--
73 ILE00.582Å
HG12 with 88 TYR HB2
Favored (54.17%)
General case / -116.2,120.1
79.1% (mt)
chi angles: 298.5,176.6
0.042Å--
74 VAL0-Favored (36.32%)
General case / -98.8,139.5
60% (t)
chi angles: 181.7
0.103Å--
75 LEU00.492Å
CD2 with 90 ALA HB3
Favored (53.29%)
General case / -102.0,132.0
75.8% (mt)
chi angles: 296.7,183
0.016Å--
76 SER0-Favored (3.87%)
General case / -166.5,138.6
33% (t)
chi angles: 183.9
0.064Å--
77 ARG01.399Å
NH1 with 77 ARG NE
Favored (18.23%)
General case / -86.8,-38.5
31.7% (mtt85)
chi angles: 295.2,154.7,193.2,116.8
0.135Å--
78 GLU0-Favored (8.09%)
General case / -67.5,-57.9
88.1% (mt-10)
chi angles: 300,174.7,151.5
0.191Å1 OUTLIER(S)
worst is C--N: -6.116 σ
1 OUTLIER(S)
worst is CA-C-O: -4.263 σ
79 LEU0-Favored (40.07%)
General case / -72.5,151.9
85.4% (mt)
chi angles: 298.7,172
0.094Å--
80 LYS00.746Å
CA with 80 LYS CB
Favored (3.33%)
General case / -115.1,-41.7
6.5% (tptt)
chi angles: 220.9,65.7,202,205.4
1.417Å2 OUTLIER(S)
worst is C--N: -4.651 σ
1 OUTLIER(S)
worst is N-CA-C: 4.413 σ
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
81 GLU01.516Å
CA with 81 GLU CB
Favored (51.05%)
Pre-proline / -87.0,157.1
34.7% (tt0)
chi angles: 180,175.7,103.6
0.932Å1 OUTLIER(S)
worst is C--N: -11.955 σ
-
82 PRO00.658Å
O with 83 PRO C
Allowed (1.19%)
Proline / -72.4,86.8
99.7% (Cg_exo)
chi angles: 329.5
0.02Å1 OUTLIER(S)
worst is C--N: 16.052 σ
1 OUTLIER(S)
worst is C-N-CA: 11.63 σ
83 PRO00.658Å
C with 82 PRO O
Allowed (0.47%)
Proline / -34.7,118.4
6.1% (Cg_endo)
chi angles: 8.6
0.084Å2 OUTLIER(S)
worst is C--O: -8.855 σ
1 OUTLIER(S)
worst is C-N-CA: -4.423 σ
84 LYS0-OUTLIER (0.03%)
General case / -17.7,124.7
21.7% (tptt)
chi angles: 178.2,37.8,187.7,160.7
0.202Å1 OUTLIER(S)
worst is C--N: 4.003 σ
-
85 GLY0-Favored (20.96%)
Glycine / 99.2,-28.2
---1 OUTLIER(S)
worst is C-N-CA: 7.932 σ
86 ALA0-Favored (47.54%)
General case / -68.0,146.8
-0.075Å--
87 HIS0-Favored (43.59%)
General case / -73.5,-48.8
62.7% (m80)
chi angles: 300.8,101.8
0.07Å--
88 TYR01.28Å
CG with 88 TYR CE2
Favored (46.11%)
General case / -140.7,153.8
67.9% (m-85)
chi angles: 304.5,89.7
0.05Å--
89 LEU0-Favored (62.55%)
General case / -120.2,133.2
0.1%
chi angles: 179.3,4.5
0.067Å--
90 ALA00.492Å
HB3 with 75 LEU CD2
Favored (54.01%)
General case / -131.0,152.0
-0.248Å--
91 LYS0-Favored (27.17%)
General case / -89.9,-17.2
3.3% (mttp)
chi angles: 280.1,133.7,213.9,99.4
0.28Å--
92 SER0-Favored (24.13%)
General case / -152.9,168.1
85.5% (p)
chi angles: 61.2
0.056Å--
93 LEU00.658Å
HB3 with 123 GLU OE2
Favored (94.85%)
General case / -64.4,-39.0
59% (tp)
chi angles: 182.3,62
0.114Å--
94 ASP00.751Å
HB3 with 98 LYS NZ
Favored (69.16%)
General case / -53.3,-45.0
1.2% (m-20)
chi angles: 276.2,78.2
0.103Å--
95 ASP00.591Å
HA with 98 LYS HD2
Favored (96.58%)
General case / -63.7,-39.8
