A0A087X7L7_POEFO Loading...

Alpha-ketoglutarate dehydrogenase subunit 4

AlphaFold DB , UniProt , Accession A0A087X7L7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 109 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.5Very low59.2Low245 Ų245137.5 Ų137.5100%1.20782%0.82SS**  0100.30-70.5154.696.800106.2
2G57.6Low59.2Low79 Ų79136.6 Ų136.681%0.81482%0.82SS**  60.911881.100000109.6
3S51Low59.5Low107 Ų107136.2 Ų136.275%0.74882%0.819SS**  cis-162.7150.712.339.40000108.4
4K61.3Low59.9Low214 Ų214132.6 Ų132.693%0.9381%0.812SS**  trans-65.9126.3171.5-55.7173.8-177.4175.50109.1
5V59.3Low60.4Low129 Ų129139.4 Ų139.478%0.78282%0.816SS**  trans-124.798.4163.9-41.10000108.7S7V5-S7 PolarHBondContact O-N 3.39Å
6S62Low60.7Low99 Ų99139.3 Ų139.369%0.69282%0.818SS**  trans-78.5108.2168.8176.60000106.7K8S6-K8 PolarHBondContact O-N 3.07Å
7S60Low61.2Low108 Ų108140.2 Ų140.276%0.75582%0.816SS**  trans-71.898.1171.9-173.40000108.5V5V5-S7 PolarHBondContact O-N 3.39Å
8K62.8Low61.9Low187 Ų187141.6 Ų141.681%0.81381%0.814SS**  trans-92.692.5166.9-66.5-136.3179.7-175.70108.1S6 A10S6-K8 PolarHBondContact O-N 3.07Å; K8-A10 PolarHBondContact O-N 3.24Å
9M61.5Low62.6Low171 Ų171139.3 Ų139.384%0.84281%0.813SS**  trans-75.3101.5166.2-80.4-92.9-54.400108.5A11M9-A11 PolarHBondContact O-N 3.39Å
10A64.8Low63.6Low94 Ų94138.3 Ų138.378%0.77781%0.808SS**  trans-76109.9166.900000108.4K8K8-A10 PolarHBondContact O-N 3.24Å
11A64.4Low64.7Low80 Ų80142.3 Ų142.366%0.66181%0.81SS**  trans-67.7135.7171.300000109.5M9 T13M9-A11 PolarHBondContact O-N 3.39Å; A11-T13 PolarHBondContact O-N 2.91Å
12P59Low66.6Low126 Ų126136 Ų13682%0.81879%0.787SS**  trans-74.1101.5174.329.4-29.5000108.3A14P12-A14 VanDerWaalsContact C-N 3.33Å; P12-A14 PolarHBondContact O-N 3.04Å
13T63.3Low68.1Low132 Ų132140 Ų14081%0.8179%0.785SS**  trans-65.195.5167.6-51.70000108.1A11 R15A11-T13 PolarHBondContact O-N 2.91Å; T13-R15 PolarHBondContact O-N 3.27Å
14A64.5Low69.8Low86 Ų86138.6 Ų138.671%0.71178%0.779SS**  trans-61.3116.4176.200000109.3P12 V16P12-A14 VanDerWaalsContact C-N 3.33Å; P12-A14 PolarHBondContact O-N 3.04Å; A14-V16 PolarHBondContact O-N 3.14Å
15R67.6Low71.1Confident234 Ų234133.6 Ų133.688%0.88377%0.768SS**  trans-72.6113.3174.2-66-178.8-179.3-174.9-0.1108.2T13 I17T13-R15 PolarHBondContact O-N 3.27Å; R15-I17 PolarHBondContact O-N 3.17Å; R15-I17 VanDerWaalsContact O-N 3.14Å
16V65.2Low72.6Confident138 Ų138134.8 Ų134.884%0.83677%0.77SS**  trans-69.7105.1172.51790000107.8A14 Q18A14-V16 PolarHBondContact O-N 3.14Å; V16-Q18 PolarHBondContact O-N 3.29Å
17I70.1Confident73.9Confident154 Ų154136.7 Ų136.779%0.7977%0.77SS**  trans-81.5102.8172.9-58.6175.9000106.9R15 A19R15-I17 PolarHBondContact O-N 3.17Å; R15-I17 VanDerWaalsContact O-N 3.14Å; I17-A19 PolarHBondContact O-N 3.11Å; I17-A19 VanDerWaalsContact O-N 3.11Å
18Q72.9Confident75.4Confident166 Ų166141 Ų14178%0.77678%0.776SS**  trans-71.2104170.4-172.3175.4-17.300108.2V16 V20V16-Q18 PolarHBondContact O-N 3.29Å; Q18-V20 PolarHBondContact O-N 3.08Å; Q18-V20 VanDerWaalsContact O-N 3.08Å
19A76.3Confident76.5Confident97 Ų97139.9 Ų139.980%0.80277%0.771SS**  trans-70.1102.8175.500000109.5I17I17-A19 PolarHBondContact O-N 3.11Å; I17-A19 VanDerWaalsContact O-N 3.11Å
20V82.6Confident77.8Confident119 Ų119136.3 Ų136.372%0.72176%0.761SS**PPolyproline II helixtrans-82.9121.5172.4179.20000108.5Q18 P22Q18-V20 PolarHBondContact O-N 3.08Å; Q18-V20 VanDerWaalsContact O-N 3.08Å; V20-P22 WeakPolarHBondContact O-CD 3.44Å
21R85.1Confident78.8Confident224 Ų224136.5 Ų136.585%0.84575%0.748SS**PPolyproline II helixtrans-70.2121.8176.1-177.1177.6177.1175.70.1109.3
