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All-Atom
Contacts
Clashscore, all atoms:15.83 76th percentile* (N=350, 2.08Å - 2.58Å)
Clashscore is the number of serious steric overlaps (> 0.4 Å) per 1000 atoms.
Protein
Geometry
Rotamer outliers2.83% Goal: <1%
Ramachandran outliers0.91% Goal: <0.2%
Ramachandran favored95.89% Goal: >98%
Cβ deviations >0.25Å1 Goal: 0
MolProbity score2.3374th percentile* (N=8627, 2.08Å - 2.58Å)
Residues with bad bonds:0.00% Goal: <5%
Residues with bad angles:1.35% 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: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 1 MET95.650.808Å
HG2 with A 2 MET H
-17.5% (ttm)
chi angles: 190.5,168,256.8
0.035Å--
A 2 MET95.650.808Å
H with A 1 MET HG2
Allowed (1.47%)
General case / -51.8,158.3
0%
chi angles: 123.5,270.9,298.3
0.044Å--
A 3 GLU95.650.476Å
N with A 2 MET HG2
Favored (19.9%)
General case / -103.7,156.9
1.5% (mt-10)
chi angles: 335.9,166,147.3
0.097Å--
A 4 GLN94.42-Favored (23.09%)
General case / -94.4,147.4
14.8% (mt-30)
chi angles: 262.4,192.6,289.5
0.007Å--
A 5 VAL80.060.449Å
HG13 with A 9 PHE HD2
Favored (3.07%)
General case / -41.6,-56.2
22% (t)
chi angles: 187.6
0.063Å--
A 6 CYS71.950.407Å
HB3 with A 178 LEU HA
Favored (7.02%)
General case / -45.6,-36.9
8.4% (p)
chi angles: 80
0.03Å--
A 7 ASP69.53-Favored (6.46%)
General case / -73.8,-57.3
0.2%
chi angles: 230.8,72.2
0.012Å--
A 8 VAL59.670.506Å
HA with A 76 LYS HD3
Favored (72.86%)
General case / -54.8,-48.1
95.6% (t)
chi angles: 176
0.05Å--
A 9 PHE53.040.449Å
HD2 with A 5 VAL HG13
Favored (39.51%)
General case / -89.7,4.4
64.1% (m-85)
chi angles: 298.2,115.2
0.098Å--
A 10 ASP52.09-Allowed (1.65%)
General case / 47.3,66.1
30.5% (m-20)
chi angles: 298.1,105.6
0.011Å--
A 11 ILE39.86-Favored (52.19%)
General case / -99.1,124.6
59.1% (mt)
chi angles: 306.2,173.7
0.035Å--
A 12 TYR44.290.625Å
HD1 with A 181 LYS HB2
Favored (32.59%)
General case / -128.1,162.9
53.6% (m-85)
chi angles: 308.2,96.4
0.113Å--
A 13 ALA35.5-Favored (45.42%)
General case / -118.3,143.8
-0.084Å--
A 14 ILE30.96-Favored (28.94%)
General case / -138.4,129.3
11.5% (tt)
chi angles: 177.9,160.8
0.041Å--
A 15 CYS37.64-Favored (8.8%)
General case / -151.7,178.3
28.6% (p)
chi angles: 61.5
0.116Å--
A 16 ALA34.080.482Å
HA with A 185 THR HB
Favored (29.08%)
General case / -139.7,131.5
-0.101Å--
A 17 CYS40.06-Favored (54.4%)
General case / -131.5,138.9
98.2% (m)
chi angles: 294.3
0.059Å--
A 18 CYS39.61-Favored (2.3%)
General case / -108.4,-175.1
29.4% (p)
chi angles: 62.3
0.045Å--
A 19 LYS46.280.442Å
HG2 with A 36 THR HG22
Favored (19.85%)
General case / -91.1,150.8
44.6% (mtmt)
chi angles: 288,176.3,305,194.2
0.042Å--
A 20 VAL61.770.781Å
HG12 with A 22 SER H
Favored (37.89%)
General case / -92.1,135.8
97.6% (t)
chi angles: 178.6
0.048Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 21 GLU84.40.795Å
O with A 21 GLU HG2
Favored (4.2%)
General case / -68.8,1.6
18.8% (tt0)
chi angles: 188.7,200.4,66.1
0.055Å--
A 22 SER91.870.781Å
H with A 20 VAL HG12
Favored (10.47%)
General case / -49.8,125.5
22.3% (t)
chi angles: 187.9
0.093Å--
A 23 LYS95.650.412Å
O with A 23 LYS HG3
Favored (2.38%)
General case / -69.8,102.8
20% (pttp)
chi angles: 50.9,176,175.4,53.9
0.022Å--
A 24 ASN95.650.658Å
ND2 with A 27 LYS HA
Favored (41.49%)
General case / -65.3,131.0
4.4% (p30)
chi angles: 41.3,3.7
