A0A087X9L1_POEFO Loading...

NSF attachment protein beta

Required for vesicular transport between the endoplasmic reticulum and the Golgi apparatus.

AlphaFold DB , UniProt , Accession A0A087X9L1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 298 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
1M49.7Very low73.4Confident224 Ų22487.5 Ų87.5100%1.10345%0.452SS*.  0121.80-76.8179.2175.300106.9N3M1-N3 PolarHBondContact O-N 3.22Å; M1-N3 VanDerWaalsContact O-N 3.11Å
2D58.4Low74.6Confident117 Ų11790.5 Ų90.563%0.62646%0.463SS*.  trans-76.493.2-174.3-173.91.6000110.5S4 G5D2-S4 PolarHBondContact O-N 3.13Å; D2-S4 WeakPolarHBondContact OD1-CB 3.47Å; D2-S4 PolarHBondContact OD1-N 3.1Å; D2-G5 PolarHBondContact OD1-N 2.69Å
3N63.9Low75.6Confident66 Ų6685.9 Ų85.935%0.35344%0.44SS..Hα-helixtrans-68.1-26.1177.5-77.80.8000111.8M1 K6 E7 A56M1-N3 PolarHBondContact O-N 3.22Å; M1-N3 VanDerWaalsContact O-N 3.11Å; N3-K6 PolarHBondContact O-N 3.43Å; N3-E7 WeakPolarHBondContact O-CG 3.06Å; N3-E7 PolarHBondContact O-N 3.26Å; N3-A56 HydrophobicContact CB-CB 4.47Å; N3-A56 PolarHBondContact ND2-O 3.43Å
4S66.6Low76.4Confident57 Ų5781.9 Ų81.940%0.39942%0.419SS..Hα-helixtrans-72.4-35.6-177.4-171.40000112.3D2 K8D2-S4 PolarHBondContact O-N 3.13Å; D2-S4 WeakPolarHBondContact OD1-CB 3.47Å; D2-S4 PolarHBondContact OD1-N 3.1Å; S4-K8 WeakPolarHBondContact O-CG 3.42Å; S4-K8 PolarHBondContact O-N 2.73Å
5G77Confident77.1Confident34 Ų3479.3 Ų79.335%0.35141%0.414SS..Hα-helixtrans-61.8-43.5174.200000112.9D2 K8 E9D2-G5 PolarHBondContact OD1-N 2.69Å; G5-K8 PolarHBondContact O-N 3.31Å; G5-E9 PolarHBondContact O-N 3.02Å; G5-E9 VanDerWaalsContact O-N 3.13Å
6K76.8Confident77.7Confident74 Ų7477.5 Ų77.532%0.32241%0.405SS..Hα-helixtrans-68.9-34.9-179.6-68.2-173176.3-174.80113.2N3 A10N3-K6 PolarHBondContact O-N 3.43Å; K6-A10 WeakPolarHBondContact O-CB 3.32Å; K6-A10 PolarHBondContact O-N 3.33Å
7E78.9Confident78.1Confident53 Ų5372.9 Ų72.925%0.24838%0.381CS..Hα-helixtrans-65.6-43.2174.8-72.4-177.6151.500112N3 E9 A10 I11 A56 N58N3-E7 WeakPolarHBondContact O-CG 3.06Å; N3-E7 PolarHBondContact O-N 3.26Å; E7-E9 PolarHBondContact O-N 2.88Å; E7-A10 PolarHBondContact O-N 2.97Å; E7-I11 VanDerWaalsContact O-CG1 3.28Å; E7-I11 WeakPolarHBondContact O-CG1 3.36Å; E7-I11 PolarHBondContact O-N 3.3Å; E7-A56 HydrophobicContact CG-CB 3.57Å; E7-N58 VanDerWaalsContact OE1-CB 3.32Å; E7-N58 WeakPolarHBondContact OE1-CB 3.49Å; E7-N58 PolarHBondContact OE1-ND2 2.97Å
8K82.5Confident78.5Confident141 Ų14171.8 Ų71.861%0.61338%0.376SS*.Hα-helixtrans-63.2-42.5177.6-71.3177.6-176.7177.20111.9S4 G5 A10 I11 Q12S4-K8 WeakPolarHBondContact O-CG 3.42Å; S4-K8 PolarHBondContact O-N 2.73Å; G5-K8 PolarHBondContact O-N 3.31Å; K8-A10 VanDerWaalsContact C-N 3.33Å; K8-I11 PolarHBondContact O-N 3.44Å; K8-Q12 PolarHBondContact O-N 3.42Å
9E84.4Confident78.9Confident94 Ų9474.8 Ų74.844%0.43939%0.386SS..Hα-helixtrans-63.4-40176-166.3-170.216500111.3G5 E7 Q12 L13 M52G5-E9 PolarHBondContact O-N 3.02Å; G5-E9 VanDerWaalsContact O-N 3.13Å; E7-E9 PolarHBondContact O-N 2.88Å; E9-Q12 PolarHBondContact O-N 3.48Å; E9-L13 WeakPolarHBondContact O-CG 3.48Å; E9-L13 PolarHBondContact O-N 3.3Å; E9-M52 HydrophobicContact CB-CE 3.57Å; E9-M52 HydrophobicContact CG-CE 3.54Å; E9-M52 WeakPolarHBondContact OE2-CE 3.33Å
10A84.1Confident79Confident0 Ų074.1 Ų74.10%038%0.379CS..Hα-helixtrans-65-41.1175.200000113.1K6 E7 K8 Q12 L13 M14 A49 M52 F53K6-A10 WeakPolarHBondContact O-CB 3.32Å; K6-A10 PolarHBondContact O-N 3.33Å; E7-A10 PolarHBondContact O-N 2.97Å; K8-A10 VanDerWaalsContact C-N 3.33Å; A10-Q12 VanDerWaalsContact C-N 3.32Å; A10-Q12 PolarHBondContact O-N 3.17Å; A10-L13 PolarHBondContact O-N 3.35Å; A10-M14 PolarHBondContact O-N 3.17Å; A10-A49 HydrophobicContact CB-CB 4.33Å; A10-A49 WeakPolarHBondContact O-CB 3.4Å; A10-M52 HydrophobicContact CB-CB 3.87Å; A10-F53 HydrophobicContact CB-CD1 3.96Å; A10-F53 HydrophobicContact CB-CD2 3.96Å; A10-F53 HydrophobicContact CB-CE1 3.65Å; A10-F53 HydrophobicContact CB-CE2 3.64Å; A10-F53 HydrophobicContact CB-CG 4.1Å; A10-F53 HydrophobicContact CB-CZ 3.47Å; A10-F53 VanDerWaalsContact CB-CZ 3.47Å
11I85.4Confident79.1Confident102 Ų10272.2 Ų72.252%0.52337%0.372SS..Hα-helixtrans-62.5-41.9175.1-67.9165000110.6E7 K8 M14 A15 F53E7-I11 VanDerWaalsContact O-CG1 3.28Å; E7-I11 WeakPolarHBondContact O-CG1 3.36Å; E7-I11 PolarHBondContact O-N 3.3Å; K8-I11 PolarHBondContact O-N 3.44Å; I11-M14 PolarHBondContact O-N 2.83Å; I11-A15 PolarHBondContact O-N 3.3Å; I11-F53 HydrophobicContact CG1-CE1 4.04Å; I11-F53 HydrophobicContact CG1-CZ 3.82Å
12Q87.2Confident80.5Confident124 Ų12469.2 Ų69.258%0.57935%0.352SS*.Hα-helixtrans-64.8-44.3177.7-172.7171.9-3.900111.6K8 E9 A10 M14 A15 D16K8-Q12 PolarHBondContact O-N 3.42Å; E9-Q12 PolarHBondContact O-N 3.48Å; A10-Q12 VanDerWaalsContact C-N 3.32Å; A10-Q12 PolarHBondContact O-N 3.17Å; Q12-M14 VanDerWaalsContact C-N 3.3Å; Q12-M14 PolarHBondContact O-N 3.28Å; Q12-A15 PolarHBondContact O-N 2.75Å; Q12-A15 VanDerWaalsContact O-N 3.14Å; Q12-D16 PolarHBondContact O-N 3.06Å
13L87.9Confident81Confident31 Ų3166.3 Ų66.316%0.16234%0.341CS..Hα-helixtrans-58.3-41.6174.8-77.6169.8000112.2E9 A10 D16 A17 M45 R48 A49 M52E9-L13 WeakPolarHBondContact O-CG 3.48Å; E9-L13 PolarHBondContact O-N 3.3Å; A10-L13 PolarHBondContact O-N 3.35Å; L13-D16 PolarHBondContact O-N 3.38Å; L13-A17 WeakPolarHBondContact O-CB 3.18Å; L13-A17 PolarHBondContact O-N 2.89Å; L13-M45 HydrophobicContact CD2-CE 4.16Å; L13-R48 HydrophobicContact CD1-CG 4.26Å; L13-A49 HydrophobicContact CB-CB 3.98Å; L13-M52 HydrophobicContact CD1-CE 4.32Å; L13-M52 HydrophobicContact CD1-SD 3.53Å; L13-M52 VanDerWaalsContact CD1-SD 3.53Å
14M86.7Confident80.8Confident30 Ų3064.4 Ų64.415%0.14833%0.333CS..Hα-helixtrans-62.8-43.3174.4-78.5-167.257.400112.8A10 I11 Q12 D16 A17 D18 Y46 A49 F53 A66 K69A10-M14 PolarHBondContact O-N 3.17Å; I11-M14 PolarHBondContact O-N 2.83Å; Q12-M14 VanDerWaalsContact C-N 3.3Å; Q12-M14 PolarHBondContact O-N 3.28Å; M14-D16 VanDerWaalsContact C-N 3.33Å; M14-D16 PolarHBondContact O-N 3.43Å; M14-A17 PolarHBondContact O-N 3.44Å; M14-D18 PolarHBondContact O-N 3.46Å; M14-Y46 HydrophobicContact CB-CE1 4.5Å; M14-Y46 HydrophobicContact CE-CE1 4.47Å; M14-Y46 HydrophobicContact CG-CD1 4.19Å; M14-Y46 HydrophobicContact CG-CE1 4.47Å; M14-A49 HydrophobicContact CG-CB 3.78Å; M14-F53 HydrophobicContact CG-CE2 4.28Å; M14-F53 HydrophobicContact SD-CE2 3.64Å; M14-F53 HydrophobicContact SD-CZ 4.22Å; M14-A66 HydrophobicContact CE-CB 4.49Å; M14-A66 HydrophobicContact CG-CB 4.46Å; M14-A66 HydrophobicContact SD-CB 3.85Å; M14-K69 HydrophobicContact CE-CD 4.12Å
15A87.2Confident80.3Confident42 Ų4265.1 Ų65.135%0.34735%0.349SS..Hα-helixtrans-65.5-38.1179.900000111.7I11 Q12 D18 K19I11-A15 PolarHBondContact O-N 3.3Å; Q12-A15 PolarHBondContact O-N 2.75Å; Q12-A15 VanDerWaalsContact O-N 3.14Å; A15-D18 PolarHBondContact O-N 3.06Å; A15-K19 WeakPolarHBondContact O-CG 3.28Å; A15-K19 PolarHBondContact O-N 3.29Å; A15-K19 VanDerWaalsContact O-N 3.11Å
