A0A087X4G8_POEFO Loading...

Chromatin modification-related protein MEAF6

Component of the NuA4 histone acetyltransferase complex which is involved in transcriptional activation of select genes principally by acetylation of nucleosomal histone H4 and H2A. This modification may both alter nucleosome - DNA interactions and promote interaction of the modified histones with other proteins which positively regulate transcription. Component of HBO1 complexes, which specifically mediate acetylation of histone H3 at 'Lys-14' (H3K14ac), and have reduced activity toward histone H4. Component of the MOZ/MORF complex which has a histone H3 acetyltransferase activity.

AlphaFold DB (A0A3B3TM47), UniProt , Accession A0A087X4G8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 203 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M44.8Very low56.8Low229 Ų229143.8 Ų143.8100%1.12882%0.817SS**  0104.10-88.9168.4167.300107.9
2A48.4Very low57.5Low86 Ų86143.3 Ų143.371%0.71181%0.808SS**  trans-87.7120.1175.200000108.6H4A2-H4 PolarHBondContact O-N 3.17Å
3M56.9Low58.6Low167 Ų167139.1 Ų139.182%0.82379%0.79SS**  trans-81.2103.1178.7-53.8-64.6-176.800108A5M3-A5 PolarHBondContact O-N 3.38Å; M3-A5 VanDerWaalsContact O-N 3.1Å
4H53Low60.4Low178 Ų178136.6 Ų136.682%0.82477%0.774SS**  trans-71.5101.5171.7-66.6138.9000109.5A2 K6A2-H4 PolarHBondContact O-N 3.17Å; H4-K6 PolarHBondContact O-N 3.13Å
5A60.1Low62.5Low97 Ų97133.2 Ų133.280%0.80276%0.757SS**  trans-70.4107.6167.400000108.7M3 A7M3-A5 PolarHBondContact O-N 3.38Å; M3-A5 VanDerWaalsContact O-N 3.1Å; A5-A7 PolarHBondContact O-N 3.48Å; A5-A7 VanDerWaalsContact O-N 3.13Å
6K54.4Low64.3Low203 Ų203138 Ų13888%0.88376%0.759SS**  trans-71.3104.5176.5-153.9174.6-172.4179.20107.8H4 T8H4-K6 PolarHBondContact O-N 3.13Å; K6-T8 PolarHBondContact O-N 3.33Å
7A61.5Low65.9Low92 Ų92139.5 Ų139.576%0.7675%0.751SS**PPolyproline II helixtrans-61.8118.3174.400000109.4A5 P9A5-A7 PolarHBondContact O-N 3.48Å; A5-A7 VanDerWaalsContact O-N 3.13Å; A7-P9 WeakPolarHBondContact O-CD 3.32Å
8T63.5Low67.4Low130 Ų130137.8 Ų137.880%0.79874%0.737SS**PPolyproline II helixtrans-64.6120.3172-42.40000107.8K6K6-T8 PolarHBondContact O-N 3.33Å
9P61.2Low68.9Low101 Ų101136.3 Ų136.366%0.65673%0.729SS**PPolyproline II helixtrans-61.7145.2177.723.6-30.7000109.8A7 Q11A7-P9 WeakPolarHBondContact O-CD 3.32Å; P9-Q11 PolarHBondContact O-N 2.97Å; P9-Q11 VanDerWaalsContact O-N 3.13Å
10P59.5Low70.2Confident116 Ų116132.6 Ų132.675%0.75372%0.718SS**PPolyproline II helixtrans-58.2120.8178.423.8-31.9000108.9I12P10-I12 PolarHBondContact O-N 3.11Å
11Q61.6Low71.4Confident183 Ų183131.4 Ų131.486%0.85571%0.707SS**  trans-62.899.6171.3-84-82.9-2000107.6P9 P13P9-Q11 PolarHBondContact O-N 2.97Å; P9-Q11 VanDerWaalsContact O-N 3.13Å; Q11-P13 VanDerWaalsContact O-CD 3.3Å; Q11-P13 WeakPolarHBondContact O-CD 3.45Å
12I65.6Low74Confident138 Ų138125.2 Ų125.271%0.70868%0.679SS**  trans-66116.5170.2-59.7166.3000105.3P10 D14P10-I12 PolarHBondContact O-N 3.11Å; I12-D14 PolarHBondContact O-N 2.74Å
13P71.8Confident76.3Confident88 Ų88125.4 Ų125.457%0.57167%0.67SS**  trans-56141.4175.621.7-30.3000109.2Q11 T15Q11-P13 VanDerWaalsContact O-CD 3.3Å; Q11-P13 WeakPolarHBondContact O-CD 3.45Å; P13-T15 PolarHBondContact O-N 3.45Å
14D83.2Confident78.3Confident105 Ų105123.9 Ų123.956%0.56166%0.659SS**  trans-70.676.2179.7-172.2-2.3000110I12 R16 R17 E18I12-D14 PolarHBondContact O-N 2.74Å; D14-R16 PolarHBondContact O-N 3.13Å; D14-R16 VanDerWaalsContact O-N 3.11Å; D14-R17 HydrophobicContact CB-CB 4.1Å; D14-R17 WeakPolarHBondContact O-CB 3.49Å; D14-R17 PolarHBondContact O-N 3.21Å; D14-R17 PolarHBondContact OD1-N 3.06Å; D14-E18 PolarHBondContact O-N 3.31Å
15T91.6Very high80.4Confident85 Ų85123.2 Ų123.252%0.52165%0.65SS.*Hα-helixtrans-56-27.6-176.751.80000112.7P13 L19P13-T15 PolarHBondContact O-N 3.45Å; T15-L19 WeakPolarHBondContact O-CB 3.32Å; T15-L19 PolarHBondContact O-N 2.94Å
16R91.1Very high82.2Confident210 Ų210126.3 Ų126.379%0.79265%0.645SS**Hα-helixtrans-68.8-42.8175.2-76.5-174.9148.3-133.4-4.4111.7D14 A20D14-R16 PolarHBondContact O-N 3.13Å; D14-R16 VanDerWaalsContact O-N 3.11Å; R16-A20 PolarHBondContact O-N 2.92Å; R16-A20 VanDerWaalsContact O-N 3.13Å
17R92.5Very high84.3Confident164 Ų164121.7 Ų121.762%0.61963%0.626SS**Hα-helixtrans-65.2-45.9174.5178-178.8170.6168.30.6111.3D14 L19 A20 E21D14-R17 HydrophobicContact CB-CB 4.1Å; D14-R17 WeakPolarHBondContact O-CB 3.49Å; D14-R17 PolarHBondContact O-N 3.21Å; D14-R17 PolarHBondContact OD1-N 3.06Å; R17-L19 VanDerWaalsContact C-N 3.32Å; R17-L19 PolarHBondContact O-N 3Å; R17-A20 WeakPolarHBondContact O-CB 3.43Å; R17-A20 PolarHBondContact O-N 3.3Å; R17-A20 VanDerWaalsContact O-N 3.13Å; R17-E21 IonicContact CZ-OE1 2.97Å; R17-E21 IonicContact NE-OE1 3.94Å; R17-E21 PolarHBondContact NE-OE1 3.13Å; R17-E21 IonicContact NH2-OE1 3.46Å; R17-E21 PolarHBondContact O-N 3.02Å
18E93.2Very high86Confident108 Ų108121.5 Ų121.551%0.50561%0.61SS.*Hα-helixtrans-58.4-44.6177.5-175.4179.6-176.900111.6D14 A20 E21 L22D14-E18 PolarHBondContact O-N 3.31Å; E18-A20 VanDerWaalsContact C-N 3.32Å; E18-A20 PolarHBondContact O-N 3.48Å; E18-E21 PolarHBondContact O-N 3.21Å; E18-L22 HydrophobicContact CG-CD1 4.39Å; E18-L22 WeakPolarHBondContact O-CG 3.38Å; E18-L22 PolarHBondContact O-N 3.39Å
19L94.9Very high87.6Confident110 Ų110120.3 Ų120.358%0.57660%0.598SS**Hα-helixtrans-59.4-42.4175.3-178.863.8000112.1T15 R17 E21 L22 V23T15-L19 WeakPolarHBondContact O-CB 3.32Å; T15-L19 PolarHBondContact O-N 2.94Å; R17-L19 VanDerWaalsContact C-N 3.32Å; R17-L19 PolarHBondContact O-N 3Å; L19-E21 VanDerWaalsContact C-N 3.34Å; L19-E21 PolarHBondContact O-N 3.4Å; L19-L22 PolarHBondContact O-N 3.46Å; L19-V23 HydrophobicContact CD1-CG2 4.38Å; L19-V23 VanDerWaalsContact O-CG2 3.32Å; L19-V23 WeakPolarHBondContact O-CG2 3.41Å; L19-V23 PolarHBondContact O-N 3.06Å
20A95.6Very high89.3Confident61 Ų61117.7 Ų117.750%0.50459%0.585SS.*Hα-helixtrans-62.7-40.9177.600000112R16 R17 E18 V23 K24R16-A20 PolarHBondContact O-N 2.92Å; R16-A20 VanDerWaalsContact O-N 3.13Å; R17-A20 WeakPolarHBondContact O-CB 3.43Å; R17-A20 PolarHBondContact O-N 3.3Å; R17-A20 VanDerWaalsContact O-N 3.13Å; E18-A20 VanDerWaalsContact C-N 3.32Å; E18-A20 PolarHBondContact O-N 3.48Å; A20-V23 PolarHBondContact O-N 3.41Å; A20-K24 WeakPolarHBondContact O-CB 3.44Å; A20-K24 PolarHBondContact O-N 3.25Å
21E96.1Very high91.1Very high108 Ų108116.9 Ų116.951%0.50557%0.571SS.*Hα-helixtrans-64.5-41.7175.4-69.5177.9-168.200111.5R17 E18 L19 K24 R25R17-E21 IonicContact CZ-OE1 2.97Å; R17-E21 IonicContact NE-OE1 3.94Å; R17-E21 PolarHBondContact NE-OE1 3.13Å; R17-E21 IonicContact NH2-OE1 3.46Å; R17-E21 PolarHBondContact O-N 3.02Å; E18-E21 PolarHBondContact O-N 3.21Å; L19-E21 VanDerWaalsContact C-N 3.34Å; L19-E21 PolarHBondContact O-N 3.4Å; E21-K24 PolarHBondContact O-N 3.37Å; E21-R25 WeakPolarHBondContact O-CB 3.3Å; E21-R25 PolarHBondContact O-N 3.13Å
22L97.5Very high92.8Very high100 Ų100111.8 Ų111.852%0.52455%0.552SS.*Hα-helixtrans-64.7-42.4176-71.6174.4000112.7E18 L19 R25 K26E18-L22 HydrophobicContact CG-CD1 4.39Å; E18-L22 WeakPolarHBondContact O-CG 3.38Å; E18-L22 PolarHBondContact O-N 3.39Å; L19-L22 PolarHBondContact O-N 3.46Å; L22-R25 PolarHBondContact O-N 3.41Å; L22-K26 WeakPolarHBondContact O-CB 3.44Å; L22-K26 PolarHBondContact O-N 3.17Å