0.102Å--
A 25 GLU95.65-Favored (2.48%)
General case / -82.2,17.2
43.7% (tt0)
chi angles: 190.4,156.5,1.1
0.102Å--
A 26 GLY95.650.498Å
H with A 24 ASN C
Allowed (0.27%)
Glycine / -156.9,61.9
----
A 27 LYS95.650.658Å
HA with A 24 ASN ND2
Favored (9.33%)
General case / -50.3,-27.7
35.1% (ttpt)
chi angles: 197.5,170.8,66.9,175.8
0.058Å--
A 28 LYS95.650.447Å
N with A 26 GLY C
Favored (5.94%)
General case / -72.3,108.7
58.5% (tttm)
chi angles: 181,184.1,177.6,300.5
0.033Å--
A 29 ASN92.37-Allowed (0.78%)
General case / 67.7,56.6
3% (m120)
chi angles: 277.9,47.9
0.04Å--
A 30 GLU77.99-Favored (14.98%)
General case / -92.8,162.3
6.9% (pt-20)
chi angles: 64.1,159.9,116.2
0.025Å--
A 31 VAL62.59-Favored (30.15%)
General case / -96.3,142.7
56.8% (t)
chi angles: 170.8
0.034Å--
A 32 PHE51.11-Favored (43.87%)
General case / -123.4,152.0
90.7% (m-85)
chi angles: 297.5,104.6
0.052Å--
A 33 ASN56.640.41Å
OD1 with A 35 TYR HB3
Favored (10.47%)
General case / -161.8,175.4
26.6% (p30)
chi angles: 55.6,43.9
0.007Å--
A 34 ASN48.56-Favored (66.84%)
General case / -54.0,-38.5
80.5% (m-20)
chi angles: 300.3,324.3
0.041Å--
A 35 TYR58.040.41Å
HB3 with A 33 ASN OD1
Favored (5.05%)
General case / -57.2,-12.9
7.1% (t80)
chi angles: 197,47.5
0.031Å--
A 36 THR39.180.442Å
HG22 with A 19 LYS HG2
Favored (82.55%)
General case / -60.9,-36.9
21% (m)
chi angles: 290.2
0.092Å--
A 37 PHE36.47-Favored (14.17%)
General case / -96.3,100.1
98% (m-85)
chi angles: 296.7,99.1
0.037Å--
A 38 ARG52.33-Allowed (0.85%)
General case / -145.9,-1.4
30.7% (ptt-85)
chi angles: 65.1,181.8,175.9,288.3
0.01Å--
A 39 GLY39.71-Favored (6.48%)
Glycine / -71.2,113.9
----
A 40 LEU40.04-Favored (5.57%)
General case / -96.2,-53.1
14.9% (mt)
chi angles: 274.6,179.8
0.046Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 41 GLY43.830.755Å
HA2 with A 47 PRO HD3
Favored (24.48%)
Glycine / -149.4,-179.2
----
A 42 ASN46.66-Favored (2.24%)
General case / -160.7,119.5
55.8% (t30)
chi angles: 189,54
0.049Å--
A 43 LYS56.04-Favored (25.08%)
General case / 56.1,39.9
55.8% (mttp)
chi angles: 293.3,177.8,179.4,52.1
0.018Å--
A 44 GLY47.29-Favored (79.49%)
Glycine / 83.8,-4.1
----
A 45 VAL46.47-Favored (3.96%)
General case / -132.4,-177.3
17.7% (m)
chi angles: 291.6
0.017Å--
A 46 LEU43.44-Favored (94.05%)
Pre-proline / -73.3,137.6
93.5% (mt)
chi angles: 299.7,177.4
0.007Å--
A 47 PRO40.630.755Å
HD3 with A 41 GLY HA2
Favored (99.15%)
Proline / -57.6,-32.4
52.5% (Cg_exo)
chi angles: 336.3
0.024Å--
A 48 TRP44.830.743Å
O with A 49 LYS HB2
Favored (46.9%)
General case / -96.0,3.0
30.3% (p90)
chi angles: 49.9,84.5
0.108Å--
A 49 LYS69.450.743Å
HB2 with A 48 TRP O
OUTLIER (0.03%)
General case / 77.2,-80.6
16.9% (mttm)
chi angles: 293.3,180.3,190.1,343.5
0.05Å--
A 50 CYS67.44-Favored (34.78%)
General case / -147.3,148.6
0%
chi angles: 121.1
0.042Å--
A 51 ASN45.03-Favored (4.77%)
General case / -142.4,105.9
21% (t-20)
chi angles: 185.9,288.4
0.083Å--
A 52 SER38.33-Favored (80.84%)
General case / -61.0,-36.1
0%
chi angles: 10.3
0.125Å--
A 53 LEU32.28-Favored (81.3%)
General case / -67.7,-44.4
20.9% (tp)
chi angles: 192,69.5
0.043Å--
A 54 ASP33.34-Favored (86.41%)
General case / -64.1,-36.4
14.3% (t70)
chi angles: 169.6,63.7
0.032Å--
A 55 MET56.84-Favored (91.34%)
General case / -65.8,-43.4
52.8% (tpp)
chi angles: 185.5,64.2,63.2
0.058Å--
A 56 LYS44.69-Favored (97.58%)