16D86.1Confident79.1Confident51 Ų5166.9 Ų66.927%0.27336%0.356SS..Hα-helixtrans-72.8-34.8177.2-68.8-23.5000111.9Q12 L13 M14 K19 K20 M45Q12-D16 PolarHBondContact O-N 3.06Å; L13-D16 PolarHBondContact O-N 3.38Å; M14-D16 VanDerWaalsContact C-N 3.33Å; M14-D16 PolarHBondContact O-N 3.43Å; D16-K19 PolarHBondContact O-N 3.03Å; D16-K19 IonicContact OD1-NZ 3.37Å; D16-K19 PolarHBondContact OD1-NZ 3.45Å; D16-K20 WeakPolarHBondContact O-CG 3.42Å; D16-K20 PolarHBondContact O-N 3.12Å; D16-M45 HydrophobicContact CB-CE 3.66Å
17A85.2Confident77.6Confident0 Ų073.6 Ų73.60%039%0.386CS..Hα-helixtrans-62.9-45.4169.800000111.9L13 M14 K19 K20 V21 A42 M45 Y46L13-A17 WeakPolarHBondContact O-CB 3.18Å; L13-A17 PolarHBondContact O-N 2.89Å; M14-A17 PolarHBondContact O-N 3.44Å; A17-K19 VanDerWaalsContact C-N 3.28Å; A17-K19 PolarHBondContact O-N 2.91Å; A17-K20 PolarHBondContact O-N 2.97Å; A17-K20 VanDerWaalsContact O-N 3.1Å; A17-V21 WeakPolarHBondContact O-CG2 3.44Å; A17-V21 PolarHBondContact O-N 3.32Å; A17-A42 HydrophobicContact CB-CB 4.39Å; A17-M45 HydrophobicContact CB-CB 3.86Å; A17-Y46 HydrophobicContact CB-CD1 4.07Å; A17-Y46 HydrophobicContact CB-CD2 3.91Å; A17-Y46 HydrophobicContact CB-CE1 3.75Å; A17-Y46 HydrophobicContact CB-CE2 3.53Å; A17-Y46 HydrophobicContact CB-CG 4.15Å; A17-Y46 VanDerWaalsContact CB-CZ 3.47Å
18D85.1Confident76.2Confident52 Ų5279.2 Ų79.228%0.27842%0.417SS..Hα-helixtrans-59.6-38.2176.9-77.7-31.8000111.2M14 A15 K22 Y46 K69M14-D18 PolarHBondContact O-N 3.46Å; A15-D18 PolarHBondContact O-N 3.06Å; D18-K22 WeakPolarHBondContact O-CG 3.42Å; D18-K22 PolarHBondContact O-N 3.29Å; D18-K22 VanDerWaalsContact O-N 3.11Å; D18-Y46 VanDerWaalsContact CA-OH 3.24Å; D18-Y46 WeakPolarHBondContact CA-OH 3.46Å; D18-Y46 VanDerWaalsContact CG-OH 3.3Å; D18-Y46 PolarHBondContact N-OH 2.67Å; D18-Y46 VanDerWaalsContact N-OH 3.16Å; D18-Y46 PolarHBondContact OD1-OH 2.9Å; D18-K69 IonicContact OD1-NZ 2.66Å; D18-K69 PolarHBondContact OD1-NZ 3.46Å; D18-K69 IonicContact OD2-NZ 3.17Å; D18-K69 PolarHBondContact OD2-NZ 2.84Å
19K85.6Confident74.6Confident130 Ų13073.7 Ų73.757%0.56540%0.4SS*.Hα-helixtrans-65.9-43.2174.6-70.9171.4-162.5155.80111.9A15 D16 A17 K22 S23A15-K19 WeakPolarHBondContact O-CG 3.28Å; A15-K19 PolarHBondContact O-N 3.29Å; A15-K19 VanDerWaalsContact O-N 3.11Å; D16-K19 PolarHBondContact O-N 3.03Å; D16-K19 IonicContact OD1-NZ 3.37Å; D16-K19 PolarHBondContact OD1-NZ 3.45Å; A17-K19 VanDerWaalsContact C-N 3.28Å; A17-K19 PolarHBondContact O-N 2.91Å; K19-K22 PolarHBondContact O-N 2.86Å; K19-S23 WeakPolarHBondContact O-CB 3.35Å; K19-S23 PolarHBondContact O-N 2.99Å
20K82.3Confident72.8Confident60 Ų6073 Ų7326%0.26142%0.418SS..Hα-helixtrans-62.2-44.7179.1-77-172.2-179.6-168.50111.7D16 A17 K22 S23 S24 E41 A42 M45D16-K20 WeakPolarHBondContact O-CG 3.42Å; D16-K20 PolarHBondContact O-N 3.12Å; A17-K20 PolarHBondContact O-N 2.97Å; A17-K20 VanDerWaalsContact O-N 3.1Å; K20-K22 PolarHBondContact O-N 3.11Å; K20-S23 PolarHBondContact O-N 3.46Å; K20-S23 PolarHBondContact O-OG 3.41Å; K20-S24 PolarHBondContact O-N 3.31Å; K20-S24 VanDerWaalsContact O-N 3.16Å; K20-E41 IonicContact NZ-OE1 2.67Å; K20-E41 PolarHBondContact NZ-OE1 3.36Å; K20-E41 IonicContact NZ-OE2 2.76Å; K20-E41 PolarHBondContact NZ-OE2 3.27Å; K20-A42 HydrophobicContact CB-CB 4.19Å; K20-M45 HydrophobicContact CD-SD 3.8Å
21V80.7Confident71Confident35 Ų3581.4 Ų81.421%0.21246%0.459CS..Hα-helixtrans-62.6-40.5175.5177.70000112.1A17 S23 S24 A42 Y46 L73A17-V21 WeakPolarHBondContact O-CG2 3.44Å; A17-V21 PolarHBondContact O-N 3.32Å; V21-S23 VanDerWaalsContact C-N 3.33Å; V21-S23 PolarHBondContact O-N 3.24Å; V21-S24 PolarHBondContact O-N 3.44Å; V21-S24 PolarHBondContact O-OG 3.45Å; V21-A42 HydrophobicContact CG2-CB 3.55Å; V21-Y46 HydrophobicContact CG2-CE2 4.24Å; V21-L73 HydrophobicContact CG1-CD2 3.93Å; V21-L73 HydrophobicContact CG2-CD1 3.71Å; V21-L73 HydrophobicContact CG2-CD2 4.02Å
22K79.2Confident69.4Low161 Ų16185.1 Ų85.170%0.747%0.472SS*.Hα-helixtrans-68.2-34.2176.5-73.9176.1-179.4179.70112.7D18 K19 K20 S24 G25 S26D18-K22 WeakPolarHBondContact O-CG 3.42Å; D18-K22 PolarHBondContact O-N 3.29Å; D18-K22 VanDerWaalsContact O-N 3.11Å; K19-K22 PolarHBondContact O-N 2.86Å; K20-K22 PolarHBondContact O-N 3.11Å; K22-S24 VanDerWaalsContact C-N 3.31Å; K22-S24 PolarHBondContact O-N 3.41Å; K22-G25 PolarHBondContact O-N 2.93Å; K22-S26 PolarHBondContact O-OG 3.37Å
23S68.9Low67.7Low56 Ų5683.3 Ų83.339%0.39249%0.486SS..Hα-helixtrans-71.3-24.5178.978.40000113.3K19 K20 V21K19-S23 WeakPolarHBondContact O-CB 3.35Å; K19-S23 PolarHBondContact O-N 2.99Å; K20-S23 PolarHBondContact O-N 3.46Å; K20-S23 PolarHBondContact O-OG 3.41Å; V21-S23 VanDerWaalsContact C-N 3.33Å; V21-S23 PolarHBondContact O-N 3.24Å
24S59.9Low66.3Low25 Ų2583.6 Ų83.618%0.17550%0.497CS..Hα-helixtrans-79.9-25.7176.759.10000113.2K20 V21 K22 V39K20-S24 PolarHBondContact O-N 3.31Å; K20-S24 VanDerWaalsContact O-N 3.16Å; V21-S24 PolarHBondContact O-N 3.44Å; V21-S24 PolarHBondContact O-OG 3.45Å; K22-S24 VanDerWaalsContact C-N 3.31Å; K22-S24 PolarHBondContact O-N 3.41Å; S24-V39 WeakPolarHBondContact OG-CG2 3.37Å
25G55.5Low65.2Low72 Ų7283.3 Ų83.374%0.74250%0.501SS*.SBendtrans-89.2-3.6178.600000116.3K22K22-G25 PolarHBondContact O-N 2.93Å
26S51.6Low64.2Low72 Ų7286.1 Ų86.150%0.50351%0.507SS..SBendtrans-81.7143.5178-69.70000111.7K22 L28 G29K22-S26 PolarHBondContact O-OG 3.37Å; S26-L28 PolarHBondContact O-N 2.95Å; S26-G29 PolarHBondContact O-N 3.25Å
27F45.8Very low63.6Low214 Ų21489.8 Ų89.894%0.93952%0.522SS*.THydrogen-bonded Turntrans-43.7-20.6-176.4-178.6-106.5000116.6
28L49.1Very low63.2Low171 Ų17194.3 Ų94.390%0.89554%0.542SS*.THydrogen-bonded Turntrans-81.6-12175.5-110.4154.4000114.8S26S26-L28 PolarHBondContact O-N 2.95Å
29G48.8Very low62.9Low26 Ų2692.5 Ų92.527%0.26853%0.533SS..SBendtrans-96.1-11.4-177.300000115.6S26 M31S26-G29 PolarHBondContact O-N 3.25Å; G29-M31 VanDerWaalsContact C-N 3.32Å; G29-M31 PolarHBondContact O-N 2.73Å
30G46.9Very low62.8Low79 Ų7989.7 Ų89.781%0.81452%0.522SS*.THydrogen-bonded Turntrans-78.1-6.5-174.600000115.8
31M46.3Very low62.8Low177 Ų17790.5 Ų90.587%0.87253%0.527SS*.THydrogen-bonded Turntrans-104.7-5.9-171.8-159.415869.900114.5G29G29-M31 VanDerWaalsContact C-N 3.32Å; G29-M31 PolarHBondContact O-N 2.73Å
32F50.5Low63Low180 Ų18088.9 Ų88.979%0.78952%0.517SS*.SBendtrans-136.2126.2174-105-97.8000107.6G34F32-G34 PolarHBondContact O-N 3.15Å
33G52.3Low63.3Low85 Ų8581.2 Ų81.288%0.87648%0.483SS*.THydrogen-bonded Turntrans-6125.8-173.900000117.8
34G58.4Low64.2Low37 Ų3784.8 Ų84.838%0.38149%0.494SS..THydrogen-bonded Turntrans-90.81.7176.700000115.3F32 H36 K38F32-G34 PolarHBondContact O-N 3.15Å; G34-H36 VanDerWaalsContact C-N 3.33Å; G34-K38 PolarHBondContact O-N 3.03Å
35G62.8Low65.5Low24 Ų2485 Ų8525%0.24749%0.492CS..Hα-helixtrans-64.1-35.7175.600000113.3K38 V39G35-K38 PolarHBondContact O-N 3.44Å; G35-V39 WeakPolarHBondContact O-CG2 3.32Å; G35-V39 PolarHBondContact O-N 2.99Å
36H66.8Low67.1Low101 Ų10181.8 Ų81.847%0.46846%0.458SS..Hα-helixtrans-65-46.4179.9-157.9-93.3000111.8G34 K38 V39 E40 L77G34-H36 VanDerWaalsContact C-N 3.33Å; H36-K38 VanDerWaalsContact C-N 3.33Å; H36-K38 PolarHBondContact O-N 3.07Å; H36-V39 PolarHBondContact O-N 3.07Å; H36-E40 PolarHBondContact O-N 3.3Å; H36-L77 VanDerWaalsContact CD2-CD2 3.44Å; H36-L77 WeakPolarHBondContact CD2-CD2 3.41Å; H36-L77 WeakPolarHBondContact NE2-CD2 3.34Å