71.8% (m-20)
chi angles: 288.4,142.8
0.064Å--
96 ALA01.468Å
C with 97 LEU N
Favored (72.32%)
General case / -64.4,-50.4
-0.045Å--
97 LEU01.468Å
N with 96 ALA C
Favored (2.71%)
General case / -60.8,-5.0
66.4% (mt)
chi angles: 286.3,168.2
0.106Å2 OUTLIER(S)
worst is C--N: 16.359 σ
-
98 LYS01.623Å
CA with 98 LYS CB
Favored (10.98%)
General case / -90.2,-45.9
60% (mttp)
chi angles: 291.5,188,182.9,71.1
0.641Å-3 OUTLIER(S)
worst is O-C-N: -14.757 σ
99 LEU00.513Å
HG with 105 LEU HD12
Favored (90.41%)
General case / -59.1,-43.5
59.3% (tp)
chi angles: 180.8,64.1
0.104Å--
100 LEU01.037Å
HD23 with 105 LEU HD13
Favored (90.99%)
General case / -60.7,-40.0
97.7% (mt)
chi angles: 293.9,172.9
0.455Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
101 GLU01.434Å
CA with 101 GLU CB
Favored (67.49%)
General case / -67.6,-22.0
4.6% (tp10)
chi angles: 202.7,81,66.3
0.564Å--
102 SER01.469Å
CA with 102 SER CB
Favored (95.01%)
Pre-proline / -63.3,142.9
4.7% (p)
chi angles: 88.4
0.611Å--
103 PRO0-Favored (2.68%)
Proline / -40.8,-58.2
52.1% (Cg_exo)
chi angles: 336.2
0.094Å1 OUTLIER(S)
worst is C--N: -4.604 σ
-
104 GLU01.268Å
HG2 with 102 SER OG
Favored (4.15%)
General case / -43.3,-38.8
3.4% (pt-20)
chi angles: 39.4,201,78.5
0.579Å1 OUTLIER(S)
worst is C--N: 4.087 σ
-
105 LEU01.037Å
HD13 with 100 LEU HD23
Favored (10.78%)
General case / -92.5,-44.5
23.8% (mt)
chi angles: 282.3,182.4
0.227Å--
106 LYS00.647Å
NZ with 101 GLU OE1
Favored (7.83%)
General case / -43.7,-45.2
4.4% (tppt?)
chi angles: 195.1,71.2,112.5,163.8
0.367Å--
107 ASP00.577Å
O with 46 LYS HE2
Favored (72.4%)
General case / -70.5,-32.5
5.3% (p-10)
chi angles: 73.6,109.5
0.154Å--
108 LYS00.487Å
NZ with 104 GLU O
Favored (22.75%)
General case / -89.6,-23.8
46.9% (mttp)
chi angles: 287.4,171.1,192.8,69.2
0.433Å--
109 VAL00.413Å
HA with 47 GLN O
Favored (36.85%)
General case / -104.5,140.9
87.5% (t)
chi angles: 175.1
0.134Å--
110 ASP0-Allowed (0.6%)
General case / -104.9,-78.8
25% (t0)
chi angles: 183,44.6
0.132Å--
111 MET0-Favored (22.28%)
General case / -102.4,152.5
66.2% (mtm)
chi angles: 298.7,185.7,274.2
0.046Å--
112 VAL0-Favored (37.45%)
General case / -113.3,114.7
61.8% (t)
chi angles: 181.5
0.036Å--
113 TRP0-Favored (62.43%)
General case / -118.3,126.5
94.5% (m95)
chi angles: 293.4,91
0.191Å--
114 ILE01.171Å
CD1 with 114 ILE CB
Favored (38.73%)
General case / -91.4,122.6
0.9%
chi angles: 305,238.5
0.233Å--
115 VAL0-Favored (4.29%)
General case / -118.2,37.3
35.7% (m)
chi angles: 297.8
0.132Å--
116 GLY0-Favored (15.14%)
Glycine / 113.3,153.7
--1 OUTLIER(S)
worst is CA--C: -5.888 σ
-
117 GLY0-OUTLIER (0%)
Glycine / -7.9,155.7
--1 OUTLIER(S)
worst is N--CA: -23.133 σ
4 OUTLIER(S)
worst is C-N-CA: 17.153 σ
118 SER00.623Å
OG with 16 ILE HD11
Favored (60.26%)
General case / -51.3,-48.8
9.2% (m)