23V97.9Very high94.3Very high89 Ų89109.2 Ų109.254%0.53954%0.54SS..Hα-helixtrans-63.5-43.7176.6169.60000110.7L19 A20 K26 Q27L19-V23 HydrophobicContact CD1-CG2 4.38Å; L19-V23 VanDerWaalsContact O-CG2 3.32Å; L19-V23 WeakPolarHBondContact O-CG2 3.41Å; L19-V23 PolarHBondContact O-N 3.06Å; A20-V23 PolarHBondContact O-N 3.41Å; V23-K26 WeakPolarHBondContact O-CB 3.4Å; V23-K26 PolarHBondContact O-N 2.97Å; V23-Q27 PolarHBondContact O-N 3.01Å
24K98Very high95.5Very high135 Ų135107.4 Ų107.459%0.58753%0.527SS*.Hα-helixtrans-59.7-48.1175.5-171.1-169.6-179.1-152.90111.3A20 E21 K26 Q27 E28A20-K24 WeakPolarHBondContact O-CB 3.44Å; A20-K24 PolarHBondContact O-N 3.25Å; E21-K24 PolarHBondContact O-N 3.37Å; K24-K26 VanDerWaalsContact C-N 3.31Å; K24-K26 PolarHBondContact O-N 3.2Å; K24-Q27 WeakPolarHBondContact O-CB 3.37Å; K24-Q27 PolarHBondContact O-N 3.33Å; K24-Q27 VanDerWaalsContact O-N 3.12Å; K24-E28 WeakPolarHBondContact CE-OE1 3.48Å; K24-E28 IonicContact NZ-OE1 3.05Å; K24-E28 PolarHBondContact NZ-OE1 3.18Å; K24-E28 WeakPolarHBondContact O-CG 3.27Å; K24-E28 PolarHBondContact O-N 3.49Å
25R98.1Very high96.1Very high165 Ų165106.6 Ų106.662%0.62352%0.522SS*.Hα-helixtrans-62.1-39178.5-169.8-178.1-176.2117.61.5112.2E21 L22 Q27 E28 L29E21-R25 WeakPolarHBondContact O-CB 3.3Å; E21-R25 PolarHBondContact O-N 3.13Å; L22-R25 PolarHBondContact O-N 3.41Å; R25-Q27 VanDerWaalsContact C-N 3.3Å; R25-Q27 PolarHBondContact O-N 3.41Å; R25-E28 PolarHBondContact O-N 2.93Å; R25-L29 HydrophobicContact CG-CD1 4.33Å; R25-L29 WeakPolarHBondContact O-CB 3.36Å; R25-L29 VanDerWaalsContact O-CG 3.32Å; R25-L29 WeakPolarHBondContact O-CG 3.38Å; R25-L29 PolarHBondContact O-N 2.85Å
26K97.9Very high96.4Very high161 Ų161106.7 Ų106.770%0.752%0.519SS*.Hα-helixtrans-59.6-42.8174.5-179.1-173.3172.4-173.80111.1L22 V23 K24 L29 A30L22-K26 WeakPolarHBondContact O-CB 3.44Å; L22-K26 PolarHBondContact O-N 3.17Å; V23-K26 WeakPolarHBondContact O-CB 3.4Å; V23-K26 PolarHBondContact O-N 2.97Å; K24-K26 VanDerWaalsContact C-N 3.31Å; K24-K26 PolarHBondContact O-N 3.2Å; K26-L29 PolarHBondContact O-N 3.1Å; K26-A30 WeakPolarHBondContact O-CB 3.48Å; K26-A30 PolarHBondContact O-N 3.46Å
27Q97.8Very high96.8Very high106 Ų10697.2 Ų97.250%0.49548%0.484SS..Hα-helixtrans-63.9-48.5177.5-179.361.42500111.6V23 K24 R25 L29 A30 E31V23-Q27 PolarHBondContact O-N 3.01Å; K24-Q27 WeakPolarHBondContact O-CB 3.37Å; K24-Q27 PolarHBondContact O-N 3.33Å; K24-Q27 VanDerWaalsContact O-N 3.12Å; R25-Q27 VanDerWaalsContact C-N 3.3Å; R25-Q27 PolarHBondContact O-N 3.41Å; Q27-L29 VanDerWaalsContact C-N 3.29Å; Q27-L29 PolarHBondContact O-N 3.23Å; Q27-A30 WeakPolarHBondContact O-CB 3.41Å; Q27-A30 PolarHBondContact O-N 3.3Å; Q27-A30 VanDerWaalsContact O-N 3.11Å; Q27-E31 PolarHBondContact NE2-OE1 3.28Å; Q27-E31 WeakPolarHBondContact O-CG 3.32Å; Q27-E31 PolarHBondContact O-N 2.96Å
28E97.7Very high96.9Very high89 Ų8992.2 Ų92.242%0.41647%0.465SS..Hα-helixtrans-58.9-40.1177.9-68.7169.3-179.800112K24 R25 T32K24-E28 WeakPolarHBondContact CE-OE1 3.48Å; K24-E28 IonicContact NZ-OE1 3.05Å; K24-E28 PolarHBondContact NZ-OE1 3.18Å; K24-E28 WeakPolarHBondContact O-CG 3.27Å; K24-E28 PolarHBondContact O-N 3.49Å; R25-E28 PolarHBondContact O-N 2.93Å; E28-T32 WeakPolarHBondContact O-CB 3.46Å; E28-T32 PolarHBondContact O-N 3.41Å; E28-T32 PolarHBondContact O-OG1 2.95Å
29L98Very high97.2Very high105 Ų10591.7 Ų91.755%0.5546%0.463SS..Hα-helixtrans-67.5-39.4175.6-73.5174.1000112.3R25 K26 Q27 T32 L33R25-L29 HydrophobicContact CG-CD1 4.33Å; R25-L29 WeakPolarHBondContact O-CB 3.36Å; R25-L29 VanDerWaalsContact O-CG 3.32Å; R25-L29 WeakPolarHBondContact O-CG 3.38Å; R25-L29 PolarHBondContact O-N 2.85Å; K26-L29 PolarHBondContact O-N 3.1Å; Q27-L29 VanDerWaalsContact C-N 3.29Å; Q27-L29 PolarHBondContact O-N 3.23Å; L29-T32 PolarHBondContact O-N 2.91Å; L29-L33 WeakPolarHBondContact O-CB 3.38Å; L29-L33 PolarHBondContact O-N 3.31Å
30A96.3Very high97.3Very high45 Ų4589.8 Ų89.837%0.37245%0.452SS..Hα-helixtrans-63.5-42.8176.900000111.5K26 Q27 L33 V34K26-A30 WeakPolarHBondContact O-CB 3.48Å; K26-A30 PolarHBondContact O-N 3.46Å; Q27-A30 WeakPolarHBondContact O-CB 3.41Å; Q27-A30 PolarHBondContact O-N 3.3Å; Q27-A30 VanDerWaalsContact O-N 3.11Å; A30-L33 PolarHBondContact O-N 3.02Å; A30-V34 WeakPolarHBondContact O-CG2 3.49Å; A30-V34 PolarHBondContact O-N 3.23Å
31E96Very high97.4Very high100 Ų10089.9 Ų89.947%0.46744%0.44SS..Hα-helixtrans-62.8-44.4175-70.9170.8-165.800111.7Q27 L33 V34 N35Q27-E31 PolarHBondContact NE2-OE1 3.28Å; Q27-E31 WeakPolarHBondContact O-CG 3.32Å; Q27-E31 PolarHBondContact O-N 2.96Å; E31-L33 VanDerWaalsContact C-N 3.33Å; E31-L33 PolarHBondContact O-N 3.11Å; E31-V34 PolarHBondContact O-N 3Å; E31-N35 VanDerWaalsContact O-CG 3.28Å; E31-N35 PolarHBondContact O-N 3.47Å; E31-N35 PolarHBondContact O-ND2 3.42Å
32T97.4Very high97.5Very high75 Ų7587.8 Ų87.846%0.4644%0.441SS..Hα-helixtrans-61.3-43.1177-56.50000111.4E28 L29 N35 L36E28-T32 WeakPolarHBondContact O-CB 3.46Å; E28-T32 PolarHBondContact O-N 3.41Å; E28-T32 PolarHBondContact O-OG1 2.95Å; L29-T32 PolarHBondContact O-N 2.91Å; T32-N35 PolarHBondContact O-N 3.12Å; T32-L36 HydrophobicContact CG2-CD1 4.26Å; T32-L36 WeakPolarHBondContact O-CG 3.43Å; T32-L36 PolarHBondContact O-N 2.99Å
33L97.2Very high97.5Very high85 Ų8589.6 Ų89.645%0.44545%0.445SS..Hα-helixtrans-59.5-50.6177.117964.4000111.3L29 A30 E31 N35 L36 E37L29-L33 WeakPolarHBondContact O-CB 3.38Å; L29-L33 PolarHBondContact O-N 3.31Å; A30-L33 PolarHBondContact O-N 3.02Å; E31-L33 VanDerWaalsContact C-N 3.33Å; E31-L33 PolarHBondContact O-N 3.11Å; L33-N35 VanDerWaalsContact C-N 3.26Å; L33-N35 PolarHBondContact O-N 3.49Å; L33-L36 PolarHBondContact O-N 3.42Å; L33-L36 VanDerWaalsContact O-N 3.1Å; L33-E37 HydrophobicContact CD1-CG 4.22Å; L33-E37 HydrophobicContact CG-CG 4.46Å; L33-E37 WeakPolarHBondContact O-CG 3.18Å; L33-E37 PolarHBondContact O-N 3.37Å
34V97.1Very high97.5Very high50 Ų5085.9 Ų85.930%0.30342%0.422SS..Hα-helixtrans-57.5-41.6178.6169.90000111.1A30 E31 R38 A99A30-V34 WeakPolarHBondContact O-CG2 3.49Å; A30-V34 PolarHBondContact O-N 3.23Å; E31-V34 PolarHBondContact O-N 3Å; V34-R38 WeakPolarHBondContact O-CB 3.37Å; V34-R38 WeakPolarHBondContact O-CD 3.28Å; V34-R38 VanDerWaalsContact O-CG 3.22Å; V34-R38 WeakPolarHBondContact O-CG 3.2Å; V34-R38 PolarHBondContact O-N 2.82Å; V34-R38 VanDerWaalsContact O-N 3.09Å; V34-A99 HydrophobicContact CG1-CB 4.12Å
35N97.1Very high97.4Very high87 Ų8780 Ų8047%0.46540%0.399SS..Hα-helixtrans-65.3-38.9178-71.5-29.1000112.7E31 T32 L33 Q39E31-N35 VanDerWaalsContact O-CG 3.28Å; E31-N35 PolarHBondContact O-N 3.47Å; E31-N35 PolarHBondContact O-ND2 3.42Å; T32-N35 PolarHBondContact O-N 3.12Å; L33-N35 VanDerWaalsContact C-N 3.26Å; L33-N35 PolarHBondContact O-N 3.49Å; N35-Q39 VanDerWaalsContact O-CG 3.31Å; N35-Q39 WeakPolarHBondContact O-CG 3.45Å; N35-Q39 PolarHBondContact O-N 3.39Å; N35-Q39 VanDerWaalsContact O-N 3.14Å; N35-Q39 PolarHBondContact O-NE2 2.89Å; N35-Q39 VanDerWaalsContact O-NE2 3.1Å