General case / -63.7,-40.3
76.9% (tttt)
chi angles: 167.7,173.4,178.2,169.4
0.048Å--
A 57 TYR32.11-Favored (80.3%)
General case / -67.3,-45.4
84.3% (t80)
chi angles: 175.1,82.6
0.036Å--
A 58 PHE33.94-Favored (87.84%)
General case / -59.4,-40.8
36.4% (t80)
chi angles: 164.5,83.5
0.053Å--
A 59 CYS54.10.482Å
O with A 63 THR HG23
Favored (79.29%)
General case / -68.7,-43.6
42.6% (t)
chi angles: 177
0.037Å--
A 60 ALA38.01-Favored (90.01%)
General case / -61.9,-46.7
-0.02Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 61 VAL33.37-Favored (73.89%)
General case / -68.5,-46.6
80.7% (t)
chi angles: 174.6
0.05Å--
A 62 THR35.78-Favored (56.87%)
General case / -74.7,-11.1
75% (p)
chi angles: 60
0.133Å--
A 63 THR43.040.482Å
HG23 with A 59 CYS O
Favored (13.32%)
General case / -106.3,-18.7
50.7% (p)
chi angles: 65.8
0.043Å--
A 64 TYR40.06-Favored (35.75%)
General case / -63.6,129.0
89.3% (t80)
chi angles: 179.8,79.6
0.084Å--
A 65 VAL43.210.505Å
HG11 with A 98 LEU HB3
Favored (48.5%)
General case / -134.9,144.8
23.8% (t)
chi angles: 163.5
0.082Å--
A 66 ASN55.13-Favored (7.34%)
General case / -124.6,99.9
29.3% (t-20)
chi angles: 179.4,314
0.076Å--
A 67 GLU73.06-Favored (72.38%)
General case / -56.1,-38.5
1.9% (mt-10)
chi angles: 288.4,233.7,60.8
0.065Å--
A 68 SER64.25-Favored (62.66%)
General case / -66.0,-14.8
25% (p)
chi angles: 78.6
0.016Å--
A 69 LYS69.56-Favored (25.61%)
General case / -97.0,-10.5
91.5% (mttt)
chi angles: 290,190.4,181,186.4
0.085Å--
A 70 TYR69.18-Favored (77.43%)
General case / -60.8,-50.1
28.6% (t80)
chi angles: 180.9,51.7
0.064Å--
A 71 GLU84.53-Favored (12.61%)
General case / -45.3,-49.2
35.4% (mt-10)
chi angles: 281.3,189.5,46
0.019Å--
A 72 LYS82.09-Favored (73.31%)
General case / -56.3,-38.8
5% (ttpm?)
chi angles: 179.3,181.1,70.3,250.1
0.05Å--
A 73 LEU71.61-Favored (66.82%)
General case / -74.3,-36.0
90.3% (mt)
chi angles: 298.4,173.2
0.01Å--
A 74 LYS74.84-Favored (80.56%)
General case / -62.5,-48.9
60.4% (tttp)
chi angles: 191.9,171.8,175.3,65
0.051Å--
A 75 TYR83.87-Favored (78.07%)
General case / -59.2,-49.8
76.2% (t80)
chi angles: 173.6,72.2
0.055Å--
A 76 LYS68.280.506Å
HD3 with A 8 VAL HA
Favored (64.88%)
General case / -52.9,-50.2
9.5% (ttmt)
chi angles: 184.3,230.1,302.8,186.5
0.02Å--
A 77 ARG65.76-Favored (89.12%)
General case / -67.1,-39.9
94.3% (mtt180)
chi angles: 294.3,165.5,191.8,174
0.027Å--
A 78 CYS71.08-Favored (36.56%)
General case / -61.6,-56.1
29.8% (m)
chi angles: 281.2
0.054Å--
A 79 LYS80.39-Favored (46.39%)
General case / -50.1,-41.6
87.2% (tttt)
chi angles: 181.5,183.7,184.6,177.9
0.015Å--
A 80 TYR71.56-Favored (71.26%)
General case / -65.5,-27.9
67.8% (t80)
chi angles: 170.1,81
0.012Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 81 LEU80.350.43Å
O with A 83 LYS HG2
Favored (33.08%)
General case / -102.1,9.7
24.8% (mt)
chi angles: 299.3,160.5
0.019Å--
A 82 ASN89.280.404Å
HB2 with A 81 LEU O
Favored (5.75%)
General case / 64.8,14.0
70.2% (m-20)
chi angles: 286.1,305.8
0.006Å--
A 83 LYS95.390.44Å
O with A 84 GLU HB3
Favored (5.05%)
General case / -104.5,176.6
24.8% (mmtm)
chi angles: 319.1,280,182.8,273.9
0.097Å--
A 84 GLU95.650.44Å
HB3 with A 83 LYS O
Favored (2.63%)
General case / -176.7,163.9
1%
chi angles: 73.4,304.5,313.3
0.042Å--
A 85 THR95.65--25.9% (m)
chi angles: 308.5
0.043Å--
A 96 LYS82.530.45Å
HB3 with A 97 LYS H
-1.2% (mptm?)