chi angles: 311.8
0.57Å--
119 SER01.607Å
CB with 119 SER CA
Favored (80.76%)
General case / -64.2,-34.4
55.7% (p)
chi angles: 73.4
0.896Å--
120 VAL0-Favored (73.45%)
General case / -68.9,-46.2
18.6% (t)
chi angles: 189.2
0.094Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
121 TYR01.331Å
CD2 with 121 TYR CB
Favored (88.02%)
General case / -58.5,-43.6
2.7% (m-30)
chi angles: 288.1,30.8
0.046Å--
122 LYS0-Favored (78.55%)
General case / -57.1,-48.3
33% (tttt)
chi angles: 188.1,171.5,171.2,216.1
0.033Å--
123 GLU00.658Å
OE2 with 93 LEU HB3
Favored (97.26%)
General case / -64.5,-40.5
40.4% (tt0)
chi angles: 197.4,181,142.6
0.079Å--
124 ALA0-Favored (91.03%)
General case / -66.2,-42.7
-0.047Å--
125 MET01.101Å
SD with 125 MET HE1
Favored (73.12%)
General case / -63.6,-30.1
51.7% (mtp)
chi angles: 292.9,184.1,48.1
0.108Å--
126 GLU0-Favored (41.28%)
General case / -81.0,-22.1
86.4% (mt-10)
chi angles: 282.3,181.9,162.2
0.669Å--
127 LYS0-Favored (91.37%)
Pre-proline / -75.3,142.8
16% (mmtp)
chi angles: 316.8,277.4,197.6,82.5
0.116Å--
128 PRO00.566Å
O with 129 ILE HG22
Favored (2.38%)
Proline / -80.8,82.5
84% (Cg_endo)
chi angles: 33
0.031Å1 OUTLIER(S)
worst is C--O: -16.195 σ
-
129 ILE00.566Å
HG22 with 128 PRO O
Favored (31.52%)
General case / -153.2,163.3
0%
chi angles: 128.5,151.7
0.202Å1 OUTLIER(S)
worst is C--N: -5.226 σ
2 OUTLIER(S)
worst is O-C-N: -13.63 σ
130 ASN00.534Å
N with 129 ILE HG13
Favored (19.12%)
General case / -63.0,123.5
1.5% (m-80)
chi angles: 287.5,228.6
0.423Å1 OUTLIER(S)
worst is C--N: -6.222 σ
-
131 GLN00.406Å
HA with 4 LEU O
Favored (25.24%)
General case / -142.7,133.5
0%
chi angles: 185,24.5,118.7
0.169Å--
132 ARG00.505Å
HG2 with 183 GLU HG3
Favored (49.9%)
General case / -110.6,117.5
0%
chi angles: 285.8,196.6,222.7,20.4
0.072Å--
133 LEU00.574Å
HD12 with 6 CYS HB2
Favored (22.98%)
General case / -102.8,107.1
6% (tp)
chi angles: 206.3,79.9
0.257Å--
134 PHE0-Favored (17.08%)
General case / -90.5,103.4
88.9% (m-85)
chi angles: 291.6,85.6
0.06Å--
135 VAL0-Favored (45.48%)
General case / -107.7,116.3
90.5% (t)
chi angles: 175.4
0.105Å--
136 THR00.522Å
HG21 with 30 GLU HG2
Favored (19.53%)
General case / -90.2,105.9
24.7% (m)
chi angles: 309
0.05Å--
137 ARG0-Favored (16.09%)
General case / -84.5,106.7
23.2% (mmt180)
chi angles: 282.9,276.2,187.2,202.7
0.097Å--
138 ILE0-Favored (17.33%)
General case / -83.8,109.1
0.9%
chi angles: 301.9,230.6
0.096Å--
139 LEU00.878Å
O with 140 GLN HB3
Allowed (0.44%)
General case / -77.8,39.3
49.4% (mt)
chi angles: 294.3,186
0.413Å--
140 GLN00.878Å
HB3 with 139 LEU O
Favored (30.4%)
General case / -156.1,158.6
20.5% (pt20)
chi angles: 70.2,188,86.4
0.836Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
141 GLU0-Favored (34.51%)
General case / -92.9,139.1
33.9% (mt-10)
chi angles: 283.7,172,89.8