36L98.1Very high97.3Very high88 Ų8874.6 Ų74.646%0.46139%0.386SS..Hα-helixtrans-68.7-45176.9-72.6172.4000111.7T32 L33 R38 Q39 I40T32-L36 HydrophobicContact CG2-CD1 4.26Å; T32-L36 WeakPolarHBondContact O-CG 3.43Å; T32-L36 PolarHBondContact O-N 2.99Å; L33-L36 PolarHBondContact O-N 3.42Å; L33-L36 VanDerWaalsContact O-N 3.1Å; L36-R38 VanDerWaalsContact C-N 3.27Å; L36-R38 PolarHBondContact O-N 2.77Å; L36-Q39 WeakPolarHBondContact O-CB 3.1Å; L36-Q39 PolarHBondContact O-N 2.99Å; L36-Q39 VanDerWaalsContact O-N 3.12Å; L36-I40 WeakPolarHBondContact O-CG1 3.49Å; L36-I40 PolarHBondContact O-N 3.34Å
37E97.8Very high97.3Very high10 Ų1070.7 Ų70.75%0.04737%0.368CS..Hα-helixtrans-60.4-39.2178.4-70-178.5141.600111.8L33 I40 Y41 S93 T95 A99L33-E37 HydrophobicContact CD1-CG 4.22Å; L33-E37 HydrophobicContact CG-CG 4.46Å; L33-E37 WeakPolarHBondContact O-CG 3.18Å; L33-E37 PolarHBondContact O-N 3.37Å; E37-I40 PolarHBondContact O-N 2.94Å; E37-Y41 PolarHBondContact O-N 2.94Å; E37-S93 WeakPolarHBondContact OE1-CB 3.31Å; E37-S93 PolarHBondContact OE1-OG 3.13Å; E37-T95 PolarHBondContact OE1-OG1 2.79Å; E37-T95 PolarHBondContact OE2-OG1 3.04Å; E37-A99 HydrophobicContact CB-CB 3.91Å; E37-A99 WeakPolarHBondContact OE2-CB 3.17Å
38R96.4Very high97.2Very high60 Ų6065.9 Ų65.923%0.22635%0.345CS..Hα-helixtrans-63.1-43.9173.3-73.6171.3178.1-143.7-5112.6V34 L36 Y41 A42 A99 A102V34-R38 WeakPolarHBondContact O-CB 3.37Å; V34-R38 WeakPolarHBondContact O-CD 3.28Å; V34-R38 VanDerWaalsContact O-CG 3.22Å; V34-R38 WeakPolarHBondContact O-CG 3.2Å; V34-R38 PolarHBondContact O-N 2.82Å; V34-R38 VanDerWaalsContact O-N 3.09Å; L36-R38 VanDerWaalsContact C-N 3.27Å; L36-R38 PolarHBondContact O-N 2.77Å; R38-Y41 PolarHBondContact O-N 3.06Å; R38-A42 WeakPolarHBondContact O-CB 3.5Å; R38-A42 PolarHBondContact O-N 3.36Å; R38-A99 HydrophobicContact CG-CB 4.5Å; R38-A99 PolarHBondContact NE-O 2.85Å; R38-A99 PolarHBondContact NH2-O 3.41Å; R38-A102 VanDerWaalsContact NH2-C 3.34Å
39Q98Very high97.1Very high96 Ų9667.6 Ų67.645%0.44935%0.354SS..Hα-helixtrans-63.8-43.6177.7-76.2171.366.200111.5N35 L36 Y41 A42 F43N35-Q39 VanDerWaalsContact O-CG 3.31Å; N35-Q39 WeakPolarHBondContact O-CG 3.45Å; N35-Q39 PolarHBondContact O-N 3.39Å; N35-Q39 VanDerWaalsContact O-N 3.14Å; N35-Q39 PolarHBondContact O-NE2 2.89Å; N35-Q39 VanDerWaalsContact O-NE2 3.1Å; L36-Q39 WeakPolarHBondContact O-CB 3.1Å; L36-Q39 PolarHBondContact O-N 2.99Å; L36-Q39 VanDerWaalsContact O-N 3.12Å; Q39-Y41 VanDerWaalsContact C-N 3.33Å; Q39-Y41 PolarHBondContact O-N 3.42Å; Q39-A42 PolarHBondContact O-N 3.05Å; Q39-F43 HydrophobicContact CB-CD2 4.34Å; Q39-F43 HydrophobicContact CB-CE2 4.25Å; Q39-F43 WeakPolarHBondContact O-CB 3.4Å; Q39-F43 WeakPolarHBondContact O-CD2 3.5Å; Q39-F43 WeakPolarHBondContact O-CG 3.4Å; Q39-F43 PolarHBondContact O-N 3.26Å
40I98.1Very high96.9Very high70 Ų7068.2 Ų68.236%0.35936%0.358SS..Hα-helixtrans-56.7-50.4174.9-69.2166.2000109.6L36 E37 A42 F43 E44 F89L36-I40 WeakPolarHBondContact O-CG1 3.49Å; L36-I40 PolarHBondContact O-N 3.34Å; E37-I40 PolarHBondContact O-N 2.94Å; I40-A42 VanDerWaalsContact C-N 3.34Å; I40-A42 PolarHBondContact O-N 2.95Å; I40-F43 PolarHBondContact O-N 2.65Å; I40-E44 HydrophobicContact CG2-CG 4.27Å; I40-E44 WeakPolarHBondContact O-CB 3.22Å; I40-E44 VanDerWaalsContact O-CG 3.3Å; I40-E44 WeakPolarHBondContact O-CG 3.5Å; I40-E44 PolarHBondContact O-N 3.01Å; I40-F89 HydrophobicContact CG2-CB 3.68Å
41Y98Very high96.7Very high64 Ų6467.2 Ų67.225%0.25135%0.347SS..Hα-helixtrans-59.2-43179.1-174.5-89000112.8E37 R38 Q39 G45 E84 R87 S90 V100E37-Y41 PolarHBondContact O-N 2.94Å; R38-Y41 PolarHBondContact O-N 3.06Å; Q39-Y41 VanDerWaalsContact C-N 3.33Å; Q39-Y41 PolarHBondContact O-N 3.42Å; Y41-G45 PolarHBondContact O-N 3.44Å; Y41-E84 VanDerWaalsContact CE2-OE1 3.28Å; Y41-E84 WeakPolarHBondContact CE2-OE1 3.49Å; Y41-E84 PolarHBondContact OH-OE1 3.12Å; Y41-E84 PolarHBondContact OH-OE2 3.31Å; Y41-R87 PolarHBondContact O-NH1 3.35Å; Y41-S90 WeakPolarHBondContact CA-OG 3.14Å; Y41-V100 HydrophobicContact CD1-CG1 4.11Å; Y41-V100 HydrophobicContact CD1-CG2 3.95Å; Y41-V100 HydrophobicContact CD2-CG2 3.79Å; Y41-V100 HydrophobicContact CE1-CG1 3.99Å; Y41-V100 HydrophobicContact CE2-CG2 4.37Å; Y41-V100 HydrophobicContact CG-CG1 4.46Å; Y41-V100 HydrophobicContact CG-CG2 3.55Å
42A97.3Very high96.4Very high63 Ų6364.3 Ų64.352%0.52133%0.333SS..Hα-helixtrans-63.8-49.117700000111.8R38 Q39 I40 E44 G45 S46R38-A42 WeakPolarHBondContact O-CB 3.5Å; R38-A42 PolarHBondContact O-N 3.36Å; Q39-A42 PolarHBondContact O-N 3.05Å; I40-A42 VanDerWaalsContact C-N 3.34Å; I40-A42 PolarHBondContact O-N 2.95Å; A42-E44 PolarHBondContact O-N 2.99Å; A42-G45 PolarHBondContact O-N 2.59Å; A42-G45 VanDerWaalsContact O-N 3.09Å; A42-S46 PolarHBondContact O-N 3.5Å
43F98.3Very high96Very high138 Ų13865.8 Ų65.861%0.60534%0.336SS*.Hα-helixtrans-65.9-35.1179.9-74.3-46.2000113.3Q39 I40 G45 S46 Y47Q39-F43 HydrophobicContact CB-CD2 4.34Å; Q39-F43 HydrophobicContact CB-CE2 4.25Å; Q39-F43 WeakPolarHBondContact O-CB 3.4Å; Q39-F43 WeakPolarHBondContact O-CD2 3.5Å; Q39-F43 WeakPolarHBondContact O-CG 3.4Å; Q39-F43 PolarHBondContact O-N 3.26Å; I40-F43 PolarHBondContact O-N 2.65Å; F43-G45 PolarHBondContact O-N 2.55Å; F43-S46 PolarHBondContact O-OG 3.22Å; F43-S46 VanDerWaalsContact O-OG 3.1Å; F43-Y47 WeakPolarHBondContact O-CB 3.24Å; F43-Y47 PolarHBondContact O-N 3.42Å
44E97.4Very high95.6Very high12 Ų1268.5 Ų68.56%0.05634%0.342CS..Hα-helixtrans-61.1-37.8172.4-79.5-174.3133.900111.6I40 A42 L48 R87 L88 F89 S90I40-E44 HydrophobicContact CG2-CG 4.27Å; I40-E44 WeakPolarHBondContact O-CB 3.22Å; I40-E44 VanDerWaalsContact O-CG 3.3Å; I40-E44 WeakPolarHBondContact O-CG 3.5Å; I40-E44 PolarHBondContact O-N 3.01Å; A42-E44 PolarHBondContact O-N 2.99Å; E44-L48 WeakPolarHBondContact O-CB 3.24Å; E44-L48 WeakPolarHBondContact O-CG 3.34Å; E44-L48 PolarHBondContact O-N 3.4Å; E44-R87 HydrophobicContact CB-CG 4.48Å; E44-R87 WeakPolarHBondContact OE1-CA 3.28Å; E44-R87 WeakPolarHBondContact OE2-CB 3.3Å; E44-R87 IonicContact OE2-NH1 3.03Å; E44-L88 PolarHBondContact OE1-N 3.13Å; E44-F89 HydrophobicContact CG-CB 4.36Å; E44-F89 HydrophobicContact CG-CD2 4.12Å; E44-F89 VanDerWaalsContact OE1-CA 3.24Å; E44-F89 WeakPolarHBondContact OE1-CA 3.28Å; E44-F89 WeakPolarHBondContact OE1-CB 3.31Å; E44-F89 WeakPolarHBondContact OE1-CD2 3.41Å; E44-F89 PolarHBondContact OE1-N 3.45Å; E44-S90 PolarHBondContact OE1-N 3.42Å; E44-S90 WeakPolarHBondContact OE2-CB 2.99Å; E44-S90 PolarHBondContact OE2-N 3.5Å; E44-S90 PolarHBondContact OE2-OG 2.93Å
45G95.9Very high95.3Very high10 Ų1066.5 Ų66.510%0.10333%0.331CS..Hα-helixtrans-60.6-55.5178.400000111.4Y41 A42 F43 Y47 L48 E49Y41-G45 PolarHBondContact O-N 3.44Å; A42-G45 PolarHBondContact O-N 2.59Å; A42-G45 VanDerWaalsContact O-N 3.09Å; F43-G45 PolarHBondContact O-N 2.55Å; G45-Y47 PolarHBondContact O-N 3.46Å; G45-L48 PolarHBondContact O-N 3.36Å; G45-E49 WeakPolarHBondContact O-CB 3.45Å; G45-E49 PolarHBondContact O-N 3.36Å; G45-E49 VanDerWaalsContact O-N 3.13Å
