A0A077Z757_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z757, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 191 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
1M41Very low53.3Low242 Ų242136.2 Ų136.2100%1.19278%0.781SS**  0120.30-62.7-154.7-127.100105.9
2A43.2Very low54.5Low107 Ų107133.2 Ų133.288%0.88476%0.76SS**  trans-88.8107.7-17900000107.6
3E46.9Very low55.8Low191 Ų191131 Ų13189%0.89374%0.744SS**PPolyproline II helixtrans-84.2126.4171.2-77.1179.5161.600108.9
4E51.8Low57.4Low181 Ų181124.8 Ų124.885%0.84672%0.723SS**PPolyproline II helixtrans-61145.5178.9-69.8174.2143.200111.7N6E4-N6 PolarHBondContact O-N 3.33Å
5P54.8Low58.7Low128 Ų128124.5 Ų124.583%0.83171%0.712SS**PPolyproline II helixtrans-72.9129.8179.729.8-31000110.9A7P5-A7 PolarHBondContact O-N 3.34Å
6N53.6Low59.6Low132 Ų132121.5 Ų121.571%0.70669%0.693SS**  trans-29.6115.7177.1-75.7-36.2000115.2E4 V8E4-N6 PolarHBondContact O-N 3.33Å; N6-V8 PolarHBondContact O-N 3.11Å
7A56Low60.8Low99 Ų99119.8 Ų119.882%0.81869%0.685SS**PPolyproline II helixtrans-62.6121.4166.200000110.1P5 N9P5-A7 PolarHBondContact O-N 3.34Å; A7-N9 PolarHBondContact O-N 3.45Å
8V55.6Low61.9Low106 Ų106115.7 Ų115.764%0.64267%0.668SS**PPolyproline II helixtrans-55.6124.4171.6176.90000108.8N6 P10 L13N6-V8 PolarHBondContact O-N 3.11Å; V8-P10 WeakPolarHBondContact O-CD 3.38Å; V8-L13 HydrophobicContact CG1-CD1 4.24Å
9N56.9Low62.8Low90 Ų90114.1 Ų114.148%0.48165%0.654SS.*PPolyproline II helixtrans-61.3122.2-178.5-165.8-9.8000109.2A7 L11 D12 L13A7-N9 PolarHBondContact O-N 3.45Å; N9-L11 PolarHBondContact O-N 3.27Å; N9-D12 PolarHBondContact O-N 3.23Å; N9-L13 PolarHBondContact O-N 3.39Å
10P60.7Low63.7Low106 Ų106112.5 Ų112.569%0.68865%0.647SS**Hα-helixtrans-54.7-26.2-178.6-26.733.5000113.9V8 G14V8-P10 WeakPolarHBondContact O-CD 3.38Å; P10-G14 PolarHBondContact O-N 3.48Å; P10-G14 VanDerWaalsContact O-N 3.11Å
11L66.3Low64.6Low116 Ų116116.1 Ų116.161%0.60765%0.65SS**Hα-helixtrans-64.8-41.4174.5-108.397.8000113N9 G14 H15N9-L11 PolarHBondContact O-N 3.27Å; L11-G14 PolarHBondContact O-N 3Å; L11-H15 PolarHBondContact O-CD2 3.21Å; L11-H15 PolarHBondContact O-N 3Å
12D67.7Low66.6Low100 Ų100109.9 Ų109.954%0.53562%0.621SS.*Hα-helixtrans-69.5-38.1-178-71.1-30.9000111.1N9 G14 H15 L16N9-D12 PolarHBondContact O-N 3.23Å; D12-G14 VanDerWaalsContact C-N 3.32Å; D12-G14 PolarHBondContact O-N 3.18Å; D12-H15 PolarHBondContact O-N 2.95Å; D12-L16 PolarHBondContact O-N 3.35Å
13L71.5Confident68.5Low105 Ų105108.2 Ų108.255%0.5560%0.597SS.*Hα-helixtrans-63.3-40.5172.7-149.489.5000111.1V8 N9 L16 V17V8-L13 HydrophobicContact CG1-CD1 4.24Å; N9-L13 PolarHBondContact O-N 3.39Å; L13-L16 PolarHBondContact O-N 3.47Å; L13-V17 WeakPolarHBondContact O-CB 3.45Å; L13-V17 VanDerWaalsContact O-CG2 3.23Å; L13-V17 WeakPolarHBondContact O-CG2 3.31Å; L13-V17 PolarHBondContact O-N 2.94Å
14G77.3Confident70.2Confident44 Ų44101.9 Ų101.945%0.45457%0.574SS.*Hα-helixtrans-61.5-42.3176.200000113.1P10 L11 D12 A18P10-G14 PolarHBondContact O-N 3.48Å; P10-G14 VanDerWaalsContact O-N 3.11Å; L11-G14 PolarHBondContact O-N 3Å; D12-G14 VanDerWaalsContact C-N 3.32Å; D12-G14 PolarHBondContact O-N 3.18Å; G14-A18 WeakPolarHBondContact O-CB 3.23Å; G14-A18 PolarHBondContact O-N 3.39Å
15H77.5Confident71.9Confident120 Ų12096 Ų9656%0.55655%0.55SS**Hα-helixtrans-65.5-44.5175.4-78.2-62.8000112.4L11 D12 V17 A18 E19L11-H15 PolarHBondContact O-CD2 3.21Å; L11-H15 PolarHBondContact O-N 3Å; D12-H15 PolarHBondContact O-N 2.95Å; H15-V17 PolarHBondContact O-N 2.96Å; H15-A18 WeakPolarHBondContact O-CB 3.34Å; H15-A18 PolarHBondContact O-N 3.35Å; H15-E19 PolarHBondContact O-N 3.47Å
16L72.3Confident73.3Confident77 Ų7791.2 Ų91.240%0.40353%0.525SS..Hα-helixtrans-64.3-40178.4-172.767.9000112.1D12 L13 A18 E19 T20D12-L16 PolarHBondContact O-N 3.35Å; L13-L16 PolarHBondContact O-N 3.47Å; L16-A18 VanDerWaalsContact C-N 3.33Å; L16-E19 PolarHBondContact O-N 3.01Å; L16-T20 WeakPolarHBondContact O-CB 3.45Å; L16-T20 PolarHBondContact O-N 3.34Å; L16-T20 PolarHBondContact O-OG1 3.16Å
17V80.1Confident74.6Confident92 Ų9289.8 Ų89.856%0.55852%0.516SS*.Hα-helixtrans-62.8-41.7174.3169.80000110.7L13 H15 R21L13-V17 WeakPolarHBondContact O-CB 3.45Å; L13-V17 VanDerWaalsContact O-CG2 3.23Å; L13-V17 WeakPolarHBondContact O-CG2 3.31Å; L13-V17 PolarHBondContact O-N 2.94Å; H15-V17 PolarHBondContact O-N 2.96Å; V17-R21 VanDerWaalsContact O-CB 3.31Å; V17-R21 WeakPolarHBondContact O-CB 3.4Å; V17-R21 PolarHBondContact O-N 2.86Å
18A81Confident76Confident46 Ų4690.8 Ų90.838%0.3850%0.504SS..Hα-helixtrans-65-42.7176.400000112.2G14 H15 L16 R21 N22G14-A18 WeakPolarHBondContact O-CB 3.23Å; G14-A18 PolarHBondContact O-N 3.39Å; H15-A18 WeakPolarHBondContact O-CB 3.34Å; H15-A18 PolarHBondContact O-N 3.35Å; L16-A18 VanDerWaalsContact C-N 3.33Å; A18-R21 PolarHBondContact O-N 3.38Å; A18-N22 WeakPolarHBondContact O-CB 3.47Å; A18-N22 VanDerWaalsContact O-CG 3.23Å; A18-N22 PolarHBondContact O-N 3.2Å; A18-N22 PolarHBondContact O-ND2 3.04Å
19E79.9Confident77.6Confident85 Ų8592.5 Ų92.540%0.39750%0.503SS..Hα-helixtrans-66.1-43.5177.5-169.8169.4-163.100111.6H15 L16 R21 N22 L23H15-E19 PolarHBondContact O-N 3.47Å; L16-E19 PolarHBondContact O-N 3.01Å; E19-R21 VanDerWaalsContact C-N 3.3Å; E19-R21 PolarHBondContact O-N 3.03Å; E19-N22 PolarHBondContact O-N 2.75Å; E19-N22 VanDerWaalsContact O-N 3.16Å; E19-L23 HydrophobicContact CG-CD1 4.39Å; E19-L23 WeakPolarHBondContact O-CB 3.49Å; E19-L23 WeakPolarHBondContact O-CG 3.5Å; E19-L23 PolarHBondContact O-N 2.87Å
20T80.1Confident78.8Confident83 Ų8392 Ų9251%0.50950%0.499SS..Hα-helixtrans-60.9-40.4175-54.30000111.2L16 L23 S24L16-T20 WeakPolarHBondContact O-CB 3.45Å; L16-T20 PolarHBondContact O-N 3.34Å; L16-T20 PolarHBondContact O-OG1 3.16Å; T20-L23 PolarHBondContact O-N 3.4Å; T20-S24 VanDerWaalsContact O-CB 3.3Å; T20-S24 WeakPolarHBondContact O-CB 3.43Å; T20-S24 PolarHBondContact O-N 2.88Å
21R82.1Confident80Confident188 Ų18892.6 Ų92.671%0.70949%0.493SS*.Hα-helixtrans-66.1-39.9175.5-170.8176.6-177.1170.81.4111.9V17 A18 E19 S24 T25V17-R21 VanDerWaalsContact O-CB 3.31Å; V17-R21 WeakPolarHBondContact O-CB 3.4Å; V17-R21 PolarHBondContact O-N 2.86Å; A18-R21 PolarHBondContact O-N 3.38Å; E19-R21 VanDerWaalsContact C-N 3.3Å; E19-R21 PolarHBondContact O-N 3.03Å; R21-S24 PolarHBondContact O-N 3.23Å; R21-T25 WeakPolarHBondContact O-CB 3.23Å; R21-T25 PolarHBondContact O-N 3.38Å; R21-T25 PolarHBondContact O-OG1 3.36Å
22N84Confident81Confident112 Ų11289.5 Ų89.560%0.59948%0.484SS*.Hα-helixtrans-65.7-43.5176-73.3-19.5000111.5A18 E19 T25 G26A18-N22 WeakPolarHBondContact O-CB 3.47Å; A18-N22 VanDerWaalsContact O-CG 3.23Å; A18-N22 PolarHBondContact O-N 3.2Å; A18-N22 PolarHBondContact O-ND2 3.04Å; E19-N22 PolarHBondContact O-N 2.75Å; E19-N22 VanDerWaalsContact O-N 3.16Å; N22-T25 PolarHBondContact O-N 2.93Å; N22-G26 PolarHBondContact O-N 2.79Å
23L82.2Confident81.9Confident72 Ų7289.2 Ų89.238%0.37748%0.482SS..Hα-helixtrans-62.7-44.8174.9-74.4170.3000111.7E19 T20 T25 G26 L27 Y111E19-L23 HydrophobicContact CG-CD1 4.39Å; E19-L23 WeakPolarHBondContact O-CB 3.49Å; E19-L23 WeakPolarHBondContact O-CG 3.5Å; E19-L23 PolarHBondContact O-N 2.87Å; T20-L23 PolarHBondContact O-N 3.4Å; L23-T25 VanDerWaalsContact C-N 3.32Å; L23-T25 PolarHBondContact O-N 3.08Å; L23-G26 WeakPolarHBondContact O-CA 3.42Å; L23-G26 PolarHBondContact O-N 2.91Å; L23-G26 VanDerWaalsContact O-N 3.14Å; L23-L27 PolarHBondContact O-N 3.44Å; L23-Y111 WeakPolarHBondContact CD2-OH 3.3Å
24S83.8Confident82.5Confident58 Ų5889 Ų8941%0.40648%0.481SS..Hα-helixtrans-60.4-42175.3177.70000111.9T20 R21 G26 L27 Q28T20-S24 VanDerWaalsContact O-CB 3.3Å; T20-S24 WeakPolarHBondContact O-CB 3.43Å; T20-S24 PolarHBondContact O-N 2.88Å; R21-S24 PolarHBondContact O-N 3.23Å; S24-G26 VanDerWaalsContact C-N 3.33Å; S24-G26 PolarHBondContact O-N 2.87Å; S24-L27 PolarHBondContact O-N 3.41Å; S24-Q28 WeakPolarHBondContact O-CG 3.5Å; S24-Q28 PolarHBondContact O-N 3.44Å; S24-Q28 VanDerWaalsContact O-N 3.07Å
25T85.8Confident82.9Confident56 Ų5692.1 Ų92.134%0.34449%0.488SS..Hα-helixtrans-65.7-37.3174.8-52.50000111.5R21 N22 L23 K29R21-T25 WeakPolarHBondContact O-CB 3.23Å; R21-T25 PolarHBondContact O-N 3.38Å; R21-T25 PolarHBondContact O-OG1 3.36Å; N22-T25 PolarHBondContact O-N 2.93Å; L23-T25 VanDerWaalsContact C-N 3.32Å; L23-T25 PolarHBondContact O-N 3.08Å; T25-K29 WeakPolarHBondContact O-CG 3.3Å; T25-K29 PolarHBondContact O-N 3.49Å
26G84.5Confident83.5Confident29 Ų2989.9 Ų89.930%0.29948%0.482SS..Hα-helixtrans-63-45.1174.200000112.4N22 L23 S24 Q28 K29 I30N22-G26 PolarHBondContact O-N 2.79Å; L23-G26 WeakPolarHBondContact O-CA 3.42Å; L23-G26 PolarHBondContact O-N 2.91Å; L23-G26 VanDerWaalsContact O-N 3.14Å; S24-G26 VanDerWaalsContact C-N 3.33Å; S24-G26 PolarHBondContact O-N 2.87Å; G26-Q28 PolarHBondContact O-N 3.49Å; G26-K29 PolarHBondContact O-N 2.88Å; G26-I30 WeakPolarHBondContact O-CG1 3.42Å; G26-I30 PolarHBondContact O-N 2.93Å
27L81.7Confident84Confident102 Ų10291.1 Ų91.153%0.53449%0.489SS..Hα-helixtrans-60.5-45.2176.3-76.4169.2000111.9L23 S24 K29 I30 E31L23-L27 PolarHBondContact O-N 3.44Å; S24-L27 PolarHBondContact O-N 3.41Å; L27-K29 VanDerWaalsContact C-N 3.27Å; L27-K29 PolarHBondContact O-N 2.74Å; L27-I30 PolarHBondContact O-N 3.33Å; L27-I30 VanDerWaalsContact O-N 3.11Å; L27-E31 WeakPolarHBondContact O-CG 3.48Å; L27-E31 PolarHBondContact O-N 3.36Å
28Q85.4Confident84.2Confident120 Ų12090.9 Ų90.956%0.56149%0.488SS*.Hα-helixtrans-59.6-37.1176.4-73.5176-11.600112.7S24 G26 A32S24-Q28 WeakPolarHBondContact O-CG 3.5Å; S24-Q28 PolarHBondContact O-N 3.44Å; S24-Q28 VanDerWaalsContact O-N 3.07Å; G26-Q28 PolarHBondContact O-N 3.49Å; Q28-A32 WeakPolarHBondContact O-CB 3.15Å; Q28-A32 PolarHBondContact O-N 3.07Å
29K89.1Confident84.5Confident141 Ų14192.5 Ų92.561%0.61349%0.493SS*.Hα-helixtrans-67.7-40.6175.4-72.7177.9178.6-176.20112T25 G26 L27 A32 L33T25-K29 WeakPolarHBondContact O-CG 3.3Å; T25-K29 PolarHBondContact O-N 3.49Å; G26-K29 PolarHBondContact O-N 2.88Å; L27-K29 VanDerWaalsContact C-N 3.27Å; L27-K29 PolarHBondContact O-N 2.74Å; K29-A32 PolarHBondContact O-N 2.86Å; K29-L33 WeakPolarHBondContact O-CG 3.35Å; K29-L33 PolarHBondContact O-N 3.04Å