22P86.6Confident79.7Confident111 Ų111141.5 Ų141.572%0.72175%0.75SS**PPolyproline II helixtrans-64.4139.5175.126.8-33.3000110.3V20 A24V20-P22 WeakPolarHBondContact O-CD 3.44Å; P22-A24 PolarHBondContact O-N 3.47Å
23H88.9Confident80.8Confident165 Ų165143.3 Ų143.376%0.76475%0.748SS**PPolyproline II helixtrans-70.8125.4178.4178.870.5000110.6
24A87.4Confident81.6Confident76 Ų76144 Ų14463%0.62875%0.746SS**  trans-92113.7172.800000109.2P22P22-A24 PolarHBondContact O-N 3.47Å
25P88.4Confident82.1Confident109 Ų109144.6 Ų144.671%0.70874%0.737SS**PPolyproline II helixtrans-67.6146.6-178.828-34.2000111.3
26L91.4Very high82.4Confident155 Ų155138.8 Ų138.881%0.81273%0.73SS**PPolyproline II helixtrans-70.2148.9174.7-62.1175.4000111.1
27I89Confident82.8Confident138 Ų138143.5 Ų143.571%0.70873%0.732SS**PPolyproline II helixtrans-61.8139.5171.460.5171000110.2F29I27-F29 HydrophobicContact CD1-CE1 4.48Å; I27-F29 HydrophobicContact CD1-CE2 4.31Å; I27-F29 HydrophobicContact CD1-CZ 3.89Å
28K90.8Very high82.7Confident198 Ų198141.1 Ų141.186%0.86173%0.727SS**  trans-104.3130.7175.6-63.4-179.3-177.3178.80109
29F87.7Confident82.9Confident165 Ų165137.3 Ų137.372%0.72471%0.712SS**PPolyproline II helixtrans-84.5140.9172.2-68-78.1000110.3I27I27-F29 HydrophobicContact CD1-CE1 4.48Å; I27-F29 HydrophobicContact CD1-CE2 4.31Å; I27-F29 HydrophobicContact CD1-CZ 3.89Å
30P87.1Confident82.7Confident95 Ų95137.6 Ų137.662%0.61770%0.703SS**PPolyproline II helixtrans-59.8142.4174.3-23.533.5000111.9R32P30-R32 PolarHBondContact O-N 2.94Å
31N85.9Confident82.4Confident98 Ų98138.1 Ų138.152%0.52470%0.698SS.*PPolyproline II helixtrans-66.5122.7170.5-172.2-7000108.9Q33N31-Q33 PolarHBondContact ND2-OE1 2.82Å; N31-Q33 VanDerWaalsContact OD1-CB 3.3Å; N31-Q33 WeakPolarHBondContact OD1-CB 3.46Å; N31-Q33 VanDerWaalsContact OD1-CD 3.26Å; N31-Q33 WeakPolarHBondContact OD1-CG 3.14Å; N31-Q33 PolarHBondContact OD1-N 3.23Å
32R83Confident81.7Confident186 Ų186131.8 Ų131.870%0.70268%0.678SS**  trans-102.413.7-178.4-58.1-173.4-179.3-173-1113.2P30 D34 I35P30-R32 PolarHBondContact O-N 2.94Å; R32-D34 VanDerWaalsContact C-N 3.33Å; R32-I35 HydrophobicContact CG-CD1 4.43Å; R32-I35 PolarHBondContact O-N 3.38Å
33Q82.3Confident81Confident163 Ų163128.6 Ų128.676%0.76266%0.661SS**SBendtrans-64.6-36.6-179.6-74165.511.900112.4N31N31-Q33 PolarHBondContact ND2-OE1 2.82Å; N31-Q33 VanDerWaalsContact OD1-CB 3.3Å; N31-Q33 WeakPolarHBondContact OD1-CB 3.46Å; N31-Q33 VanDerWaalsContact OD1-CD 3.26Å; N31-Q33 WeakPolarHBondContact OD1-CG 3.14Å; N31-Q33 PolarHBondContact OD1-N 3.23Å
34D81Confident80.2Confident146 Ų146123.9 Ų123.978%0.78164%0.641SS**SBendtrans-93-4.2-178.9-51.9-48.3000113.5R32 P36R32-D34 VanDerWaalsContact C-N 3.33Å; D34-P36 WeakPolarHBondContact O-CD 3.42Å
35I75.3Confident79.4Confident100 Ų100126.4 Ų126.451%0.51364%0.638SS.*SBendtrans-91.6110.4179-58.4172.9000107.3R32 R37R32-I35 HydrophobicContact CG-CD1 4.43Å; R32-I35 PolarHBondContact O-N 3.38Å; I35-R37 PolarHBondContact O-N 3.18Å
36P72.5Confident78.6Confident112 Ų112128.9 Ų128.973%0.72764%0.644SS**PPolyproline II helixtrans-57.5129.1175.523.9-32000108.4D34 P38D34-P36 WeakPolarHBondContact O-CD 3.42Å; P36-P38 WeakPolarHBondContact O-CD 3.1Å; P36-P38 VanDerWaalsContact O-N 3.1Å
37R73.6Confident77.6Confident237 Ų237127.6 Ų127.689%0.89464%0.637SS**PPolyproline II helixtrans-54.1122.3176.8-71.7-175.1178.5-1760.2107.5I35 N39I35-R37 PolarHBondContact O-N 3.18Å; R37-N39 PolarHBondContact O-N 2.84Å; R37-N39 VanDerWaalsContact O-N 3.13Å
38P68.4Low76.3Confident104 Ų104124 Ų12468%0.67564%0.635SS**PPolyproline II helixtrans-59.7125.1179.623.2-31.8000108P36 V40P36-P38 WeakPolarHBondContact O-CD 3.1Å; P36-P38 VanDerWaalsContact O-N 3.1Å; P38-V40 PolarHBondContact O-N 2.8Å; P38-V40 VanDerWaalsContact O-N 3.14Å