46S96.7Very high95.2Very high52 Ų5262.5 Ų62.536%0.36431%0.309SS..Hα-helixtrans-63.3-43.117958.30000112A42 F43 L48 E49 D50A42-S46 PolarHBondContact O-N 3.5Å; F43-S46 PolarHBondContact O-OG 3.22Å; F43-S46 VanDerWaalsContact O-OG 3.1Å; S46-L48 PolarHBondContact O-N 2.89Å; S46-E49 PolarHBondContact O-N 3.09Å; S46-D50 WeakPolarHBondContact O-CB 3.19Å; S46-D50 VanDerWaalsContact O-CG 3.26Å; S46-D50 PolarHBondContact O-N 2.97Å
47Y97.6Very high95Very high79 Ų7963.3 Ų63.331%0.3131%0.313SS..Hα-helixtrans-59.9-46.3179.2177.9-98.8000112.3F43 G45 T51 N56 I57F43-Y47 WeakPolarHBondContact O-CB 3.24Å; F43-Y47 PolarHBondContact O-N 3.42Å; G45-Y47 PolarHBondContact O-N 3.46Å; Y47-T51 HydrophobicContact CD2-CG2 3.91Å; Y47-T51 HydrophobicContact CE2-CG2 3.72Å; Y47-T51 HydrophobicContact CG-CG2 4.46Å; Y47-T51 VanDerWaalsContact O-CB 3.3Å; Y47-T51 WeakPolarHBondContact O-CB 3.37Å; Y47-T51 VanDerWaalsContact O-CG2 3.25Å; Y47-T51 WeakPolarHBondContact O-CG2 3.46Å; Y47-T51 PolarHBondContact O-N 3.35Å; Y47-T51 VanDerWaalsContact O-N 3.12Å; Y47-T51 PolarHBondContact O-OG1 2.93Å; Y47-N56 HydrophobicContact CE1-CB 3.94Å; Y47-I57 HydrophobicContact CE1-CG2 4.02Å
48L95.3Very high94.9Very high5 Ų565 Ų653%0.02632%0.322CS..Hα-helixtrans-69.4-35.5-178.6-68.3177.1000112.5E44 G45 S46 Q52 I58 F82 E86 R87E44-L48 WeakPolarHBondContact O-CB 3.24Å; E44-L48 WeakPolarHBondContact O-CG 3.34Å; E44-L48 PolarHBondContact O-N 3.4Å; G45-L48 PolarHBondContact O-N 3.36Å; S46-L48 PolarHBondContact O-N 2.89Å; L48-Q52 PolarHBondContact O-N 2.96Å; L48-I58 HydrophobicContact CD2-CB 4.45Å; L48-I58 HydrophobicContact CD2-CG1 3.65Å; L48-F82 HydrophobicContact CB-CB 3.93Å; L48-F82 HydrophobicContact CB-CD2 4.33Å; L48-F82 HydrophobicContact CB-CG 4.05Å; L48-F82 HydrophobicContact CD1-CD2 4.27Å; L48-E86 HydrophobicContact CD1-CB 4.06Å; L48-R87 HydrophobicContact CD1-CG 4.31Å
49E94.3Very high94.6Very high126 Ų12666.1 Ų66.159%0.58933%0.326SS*.Hα-helixtrans-66.5-51.5175.9-175.1161.7-149.100111.5G45 S46 T51 F82G45-E49 WeakPolarHBondContact O-CB 3.45Å; G45-E49 PolarHBondContact O-N 3.36Å; G45-E49 VanDerWaalsContact O-N 3.13Å; S46-E49 PolarHBondContact O-N 3.09Å; E49-T51 PolarHBondContact O-N 3.44Å; E49-F82 HydrophobicContact CB-CD1 4.35Å; E49-F82 HydrophobicContact CB-CE1 4.22Å
50D94.3Very high94.4Very high118 Ų11862.8 Ų62.863%0.63132%0.318SS*.Hα-helixtrans-68.5-33.2-174.9-69.8-21.7000113S46S46-D50 WeakPolarHBondContact O-CB 3.19Å; S46-D50 VanDerWaalsContact O-CG 3.26Å; S46-D50 PolarHBondContact O-N 2.97Å
51T92.9Very high94.1Very high24 Ų2466 Ų6615%0.14733%0.325CS..Hα-helixtrans-94.4-5.2-172.563.70000114.5Y47 E49 M53 Y54 G55 N56Y47-T51 HydrophobicContact CD2-CG2 3.91Å; Y47-T51 HydrophobicContact CE2-CG2 3.72Å; Y47-T51 HydrophobicContact CG-CG2 4.46Å; Y47-T51 VanDerWaalsContact O-CB 3.3Å; Y47-T51 WeakPolarHBondContact O-CB 3.37Å; Y47-T51 VanDerWaalsContact O-CG2 3.25Å; Y47-T51 WeakPolarHBondContact O-CG2 3.46Å; Y47-T51 PolarHBondContact O-N 3.35Å; Y47-T51 VanDerWaalsContact O-N 3.12Å; Y47-T51 PolarHBondContact O-OG1 2.93Å; E49-T51 PolarHBondContact O-N 3.44Å; T51-M53 PolarHBondContact O-N 3.14Å; T51-Y54 PolarHBondContact O-N 3.01Å; T51-Y54 VanDerWaalsContact O-N 3.15Å; T51-G55 PolarHBondContact O-N 3.01Å; T51-N56 VanDerWaalsContact OG1-CB 3.28Å; T51-N56 WeakPolarHBondContact OG1-CB 3.15Å; T51-N56 PolarHBondContact OG1-ND2 3.29Å
52Q90.3Very high93.6Very high39 Ų3968.5 Ų68.518%0.18234%0.343CS..THydrogen-bonded Turntrans-53.2-33.8-174.2-179.5174.2-42.300113.3L48 N79 R80L48-Q52 PolarHBondContact O-N 2.96Å; Q52-N79 PolarHBondContact NE2-O 3.3Å; Q52-R80 PolarHBondContact NE2-O 3.27Å
53M87.2Confident93Very high105 Ų10567.9 Ų67.952%0.51733%0.327SS..THydrogen-bonded Turntrans-84.6-18.2-172.8-62.8-61.5-109.300114.6T51 R63 N67T51-M53 PolarHBondContact O-N 3.14Å; M53-R63 WeakPolarHBondContact O-CD 3.17Å; M53-N67 PolarHBondContact O-ND2 3.1Å
54Y88.8Confident92.5Very high143 Ų14367.5 Ų67.556%0.56132%0.323SS*.THydrogen-bonded Turntrans-108-22.2-176.3-50.5-68.9000112.1T51 R63 Y64T51-Y54 PolarHBondContact O-N 3.01Å; T51-Y54 VanDerWaalsContact O-N 3.15Å; Y54-R63 CarbonylContact O-C 3.56Å; Y54-Y64 VanDerWaalsContact O-CA 3.31Å; Y54-Y64 WeakPolarHBondContact O-CA 3.43Å; Y54-Y64 WeakPolarHBondContact O-CB 3.17Å; Y54-Y64 PolarHBondContact O-N 3.1Å
55G91.7Very high91.9Very high7 Ų772.7 Ų72.77%0.07235%0.35CS..  trans104.1156.5-166.400000110.2T51 G60 W61T51-G55 PolarHBondContact O-N 3.01Å; G55-G60 CarbonylContact C-O 3.39Å; G55-G60 VanDerWaalsContact CA-O 3.25Å; G55-G60 WeakPolarHBondContact CA-O 3.42Å; G55-W61 WeakPolarHBondContact O-CZ3 3.41Å
56N94.1Very high91Very high3 Ų376.5 Ų76.52%0.01637%0.371CS..BIsolated β-bridgetrans-157.7177.6-175.662.930.7000111.3Y47 T51 I58 R59 G60Y47-N56 HydrophobicContact CE1-CB 3.94Å; T51-N56 VanDerWaalsContact OG1-CB 3.28Å; T51-N56 WeakPolarHBondContact OG1-CB 3.15Å; T51-N56 PolarHBondContact OG1-ND2 3.29Å; N56-I58 PolarHBondContact O-N 3.31Å; N56-I58 VanDerWaalsContact O-N 3.15Å; N56-I58 WeakPolarHBondContact OD1-CB 3.34Å; N56-I58 PolarHBondContact OD1-N 3.04Å; N56-R59 PolarHBondContact O-N 3.37Å; N56-R59 PolarHBondContact OD1-N 3.45Å; N56-G60 PolarHBondContact N-O 3Å; N56-G60 VanDerWaalsContact N-O 3.1Å; N56-G60 CarbonylContact O-C 3.57Å; N56-G60 VanDerWaalsContact O-CA 3.28Å; N56-G60 WeakPolarHBondContact O-CA 3.39Å; N56-G60 PolarHBondContact O-N 2.79Å
57I95.6Very high89.5Confident105 Ų10577.6 Ų77.654%0.53837%0.373SS..THydrogen-bonded Turntrans-61.4-23.6-177.9-167.6164.2000114Y47Y47-I57 HydrophobicContact CE1-CG2 4.02Å
58I94.4Very high88Confident46 Ų4681.3 Ų81.324%0.23639%0.394CS..THydrogen-bonded Turntrans-83.3-42.8-178.8-48.3-57.4000111.6L48 N56 E86 L88L48-I58 HydrophobicContact CD2-CB 4.45Å; L48-I58 HydrophobicContact CD2-CG1 3.65Å; N56-I58 PolarHBondContact O-N 3.31Å; N56-I58 VanDerWaalsContact O-N 3.15Å; N56-I58 WeakPolarHBondContact OD1-CB 3.34Å; N56-I58 PolarHBondContact OD1-N 3.04Å; I58-E86 HydrophobicContact CG2-CB 4.11Å; I58-E86 HydrophobicContact CG2-CG 4.37Å; I58-L88 HydrophobicContact CD1-CB 4.07Å; I58-L88 HydrophobicContact CD1-CD1 3.59Å; I58-L88 HydrophobicContact CD1-CG 3.79Å; I58-L88 HydrophobicContact CG2-CD1 4.47Å
59R91.1Very high86.7Confident84 Ų8489.2 Ų89.232%0.31743%0.428SS..THydrogen-bonded Turntrans-102.7-7.4-173.7-65.3-179.1174.1171.6-2.7113.8N56 R80 E86N56-R59 PolarHBondContact O-N 3.37Å; N56-R59 PolarHBondContact OD1-N 3.45Å; R59-R80 PolarHBondContact NH1-O 3.46Å; R59-R80 PolarHBondContact NH2-O 2.83Å; R59-E86 IonicContact CZ-OE1 3.58Å; R59-E86 VanDerWaalsContact CZ-OE1 3.27Å; R59-E86 IonicContact CZ-OE2 3.42Å; R59-E86 IonicContact NE-OE1 3.72Å; R59-E86 PolarHBondContact NE-OE1 3.25Å; R59-E86 IonicContact NE-OE2 3.63Å; R59-E86 VanDerWaalsContact NH2-CD 3.26Å; R59-E86 IonicContact NH2-OE1 3Å; R59-E86 PolarHBondContact NH2-OE1 3Å; R59-E86 IonicContact NH2-OE2 3.8Å; R59-E86 PolarHBondContact NH2-OE2 3.19Å
60G92.3Very high84.9Confident26 Ų2691.1 Ų91.127%0.26844%0.442SS..BIsolated β-bridgetrans89.5170.9-175.800000114.1G55 N56G55-G60 CarbonylContact C-O 3.39Å; G55-G60 VanDerWaalsContact CA-O 3.25Å; G55-G60 WeakPolarHBondContact CA-O 3.42Å; N56-G60 PolarHBondContact N-O 3Å; N56-G60 VanDerWaalsContact N-O 3.1Å; N56-G60 CarbonylContact O-C 3.57Å; N56-G60 VanDerWaalsContact O-CA 3.28Å; N56-G60 WeakPolarHBondContact O-CA 3.39Å; N56-G60 PolarHBondContact O-N 2.79Å