chi angles: 268,63.2,190.1,301.7
0.015Å--
A 97 LYS78.250.45Å
H with A 96 LYS HB3
Favored (34.72%)
General case / -80.9,140.4
86% (tttt)
chi angles: 188.2,179.7,183.2,181.2
0.083Å--
A 98 LEU57.150.505Å
HB3 with A 65 VAL HG11
Favored (52.49%)
General case / -59.8,137.5
20.3% (tp)
chi angles: 192.5,56.3
0.035Å--
A 99 GLN41.920.438Å
HG3 with A 97 LYS O
Favored (32.53%)
General case / -140.8,164.6
82.3% (mt-30)
chi angles: 302.6,186.3,326.3
0.071Å--
A 100 ASN42.570.493Å
OD1 with A 159 TYR HB3
Favored (11.04%)
General case / -95.5,167.7
80.2% (m-20)
chi angles: 291.3,309.6
0.121Å--
A 101 VAL33.88-Favored (49.58%)
General case / -113.1,140.5
46.4% (t)
chi angles: 168
0.127Å--
A 102 VAL33.49-Favored (62.74%)
General case / -124.7,130.4
17.6% (m)
chi angles: 291.6
0.024Å--
A 103 VAL34.23-Favored (62.34%)
General case / -117.7,126.5
48.8% (t)
chi angles: 182.6
0.086Å--
A 104 MET39.31-Favored (36.93%)
General case / -138.9,163.8
10% (ptp)
chi angles: 74.6,198.6,84.4
0.058Å--
A 105 GLY38.1-Favored (36.99%)
Glycine / -86.5,159.3
----
A 106 ARG51.270.741Å
HH11 with A 106 ARG HG2
Favored (68.06%)
General case / -52.9,-45.3
29% (ttp85)
chi angles: 188.9,194.1,66.5,54.1
0.014Å--
A 107 THR40.17-Favored (91.9%)
General case / -60.7,-40.3
28.6% (m)
chi angles: 307.6
0.038Å--
A 108 SER48.26-Favored (95.28%)
General case / -65.5,-40.8
74.6% (m)
chi angles: 294.2
0.027Å--
A 109 TRP37.540.551Å
CE2 with A 117 LYS HD2
Favored (87.23%)
General case / -58.7,-42.0
22% (t-105)
chi angles: 164.2,266.5
0.035Å--
A 110 GLU53.160.428Å
HG3 with A 106 ARG O
Favored (62.91%)
General case / -72.8,-16.9
42.4% (mt-10)
chi angles: 307.8,192.7,138.4
0.04Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 111 SER45.49-Favored (51.84%)
General case / -83.8,-11.2
78.1% (p)
chi angles: 59
0.029Å--
A 112 ILE45.70.41Å
HA with A 113 PRO HD3
Favored (64.17%)
Pre-proline / -85.0,134.6
72% (mt)
chi angles: 303.1,173.7
0.039Å--
A 113 PRO47.350.41Å
HD3 with A 112 ILE HA
Favored (63.95%)
Proline / -63.4,136.2
87.3% (Cg_exo)
chi angles: 331.3
0.034Å--
A 114 LYS70.11-Allowed (1.06%)
General case / -36.1,-47.6
19.4% (tttp)
chi angles: 189.5,211.5,188.7,70.5
0.02Å--
A 115 LYS64.120.466Å
HE3 with A 116 PHE CZ
Favored (14.96%)
General case / -62.6,-9.5
62.3% (pttt)
chi angles: 61,173.7,179.3,177.8
0.076Å--
A 116 PHE56.520.466Å
CZ with A 115 LYS HE3
Favored (16.82%)
General case / -107.7,-5.2
31.6% (m-85)
chi angles: 295.4,127.8
0.014Å--
A 117 LYS48.860.551Å
HD2 with A 109 TRP CE2
Favored (23.91%)
Pre-proline / -102.4,135.0
58% (mtmt)
chi angles: 291.1,184.5,293.9,188.1
0.047Å--
A 118 PRO41.59-Favored (41.2%)
Proline / -77.2,155.2
84% (Cg_endo)
chi angles: 31.4
0.026Å--
A 119 LEU38.03-Favored (23.94%)
General case / -54.3,128.1
65.1% (mt)
chi angles: 303.2,172.4
0.016Å--
A 120 SER42.17-Favored (44.45%)