30I82.3Confident84.8Confident80 Ų8094.2 Ų94.241%0.4150%0.501SS..Hα-helixtrans-64.2-44.3177.2-67.8167.8000110.3G26 L27 A32 L33 L34G26-I30 WeakPolarHBondContact O-CG1 3.42Å; G26-I30 PolarHBondContact O-N 2.93Å; L27-I30 PolarHBondContact O-N 3.33Å; L27-I30 VanDerWaalsContact O-N 3.11Å; I30-A32 PolarHBondContact O-N 3.1Å; I30-L33 PolarHBondContact O-N 2.91Å; I30-L34 HydrophobicContact CG2-CD1 4.21Å; I30-L34 WeakPolarHBondContact O-CG 3.09Å; I30-L34 PolarHBondContact O-N 3.46Å
31E84.8Confident84.7Confident118 Ų11893.4 Ų93.455%0.55150%0.499SS*.Hα-helixtrans-59.1-46.4175.8-72.3173.816300111.5L27 L33 L34 D35L27-E31 WeakPolarHBondContact O-CG 3.48Å; L27-E31 PolarHBondContact O-N 3.36Å; E31-L33 VanDerWaalsContact C-N 3.32Å; E31-L33 PolarHBondContact O-N 3.4Å; E31-L34 WeakPolarHBondContact O-CB 3.47Å; E31-L34 PolarHBondContact O-N 2.84Å; E31-D35 PolarHBondContact O-N 3.16Å
32A87.7Confident84.8Confident52 Ų5288 Ų8843%0.4349%0.487SS..Hα-helixtrans-62.8-35.5177.600000113.5Q28 K29 I30 T36Q28-A32 WeakPolarHBondContact O-CB 3.15Å; Q28-A32 PolarHBondContact O-N 3.07Å; K29-A32 PolarHBondContact O-N 2.86Å; I30-A32 PolarHBondContact O-N 3.1Å; A32-T36 PolarHBondContact O-N 3.04Å; A32-T36 VanDerWaalsContact O-N 3.16Å; A32-T36 PolarHBondContact O-OG1 3.2Å
33L86.5Confident84.7Confident93 Ų9386.8 Ų86.849%0.48748%0.48SS..Hα-helixtrans-68-41.5174.6-73.8172000111.6K29 I30 E31 D35 T36 L37K29-L33 WeakPolarHBondContact O-CG 3.35Å; K29-L33 PolarHBondContact O-N 3.04Å; I30-L33 PolarHBondContact O-N 2.91Å; E31-L33 VanDerWaalsContact C-N 3.32Å; E31-L33 PolarHBondContact O-N 3.4Å; L33-D35 PolarHBondContact O-N 2.84Å; L33-T36 PolarHBondContact O-N 3.21Å; L33-L37 PolarHBondContact O-N 3.46Å
34L84.2Confident84.6Confident100 Ų10089.2 Ų89.252%0.52449%0.485SS..Hα-helixtrans-62.3-40.8176.2-74.6171.1000112.2I30 E31 T36 L37 T38I30-L34 HydrophobicContact CG2-CD1 4.21Å; I30-L34 WeakPolarHBondContact O-CG 3.09Å; I30-L34 PolarHBondContact O-N 3.46Å; E31-L34 WeakPolarHBondContact O-CB 3.47Å; E31-L34 PolarHBondContact O-N 2.84Å; L34-T36 VanDerWaalsContact C-N 3.33Å; L34-T36 PolarHBondContact O-N 3.49Å; L34-L37 PolarHBondContact O-N 3.18Å; L34-T38 WeakPolarHBondContact O-CB 3.45Å; L34-T38 PolarHBondContact O-N 2.95Å; L34-T38 PolarHBondContact O-OG1 3.37Å
35D86.6Confident84.4Confident111 Ų11191.8 Ų91.859%0.59449%0.494SS*.Hα-helixtrans-63.4-40.8175.6-76.2-16.8000111.8E31 L33 T39E31-D35 PolarHBondContact O-N 3.16Å; L33-D35 PolarHBondContact O-N 2.84Å; D35-T39 WeakPolarHBondContact O-CB 3.49Å; D35-T39 PolarHBondContact O-N 3.31Å; D35-T39 PolarHBondContact O-OG1 3.49Å
36T89Confident84.1Confident73 Ų7394 Ų9445%0.44850%0.5SS..Hα-helixtrans-64.3-46.1177.1-57.40000111.3A32 L33 L34 T39 Q40A32-T36 PolarHBondContact O-N 3.04Å; A32-T36 VanDerWaalsContact O-N 3.16Å; A32-T36 PolarHBondContact O-OG1 3.2Å; L33-T36 PolarHBondContact O-N 3.21Å; L34-T36 VanDerWaalsContact C-N 3.33Å; L34-T36 PolarHBondContact O-N 3.49Å; T36-T39 PolarHBondContact O-N 3.21Å; T36-Q40 WeakPolarHBondContact O-CG 3.49Å; T36-Q40 PolarHBondContact O-N 2.91Å
37L83.3Confident83.8Confident102 Ų10297.3 Ų97.353%0.53451%0.511SS..Hα-helixtrans-62.9-44.1177.9-100.9141.1000112.2L33 L34 T39 Q40 S41L33-L37 PolarHBondContact O-N 3.46Å; L34-L37 PolarHBondContact O-N 3.18Å; L37-T39 VanDerWaalsContact C-N 3.31Å; L37-T39 PolarHBondContact O-N 3.19Å; L37-Q40 PolarHBondContact O-N 3.11Å; L37-S41 WeakPolarHBondContact O-CB 3.41Å; L37-S41 PolarHBondContact O-N 3.04Å
38T84.3Confident83.3Confident87 Ų8795.1 Ų95.153%0.53450%0.499SS..Hα-helixtrans-59.2-43.4175.6-58.40000111.4L34 S41 T42L34-T38 WeakPolarHBondContact O-CB 3.45Å; L34-T38 PolarHBondContact O-N 2.95Å; L34-T38 PolarHBondContact O-OG1 3.37Å; T38-S41 PolarHBondContact O-N 2.87Å; T38-T42 PolarHBondContact O-N 3.14Å; T38-T42 PolarHBondContact O-OG1 3.31Å
39T87.3Confident82.8Confident81 Ų8196.9 Ų96.950%0.49750%0.5SS..Hα-helixtrans-64.9-46.3178.3-58.80000111.6D35 T36 L37 S41 T42 N43D35-T39 WeakPolarHBondContact O-CB 3.49Å; D35-T39 PolarHBondContact O-N 3.31Å; D35-T39 PolarHBondContact O-OG1 3.49Å; T36-T39 PolarHBondContact O-N 3.21Å; L37-T39 VanDerWaalsContact C-N 3.31Å; L37-T39 PolarHBondContact O-N 3.19Å; T39-S41 PolarHBondContact O-N 3.07Å; T39-T42 PolarHBondContact O-N 2.72Å; T39-N43 VanDerWaalsContact O-CG 3.31Å; T39-N43 PolarHBondContact O-N 3.33Å; T39-N43 PolarHBondContact O-ND2 3.35Å
40Q85.5Confident82.2Confident121 Ų12193.9 Ų93.957%0.56549%0.491SS*.Hα-helixtrans-61.8-43.3176.9-73.9179.6-6.200112.1T36 L37 N43 Y44T36-Q40 WeakPolarHBondContact O-CG 3.49Å; T36-Q40 PolarHBondContact O-N 2.91Å; L37-Q40 PolarHBondContact O-N 3.11Å; Q40-N43 PolarHBondContact O-N 3.48Å; Q40-Y44 WeakPolarHBondContact O-CB 3.48Å; Q40-Y44 PolarHBondContact O-N 3.06Å
41S79.2Confident81.7Confident66 Ų6695 Ų9546%0.46250%0.497SS..Hα-helixtrans-60.4-45.9177-173.60000111.8L37 T38 T39 N43 Y44 L45L37-S41 WeakPolarHBondContact O-CB 3.41Å; L37-S41 PolarHBondContact O-N 3.04Å; T38-S41 PolarHBondContact O-N 2.87Å; T39-S41 PolarHBondContact O-N 3.07Å; S41-N43 PolarHBondContact O-N 2.86Å; S41-Y44 PolarHBondContact O-N 3.42Å; S41-L45 WeakPolarHBondContact O-CG 3.43Å; S41-L45 PolarHBondContact O-N 2.96Å
42T83.3Confident80.9Confident74 Ų7494 Ų9445%0.45450%0.495SS..Hα-helixtrans-61.2-47178-540000111.3T38 T39 Y44 L45 E46T38-T42 PolarHBondContact O-N 3.14Å; T38-T42 PolarHBondContact O-OG1 3.31Å; T39-T42 PolarHBondContact O-N 2.72Å; T42-Y44 VanDerWaalsContact C-N 3.33Å; T42-Y44 PolarHBondContact O-N 2.92Å; T42-L45 PolarHBondContact O-N 2.97Å; T42-E46 WeakPolarHBondContact O-CB 3.32Å; T42-E46 PolarHBondContact O-N 2.89Å
43N82.7Confident80.1Confident87 Ų8796.3 Ų96.347%0.46550%0.496SS..Hα-helixtrans-61.1-40.2176.7-71.9-23.9000112.3T39 Q40 S41 E46 N47T39-N43 VanDerWaalsContact O-CG 3.31Å; T39-N43 PolarHBondContact O-N 3.33Å; T39-N43 PolarHBondContact O-ND2 3.35Å; Q40-N43 PolarHBondContact O-N 3.48Å; S41-N43 PolarHBondContact O-N 2.86Å; N43-E46 PolarHBondContact O-N 3.29Å; N43-N47 WeakPolarHBondContact O-CB 3.3Å; N43-N47 VanDerWaalsContact O-CG 3.26Å; N43-N47 PolarHBondContact O-N 3.4Å; N43-N47 PolarHBondContact O-ND2 2.85Å
44Y79.1Confident79Confident123 Ų12395.1 Ų95.148%0.48250%0.495SS..Hα-helixtrans-63.1-46.3177-179.4-97.1000111.7Q40 S41 T42 E46 N47 M48Q40-Y44 WeakPolarHBondContact O-CB 3.48Å; Q40-Y44 PolarHBondContact O-N 3.06Å; S41-Y44 PolarHBondContact O-N 3.42Å; T42-Y44 VanDerWaalsContact C-N 3.33Å; T42-Y44 PolarHBondContact O-N 2.92Å; Y44-E46 VanDerWaalsContact C-N 3.34Å; Y44-E46 PolarHBondContact O-N 2.76Å; Y44-N47 PolarHBondContact O-N 3.2Å; Y44-M48 HydrophobicContact CD1-CG 4.26Å; Y44-M48 HydrophobicContact CE1-CG 3.89Å; Y44-M48 WeakPolarHBondContact O-CG 3.5Å; Y44-M48 PolarHBondContact O-N 3.35Å
45L80.6Confident77.8Confident112 Ų11295.6 Ų95.659%0.58649%0.494SS*.Hα-helixtrans-63.8-38.5177.6-69.6175000112.2S41 T42 M48 R49S41-L45 WeakPolarHBondContact O-CG 3.43Å; S41-L45 PolarHBondContact O-N 2.96Å; T42-L45 PolarHBondContact O-N 2.97Å; L45-M48 PolarHBondContact O-N 3.41Å; L45-R49 WeakPolarHBondContact O-CB 3.49Å; L45-R49 PolarHBondContact O-N 2.91Å
46E79.8Confident76.2Confident101 Ų10196.4 Ų96.447%0.47250%0.499SS..Hα-helixtrans-66.5-42.9176.2-171.7128.4-139.600111.9T42 N43 Y44 M48 R49 N50T42-E46 WeakPolarHBondContact O-CB 3.32Å; T42-E46 PolarHBondContact O-N 2.89Å; N43-E46 PolarHBondContact O-N 3.29Å; Y44-E46 VanDerWaalsContact C-N 3.34Å; Y44-E46 PolarHBondContact O-N 2.76Å; E46-M48 PolarHBondContact O-N 3.33Å; E46-R49 WeakPolarHBondContact O-CB 3.47Å; E46-R49 PolarHBondContact O-N 2.95Å; E46-N50 VanDerWaalsContact O-CG 3.31Å; E46-N50 PolarHBondContact O-N 2.93Å; E46-N50 PolarHBondContact O-ND2 3.43Å
47N78.5Confident74.5Confident100 Ų100102.5 Ų102.554%0.53551%0.514SS..Hα-helixtrans-60.8-44.5173.9-74.7-21.8000111.9N43 Y44 R49 N50 L51N43-N47 WeakPolarHBondContact O-CB 3.3Å; N43-N47 VanDerWaalsContact O-CG 3.26Å; N43-N47 PolarHBondContact O-N 3.4Å; N43-N47 PolarHBondContact O-ND2 2.85Å; Y44-N47 PolarHBondContact O-N 3.2Å; N47-R49 VanDerWaalsContact C-N 3.32Å; N47-R49 PolarHBondContact O-N 3.35Å; N47-N50 PolarHBondContact O-N 3.26Å; N47-L51 WeakPolarHBondContact O-CG 3.44Å; N47-L51 PolarHBondContact O-N 3.49Å
48M70.9Confident73Confident55 Ų55100.9 Ų100.927%0.27152%0.515SS..Hα-helixtrans-61.2-40.6174.8-74-63.5-65.200112Y44 L45 E46 L51 L52Y44-M48 HydrophobicContact CD1-CG 4.26Å; Y44-M48 HydrophobicContact CE1-CG 3.89Å; Y44-M48 WeakPolarHBondContact O-CG 3.5Å; Y44-M48 PolarHBondContact O-N 3.35Å; L45-M48 PolarHBondContact O-N 3.41Å; E46-M48 PolarHBondContact O-N 3.33Å; M48-L51 PolarHBondContact O-N 3.01Å; M48-L51 HydrophobicContact SD-CD1 4.37Å; M48-L52 WeakPolarHBondContact O-CG 3.44Å; M48-L52 PolarHBondContact O-N 3.17Å; M48-L52 VanDerWaalsContact O-N 3.09Å
49R74.3Confident71.5Confident158 Ų158104.6 Ų104.660%0.59653%0.526SS*.Hα-helixtrans-64.2-39.4175.8-168.5-178.5-168-179.26112L45 E46 N47 K53L45-R49 WeakPolarHBondContact O-CB 3.49Å; L45-R49 PolarHBondContact O-N 2.91Å; E46-R49 WeakPolarHBondContact O-CB 3.47Å; E46-R49 PolarHBondContact O-N 2.95Å; N47-R49 VanDerWaalsContact C-N 3.32Å; N47-R49 PolarHBondContact O-N 3.35Å; R49-K53 WeakPolarHBondContact O-CG 3.44Å; R49-K53 PolarHBondContact O-N 3.06Å; R49-K53 VanDerWaalsContact O-N 3.09Å
50N75.8Confident69.7Low78 Ų78104.8 Ų104.842%0.41753%0.531SS..Hα-helixtrans-69.8-38.9178.1-71.5-27.2000112.1E46 N47 K53 S54E46-N50 VanDerWaalsContact O-CG 3.31Å; E46-N50 PolarHBondContact O-N 2.93Å; E46-N50 PolarHBondContact O-ND2 3.43Å; N47-N50 PolarHBondContact O-N 3.26Å; N50-K53 PolarHBondContact O-N 3.16Å; N50-S54 PolarHBondContact O-N 2.89Å
51L72.6Confident68Low103 Ų103105.7 Ų105.754%0.53954%0.539SS..Hα-helixtrans-59.7-49.1173.3-75168.2000111.3N47 M48 K53 S54 E55N47-L51 WeakPolarHBondContact O-CG 3.44Å; N47-L51 PolarHBondContact O-N 3.49Å; M48-L51 PolarHBondContact O-N 3.01Å; M48-L51 HydrophobicContact SD-CD1 4.37Å; L51-K53 VanDerWaalsContact C-N 3.35Å; L51-K53 PolarHBondContact O-N 2.99Å; L51-S54 PolarHBondContact O-N 2.96Å; L51-S54 PolarHBondContact O-OG 3.43Å; L51-E55 PolarHBondContact O-N 3.21Å; L51-E55 VanDerWaalsContact O-N 3.12Å