61W93.4Very high83Confident136 Ų13690.3 Ų90.352%0.51545%0.445SS..SBendtrans-102.68.1-175.7-61.2105.8000113.9G55 R63 Y64 L65G55-W61 WeakPolarHBondContact O-CZ3 3.41Å; W61-R63 PolarHBondContact O-N 3.17Å; W61-Y64 VanDerWaalsContact O-CB 3.31Å; W61-Y64 WeakPolarHBondContact O-CB 3.48Å; W61-Y64 PolarHBondContact O-N 2.91Å; W61-L65 PolarHBondContact O-N 2.98Å
62D86.8Confident81.4Confident117 Ų11796.4 Ų96.463%0.62648%0.477SS*.Hα-helixtrans-56.9-36.6-179.5-62.6-52.1000112.5Y64 L65 T66D62-Y64 VanDerWaalsContact C-N 3.31Å; D62-Y64 PolarHBondContact O-N 3.11Å; D62-L65 PolarHBondContact O-N 3.34Å; D62-T66 WeakPolarHBondContact O-CB 3.22Å; D62-T66 VanDerWaalsContact O-CG2 3.29Å; D62-T66 WeakPolarHBondContact O-CG2 3.2Å; D62-T66 PolarHBondContact O-N 2.98Å; D62-T66 PolarHBondContact O-OG1 2.81Å
63R84.8Confident79.7Confident50 Ų5098.5 Ų98.519%0.18950%0.496CS..Hα-helixtrans-64.8-35.4176.6-174.9172.5-74.6-95.413.4112.2M53 Y54 W61 L65 T66 N67 N79M53-R63 WeakPolarHBondContact O-CD 3.17Å; Y54-R63 CarbonylContact O-C 3.56Å; W61-R63 PolarHBondContact O-N 3.17Å; R63-L65 VanDerWaalsContact C-N 3.34Å; R63-L65 PolarHBondContact O-N 3.42Å; R63-T66 WeakPolarHBondContact CA-OG1 3.3Å; R63-T66 PolarHBondContact O-N 3.34Å; R63-T66 PolarHBondContact O-OG1 3.38Å; R63-N67 WeakPolarHBondContact O-CB 3.44Å; R63-N67 PolarHBondContact O-N 3.12Å; R63-N79 PolarHBondContact NH2-OD1 2.87Å
64Y88.1Confident78.1Confident131 Ų131103.4 Ų103.451%0.51451%0.514SS..Hα-helixtrans-64.8-40.9177.5-177-104.8000111Y54 W61 D62Y54-Y64 VanDerWaalsContact O-CA 3.31Å; Y54-Y64 WeakPolarHBondContact O-CA 3.43Å; Y54-Y64 WeakPolarHBondContact O-CB 3.17Å; Y54-Y64 PolarHBondContact O-N 3.1Å; W61-Y64 VanDerWaalsContact O-CB 3.31Å; W61-Y64 WeakPolarHBondContact O-CB 3.48Å; W61-Y64 PolarHBondContact O-N 2.91Å; D62-Y64 VanDerWaalsContact C-N 3.31Å; D62-Y64 PolarHBondContact O-N 3.11Å
65L84.3Confident76.6Confident121 Ų12198.3 Ų98.363%0.63450%0.498SS*.Hα-helixtrans-70.8-36.4178.1-60.9177.4000112.8W61 D62 R63W61-L65 PolarHBondContact O-N 2.98Å; D62-L65 PolarHBondContact O-N 3.34Å; R63-L65 VanDerWaalsContact C-N 3.34Å; R63-L65 PolarHBondContact O-N 3.42Å
66T77.3Confident74.7Confident89 Ų89104.4 Ų104.455%0.54653%0.529SS..Hα-helixtrans-85-32.8-176.954.10000113.5D62 R63 Q68 K69D62-T66 WeakPolarHBondContact O-CB 3.22Å; D62-T66 VanDerWaalsContact O-CG2 3.29Å; D62-T66 WeakPolarHBondContact O-CG2 3.2Å; D62-T66 PolarHBondContact O-N 2.98Å; D62-T66 PolarHBondContact O-OG1 2.81Å; R63-T66 WeakPolarHBondContact CA-OG1 3.3Å; R63-T66 PolarHBondContact O-N 3.34Å; R63-T66 PolarHBondContact O-OG1 3.38Å; T66-Q68 PolarHBondContact O-N 3.08Å; T66-K69 CarbonylContact O-C 3.41Å; T66-K69 PolarHBondContact O-N 3.48Å; T66-K69 VanDerWaalsContact O-O 3.05Å
67N65.5Low72.9Confident76 Ų76116.3 Ų116.341%0.40657%0.574SS.*Hα-helixtrans-64-19177.9-94.3-4.2000113.5M53 R63 K69M53-N67 PolarHBondContact O-ND2 3.1Å; R63-N67 WeakPolarHBondContact O-CB 3.44Å; R63-N67 PolarHBondContact O-N 3.12Å; N67-K69 PolarHBondContact O-N 2.52Å
68Q66.6Low71.3Confident157 Ų157119.4 Ų119.473%0.73458%0.579SS**THydrogen-bonded Turntrans-66.8-23171.7-77.4-145.438.800113.3T66T66-Q68 PolarHBondContact O-N 3.08Å
69K66.4Low69.8Low171 Ų171119.6 Ų119.674%0.74358%0.581SS**SBendtrans-113.193.4179.3-63.9176-175.7175.50106.9T66 N67 S71T66-K69 CarbonylContact O-C 3.41Å; T66-K69 PolarHBondContact O-N 3.48Å; T66-K69 VanDerWaalsContact O-O 3.05Å; N67-K69 PolarHBondContact O-N 2.52Å; K69-S71 PolarHBondContact O-N 3.26Å
70N56.4Low69Low166 Ų166123.1 Ų123.189%0.88859%0.594SS**  trans-43.358.2-178.3-106.532.4000117.1
71S54.8Low68.6Low101 Ų101130.2 Ų130.271%0.70662%0.617SS**  trans-112.976178.1-167.10000108.9K69 S73K69-S71 PolarHBondContact O-N 3.26Å; S71-S73 PolarHBondContact O-N 3.04Å
72N60.4Low68.3Low151 Ų151126.8 Ų126.881%0.80761%0.606SS**  trans-85.683.3175.5-158.63.4000108.5
73S54.4Low68.6Low84 Ų84125 Ų12559%0.58759%0.593SS**  trans-141.3119.5167.164.20000111.6S71S71-S73 PolarHBondContact O-N 3.04Å
74K53.7Low69Low207 Ų207127.3 Ų127.390%0.961%0.606SS**SBendtrans75.625.7166.1-66.1177.7174.3164.20119.9
75T56.3Low69.2Low36 Ų36123.8 Ų123.822%0.22160%0.604CS.*  trans-103.27.1174.7700000115.7R77 R78T75-R77 VanDerWaalsContact C-N 3.27Å; T75-R77 PolarHBondContact O-N 3.25Å; T75-R78 VanDerWaalsContact CG2-NH2 3.35Å; T75-R78 VanDerWaalsContact O-CB 3.25Å; T75-R78 WeakPolarHBondContact O-CB 3.36Å; T75-R78 WeakPolarHBondContact O-CG 3.15Å; T75-R78 PolarHBondContact O-N 2.72Å
76D52Low69.7Low136 Ų136119.7 Ų119.773%0.72758%0.581SS**G310 helixtrans-58.3-28.2-168.2-146.5-20.8000115.4R78 N79D76-R78 PolarHBondContact O-N 3.09Å; D76-N79 PolarHBondContact O-N 3.41Å; D76-N79 VanDerWaalsContact O-N 3.13Å
77R56.3Low70.6Confident252 Ų252116.2 Ų116.295%0.95156%0.558SS**G310 helixtrans-60.2-14.5171.7-74.6-174.1174.9174-1.4113.8T75T75-R77 VanDerWaalsContact C-N 3.27Å; T75-R77 PolarHBondContact O-N 3.25Å
78R61.4Low72.1Confident171 Ų171117.2 Ų117.265%0.64556%0.563SS**G310 helixtrans-98.2-2.7-178.1-55.2178.6-128.9170.5-0.1113.6T75 D76 R80T75-R78 VanDerWaalsContact CG2-NH2 3.35Å; T75-R78 VanDerWaalsContact O-CB 3.25Å; T75-R78 WeakPolarHBondContact O-CB 3.36Å; T75-R78 WeakPolarHBondContact O-CG 3.15Å; T75-R78 PolarHBondContact O-N 2.72Å; D76-R78 PolarHBondContact O-N 3.09Å; R78-R80 PolarHBondContact O-N 3.37Å
79N63.1Low73.6Confident50 Ų50115.2 Ų115.227%0.26755%0.552SS.*  trans-89.328.5176.7-83.963.1000112.8Q52 R63 D76 K81Q52-N79 PolarHBondContact NE2-O 3.3Å; R63-N79 PolarHBondContact NH2-OD1 2.87Å; D76-N79 PolarHBondContact O-N 3.41Å; D76-N79 VanDerWaalsContact O-N 3.13Å; N79-K81 PolarHBondContact O-N 2.88Å
80R75.8Confident75.1Confident158 Ų158107.4 Ų107.460%0.59652%0.519SS*.  trans-65.7132.8-178.2-165173177.5178.72.7110.3Q52 R59 R78 K83Q52-R80 PolarHBondContact NE2-O 3.27Å; R59-R80 PolarHBondContact NH1-O 3.46Å; R59-R80 PolarHBondContact NH2-O 2.83Å; R78-R80 PolarHBondContact O-N 3.37Å; R80-K83 VanDerWaalsContact NH1-CE 3.31Å
81K82.3Confident77Confident174 Ų174105.5 Ų105.576%0.75750%0.503SS*.  trans-44.8142.8169.9-62-175.1179-172.30109.9N79N79-K81 PolarHBondContact O-N 2.88Å
82F88.6Confident79.1Confident64 Ų64105.5 Ų105.528%0.28150%0.503SS..  trans-56.7151.7177.480.6-91.7000110.5L48 E49 E86L48-F82 HydrophobicContact CB-CB 3.93Å; L48-F82 HydrophobicContact CB-CD2 4.33Å; L48-F82 HydrophobicContact CB-CG 4.05Å; L48-F82 HydrophobicContact CD1-CD2 4.27Å; E49-F82 HydrophobicContact CB-CD1 4.35Å; E49-F82 HydrophobicContact CB-CE1 4.22Å; F82-E86 WeakPolarHBondContact CA-OE2 3.44Å
83K91.9Very high80.8Confident79 Ų79100 Ų10034%0.34348%0.476SS..  trans-119.1157.4178.9-64.2179.2-176.8174.90110.7R80 A85 E86R80-K83 VanDerWaalsContact NH1-CE 3.31Å; K83-A85 HydrophobicContact CB-CB 4.49Å; K83-A85 PolarHBondContact O-N 3.03Å; K83-A85 VanDerWaalsContact O-N 3.11Å; K83-E86 HydrophobicContact CB-CG 4.35Å; K83-E86 PolarHBondContact N-OE2 3.12Å; K83-E86 VanDerWaalsContact N-OE2 3.12Å; K83-E86 WeakPolarHBondContact O-CB 3.36Å; K83-E86 PolarHBondContact O-N 3.02Å