General case / -60.6,143.3
54.1% (p)
chi angles: 55
0.027Å--
A 121 ASN46.47-Favored (8.68%)
General case / 57.6,23.9
35.2% (m120)
chi angles: 300.9,111.6
0.019Å--
A 122 ARG35.89-Favored (43.28%)
General case / -139.9,145.3
63.6% (mtm180)
chi angles: 287.6,155.1,283.8,184.3
0.028Å--
A 123 ILE33.14-Favored (18.44%)
General case / -82.1,111.9
81.3% (mt)
chi angles: 294.8,164.3
0.115Å--
A 124 ASN35.770.519Å
HD22 with A 124 ASN N
Favored (38.84%)
General case / -85.3,132.6
0.9%
chi angles: 296.6,227.8
0.028Å--
A 125 VAL36.44-Favored (60.22%)
General case / -128.1,132.0
60.5% (t)
chi angles: 181.2
0.044Å--
A 126 ILE40.03-Favored (63.36%)
General case / -122.7,132.3
39.2% (mt)
chi angles: 309.8,169.7
0.052Å--
A 127 LEU42.40.97Å
HD23 with A 143 ILE HG13
Favored (43.92%)
General case / -93.0,129.6
38.6% (mt)
chi angles: 281.8,168.2
0.069Å--
A 128 SER46.34-Favored (12.58%)
General case / -163.9,151.2
22.6% (t)
chi angles: 186.5
0.028Å--
A 129 ARG57.03-Favored (3.2%)
General case / -116.2,-41.4
59.6% (mtt85)
chi angles: 290.8,189.6,196.8,83
0.06Å--
A 130 THR51.43-Favored (59.61%)
General case / -74.3,-21.4
6.9% (p)
chi angles: 79.2
0.057Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 131 LEU47.4-Favored (35.97%)
General case / -119.3,152.6
79.8% (mt)
chi angles: 300.7,182
0.025Å--
A 132 LYS58.71-Favored (12.35%)
General case / -127.3,172.6
56.3% (mttm)
chi angles: 293.2,164.1,173.6,299.6
0.058Å--
A 133 LYS56.8-Favored (34.97%)
General case / -53.7,-28.4
22.1% (pttm)
chi angles: 68.8,165,189.4,296.4
0.054Å--
A 134 GLU59.29-Favored (68.42%)
General case / -67.0,-23.7
18.5% (mp0)
chi angles: 290.6,70.5,48.2
0.068Å--
A 135 ASP51.78-Favored (46.22%)
General case / -83.8,-2.3
45.9% (m-20)
chi angles: 300.9,115.2
0.032Å--
A 136 PHE38.07-Favored (55.97%)
General case / -118.2,138.4
88.6% (m-85)
chi angles: 296.2,83.1
0.054Å--
A 137 ASP42.37-Favored (18.66%)
General case / -94.0,-23.6
21.9% (t0)
chi angles: 181.2,42.4
0.086Å--
A 138 GLU44.02-Favored (32.89%)
General case / -72.9,157.1
39.9% (mp0)
chi angles: 306.4,86.1,1.1
0.054Å--
A 139 ASP36.81-Favored (3.82%)
General case / -76.8,89.8
46.2% (t0)
chi angles: 175.7,170.1
0.111Å--
A 140 VAL35.72-Favored (32.17%)
General case / -148.5,162.2
18% (m)
chi angles: 304.6
0.066Å--
A 141 TYR38.26-Favored (56.64%)
General case / -108.2,134.4
76.6% (m-85)
chi angles: 287.1,87.7
0.144Å--
A 142 ILE45-Favored (54.31%)
General case / -110.6,137.1
27.4% (mm)
chi angles: 306.9,309.8
0.082Å--
A 143 ILE44.330.97Å
HG13 with A 127 LEU HD23
Favored (44.5%)
General case / -137.7,141.9
27.7% (pt)
chi angles: 55.1,177.9
0.022Å--
A 144 ASN54.67-Favored (25.23%)
General case / -108.2,11.9
51.1% (p-10)
chi angles: 65.4,359.9
0.006Å--
A 145 LYS60.41-Favored (16.67%)
General case / -153.0,139.7
20.8% (mtmm)
chi angles: 265.5,180.4,287.6,294.7
0.1Å--