37H73.6Confident68.7Low128 Ų12879.7 Ų79.759%0.59344%0.443SS*.Hα-helixtrans-65.1-35.4-179.6-168.456.3000112.7V39 E40 E41H37-V39 VanDerWaalsContact C-N 3.34Å; H37-V39 PolarHBondContact O-N 3.48Å; H37-E40 IonicContact ND1-OE2 2.89Å; H37-E40 PolarHBondContact O-N 3.25Å; H37-E41 WeakPolarHBondContact O-CB 3.13Å; H37-E41 PolarHBondContact O-N 3.23Å
38K76.9Confident70.7Confident96 Ų9676.8 Ų76.842%0.41743%0.426SS..Hα-helixtrans-67.5-34175.3-71.4179.9180-179.30113G34 G35 H36 A42G34-K38 PolarHBondContact O-N 3.03Å; G35-K38 PolarHBondContact O-N 3.44Å; H36-K38 VanDerWaalsContact C-N 3.33Å; H36-K38 PolarHBondContact O-N 3.07Å; K38-A42 WeakPolarHBondContact O-CB 3.47Å; K38-A42 PolarHBondContact O-N 3.34Å; K38-A42 VanDerWaalsContact O-N 3.11Å
39V79.9Confident72.5Confident14 Ų1468.7 Ų68.79%0.08538%0.383CS..Hα-helixtrans-76.4-36178.1173.70000110.6S24 G35 H36 H37 A42 C43 L73 L77S24-V39 WeakPolarHBondContact OG-CG2 3.37Å; G35-V39 WeakPolarHBondContact O-CG2 3.32Å; G35-V39 PolarHBondContact O-N 2.99Å; H36-V39 PolarHBondContact O-N 3.07Å; H37-V39 VanDerWaalsContact C-N 3.34Å; H37-V39 PolarHBondContact O-N 3.48Å; V39-A42 PolarHBondContact O-N 2.86Å; V39-C43 WeakPolarHBondContact O-CB 3.25Å; V39-C43 PolarHBondContact O-N 2.89Å; V39-L73 HydrophobicContact CG1-CB 4.16Å; V39-L73 HydrophobicContact CG1-CD2 4.11Å; V39-L77 HydrophobicContact CB-CD2 3.93Å; V39-L77 HydrophobicContact CG1-CD1 3.99Å; V39-L77 HydrophobicContact CG1-CD2 3.73Å; V39-L77 HydrophobicContact CG1-CG 3.83Å
40E81.5Confident74.3Confident70 Ų7067.4 Ų67.433%0.32737%0.37SS..Hα-helixtrans-63.3-48.1172.9-170.8171.5-150.600111.8H36 H37 A42 C43 E44 L77H36-E40 PolarHBondContact O-N 3.3Å; H37-E40 IonicContact ND1-OE2 2.89Å; H37-E40 PolarHBondContact O-N 3.25Å; E40-A42 VanDerWaalsContact C-N 3.32Å; E40-A42 PolarHBondContact O-N 3.4Å; E40-C43 WeakPolarHBondContact O-CA 3.48Å; E40-C43 WeakPolarHBondContact O-CB 3.22Å; E40-C43 PolarHBondContact O-N 3.05Å; E40-E44 PolarHBondContact O-N 2.89Å; E40-E44 VanDerWaalsContact O-N 3.09Å; E40-L77 HydrophobicContact CB-CD1 4.04Å
41E83.8Confident76.2Confident78 Ų7867.4 Ų67.436%0.36435%0.351SS..Hα-helixtrans-62.1-39.6175.9-165-169.4178.100111.8K20 H37 C43 E44 M45K20-E41 IonicContact NZ-OE1 2.67Å; K20-E41 PolarHBondContact NZ-OE1 3.36Å; K20-E41 IonicContact NZ-OE2 2.76Å; K20-E41 PolarHBondContact NZ-OE2 3.27Å; H37-E41 WeakPolarHBondContact O-CB 3.13Å; H37-E41 PolarHBondContact O-N 3.23Å; E41-C43 VanDerWaalsContact C-N 3.26Å; E41-C43 PolarHBondContact O-N 3.17Å; E41-E44 PolarHBondContact O-N 3.48Å; E41-M45 VanDerWaalsContact O-CG 3.27Å; E41-M45 WeakPolarHBondContact O-CG 3.43Å; E41-M45 PolarHBondContact O-N 3.14Å
42A84.6Confident78Confident0 Ų059.8 Ų59.80%031%0.314CS..Hα-helixtrans-62.5-35.917400000111.8A17 K20 V21 K38 V39 E40 M45 Y46A17-A42 HydrophobicContact CB-CB 4.39Å; K20-A42 HydrophobicContact CB-CB 4.19Å; V21-A42 HydrophobicContact CG2-CB 3.55Å; K38-A42 WeakPolarHBondContact O-CB 3.47Å; K38-A42 PolarHBondContact O-N 3.34Å; K38-A42 VanDerWaalsContact O-N 3.11Å; V39-A42 PolarHBondContact O-N 2.86Å; E40-A42 VanDerWaalsContact C-N 3.32Å; E40-A42 PolarHBondContact O-N 3.4Å; A42-M45 WeakPolarHBondContact O-CB 3.4Å; A42-M45 PolarHBondContact O-N 3.33Å; A42-Y46 HydrophobicContact CB-CE2 4.44Å; A42-Y46 WeakPolarHBondContact O-CD2 3.12Å; A42-Y46 PolarHBondContact O-N 3.05Å
43C85.5Confident79.7Confident0 Ų051.5 Ų51.50%028%0.278CS..Hα-helixtrans-63.6-47.2177.3-153.30000112V39 E40 E41 M45 Y46 C47 A70 L73 H74V39-C43 WeakPolarHBondContact O-CB 3.25Å; V39-C43 PolarHBondContact O-N 2.89Å; E40-C43 WeakPolarHBondContact O-CA 3.48Å; E40-C43 WeakPolarHBondContact O-CB 3.22Å; E40-C43 PolarHBondContact O-N 3.05Å; E41-C43 VanDerWaalsContact C-N 3.26Å; E41-C43 PolarHBondContact O-N 3.17Å; C43-M45 VanDerWaalsContact C-N 3.27Å; C43-M45 PolarHBondContact O-N 2.76Å; C43-Y46 PolarHBondContact O-N 3.43Å; C43-Y46 VanDerWaalsContact O-N 3.16Å; C43-C47 PolarHBondContact O-N 3.36Å; C43-A70 PolarHBondContact SG-O 2.95Å; C43-L73 HydrophobicContact CB-CB 4.49Å; C43-H74 PolarHBondContact SG-CD2 2.78Å; C43-H74 PolarHBondContact SG-CE1 2.65Å; C43-H74 VanDerWaalsContact SG-CG 3.51Å; C43-H74 PolarHBondContact SG-NE2 3.1Å
44E86.6Confident81.1Confident132 Ų13250 Ų5062%0.61725%0.247SC*.Hα-helixtrans-59.2-39.6173.9-66.6-176.2174.400111.9E40 E41 C47 R48E40-E44 PolarHBondContact O-N 2.89Å; E40-E44 VanDerWaalsContact O-N 3.09Å; E41-E44 PolarHBondContact O-N 3.48Å; E44-C47 PolarHBondContact O-N 3.39Å; E44-R48 WeakPolarHBondContact O-CB 3.35Å; E44-R48 PolarHBondContact O-N 2.99Å
45M87.9Confident82.2Confident29 Ų2953.8 Ų53.814%0.14326%0.256CS..Hα-helixtrans-62.5-41.3175.8-701777100112.3L13 D16 A17 K20 E41 A42 C43 R48 A49L13-M45 HydrophobicContact CD2-CE 4.16Å; D16-M45 HydrophobicContact CB-CE 3.66Å; A17-M45 HydrophobicContact CB-CB 3.86Å; K20-M45 HydrophobicContact CD-SD 3.8Å; E41-M45 VanDerWaalsContact O-CG 3.27Å; E41-M45 WeakPolarHBondContact O-CG 3.43Å; E41-M45 PolarHBondContact O-N 3.14Å; A42-M45 WeakPolarHBondContact O-CB 3.4Å; A42-M45 PolarHBondContact O-N 3.33Å; C43-M45 VanDerWaalsContact C-N 3.27Å; C43-M45 PolarHBondContact O-N 2.76Å; M45-R48 PolarHBondContact O-N 3.18Å; M45-A49 WeakPolarHBondContact O-CB 3.45Å; M45-A49 PolarHBondContact O-N 3.19Å
46Y88.8Confident83.1Confident5 Ų553 Ų532%0.0225%0.247CC..Hα-helixtrans-65.9-43.7174.1-72.7-65.6000112.2M14 A17 D18 V21 A42 C43 R48 A49 A50 K69 L73M14-Y46 HydrophobicContact CB-CE1 4.5Å; M14-Y46 HydrophobicContact CE-CE1 4.47Å; M14-Y46 HydrophobicContact CG-CD1 4.19Å; M14-Y46 HydrophobicContact CG-CE1 4.47Å; A17-Y46 HydrophobicContact CB-CD1 4.07Å; A17-Y46 HydrophobicContact CB-CD2 3.91Å; A17-Y46 HydrophobicContact CB-CE1 3.75Å; A17-Y46 HydrophobicContact CB-CE2 3.53Å; A17-Y46 HydrophobicContact CB-CG 4.15Å; A17-Y46 VanDerWaalsContact CB-CZ 3.47Å; D18-Y46 VanDerWaalsContact CA-OH 3.24Å; D18-Y46 WeakPolarHBondContact CA-OH 3.46Å; D18-Y46 VanDerWaalsContact CG-OH 3.3Å; D18-Y46 PolarHBondContact N-OH 2.67Å; D18-Y46 VanDerWaalsContact N-OH 3.16Å; D18-Y46 PolarHBondContact OD1-OH 2.9Å; V21-Y46 HydrophobicContact CG2-CE2 4.24Å; A42-Y46 HydrophobicContact CB-CE2 4.44Å; A42-Y46 WeakPolarHBondContact O-CD2 3.12Å; A42-Y46 PolarHBondContact O-N 3.05Å; C43-Y46 PolarHBondContact O-N 3.43Å; C43-Y46 VanDerWaalsContact O-N 3.16Å; Y46-R48 VanDerWaalsContact C-N 3.3Å; Y46-R48 PolarHBondContact O-N 3.01Å; Y46-A49 PolarHBondContact O-N 3.02Å; Y46-A50 VanDerWaalsContact O-CB 3.31Å; Y46-A50 WeakPolarHBondContact O-CB 3.11Å; Y46-A50 PolarHBondContact O-N 3.39Å; Y46-K69 HydrophobicContact CD1-CB 4.14Å; Y46-K69 HydrophobicContact CD1-CD 4.21Å; Y46-K69 HydrophobicContact CE1-CB 4.16Å; Y46-K69 HydrophobicContact CE1-CD 3.63Å; Y46-K69 HydrophobicContact CG-CB 4.32Å; Y46-L73 HydrophobicContact CD2-CD1 3.62Å; Y46-L73 HydrophobicContact CE2-CD1 3.36Å
47C86.6Confident83.6Confident27 Ų2755.7 Ų55.718%0.18226%0.258CS..Hα-helixtrans-60.9-40.8176.8-720000111.6C43 E44 A50 N51C43-C47 PolarHBondContact O-N 3.36Å; E44-C47 PolarHBondContact O-N 3.39Å; C47-A50 PolarHBondContact O-N 3.13Å; C47-N51 PolarHBondContact O-N 3.42Å; C47-N51 PolarHBondContact O-ND2 2.75Å