39N76.9Confident74.9Confident86 Ų86119.4 Ų119.446%0.4662%0.619SS.*PPolyproline II helixtrans-57.9121.8174.7179.6-2.7000107.3R37 Q41 E42 A43R37-N39 PolarHBondContact O-N 2.84Å; R37-N39 VanDerWaalsContact O-N 3.13Å; N39-Q41 PolarHBondContact O-N 3.19Å; N39-Q41 VanDerWaalsContact O-N 3.1Å; N39-Q41 PolarHBondContact OD1-N 3.27Å; N39-Q41 VanDerWaalsContact OD1-N 3.1Å; N39-E42 HydrophobicContact CB-CB 4.3Å; N39-E42 HydrophobicContact CB-CG 4.07Å; N39-E42 PolarHBondContact O-N 3.03Å; N39-A43 PolarHBondContact O-N 3.44Å
40V72.5Confident73.6Confident102 Ų102118.6 Ų118.662%0.61862%0.622SS**Hα-helixtrans-53.2-36.1-177.8-179.30000110.2P38 A43 L44P38-V40 PolarHBondContact O-N 2.8Å; P38-V40 VanDerWaalsContact O-N 3.14Å; V40-A43 PolarHBondContact O-N 3.3Å; V40-L44 HydrophobicContact CG1-CD1 3.5Å; V40-L44 WeakPolarHBondContact O-CB 3.3Å; V40-L44 WeakPolarHBondContact O-CD1 3.34Å; V40-L44 PolarHBondContact O-N 3.45Å
41Q75.9Confident72.4Confident131 Ų131119.3 Ų119.361%0.61263%0.625SS**Hα-helixtrans-66.2-41177.8-57.8-168.821.600113.1N39 L44 K45N39-Q41 PolarHBondContact O-N 3.19Å; N39-Q41 VanDerWaalsContact O-N 3.1Å; N39-Q41 PolarHBondContact OD1-N 3.27Å; N39-Q41 VanDerWaalsContact OD1-N 3.1Å; Q41-L44 PolarHBondContact O-N 3.32Å; Q41-K45 VanDerWaalsContact O-CG 3.29Å; Q41-K45 WeakPolarHBondContact O-CG 3.46Å; Q41-K45 PolarHBondContact O-N 3.23Å
42E71.1Confident71Confident90 Ų90119.4 Ų119.442%0.42163%0.631SS.*Hα-helixtrans-71.5-36.6177-63.4-56.3141.600111.3N39 L44 K45 L46N39-E42 HydrophobicContact CB-CB 4.3Å; N39-E42 HydrophobicContact CB-CG 4.07Å; N39-E42 PolarHBondContact O-N 3.03Å; E42-L44 PolarHBondContact O-N 3Å; E42-K45 PolarHBondContact O-N 3.12Å; E42-K45 IonicContact OE1-NZ 2.74Å; E42-K45 PolarHBondContact OE1-NZ 3.37Å; E42-K45 IonicContact OE2-NZ 3.68Å; E42-L46 WeakPolarHBondContact O-CG 3.3Å; E42-L46 PolarHBondContact O-N 3.46Å
43A72.1Confident69.9Low45 Ų45119.2 Ų119.237%0.37264%0.638SS.*Hα-helixtrans-63.6-39.7173.700000112.2N39 V40 L46 L47N39-A43 PolarHBondContact O-N 3.44Å; V40-A43 PolarHBondContact O-N 3.3Å; A43-L46 PolarHBondContact O-N 3.45Å; A43-L47 WeakPolarHBondContact O-CB 3.33Å; A43-L47 PolarHBondContact O-N 3.42Å; A43-L47 VanDerWaalsContact O-N 3.08Å
44L72.6Confident68.1Low65 Ų65119.2 Ų119.234%0.3464%0.637SS.*Hα-helixtrans-66-38.4173.9-94.8112.6000112.6V40 Q41 E42 L47 G48 L49V40-L44 HydrophobicContact CG1-CD1 3.5Å; V40-L44 WeakPolarHBondContact O-CB 3.3Å; V40-L44 WeakPolarHBondContact O-CD1 3.34Å; V40-L44 PolarHBondContact O-N 3.45Å; Q41-L44 PolarHBondContact O-N 3.32Å; E42-L44 PolarHBondContact O-N 3Å; L44-L47 CarbonylContact O-C 3.6Å; L44-L47 PolarHBondContact O-N 3.46Å; L44-G48 PolarHBondContact O-N 3.14Å; L44-L49 HydrophobicContact CD2-CB 4.09Å; L44-L49 HydrophobicContact CD2-CD1 4.45Å; L44-L49 PolarHBondContact O-N 3.32Å
45K70.6Confident66.9Low129 Ų129119.5 Ų119.556%0.56164%0.639SS**Hα-helixtrans-62.8-44.7174.5-71.5170.3-169.7174.20111.7Q41 E42 L47 G48Q41-K45 VanDerWaalsContact O-CG 3.29Å; Q41-K45 WeakPolarHBondContact O-CG 3.46Å; Q41-K45 PolarHBondContact O-N 3.23Å; E42-K45 PolarHBondContact O-N 3.12Å; E42-K45 IonicContact OE1-NZ 2.74Å; E42-K45 PolarHBondContact OE1-NZ 3.37Å; E42-K45 IonicContact OE2-NZ 3.68Å; K45-L47 PolarHBondContact O-N 3.15Å; K45-G48 PolarHBondContact O-N 2.85Å; K45-G48 VanDerWaalsContact O-N 3.1Å
46L70.5Confident65.3Low161 Ų161118.5 Ų118.584%0.84365%0.645SS**Hα-helixtrans-63.3-31.5175.5-71.7175000112.6E42 A43 G48E42-L46 WeakPolarHBondContact O-CG 3.3Å; E42-L46 PolarHBondContact O-N 3.46Å; A43-L46 PolarHBondContact O-N 3.45Å; L46-G48 PolarHBondContact O-N 2.97Å