52L66.8Low66.7Low98 Ų98111.1 Ų111.151%0.51355%0.551SS.*Hα-helixtrans-60.6-41.5177.6-70.3169.2000112.5M48 S54 E55 D56M48-L52 WeakPolarHBondContact O-CG 3.44Å; M48-L52 PolarHBondContact O-N 3.17Å; M48-L52 VanDerWaalsContact O-N 3.09Å; L52-S54 VanDerWaalsContact C-N 3.26Å; L52-S54 PolarHBondContact O-N 3.44Å; L52-E55 PolarHBondContact O-N 2.95Å; L52-D56 PolarHBondContact O-N 3.31Å
53K71.9Confident65Low100 Ų100115.9 Ų115.944%0.43557%0.574SS.*Hα-helixtrans-63.6-30.3174.9-76.3177179.7176.50113.3R49 N50 L51R49-K53 WeakPolarHBondContact O-CG 3.44Å; R49-K53 PolarHBondContact O-N 3.06Å; R49-K53 VanDerWaalsContact O-N 3.09Å; N50-K53 PolarHBondContact O-N 3.16Å; L51-K53 VanDerWaalsContact C-N 3.35Å; L51-K53 PolarHBondContact O-N 2.99Å
54S64.2Low63.7Low67 Ų67115 Ų11547%0.46957%0.568SS.*Hα-helixtrans-75-35.1177.973.60000112.1N50 L51 L52 R57 A58N50-S54 PolarHBondContact O-N 2.89Å; L51-S54 PolarHBondContact O-N 2.96Å; L51-S54 PolarHBondContact O-OG 3.43Å; L52-S54 VanDerWaalsContact C-N 3.26Å; L52-S54 PolarHBondContact O-N 3.44Å; S54-R57 PolarHBondContact O-N 2.95Å; S54-A58 PolarHBondContact O-N 2.91Å
55E58.2Low62.4Low110 Ų110112 Ų11251%0.51457%0.565SS.*Hα-helixtrans-66-41.3174.9-71.6-175.215800111.7L51 L52 R57 A58 H59L51-E55 PolarHBondContact O-N 3.21Å; L51-E55 VanDerWaalsContact O-N 3.12Å; L52-E55 PolarHBondContact O-N 2.95Å; E55-R57 VanDerWaalsContact C-N 3.26Å; E55-R57 PolarHBondContact O-N 3.4Å; E55-A58 PolarHBondContact O-N 3.14Å; E55-H59 PolarHBondContact O-ND1 3.19Å
56D52.9Low61.1Low129 Ų129111.2 Ų111.269%0.6957%0.569SS**Hα-helixtrans-62.4-30.9178.3-78.1-22.7000113.1L52L52-D56 PolarHBondContact O-N 3.31Å
57R52.9Low60.1Low200 Ų200114 Ų11476%0.75559%0.585SS**Hα-helixtrans-76.4-32.3179.6-69.9-178.2-174.8-173.11113S54 E55 H59 S60S54-R57 PolarHBondContact O-N 2.95Å; E55-R57 VanDerWaalsContact C-N 3.26Å; E55-R57 PolarHBondContact O-N 3.4Å; R57-H59 PolarHBondContact O-N 3.35Å; R57-S60 PolarHBondContact O-OG 2.87Å
58A53.4Low59.1Low69 Ų69113.9 Ų113.957%0.5758%0.58SS**Hα-helixtrans-68.1-21.8-176.400000113.5S54 E55 S60S54-A58 PolarHBondContact O-N 2.91Å; E55-A58 PolarHBondContact O-N 3.14Å; A58-S60 PolarHBondContact O-N 3.27Å
59H50.9Low58.4Low164 Ų164115.1 Ų115.176%0.75959%0.588SS**THydrogen-bonded Turntrans-86.1-0.9-174.2-70.681.4000115.1E55 R57E55-H59 PolarHBondContact O-ND1 3.19Å; R57-H59 PolarHBondContact O-N 3.35Å
60S50.6Low57.7Low86 Ų86114.1 Ų114.160%0.60159%0.59SS**THydrogen-bonded Turntrans-98.6-2.5-167.6640000117.1R57 A58R57-S60 PolarHBondContact O-OG 2.87Å; A58-S60 PolarHBondContact O-N 3.27Å
61N49.6Very low57Low139 Ų139113 Ų11374%0.74359%0.592SS**SBendtrans-138.825.9-161.2-98.6-2.7000118.4
62Y50.9Low56.2Low181 Ų181112 Ų11271%0.7159%0.587SS**  trans-123.9113.8179.4-81.2-89.4000114I64Y62-I64 PolarHBondContact O-N 3.42Å
63D49.4Very low55.7Low173 Ų173112.5 Ų112.593%0.92559%0.589SS**  trans-69.7100.3152.5-93.2-30.8000107.3
64I54Low55.2Low68 Ų68112.9 Ų112.935%0.34960%0.596SS.*  trans-96.2123.7-170-68.2159.6000109.4Y62 E68 L69 L72Y62-I64 PolarHBondContact O-N 3.42Å; I64-E68 HydrophobicContact CG2-CB 3.66Å; I64-L69 HydrophobicContact CG2-CB 3.77Å; I64-L69 HydrophobicContact CG2-CD1 3.94Å; I64-L72 HydrophobicContact CB-CD1 4.42Å; I64-L72 HydrophobicContact CD1-CD1 3.3Å; I64-L72 HydrophobicContact CG1-CD1 3.71Å; I64-L72 HydrophobicContact CG2-CD1 3.77Å
65S52.6Low55Low60 Ų60114.3 Ų114.342%0.4260%0.598SS.*  trans-69.1151.9170.664.70000111.3M67 E68 L69S65-M67 PolarHBondContact O-N 3.24Å; S65-E68 WeakPolarHBondContact CB-OE2 3.18Å; S65-E68 PolarHBondContact N-OE2 3.06Å; S65-E68 CarbonylContact O-C 3.52Å; S65-E68 WeakPolarHBondContact O-CA 3.22Å; S65-E68 WeakPolarHBondContact O-CB 3.39Å; S65-E68 PolarHBondContact O-N 3.34Å; S65-E68 WeakPolarHBondContact OG-CG 3.36Å; S65-E68 PolarHBondContact OG-OE2 3.38Å; S65-L69 PolarHBondContact O-N 2.93Å
66S52.4Low54.9Low96 Ų96112 Ų11267%0.67160%0.595SS**Hα-helixtrans-57.6-26.8-173.7-162.90000114.5L69 E70S66-L69 PolarHBondContact O-N 3.44Å; S66-E70 PolarHBondContact O-N 2.76Å
67M59.5Low55.3Low161 Ų161108.5 Ų108.579%0.79358%0.58SS**Hα-helixtrans-76.6-35.4175-167.6175.5-85.100111.8S65 L69 A71S65-M67 PolarHBondContact O-N 3.24Å; M67-L69 VanDerWaalsContact C-N 3.33Å; M67-A71 PolarHBondContact O-N 3Å; M67-A71 VanDerWaalsContact O-N 3.16Å
68E57.3Low55.8Low96 Ų96105.4 Ų105.445%0.44957%0.572SS.*Hα-helixtrans-70.5-30.3169.4-70.3167.1146.600111.5I64 S65 A71 L72I64-E68 HydrophobicContact CG2-CB 3.66Å; S65-E68 WeakPolarHBondContact CB-OE2 3.18Å; S65-E68 PolarHBondContact N-OE2 3.06Å; S65-E68 CarbonylContact O-C 3.52Å; S65-E68 WeakPolarHBondContact O-CA 3.22Å; S65-E68 WeakPolarHBondContact O-CB 3.39Å; S65-E68 PolarHBondContact O-N 3.34Å; S65-E68 WeakPolarHBondContact OG-CG 3.36Å; S65-E68 PolarHBondContact OG-OE2 3.38Å; E68-A71 PolarHBondContact O-N 2.89Å; E68-L72 VanDerWaalsContact O-CB 3.23Å; E68-L72 WeakPolarHBondContact O-CB 3.43Å; E68-L72 WeakPolarHBondContact O-CG 3.5Å; E68-L72 PolarHBondContact O-N 3.35Å
69L55.8Low56.4Low82 Ų82105.4 Ų105.443%0.42957%0.568SS.*Hα-helixtrans-66.3-42.4175.6-164.174.6000111.2I64 S65 S66 M67 L72 L73I64-L69 HydrophobicContact CG2-CB 3.77Å; I64-L69 HydrophobicContact CG2-CD1 3.94Å; S65-L69 PolarHBondContact O-N 2.93Å; S66-L69 PolarHBondContact O-N 3.44Å; M67-L69 VanDerWaalsContact C-N 3.33Å; L69-L72 PolarHBondContact O-N 3.35Å; L69-L73 HydrophobicContact CG-CD1 4.25Å; L69-L73 VanDerWaalsContact O-CB 3.32Å; L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 WeakPolarHBondContact O-CG 3.34Å; L69-L73 PolarHBondContact O-N 2.98Å
70E59.2Low57.4Low136 Ų136100 Ų10064%0.63655%0.549SS*.Hα-helixtrans-66.1-39.5173.6-81.5-176.2162.800112.3S66 L73 N74S66-E70 PolarHBondContact O-N 2.76Å; E70-L73 PolarHBondContact O-N 2.86Å; E70-N74 WeakPolarHBondContact O-CB 3.29Å; E70-N74 PolarHBondContact O-N 2.84Å
71A61.8Low58.6Low55 Ų55100.4 Ų100.446%0.45554%0.544SS..Hα-helixtrans-63.2-43.4173.700000111.6M67 E68 N74 D75M67-A71 PolarHBondContact O-N 3Å; M67-A71 VanDerWaalsContact O-N 3.16Å; E68-A71 PolarHBondContact O-N 2.89Å; A71-N74 PolarHBondContact O-N 3.47Å; A71-D75 WeakPolarHBondContact O-CB 3.36Å; A71-D75 PolarHBondContact O-N 2.89Å
72L55.9Low59.7Low83 Ų83102.3 Ų102.344%0.43554%0.541SS..Hα-helixtrans-69-32.3176-76168.3000112.8I64 E68 L69 S76I64-L72 HydrophobicContact CB-CD1 4.42Å; I64-L72 HydrophobicContact CD1-CD1 3.3Å; I64-L72 HydrophobicContact CG1-CD1 3.71Å; I64-L72 HydrophobicContact CG2-CD1 3.77Å; E68-L72 VanDerWaalsContact O-CB 3.23Å; E68-L72 WeakPolarHBondContact O-CB 3.43Å; E68-L72 WeakPolarHBondContact O-CG 3.5Å; E68-L72 PolarHBondContact O-N 3.35Å; L69-L72 PolarHBondContact O-N 3.35Å; L72-S76 WeakPolarHBondContact O-CA 3.49Å; L72-S76 WeakPolarHBondContact O-CB 3.42Å; L72-S76 PolarHBondContact O-N 2.87Å
73L57.1Low60.8Low108 Ų10897.1 Ų97.157%0.56553%0.525SS*.Hα-helixtrans-71.4-37.8173.5-76167.9000111.2L69 E70 S76 S77L69-L73 HydrophobicContact CG-CD1 4.25Å; L69-L73 VanDerWaalsContact O-CB 3.32Å; L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 WeakPolarHBondContact O-CG 3.34Å; L69-L73 PolarHBondContact O-N 2.98Å; E70-L73 PolarHBondContact O-N 2.86Å; L73-S76 PolarHBondContact O-N 2.98Å; L73-S77 WeakPolarHBondContact O-CB 3.45Å; L73-S77 PolarHBondContact O-N 2.92Å
74N61.2Low62.1Low108 Ų10895.3 Ų95.358%0.57851%0.508SS*.Hα-helixtrans-67-43.5172.6-107.8-14.9000111.6E70 A71 S77 K78E70-N74 WeakPolarHBondContact O-CB 3.29Å; E70-N74 PolarHBondContact O-N 2.84Å; A71-N74 PolarHBondContact O-N 3.47Å; N74-S77 PolarHBondContact O-N 2.82Å; N74-S77 PolarHBondContact O-OG 3.43Å; N74-K78 WeakPolarHBondContact O-CG 3.42Å; N74-K78 PolarHBondContact O-N 3.33Å; N74-K78 VanDerWaalsContact O-N 3.11Å
75D58.6Low63.1Low96 Ų9697.7 Ų97.751%0.51352%0.521SS..Hα-helixtrans-69.8-32.4174.4-88.3-9000112.5A71 K78 S79A71-D75 WeakPolarHBondContact O-CB 3.36Å; A71-D75 PolarHBondContact O-N 2.89Å; D75-K78 PolarHBondContact O-N 3.19Å; D75-S79 VanDerWaalsContact O-CB 3.29Å; D75-S79 WeakPolarHBondContact O-CB 3.27Å; D75-S79 PolarHBondContact O-N 3.43Å; D75-S79 PolarHBondContact O-OG 2.95Å
76S58Low64.1Low63 Ų6398.3 Ų98.344%0.44152%0.519SS..Hα-helixtrans-67.3-37.9172.4177.50000111.5L72 L73 S79 S80L72-S76 WeakPolarHBondContact O-CA 3.49Å; L72-S76 WeakPolarHBondContact O-CB 3.42Å; L72-S76 PolarHBondContact O-N 2.87Å; L73-S76 PolarHBondContact O-N 2.98Å; S76-S79 WeakPolarHBondContact CA-OG 3.48Å; S76-S79 PolarHBondContact O-N 3.3Å; S76-S79 PolarHBondContact O-OG 3.35Å; S76-S79 VanDerWaalsContact O-OG 3.07Å; S76-S80 WeakPolarHBondContact O-CB 3.4Å; S76-S80 PolarHBondContact O-N 3.45Å
77S60.5Low65.4Low54 Ų54101.7 Ų101.738%0.37852%0.517SS..Hα-helixtrans-65.8-39.5173.679.90000111.6L73 N74 N81L73-S77 WeakPolarHBondContact O-CB 3.45Å; L73-S77 PolarHBondContact O-N 2.92Å; N74-S77 PolarHBondContact O-N 2.82Å; N74-S77 PolarHBondContact O-OG 3.43Å; S77-N81 WeakPolarHBondContact O-CB 3.48Å; S77-N81 VanDerWaalsContact O-CG 3.26Å; S77-N81 PolarHBondContact O-N 2.81Å; S77-N81 PolarHBondContact O-ND2 2.93Å
78K64.2Low66.3Low135 Ų13596 Ų9659%0.58750%0.499SS*.Hα-helixtrans-69.1-41.8174.4-71.6176.8-175.9170.80112N74 D75 N81 R82N74-K78 WeakPolarHBondContact O-CG 3.42Å; N74-K78 PolarHBondContact O-N 3.33Å; N74-K78 VanDerWaalsContact O-N 3.11Å; D75-K78 PolarHBondContact O-N 3.19Å; K78-N81 PolarHBondContact O-N 3.31Å; K78-R82 VanDerWaalsContact O-CB 3.28Å; K78-R82 WeakPolarHBondContact O-CB 3.34Å; K78-R82 PolarHBondContact O-N 3.02Å
79S65.1Low67.4Low69 Ų6997.2 Ų97.248%0.48351%0.505SS..Hα-helixtrans-68.1-39.717878.30000111D75 S76 R82 L83D75-S79 VanDerWaalsContact O-CB 3.29Å; D75-S79 WeakPolarHBondContact O-CB 3.27Å; D75-S79 PolarHBondContact O-N 3.43Å; D75-S79 PolarHBondContact O-OG 2.95Å; S76-S79 WeakPolarHBondContact CA-OG 3.48Å; S76-S79 PolarHBondContact O-N 3.3Å; S76-S79 PolarHBondContact O-OG 3.35Å; S76-S79 VanDerWaalsContact O-OG 3.07Å; S79-R82 PolarHBondContact O-N 3.43Å; S79-L83 WeakPolarHBondContact O-CB 3.42Å; S79-L83 PolarHBondContact O-N 2.93Å