48R87.5Confident83.6Confident154 Ų15451.7 Ų51.758%0.58124%0.241SC*.Hα-helixtrans-64.5-46.7175.4-173173.8178166.2-1.8111.7L13 E44 M45 Y46 A50 N51 M52L13-R48 HydrophobicContact CD1-CG 4.26Å; E44-R48 WeakPolarHBondContact O-CB 3.35Å; E44-R48 PolarHBondContact O-N 2.99Å; M45-R48 PolarHBondContact O-N 3.18Å; Y46-R48 VanDerWaalsContact C-N 3.3Å; Y46-R48 PolarHBondContact O-N 3.01Å; R48-A50 VanDerWaalsContact C-N 3.31Å; R48-A50 PolarHBondContact O-N 3.39Å; R48-N51 PolarHBondContact O-N 2.89Å; R48-M52 HydrophobicContact CG-SD 4.19Å; R48-M52 VanDerWaalsContact O-CG 3.3Å; R48-M52 WeakPolarHBondContact O-CG 3.3Å; R48-M52 PolarHBondContact O-N 2.96Å
49A86.7Confident83.2Confident0 Ų051.4 Ų51.40%024%0.237CC..Hα-helixtrans-59.1-43.8175.600000111.6A10 L13 M14 M45 Y46 N51 M52 F53A10-A49 HydrophobicContact CB-CB 4.33Å; A10-A49 WeakPolarHBondContact O-CB 3.4Å; L13-A49 HydrophobicContact CB-CB 3.98Å; M14-A49 HydrophobicContact CG-CB 3.78Å; M45-A49 WeakPolarHBondContact O-CB 3.45Å; M45-A49 PolarHBondContact O-N 3.19Å; Y46-A49 PolarHBondContact O-N 3.02Å; A49-N51 PolarHBondContact O-N 3.31Å; A49-M52 WeakPolarHBondContact O-CB 3.23Å; A49-M52 PolarHBondContact O-N 3.38Å; A49-M52 VanDerWaalsContact O-N 3.14Å; A49-F53 HydrophobicContact CB-CE2 4.41Å; A49-F53 WeakPolarHBondContact O-CD2 3.49Å; A49-F53 PolarHBondContact O-N 3.23Å
50A86.3Confident82.8Confident0 Ų052.7 Ų52.70%025%0.246CC..Hα-helixtrans-63.1-41.2178.900000112.6Y46 C47 R48 M52 F53 K54 A66 F67Y46-A50 VanDerWaalsContact O-CB 3.31Å; Y46-A50 WeakPolarHBondContact O-CB 3.11Å; Y46-A50 PolarHBondContact O-N 3.39Å; C47-A50 PolarHBondContact O-N 3.13Å; R48-A50 VanDerWaalsContact C-N 3.31Å; R48-A50 PolarHBondContact O-N 3.39Å; A50-M52 VanDerWaalsContact C-N 3.32Å; A50-M52 PolarHBondContact O-N 2.91Å; A50-F53 PolarHBondContact O-N 3.16Å; A50-K54 PolarHBondContact O-N 3.42Å; A50-A66 HydrophobicContact CB-CB 3.67Å; A50-F67 HydrophobicContact CB-CD1 3.78Å; A50-F67 HydrophobicContact CB-CD2 3.45Å; A50-F67 VanDerWaalsContact CB-CD2 3.45Å; A50-F67 HydrophobicContact CB-CE1 3.65Å; A50-F67 HydrophobicContact CB-CE2 3.28Å; A50-F67 HydrophobicContact CB-CG 3.67Å; A50-F67 HydrophobicContact CB-CZ 3.4Å
51N86.4Confident82Confident78 Ų7851.7 Ų51.742%0.41725%0.25SS..Hα-helixtrans-63.4-37.4172.9-78.1-36.4000112.4C47 R48 A49 K54 M55C47-N51 PolarHBondContact O-N 3.42Å; C47-N51 PolarHBondContact O-ND2 2.75Å; R48-N51 PolarHBondContact O-N 2.89Å; A49-N51 PolarHBondContact O-N 3.31Å; N51-K54 WeakPolarHBondContact O-CB 3.47Å; N51-K54 PolarHBondContact O-N 3.13Å; N51-M55 WeakPolarHBondContact O-CG 3.48Å; N51-M55 PolarHBondContact O-N 3.46Å
52M85.1Confident81.6Confident18 Ų1849.2 Ų49.29%0.08924%0.243CC..Hα-helixtrans-67.7-37.8175.8-68.8169.169.700112.3E9 A10 L13 R48 A49 A50 M55 A56E9-M52 HydrophobicContact CB-CE 3.57Å; E9-M52 HydrophobicContact CG-CE 3.54Å; E9-M52 WeakPolarHBondContact OE2-CE 3.33Å; A10-M52 HydrophobicContact CB-CB 3.87Å; L13-M52 HydrophobicContact CD1-CE 4.32Å; L13-M52 HydrophobicContact CD1-SD 3.53Å; L13-M52 VanDerWaalsContact CD1-SD 3.53Å; R48-M52 HydrophobicContact CG-SD 4.19Å; R48-M52 VanDerWaalsContact O-CG 3.3Å; R48-M52 WeakPolarHBondContact O-CG 3.3Å; R48-M52 PolarHBondContact O-N 2.96Å; A49-M52 WeakPolarHBondContact O-CB 3.23Å; A49-M52 PolarHBondContact O-N 3.38Å; A49-M52 VanDerWaalsContact O-N 3.14Å; A50-M52 VanDerWaalsContact C-N 3.32Å; A50-M52 PolarHBondContact O-N 2.91Å; M52-M55 PolarHBondContact O-N 3.27Å; M52-A56 PolarHBondContact O-N 3.13Å
53F85.2Confident81.5Confident5 Ų549.2 Ų49.22%0.02224%0.243CC..Hα-helixtrans-62.8-41.1170.6-70.4-58.8000112.2A10 I11 M14 A49 A50 M55 A56 K57 N58 A62 A63A10-F53 HydrophobicContact CB-CD1 3.96Å; A10-F53 HydrophobicContact CB-CD2 3.96Å; A10-F53 HydrophobicContact CB-CE1 3.65Å; A10-F53 HydrophobicContact CB-CE2 3.64Å; A10-F53 HydrophobicContact CB-CG 4.1Å; A10-F53 HydrophobicContact CB-CZ 3.47Å; A10-F53 VanDerWaalsContact CB-CZ 3.47Å; I11-F53 HydrophobicContact CG1-CE1 4.04Å; I11-F53 HydrophobicContact CG1-CZ 3.82Å; M14-F53 HydrophobicContact CG-CE2 4.28Å; M14-F53 HydrophobicContact SD-CE2 3.64Å; M14-F53 HydrophobicContact SD-CZ 4.22Å; A49-F53 HydrophobicContact CB-CE2 4.41Å; A49-F53 WeakPolarHBondContact O-CD2 3.49Å; A49-F53 PolarHBondContact O-N 3.23Å; A50-F53 PolarHBondContact O-N 3.16Å; F53-M55 PolarHBondContact O-N 2.64Å; F53-A56 PolarHBondContact O-N 3.09Å; F53-K57 PolarHBondContact O-N 2.84Å; F53-N58 CarbonylContact O-C 3.56Å; F53-N58 PolarHBondContact O-N 3.15Å; F53-A62 HydrophobicContact CD1-CB 4.08Å; F53-A62 HydrophobicContact CD2-CB 4.31Å; F53-A62 HydrophobicContact CE1-CB 4.09Å; F53-A62 HydrophobicContact CE2-CB 4.32Å; F53-A62 HydrophobicContact CG-CB 4.2Å; F53-A62 HydrophobicContact CZ-CB 4.21Å; F53-A63 HydrophobicContact CB-CB 3.67Å
54K82.2Confident81.5Confident53 Ų5349.2 Ų49.223%0.2324%0.243CC..Hα-helixtrans-58.7-44.6172.3-73.8172.562.3178.70111.6A50 N51 A56 K57 W59 A63 F67A50-K54 PolarHBondContact O-N 3.42Å; N51-K54 WeakPolarHBondContact O-CB 3.47Å; N51-K54 PolarHBondContact O-N 3.13Å; K54-A56 VanDerWaalsContact C-N 3.3Å; K54-A56 PolarHBondContact O-N 3.41Å; K54-K57 PolarHBondContact O-N 3.28Å; K54-W59 HydrophobicContact CB-CE3 4.16Å; K54-W59 HydrophobicContact CB-CH2 4.18Å; K54-W59 HydrophobicContact CB-CZ3 3.75Å; K54-W59 HydrophobicContact CD-CZ3 4.21Å; K54-W59 HydrophobicContact CG-CE3 3.81Å; K54-W59 HydrophobicContact CG-CZ3 3.67Å; K54-A63 HydrophobicContact CG-CB 4.36Å; K54-F67 HydrophobicContact CD-CE2 3.66Å; K54-F67 HydrophobicContact CD-CZ 4.12Å; K54-F67 HydrophobicContact CG-CE2 4.49Å
55M81.8Confident81.5Confident118 Ų11846.7 Ų46.758%0.58123%0.234SC*.Hα-helixtrans-63.3-34.9177.2-69.2-177.287.400112.9N51 M52 F53 K57N51-M55 WeakPolarHBondContact O-CG 3.48Å; N51-M55 PolarHBondContact O-N 3.46Å; M52-M55 PolarHBondContact O-N 3.27Å; F53-M55 PolarHBondContact O-N 2.64Å; M55-K57 PolarHBondContact O-N 3Å
56A81Confident81.5Confident7 Ų745.3 Ų45.36%0.05823%0.227CC..THydrogen-bonded Turntrans-73.1-1.1175.500000113.3N3 E7 M52 F53 K54 N58N3-A56 HydrophobicContact CB-CB 4.47Å; N3-A56 PolarHBondContact ND2-O 3.43Å; E7-A56 HydrophobicContact CG-CB 3.57Å; M52-A56 PolarHBondContact O-N 3.13Å; F53-A56 PolarHBondContact O-N 3.09Å; K54-A56 VanDerWaalsContact C-N 3.3Å; K54-A56 PolarHBondContact O-N 3.41Å; A56-N58 HydrophobicContact CB-CB 4.43Å; A56-N58 PolarHBondContact O-N 3.49Å
57K77.4Confident81.6Confident158 Ų15845.2 Ų45.269%0.68723%0.227SC*.THydrogen-bonded Turntrans59.817.5-169.3-56.1-179.3178.6-178.80113.5F53 K54 M55 W59F53-K57 PolarHBondContact O-N 2.84Å; K54-K57 PolarHBondContact O-N 3.28Å; M55-K57 PolarHBondContact O-N 3Å; K57-W59 PolarHBondContact O-N 3.25Å
58N73.7Confident81.7Confident44 Ų4444.5 Ų44.524%0.23522%0.222CC..  trans-86.265.6170.6-158.3-16.9000108.2E7 F53 A56 S60E7-N58 VanDerWaalsContact OE1-CB 3.32Å; E7-N58 WeakPolarHBondContact OE1-CB 3.49Å; E7-N58 PolarHBondContact OE1-ND2 2.97Å; F53-N58 CarbonylContact O-C 3.56Å; F53-N58 PolarHBondContact O-N 3.15Å; A56-N58 HydrophobicContact CB-CB 4.43Å; A56-N58 PolarHBondContact O-N 3.49Å; N58-S60 PolarHBondContact O-N 3.24Å; N58-S60 VanDerWaalsContact O-N 3.09Å; N58-S60 VanDerWaalsContact OD1-CB 3.31Å; N58-S60 WeakPolarHBondContact OD1-CB 3.43Å; N58-S60 PolarHBondContact OD1-OG 2.86Å