47L70.5Confident64Low128 Ų128119 Ų11967%0.6765%0.648SS**THydrogen-bonded Turntrans-81.62.3177-158.660.3000113.1A43 L44 K45 L49A43-L47 WeakPolarHBondContact O-CB 3.33Å; A43-L47 PolarHBondContact O-N 3.42Å; A43-L47 VanDerWaalsContact O-N 3.08Å; L44-L47 CarbonylContact O-C 3.6Å; L44-L47 PolarHBondContact O-N 3.46Å; K45-L47 PolarHBondContact O-N 3.15Å; L47-L49 HydrophobicContact CB-CG 4.39Å; L47-L49 HydrophobicContact CD2-CD1 3.84Å; L47-L49 HydrophobicContact CD2-CG 4.38Å; L47-L49 HydrophobicContact CG-CD1 4.28Å; L47-L49 HydrophobicContact CG-CG 4.27Å; L47-L49 PolarHBondContact O-N 2.92Å
48G61.5Low62.9Low63 Ų63113.6 Ų113.665%0.64965%0.647SS**THydrogen-bonded Turntrans67.213.8177.600000114.6L44 K45 L46 N50L44-G48 PolarHBondContact O-N 3.14Å; K45-G48 PolarHBondContact O-N 2.85Å; K45-G48 VanDerWaalsContact O-N 3.1Å; L46-G48 PolarHBondContact O-N 2.97Å; G48-N50 PolarHBondContact O-N 3.25Å; G48-N50 VanDerWaalsContact O-N 3.11Å
49L61.1Low61.8Low101 Ų101114.1 Ų114.153%0.52965%0.654SS.*  trans-86.379.3-179.7-63.8-178.7000109.8L44 L47 V51L44-L49 HydrophobicContact CD2-CB 4.09Å; L44-L49 HydrophobicContact CD2-CD1 4.45Å; L44-L49 PolarHBondContact O-N 3.32Å; L47-L49 HydrophobicContact CB-CG 4.39Å; L47-L49 HydrophobicContact CD2-CD1 3.84Å; L47-L49 HydrophobicContact CD2-CG 4.38Å; L47-L49 HydrophobicContact CG-CD1 4.28Å; L47-L49 HydrophobicContact CG-CG 4.27Å; L47-L49 PolarHBondContact O-N 2.92Å; L49-V51 PolarHBondContact O-N 3.44Å
50N61.9Low60.1Low149 Ų149114.8 Ų114.880%0.79767%0.671SS**  trans-74101.8166.3-169.234.7000108.6G48 P52G48-N50 PolarHBondContact O-N 3.25Å; G48-N50 VanDerWaalsContact O-N 3.11Å; N50-P52 WeakPolarHBondContact O-CD 3.35Å
51V60.9Low59.2Low110 Ų110115.7 Ų115.767%0.66768%0.682SS**  trans-79.5114.8170.5179.30000107.4L49 Q53L49-V51 PolarHBondContact O-N 3.44Å; V51-Q53 PolarHBondContact O-N 3.18Å
52P57.4Low58Low100 Ų100115.4 Ų115.465%0.64969%0.689SS**  trans-70.6122.2178.125.3-26.6000109.4N50 H54N50-P52 WeakPolarHBondContact O-CD 3.35Å; P52-H54 PolarHBondContact O-N 2.87Å
53Q58.7Low57.1Low182 Ų182117 Ų11785%0.8571%0.71SS**  trans-69.596.9167.8-174.7159.2-41.600108.1V51 N55V51-Q53 PolarHBondContact O-N 3.18Å; Q53-N55 PolarHBondContact O-N 3.33Å
54H44.5Very low55.9Low162 Ų162120.2 Ų120.275%0.7573%0.73SS**  trans-76.5109.6179.580.4-83000109.8P52P52-H54 PolarHBondContact O-N 2.87Å
55N56.6Low55.2Low152 Ų152126.8 Ų126.881%0.81375%0.75SS**  trans-103.9103.5155.1-92.746.8000106.2Q53Q53-N55 PolarHBondContact O-N 3.33Å
56A41.5Very low54.2Low79 Ų79125.2 Ų125.265%0.65375%0.753SS**  trans-137.2138.4170.700000110.1
57P46Very low53.5Low122 Ų122126.6 Ų126.679%0.79276%0.755SS**  trans-76.1142.5-176.530.7-32.5000111.7S59P57-S59 PolarHBondContact O-N 3.43Å
58S50.4Low52.8Low124 Ų124125.3 Ų125.387%0.86775%0.753SS**  trans-53.3123.1179.7-45.30000112.2
59S43.9Very low52.5Low116 Ų116127.3 Ų127.381%0.81175%0.754SS**  trans-140.1121163.4-78.50000110.2P57P57-S59 PolarHBondContact O-N 3.43Å
60A42.6Very low52.4Low100 Ų100130.5 Ų130.583%0.82677%0.771SS**  trans38.111716000000119.6T62A60-T62 PolarHBondContact O-N 2.9Å
61S53.1Low52.2Low121 Ų121128.9 Ų128.985%0.84677%0.767SS**  trans-56.4111.6168.747.10000114.6
62T49.4Very low52.2Low125 Ų125129.1 Ų129.177%0.76777%0.77SS**SBendtrans-128.9115.2139.447.80000106.1A60 S64A60-T62 PolarHBondContact O-N 2.9Å; T62-S64 PolarHBondContact O-N 3.34Å
63S53Low52.2Low123 Ų123128.8 Ų128.886%0.8677%0.77SS**  trans-13.491-176.559.10000114.7R65S63-R65 VanDerWaalsContact C-N 3.25Å; S63-R65 PolarHBondContact O-N 2.82Å
64S46.9Very low52.2Low112 Ų112129.1 Ų129.178%0.78378%0.777SS**  trans-7779177.350.70000109.1T62 P66T62-S64 PolarHBondContact O-N 3.34Å; S64-P66 WeakPolarHBondContact O-CD 3.21Å