0.072Å--
142 PHE0-Favored (49.63%)
General case / -134.6,147.2
90.2% (m-85)
chi angles: 290.9,90.4
0.092Å--
143 GLU01.27Å
OE1 with 143 GLU CG
Favored (21.42%)
General case / -64.9,123.9
0%
chi angles: 121.8,191.1,319.7
0.107Å--
144 SER0-Favored (55.1%)
General case / -133.3,153.6
28.9% (m)
chi angles: 304.2
0.087Å--
145 ASP0-Favored (6%)
General case / -120.9,-20.3
5.1% (p30)
chi angles: 61.1,47.3
0.098Å--
146 THR01.153Å
CG2 with 146 THR CA
Favored (62.72%)
General case / -122.0,127.6
0.5%
chi angles: 245.1
0.025Å--
147 PHE0-Favored (39.39%)
General case / -121.1,152.4
96% (m-85)
chi angles: 293.2,89.3
0.098Å--
148 PHE00.566Å
HE1 with 121 TYR HD2
Favored (58.89%)
Pre-proline / -87.1,133.6
71% (t80)
chi angles: 186.4,74.1
0.184Å--
149 PRO0-Favored (61.08%)
Proline / -60.5,154.2
3.4% (Cg_exo)
chi angles: 353.4
0.041Å--
150 GLU01.295Å
CG with 150 GLU CA
Favored (54.33%)
General case / -60.8,139.2
1.4% (mt-10)
chi angles: 336.3,199.9,116.6
0.012Å-1 OUTLIER(S)
worst is CA-C-N: -4.105 σ
151 ILE00.929Å
CB with 151 ILE CA
Favored (21.6%)
General case / -87.7,110.7
89.3% (mt)
chi angles: 294.4,174.1
1.129Å--
152 ASP0-Allowed (1.54%)
General case / -70.1,97.2
10.5% (t0)
chi angles: 187.2,124.2
0.116Å--
153 LEU00.619Å
HD23 with 156 PHE O
Favored (9.96%)
General case / -68.5,-2.5
10.4% (mt)
chi angles: 280.9,152.1
0.687Å--
154 LYS0-Favored (27.77%)
General case / -83.1,-31.4
25.6% (mtmm)
chi angles: 317.5,175.4,300.2,299.7
0.576Å--
155 SER01.202Å
CB with 155 SER OG
Favored (6.68%)
General case / -80.9,-54.8
33.2% (m)
chi angles: 287
0.15Å--
156 PHE01.232Å
CZ with 156 PHE CD1
Favored (35.79%)
General case / -86.1,125.8
46.3% (m-85)
chi angles: 281.5,99.2
0.462Å--
157 LYS00.514Å
HG2 with 183 GLU O
Favored (55%)
General case / -103.5,121.6
0.1%
chi angles: 43.8,210.8,106.7,171.4
0.025Å--
158 LEU01.316Å
CD2 with 158 LEU CB
Favored (14.78%)
General case / -67.2,120.0
0.1%
chi angles: 183,344.8
0.083Å--
159 LEU0-OUTLIER (0%)
Pre-proline / -99.4,-147.5
61.6% (mt)
chi angles: 306.7,178.6
0.061Å1 OUTLIER(S)
worst is C--O: -5.784 σ
-
160 PRO01.077Å
C with 161 GLU N
-50.7% (Cg_exo)
chi angles: 335.3
0.052Å-3 OUTLIER(S)
worst is O-C-N: -29.131 σ
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
161 GLU01.077Å
N with 160 PRO C
-0.1%
chi angles: 112.3,214.6,1
0.101Å--
162 TYR0-Favored (12.78%)
Pre-proline / -156.4,143.1
67.8% (t80)
chi angles: 186.2,83
0.115Å--
163 PRO0-Favored (3.03%)
Proline / -50.9,112.2
1.7% (Cg_endo)
chi angles: 2.2
0.119Å--
164 GLY0-Favored (65.21%)
Glycine / 88.4,14.2
----
165 VAL0-Favored (45.22%)
Pre-proline / -117.1,113.5
60.2% (t)
chi angles: 171
0.116Å--
166 PRO0-Favored (4.95%)
Proline / -53.4,113.7
38.3% (Cg_exo)
chi angles: 338
0.113Å1 OUTLIER(S)
worst is C--N: 16.266 σ
3 OUTLIER(S)
worst is C-N-CA: 18.385 σ
167 SER0-Favored (8.13%)