84E92.9Very high82.9Confident100 Ų100102.9 Ų102.947%0.46749%0.49SS..G310 helixtrans-54.6-32.2170.3-163.856.7-151.600113.2Y41 E86 R87Y41-E84 VanDerWaalsContact CE2-OE1 3.28Å; Y41-E84 WeakPolarHBondContact CE2-OE1 3.49Å; Y41-E84 PolarHBondContact OH-OE1 3.12Å; Y41-E84 PolarHBondContact OH-OE2 3.31Å; E84-E86 PolarHBondContact O-N 2.99Å; E84-R87 PolarHBondContact O-N 3.29Å; E84-R87 WeakPolarHBondContact OE1-CD 3.5Å; E84-R87 IonicContact OE1-NE 2.71Å; E84-R87 PolarHBondContact OE1-NE 2.71Å; E84-R87 WeakPolarHBondContact OE2-CD 3.25Å; E84-R87 IonicContact OE2-NE 3.27Å; E84-R87 PolarHBondContact OE2-NE 2.71Å
85A93.3Very high84.9Confident57 Ų5796 Ų9647%0.47147%0.465SS..G310 helixtrans-63.7-19.5176.400000114.4K83K83-A85 HydrophobicContact CB-CB 4.49Å; K83-A85 PolarHBondContact O-N 3.03Å; K83-A85 VanDerWaalsContact O-N 3.11Å
86E94.8Very high86.8Confident35 Ų3594.6 Ų94.616%0.16446%0.457CS..G310 helixtrans-88.3-3.7-175.1-63.9177.9160.400113.4L48 I58 R59 F82 K83 E84 L88L48-E86 HydrophobicContact CD1-CB 4.06Å; I58-E86 HydrophobicContact CG2-CB 4.11Å; I58-E86 HydrophobicContact CG2-CG 4.37Å; R59-E86 IonicContact CZ-OE1 3.58Å; R59-E86 VanDerWaalsContact CZ-OE1 3.27Å; R59-E86 IonicContact CZ-OE2 3.42Å; R59-E86 IonicContact NE-OE1 3.72Å; R59-E86 PolarHBondContact NE-OE1 3.25Å; R59-E86 IonicContact NE-OE2 3.63Å; R59-E86 VanDerWaalsContact NH2-CD 3.26Å; R59-E86 IonicContact NH2-OE1 3Å; R59-E86 PolarHBondContact NH2-OE1 3Å; R59-E86 IonicContact NH2-OE2 3.8Å; R59-E86 PolarHBondContact NH2-OE2 3.19Å; F82-E86 WeakPolarHBondContact CA-OE2 3.44Å; K83-E86 HydrophobicContact CB-CG 4.35Å; K83-E86 PolarHBondContact N-OE2 3.12Å; K83-E86 VanDerWaalsContact N-OE2 3.12Å; K83-E86 WeakPolarHBondContact O-CB 3.36Å; K83-E86 PolarHBondContact O-N 3.02Å; E84-E86 PolarHBondContact O-N 2.99Å; E86-L88 VanDerWaalsContact C-N 3.29Å; E86-L88 PolarHBondContact O-N 3.45Å
87R96.8Very high88.8Confident16 Ų1693 Ų936%0.0645%0.452CS..  trans-78.269.6177-68.1-179.6178.9-78.63.3112.3Y41 E44 L48 E84 F89 K91Y41-R87 PolarHBondContact O-NH1 3.35Å; E44-R87 HydrophobicContact CB-CG 4.48Å; E44-R87 WeakPolarHBondContact OE1-CA 3.28Å; E44-R87 WeakPolarHBondContact OE2-CB 3.3Å; E44-R87 IonicContact OE2-NH1 3.03Å; L48-R87 HydrophobicContact CD1-CG 4.31Å; E84-R87 PolarHBondContact O-N 3.29Å; E84-R87 WeakPolarHBondContact OE1-CD 3.5Å; E84-R87 IonicContact OE1-NE 2.71Å; E84-R87 PolarHBondContact OE1-NE 2.71Å; E84-R87 WeakPolarHBondContact OE2-CD 3.25Å; E84-R87 IonicContact OE2-NE 3.27Å; E84-R87 PolarHBondContact OE2-NE 2.71Å; R87-F89 VanDerWaalsContact C-N 3.34Å; R87-F89 PolarHBondContact O-N 3.43Å; R87-K91 VanDerWaalsContact O-CB 3.24Å; R87-K91 WeakPolarHBondContact O-CB 3.25Å; R87-K91 WeakPolarHBondContact O-CG 3.34Å; R87-K91 PolarHBondContact O-N 3.03Å
88L97.1Very high90.5Very high97 Ų9784.1 Ų84.151%0.50843%0.432SS..THydrogen-bonded Turntrans-65.5-32.4-172.5-68.1-175.3000114.1E44 I58 E86 S92E44-L88 PolarHBondContact OE1-N 3.13Å; I58-L88 HydrophobicContact CD1-CB 4.07Å; I58-L88 HydrophobicContact CD1-CD1 3.59Å; I58-L88 HydrophobicContact CD1-CG 3.79Å; I58-L88 HydrophobicContact CG2-CD1 4.47Å; E86-L88 VanDerWaalsContact C-N 3.29Å; E86-L88 PolarHBondContact O-N 3.45Å; L88-S92 PolarHBondContact O-N 2.94Å; L88-S92 VanDerWaalsContact O-N 3.08Å
89F97.7Very high91.9Very high114 Ų11476.2 Ų76.250%0.540%0.403SS..THydrogen-bonded Turntrans-76.8-39.6179.1-54.7-83000111.6I40 E44 R87 K91 S92I40-F89 HydrophobicContact CG2-CB 3.68Å; E44-F89 HydrophobicContact CG-CB 4.36Å; E44-F89 HydrophobicContact CG-CD2 4.12Å; E44-F89 VanDerWaalsContact OE1-CA 3.24Å; E44-F89 WeakPolarHBondContact OE1-CA 3.28Å; E44-F89 WeakPolarHBondContact OE1-CB 3.31Å; E44-F89 WeakPolarHBondContact OE1-CD2 3.41Å; E44-F89 PolarHBondContact OE1-N 3.45Å; R87-F89 VanDerWaalsContact C-N 3.34Å; R87-F89 PolarHBondContact O-N 3.43Å; F89-K91 VanDerWaalsContact C-N 3.29Å; F89-K91 PolarHBondContact O-N 3.37Å; F89-S92 PolarHBondContact O-N 3.15Å; F89-S92 PolarHBondContact O-OG 2.97Å
90S97.7Very high93.1Very high7 Ų775.7 Ų75.75%0.04940%0.402CS..G310 helixtrans-63.8-40.4170.4-66.20000110.7Y41 E44 S92 S93 S96Y41-S90 WeakPolarHBondContact CA-OG 3.14Å; E44-S90 PolarHBondContact OE1-N 3.42Å; E44-S90 WeakPolarHBondContact OE2-CB 2.99Å; E44-S90 PolarHBondContact OE2-N 3.5Å; E44-S90 PolarHBondContact OE2-OG 2.93Å; S90-S92 PolarHBondContact O-N 2.89Å; S90-S93 PolarHBondContact O-N 3.46Å; S90-S93 VanDerWaalsContact O-O 3.12Å; S90-S96 WeakPolarHBondContact O-CB 3.25Å; S90-S96 PolarHBondContact O-OG 3.1Å
91K97.1Very high93.6Very high127 Ų12772.1 Ų72.155%0.55240%0.4SS*.G310 helixtrans-70.1-13.1179.2-75.4-179.3161.2-1410115.1R87 F89 S93R87-K91 VanDerWaalsContact O-CB 3.24Å; R87-K91 WeakPolarHBondContact O-CB 3.25Å; R87-K91 WeakPolarHBondContact O-CG 3.34Å; R87-K91 PolarHBondContact O-N 3.03Å; F89-K91 VanDerWaalsContact C-N 3.29Å; F89-K91 PolarHBondContact O-N 3.37Å; K91-S93 VanDerWaalsContact C-N 3.26Å
92S97.3Very high93.3Very high101 Ų10166.9 Ų66.971%0.70639%0.389SS*.G310 helixtrans-78.3-14.2174.973.60000112.6L88 F89 S90L88-S92 PolarHBondContact O-N 2.94Å; L88-S92 VanDerWaalsContact O-N 3.08Å; F89-S92 PolarHBondContact O-N 3.15Å; F89-S92 PolarHBondContact O-OG 2.97Å; S90-S92 PolarHBondContact O-N 2.89Å
93S97.2Very high91.9Very high35 Ų3570 Ų7025%0.24541%0.409CS..  trans-109.9129.5172.9-177.20000111.4E37 S90 K91 T95 S96E37-S93 WeakPolarHBondContact OE1-CB 3.31Å; E37-S93 PolarHBondContact OE1-OG 3.13Å; S90-S93 PolarHBondContact O-N 3.46Å; S90-S93 VanDerWaalsContact O-O 3.12Å; K91-S93 VanDerWaalsContact C-N 3.26Å; S93-T95 PolarHBondContact O-N 2.97Å; S93-T95 PolarHBondContact OG-N 2.85Å; S93-T95 PolarHBondContact OG-OG1 3.01Å; S93-S96 PolarHBondContact O-N 3.07Å; S93-S96 PolarHBondContact O-OG 3.06Å
94V97.5Very high90.3Very high144 Ų14469.7 Ų69.787%0.87343%0.427SS*.THydrogen-bonded Turntrans-70.1-21.3175.2-62.70000112.7
95T96.7Very high87.9Confident62 Ų6267.9 Ų67.938%0.3844%0.436SS..THydrogen-bonded Turntrans-90.1-12.5-179.140.50000113.6E37 S93 V97 A98 A99E37-T95 PolarHBondContact OE1-OG1 2.79Å; E37-T95 PolarHBondContact OE2-OG1 3.04Å; S93-T95 PolarHBondContact O-N 2.97Å; S93-T95 PolarHBondContact OG-N 2.85Å; S93-T95 PolarHBondContact OG-OG1 3.01Å; T95-V97 PolarHBondContact O-N 3.4Å; T95-A98 PolarHBondContact O-N 3.2Å; T95-A99 PolarHBondContact O-N 3.28Å
96S95Very high85.5Confident7 Ų771.8 Ų71.85%0.04945%0.447CS..Hα-helixtrans-58-43.1-174.264.10000113.9S90 S93 A98 A99 V100S90-S96 WeakPolarHBondContact O-CB 3.25Å; S90-S96 PolarHBondContact O-OG 3.1Å; S93-S96 PolarHBondContact O-N 3.07Å; S93-S96 PolarHBondContact O-OG 3.06Å; S96-A98 PolarHBondContact O-N 2.85Å; S96-A99 WeakPolarHBondContact O-CB 3.42Å; S96-A99 PolarHBondContact O-N 2.6Å; S96-V100 WeakPolarHBondContact O-CG2 3.29Å; S96-V100 PolarHBondContact O-N 3.15Å
97V93.6Very high83.3Confident104 Ų10475.8 Ų75.863%0.6348%0.476SS*.Hα-helixtrans-63.4-45.2-179.8177.50000110.4T95 A99 V100 C101T95-V97 PolarHBondContact O-N 3.4Å; V97-A99 VanDerWaalsContact C-N 3.32Å; V97-A99 PolarHBondContact O-N 3.12Å; V97-V100 PolarHBondContact O-N 2.79Å; V97-C101 WeakPolarHBondContact O-CB 3.47Å; V97-C101 PolarHBondContact O-N 3.1Å; V97-C101 PolarHBondContact O-SG 3.5Å
98A92.8Very high81Confident65 Ų6582.8 Ų82.854%0.53752%0.515SS..Hα-helixtrans-62.7-41.3176.600000111.1T95 S96 V100 C101 A102T95-A98 PolarHBondContact O-N 3.2Å; S96-A98 PolarHBondContact O-N 2.85Å; A98-V100 VanDerWaalsContact C-N 3.33Å; A98-V100 PolarHBondContact O-N 3.18Å; A98-C101 PolarHBondContact O-N 3.21Å; A98-A102 VanDerWaalsContact O-CB 3.27Å; A98-A102 WeakPolarHBondContact O-CB 3.35Å; A98-A102 PolarHBondContact O-N 2.83Å