65R58.1Low53.2Low203 Ų203123.7 Ų123.777%0.76677%0.765SS**  trans-54.6125.4150.1-174.5175.9180175.10.7104.8S63 Q67S63-R65 VanDerWaalsContact C-N 3.25Å; S63-R65 PolarHBondContact O-N 2.82Å; R65-Q67 PolarHBondContact O-N 3.47Å
66P49.3Very low53.9Low97 Ų97122.5 Ų122.563%0.6376%0.763SS**  trans-53.8117.917121.6-29.5000105S64 V68S64-P66 WeakPolarHBondContact O-CD 3.21Å; P66-V68 HydrophobicContact CB-CG2 4.47Å; P66-V68 HydrophobicContact CG-CG2 4.42Å; P66-V68 PolarHBondContact O-N 2.69Å
67Q55.1Low55.4Low190 Ų190124 Ų12489%0.88877%0.766SS**  trans-65.382.9164.4-67.5-152.4-19.700104.1R65 P69R65-Q67 PolarHBondContact O-N 3.47Å; Q67-P69 WeakPolarHBondContact O-CD 3.43Å
68V56.6Low56.9Low101 Ų101123 Ų12361%0.61275%0.754SS**  trans-53.9115.8168.2179.40000102.2P66 L70P66-V68 HydrophobicContact CB-CG2 4.47Å; P66-V68 HydrophobicContact CG-CG2 4.42Å; P66-V68 PolarHBondContact O-N 2.69Å; V68-L70 PolarHBondContact O-N 2.98Å
69P56.4Low58.5Low104 Ų104120.3 Ų120.368%0.67574%0.735SS**  trans-50.2117.7171.2-21.532.1000104.5Q67 T71Q67-P69 WeakPolarHBondContact O-CD 3.43Å; P69-T71 PolarHBondContact O-N 3.22Å
70L59Low60.4Low168 Ų168121.5 Ų121.588%0.8873%0.732SS**  trans-61.590.8172.4-73164000103.5V68 P72V68-L70 PolarHBondContact O-N 2.98Å; L70-P72 WeakPolarHBondContact O-CD 3.39Å
71T57.4Low62.4Low116 Ų116119.3 Ų119.371%0.71271%0.714SS**  trans-52.6119.3167.833.60000103.1P69 S73P69-T71 PolarHBondContact O-N 3.22Å; T71-S73 VanDerWaalsContact C-N 3.33Å; T71-S73 PolarHBondContact O-N 3.44Å
72P60.2Low64Low114 Ų114115.7 Ų115.774%0.7469%0.689SS**  trans-54.2112174.720.8-29.5000104.4L70 L74L70-P72 WeakPolarHBondContact O-CD 3.39Å; P72-L74 PolarHBondContact O-N 2.96Å
73S57.8Low65.9Low93 Ų93110.8 Ų110.865%0.6566%0.658SS**  trans-52.6120.9179.253.20000104.8T71 G75T71-S73 VanDerWaalsContact C-N 3.33Å; T71-S73 PolarHBondContact O-N 3.44Å; S73-G75 PolarHBondContact O-N 3.17Å
74L58.3Low67.6Low189 Ų189111.4 Ų111.499%0.9965%0.648SS**SBendtrans-73.358.3-176.2-152.693.1000109.1P72P72-L74 PolarHBondContact O-N 2.96Å
75G65.2Low69.7Low48 Ų48113.8 Ų113.850%0.49565%0.646SS.*SBendtrans-160.9152.1-167.700000109.7S73S73-G75 PolarHBondContact O-N 3.17Å
76T70.9Confident71.2Confident127 Ų127108 Ų10878%0.77963%0.63SS**PPolyproline II helixtrans-56128.5179.6-39.80000109.1D78T76-D78 PolarHBondContact O-N 3.4Å
77P73.5Confident73.5Confident111 Ų111106.8 Ų106.872%0.72162%0.622SS**PPolyproline II helixtrans-57.7127.117623.5-32.5000108.8S79P77-S79 PolarHBondContact O-N 3.21Å
78D76.8Confident75.2Confident102 Ų102101.1 Ų101.155%0.54561%0.608SS.*PPolyproline II helixtrans-61123.1178.8-74.1-27.2000109T76 R92T76-D78 PolarHBondContact O-N 3.4Å; D78-R92 IonicContact OD2-CZ 3.16Å; D78-R92 IonicContact OD2-NH1 2.69Å; D78-R92 PolarHBondContact OD2-NH1 2.88Å; D78-R92 IonicContact OD2-NH2 2.82Å; D78-R92 PolarHBondContact OD2-NH2 2.92Å
79S85.3Confident77.1Confident66 Ų66106.1 Ų106.146%0.46262%0.616SS.*  trans-113.5153.6176.7174.50000109.6P77 A81 S82 V83P77-S79 PolarHBondContact O-N 3.21Å; S79-A81 PolarHBondContact O-N 3.45Å; S79-A81 VanDerWaalsContact O-N 3.14Å; S79-S82 PolarHBondContact N-OG 2.83Å; S79-S82 PolarHBondContact O-N 3.19Å; S79-S82 PolarHBondContact O-OG 2.96Å; S79-V83 PolarHBondContact O-N 3.26Å; S79-V83 VanDerWaalsContact O-N 3.15Å
80L82.9Confident78.8Confident142 Ų142108.5 Ų108.574%0.74361%0.612SS**Hα-helixtrans-59-31.8179.4-60.6-151.1000111.8V83 Q84L80-V83 PolarHBondContact O-N 3.45Å; L80-Q84 WeakPolarHBondContact O-CG 3.26Å; L80-Q84 PolarHBondContact O-N 2.78Å; L80-Q84 VanDerWaalsContact O-N 3.12Å