80S72.5Confident68.5Low52 Ų5295.6 Ų95.636%0.36450%0.497SS..Hα-helixtrans-63.7-44.3174.5-176.70000111.6S76 L83 K84S76-S80 WeakPolarHBondContact O-CB 3.4Å; S76-S80 PolarHBondContact O-N 3.45Å; S80-L83 PolarHBondContact O-N 3.4Å; S80-K84 WeakPolarHBondContact O-CB 3.33Å; S80-K84 WeakPolarHBondContact O-CG 3.41Å; S80-K84 PolarHBondContact O-N 3.27Å
81N74.6Confident69.8Low93 Ų9394 Ų9450%0.49749%0.492SS..Hα-helixtrans-65.4-42.5174.6-74.6-25.5000111.9S77 K78 L83 K84 L85S77-N81 WeakPolarHBondContact O-CB 3.48Å; S77-N81 VanDerWaalsContact O-CG 3.26Å; S77-N81 PolarHBondContact O-N 2.81Å; S77-N81 PolarHBondContact O-ND2 2.93Å; K78-N81 PolarHBondContact O-N 3.31Å; N81-L83 PolarHBondContact O-N 2.95Å; N81-K84 PolarHBondContact O-N 3.5Å; N81-L85 WeakPolarHBondContact O-CG 3.47Å; N81-L85 PolarHBondContact O-N 2.91Å
82R73.4Confident70.8Confident180 Ų18097.2 Ų97.268%0.67950%0.497SS*.Hα-helixtrans-61.8-42.2174.5-175.5177.1178.2-176.8-0.7111.8K78 S79 L85 M86K78-R82 VanDerWaalsContact O-CB 3.28Å; K78-R82 WeakPolarHBondContact O-CB 3.34Å; K78-R82 PolarHBondContact O-N 3.02Å; S79-R82 PolarHBondContact O-N 3.43Å; R82-L85 PolarHBondContact O-N 3.45Å; R82-M86 HydrophobicContact CG-SD 4.37Å; R82-M86 WeakPolarHBondContact O-CB 3.37Å; R82-M86 WeakPolarHBondContact O-CG 3.36Å; R82-M86 PolarHBondContact O-N 3.48Å
83L73.4Confident72.2Confident71 Ų7197.1 Ų97.137%0.37250%0.497SS..Hα-helixtrans-66.2-39.1177.5-175.564.6000111.3S79 S80 N81 M86 R87S79-L83 WeakPolarHBondContact O-CB 3.42Å; S79-L83 PolarHBondContact O-N 2.93Å; S80-L83 PolarHBondContact O-N 3.4Å; N81-L83 PolarHBondContact O-N 2.95Å; L83-M86 PolarHBondContact O-N 3.49Å; L83-R87 WeakPolarHBondContact O-CB 3.47Å; L83-R87 WeakPolarHBondContact O-CG 3.38Å; L83-R87 PolarHBondContact O-N 2.83Å
84K76.5Confident73.5Confident135 Ų13598.9 Ų98.959%0.58750%0.5SS*.Hα-helixtrans-62.3-44.5172.6-76.7176.9-176.4176.40111.8S80 N81 R87 G88S80-K84 WeakPolarHBondContact O-CB 3.33Å; S80-K84 WeakPolarHBondContact O-CG 3.41Å; S80-K84 PolarHBondContact O-N 3.27Å; N81-K84 PolarHBondContact O-N 3.5Å; K84-R87 PolarHBondContact O-N 3.44Å; K84-G88 PolarHBondContact O-N 2.84Å
85L74.7Confident74.7Confident118 Ų11898.6 Ų98.662%0.61850%0.495SS*.Hα-helixtrans-60.2-50.5174.8-73.8168.4000111N81 R82 R87 G88 E89N81-L85 WeakPolarHBondContact O-CG 3.47Å; N81-L85 PolarHBondContact O-N 2.91Å; R82-L85 PolarHBondContact O-N 3.45Å; L85-R87 VanDerWaalsContact C-N 3.28Å; L85-R87 PolarHBondContact O-N 3.46Å; L85-G88 WeakPolarHBondContact O-CA 3.4Å; L85-G88 PolarHBondContact O-N 3.32Å; L85-E89 WeakPolarHBondContact O-CG 3.28Å; L85-E89 PolarHBondContact O-N 3.35Å
86M75.6Confident75.9Confident74 Ų7496.2 Ų96.237%0.36548%0.481SS..Hα-helixtrans-60.9-35.7177.2-74.2-177.760.400112.8R82 L83 N90R82-M86 HydrophobicContact CG-SD 4.37Å; R82-M86 WeakPolarHBondContact O-CB 3.37Å; R82-M86 WeakPolarHBondContact O-CG 3.36Å; R82-M86 PolarHBondContact O-N 3.48Å; L83-M86 PolarHBondContact O-N 3.49Å; M86-N90 WeakPolarHBondContact O-CB 3.41Å; M86-N90 PolarHBondContact O-N 2.97Å; M86-N90 PolarHBondContact O-ND2 3.25Å
87R77.8Confident77.1Confident167 Ų16797.5 Ų97.563%0.6348%0.482SS*.Hα-helixtrans-67.9-39.3174.2-77.5174.4178.7-178.71.2111.6L83 K84 L85 N90 L91L83-R87 WeakPolarHBondContact O-CB 3.47Å; L83-R87 WeakPolarHBondContact O-CG 3.38Å; L83-R87 PolarHBondContact O-N 2.83Å; K84-R87 PolarHBondContact O-N 3.44Å; L85-R87 VanDerWaalsContact C-N 3.28Å; L85-R87 PolarHBondContact O-N 3.46Å; R87-N90 PolarHBondContact O-N 3.41Å; R87-L91 WeakPolarHBondContact O-CB 3.42Å; R87-L91 PolarHBondContact O-N 2.99Å
88G78.5Confident78.4Confident41 Ų4199.9 Ų99.942%0.42349%0.487SS..Hα-helixtrans-64-46.1173.900000112.3K84 L85 N90 L91 H92K84-G88 PolarHBondContact O-N 2.84Å; L85-G88 WeakPolarHBondContact O-CA 3.4Å; L85-G88 PolarHBondContact O-N 3.32Å; G88-N90 PolarHBondContact O-N 3.46Å; G88-L91 WeakPolarHBondContact O-CB 3.36Å; G88-L91 PolarHBondContact O-N 2.93Å; G88-H92 PolarHBondContact O-N 2.85Å
89E81.4Confident79.3Confident122 Ų12298 Ų9857%0.5748%0.483SS*.Hα-helixtrans-61.5-42.8174.7-71.8175.2174.200111.7L85 L91 H92 L93L85-E89 WeakPolarHBondContact O-CG 3.28Å; L85-E89 PolarHBondContact O-N 3.35Å; E89-L91 VanDerWaalsContact C-N 3.33Å; E89-L91 PolarHBondContact O-N 3.45Å; E89-H92 PolarHBondContact O-N 3.31Å; E89-L93 WeakPolarHBondContact O-CB 3.32Å; E89-L93 WeakPolarHBondContact O-CG 3.35Å; E89-L93 PolarHBondContact O-N 3.23Å
90N78.1Confident80.1Confident48 Ų4899.4 Ų99.426%0.25748%0.478SS..Hα-helixtrans-63.6-37.8175.4-88.2-69.1000112.8M86 R87 G88 K94M86-N90 WeakPolarHBondContact O-CB 3.41Å; M86-N90 PolarHBondContact O-N 2.97Å; M86-N90 PolarHBondContact O-ND2 3.25Å; R87-N90 PolarHBondContact O-N 3.41Å; G88-N90 PolarHBondContact O-N 3.46Å; N90-K94 WeakPolarHBondContact O-CB 3.44Å; N90-K94 VanDerWaalsContact O-CG 3.28Å; N90-K94 WeakPolarHBondContact O-CG 3.27Å; N90-K94 PolarHBondContact O-N 2.91Å
91L86Confident80.5Confident103 Ų103102 Ų10254%0.53948%0.484SS..Hα-helixtrans-64.1-46.6175.2-176.767.2000110.3R87 G88 E89 L93 K94 E95R87-L91 WeakPolarHBondContact O-CB 3.42Å; R87-L91 PolarHBondContact O-N 2.99Å; G88-L91 WeakPolarHBondContact O-CB 3.36Å; G88-L91 PolarHBondContact O-N 2.93Å; E89-L91 VanDerWaalsContact C-N 3.33Å; E89-L91 PolarHBondContact O-N 3.45Å; L91-L93 PolarHBondContact O-N 3.38Å; L91-K94 WeakPolarHBondContact O-CB 3.45Å; L91-K94 PolarHBondContact O-N 3.46Å; L91-E95 PolarHBondContact O-N 2.91Å
92H84Confident81.1Confident121 Ų121101.9 Ų101.956%0.5648%0.483SS*.Hα-helixtrans-60.3-45.6177.7-176.957000112.5G88 E89 K94 E95 E96G88-H92 PolarHBondContact O-N 2.85Å; E89-H92 PolarHBondContact O-N 3.31Å; H92-K94 VanDerWaalsContact C-N 3.32Å; H92-K94 PolarHBondContact O-N 3.48Å; H92-E95 PolarHBondContact O-N 3.27Å; H92-E96 PolarHBondContact O-N 3.22Å
93L84.5Confident81.3Confident81 Ų8195.7 Ų95.742%0.42447%0.47SS..Hα-helixtrans-62.8-37.4175.9-72.9171000112.3E89 L91 E96 I97E89-L93 WeakPolarHBondContact O-CB 3.32Å; E89-L93 WeakPolarHBondContact O-CG 3.35Å; E89-L93 PolarHBondContact O-N 3.23Å; L91-L93 PolarHBondContact O-N 3.38Å; L93-E96 PolarHBondContact O-N 2.96Å; L93-I97 VanDerWaalsContact O-CG1 3.27Å; L93-I97 WeakPolarHBondContact O-CG1 3.36Å; L93-I97 PolarHBondContact O-N 3.31Å
94K85.1Confident81.8Confident146 Ų14695.7 Ų95.764%0.63547%0.47SS*.Hα-helixtrans-63.8-42.2175.3-79.6177.1178.7-175.20112N90 L91 H92 I97 H98N90-K94 WeakPolarHBondContact O-CB 3.44Å; N90-K94 VanDerWaalsContact O-CG 3.28Å; N90-K94 WeakPolarHBondContact O-CG 3.27Å; N90-K94 PolarHBondContact O-N 2.91Å; L91-K94 WeakPolarHBondContact O-CB 3.45Å; L91-K94 PolarHBondContact O-N 3.46Å; H92-K94 VanDerWaalsContact C-N 3.32Å; H92-K94 PolarHBondContact O-N 3.48Å; K94-I97 PolarHBondContact O-N 2.85Å; K94-H98 WeakPolarHBondContact O-CB 3.41Å; K94-H98 PolarHBondContact O-N 3.49Å
95E85.5Confident82Confident102 Ų10294.3 Ų94.348%0.47747%0.469SS..Hα-helixtrans-63.4-43.4175.3-71.3173.3176.900111.3L91 H92 I97 H98 N99L91-E95 PolarHBondContact O-N 2.91Å; H92-E95 PolarHBondContact O-N 3.27Å; E95-I97 PolarHBondContact O-N 3.42Å; E95-H98 PolarHBondContact O-N 3.35Å; E95-N99 PolarHBondContact O-N 3.44Å; E95-N99 PolarHBondContact O-ND2 2.85Å
96E83.8Confident82.4Confident46 Ų4696.2 Ų96.222%0.21547%0.469CS..Hα-helixtrans-63-43177.9-160.9-168.1-167.300112H92 L93 H98 N99 R100H92-E96 PolarHBondContact O-N 3.22Å; L93-E96 PolarHBondContact O-N 2.96Å; E96-H98 VanDerWaalsContact C-N 3.35Å; E96-N99 PolarHBondContact O-N 3.32Å; E96-R100 WeakPolarHBondContact O-CG 3.29Å; E96-R100 PolarHBondContact O-N 2.89Å; E96-R100 IonicContact OE1-CZ 3.15Å; E96-R100 IonicContact OE1-NH1 3.38Å; E96-R100 PolarHBondContact OE1-NH1 3.09Å; E96-R100 IonicContact OE1-NH2 2.6Å; E96-R100 PolarHBondContact OE1-NH2 2.99Å; E96-R100 IonicContact OE2-CZ 3.53Å; E96-R100 IonicContact OE2-NH1 2.9Å; E96-R100 PolarHBondContact OE2-NH1 2.98Å; E96-R100 IonicContact OE2-NH2 3.53Å
97I83.2Confident82.6Confident89 Ų8993.6 Ų93.646%0.45646%0.456SS..Hα-helixtrans-61.8-43.7174.7-70.7166.7000110.8L93 K94 E95 R100 Q101L93-I97 VanDerWaalsContact O-CG1 3.27Å; L93-I97 WeakPolarHBondContact O-CG1 3.36Å; L93-I97 PolarHBondContact O-N 3.31Å; K94-I97 PolarHBondContact O-N 2.85Å; E95-I97 PolarHBondContact O-N 3.42Å; I97-R100 PolarHBondContact O-N 3.39Å; I97-Q101 WeakPolarHBondContact O-CG 3.34Å; I97-Q101 PolarHBondContact O-N 2.87Å
98H88.6Confident82.6Confident105 Ų10589 Ų8949%0.48644%0.442SS..Hα-helixtrans-62.7-44.4179.1-175.157.1000112K94 E95 E96 R100 Q101 I102K94-H98 WeakPolarHBondContact O-CB 3.41Å; K94-H98 PolarHBondContact O-N 3.49Å; E95-H98 PolarHBondContact O-N 3.35Å; E96-H98 VanDerWaalsContact C-N 3.35Å; H98-R100 VanDerWaalsContact C-N 3.33Å; H98-R100 PolarHBondContact O-N 3.11Å; H98-Q101 WeakPolarHBondContact O-CB 3.37Å; H98-Q101 PolarHBondContact O-N 3.36Å; H98-I102 WeakPolarHBondContact O-CG1 3.42Å; H98-I102 PolarHBondContact O-N 2.96Å; H98-I102 VanDerWaalsContact O-N 3.1Å
99N82.6Confident82.7Confident96 Ų9691.4 Ų91.451%0.51345%0.449SS..Hα-helixtrans-62.6-40.1176.6-70.5-22.8000112.1E95 E96 I102 A103E95-N99 PolarHBondContact O-N 3.44Å; E95-N99 PolarHBondContact O-ND2 2.85Å; E96-N99 PolarHBondContact O-N 3.32Å; N99-I102 PolarHBondContact O-N 3.43Å; N99-A103 PolarHBondContact O-N 3.41Å; N99-A103 VanDerWaalsContact O-N 3.12Å
100R81.5Confident82.5Confident97 Ų9787.4 Ų87.437%0.36643%0.433SS..Hα-helixtrans-63.8-39.6174.7-74.1177.1179.3136.5-4.6112.2E96 I97 H98 A103 I104E96-R100 WeakPolarHBondContact O-CG 3.29Å; E96-R100 PolarHBondContact O-N 2.89Å; E96-R100 IonicContact OE1-CZ 3.15Å; E96-R100 IonicContact OE1-NH1 3.38Å; E96-R100 PolarHBondContact OE1-NH1 3.09Å; E96-R100 IonicContact OE1-NH2 2.6Å; E96-R100 PolarHBondContact OE1-NH2 2.99Å; E96-R100 IonicContact OE2-CZ 3.53Å; E96-R100 IonicContact OE2-NH1 2.9Å; E96-R100 PolarHBondContact OE2-NH1 2.98Å; E96-R100 IonicContact OE2-NH2 3.53Å; I97-R100 PolarHBondContact O-N 3.39Å; H98-R100 VanDerWaalsContact C-N 3.33Å; H98-R100 PolarHBondContact O-N 3.11Å; R100-A103 PolarHBondContact O-N 2.79Å; R100-I104 WeakPolarHBondContact O-CG1 3.38Å; R100-I104 PolarHBondContact O-N 3.27Å