99A90.6Very high78.5Confident4 Ų485.8 Ų85.83%0.03353%0.526CS..Hα-helixtrans-59.3-42.7177.200000112.1V34 E37 R38 T95 S96 V97V34-A99 HydrophobicContact CG1-CB 4.12Å; E37-A99 HydrophobicContact CB-CB 3.91Å; E37-A99 WeakPolarHBondContact OE2-CB 3.17Å; R38-A99 HydrophobicContact CG-CB 4.5Å; R38-A99 PolarHBondContact NE-O 2.85Å; R38-A99 PolarHBondContact NH2-O 3.41Å; T95-A99 PolarHBondContact O-N 3.28Å; S96-A99 WeakPolarHBondContact O-CB 3.42Å; S96-A99 PolarHBondContact O-N 2.6Å; V97-A99 VanDerWaalsContact C-N 3.32Å; V97-A99 PolarHBondContact O-N 3.12Å
100V89.1Confident75.9Confident39 Ų3986 Ų8624%0.23653%0.53CS..Hα-helixtrans-72.7-45.3178.5177.10000111.5Y41 S96 V97 A98 A102 L103Y41-V100 HydrophobicContact CD1-CG1 4.11Å; Y41-V100 HydrophobicContact CD1-CG2 3.95Å; Y41-V100 HydrophobicContact CD2-CG2 3.79Å; Y41-V100 HydrophobicContact CE1-CG1 3.99Å; Y41-V100 HydrophobicContact CE2-CG2 4.37Å; Y41-V100 HydrophobicContact CG-CG1 4.46Å; Y41-V100 HydrophobicContact CG-CG2 3.55Å; S96-V100 WeakPolarHBondContact O-CG2 3.29Å; S96-V100 PolarHBondContact O-N 3.15Å; V97-V100 PolarHBondContact O-N 2.79Å; A98-V100 VanDerWaalsContact C-N 3.33Å; A98-V100 PolarHBondContact O-N 3.18Å; V100-A102 VanDerWaalsContact C-N 3.31Å; V100-A102 PolarHBondContact O-N 3.33Å; V100-L103 PolarHBondContact O-N 3.31Å
101C86.6Confident73.1Confident84 Ų8493.8 Ų93.857%0.56857%0.571SS**Hα-helixtrans-64.1-33.4-179.7-710000113V97 A98 L103 G104V97-C101 WeakPolarHBondContact O-CB 3.47Å; V97-C101 PolarHBondContact O-N 3.1Å; V97-C101 PolarHBondContact O-SG 3.5Å; A98-C101 PolarHBondContact O-N 3.21Å; C101-L103 PolarHBondContact O-N 3.45Å; C101-G104 PolarHBondContact O-N 3.01Å
102A75.5Confident70.4Confident63 Ų6394.5 Ų94.552%0.52158%0.576SS.*THydrogen-bonded Turntrans-63.7-7.2178.400000114.4R38 A98 V100R38-A102 VanDerWaalsContact NH2-C 3.34Å; A98-A102 VanDerWaalsContact O-CB 3.27Å; A98-A102 WeakPolarHBondContact O-CB 3.35Å; A98-A102 PolarHBondContact O-N 2.83Å; V100-A102 VanDerWaalsContact C-N 3.31Å; V100-A102 PolarHBondContact O-N 3.33Å
103L59.7Low67.6Low131 Ų13197.3 Ų97.369%0.68658%0.576SS**THydrogen-bonded Turntrans-92.7-15.7171.9-165.565.9000112.9V100 C101 G105V100-L103 PolarHBondContact O-N 3.31Å; C101-L103 PolarHBondContact O-N 3.45Å; L103-G105 PolarHBondContact O-N 2.96Å
104G57.1Low65.3Low71 Ų71107 Ų10773%0.73261%0.607SS**SBendtrans-75.74.2-172.100000116.4C101C101-G104 PolarHBondContact O-N 3.01Å
105G42.9Very low62.4Low63 Ų63108 Ų10865%0.64960%0.602SS**  trans73.5102.3-178.500000112.5L103L103-G105 PolarHBondContact O-N 2.96Å
106I43.2Very low59.8Low139 Ų139109.3 Ų109.371%0.71362%0.619SS**  trans-83.8126.6165.3-64.4162.1000106.6D108I106-D108 PolarHBondContact O-N 3.19Å
107P47.4Very low56.8Low118 Ų118112.7 Ų112.777%0.76666%0.655SS**  trans-72118.2153.129.4-25.4000107H109P107-H109 PolarHBondContact O-N 3.26Å
108D48.3Very low54Low164 Ų164113.4 Ų113.488%0.87766%0.664SS**  trans-40117.5167.1-88.7-42.8000111.2I106I106-D108 PolarHBondContact O-N 3.19Å
109H45Very low51.3Low159 Ų159113.5 Ų113.574%0.73667%0.672SS**  trans-153.8126154.2-155.1-116.7000111.1P107P107-H109 PolarHBondContact O-N 3.26Å
110M42.9Very low48.9Very low120 Ų120119.5 Ų119.559%0.59171%0.708SS**  trans89.363.6168.3-47-77.375.800117.6
111N39.8Very low46.9Very low169 Ų169126.5 Ų126.590%0.90474%0.738SS**  -91.199.5127.9179.725.9000107.3
112E39.3Very low44.9Very low143 Ų143127.4 Ų127.467%0.66875%0.746SS**  trans-130.4121.6162.7-155.1177176.300110.5
113K39.8Very low43.4Very low160 Ų160131.4 Ų131.470%0.69676%0.758SS**  trans66.2105.2158.4-89.6169.5163-79.10119.5
114R48.4Very low42.4Very low239 Ų239131.9 Ų131.990%0.90277%0.767SS**  trans-60.9134.4130.7-65.3179.9-177.5-176.40.2108.8
115E35.9Very low41.9Very low164 Ų164133.5 Ų133.577%0.76677%0.767SS**  trans-157.5150.7138.2-101.9-48.7146.100110.2
116A42.1Very low42.3Very low90 Ų90136.1 Ų136.174%0.74477%0.773SS**  trans-81.9157.2-172.200000113.3
117G33.1Very low41.9Very low77 Ų77136.4 Ų136.479%0.79478%0.776SS**  trans113.1110.9150.300000115.7
118S34.3Very low41.5Very low119 Ų119138 Ų13883%0.83278%0.777SS**  156.9113.5117.7-170.20000108.7
119G37.2Very low41.4Very low67 Ų67138.9 Ų138.969%0.69178%0.776SS**  trans-69.7150.217200000111.5
120T40.2Very low40.9Very low130 Ų130137.4 Ų137.480%0.79877%0.773SS**  trans-159.1107.4136.3-12.30000107.8
121E46.5Very low41Very low186 Ų186141.1 Ų141.187%0.86979%0.789SS**  trans-59.2127.1156.958.7-148.2107.600109.5
122S44.1Very low40.7Very low104 Ų104140.8 Ų140.873%0.72778%0.782SS**  trans-163.387.4162.6-70.30000109.3
123D43.3Very low40.6Very low146 Ų146142.1 Ų142.178%0.78179%0.794SS**  trans7.8117.1133-155.14.9000117
124T39.1Very low40.7Very low142 Ų142142.8 Ų142.887%0.87180%0.799SS**  trans-158.2118.3145.128.90000109.8
125S47.7Very low40.5Very low104 Ų104136.1 Ų136.173%0.72779%0.787SS**  trans-67.7165.1-177.8-72.90000114.4
126P51.1Low40.4Very low119 Ų119134.1 Ų134.177%0.77379%0.791SS**  trans-80.2134.8-175.632-34.2000112.7
127D33.9Very low40.4Very low145 Ų145138.9 Ų138.978%0.77580%0.798SS**  trans-87.8115.3171.8-168.934.7000110.3
128L40.4Very low40.6Very low152 Ų152142.8 Ų142.880%0.79680%0.801SS**  trans-90.5114.7171.5-73.8169000107.9
129Q44.5Very low40.8Very low182 Ų182144 Ų14485%0.8580%0.798SS**  trans-99.993.2167.8-136.2158.937.200110
130N36.3Very low41Very low127 Ų127147.4 Ų147.468%0.67981%0.806SS**  trans-58.1128.2161.6-87.4-13.6000109.9E132N130-E132 HydrophobicContact CB-CG 4.28Å
131Q43.6Very low41Very low198 Ų198149.6 Ų149.693%0.92581%0.807SS**  trans-114.799.7151.9-123.9176.963.300106.8
132E34.6Very low40.7Very low163 Ų163147 Ų14776%0.76280%0.798SS**  trans-79.6132.1173.4-56.1179.3134.600108.5N130N130-E132 HydrophobicContact CB-CG 4.28Å
133N35.8Very low40.5Very low171 Ų171148.2 Ų148.291%0.91480%0.801SS**  trans-154.7114.8140.2-144.649.6000109.5
134E41.9Very low40Very low173 Ų173148 Ų14881%0.80880%0.8SS**  trans-82.3173-179.4-96.9-76.5119.200111.8
135P44.7Very low39.9Very low100 Ų100146 Ų14665%0.64979%0.792SS**  trans-95.9171.4-146.337.8-38000114.5
136S34.5Very low39.5Very low121 Ų121145.2 Ų145.285%0.84679%0.792SS**  trans-141.6122.2160.1-45.40000109.3
137Q42.3Very low38.9Very low191 Ų191147 Ų14789%0.89379%0.794SS**  trans-67.1145.5162.3-69.5169.9-70.400109.5
138D36.7Very low39.3Very low158 Ų158149.1 Ų149.185%0.84580%0.799SS**  trans-162.2143.6131.4-114.4-22000110.6
139D38.4Very low39Very low146 Ų146147.7 Ų147.778%0.78179%0.793SS**  trans-64.1161.2-174.3-62.6-65.8000114.2
140T40.8Very low38.7Very low138 Ų138145.9 Ų145.985%0.84779%0.788SS**  -176.8133.7118.6-51.80000109.7
141E41.6Very low38.7Very low175 Ų175148.3 Ų148.382%0.81879%0.792SS**  trans-76.9-167.9175.2-59.1-153.614900113.7
142D40.1Very low38.6Very low131 Ų131144.7 Ų144.770%0.70179%0.786SS**  trans103.794.2169-61.5-46.7000115.6
143V39.1Very low38.8Very low130 Ų130144.8 Ų144.879%0.78879%0.787SS**  58.7136.391.7-54.60000112.3
144D33.4Very low38.9Very low142 Ų142146.1 Ų146.176%0.75979%0.785SS**  cis-171.9175.627.1-174.922.1000107.9