A 146 VAL49.74-Favored (81.27%)
General case / -59.2,-38.4
78.9% (t)
chi angles: 174.4
0.052Å--
A 147 GLU61.39-Favored (68.68%)
General case / -57.2,-33.4
2.2% (mp0)
chi angles: 304.1,88.3,101.9
0.027Å--
A 148 ASP60.09-Favored (67.02%)
General case / -68.9,-24.1
81.5% (m-20)
chi angles: 291.2,148.2
0.056Å--
A 149 LEU45.69-Favored (83.37%)
General case / -67.5,-43.8
24.9% (tp)
chi angles: 165.8,64.3
0.065Å--
A 150 ILE43.710.41Å
HD12 with A 5 VAL HG11
Favored (97.25%)
General case / -61.3,-43.9
21.3% (mm)
chi angles: 311.7,308.5
0.019Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 151 VAL45.94-Favored (87.54%)
General case / -59.8,-47.0
98.9% (t)
chi angles: 176.5
0.02Å--
A 152 LEU44.99-Favored (84.7%)
General case / -58.1,-46.5
63.3% (tp)
chi angles: 179.3,63.7
0.024Å--
A 153 LEU48.880.414Å
HD23 with A 153 LEU HA
Favored (66.82%)
General case / -56.1,-33.7
65.8% (mt)
chi angles: 292.5,182.5
0.016Å--
A 154 GLY50.42-Favored (70.77%)
Glycine / -67.5,-22.7
----
A 155 LYS57.41-Favored (17.91%)
General case / -94.4,-24.7
89.7% (mttt)
chi angles: 294.7,170.5,179,165.8
0.036Å--
A 156 LEU54.18-Favored (19.41%)
General case / -86.9,157.7
81.5% (mt)
chi angles: 297.6,170.1
0.017Å--
A 157 ASN57.05-Favored (25.01%)
General case / -108.2,108.8
84.8% (m-20)
chi angles: 288.7,319.8
0.117Å--
A 158 TYR48.53-Favored (21.11%)
General case / -146.9,168.7
24.1% (p90)
chi angles: 67.6,104.4
0.048Å--
A 159 TYR44.170.636Å
CE2 with A 160 LYS HE3
Allowed (0.63%)
General case / -89.8,-74.9
43.5% (t80)
chi angles: 186.1,60.5
0.067Å--
A 160 LYS45.110.636Å
HE3 with A 159 TYR CE2
Favored (33.92%)
General case / -128.1,162.4
94.8% (mttt)
chi angles: 298.3,177.5,177.6,187.6
0.028Å--
A 161 CYS35.24-Favored (44.33%)
General case / -119.2,117.8
31.8% (t)
chi angles: 173.1
0.044Å--
A 162 PHE33.06-Favored (60.76%)
General case / -108.0,125.9
94% (m-85)
chi angles: 291.9,96.4
0.042Å--
A 163 ILE35.57-Favored (29.9%)
General case / -88.0,118.4
25.9% (mm)
chi angles: 300.1,311
0.139Å-1 OUTLIER(S)
worst is N-CA-C: -4.221 σ
A 164 ILE33.21-Favored (16.11%)
General case / -109.2,21.2
16.7% (pt)
chi angles: 69.7,182.1
0.1Å--
A 165 GLY35.68-Favored (19.21%)
Glycine / 112.8,176.5
----
A 166 GLY35.59-Favored (10.33%)
Glycine / -89.4,-142.3
----
A 167 SER46.33-Favored (97.94%)
General case / -64.2,-42.1
53.3% (p)
chi angles: 74.5
0.047Å--
A 168 VAL41.12-Favored (90.98%)
General case / -66.3,-42.3
53.1% (t)
chi angles: 170.4
0.043Å--
A 169 VAL39.10.523Å
O with A 173 PHE HD1
Favored (96.18%)
General case / -63.0,-44.8
66.3% (t)
chi angles: 179.7
0.025Å--
A 170 TYR43.13-Favored (84.42%)
General case / -59.9,-48.0
29.9% (m-85)
chi angles: 290.8,127.5
0.121Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 171 GLN63.260.517Å
O with A 175 GLU HG3
Favored (38.14%)
General case / -49.2,-48.5
20.1% (tm0?)