59W68.7Low81.8Confident90 Ų9040.5 Ų40.534%0.34121%0.209SC..THydrogen-bonded Turntrans-65.4-5.3177.7-52.798.4000112.8K54 K57 A93K54-W59 HydrophobicContact CB-CE3 4.16Å; K54-W59 HydrophobicContact CB-CH2 4.18Å; K54-W59 HydrophobicContact CB-CZ3 3.75Å; K54-W59 HydrophobicContact CD-CZ3 4.21Å; K54-W59 HydrophobicContact CG-CE3 3.81Å; K54-W59 HydrophobicContact CG-CZ3 3.67Å; K57-W59 PolarHBondContact O-N 3.25Å; W59-A93 CarbonylContact O-C 3.45Å
60S70.8Confident81.9Confident40 Ų4040.5 Ų40.528%0.2821%0.209SC..THydrogen-bonded Turntrans-64.3-168.9-172.880.20000113.7N58 A62 A63 G64 S97N58-S60 PolarHBondContact O-N 3.24Å; N58-S60 VanDerWaalsContact O-N 3.09Å; N58-S60 VanDerWaalsContact OD1-CB 3.31Å; N58-S60 WeakPolarHBondContact OD1-CB 3.43Å; N58-S60 PolarHBondContact OD1-OG 2.86Å; S60-A62 PolarHBondContact O-N 3.18Å; S60-A62 PolarHBondContact OG-N 3.38Å; S60-A63 PolarHBondContact O-N 3.06Å; S60-A63 VanDerWaalsContact O-N 3.15Å; S60-G64 PolarHBondContact O-N 3.22Å; S60-S97 WeakPolarHBondContact CA-OG 3.41Å
61A64.6Low82Confident49 Ų4940.5 Ų40.541%0.40521%0.209SC..Hα-helixtrans-44-31173.400000114.2N65A61-N65 WeakPolarHBondContact O-CA 3.38Å; A61-N65 WeakPolarHBondContact O-CB 3.1Å; A61-N65 PolarHBondContact O-N 3.07Å; A61-N65 PolarHBondContact O-ND2 2.83Å
62A76.9Confident82.1Confident27 Ų2744.2 Ų44.222%0.22322%0.217CC..Hα-helixtrans-65.4-49.1-18000000113.3F53 S60 A66F53-A62 HydrophobicContact CD1-CB 4.08Å; F53-A62 HydrophobicContact CD2-CB 4.31Å; F53-A62 HydrophobicContact CE1-CB 4.09Å; F53-A62 HydrophobicContact CE2-CB 4.32Å; F53-A62 HydrophobicContact CG-CB 4.2Å; F53-A62 HydrophobicContact CZ-CB 4.21Å; S60-A62 PolarHBondContact O-N 3.18Å; S60-A62 PolarHBondContact OG-N 3.38Å; A62-A66 WeakPolarHBondContact O-CB 3.35Å; A62-A66 PolarHBondContact O-N 2.87Å; A62-A66 VanDerWaalsContact O-N 3.08Å
63A82.1Confident82.2Confident0 Ų044 Ų440%022%0.216CC..Hα-helixtrans-67.3-46.7178.200000111.2F53 K54 S60 A66 F67 A93F53-A63 HydrophobicContact CB-CB 3.67Å; K54-A63 HydrophobicContact CG-CB 4.36Å; S60-A63 PolarHBondContact O-N 3.06Å; S60-A63 VanDerWaalsContact O-N 3.15Å; A63-A66 PolarHBondContact O-N 3.1Å; A63-F67 VanDerWaalsContact O-CD2 3.28Å; A63-F67 WeakPolarHBondContact O-CD2 3.39Å; A63-F67 PolarHBondContact O-N 3.06Å; A63-A93 HydrophobicContact CB-CB 4.27Å
64G85Confident82.2Confident0 Ų044.8 Ų44.80%022%0.22CC..Hα-helixtrans-61.3-44.9177.600000112.4S60 A66 F67 C68 Y94S60-G64 PolarHBondContact O-N 3.22Å; G64-A66 VanDerWaalsContact C-N 3.31Å; G64-A66 PolarHBondContact O-N 3.08Å; G64-F67 PolarHBondContact O-N 3.36Å; G64-C68 WeakPolarHBondContact O-CB 3.44Å; G64-C68 PolarHBondContact O-N 3.49Å; G64-C68 PolarHBondContact O-SG 2.87Å; G64-C68 VanDerWaalsContact O-SG 3.36Å; G64-Y94 VanDerWaalsContact C-CE2 3.47Å; G64-Y94 VanDerWaalsContact CA-CZ 3.43Å
65N86.8Confident82.3Confident79 Ų7947.4 Ų47.442%0.42223%0.234SC..Hα-helixtrans-65.3-37.7179.9-74.4-27.6000111A61 C68 K69 Y94A61-N65 WeakPolarHBondContact O-CA 3.38Å; A61-N65 WeakPolarHBondContact O-CB 3.1Å; A61-N65 PolarHBondContact O-N 3.07Å; A61-N65 PolarHBondContact O-ND2 2.83Å; N65-C68 PolarHBondContact O-N 2.98Å; N65-K69 WeakPolarHBondContact O-CB 3.45Å; N65-K69 WeakPolarHBondContact O-CG 3.42Å; N65-K69 PolarHBondContact O-N 3.47Å; N65-Y94 WeakPolarHBondContact CA-OH 3.34Å; N65-Y94 PolarHBondContact N-OH 3.37Å; N65-Y94 PolarHBondContact OD1-OH 3.08Å
66A88.7Confident82.4Confident0 Ų048.3 Ų48.30%024%0.237CC..Hα-helixtrans-63.6-46.6176.300000111.3M14 A50 A62 A63 G64 K69 A70M14-A66 HydrophobicContact CE-CB 4.49Å; M14-A66 HydrophobicContact CG-CB 4.46Å; M14-A66 HydrophobicContact SD-CB 3.85Å; A50-A66 HydrophobicContact CB-CB 3.67Å; A62-A66 WeakPolarHBondContact O-CB 3.35Å; A62-A66 PolarHBondContact O-N 2.87Å; A62-A66 VanDerWaalsContact O-N 3.08Å; A63-A66 PolarHBondContact O-N 3.1Å; G64-A66 VanDerWaalsContact C-N 3.31Å; G64-A66 PolarHBondContact O-N 3.08Å; A66-K69 PolarHBondContact O-N 2.95Å; A66-A70 PolarHBondContact O-N 3Å
67F90.1Very high82.5Confident3 Ų348.5 Ų48.51%0.01324%0.237CC..Hα-helixtrans-64.8-38.4174-77.7-59.7000112.9A50 K54 A63 G64 K69 A70 A71 D89 A90A50-F67 HydrophobicContact CB-CD1 3.78Å; A50-F67 HydrophobicContact CB-CD2 3.45Å; A50-F67 VanDerWaalsContact CB-CD2 3.45Å; A50-F67 HydrophobicContact CB-CE1 3.65Å; A50-F67 HydrophobicContact CB-CE2 3.28Å; A50-F67 HydrophobicContact CB-CG 3.67Å; A50-F67 HydrophobicContact CB-CZ 3.4Å; K54-F67 HydrophobicContact CD-CE2 3.66Å; K54-F67 HydrophobicContact CD-CZ 4.12Å; K54-F67 HydrophobicContact CG-CE2 4.49Å; A63-F67 VanDerWaalsContact O-CD2 3.28Å; A63-F67 WeakPolarHBondContact O-CD2 3.39Å; A63-F67 PolarHBondContact O-N 3.06Å; G64-F67 PolarHBondContact O-N 3.36Å; F67-K69 VanDerWaalsContact C-N 3.34Å; F67-K69 PolarHBondContact O-N 3.4Å; F67-A70 WeakPolarHBondContact O-CB 3.3Å; F67-A70 PolarHBondContact O-N 2.94Å; F67-A71 WeakPolarHBondContact O-CB 3.31Å; F67-A71 PolarHBondContact O-N 3.37Å; F67-D89 HydrophobicContact CD1-CB 4.01Å; F67-D89 HydrophobicContact CD2-CB 4.22Å; F67-D89 HydrophobicContact CE1-CB 4.02Å; F67-D89 HydrophobicContact CE2-CB 4.25Å; F67-D89 HydrophobicContact CG-CB 4.12Å; F67-D89 HydrophobicContact CZ-CB 4.15Å; F67-A90 HydrophobicContact CB-CB 3.61Å
68C89.8Confident82.7Confident11 Ų1149 Ų497%0.07424%0.242CC..Hα-helixtrans-61.9-40.8174.1-78.10000112.6G64 N65 A71 R72 C105G64-C68 WeakPolarHBondContact O-CB 3.44Å; G64-C68 PolarHBondContact O-N 3.49Å; G64-C68 PolarHBondContact O-SG 2.87Å; G64-C68 VanDerWaalsContact O-SG 3.36Å; N65-C68 PolarHBondContact O-N 2.98Å; C68-A71 PolarHBondContact O-N 3.26Å; C68-R72 VanDerWaalsContact O-CG 3.3Å; C68-R72 WeakPolarHBondContact O-CG 3.41Å; C68-R72 PolarHBondContact O-N 3.2Å; C68-R72 VanDerWaalsContact O-N 3.08Å; C68-C105 PolarHBondContact SG-SG 3.08Å
69K88.3Confident83.3Confident70 Ų7049.6 Ų49.630%0.30425%0.245SC..Hα-helixtrans-63.1-46.7174-77-177.1175-165.30110.6M14 D18 Y46 N65 A66 F67 A71 R72 L73M14-K69 HydrophobicContact CE-CD 4.12Å; D18-K69 IonicContact OD1-NZ 2.66Å; D18-K69 PolarHBondContact OD1-NZ 3.46Å; D18-K69 IonicContact OD2-NZ 3.17Å; D18-K69 PolarHBondContact OD2-NZ 2.84Å; Y46-K69 HydrophobicContact CD1-CB 4.14Å; Y46-K69 HydrophobicContact CD1-CD 4.21Å; Y46-K69 HydrophobicContact CE1-CB 4.16Å; Y46-K69 HydrophobicContact CE1-CD 3.63Å; Y46-K69 HydrophobicContact CG-CB 4.32Å; N65-K69 WeakPolarHBondContact O-CB 3.45Å; N65-K69 WeakPolarHBondContact O-CG 3.42Å; N65-K69 PolarHBondContact O-N 3.47Å; A66-K69 PolarHBondContact O-N 2.95Å; F67-K69 VanDerWaalsContact C-N 3.34Å; F67-K69 PolarHBondContact O-N 3.4Å; K69-A71 PolarHBondContact O-N 3.39Å; K69-R72 PolarHBondContact O-N 2.85Å; K69-L73 WeakPolarHBondContact O-CG 3.2Å; K69-L73 PolarHBondContact O-N 2.84Å; K69-L73 VanDerWaalsContact O-N 3.15Å
70A88.6Confident84.2Confident0 Ų050.2 Ų50.20%025%0.25CC..Hα-helixtrans-57.4-49.4175.100000111.7C43 A66 F67 R72 L73 H74C43-A70 PolarHBondContact SG-O 2.95Å; A66-A70 PolarHBondContact O-N 3Å; F67-A70 WeakPolarHBondContact O-CB 3.3Å; F67-A70 PolarHBondContact O-N 2.94Å; A70-R72 VanDerWaalsContact C-N 3.32Å; A70-R72 PolarHBondContact O-N 3.32Å; A70-L73 PolarHBondContact O-N 2.91Å; A70-H74 PolarHBondContact O-N 3.37Å