81A84.9Confident80.4Confident54 Ų54106.2 Ų106.245%0.44659%0.592SS.*Hα-helixtrans-64.8-39.5174.800000112.6S79 Q84 Q85S79-A81 PolarHBondContact O-N 3.45Å; S79-A81 VanDerWaalsContact O-N 3.14Å; A81-Q84 PolarHBondContact O-N 2.97Å; A81-Q85 WeakPolarHBondContact O-CG 3.44Å; A81-Q85 PolarHBondContact O-N 2.9Å
82S87.4Confident82Confident45 Ų45108.4 Ų108.432%0.31559%0.587SS.*Hα-helixtrans-70.2-36.9178.567.60000111.4S79 Q84 Q85S79-S82 PolarHBondContact N-OG 2.83Å; S79-S82 PolarHBondContact O-N 3.19Å; S79-S82 PolarHBondContact O-OG 2.96Å; S82-Q84 VanDerWaalsContact C-N 3.34Å; S82-Q84 PolarHBondContact O-N 2.66Å; S82-Q85 PolarHBondContact O-N 2.68Å
83V88.2Confident83.3Confident22 Ų22113.6 Ų113.613%0.13359%0.592CS.*Hα-helixtrans-65.7-36.6176.3179.70000111.6S79 L80 Q85 L86 R91 R92S79-V83 PolarHBondContact O-N 3.26Å; S79-V83 VanDerWaalsContact O-N 3.15Å; L80-V83 PolarHBondContact O-N 3.45Å; V83-Q85 VanDerWaalsContact C-N 3.27Å; V83-Q85 PolarHBondContact O-N 3.21Å; V83-L86 PolarHBondContact O-N 2.69Å; V83-R91 HydrophobicContact CG1-CB 4.36Å; V83-R91 WeakPolarHBondContact O-CG 3.28Å; V83-R92 HydrophobicContact CG1-CG 4.03Å; V83-R92 HydrophobicContact CG2-CG 4.34Å
84Q88.8Confident84.7Confident136 Ų136114.7 Ų114.764%0.63660%0.597SS**Hα-helixtrans-64.7-31.1177.8-75.9178.3100113L80 A81 S82 L86 R91L80-Q84 WeakPolarHBondContact O-CG 3.26Å; L80-Q84 PolarHBondContact O-N 2.78Å; L80-Q84 VanDerWaalsContact O-N 3.12Å; A81-Q84 PolarHBondContact O-N 2.97Å; S82-Q84 VanDerWaalsContact C-N 3.34Å; S82-Q84 PolarHBondContact O-N 2.66Å; Q84-L86 VanDerWaalsContact C-N 3.29Å; Q84-L86 PolarHBondContact O-N 3.45Å; Q84-R91 PolarHBondContact O-NE 3.1Å; Q84-R91 PolarHBondContact O-NH2 3.14Å
85Q91.3Very high86.2Confident162 Ų162110.5 Ų110.576%0.75758%0.575SS**Hα-helixtrans-71.4-22.6178.8-67.9169.4-6.600113.1A81 S82 V83A81-Q85 WeakPolarHBondContact O-CG 3.44Å; A81-Q85 PolarHBondContact O-N 2.9Å; S82-Q85 PolarHBondContact O-N 2.68Å; V83-Q85 VanDerWaalsContact C-N 3.27Å; V83-Q85 PolarHBondContact O-N 3.21Å
86L90.4Very high87.5Confident80 Ų80112.1 Ų112.142%0.41958%0.576SS.*SBendtrans-71149.2179.8-64.7175.6000111.9V83 Q84 R91V83-L86 PolarHBondContact O-N 2.69Å; Q84-L86 VanDerWaalsContact C-N 3.29Å; Q84-L86 PolarHBondContact O-N 3.45Å; L86-R91 HydrophobicContact CB-CG 4.35Å; L86-R91 PolarHBondContact O-NE 3.1Å; L86-R91 PolarHBondContact O-NH2 2.96Å
87P96Very high88.6Confident72 Ų72112.7 Ų112.747%0.46857%0.573SS.*  trans-55.8146.8170.7-24.532.8000112.1R89 Y90 R91P87-R89 HydrophobicContact CB-CG 4.28Å; P87-R89 PolarHBondContact O-N 2.91Å; P87-Y90 HydrophobicContact CB-CD2 3.92Å; P87-Y90 HydrophobicContact CB-CE2 4.39Å; P87-Y90 HydrophobicContact CG-CD2 4Å; P87-Y90 HydrophobicContact CG-CE2 4.38Å; P87-Y90 PolarHBondContact O-N 3.5Å; P87-R91 PolarHBondContact O-N 2.96Å
88A92.2Very high89.5Confident72 Ų72112.9 Ų112.960%0.59557%0.568SS**G310 helixtrans-51.2-37.8-173.200000114.1Y90 R91A88-Y90 PolarHBondContact O-N 3.46Å; A88-R91 PolarHBondContact O-N 3.4Å
89R95.4Very high90.3Very high206 Ų206112.3 Ų112.378%0.77756%0.562SS**G310 helixtrans-63.2-16.4177.669.2-149.8-67-171.8-2115.1P87P87-R89 HydrophobicContact CB-CG 4.28Å; P87-R89 PolarHBondContact O-N 2.91Å
90Y93.3Very high90.7Very high153 Ų153112.8 Ų112.860%0.656%0.558SS**G310 helixtrans-114.4-0.2179.8-55.5-62000112.9P87 A88 R92P87-Y90 HydrophobicContact CB-CD2 3.92Å; P87-Y90 HydrophobicContact CB-CE2 4.39Å; P87-Y90 HydrophobicContact CG-CD2 4Å; P87-Y90 HydrophobicContact CG-CE2 4.38Å; P87-Y90 PolarHBondContact O-N 3.5Å; A88-Y90 PolarHBondContact O-N 3.46Å; Y90-R92 PolarHBondContact O-N 3.13Å