101Q82.1Confident82.5Confident106 Ų10687.3 Ų87.350%0.49543%0.43SS..Hα-helixtrans-61.2-45.8175.6-75.1174-19.600111.6I97 H98 A103 I104 D105I97-Q101 WeakPolarHBondContact O-CG 3.34Å; I97-Q101 PolarHBondContact O-N 2.87Å; H98-Q101 WeakPolarHBondContact O-CB 3.37Å; H98-Q101 PolarHBondContact O-N 3.36Å; Q101-A103 VanDerWaalsContact C-N 3.29Å; Q101-A103 PolarHBondContact O-N 3.46Å; Q101-I104 PolarHBondContact O-N 3.36Å; Q101-I104 VanDerWaalsContact O-N 3.17Å; Q101-D105 PolarHBondContact O-N 3.02Å
102I86.2Confident82.1Confident92 Ų9290.7 Ų90.747%0.47244%0.435SS..Hα-helixtrans-57.5-43.1175.9-65.8168.2000111.1H98 N99 D105 Y106H98-I102 WeakPolarHBondContact O-CG1 3.42Å; H98-I102 PolarHBondContact O-N 2.96Å; H98-I102 VanDerWaalsContact O-N 3.1Å; N99-I102 PolarHBondContact O-N 3.43Å; I102-D105 PolarHBondContact O-N 2.82Å; I102-Y106 PolarHBondContact O-N 2.93Å
103A79.2Confident81.7Confident50 Ų5091.2 Ų91.241%0.41343%0.432SS..Hα-helixtrans-64.9-40.7178.100000112.6N99 R100 Q101 Y106 L107N99-A103 PolarHBondContact O-N 3.41Å; N99-A103 VanDerWaalsContact O-N 3.12Å; R100-A103 PolarHBondContact O-N 2.79Å; Q101-A103 VanDerWaalsContact C-N 3.29Å; Q101-A103 PolarHBondContact O-N 3.46Å; A103-Y106 PolarHBondContact O-N 3.26Å; A103-L107 WeakPolarHBondContact O-CG 3.49Å; A103-L107 PolarHBondContact O-N 3.02Å
104I82.2Confident81.1Confident70 Ų7089.1 Ų89.136%0.35942%0.422SS..Hα-helixtrans-64.2-45.9176.2-70166.7000110.6R100 Q101 Y106 L107 M108R100-I104 WeakPolarHBondContact O-CG1 3.38Å; R100-I104 PolarHBondContact O-N 3.27Å; Q101-I104 PolarHBondContact O-N 3.36Å; Q101-I104 VanDerWaalsContact O-N 3.17Å; I104-Y106 VanDerWaalsContact C-N 3.29Å; I104-Y106 PolarHBondContact O-N 3.39Å; I104-L107 PolarHBondContact O-N 2.89Å; I104-M108 HydrophobicContact CG2-CG 4.24Å; I104-M108 WeakPolarHBondContact O-CB 3.36Å; I104-M108 WeakPolarHBondContact O-CG 3.39Å; I104-M108 PolarHBondContact O-N 3.37Å
105D81.5Confident80.4Confident106 Ų10685.1 Ų85.157%0.56741%0.406SS*.Hα-helixtrans-61.6-39.2179.2-73.5-21.6000111.8Q101 I102 M108 T109Q101-D105 PolarHBondContact O-N 3.02Å; I102-D105 PolarHBondContact O-N 2.82Å; D105-M108 PolarHBondContact O-N 3.02Å; D105-T109 WeakPolarHBondContact O-CB 3.32Å; D105-T109 PolarHBondContact O-N 2.91Å; D105-T109 PolarHBondContact O-OG1 3.4Å
106Y82.8Confident79.7Confident158 Ų15882.4 Ų82.462%0.6240%0.399SS*.Hα-helixtrans-62-49173.3179.5-100.8000111.9I102 A103 I104 M108 T109 V110I102-Y106 PolarHBondContact O-N 2.93Å; A103-Y106 PolarHBondContact O-N 3.26Å; I104-Y106 VanDerWaalsContact C-N 3.29Å; I104-Y106 PolarHBondContact O-N 3.39Å; Y106-M108 VanDerWaalsContact C-N 3.34Å; Y106-M108 PolarHBondContact O-N 3.49Å; Y106-T109 WeakPolarHBondContact O-CB 3.35Å; Y106-T109 PolarHBondContact O-N 3.44Å; Y106-V110 HydrophobicContact CD1-CG2 4.42Å; Y106-V110 HydrophobicContact CE1-CG2 4.01Å; Y106-V110 HydrophobicContact CE2-CG2 4.45Å; Y106-V110 WeakPolarHBondContact O-CG2 3.29Å; Y106-V110 PolarHBondContact O-N 2.95Å
107L79.2Confident78.9Confident20 Ų2081.2 Ų81.211%0.10539%0.393CS..Hα-helixtrans-62.2-40.7178-73.5171.3000112.1A103 I104 T109 V110 Y111 L147 L151 L169A103-L107 WeakPolarHBondContact O-CG 3.49Å; A103-L107 PolarHBondContact O-N 3.02Å; I104-L107 PolarHBondContact O-N 2.89Å; L107-T109 VanDerWaalsContact C-N 3.31Å; L107-T109 PolarHBondContact O-N 3.5Å; L107-V110 PolarHBondContact O-N 2.96Å; L107-Y111 VanDerWaalsContact O-CB 3.32Å; L107-Y111 WeakPolarHBondContact O-CB 3.45Å; L107-Y111 PolarHBondContact O-N 3.29Å; L107-L147 HydrophobicContact CD2-CD2 3.94Å; L107-L151 HydrophobicContact CB-CD2 3.92Å; L107-L151 HydrophobicContact CB-CG 4.5Å; L107-L151 HydrophobicContact CD1-CD2 3.64Å; L107-L151 HydrophobicContact CD1-CG 4.17Å; L107-L151 HydrophobicContact CG-CD2 4.42Å; L107-L169 HydrophobicContact CD2-CD1 4.11Å
108M79.3Confident77.8Confident69 Ų6978.5 Ų78.534%0.3438%0.383SS..Hα-helixtrans-64-37175.7-74.8-58.9-64.200112I104 D105 Y106 Y111 R112I104-M108 HydrophobicContact CG2-CG 4.24Å; I104-M108 WeakPolarHBondContact O-CB 3.36Å; I104-M108 WeakPolarHBondContact O-CG 3.39Å; I104-M108 PolarHBondContact O-N 3.37Å; D105-M108 PolarHBondContact O-N 3.02Å; Y106-M108 VanDerWaalsContact C-N 3.34Å; Y106-M108 PolarHBondContact O-N 3.49Å; M108-Y111 PolarHBondContact O-N 3.46Å; M108-R112 WeakPolarHBondContact O-CB 3.33Å; M108-R112 VanDerWaalsContact O-CG 3.28Å; M108-R112 WeakPolarHBondContact O-CG 3.34Å; M108-R112 PolarHBondContact O-N 2.9Å
109T80.4Confident76.6Confident92 Ų9279.8 Ų79.856%0.56439%0.389SS*.Hα-helixtrans-64.2-47.5174.3-59.10000111.1D105 Y106 L107 Y111 R112 R113D105-T109 WeakPolarHBondContact O-CB 3.32Å; D105-T109 PolarHBondContact O-N 2.91Å; D105-T109 PolarHBondContact O-OG1 3.4Å; Y106-T109 WeakPolarHBondContact O-CB 3.35Å; Y106-T109 PolarHBondContact O-N 3.44Å; L107-T109 VanDerWaalsContact C-N 3.31Å; L107-T109 PolarHBondContact O-N 3.5Å; T109-Y111 VanDerWaalsContact C-N 3.33Å; T109-Y111 PolarHBondContact O-N 3.38Å; T109-R112 PolarHBondContact O-N 2.8Å; T109-R113 WeakPolarHBondContact O-CB 3.36Å; T109-R113 PolarHBondContact O-N 3.03Å
110V77.2Confident75.7Confident39 Ų3979.3 Ų79.324%0.23638%0.383CS..Hα-helixtrans-60.1-44.6175.6172.70000110.9Y106 L107 R113 N114 L147Y106-V110 HydrophobicContact CD1-CG2 4.42Å; Y106-V110 HydrophobicContact CE1-CG2 4.01Å; Y106-V110 HydrophobicContact CE2-CG2 4.45Å; Y106-V110 WeakPolarHBondContact O-CG2 3.29Å; Y106-V110 PolarHBondContact O-N 2.95Å; L107-V110 PolarHBondContact O-N 2.96Å; V110-R113 PolarHBondContact O-N 3.4Å; V110-N114 VanDerWaalsContact O-CG 3.27Å; V110-N114 PolarHBondContact O-N 2.92Å; V110-N114 PolarHBondContact O-ND2 3.19Å; V110-L147 HydrophobicContact CG1-CD1 4.08Å; V110-L147 HydrophobicContact CG1-CD2 4.15Å
111Y76.9Confident74.5Confident46 Ų4676.3 Ų76.318%0.1837%0.374CS..Hα-helixtrans-61.9-48178.8-177.4-104.5000112.2L23 L107 M108 T109 R113 N114 I115L23-Y111 WeakPolarHBondContact CD2-OH 3.3Å; L107-Y111 VanDerWaalsContact O-CB 3.32Å; L107-Y111 WeakPolarHBondContact O-CB 3.45Å; L107-Y111 PolarHBondContact O-N 3.29Å; M108-Y111 PolarHBondContact O-N 3.46Å; T109-Y111 VanDerWaalsContact C-N 3.33Å; T109-Y111 PolarHBondContact O-N 3.38Å; Y111-R113 VanDerWaalsContact C-N 3.33Å; Y111-R113 PolarHBondContact O-N 3.04Å; Y111-N114 PolarHBondContact O-N 3.45Å; Y111-I115 HydrophobicContact CD1-CD1 3.8Å; Y111-I115 HydrophobicContact CE1-CD1 3.24Å; Y111-I115 HydrophobicContact CE1-CG1 4.24Å; Y111-I115 HydrophobicContact CE2-CD1 4.41Å; Y111-I115 PolarHBondContact O-N 2.83Å
112R78Confident73Confident174 Ų17476.7 Ų76.766%0.65737%0.374SS*.Hα-helixtrans-60.4-41.7176.2-74.6177.4-176-165.53.5112M108 T109 I115 S116M108-R112 WeakPolarHBondContact O-CB 3.33Å; M108-R112 VanDerWaalsContact O-CG 3.28Å; M108-R112 WeakPolarHBondContact O-CG 3.34Å; M108-R112 PolarHBondContact O-N 2.9Å; T109-R112 PolarHBondContact O-N 2.8Å; R112-I115 PolarHBondContact O-N 3.19Å; R112-S116 PolarHBondContact O-N 2.99Å
113R75.5Confident71.1Confident132 Ų13274.4 Ų74.450%0.49837%0.373SS..Hα-helixtrans-61-45.3175.4-171.2178.4-172.4179.62.1111.4T109 V110 Y111 I115 S116 I117T109-R113 WeakPolarHBondContact O-CB 3.36Å; T109-R113 PolarHBondContact O-N 3.03Å; V110-R113 PolarHBondContact O-N 3.4Å; Y111-R113 VanDerWaalsContact C-N 3.33Å; Y111-R113 PolarHBondContact O-N 3.04Å; R113-I115 VanDerWaalsContact C-N 3.33Å; R113-I115 PolarHBondContact O-N 3.43Å; R113-S116 WeakPolarHBondContact O-CB 3.45Å; R113-S116 PolarHBondContact O-N 3.38Å; R113-I117 HydrophobicContact CG-CD1 3.94Å; R113-I117 WeakPolarHBondContact O-CG1 3.44Å; R113-I117 PolarHBondContact O-N 3.3Å
114N71.7Confident69.7Low37 Ų3778.1 Ų78.120%0.19838%0.382CS..Hα-helixtrans-64.5-36.7178.3-71.1-27.1000112.6V110 Y111 S118 L143 L147V110-N114 VanDerWaalsContact O-CG 3.27Å; V110-N114 PolarHBondContact O-N 2.92Å; V110-N114 PolarHBondContact O-ND2 3.19Å; Y111-N114 PolarHBondContact O-N 3.45Å; N114-S118 VanDerWaalsContact O-CB 3.32Å; N114-S118 WeakPolarHBondContact O-CB 3.37Å; N114-S118 PolarHBondContact O-N 3.43Å; N114-S118 PolarHBondContact O-OG 2.82Å; N114-L143 VanDerWaalsContact ND2-CD2 3.27Å; N114-L143 WeakPolarHBondContact ND2-CD2 3.46Å; N114-L147 VanDerWaalsContact ND2-CD1 3.29Å; N114-L147 WeakPolarHBondContact ND2-CD1 3.46Å
115I71.3Confident67.8Low62 Ų6279 Ų7932%0.31839%0.385SS..Hα-helixtrans-62.2-48.8171.3-71.9175.8000110.5Y111 R112 R113 I117 S118 Q119Y111-I115 HydrophobicContact CD1-CD1 3.8Å; Y111-I115 HydrophobicContact CE1-CD1 3.24Å; Y111-I115 HydrophobicContact CE1-CG1 4.24Å; Y111-I115 HydrophobicContact CE2-CD1 4.41Å; Y111-I115 PolarHBondContact O-N 2.83Å; R112-I115 PolarHBondContact O-N 3.19Å; R113-I115 VanDerWaalsContact C-N 3.33Å; R113-I115 PolarHBondContact O-N 3.43Å; I115-I117 PolarHBondContact O-N 3.16Å; I115-S118 PolarHBondContact O-N 3.41Å; I115-Q119 HydrophobicContact CG2-CG 4.24Å; I115-Q119 WeakPolarHBondContact O-CB 3.44Å; I115-Q119 WeakPolarHBondContact O-CG 3.41Å; I115-Q119 PolarHBondContact O-N 3.49Å
116S70.2Confident66.1Low45 Ų4578.3 Ų78.332%0.31539%0.393SS..Hα-helixtrans-58-48.8180-170.20000111.8R112 R113 S118 Q119 Q120R112-S116 PolarHBondContact O-N 2.99Å; R113-S116 WeakPolarHBondContact O-CB 3.45Å; R113-S116 PolarHBondContact O-N 3.38Å; S116-S118 VanDerWaalsContact C-N 3.32Å; S116-S118 PolarHBondContact O-N 3.3Å; S116-Q119 PolarHBondContact O-N 3.05Å; S116-Q120 WeakPolarHBondContact O-CG 3.45Å; S116-Q120 PolarHBondContact O-N 2.97Å
117I66.7Low64.4Low20 Ų2075.5 Ų75.510%0.10340%0.397CS..Hα-helixtrans-59.9-43.7176.7-67.3167.9000110.6R113 I115 Q119 Q120 Q121R113-I117 HydrophobicContact CG-CD1 3.94Å; R113-I117 WeakPolarHBondContact O-CG1 3.44Å; R113-I117 PolarHBondContact O-N 3.3Å; I115-I117 PolarHBondContact O-N 3.16Å; I117-Q119 PolarHBondContact O-N 3.22Å; I117-Q120 PolarHBondContact O-N 2.95Å; I117-Q121 HydrophobicContact CG2-CG 4.44Å; I117-Q121 WeakPolarHBondContact O-CB 3.4Å; I117-Q121 VanDerWaalsContact O-CG 3.3Å; I117-Q121 WeakPolarHBondContact O-CG 3.24Å; I117-Q121 PolarHBondContact O-N 3.34Å