71A89.1Confident85.1Confident0 Ų052.4 Ų52.40%026%0.256CS..Hα-helixtrans-58.9-41-17900000112.7F67 C68 K69 H74 M75 S83 F87F67-A71 WeakPolarHBondContact O-CB 3.31Å; F67-A71 PolarHBondContact O-N 3.37Å; C68-A71 PolarHBondContact O-N 3.26Å; K69-A71 PolarHBondContact O-N 3.39Å; A71-H74 PolarHBondContact O-N 3.48Å; A71-M75 PolarHBondContact O-N 3.48Å; A71-S83 PolarHBondContact O-OG 3.19Å; A71-F87 HydrophobicContact CB-CB 4.48Å; A71-F87 HydrophobicContact CB-CD1 3.73Å; A71-F87 HydrophobicContact CB-CD2 3.6Å; A71-F87 HydrophobicContact CB-CE1 3.73Å; A71-F87 HydrophobicContact CB-CE2 3.6Å; A71-F87 HydrophobicContact CB-CG 3.65Å; A71-F87 HydrophobicContact CB-CZ 3.66Å
72R87.9Confident86.2Confident157 Ų15753.5 Ų53.559%0.59225%0.254SS*.Hα-helixtrans-65.7-36.4175.8-72.1174.6-172.6177.14.5112.5C68 K69 A70 M75 Q76 F87C68-R72 VanDerWaalsContact O-CG 3.3Å; C68-R72 WeakPolarHBondContact O-CG 3.41Å; C68-R72 PolarHBondContact O-N 3.2Å; C68-R72 VanDerWaalsContact O-N 3.08Å; K69-R72 PolarHBondContact O-N 2.85Å; A70-R72 VanDerWaalsContact C-N 3.32Å; A70-R72 PolarHBondContact O-N 3.32Å; R72-M75 WeakPolarHBondContact O-CB 3.41Å; R72-M75 PolarHBondContact O-N 3.49Å; R72-Q76 WeakPolarHBondContact O-CG 3.25Å; R72-Q76 PolarHBondContact O-N 3.12Å; R72-Q76 VanDerWaalsContact O-N 3.14Å; R72-F87 HydrophobicContact CG-CZ 4.35Å
73L86.9Confident86.7Confident13 Ų1352.2 Ų52.27%0.06824%0.244CC..Hα-helixtrans-70.8-42.8175.7-64.5172.7000111.3V21 V39 C43 Y46 K69 A70 M75 Q76 L77V21-L73 HydrophobicContact CG1-CD2 3.93Å; V21-L73 HydrophobicContact CG2-CD1 3.71Å; V21-L73 HydrophobicContact CG2-CD2 4.02Å; V39-L73 HydrophobicContact CG1-CB 4.16Å; V39-L73 HydrophobicContact CG1-CD2 4.11Å; C43-L73 HydrophobicContact CB-CB 4.49Å; Y46-L73 HydrophobicContact CD2-CD1 3.62Å; Y46-L73 HydrophobicContact CE2-CD1 3.36Å; K69-L73 WeakPolarHBondContact O-CG 3.2Å; K69-L73 PolarHBondContact O-N 2.84Å; K69-L73 VanDerWaalsContact O-N 3.15Å; A70-L73 PolarHBondContact O-N 2.91Å; L73-M75 PolarHBondContact O-N 3.42Å; L73-Q76 WeakPolarHBondContact O-CB 3.29Å; L73-Q76 PolarHBondContact O-N 2.94Å; L73-L77 WeakPolarHBondContact O-CG 3.34Å; L73-L77 PolarHBondContact O-N 3.31Å
74H86.1Confident87.1Confident22 Ų2252.2 Ų52.210%0.10224%0.244CC..Hα-helixtrans-56.6-36171.7-80.2-53.1000112.3C43 A70 A71 L77 Q78 N79 S86C43-H74 PolarHBondContact SG-CD2 2.78Å; C43-H74 PolarHBondContact SG-CE1 2.65Å; C43-H74 VanDerWaalsContact SG-CG 3.51Å; C43-H74 PolarHBondContact SG-NE2 3.1Å; A70-H74 PolarHBondContact O-N 3.37Å; A71-H74 PolarHBondContact O-N 3.48Å; H74-L77 CarbonylContact O-C 3.59Å; H74-L77 PolarHBondContact O-N 2.89Å; H74-Q78 PolarHBondContact O-N 3.44Å; H74-N79 PolarHBondContact O-N 2.71Å; H74-S86 PolarHBondContact CD2-OG 2.96Å
75M85.1Confident87.4Confident108 Ų10854.7 Ų54.753%0.53226%0.259SS..Hα-helixtrans-67.5-38.3175.2-164.3167.268.800112.4A71 R72 L73 L77 Q78A71-M75 PolarHBondContact O-N 3.48Å; R72-M75 WeakPolarHBondContact O-CB 3.41Å; R72-M75 PolarHBondContact O-N 3.49Å; L73-M75 PolarHBondContact O-N 3.42Å; M75-L77 VanDerWaalsContact C-N 3.29Å; M75-L77 PolarHBondContact O-N 2.89Å; M75-Q78 PolarHBondContact O-N 3.25Å; M75-Q78 VanDerWaalsContact O-N 3.15Å
76Q83.2Confident87.6Confident137 Ų13751.3 Ų51.364%0.6424%0.242SC*.Hα-helixtrans-64.7-33.7173.1-70178.3-4.900112.4R72 L73 Q78R72-Q76 WeakPolarHBondContact O-CG 3.25Å; R72-Q76 PolarHBondContact O-N 3.12Å; R72-Q76 VanDerWaalsContact O-N 3.14Å; L73-Q76 WeakPolarHBondContact O-CB 3.29Å; L73-Q76 PolarHBondContact O-N 2.94Å; Q76-Q78 PolarHBondContact O-N 3.47Å
77L83Confident87.8Confident10 Ų1052 Ų525%0.05225%0.245CC..THydrogen-bonded Turntrans-78.12.7175.3-62.4173.4000113.4H36 V39 E40 L73 H74 M75 N79H36-L77 VanDerWaalsContact CD2-CD2 3.44Å; H36-L77 WeakPolarHBondContact CD2-CD2 3.41Å; H36-L77 WeakPolarHBondContact NE2-CD2 3.34Å; V39-L77 HydrophobicContact CB-CD2 3.93Å; V39-L77 HydrophobicContact CG1-CD1 3.99Å; V39-L77 HydrophobicContact CG1-CD2 3.73Å; V39-L77 HydrophobicContact CG1-CG 3.83Å; E40-L77 HydrophobicContact CB-CD1 4.04Å; L73-L77 WeakPolarHBondContact O-CG 3.34Å; L73-L77 PolarHBondContact O-N 3.31Å; H74-L77 CarbonylContact O-C 3.59Å; H74-L77 PolarHBondContact O-N 2.89Å; M75-L77 VanDerWaalsContact C-N 3.29Å; M75-L77 PolarHBondContact O-N 2.89Å; L77-N79 PolarHBondContact O-N 3.5Å; L77-N79 VanDerWaalsContact O-N 3.14Å
78Q81.9Confident87.9Confident170 Ų17053 Ų5379%0.79425%0.25SC*.THydrogen-bonded Turntrans59.115.2-173.3-58.1-162.7-19.600115.4H74 M75 Q76 K80H74-Q78 PolarHBondContact O-N 3.44Å; M75-Q78 PolarHBondContact O-N 3.25Å; M75-Q78 VanDerWaalsContact O-N 3.15Å; Q76-Q78 PolarHBondContact O-N 3.47Å; Q78-K80 VanDerWaalsContact C-N 3.32Å; Q78-K80 PolarHBondContact O-N 3.43Å
79N85.9Confident88Confident55 Ų5554.9 Ų54.929%0.29426%0.259SS..  trans-83.274.8174.5-70.5-7.2000110.3H74 L77 H81 D82 S83H74-N79 PolarHBondContact O-N 2.71Å; L77-N79 PolarHBondContact O-N 3.5Å; L77-N79 VanDerWaalsContact O-N 3.14Å; N79-H81 VanDerWaalsContact C-N 3.35Å; N79-H81 PolarHBondContact O-N 3.02Å; N79-D82 HydrophobicContact CB-CB 4.45Å; N79-D82 PolarHBondContact O-N 3.38Å; N79-S83 WeakPolarHBondContact O-CB 3.38Å; N79-S83 PolarHBondContact O-N 3.42Å
80K88Confident88Confident103 Ų10351.6 Ų51.645%0.44825%0.245SC..Hα-helixtrans-56.3-43.7-176.5-68.6-168.2178.2-164.80113.2Q78 D82 S83 A84 I112 D115 M116Q78-K80 VanDerWaalsContact C-N 3.32Å; Q78-K80 PolarHBondContact O-N 3.43Å; K80-D82 PolarHBondContact O-N 3.05Å; K80-S83 PolarHBondContact O-N 2.84Å; K80-A84 WeakPolarHBondContact O-CB 2.81Å; K80-A84 PolarHBondContact O-N 2.98Å; K80-I112 HydrophobicContact CB-CG2 3.83Å; K80-I112 HydrophobicContact CG-CG2 4.47Å; K80-I112 WeakPolarHBondContact O-CG2 3.31Å; K80-D115 IonicContact NZ-OD2 3.89Å; K80-M116 HydrophobicContact CB-CG 4.33Å; K80-M116 HydrophobicContact CB-SD 3.85Å; K80-M116 HydrophobicContact CD-CG 4.38Å
81H88.8Confident88.1Confident87 Ų8751.6 Ų51.640%0.40325%0.245SC..Hα-helixtrans-62-46.3-177.7-176.1-87.4000112.8N79 A84 T85 M116N79-H81 VanDerWaalsContact C-N 3.35Å; N79-H81 PolarHBondContact O-N 3.02Å; H81-A84 PolarHBondContact O-N 3.16Å; H81-T85 PolarHBondContact O-N 3.37Å; H81-T85 PolarHBondContact O-OG1 3.46Å; H81-M116 HydrophobicContact CB-CE 3.93Å
82D87.3Confident88Confident71 Ų7155.9 Ų55.938%0.3827%0.268SS..Hα-helixtrans-75.2-32.2-177.8-57.9-26.2000111.4N79 K80 T85 S86N79-D82 HydrophobicContact CB-CB 4.45Å; N79-D82 PolarHBondContact O-N 3.38Å; K80-D82 PolarHBondContact O-N 3.05Å; D82-T85 PolarHBondContact O-N 3.39Å; D82-S86 WeakPolarHBondContact O-CB 3.06Å; D82-S86 PolarHBondContact O-N 3.45Å; D82-S86 PolarHBondContact O-OG 3.13Å
83S88.9Confident88Confident0 Ų048.5 Ų48.50%024%0.241CC..Hα-helixtrans-59.8-50.1170.4-174.50000111.3A71 N79 K80 T85 S86 F87A71-S83 PolarHBondContact O-OG 3.19Å; N79-S83 WeakPolarHBondContact O-CB 3.38Å; N79-S83 PolarHBondContact O-N 3.42Å; K80-S83 PolarHBondContact O-N 2.84Å; S83-T85 VanDerWaalsContact C-N 3.35Å; S83-T85 PolarHBondContact O-N 3.28Å; S83-S86 PolarHBondContact O-N 3.24Å; S83-F87 VanDerWaalsContact O-CD2 3.27Å; S83-F87 WeakPolarHBondContact O-CD2 3.35Å; S83-F87 PolarHBondContact O-N 2.94Å
84A90.7Very high88Confident0 Ų048.1 Ų48.10%024%0.238CC..Hα-helixtrans-62.3-42.2179.100000112K80 H81 S86 F87 I88 I112 Y113K80-A84 WeakPolarHBondContact O-CB 2.81Å; K80-A84 PolarHBondContact O-N 2.98Å; H81-A84 PolarHBondContact O-N 3.16Å; A84-S86 PolarHBondContact O-N 2.9Å; A84-F87 PolarHBondContact O-N 3.12Å; A84-I88 WeakPolarHBondContact O-CG1 3.01Å; A84-I88 PolarHBondContact O-N 2.96Å; A84-I112 HydrophobicContact CB-CB 4.04Å; A84-I112 HydrophobicContact CB-CD1 4.33Å; A84-I112 HydrophobicContact CB-CG2 3.81Å; A84-Y113 HydrophobicContact CB-CD1 4.49Å; A84-Y113 HydrophobicContact CB-CD2 4.04Å; A84-Y113 HydrophobicContact CB-CE1 4.03Å; A84-Y113 HydrophobicContact CB-CE2 3.49Å; A84-Y113 VanDerWaalsContact CB-CE2 3.49Å; A84-Y113 HydrophobicContact CB-CG 4.5Å; A84-Y113 VanDerWaalsContact CB-CZ 3.5Å