chi angles: 201.6,279.7,336.2
0.042Å--
A 172 GLU65.880.449Å
O with A 176 LYS HG3
Favored (58.25%)
General case / -76.7,-28.8
11.2% (pt-20)
chi angles: 64.7,200,135.4
0.084Å--
A 173 PHE47.250.523Å
HD1 with A 169 VAL O
Favored (70.49%)
General case / -71.5,-32.3
32.8% (m-85)
chi angles: 277.8,81.3
0.036Å--
A 174 LEU51.09-Favored (55.84%)
General case / -72.9,-47.6
57.6% (mt)
chi angles: 286.2,165.8
0.035Å--
A 175 GLU70.850.517Å
HG3 with A 171 GLN O
Favored (77.04%)
General case / -58.7,-37.1
60.1% (mt-10)
chi angles: 295.6,195.9,148.1
0.088Å--
A 176 LYS69.40.449Å
HG3 with A 172 GLU O
Favored (25.07%)
General case / -84.8,5.5
51.6% (mttm)
chi angles: 301.8,188.5,191.3,281.5
0.025Å--
A 177 LYS63.08-Favored (21.65%)
General case / 52.3,45.5
27.4% (mttm)
chi angles: 313.3,207.1,187.2,311.6
0.028Å--
A 178 LEU55.180.407Å
HA with A 6 CYS HB3
Favored (37.11%)
General case / -98.5,-1.1
43.3% (mt)
chi angles: 293.9,162.2
0.037Å--
A 179 ILE49.85-Favored (48.96%)
General case / -97.5,123.9
32% (mm)
chi angles: 310.6,301.7
0.025Å--
A 180 LYS58.41-Favored (19.51%)
General case / -91.7,-26.7
74.7% (tttt)
chi angles: 169,173.6,164.8,173.7
0.09Å--
A 181 LYS42.40.625Å
HB2 with A 12 TYR HD1
Favored (20.06%)
General case / -158.7,151.2
82.6% (mttt)
chi angles: 279.2,190.2,177.5,171.2
0.149Å--
A 182 ILE39.69-Favored (28.63%)
General case / -123.2,114.6
54.6% (mt)
chi angles: 307.1,174.7
0.11Å--
A 183 TYR36.25-Favored (14.18%)
General case / -90.7,100.6
86.3% (m-85)
chi angles: 289.9,94.9
0.104Å--
A 184 PHE32.41-Favored (52.8%)
General case / -105.5,119.0
8% (t80)
chi angles: 200.9,104.9
0.122Å--
A 185 THR31.660.482Å
HB with A 16 ALA HA
Favored (47.38%)
General case / -95.2,127.7
25.6% (m)
chi angles: 291.6
0.11Å--
A 186 ARG30.66-Favored (28.01%)
General case / -102.4,110.6
74.8% (mtm180)
chi angles: 297.1,186.1,295.7,192.1
0.036Å--
A 187 ILE33.92-Favored (20.73%)
General case / -90.8,106.7
13.2% (mm)
chi angles: 302.3,283.6
0.149Å--
A 188 ASN35.04-Favored (4.3%)
General case / -82.0,61.9
59.2% (t30)
chi angles: 192.5,21.3
0.116Å--
A 189 SER42.07-Favored (29.38%)
General case / -158.8,161.8
3.6% (p)
chi angles: 40.9
0.056Å--
A 190 THR40.92-Favored (32.01%)
General case / -102.2,143.1
11.6% (m)
chi angles: 312.7
0.035Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 191 TYR43.47-Favored (31.91%)
General case / -150.9,162.7
25.1% (m-85)
chi angles: 310.5,82.2
0.067Å--
A 192 GLU61.27-Favored (41.61%)
General case / -72.9,130.2
33.7% (tt0)
chi angles: 175.3,178.1,118.8
0.101Å--
A 193 CYS47.61-Favored (48.81%)
General case / -139.4,154.0
51.3% (m)
chi angles: 306.8
0.065Å--
A 194 ASP51.87-Favored (5.27%)
General case / -123.3,-18.7
12.4% (p30)
chi angles: 50.6,34.3
0.099Å--
A 195 VAL46.36-Favored (48.34%)
General case / -125.6,150.5
23.7% (m)
chi angles: 293.3
0.06Å--
A 196 PHE44.44-Favored (41.82%)
General case / -134.9,162.5
15.6% (m-85)
chi angles: 315.6,94.9
0.068Å--
A 197 PHE45.12-Favored (74.43%)
Pre-proline / -81.3,150.4
32.8% (t80)
chi angles: 195.6,72.7
0.095Å--
A 198 PRO51.52-Favored (63.93%)
Proline / -71.9,149.9
36.7% (Cg_exo)
chi angles: 340.8
0.027Å--
A 199 GLU68.61-Favored (23.59%)
General case / -62.8,125.2
10.3% (tt0)
chi angles: 170.1,149.1,43
0.072Å--
A 200 ILE61.65-Favored (40.25%)
General case / -82.6,131.9
73.5% (mt)
chi angles: 293.1,177.2
0.023Å--
A 201 ASN67.410.47Å
OD1 with A 203 ASN HB2
Favored (21.95%)
General case / -80.4,116.5
31.7% (t-20)
chi angles: 186.1,304.8
0.037Å--
A 202 GLU79.23-Favored (36.39%)
General case / -61.2,-15.5
1.6% (tp10)
chi angles: 201.7,70.9,133.9
0.006Å--
A 203 ASN71.90.47Å
HB2 with A 201 ASN OD1