118S61.2Low62.6Low33 Ų3381.2 Ų81.223%0.23142%0.423CS..Hα-helixtrans-63-43.2178.4-58.70000111.1N114 I115 S116 Q121 F122N114-S118 VanDerWaalsContact O-CB 3.32Å; N114-S118 WeakPolarHBondContact O-CB 3.37Å; N114-S118 PolarHBondContact O-N 3.43Å; N114-S118 PolarHBondContact O-OG 2.82Å; I115-S118 PolarHBondContact O-N 3.41Å; S116-S118 VanDerWaalsContact C-N 3.32Å; S116-S118 PolarHBondContact O-N 3.3Å; S118-Q121 PolarHBondContact O-N 3.31Å; S118-F122 WeakPolarHBondContact O-CB 3.46Å; S118-F122 VanDerWaalsContact O-CD2 3.3Å; S118-F122 WeakPolarHBondContact O-CD2 3.45Å; S118-F122 PolarHBondContact O-N 3.35Å
119Q62.9Low60.6Low131 Ų13183.1 Ų83.161%0.61244%0.441SS*.Hα-helixtrans-64.6-41.4177.6-73.7176.7-12.300112.5I115 S116 I117 F122 G123I115-Q119 HydrophobicContact CG2-CG 4.24Å; I115-Q119 WeakPolarHBondContact O-CB 3.44Å; I115-Q119 WeakPolarHBondContact O-CG 3.41Å; I115-Q119 PolarHBondContact O-N 3.49Å; S116-Q119 PolarHBondContact O-N 3.05Å; I117-Q119 PolarHBondContact O-N 3.22Å; Q119-F122 PolarHBondContact O-N 2.9Å; Q119-G123 PolarHBondContact O-N 3.35Å
120Q63.6Low58.9Low86 Ų8683.7 Ų83.740%0.40244%0.444SS..Hα-helixtrans-63.1-44.5174.2-75.3176.1-700111.8S116 I117 F122 G123 Q124 E190S116-Q120 WeakPolarHBondContact O-CG 3.45Å; S116-Q120 PolarHBondContact O-N 2.97Å; I117-Q120 PolarHBondContact O-N 2.95Å; Q120-F122 VanDerWaalsContact C-N 3.32Å; Q120-F122 PolarHBondContact O-N 3.21Å; Q120-G123 PolarHBondContact O-N 3.43Å; Q120-Q124 WeakPolarHBondContact O-CB 3.45Å; Q120-Q124 WeakPolarHBondContact O-CG 3.34Å; Q120-Q124 PolarHBondContact O-N 3.47Å; Q120-E190 PolarHBondContact NE2-OE1 3.43Å
121Q55.7Low57.1Low35 Ų3591.1 Ų91.116%0.16448%0.476CS..Hα-helixtrans-62.9-38.4176.7-73.5177.7-3.400112I117 S118 Q125I117-Q121 HydrophobicContact CG2-CG 4.44Å; I117-Q121 WeakPolarHBondContact O-CB 3.4Å; I117-Q121 VanDerWaalsContact O-CG 3.3Å; I117-Q121 WeakPolarHBondContact O-CG 3.24Å; I117-Q121 PolarHBondContact O-N 3.34Å; S118-Q121 PolarHBondContact O-N 3.31Å; Q121-Q125 WeakPolarHBondContact O-CB 3.32Å; Q121-Q125 VanDerWaalsContact O-CG 3.23Å; Q121-Q125 WeakPolarHBondContact O-CG 3.36Å; Q121-Q125 PolarHBondContact O-N 2.95Å; Q121-Q125 VanDerWaalsContact O-N 3.08Å
122F50.6Low55.4Low114 Ų11497.5 Ų97.550%0.550%0.504SS..Hα-helixtrans-67.4-41.2173-93.9-76.5000112.4S118 Q119 Q120 Q125 A126S118-F122 WeakPolarHBondContact O-CB 3.46Å; S118-F122 VanDerWaalsContact O-CD2 3.3Å; S118-F122 WeakPolarHBondContact O-CD2 3.45Å; S118-F122 PolarHBondContact O-N 3.35Å; Q119-F122 PolarHBondContact O-N 2.9Å; Q120-F122 VanDerWaalsContact C-N 3.32Å; Q120-F122 PolarHBondContact O-N 3.21Å; F122-Q125 PolarHBondContact O-N 3.48Å; F122-A126 PolarHBondContact O-N 2.93Å
123G47.5Very low54.2Low44 Ų4491.1 Ų91.145%0.45449%0.486SS..Hα-helixtrans-66.2-37.1177.300000113.5Q119 Q120Q119-G123 PolarHBondContact O-N 3.35Å; Q120-G123 PolarHBondContact O-N 3.43Å
124Q48.4Very low53.1Low127 Ų12788.7 Ų88.759%0.59349%0.489SS*.Hα-helixtrans-70.8-38.1174.6-74.5179.2-5.600112Q120 A126 S127Q120-Q124 WeakPolarHBondContact O-CB 3.45Å; Q120-Q124 WeakPolarHBondContact O-CG 3.34Å; Q120-Q124 PolarHBondContact O-N 3.47Å; Q124-A126 VanDerWaalsContact C-N 3.27Å; Q124-A126 PolarHBondContact O-N 3.45Å; Q124-S127 PolarHBondContact O-N 3Å; Q124-S127 VanDerWaalsContact O-N 3.16Å
125Q42.4Very low51.7Low90 Ų9093.6 Ų93.642%0.42151%0.51SS..Hα-helixtrans-69.6-20.5177.4-75.517326.200114Q121 F122 S127Q121-Q125 WeakPolarHBondContact O-CB 3.32Å; Q121-Q125 VanDerWaalsContact O-CG 3.23Å; Q121-Q125 WeakPolarHBondContact O-CG 3.36Å; Q121-Q125 PolarHBondContact O-N 2.95Å; Q121-Q125 VanDerWaalsContact O-N 3.08Å; F122-Q125 PolarHBondContact O-N 3.48Å; Q125-S127 PolarHBondContact O-N 2.96Å
126A47Very low50.4Low90 Ų9091.7 Ų91.774%0.74450%0.501SS*.THydrogen-bonded Turntrans-71.1-13.2173.100000113.3F122 Q124F122-A126 PolarHBondContact O-N 2.93Å; Q124-A126 VanDerWaalsContact C-N 3.27Å; Q124-A126 PolarHBondContact O-N 3.45Å
127S47.8Very low49.5Very low100 Ų10092.3 Ų92.370%0.69951%0.505SS*.THydrogen-bonded Turntrans-106.1-13-173.3-52.60000114.2Q124 Q125Q124-S127 PolarHBondContact O-N 3Å; Q124-S127 VanDerWaalsContact O-N 3.16Å; Q125-S127 PolarHBondContact O-N 2.96Å
128E40.3Very low48.7Very low139 Ų13998.2 Ų98.265%0.6553%0.53SS*.  trans-138.3127.8-179.1-70.6-169.3160.600112.3V130E128-V130 HydrophobicContact CB-CG2 4.4Å; E128-V130 PolarHBondContact O-N 3.1Å
129P38.1Very low47.9Very low110 Ų11097.3 Ų97.371%0.71452%0.524SS*.  trans-81.384.7176.434.2-29.9000108.4
130V43.1Very low47.5Very low104 Ų10492.5 Ų92.563%0.6350%0.504SS*.  trans-125.2112.9172-173.20000109.6E128 K132E128-V130 HydrophobicContact CB-CG2 4.4Å; E128-V130 PolarHBondContact O-N 3.1Å; V130-K132 VanDerWaalsContact C-N 3.28Å; V130-K132 PolarHBondContact O-N 3.39Å
131E40.1Very low47.1Very low194 Ų19491 Ų9191%0.90750%0.503SS*.  trans-56.582.8169.4-69.1-178.4137.900111.2
132K42.4Very low47.2Very low181 Ų18191.2 Ų91.279%0.78751%0.511SS*.  trans-179.4100159.6-107.2163.4-177.6177.80110.7V130V130-K132 VanDerWaalsContact C-N 3.28Å; V130-K132 PolarHBondContact O-N 3.39Å
133P50.9Low47.9Very low40 Ų4086.4 Ų86.426%0.2649%0.49SS..  trans-153.930.4133.231.5-8.1000114.4Q135 L136 S137P133-Q135 PolarHBondContact O-N 3.34Å; P133-L136 HydrophobicContact CB-CB 4.38Å; P133-L136 PolarHBondContact O-N 3.17Å; P133-S137 PolarHBondContact O-N 2.97Å
134S54Low48.6Very low81 Ų8185.2 Ų85.257%0.56648%0.478SS*.Hα-helixtrans-61.5-20-177.772.70000114.2K138S134-K138 WeakPolarHBondContact O-CB 3.41Å; S134-K138 WeakPolarHBondContact O-CD 3.4Å; S134-K138 WeakPolarHBondContact O-CE 3.47Å; S134-K138 WeakPolarHBondContact O-CG 3.35Å
135Q41.4Very low49.2Very low139 Ų13982.1 Ų82.165%0.6547%0.47SS*.Hα-helixtrans-92.8-33.5176.2-64.8-164.51.500113.6P133 C139P133-Q135 PolarHBondContact O-N 3.34Å; Q135-C139 VanDerWaalsContact O-CB 3.29Å; Q135-C139 WeakPolarHBondContact O-CB 3.27Å; Q135-C139 PolarHBondContact O-N 3.02Å
136L45.2Very low50.3Low22 Ų2279.1 Ų79.112%0.11546%0.458CS..Hα-helixtrans-69.6-45.2175.6-90.3168.1000111P133 K138 C139 C140 L183 L185P133-L136 HydrophobicContact CB-CB 4.38Å; P133-L136 PolarHBondContact O-N 3.17Å; L136-K138 VanDerWaalsContact C-N 3.32Å; L136-K138 PolarHBondContact O-N 3.31Å; L136-C139 WeakPolarHBondContact O-CB 3.49Å; L136-C139 PolarHBondContact O-N 3.28Å; L136-C140 PolarHBondContact O-N 2.6Å; L136-C140 PolarHBondContact O-SG 2.67Å; L136-L183 HydrophobicContact CD1-CD1 3.46Å; L136-L183 VanDerWaalsContact CD1-CD1 3.46Å; L136-L183 HydrophobicContact CD2-CD1 3.85Å; L136-L183 HydrophobicContact CG-CD1 3.41Å; L136-L183 VanDerWaalsContact CG-CD1 3.41Å; L136-L185 HydrophobicContact CD1-CD1 3.93Å
137S49.8Very low51.2Low59 Ų5975 Ų7541%0.41342%0.424SS..Hα-helixtrans-59-45.6175.1123.50000110.6P133 C139 C140 S141P133-S137 PolarHBondContact O-N 2.97Å; S137-C139 VanDerWaalsContact C-N 3.3Å; S137-C139 PolarHBondContact O-N 3.12Å; S137-C140 PolarHBondContact O-N 3.38Å; S137-S141 WeakPolarHBondContact O-CB 3.42Å; S137-S141 PolarHBondContact O-N 3.43Å; S137-S141 PolarHBondContact O-OG 2.94Å; S137-S141 VanDerWaalsContact O-OG 3.1Å
138K50.6Low52.1Low144 Ų14473.1 Ų73.163%0.62641%0.405SS*.Hα-helixtrans-60.5-37.4174-75.6176.9-169.5179.70112.8S134 L136 A142S134-K138 WeakPolarHBondContact O-CB 3.41Å; S134-K138 WeakPolarHBondContact O-CD 3.4Å; S134-K138 WeakPolarHBondContact O-CE 3.47Å; S134-K138 WeakPolarHBondContact O-CG 3.35Å; L136-K138 VanDerWaalsContact C-N 3.32Å; L136-K138 PolarHBondContact O-N 3.31Å; K138-A142 WeakPolarHBondContact O-CB 3.36Å; K138-A142 PolarHBondContact O-N 3.04Å
139C45Very low53.3Low14 Ų1470.4 Ų70.410%0.09540%0.396CS..Hα-helixtrans-70-42.1178.6-165.60000111.6Q135 L136 S137 A142 L143 N176 L179Q135-C139 VanDerWaalsContact O-CB 3.29Å; Q135-C139 WeakPolarHBondContact O-CB 3.27Å; Q135-C139 PolarHBondContact O-N 3.02Å; L136-C139 WeakPolarHBondContact O-CB 3.49Å; L136-C139 PolarHBondContact O-N 3.28Å; S137-C139 VanDerWaalsContact C-N 3.3Å; S137-C139 PolarHBondContact O-N 3.12Å; C139-A142 PolarHBondContact O-N 3.37Å; C139-L143 WeakPolarHBondContact O-CB 3.37Å; C139-L143 PolarHBondContact O-N 3.23Å; C139-N176 PolarHBondContact SG-ND2 3.33Å; C139-N176 VanDerWaalsContact SG-ND2 3.35Å; C139-L179 HydrophobicContact CB-CD1 4.23Å
140C53.6Low54.5Low29 Ų2965.3 Ų65.320%0.19636%0.362CS..Hα-helixtrans-67-43.7176.6-64.70000111.8L136 S137 A142 L143 G144L136-C140 PolarHBondContact O-N 2.6Å; L136-C140 PolarHBondContact O-SG 2.67Å; S137-C140 PolarHBondContact O-N 3.38Å; C140-A142 VanDerWaalsContact C-N 3.34Å; C140-A142 PolarHBondContact O-N 2.9Å; C140-L143 PolarHBondContact O-N 2.88Å; C140-G144 PolarHBondContact O-N 3.09Å
141S56.1Low55.5Low55 Ų5561.5 Ų61.539%0.38534%0.338SS..Hα-helixtrans-64-38.9174.2-57.80000111.9S137 S145S137-S141 WeakPolarHBondContact O-CB 3.42Å; S137-S141 PolarHBondContact O-N 3.43Å; S137-S141 PolarHBondContact O-OG 2.94Å; S137-S141 VanDerWaalsContact O-OG 3.1Å; S141-S145 WeakPolarHBondContact O-CB 3.39Å; S141-S145 PolarHBondContact O-N 3.43Å
142A56.9Low56.5Low39 Ų3955.9 Ų55.932%0.32231%0.314SS..Hα-helixtrans-65-44.8174.600000111.7K138 C139 C140 S145 T146 M172K138-A142 WeakPolarHBondContact O-CB 3.36Å; K138-A142 PolarHBondContact O-N 3.04Å; C139-A142 PolarHBondContact O-N 3.37Å; C140-A142 VanDerWaalsContact C-N 3.34Å; C140-A142 PolarHBondContact O-N 2.9Å; A142-S145 PolarHBondContact O-N 3.42Å; A142-T146 WeakPolarHBondContact O-CB 3.28Å; A142-T146 PolarHBondContact O-N 3.04Å; A142-T146 PolarHBondContact O-OG1 3.09Å; A142-M172 HydrophobicContact CB-CE 3.8Å
143L64.6Low57.3Low13 Ų1348.6 Ų48.67%0.06829%0.285CS..Hα-helixtrans-62-44.1176.9-169.180.4000111.4N114 C139 C140 T146 L147 M172N114-L143 VanDerWaalsContact ND2-CD2 3.27Å; N114-L143 WeakPolarHBondContact ND2-CD2 3.46Å; C139-L143 WeakPolarHBondContact O-CB 3.37Å; C139-L143 PolarHBondContact O-N 3.23Å; C140-L143 PolarHBondContact O-N 2.88Å; L143-T146 PolarHBondContact O-N 2.96Å; L143-L147 HydrophobicContact CG-CD1 4.26Å; L143-L147 WeakPolarHBondContact O-CB 3.46Å; L143-L147 WeakPolarHBondContact O-CG 3.43Å; L143-L147 PolarHBondContact O-N 2.87Å; L143-M172 HydrophobicContact CD1-CB 3.93Å
144G64Low57.7Low19 Ų1948.9 Ų48.920%0.19629%0.288CS..Hα-helixtrans-62.6-43.9176.100000112.5C140 L147 L148C140-G144 PolarHBondContact O-N 3.09Å; G144-L147 PolarHBondContact O-N 3.44Å; G144-L148 WeakPolarHBondContact O-CB 3.41Å; G144-L148 WeakPolarHBondContact O-CG 3.46Å; G144-L148 PolarHBondContact O-N 3.21Å