145S36.4Very low38.6Very low99 Ų99142.5 Ų142.569%0.69278%0.784SS**  trans82.9129.8150.7-75.90000118.4
146A39.2Very low38.1Very low88 Ų88142.1 Ų142.173%0.72779%0.79SS**  cis-161.9139.44.100000110.9
147L39.6Very low38.2Very low158 Ų158141.2 Ų141.283%0.82778%0.783SS**  trans-68.5140.1158.8-107.2137.1000110.7
148Q42.1Very low37.9Very low188 Ų188137 Ų13788%0.87977%0.774SS**  trans-141.4103.6152.1-67.6-172.213.700104.8
149D34.2Very low37.8Very low123 Ų123134.5 Ų134.566%0.65877%0.769SS**  cis77.7103.149.7-122.922.5000115
150L36.8Very low37.7Very low144 Ų144133.2 Ų133.275%0.75477%0.772SS**  trans72.3121.2146-48.6173000121.3
151K36.4Very low37.6Very low177 Ų177131.9 Ų131.977%0.7777%0.768SS**  177.9120.399.6-157.9140.5179.4171.30113.9Q153K151-Q153 HydrophobicContact CG-CG 4.32Å
152P41Very low37.3Very low123 Ų123129 Ų12980%0.79977%0.767SS**  trans-95.5135.2160.310.47.7000110.9
153Q40.5Very low37.3Very low164 Ų164127.3 Ų127.377%0.76677%0.766SS**  trans-118.8121.7172.8-73.6-155-71.600113.3K151K151-Q153 HydrophobicContact CG-CG 4.32Å
154K36.3Very low37.2Very low200 Ų200128.8 Ų128.887%0.8776%0.764SS**  trans55.2130.3141.6-89.6-170174-174.50122.4
155A36.8Very low37.5Very low97 Ų97130.7 Ų130.780%0.80277%0.768SS**  trans-72.1151.5159.200000113.6
156A33.6Very low37.6Very low92 Ų92129.6 Ų129.676%0.7677%0.772SS**  trans180121.6133.300000112.4
157S36.2Very low37.9Very low102 Ų102133 Ų13371%0.71378%0.778SS**  trans41.5127.5137.263.70000124.5
158S36.4Very low38.4Very low101 Ų101134.6 Ų134.671%0.70678%0.781SS**  72.6121.612568.60000123
159S35.8Very low38.8Very low106 Ų106134.5 Ų134.574%0.74178%0.778SS**  trans54.7121.2135.365.30000120.4
160S35.6Very low39.9Very low119 Ų119138.2 Ų138.283%0.83279%0.788SS**  -175.8150.8112.843.20000112.7
161S38.5Very low40.9Very low110 Ų110143.5 Ų143.577%0.76980%0.798SS**  trans-47.5149.4172.8510000116.8
162S35.5Very low41.9Very low115 Ų115144.6 Ų144.680%0.80480%0.803SS**  -168.9121125.358.40000111.5
163S40.4Very low42.1Very low95 Ų95144.9 Ų144.966%0.66480%0.797SS**  trans-63.5155.2156.356.90000110.2
164H37.4Very low43Very low162 Ų162147 Ų14775%0.7580%0.804SS**  175.1129127.9-90.222.8000113.2
165H37.8Very low43.4Very low182 Ų182143 Ų14384%0.84379%0.792SS**  trans38.4137143.7-67-39000124.4
166G40.4Very low44.1Very low76 Ų76150 Ų15078%0.78480%0.798SS**  trans175.866.6156.700000115.1H168G166-H168 PolarHBondContact O-N 3.35Å
167N44.7Very low44.7Very low158 Ų158152.8 Ų152.885%0.84580%0.795SS**  trans-64.8127.8162.9-94.111.1000109.6
168H50.2Low45.3Very low193 Ų193153.6 Ų153.689%0.89480%0.801SS**  trans-143113.3153-114.1-56.2000112.9G166G166-H168 PolarHBondContact O-N 3.35Å
169K50.9Low46Very low185 Ų185154.3 Ų154.380%0.80480%0.803SS**  trans-65.3137.3166-67.8166.8178.3167.20109.2
170K56Low46.1Very low201 Ų201153.7 Ų153.787%0.87480%0.798SS**  176114.1106.1-89.2-170.7-172-173.30110.5
171R58.6Low47Very low255 Ų255153.2 Ų153.296%0.96280%0.802SS**  trans-67.4125.3169.8-67.2164.367.2177.42.8108.3
172K57.7Low48Very low201 Ų201155.3 Ų155.387%0.87480%0.801SS**  trans-97.3132.8-179.6-157.4-179.5179.1178.10110
173N45.8Very low48.3Very low128 Ų128158.8 Ų158.868%0.68480%0.802SS**  trans65.6108.2154.9-135.715000120.6
174K58.7Low48.4Very low208 Ų208161.6 Ų161.690%0.90481%0.81SS**  trans-94.5100.2154.2-64.2174.4-173.2166.60106.8
175N43.5Very low48.5Very low116 Ų116164.2 Ų164.262%0.6281%0.814SS**  trans-128.481.1162-130.154.6000107.6H177N175-H177 PolarHBondContact ND2-ND1 2.61Å; N175-H177 PolarHBondContact O-N 3.01Å
176R52.9Low48.9Very low244 Ų244162.9 Ų162.992%0.92181%0.814SS**  trans-71.1109.3160.8-89.1177.8168.6177-5.4106.4
177H46.1Very low48.9Very low151 Ų151169.3 Ų169.370%0.69982%0.821SS**  trans-126.7102.8153.6-77.984000105.7N175 P179N175-H177 PolarHBondContact ND2-ND1 2.61Å; N175-H177 PolarHBondContact O-N 3.01Å; H177-P179 WeakPolarHBondContact O-CD 3.31Å
178S49.2Very low48.9Very low120 Ų120170.5 Ų170.584%0.83982%0.821SS**  trans-85.9121.8160.5175.70000106.4
179P49.5Very low48.9Very low116 Ų116171.1 Ų171.175%0.75382%0.821SS**  trans-134110.6147.333.5-18.3000109.1H177H177-P179 WeakPolarHBondContact O-CD 3.31Å
180S39.4Very low49Very low92 Ų92169.6 Ų169.664%0.64382%0.822SS**  trans176.685.5133.7-166.30000109.3
181A54.2Low48.8Very low109 Ų109167.1 Ų167.190%0.90182%0.815SS**  trans-9693.4142.400000104.7
182M58.1Low48.8Very low154 Ų154162.4 Ų162.476%0.75980%0.802SS**  trans-164.540.3171.6-149.3179.9-153.600114.9
183F43.3Very low48.6Very low189 Ų189159.6 Ų159.683%0.82980%0.801SS**  trans-136.773.2157.3-71.9-69.1000109
184D42.5Very low49Very low154 Ų154161.3 Ų161.382%0.82481%0.81SS**  trans-62.6122.2145.9-74.1-34.3000107.4
185Y39.8Very low48.7Very low216 Ų216160.9 Ų160.985%0.84781%0.808SS**  trans-139.6101.4152.4-113.9-86.4000107F187Y185-F187 PolarHBondContact O-N 3.19Å; Y185-F187 VanDerWaalsContact O-N 3.12Å
186D45.4Very low49.7Very low155 Ų155164.5 Ų164.583%0.82982%0.819SS**  trans-52.7107.6164.3-77.3-40.6000109.4E188D186-E188 VanDerWaalsContact C-N 3.33Å
187F40.3Very low49.9Very low211 Ų211159.1 Ų159.193%0.92582%0.815SS**  trans-98.524170.6-166-101.1000111.4Y185Y185-F187 PolarHBondContact O-N 3.19Å; Y185-F187 VanDerWaalsContact O-N 3.12Å
188E45.6Very low50Low182 Ų182163 Ų16385%0.8582%0.824SS**  trans-128.935.9-172.1-143.5171.4-156.800114D186D186-E188 VanDerWaalsContact C-N 3.33Å
189F48.8Very low50.2Low206 Ų206160.4 Ų160.490%0.90481%0.809SS**  trans-14246.8168.2-140.7-89.9000115.5
190D53.8Low50.2Low153 Ų153160.9 Ų160.982%0.81881%0.806SS**  trans-140.675.7155.7-156.410.1000112.7
191M51.7Low50.3Low150 Ų150166.3 Ų166.374%0.73981%0.814SS**SBendtrans-123.4105157.4-90.5-134.4-45.700109.7
192K59.1Low50Low156 Ų156166.5 Ų166.568%0.67881%0.808SS**  trans69.497.9159.2-62.598.9152.5-175.50117
193V53.8Low49.7Very low141 Ų141169.3 Ų169.386%0.85583%0.834SS**  -143.183.4126.6-80.60000110.4K195V193-K195 PolarHBondContact O-N 3.38Å
194N52.4Low50.1Low165 Ų165168.4 Ų168.488%0.88284%0.835SS**  trans-74.4101.1165-136.1-8.9000107.8
195K53.8Low50.4Low198 Ų198169.1 Ų169.186%0.86184%0.835SS**  trans-141.9102.2167.6-128.5166.9-177.4172.90110.1V193V193-K195 PolarHBondContact O-N 3.38Å
196K63.3Low51Low192 Ų192166.5 Ų166.584%0.83584%0.835SS**PPolyproline II helixtrans-54.4137.3174.9-59.2176.6179.1179.90110.3R198K196-R198 PolarHBondContact O-N 3.49Å
197P56.8Low51.4Low131 Ų131167.2 Ų167.285%0.85184%0.835SS**PPolyproline II helixtrans-74.1124.5164.128.5-29.8000109.7
198R49.4Very low52.1Low234 Ų234164.4 Ų164.488%0.88383%0.829SS**PPolyproline II helixtrans-86122.9168.7176.8174.7170.1159.8-3.5107.7K196K196-R198 PolarHBondContact O-N 3.49Å
199A54Low52.5Low64 Ų64163.3 Ų163.353%0.52983%0.828SS.*PPolyproline II helixtrans-76.5152.4176.400000112.7
200D49Very low52.8Low127 Ų127160.2 Ų160.268%0.67982%0.822SS**  trans70.8143.4158.8-47.3-29.7000117.3
201Y40.5Very low52.7Low206 Ų206160.8 Ų160.881%0.80882%0.823SS**  cis-154.5161.744.4-50-90.3000114.3
202S49.1Very low52.8Low113 Ų113161.7 Ų161.779%0.7983%0.83SS**  trans-58148.2169-170.70000115.4
203T51.9Low52.2Low213 Ų213162.2 Ų162.2100%1.30784%0.844SS**  trans-160.90132.727.70000108.9

Retrieved 203 of 203 residues in 29.6 ms (Link to these results)