General case / -67.3,-2.7
61.7% (p)
chi angles: 56.4
1.098Å2 OUTLIER(S)
worst is C--N: -32.123 σ
3 OUTLIER(S)
worst is O-C-N: -13.999 σ
168 ASP0-Favored (12.7%)
General case / -89.2,168.8
0%
chi angles: 16.5,211.4
0.032Å1 OUTLIER(S)
worst is C--N: -4.741 σ
-
169 VAL00.963Å
HG22 with 178 LYS HB3
Favored (39.15%)
General case / -89.9,127.1
61.1% (t)
chi angles: 181.3
0.702Å--
170 GLN0-Favored (26.18%)
General case / -102.9,148.1
1.7% (mm-40)
chi angles: 309.7,298.1,245.8
0.157Å--
171 GLU0-Favored (45.82%)
General case / -131.2,125.6
85.6% (tt0)
chi angles: 185.5,177.2,171
0.101Å2 OUTLIER(S)
worst is C--N: -5.911 σ
-
172 GLU0-Favored (35.34%)
General case / -136.6,130.4
78.1% (tt0)
chi angles: 187.6,176.1,163.7
0.106Å1 OUTLIER(S)
worst is C--N: 4.245 σ
-
173 ASN00.557Å
ND2 with 26 PRO O
Favored (17.31%)
General case / 60.5,32.8
1.1% (m-80)
chi angles: 298.8,234.3
0.132Å-2 OUTLIER(S)
worst is O-C-N: 6.264 σ
174 GLY0-Favored (64.78%)
Glycine / 72.3,6.1
----
175 ILE01.334Å
CD1 with 175 ILE CB
Favored (25.88%)
General case / -105.0,109.0
12.4% (mt)
chi angles: 303.1,191.9
0.098Å1 OUTLIER(S)
worst is C--N: 5.238 σ
1 OUTLIER(S)
worst is C-N-CA: 4.481 σ
176 GLN01.551Å
CB with 176 GLN CA
Favored (42.58%)
General case / -76.0,137.7
53.4% (mt-30)
chi angles: 306.4,168.5,292.3
0.709Å--
177 TYR00.423Å
O with 169 VAL HG13
Favored (37.92%)
General case / -145.5,149.6
39.3% (p90)
chi angles: 53.8,92.2
0.058Å--
178 LYS00.963Å
HB3 with 169 VAL HG22
Favored (51.74%)
General case / -130.5,148.8
32% (pttt)
chi angles: 55,163,164.7,162.3
0.156Å--
179 PHE01.4Å
CD2 with 179 PHE CB
Favored (44%)
General case / -99.5,119.2
0.1%
chi angles: 305.1,223
0.031Å--
180 GLU0-Favored (45.92%)
General case / -122.3,146.2
64.1% (mt-10)
chi angles: 300.4,177.5,27.1
0.088Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 0.00Clashscore: 108.42Outliers: 3 of 182Outliers: 19 of 170Outliers: 38 of 176Outliers: 39 of 186Outliers: 29 of 186
181 VAL0-Favored (56.74%)
General case / -118.9,121.5
21.9% (t)
chi angles: 187.6
0.05Å--
182 TYR00.542Å
HB2 with 133 LEU HB3
Favored (59.58%)
General case / -109.9,122.2
76% (m-85)
chi angles: 287.8,85.2
0.146Å--
183 GLU00.514Å
O with 157 LYS HG2
Favored (60.85%)
General case / -108.1,126.4
27.3% (tt0)
chi angles: 191.3,190.1,92.4
0.282Å1 OUTLIER(S)
worst is C--N: -6.377 σ
-
184 LYS01.145Å
NZ with 184 LYS CD
Favored (60.27%)
General case / -107.5,124.4
13.9% (tttt)
chi angles: 173.6,177.1,146.6,128.2
0.114Å--
185 SER01.48Å
CA with 185 SER CB
Allowed (1.19%)
General case / -122.9,68.1
66% (m)
chi angles: 296.5
0.671Å1 OUTLIER(S)
worst is C--O: -4.987 σ
-
186 GLU01.393Å
N with 185 SER C
-80.7% (mm-40)
chi angles: 295.4,296.1,146
0.012Å2 OUTLIER(S)
worst is C--N: 20.421 σ
1 OUTLIER(S)
worst is O-C-N: -13.854 σ
187 NDP01.475Å
O2X with 187 NDP P2B
-----