91R92.9Very high91.2Very high120 Ų120109.5 Ų109.545%0.45354%0.541SS..PPolyproline II helixtrans-76.1123.4177.2-63.9-170.9-178.1116.8-0.3109.6V83 Q84 L86 P87 A88V83-R91 HydrophobicContact CG1-CB 4.36Å; V83-R91 WeakPolarHBondContact O-CG 3.28Å; Q84-R91 PolarHBondContact O-NE 3.1Å; Q84-R91 PolarHBondContact O-NH2 3.14Å; L86-R91 HydrophobicContact CB-CG 4.35Å; L86-R91 PolarHBondContact O-NE 3.1Å; L86-R91 PolarHBondContact O-NH2 2.96Å; P87-R91 PolarHBondContact O-N 2.96Å; A88-R91 PolarHBondContact O-N 3.4Å
92R89.8Confident91.7Very high162 Ų162111.9 Ų111.961%0.61154%0.54SS*.PPolyproline II helixtrans-73.1154.9171.351.5175.976.6150.712.4111.3D78 V83 Y90D78-R92 IonicContact OD2-CZ 3.16Å; D78-R92 IonicContact OD2-NH1 2.69Å; D78-R92 PolarHBondContact OD2-NH1 2.88Å; D78-R92 IonicContact OD2-NH2 2.82Å; D78-R92 PolarHBondContact OD2-NH2 2.92Å; V83-R92 HydrophobicContact CG1-CG 4.03Å; V83-R92 HydrophobicContact CG2-CG 4.34Å; Y90-R92 PolarHBondContact O-N 3.13Å
93R87.9Confident91.9Very high223 Ų223114.6 Ų114.684%0.84255%0.549SS*.PPolyproline II helixtrans-79.2145.7176.5-67.6-71.3-179.5151.70.1110.4
94P87.1Confident92.1Very high116 Ų116120 Ų12075%0.75357%0.573SS**PPolyproline II helixtrans-63.3136.4168.3-16.430000110.3
95L89.7Confident92.4Very high102 Ų102120.3 Ų120.353%0.53457%0.568SS.*PPolyproline II helixtrans-84.1134.7173.1-79.8165.6000109.9E99 M100 I103L95-E99 HydrophobicContact CD2-CB 4.43Å; L95-E99 HydrophobicContact CD2-CG 3.76Å; L95-M100 HydrophobicContact CB-CG 4.07Å; L95-I103 HydrophobicContact CD2-CD1 3.93Å
96T93.8Very high92.4Very high82 Ų82115.9 Ų115.950%0.50357%0.566SS.*PPolyproline II helixtrans-84.5158.5171.466.10000110.4D98 E99 M100T96-D98 VanDerWaalsContact C-N 3.34Å; T96-D98 PolarHBondContact O-N 3.36Å; T96-E99 PolarHBondContact O-N 2.89Å; T96-E99 VanDerWaalsContact OG1-CB 3.3Å; T96-E99 WeakPolarHBondContact OG1-CB 3.48Å; T96-E99 PolarHBondContact OG1-N 3.19Å; T96-M100 WeakPolarHBondContact O-CG 3.38Å; T96-M100 PolarHBondContact O-N 3.11Å
97L93.3Very high92.3Very high138 Ų138112.7 Ų112.772%0.72355%0.553SS**Hα-helixtrans-61-42.4179.5-67.2177.2000112.3E99 M100 D101L97-E99 VanDerWaalsContact C-N 3.31Å; L97-E99 PolarHBondContact O-N 3.2Å; L97-M100 HydrophobicContact CD2-SD 4.16Å; L97-M100 WeakPolarHBondContact O-CB 3.33Å; L97-M100 PolarHBondContact O-N 3.28Å; L97-M100 VanDerWaalsContact O-N 3.17Å; L97-D101 PolarHBondContact O-N 3.1Å
98D92.9Very high91.9Very high116 Ų116114 Ų11462%0.6256%0.562SS**Hα-helixtrans-61.1-40.5177.1-176.349000112T96 D101 Y102T96-D98 VanDerWaalsContact C-N 3.34Å; T96-D98 PolarHBondContact O-N 3.36Å; D98-D101 PolarHBondContact O-N 3.41Å; D98-Y102 WeakPolarHBondContact O-CB 3.19Å; D98-Y102 PolarHBondContact O-N 3.38Å
99E92.3Very high91.2Very high89 Ų89122.2 Ų122.242%0.41659%0.588SS.*Hα-helixtrans-66.7-40.3175-173.7176.2-172.900111.7L95 T96 L97 D101 Y102 I103L95-E99 HydrophobicContact CD2-CB 4.43Å; L95-E99 HydrophobicContact CD2-CG 3.76Å; T96-E99 PolarHBondContact O-N 2.89Å; T96-E99 VanDerWaalsContact OG1-CB 3.3Å; T96-E99 WeakPolarHBondContact OG1-CB 3.48Å; T96-E99 PolarHBondContact OG1-N 3.19Å; L97-E99 VanDerWaalsContact C-N 3.31Å; L97-E99 PolarHBondContact O-N 3.2Å; E99-D101 VanDerWaalsContact C-N 3.3Å; E99-D101 PolarHBondContact O-N 3.08Å; E99-Y102 PolarHBondContact O-N 3.26Å; E99-I103 HydrophobicContact CG-CD1 3.87Å; E99-I103 HydrophobicContact CG-CG1 4.42Å; E99-I103 WeakPolarHBondContact O-CB 3.49Å; E99-I103 WeakPolarHBondContact O-CG1 3.45Å; E99-I103 PolarHBondContact O-N 3.2Å