85T91.4Very high87.9Confident52 Ų5250.8 Ų50.832%0.31925%0.25SC..Hα-helixtrans-61.3-44.4175.9-55.70000111.5H81 D82 S83 F87 I88 D89H81-T85 PolarHBondContact O-N 3.37Å; H81-T85 PolarHBondContact O-OG1 3.46Å; D82-T85 PolarHBondContact O-N 3.39Å; S83-T85 VanDerWaalsContact C-N 3.35Å; S83-T85 PolarHBondContact O-N 3.28Å; T85-F87 VanDerWaalsContact C-N 3.33Å; T85-F87 PolarHBondContact O-N 3.23Å; T85-I88 WeakPolarHBondContact O-CB 3.27Å; T85-I88 PolarHBondContact O-N 3.37Å; T85-D89 PolarHBondContact O-N 3.2Å
86S91.2Very high87.5Confident8 Ų853.3 Ų53.36%0.05626%0.258CS..Hα-helixtrans-63.5-37.2176.8-60.90000112.3H74 D82 S83 A84 D89 A90H74-S86 PolarHBondContact CD2-OG 2.96Å; D82-S86 WeakPolarHBondContact O-CB 3.06Å; D82-S86 PolarHBondContact O-N 3.45Å; D82-S86 PolarHBondContact O-OG 3.13Å; S83-S86 PolarHBondContact O-N 3.24Å; A84-S86 PolarHBondContact O-N 2.9Å; S86-D89 PolarHBondContact O-N 3.17Å; S86-A90 PolarHBondContact O-N 3.02Å
87F92.8Very high87.4Confident16 Ų1649.8 Ų49.87%0.0725%0.248CC..Hα-helixtrans-66.7-36.9173.5-83.2-58.2000112.8A71 R72 S83 A84 T85 A90 G91 C105 A108 A109 I112A71-F87 HydrophobicContact CB-CB 4.48Å; A71-F87 HydrophobicContact CB-CD1 3.73Å; A71-F87 HydrophobicContact CB-CD2 3.6Å; A71-F87 HydrophobicContact CB-CE1 3.73Å; A71-F87 HydrophobicContact CB-CE2 3.6Å; A71-F87 HydrophobicContact CB-CG 3.65Å; A71-F87 HydrophobicContact CB-CZ 3.66Å; R72-F87 HydrophobicContact CG-CZ 4.35Å; S83-F87 VanDerWaalsContact O-CD2 3.27Å; S83-F87 WeakPolarHBondContact O-CD2 3.35Å; S83-F87 PolarHBondContact O-N 2.94Å; A84-F87 PolarHBondContact O-N 3.12Å; T85-F87 VanDerWaalsContact C-N 3.33Å; T85-F87 PolarHBondContact O-N 3.23Å; F87-A90 WeakPolarHBondContact O-CB 3.37Å; F87-A90 PolarHBondContact O-N 3.27Å; F87-G91 PolarHBondContact O-N 2.99Å; F87-C105 HydrophobicContact CD1-CB 4.46Å; F87-A108 HydrophobicContact CD1-CB 4.21Å; F87-A108 HydrophobicContact CD2-CB 4.25Å; F87-A108 HydrophobicContact CE1-CB 4.2Å; F87-A108 HydrophobicContact CE2-CB 4.24Å; F87-A108 HydrophobicContact CG-CB 4.25Å; F87-A108 HydrophobicContact CZ-CB 4.22Å; F87-A109 HydrophobicContact CB-CB 3.87Å; F87-I112 HydrophobicContact CD2-CD1 3.81Å; F87-I112 HydrophobicContact CE2-CD1 3.95Å
88I92.1Very high87.4Confident23 Ų2352.2 Ų52.212%0.11826%0.261CS..Hα-helixtrans-63.8-45.3173-65.6158.9000110.5A84 T85 A90 G91 N92 A109 Y113 H125A84-I88 WeakPolarHBondContact O-CG1 3.01Å; A84-I88 PolarHBondContact O-N 2.96Å; T85-I88 WeakPolarHBondContact O-CB 3.27Å; T85-I88 PolarHBondContact O-N 3.37Å; I88-A90 VanDerWaalsContact C-N 3.29Å; I88-A90 PolarHBondContact O-N 3.34Å; I88-G91 PolarHBondContact O-N 3.38Å; I88-G91 VanDerWaalsContact O-N 3.15Å; I88-N92 PolarHBondContact O-N 2.79Å; I88-N92 PolarHBondContact O-ND2 3.06Å; I88-A109 HydrophobicContact CG1-CB 3.96Å; I88-Y113 HydrophobicContact CD1-CE2 3.49Å; I88-Y113 VanDerWaalsContact CD1-CE2 3.49Å; I88-Y113 WeakPolarHBondContact CD1-OH 3.39Å; I88-Y113 HydrophobicContact CG1-CE2 4.33Å; I88-H125 WeakPolarHBondContact CD1-NE2 3.37Å
89D90.1Very high87.6Confident51 Ų5145.3 Ų45.327%0.27323%0.231SC..Hα-helixtrans-62.6-37.9177.9-83.6-32.3000112.1F67 T85 S86 A93F67-D89 HydrophobicContact CD1-CB 4.01Å; F67-D89 HydrophobicContact CD2-CB 4.22Å; F67-D89 HydrophobicContact CE1-CB 4.02Å; F67-D89 HydrophobicContact CE2-CB 4.25Å; F67-D89 HydrophobicContact CG-CB 4.12Å; F67-D89 HydrophobicContact CZ-CB 4.15Å; T85-D89 PolarHBondContact O-N 3.2Å; S86-D89 PolarHBondContact O-N 3.17Å; D89-A93 PolarHBondContact O-N 2.89Å; D89-A93 VanDerWaalsContact O-N 3.12Å
90A89.9Confident87.6Confident0 Ų046.7 Ų46.70%024%0.238CC..Hα-helixtrans-60.4-50.8169.900000111.2F67 S86 F87 I88 N92 A93 Y94 C105F67-A90 HydrophobicContact CB-CB 3.61Å; S86-A90 PolarHBondContact O-N 3.02Å; F87-A90 WeakPolarHBondContact O-CB 3.37Å; F87-A90 PolarHBondContact O-N 3.27Å; I88-A90 VanDerWaalsContact C-N 3.29Å; I88-A90 PolarHBondContact O-N 3.34Å; A90-N92 VanDerWaalsContact C-N 3.3Å; A90-N92 PolarHBondContact O-N 3.08Å; A90-A93 WeakPolarHBondContact O-CB 3.27Å; A90-A93 PolarHBondContact O-N 3.45Å; A90-Y94 HydrophobicContact CB-CD2 4.35Å; A90-Y94 HydrophobicContact CB-CE2 4.22Å; A90-Y94 WeakPolarHBondContact O-CD2 3.45Å; A90-Y94 PolarHBondContact O-N 3.22Å; A90-C105 HydrophobicContact CB-CB 4.3Å
91G89.3Confident87.5Confident1 Ų144.7 Ų44.71%0.0123%0.231CC..Hα-helixtrans-57-41.4178.800000112.9F87 I88 A93 Y94 K95F87-G91 PolarHBondContact O-N 2.99Å; I88-G91 PolarHBondContact O-N 3.38Å; I88-G91 VanDerWaalsContact O-N 3.15Å; G91-A93 VanDerWaalsContact C-N 3.35Å; G91-A93 PolarHBondContact O-N 3.48Å; G91-Y94 PolarHBondContact O-N 3.35Å; G91-K95 WeakPolarHBondContact O-CB 3.45Å; G91-K95 PolarHBondContact O-N 3.48Å
92N87.8Confident87.5Confident89 Ų8940.5 Ų40.548%0.47621%0.211SC..Hα-helixtrans-65.9-34.3176.1-74-29000113.2I88 A90I88-N92 PolarHBondContact O-N 2.79Å; I88-N92 PolarHBondContact O-ND2 3.06Å; A90-N92 VanDerWaalsContact C-N 3.3Å; A90-N92 PolarHBondContact O-N 3.08Å
93A87.4Confident87.6Confident2 Ų237.4 Ų37.42%0.01720%0.195CC..Hα-helixtrans-69-49.2173.400000110.6W59 A63 D89 A90 G91 K95W59-A93 CarbonylContact O-C 3.45Å; A63-A93 HydrophobicContact CB-CB 4.27Å; D89-A93 PolarHBondContact O-N 2.89Å; D89-A93 VanDerWaalsContact O-N 3.12Å; A90-A93 WeakPolarHBondContact O-CB 3.27Å; A90-A93 PolarHBondContact O-N 3.45Å; G91-A93 VanDerWaalsContact C-N 3.35Å; G91-A93 PolarHBondContact O-N 3.48Å; A93-K95 VanDerWaalsContact C-N 3.3Å; A93-K95 PolarHBondContact O-N 2.86Å
94Y87.7Confident87.7Confident6 Ų643.2 Ų43.22%0.02422%0.22CC..Hα-helixtrans-65.6-27.6179.4-72.8-64.1000113.8G64 N65 A90 G91 K96 S97 D98 E101G64-Y94 VanDerWaalsContact C-CE2 3.47Å; G64-Y94 VanDerWaalsContact CA-CZ 3.43Å; N65-Y94 WeakPolarHBondContact CA-OH 3.34Å; N65-Y94 PolarHBondContact N-OH 3.37Å; N65-Y94 PolarHBondContact OD1-OH 3.08Å; A90-Y94 HydrophobicContact CB-CD2 4.35Å; A90-Y94 HydrophobicContact CB-CE2 4.22Å; A90-Y94 WeakPolarHBondContact O-CD2 3.45Å; A90-Y94 PolarHBondContact O-N 3.22Å; G91-Y94 PolarHBondContact O-N 3.35Å; Y94-K96 PolarHBondContact O-N 3.09Å; Y94-S97 PolarHBondContact O-N 3.42Å; Y94-D98 HydrophobicContact CD1-CB 4.31Å; Y94-D98 CarbonylContact O-C 3.31Å; Y94-D98 VanDerWaalsContact O-C 3.31Å; Y94-D98 PolarHBondContact O-N 3.46Å; Y94-D98 VanDerWaalsContact O-O 3.13Å; Y94-E101 HydrophobicContact CD1-CB 3.97Å; Y94-E101 HydrophobicContact CD2-CB 4.38Å; Y94-E101 HydrophobicContact CE1-CB 4.11Å; Y94-E101 HydrophobicContact CG-CB 4.11Å
95K83.5Confident87.8Confident77 Ų7743.4 Ų43.434%0.33522%0.221SC..THydrogen-bonded Turntrans-50.7-29.6-178.3-175.8168.5-178.5169.40113.7G91 A93 I132G91-K95 WeakPolarHBondContact O-CB 3.45Å; G91-K95 PolarHBondContact O-N 3.48Å; A93-K95 VanDerWaalsContact C-N 3.3Å; A93-K95 PolarHBondContact O-N 2.86Å; K95-I132 HydrophobicContact CD-CD1 4.2Å; K95-I132 HydrophobicContact CD-CG1 4.09Å; K95-I132 HydrophobicContact CG-CD1 4.21Å; K95-I132 HydrophobicContact CG-CG1 4.12Å