145S60.5Low58.1Low62 Ų6249.8 Ų49.843%0.43429%0.285SS..Hα-helixtrans-64.1-41174.7-175.70000112.2S141 A142 L148 N149S141-S145 WeakPolarHBondContact O-CB 3.39Å; S141-S145 PolarHBondContact O-N 3.43Å; A142-S145 PolarHBondContact O-N 3.42Å; S145-L148 PolarHBondContact O-N 3.24Å; S145-N149 WeakPolarHBondContact O-CB 3.4Å; S145-N149 VanDerWaalsContact O-CG 3.22Å; S145-N149 PolarHBondContact O-N 3.49Å; S145-N149 PolarHBondContact O-ND2 3.2Å
146T66Low58.7Low27 Ų2750.7 Ų50.717%0.16629%0.29CS..Hα-helixtrans-65.4-42.1176.7-600000111.2A142 L143 N149 S150 L169 M172A142-T146 WeakPolarHBondContact O-CB 3.28Å; A142-T146 PolarHBondContact O-N 3.04Å; A142-T146 PolarHBondContact O-OG1 3.09Å; L143-T146 PolarHBondContact O-N 2.96Å; T146-N149 PolarHBondContact O-N 3.43Å; T146-S150 WeakPolarHBondContact O-CB 3.45Å; T146-S150 PolarHBondContact O-N 3.39Å; T146-S150 PolarHBondContact O-OG 3.48Å; T146-L169 HydrophobicContact CG2-CD2 4.03Å; T146-L169 HydrophobicContact CG2-CG 4.31Å; T146-M172 HydrophobicContact CG2-CG 4.49Å
147L65.9Low59Low4 Ų453.1 Ų53.12%0.02131%0.305CS..Hα-helixtrans-61.6-44.7175-79.4163.8000112L107 V110 N114 L143 G144 S150 L151 L169L107-L147 HydrophobicContact CD2-CD2 3.94Å; V110-L147 HydrophobicContact CG1-CD1 4.08Å; V110-L147 HydrophobicContact CG1-CD2 4.15Å; N114-L147 VanDerWaalsContact ND2-CD1 3.29Å; N114-L147 WeakPolarHBondContact ND2-CD1 3.46Å; L143-L147 HydrophobicContact CG-CD1 4.26Å; L143-L147 WeakPolarHBondContact O-CB 3.46Å; L143-L147 WeakPolarHBondContact O-CG 3.43Å; L143-L147 PolarHBondContact O-N 2.87Å; G144-L147 PolarHBondContact O-N 3.44Å; L147-S150 PolarHBondContact O-N 2.97Å; L147-L151 WeakPolarHBondContact O-CB 3.36Å; L147-L151 WeakPolarHBondContact O-CG 3.47Å; L147-L151 PolarHBondContact O-N 2.94Å; L147-L169 HydrophobicContact CD2-CD1 4.38Å; L147-L169 HydrophobicContact CD2-CD2 3.4Å; L147-L169 VanDerWaalsContact CD2-CD2 3.4Å; L147-L169 HydrophobicContact CG-CD2 3.69Å
148L66.2Low58.9Low60 Ų6051.4 Ų51.431%0.31430%0.297SS..Hα-helixtrans-63.2-43.2176.4-78.7167.5000112G144 S145 L151 N152G144-L148 WeakPolarHBondContact O-CB 3.41Å; G144-L148 WeakPolarHBondContact O-CG 3.46Å; G144-L148 PolarHBondContact O-N 3.21Å; S145-L148 PolarHBondContact O-N 3.24Å; L148-L151 PolarHBondContact O-N 3Å; L148-N152 WeakPolarHBondContact O-CB 3.48Å; L148-N152 VanDerWaalsContact O-CG 3.3Å; L148-N152 PolarHBondContact O-N 3.49Å; L148-N152 PolarHBondContact O-ND2 3.27Å
149N65.3Low59Low83 Ų8350.9 Ų50.944%0.44430%0.296SS..Hα-helixtrans-63.1-43.6175.1-72.1-12.5000111.2S145 T146 L151 N152 V153S145-N149 WeakPolarHBondContact O-CB 3.4Å; S145-N149 VanDerWaalsContact O-CG 3.22Å; S145-N149 PolarHBondContact O-N 3.49Å; S145-N149 PolarHBondContact O-ND2 3.2Å; T146-N149 PolarHBondContact O-N 3.43Å; N149-L151 VanDerWaalsContact C-N 3.33Å; N149-L151 PolarHBondContact O-N 3.26Å; N149-N152 PolarHBondContact O-N 3.04Å; N149-V153 WeakPolarHBondContact O-CB 3.33Å; N149-V153 VanDerWaalsContact O-CG2 3.29Å; N149-V153 WeakPolarHBondContact O-CG2 3.33Å; N149-V153 PolarHBondContact O-N 3.41Å
150S62.4Low59.5Low2 Ų259.7 Ų59.71%0.01433%0.333CS..Hα-helixtrans-61.2-42.2176.7-58.20000111.5T146 L147 V153 C154 L169T146-S150 WeakPolarHBondContact O-CB 3.45Å; T146-S150 PolarHBondContact O-N 3.39Å; T146-S150 PolarHBondContact O-OG 3.48Å; L147-S150 PolarHBondContact O-N 2.97Å; S150-V153 PolarHBondContact O-N 3.45Å; S150-C154 VanDerWaalsContact O-CB 3.32Å; S150-C154 WeakPolarHBondContact O-CB 3.5Å; S150-C154 PolarHBondContact O-N 3.29Å; S150-C154 PolarHBondContact O-SG 3.4Å; S150-L169 WeakPolarHBondContact OG-CD1 3.5Å
151L64.4Low59.4Low25 Ų2562.9 Ų62.913%0.13135%0.345CS..Hα-helixtrans-63-46.6174.9-79.8163.9000111.7L107 L147 L148 N149 V153 C154 L155L107-L151 HydrophobicContact CB-CD2 3.92Å; L107-L151 HydrophobicContact CB-CG 4.5Å; L107-L151 HydrophobicContact CD1-CD2 3.64Å; L107-L151 HydrophobicContact CD1-CG 4.17Å; L107-L151 HydrophobicContact CG-CD2 4.42Å; L147-L151 WeakPolarHBondContact O-CB 3.36Å; L147-L151 WeakPolarHBondContact O-CG 3.47Å; L147-L151 PolarHBondContact O-N 2.94Å; L148-L151 PolarHBondContact O-N 3Å; N149-L151 VanDerWaalsContact C-N 3.33Å; N149-L151 PolarHBondContact O-N 3.26Å; L151-V153 VanDerWaalsContact C-N 3.35Å; L151-V153 PolarHBondContact O-N 3.28Å; L151-C154 PolarHBondContact O-N 3.12Å; L151-L155 VanDerWaalsContact O-CG 3.27Å; L151-L155 WeakPolarHBondContact O-CG 3.22Å; L151-L155 PolarHBondContact O-N 3.34Å
152N61.5Low59.3Low75 Ų7562.2 Ų62.240%0.40134%0.34SS..Hα-helixtrans-61.1-43.1177.7-73.5-24.9000111.7L148 N149 L155 E156L148-N152 WeakPolarHBondContact O-CB 3.48Å; L148-N152 VanDerWaalsContact O-CG 3.3Å; L148-N152 PolarHBondContact O-N 3.49Å; L148-N152 PolarHBondContact O-ND2 3.27Å; N149-N152 PolarHBondContact O-N 3.04Å; N152-L155 PolarHBondContact O-N 3.05Å; N152-E156 WeakPolarHBondContact O-CB 3.22Å; N152-E156 WeakPolarHBondContact O-CG 3.32Å; N152-E156 PolarHBondContact O-N 2.83Å
153V58.1Low59.5Low28 Ų2865.5 Ų65.517%0.1735%0.352CS..Hα-helixtrans-67.2-40.4177.5171.80000111.6N149 S150 L151 L155 E156 V157 Q161 E165N149-V153 WeakPolarHBondContact O-CB 3.33Å; N149-V153 VanDerWaalsContact O-CG2 3.29Å; N149-V153 WeakPolarHBondContact O-CG2 3.33Å; N149-V153 PolarHBondContact O-N 3.41Å; S150-V153 PolarHBondContact O-N 3.45Å; L151-V153 VanDerWaalsContact C-N 3.35Å; L151-V153 PolarHBondContact O-N 3.28Å; V153-L155 PolarHBondContact O-N 3.39Å; V153-E156 PolarHBondContact O-N 2.92Å; V153-V157 HydrophobicContact CG1-CG2 4.49Å; V153-V157 PolarHBondContact O-N 3.21Å; V153-Q161 HydrophobicContact CG1-CB 3.56Å; V153-E165 HydrophobicContact CG1-CG 4.44Å
154C60.5Low59.5Low47 Ų4767.3 Ų67.332%0.31837%0.369SS..Hα-helixtrans-60.8-35173.4-77.60000112.3S150 L151S150-C154 VanDerWaalsContact O-CB 3.32Å; S150-C154 WeakPolarHBondContact O-CB 3.5Å; S150-C154 PolarHBondContact O-N 3.29Å; S150-C154 PolarHBondContact O-SG 3.4Å; L151-C154 PolarHBondContact O-N 3.12Å
155L61.1Low59.4Low99 Ų9968.7 Ų68.752%0.51837%0.37SS..Hα-helixtrans-77.2-36.2176.2-69.7170.8000112.7L151 N152 V153L151-L155 VanDerWaalsContact O-CG 3.27Å; L151-L155 WeakPolarHBondContact O-CG 3.22Å; L151-L155 PolarHBondContact O-N 3.34Å; N152-L155 PolarHBondContact O-N 3.05Å; V153-L155 PolarHBondContact O-N 3.39Å
156E55.9Low59.6Low159 Ų15969.7 Ų69.774%0.74337%0.37SS*.Hα-helixtrans-84.8-35.7-174.4-77.3-178.1172.900114.2N152 V153N152-E156 WeakPolarHBondContact O-CB 3.22Å; N152-E156 WeakPolarHBondContact O-CG 3.32Å; N152-E156 PolarHBondContact O-N 2.83Å; V153-E156 PolarHBondContact O-N 2.92Å
157V49.9Very low59.9Low73 Ų7373.9 Ų73.944%0.44239%0.388SS..Hα-helixtrans-127.9-6.3-157.5-154.50000115.5V153 Q161V153-V157 HydrophobicContact CG1-CG2 4.49Å; V153-V157 PolarHBondContact O-N 3.21Å; V157-Q161 HydrophobicContact CG1-CG 4.34Å
158G49Very low60Low22 Ų2277.6 Ų77.623%0.22741%0.408CS..  trans65175.8-179.400000114.1K160 Q161G158-K160 PolarHBondContact O-N 3.48Å; G158-Q161 PolarHBondContact O-N 3.48Å
159E51.9Low60.1Low133 Ų13375.9 Ų75.962%0.62140%0.399SS*.Hα-helixtrans-41-35-159.9-81.9-174.7145.500117.7Q161 S162E159-Q161 VanDerWaalsContact C-N 3.35Å; E159-Q161 PolarHBondContact O-N 2.95Å; E159-S162 PolarHBondContact O-N 3.45Å; E159-S162 VanDerWaalsContact O-N 3.16Å; E159-S162 PolarHBondContact O-OG 2.84Å
160K56.2Low60.5Low199 Ų19977.4 Ų77.487%0.86540%0.403SS*.Hα-helixtrans-67-28.1-168.2-71.4-174178.6178.80114.8G158G158-K160 PolarHBondContact O-N 3.48Å
161Q51.6Low61Low97 Ų9782.9 Ų82.945%0.45343%0.429SS..Hα-helixtrans-95.8-16.1174.7-74.1-178.3-6.900113V153 V157 G158 E159 L163 A164 E165V153-Q161 HydrophobicContact CG1-CB 3.56Å; V157-Q161 HydrophobicContact CG1-CG 4.34Å; G158-Q161 PolarHBondContact O-N 3.48Å; E159-Q161 VanDerWaalsContact C-N 3.35Å; E159-Q161 PolarHBondContact O-N 2.95Å; Q161-L163 VanDerWaalsContact C-N 3.26Å; Q161-L163 PolarHBondContact O-N 3.29Å; Q161-A164 PolarHBondContact O-N 3.23Å; Q161-E165 PolarHBondContact O-N 2.97Å
162S52.9Low61.3Low40 Ų4083.2 Ų83.228%0.2843%0.43SS..Hα-helixtrans-65.3-28.8179.482.30000113E159 E165 L166E159-S162 PolarHBondContact O-N 3.45Å; E159-S162 VanDerWaalsContact O-N 3.16Å; E159-S162 PolarHBondContact O-OG 2.84Å; S162-E165 PolarHBondContact O-N 3.49Å; S162-L166 VanDerWaalsContact O-CB 3.24Å; S162-L166 WeakPolarHBondContact O-CB 3.29Å; S162-L166 PolarHBondContact O-N 2.78Å
163L60.9Low61.8Low109 Ų10986 Ų8657%0.57144%0.436SS*.Hα-helixtrans-68.7-41.4-179.3-161.289.1000112.2Q161 L166 Q167Q161-L163 VanDerWaalsContact C-N 3.26Å; Q161-L163 PolarHBondContact O-N 3.29Å; L163-L166 PolarHBondContact O-N 2.84Å; L163-Q167 WeakPolarHBondContact O-CG 3.28Å; L163-Q167 PolarHBondContact O-N 3.17Å
164A64.5Low62.6Low51 Ų5189.6 Ų89.642%0.42145%0.452SS..Hα-helixtrans-67.5-39.8178.200000111Q161 Q167 N168Q161-A164 PolarHBondContact O-N 3.23Å; A164-Q167 PolarHBondContact O-N 3.31Å; A164-N168 PolarHBondContact O-N 3.06Å
165E62.7Low63.1Low47 Ų4794.3 Ų94.322%0.2246%0.463CS..Hα-helixtrans-71.8-34.2176-70.1-58.3159.300112.7V153 Q161 S162 Q167 N168 L169V153-E165 HydrophobicContact CG1-CG 4.44Å; Q161-E165 PolarHBondContact O-N 2.97Å; S162-E165 PolarHBondContact O-N 3.49Å; E165-Q167 VanDerWaalsContact C-N 3.3Å; E165-Q167 PolarHBondContact O-N 3.32Å; E165-N168 PolarHBondContact O-N 2.92Å; E165-N168 PolarHBondContact OE2-ND2 3.31Å; E165-L169 WeakPolarHBondContact O-CB 3.39Å; E165-L169 WeakPolarHBondContact O-CG 2.95Å; E165-L169 PolarHBondContact O-N 3.49Å
166L65Low63.4Low84 Ų8490.5 Ų90.544%0.4444%0.443SS..Hα-helixtrans-60.3-42170.9-174.870.8000111S162 L163 L169 Q170S162-L166 VanDerWaalsContact O-CB 3.24Å; S162-L166 WeakPolarHBondContact O-CB 3.29Å; S162-L166 PolarHBondContact O-N 2.78Å; L163-L166 PolarHBondContact O-N 2.84Å; L166-L169 PolarHBondContact O-N 3.34Å; L166-Q170 WeakPolarHBondContact O-CB 3.42Å; L166-Q170 WeakPolarHBondContact O-CG 3.35Å; L166-Q170 PolarHBondContact O-N 3.3Å
167Q71.3Confident64Low115 Ų11584.2 Ų84.254%0.53742%0.416SS..Hα-helixtrans-64.7-42174.8-72.7175.5-10.200111.8L163 A164 E165 Q170 H171L163-Q167 WeakPolarHBondContact O-CG 3.28Å; L163-Q167 PolarHBondContact O-N 3.17Å; A164-Q167 PolarHBondContact O-N 3.31Å; E165-Q167 VanDerWaalsContact C-N 3.3Å; E165-Q167 PolarHBondContact O-N 3.32Å; Q167-Q170 PolarHBondContact O-N 2.95Å; Q167-H171 WeakPolarHBondContact O-CB 3.33Å; Q167-H171 PolarHBondContact O-N 3.47Å