100M93.6Very high90.9Very high77 Ų77118.1 Ų118.138%0.37958%0.578SS.*Hα-helixtrans-57.5-46.3173.8-70.117767.500110.8L95 T96 L97 I103 Q104L95-M100 HydrophobicContact CB-CG 4.07Å; T96-M100 WeakPolarHBondContact O-CG 3.38Å; T96-M100 PolarHBondContact O-N 3.11Å; L97-M100 HydrophobicContact CD2-SD 4.16Å; L97-M100 WeakPolarHBondContact O-CB 3.33Å; L97-M100 PolarHBondContact O-N 3.28Å; L97-M100 VanDerWaalsContact O-N 3.17Å; M100-I103 PolarHBondContact O-N 3.06Å; M100-Q104 WeakPolarHBondContact O-CB 3.12Å; M100-Q104 VanDerWaalsContact O-CG 3.26Å; M100-Q104 WeakPolarHBondContact O-CG 3.32Å; M100-Q104 PolarHBondContact O-N 3.29Å
101D94.3Very high90.8Very high72 Ų72116.2 Ų116.239%0.38558%0.577SS.*Hα-helixtrans-69.5-39.2-179.4-60.9-27.7000111.5L97 D98 E99 Q104 R105L97-D101 PolarHBondContact O-N 3.1Å; D98-D101 PolarHBondContact O-N 3.41Å; E99-D101 VanDerWaalsContact C-N 3.3Å; E99-D101 PolarHBondContact O-N 3.08Å; D101-Q104 PolarHBondContact O-N 2.98Å; D101-R105 WeakPolarHBondContact O-CB 3.35Å; D101-R105 VanDerWaalsContact O-CG 3.28Å; D101-R105 WeakPolarHBondContact O-CG 3.29Å; D101-R105 PolarHBondContact O-N 3.26Å
102Y94.3Very high90.7Very high105 Ų105116 Ų11641%0.41258%0.584SS.*Hα-helixtrans-61.5-43.4175.2-177.1-94000112.2D98 E99 Q104 R105 G106 G107 P108D98-Y102 WeakPolarHBondContact O-CB 3.19Å; D98-Y102 PolarHBondContact O-N 3.38Å; E99-Y102 PolarHBondContact O-N 3.26Å; Y102-Q104 VanDerWaalsContact C-N 3.35Å; Y102-R105 PolarHBondContact O-N 2.74Å; Y102-G106 PolarHBondContact O-N 3.37Å; Y102-G107 VanDerWaalsContact CE2-C 3.4Å; Y102-G107 PolarHBondContact O-N 3.28Å; Y102-P108 HydrophobicContact CE2-CB 4.29Å; Y102-P108 HydrophobicContact CE2-CG 4.34Å; Y102-P108 WeakPolarHBondContact OH-CD 3.43Å; Y102-P108 WeakPolarHBondContact OH-CG 3.49Å
103I93Very high90.8Very high101 Ų101113.3 Ų113.352%0.51858%0.582SS.*Hα-helixtrans-64.6-40.6175.2-68.3167000110.9L95 E99 M100 G106L95-I103 HydrophobicContact CD2-CD1 3.93Å; E99-I103 HydrophobicContact CG-CD1 3.87Å; E99-I103 HydrophobicContact CG-CG1 4.42Å; E99-I103 WeakPolarHBondContact O-CB 3.49Å; E99-I103 WeakPolarHBondContact O-CG1 3.45Å; E99-I103 PolarHBondContact O-N 3.2Å; M100-I103 PolarHBondContact O-N 3.06Å; I103-G106 PolarHBondContact O-N 3.04Å
104Q92.3Very high90.9Very high135 Ų135106.4 Ų106.463%0.63157%0.566SS**Hα-helixtrans-68.7-39.3178.6-75.3-178.717.800112.7M100 D101 Y102 G106M100-Q104 WeakPolarHBondContact O-CB 3.12Å; M100-Q104 VanDerWaalsContact O-CG 3.26Å; M100-Q104 WeakPolarHBondContact O-CG 3.32Å; M100-Q104 PolarHBondContact O-N 3.29Å; D101-Q104 PolarHBondContact O-N 2.98Å; Y102-Q104 VanDerWaalsContact C-N 3.35Å; Q104-G106 VanDerWaalsContact C-N 3.32Å
105R93.8Very high91.2Very high143 Ų143105.8 Ų105.854%0.5455%0.553SS.*Hα-helixtrans-69.4-29.3175.4-71.9-173.2-55.6-99.5-0.8112.6D101 Y102D101-R105 WeakPolarHBondContact O-CB 3.35Å; D101-R105 VanDerWaalsContact O-CG 3.28Å; D101-R105 WeakPolarHBondContact O-CG 3.29Å; D101-R105 PolarHBondContact O-N 3.26Å; Y102-R105 PolarHBondContact O-N 2.74Å
106G93.2Very high91.3Very high69 Ų69106.1 Ų106.171%0.71156%0.555SS**THydrogen-bonded Turntrans98.317174.800000115Y102 I103 Q104Y102-G106 PolarHBondContact O-N 3.37Å; I103-G106 PolarHBondContact O-N 3.04Å; Q104-G106 VanDerWaalsContact C-N 3.32Å
107G88.3Confident91.1Very high13 Ų13107.9 Ų107.913%0.13456%0.559CS.*SBendtrans124.4-166.3177.900000113.8Y102Y102-G107 VanDerWaalsContact CE2-C 3.4Å; Y102-G107 PolarHBondContact O-N 3.28Å
108P87.6Confident90.9Very high101 Ų101105.4 Ų105.466%0.65655%0.545SS*.  trans-81.6152.2173.423.7-8.2000110.6Y102Y102-P108 HydrophobicContact CE2-CB 4.29Å; Y102-P108 HydrophobicContact CE2-CG 4.34Å; Y102-P108 WeakPolarHBondContact OH-CD 3.43Å; Y102-P108 WeakPolarHBondContact OH-CG 3.49Å
109E75.6Confident90.7Very high244 Ų244104.5 Ų104.5100%1.1454%0.538SS*.  trans-72.30173-57.5-68.4140.900112.5

Retrieved 109 of 109 residues in 135.7 ms (Link to these results)