Favored (29.56%)
General case / -89.6,-16.1
71.4% (m-20)
chi angles: 287.1,304.6
0.012Å--
A 204 GLU77.82-Favored (10.61%)
General case / -100.7,-30.6
50% (mt-10)
chi angles: 286.6,181.7,46.2
0.088Å--
A 205 TYR52.47-Favored (47.06%)
General case / -135.3,138.1
75.1% (m-85)
chi angles: 288.9,101.6
0.069Å--
A 206 GLN63.98-Favored (51.44%)
General case / -133.0,139.3
9.7% (pt20)
chi angles: 77.4,169.7,52.1
0.029Å--
A 207 ILE41.31-Favored (32.82%)
General case / -67.9,127.9
98.3% (mt)
chi angles: 296.9,171.4
0.069Å--
A 208 ILE45.560.609Å
HD13 with A 227 LYS HD2
Favored (11.1%)
General case / -114.7,-8.9
16.3% (pt)
chi angles: 48.9,166.9
0.041Å--
A 209 SER39.65-Favored (13.79%)
General case / -158.7,144.5
53.1% (m)
chi angles: 300
0.029Å--
A 210 VAL36.74-Favored (41.11%)
General case / -136.2,133.9
22.7% (m)
chi angles: 302.7
0.037Å--
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 211 SER28.81-Favored (4.35%)
General case / -87.7,-174.5
58.7% (p)
chi angles: 72.9
0.071Å--
A 212 ASP35.03-Favored (14.83%)
General case / -71.4,168.1
64.1% (t0)
chi angles: 185.7,1
0.143Å--
A 213 VAL26.25-Favored (30.43%)
General case / -103.3,144.7
68.3% (t)
chi angles: 171.6
0.016Å--
A 214 TYR30.610.489Å
O with A 220 THR HA
Favored (22.68%)
General case / -136.1,169.4
36.9% (m-85)
chi angles: 308.2,82.7
0.133Å--
A 215 THR32.44-Favored (62.84%)
General case / -125.1,132.8
2.7% (m)
chi angles: 281.5
0.035Å--
A 216 SER32.9-Favored (5.72%)
General case / -159.3,130.7
41.1% (t)
chi angles: 177.2
0.043Å--
A 217 ASN35.86-Favored (14.57%)
General case / 56.3,49.0
9.8% (m120)
chi angles: 303.9,78.7
0.022Å--
A 218 ASN52.82-Favored (15.67%)
General case / 60.4,30.7
73.8% (m-20)
chi angles: 289.5,303.7
0.089Å--
A 219 THR34.38-Favored (25.67%)
General case / -156.3,153.5
6.8% (t)
chi angles: 178.2
0.049Å--
A 220 THR30.160.489Å
HA with A 214 TYR O
Favored (13.95%)
General case / -93.6,164.0
33.6% (p)
chi angles: 52
0.081Å--
A 221 LEU29.77-Favored (10.42%)
General case / -168.5,158.4
2.1% (pt?)
chi angles: 66.7,158.3
0.108Å--
A 222 ASP32.74-Favored (14%)
General case / -144.4,173.1
52.5% (p30)
chi angles: 67.2,9.3
0.118Å--
A 223 PHE29.37-Favored (61.38%)
General case / -126.1,130.2
29.8% (m-85)
chi angles: 311.6,92.1
0.085Å--
A 224 ILE32.69-Favored (39.53%)
General case / -126.9,159.8
36% (pt)
chi angles: 67.4,172.4
0.049Å--
A 225 ILE37.71-Favored (56.09%)
General case / -125.4,123.8
70.8% (mt)
chi angles: 303.2,174.2
0.08Å--
A 226 TYR45.07-Favored (36.13%)
General case / -99.4,139.8
66.9% (m-85)
chi angles: 285.4,85.5
0.113Å--
A 227 LYS61.10.609Å
HD2 with A 208 ILE HD13
Favored (54.47%)
General case / -117.5,139.4
77.5% (tttt)
chi angles: 196,167.1,180.2,178.6
0.029Å--
A 228 LYS66.7-Favored (4.35%)
General case / -58.3,116.2
24.3% (tptp)
chi angles: 188.6,71.1,165.8,77.7
0.128Å--
A 229 THR77.97-Favored (55.27%)
General case / -63.1,136.5
6.6% (p)
chi angles: 42.6
0.094Å--
A 230 ASN93.76-Favored (10.47%)
General case / -54.9,122.5
41.7% (m-20)
chi angles: 312,306.2
0.243Å-1 OUTLIER(S)
worst is N-CA-C: -4.017 σ
#ResHigh BClash > 0.4ÅRamachandranRotamerCβ deviationBond lengths.Bond angles.
Avg: 53.41Clashscore: 15.83Outliers: 2 of 219Outliers: 6 of 212Outliers: 1 of 215Outliers: 0 of 223Outliers: 3 of 223
A 231 ASN95.65-OUTLIER (0.02%)
General case / -28.4,-33.2
5% (p30)
chi angles: 76.3,97.4
0.279Å-1 OUTLIER(S)
worst is N-CA-C: 6.434 σ
A 232 LYS95.650.414Å
O with A 233 MET C
Favored (5.13%)
General case / -97.3,87.2
48.9% (mttp)
chi angles: 309.3,176.9,187.6,58.3
0.037Å--
A 233 MET95.650.414Å
C with A 232 LYS O
-3.7% (mpp?)
chi angles: 298.5,72.2,93.4
0.053Å--