168N67.9Low65.1Low81 Ų8186.1 Ų86.143%0.43342%0.42SS..Hα-helixtrans-62.6-43.3174.2-76.4-22.4000112.1A164 E165 H171 M172A164-N168 PolarHBondContact O-N 3.06Å; E165-N168 PolarHBondContact O-N 2.92Å; E165-N168 PolarHBondContact OE2-ND2 3.31Å; N168-H171 PolarHBondContact O-N 2.76Å; N168-M172 WeakPolarHBondContact O-CB 3.21Å; N168-M172 WeakPolarHBondContact O-CG 3.47Å; N168-M172 PolarHBondContact O-N 3.39Å
169L68.6Low65.8Low24 Ų2487.3 Ų87.313%0.12642%0.42CS..Hα-helixtrans-61.4-44.7176.1-82.4167.1000111.7L107 T146 L147 S150 E165 L166 H171 M172 Y173L107-L169 HydrophobicContact CD2-CD1 4.11Å; T146-L169 HydrophobicContact CG2-CD2 4.03Å; T146-L169 HydrophobicContact CG2-CG 4.31Å; L147-L169 HydrophobicContact CD2-CD1 4.38Å; L147-L169 HydrophobicContact CD2-CD2 3.4Å; L147-L169 VanDerWaalsContact CD2-CD2 3.4Å; L147-L169 HydrophobicContact CG-CD2 3.69Å; S150-L169 WeakPolarHBondContact OG-CD1 3.5Å; E165-L169 WeakPolarHBondContact O-CB 3.39Å; E165-L169 WeakPolarHBondContact O-CG 2.95Å; E165-L169 PolarHBondContact O-N 3.49Å; L166-L169 PolarHBondContact O-N 3.34Å; L169-H171 VanDerWaalsContact C-N 3.34Å; L169-H171 PolarHBondContact O-N 2.86Å; L169-M172 PolarHBondContact O-N 2.86Å; L169-Y173 WeakPolarHBondContact O-CB 3.39Å; L169-Y173 PolarHBondContact O-N 3.07Å
170Q74Confident66.3Low116 Ų11683.4 Ų83.454%0.54240%0.4SS..Hα-helixtrans-61.9-42.2174.9-76.7179-3.100111.8L166 Q167 Y173 M174L166-Q170 WeakPolarHBondContact O-CB 3.42Å; L166-Q170 WeakPolarHBondContact O-CG 3.35Å; L166-Q170 PolarHBondContact O-N 3.3Å; Q167-Q170 PolarHBondContact O-N 2.95Å; Q170-Y173 PolarHBondContact O-N 3.43Å; Q170-M174 WeakPolarHBondContact O-CB 3.07Å; Q170-M174 PolarHBondContact O-N 3.35Å
171H73.9Confident66.9Low117 Ų11780.6 Ų80.654%0.54239%0.39SS..Hα-helixtrans-63.6-43.1177.3-168.470.4000111.8Q167 N168 L169 M174 R175Q167-H171 WeakPolarHBondContact O-CB 3.33Å; Q167-H171 PolarHBondContact O-N 3.47Å; N168-H171 PolarHBondContact O-N 2.76Å; L169-H171 VanDerWaalsContact C-N 3.34Å; L169-H171 PolarHBondContact O-N 2.86Å; H171-M174 PolarHBondContact O-N 2.85Å; H171-R175 WeakPolarHBondContact O-CB 3.45Å; H171-R175 PolarHBondContact O-N 3.31Å
172M70Confident67.6Low32 Ų3280 Ų8016%0.15840%0.402CS..Hα-helixtrans-66.9-40.3176.9-74.5-67.1-73.300112.4A142 L143 T146 N168 L169 R175 N176A142-M172 HydrophobicContact CB-CE 3.8Å; L143-M172 HydrophobicContact CD1-CB 3.93Å; T146-M172 HydrophobicContact CG2-CG 4.49Å; N168-M172 WeakPolarHBondContact O-CB 3.21Å; N168-M172 WeakPolarHBondContact O-CG 3.47Å; N168-M172 PolarHBondContact O-N 3.39Å; L169-M172 PolarHBondContact O-N 2.86Å; M172-R175 PolarHBondContact O-N 2.9Å; M172-N176 WeakPolarHBondContact O-CB 3.49Å; M172-N176 PolarHBondContact O-N 3.29Å
173Y72.8Confident68Low133 Ų13382.6 Ų82.652%0.52241%0.412SS..Hα-helixtrans-59-50.5173.8178.8-96.6000111.1L169 Q170 R175 N176 T177L169-Y173 WeakPolarHBondContact O-CB 3.39Å; L169-Y173 PolarHBondContact O-N 3.07Å; Q170-Y173 PolarHBondContact O-N 3.43Å; Y173-R175 VanDerWaalsContact C-N 3.32Å; Y173-R175 PolarHBondContact O-N 2.71Å; Y173-N176 WeakPolarHBondContact O-CB 3.47Å; Y173-N176 PolarHBondContact O-N 3.43Å; Y173-N176 VanDerWaalsContact O-N 3.09Å; Y173-T177 PolarHBondContact O-N 3.45Å; Y173-T177 PolarHBondContact O-OG1 3.11Å; Y173-T177 VanDerWaalsContact O-OG1 3.11Å
174M73.6Confident67.8Low104 Ų10480.2 Ų80.251%0.51241%0.414SS..Hα-helixtrans-59-43.4178.8-168.2-169.5-43.700112Q170 H171 N176 T177 Q178Q170-M174 WeakPolarHBondContact O-CB 3.07Å; Q170-M174 PolarHBondContact O-N 3.35Å; H171-M174 PolarHBondContact O-N 2.85Å; M174-N176 VanDerWaalsContact C-N 3.34Å; M174-T177 PolarHBondContact O-N 3Å; M174-Q178 WeakPolarHBondContact O-CG 3.23Å; M174-Q178 PolarHBondContact O-N 2.86Å
175R71.2Confident67.2Low146 Ų14681 Ų8155%0.55141%0.411SS*.Hα-helixtrans-64.8-38.2176.1-171177.3-179.1179.81.2112H171 M172 Y173 Q178 L179H171-R175 WeakPolarHBondContact O-CB 3.45Å; H171-R175 PolarHBondContact O-N 3.31Å; M172-R175 PolarHBondContact O-N 2.9Å; Y173-R175 VanDerWaalsContact C-N 3.32Å; Y173-R175 PolarHBondContact O-N 2.71Å; R175-Q178 PolarHBondContact O-N 3.37Å; R175-L179 HydrophobicContact CG-CD1 4.4Å; R175-L179 WeakPolarHBondContact O-CG 3.39Å; R175-L179 PolarHBondContact O-N 2.79Å
176N67.9Low67Low19 Ų1983.8 Ų83.810%0.10243%0.431CS..Hα-helixtrans-64.1-45.4175-172.8-86.9000111.1C139 M172 Y173 M174 Q178 L179 R180C139-N176 PolarHBondContact SG-ND2 3.33Å; C139-N176 VanDerWaalsContact SG-ND2 3.35Å; M172-N176 WeakPolarHBondContact O-CB 3.49Å; M172-N176 PolarHBondContact O-N 3.29Å; Y173-N176 WeakPolarHBondContact O-CB 3.47Å; Y173-N176 PolarHBondContact O-N 3.43Å; Y173-N176 VanDerWaalsContact O-N 3.09Å; M174-N176 VanDerWaalsContact C-N 3.34Å; N176-Q178 VanDerWaalsContact C-N 3.34Å; N176-Q178 PolarHBondContact O-N 3.46Å; N176-L179 PolarHBondContact O-N 2.74Å; N176-R180 WeakPolarHBondContact O-CG 3.41Å; N176-R180 PolarHBondContact O-N 2.7Å; N176-R180 WeakPolarHBondContact OD1-CD 3.41Å
177T68.9Low66.5Low27 Ų2785.6 Ų85.617%0.16644%0.437CS..Hα-helixtrans-58.3-45.1174.6-53.10000111.7Y173 M174 L179 R180 Q181Y173-T177 PolarHBondContact O-N 3.45Å; Y173-T177 PolarHBondContact O-OG1 3.11Å; Y173-T177 VanDerWaalsContact O-OG1 3.11Å; M174-T177 PolarHBondContact O-N 3Å; T177-L179 VanDerWaalsContact C-N 3.35Å; T177-L179 PolarHBondContact O-N 2.74Å; T177-R180 PolarHBondContact O-N 3.2Å; T177-Q181 WeakPolarHBondContact O-CG 3.19Å; T177-Q181 PolarHBondContact O-N 3.38Å
178Q71.7Confident65.3Low113 Ų11387 Ų8753%0.52845%0.448SS..Hα-helixtrans-60.8-41.9176-73.1171.7-7.100112.3M174 R175 N176 Q181 A182M174-Q178 WeakPolarHBondContact O-CG 3.23Å; M174-Q178 PolarHBondContact O-N 2.86Å; R175-Q178 PolarHBondContact O-N 3.37Å; N176-Q178 VanDerWaalsContact C-N 3.34Å; N176-Q178 PolarHBondContact O-N 3.46Å; Q178-Q181 PolarHBondContact O-N 2.88Å; Q178-A182 WeakPolarHBondContact O-CB 3.46Å; Q178-A182 PolarHBondContact O-N 3.22Å
179L64.6Low64Low46 Ų4690.6 Ų90.624%0.24146%0.463CS..Hα-helixtrans-66-41.5176.1-75.6167.5000111.8C139 R175 N176 T177 A182 L183C139-L179 HydrophobicContact CB-CD1 4.23Å; R175-L179 HydrophobicContact CG-CD1 4.4Å; R175-L179 WeakPolarHBondContact O-CG 3.39Å; R175-L179 PolarHBondContact O-N 2.79Å; N176-L179 PolarHBondContact O-N 2.74Å; T177-L179 VanDerWaalsContact C-N 3.35Å; T177-L179 PolarHBondContact O-N 2.74Å; L179-A182 PolarHBondContact O-N 2.99Å; L179-L183 WeakPolarHBondContact O-CB 3.32Å; L179-L183 WeakPolarHBondContact O-CD1 3.43Å; L179-L183 WeakPolarHBondContact O-CG 3.47Å; L179-L183 PolarHBondContact O-N 3.16Å
180R63.1Low62.4Low52 Ų5294.3 Ų94.320%0.19648%0.479CS..Hα-helixtrans-60.6-45.1175.2-72.2-177.377169.35.5111.3N176 T177 L183 G184 L185N176-R180 WeakPolarHBondContact O-CG 3.41Å; N176-R180 PolarHBondContact O-N 2.7Å; N176-R180 WeakPolarHBondContact OD1-CD 3.41Å; T177-R180 PolarHBondContact O-N 3.2Å; R180-L183 CarbonylContact O-C 3.51Å; R180-L183 PolarHBondContact O-N 2.85Å; R180-G184 PolarHBondContact O-N 3.49Å; R180-G184 VanDerWaalsContact O-N 3.14Å; R180-L185 HydrophobicContact CB-CB 4.22Å; R180-L185 PolarHBondContact O-N 2.79Å
181Q68.2Low60.3Low140 Ų14099.1 Ų99.165%0.65452%0.517SS*.Hα-helixtrans-61.1-45.6174.8-72.3174.7-4.400112.1T177 Q178 L183 G184T177-Q181 WeakPolarHBondContact O-CG 3.19Å; T177-Q181 PolarHBondContact O-N 3.38Å; Q178-Q181 PolarHBondContact O-N 2.88Å; Q181-L183 PolarHBondContact O-N 3.01Å; Q181-G184 PolarHBondContact O-N 3.38Å
182A65.9Low59.6Low85 Ų8598.2 Ų98.270%0.70252%0.515SS*.Hα-helixtrans-62.9-25.3177.400000113.2Q178 L179Q178-A182 WeakPolarHBondContact O-CB 3.46Å; Q178-A182 PolarHBondContact O-N 3.22Å; L179-A182 PolarHBondContact O-N 2.99Å
183L61Low59.1Low93 Ų93101.7 Ų101.749%0.48753%0.534SS..THydrogen-bonded Turntrans-94.83.4177.7-66.2168.2000113.2L136 L179 R180 Q181 L185L136-L183 HydrophobicContact CD1-CD1 3.46Å; L136-L183 VanDerWaalsContact CD1-CD1 3.46Å; L136-L183 HydrophobicContact CD2-CD1 3.85Å; L136-L183 HydrophobicContact CG-CD1 3.41Å; L136-L183 VanDerWaalsContact CG-CD1 3.41Å; L179-L183 WeakPolarHBondContact O-CB 3.32Å; L179-L183 WeakPolarHBondContact O-CD1 3.43Å; L179-L183 WeakPolarHBondContact O-CG 3.47Å; L179-L183 PolarHBondContact O-N 3.16Å; R180-L183 CarbonylContact O-C 3.51Å; R180-L183 PolarHBondContact O-N 2.85Å; Q181-L183 PolarHBondContact O-N 3.01Å; L183-L185 VanDerWaalsContact C-N 3.28Å; L183-L185 HydrophobicContact CB-CD1 4.34Å; L183-L185 HydrophobicContact CB-CG 4.37Å; L183-L185 PolarHBondContact O-N 3.4Å
184G57.8Low58.3Low59 Ų5999.9 Ų99.961%0.60854%0.535SS*.THydrogen-bonded Turntrans73.714.3178.700000114.8R180 Q181 T186R180-G184 PolarHBondContact O-N 3.49Å; R180-G184 VanDerWaalsContact O-N 3.14Å; Q181-G184 PolarHBondContact O-N 3.38Å; G184-T186 PolarHBondContact O-N 2.79Å
185L51.6Low57.4Low69 Ų6999.7 Ų99.736%0.36154%0.536SS..  trans-86.594.9178.2-61.4171.3000108.9L136 R180 L183L136-L185 HydrophobicContact CD1-CD1 3.93Å; R180-L185 HydrophobicContact CB-CB 4.22Å; R180-L185 PolarHBondContact O-N 2.79Å; L183-L185 VanDerWaalsContact C-N 3.28Å; L183-L185 HydrophobicContact CB-CD1 4.34Å; L183-L185 HydrophobicContact CB-CG 4.37Å; L183-L185 PolarHBondContact O-N 3.4Å
186T57.7Low56.6Low104 Ų10496.8 Ų96.864%0.63854%0.535SS*.  trans-79.7149.3176.749.70000111.6G184 N188G184-T186 PolarHBondContact O-N 2.79Å; T186-N188 PolarHBondContact O-N 2.94Å
187E55.4Low55.8Low122 Ų122102 Ų10257%0.5756%0.564SS**SBendtrans-72.325.3-178-65-177.415000114.1
188N46Very low54.9Low145 Ų145107.4 Ų107.478%0.77559%0.593SS**  trans-97.217.2-165.9-77.2-8000115.8T186T186-N188 PolarHBondContact O-N 2.94Å
189E39.9Very low53.6Low157 Ų157106.9 Ų106.973%0.73460%0.598SS**SBendtrans-125.3132.9168.5-65.9-175.8163.600107.9
190E34.8Very low52.7Low101 Ų101112 Ų11247%0.47263%0.627SS.*  trans97.969-178.4-53.1-179.4161.700116.6Q120Q120-E190 PolarHBondContact NE2-OE1 3.43Å
191T31.1Very low51.8Low217 Ų217117.5 Ų117.5100%1.33167%0.667SS**  -74.30128.742.20000110.4

Retrieved 191 of 191 residues in 172.7 ms (Link to these results)