96K77.1Confident87.8Confident161 Ų16141.1 Ų41.170%0.721%0.207SC*.THydrogen-bonded Turntrans-95.9-8.2179.4-64.7-176.8179.5178.90114.8Y94Y94-K96 PolarHBondContact O-N 3.09Å
97S79.9Confident87.9Confident63 Ų6343.1 Ų43.144%0.44122%0.217SC..THydrogen-bonded Turntrans-126.4-44.4-169.8-63.30000112.8S60 Y94S60-S97 WeakPolarHBondContact CA-OG 3.41Å; Y94-S97 PolarHBondContact O-N 3.42Å
98D84.4Confident87.8Confident61 Ų6143.7 Ų43.733%0.32623%0.225SC..  trans-143.599.6177.5-170.6-25.6000110Y94 N100 E101 A102Y94-D98 HydrophobicContact CD1-CB 4.31Å; Y94-D98 CarbonylContact O-C 3.31Å; Y94-D98 VanDerWaalsContact O-C 3.31Å; Y94-D98 PolarHBondContact O-N 3.46Å; Y94-D98 VanDerWaalsContact O-O 3.13Å; D98-N100 VanDerWaalsContact C-N 3.27Å; D98-N100 PolarHBondContact O-N 3.37Å; D98-N100 WeakPolarHBondContact OD1-CB 3.49Å; D98-N100 PolarHBondContact OD1-N 3.03Å; D98-E101 HydrophobicContact CB-CB 4.23Å; D98-E101 PolarHBondContact O-N 3.46Å; D98-E101 PolarHBondContact OD1-N 3.13Å; D98-E101 WeakPolarHBondContact OD2-CG 3.35Å; D98-A102 PolarHBondContact O-N 2.93Å; D98-A102 VanDerWaalsContact O-N 3.08Å
99P85.1Confident87.9Confident25 Ų2542.6 Ų42.616%0.16222%0.22CC..Hα-helixtrans-64.8-29.9-178.825.3-33000112.6A102 I103 I132 E136P99-A102 WeakPolarHBondContact O-CB 3.43Å; P99-A102 PolarHBondContact O-N 3.06Å; P99-I103 WeakPolarHBondContact O-CD1 3.07Å; P99-I103 VanDerWaalsContact O-CG1 3.23Å; P99-I103 WeakPolarHBondContact O-CG1 3.44Å; P99-I103 PolarHBondContact O-N 3.34Å; P99-I132 HydrophobicContact CB-CG2 3.65Å; P99-E136 HydrophobicContact CB-CB 3.99Å; P99-E136 HydrophobicContact CB-CG 4.12Å; P99-E136 HydrophobicContact CG-CB 3.99Å; P99-E136 HydrophobicContact CG-CG 4.34Å
100N86.4Confident88Confident84 Ų8440.4 Ų40.445%0.44921%0.207SC..Hα-helixtrans-71.1-42.9-178.6-71.6-52.1000111.6D98 A102 I103 K104D98-N100 VanDerWaalsContact C-N 3.27Å; D98-N100 PolarHBondContact O-N 3.37Å; D98-N100 WeakPolarHBondContact OD1-CB 3.49Å; D98-N100 PolarHBondContact OD1-N 3.03Å; N100-A102 VanDerWaalsContact C-N 3.33Å; N100-I103 PolarHBondContact O-N 3.26Å; N100-K104 PolarHBondContact O-N 2.92Å
101E86.9Confident88.2Confident61 Ų6145.2 Ų45.229%0.28523%0.233SC..Hα-helixtrans-68.9-33.5174-71.3-58.3134.700111.9Y94 D98 I103 K104 C105Y94-E101 HydrophobicContact CD1-CB 3.97Å; Y94-E101 HydrophobicContact CD2-CB 4.38Å; Y94-E101 HydrophobicContact CE1-CB 4.11Å; Y94-E101 HydrophobicContact CG-CB 4.11Å; D98-E101 HydrophobicContact CB-CB 4.23Å; D98-E101 PolarHBondContact O-N 3.46Å; D98-E101 PolarHBondContact OD1-N 3.13Å; D98-E101 WeakPolarHBondContact OD2-CG 3.35Å; E101-I103 VanDerWaalsContact C-N 3.33Å; E101-I103 PolarHBondContact O-N 3.05Å; E101-K104 PolarHBondContact O-N 3.49Å; E101-K104 IonicContact OE1-NZ 3.63Å; E101-K104 PolarHBondContact OE1-NZ 3.18Å; E101-C105 PolarHBondContact O-N 2.81Å; E101-C105 PolarHBondContact O-SG 2.83Å
102A88.3Confident88.4Confident0 Ų045.9 Ų45.90%024%0.237CC..Hα-helixtrans-58.3-46172.900000111.7D98 P99 N100 K104 C105 L106 I132D98-A102 PolarHBondContact O-N 2.93Å; D98-A102 VanDerWaalsContact O-N 3.08Å; P99-A102 WeakPolarHBondContact O-CB 3.43Å; P99-A102 PolarHBondContact O-N 3.06Å; N100-A102 VanDerWaalsContact C-N 3.33Å; A102-K104 PolarHBondContact O-N 2.89Å; A102-C105 PolarHBondContact O-N 3.06Å; A102-L106 WeakPolarHBondContact O-CG 3.49Å; A102-L106 PolarHBondContact O-N 3.03Å; A102-I132 HydrophobicContact CB-CD1 4.27Å
103I89.4Confident88.6Confident5 Ų542.1 Ų42.13%0.02622%0.216CC..Hα-helixtrans-62.7-42.6178.6-67157.9000111.1P99 N100 E101 C105 L106 N107 I129 I132 Y133 L137P99-I103 WeakPolarHBondContact O-CD1 3.07Å; P99-I103 VanDerWaalsContact O-CG1 3.23Å; P99-I103 WeakPolarHBondContact O-CG1 3.44Å; P99-I103 PolarHBondContact O-N 3.34Å; N100-I103 PolarHBondContact O-N 3.26Å; E101-I103 VanDerWaalsContact C-N 3.33Å; E101-I103 PolarHBondContact O-N 3.05Å; I103-C105 VanDerWaalsContact C-N 3.34Å; I103-C105 PolarHBondContact O-N 2.91Å; I103-L106 PolarHBondContact O-N 3.32Å; I103-N107 WeakPolarHBondContact CG2-ND2 3.44Å; I103-N107 WeakPolarHBondContact O-CB 3.47Å; I103-N107 PolarHBondContact O-N 3.05Å; I103-N107 PolarHBondContact O-ND2 3.24Å; I103-I129 HydrophobicContact CG1-CG2 4.3Å; I103-I129 HydrophobicContact CG2-CG2 4.03Å; I103-I132 HydrophobicContact CD1-CG2 3.99Å; I103-I132 HydrophobicContact CG1-CG2 4.05Å; I103-Y133 HydrophobicContact CD1-CD1 4.09Å; I103-Y133 HydrophobicContact CD1-CD2 4.41Å; I103-Y133 HydrophobicContact CD1-CE1 3.58Å; I103-Y133 HydrophobicContact CD1-CE2 3.98Å; I103-Y133 HydrophobicContact CD1-CG 4.46Å; I103-Y133 HydrophobicContact CG1-CE2 4.45Å; I103-Y133 HydrophobicContact CG2-CE2 4.28Å; I103-L137 HydrophobicContact CD1-CD1 4.03Å
104K90.6Very high88.8Confident122 Ų12243.8 Ų43.853%0.5323%0.226SC..Hα-helixtrans-60.4-43.2176.3-70.1176.4-171168.80112.1N100 E101 A102 A108N100-K104 PolarHBondContact O-N 2.92Å; E101-K104 PolarHBondContact O-N 3.49Å; E101-K104 IonicContact OE1-NZ 3.63Å; E101-K104 PolarHBondContact OE1-NZ 3.18Å; A102-K104 PolarHBondContact O-N 2.89Å; K104-A108 PolarHBondContact O-N 3.23Å; K104-A108 VanDerWaalsContact O-N 3.09Å
105C91.8Very high89Confident5 Ų549.2 Ų49.23%0.03426%0.255CS..Hα-helixtrans-65.4-43.7178-62.80000111.7C68 F87 A90 E101 A102 I103 A108 A109C68-C105 PolarHBondContact SG-SG 3.08Å; F87-C105 HydrophobicContact CD1-CB 4.46Å; A90-C105 HydrophobicContact CB-CB 4.3Å; E101-C105 PolarHBondContact O-N 2.81Å; E101-C105 PolarHBondContact O-SG 2.83Å; A102-C105 PolarHBondContact O-N 3.06Å; I103-C105 VanDerWaalsContact C-N 3.34Å; I103-C105 PolarHBondContact O-N 2.91Å; C105-A108 PolarHBondContact O-N 3.5Å; C105-A109 PolarHBondContact O-N 2.85Å
106L92.4Very high89.3Confident4 Ų448.6 Ų48.62%0.02125%0.254CS..Hα-helixtrans-67.5-38.1178.6-69.3172000112.3A102 I103 A109 I110 I129 I132A102-L106 WeakPolarHBondContact O-CG 3.49Å; A102-L106 PolarHBondContact O-N 3.03Å; I103-L106 PolarHBondContact O-N 3.32Å; L106-A109 WeakPolarHBondContact O-CB 3.48Å; L106-A109 PolarHBondContact O-N 3.38Å; L106-I110 VanDerWaalsContact O-CG1 3.29Å; L106-I110 WeakPolarHBondContact O-CG1 3.35Å; L106-I110 PolarHBondContact O-N 3.09Å; L106-I129 HydrophobicContact CB-CD1 3.63Å; L106-I129 HydrophobicContact CB-CG1 3.58Å; L106-I129 HydrophobicContact CD1-CG1 3.76Å; L106-I129 HydrophobicContact CG-CG1 4.33Å; L106-I132 HydrophobicContact CD1-CD1 3.74Å
107N92.6Very high89.9Confident49 Ų4942.8 Ų42.826%0.26224%0.24SC..Hα-helixtrans-61.6-44.5173-79.5-33.5000111.5I103 A109 I110 D111 I129I103-N107 WeakPolarHBondContact CG2-ND2 3.44Å; I103-N107 WeakPolarHBondContact O-CB 3.47Å; I103-N107 PolarHBondContact O-N 3.05Å; I103-N107 PolarHBondContact O-ND2 3.24Å; N107-A109 VanDerWaalsContact C-N 3.28Å; N107-A109 PolarHBondContact O-N 3.3Å; N107-I110 WeakPolarHBondContact O-CB 3.13Å; N107-I110 PolarHBondContact O-N 3.27Å; N107-I110 VanDerWaalsContact O-N 3.12Å; N107-D111 PolarHBondContact O-N 2.82Å; N107-I129 WeakPolarHBondContact OD1-CD1 3.19Å
108A92.3Very high90.4Very high29 Ų2945.2 Ų45.224%0.2424%0.239CC..Hα-helixtrans-60.4-38.117500000112.3F87 K104 C105 I112F87-A108 HydrophobicContact CD1-CB 4.21Å; F87-A108 HydrophobicContact CD2-CB 4.25Å; F87-A108 HydrophobicContact CE1-CB 4.2Å; F87-A108 HydrophobicContact CE2-CB 4.24Å; F87-A108 HydrophobicContact CG-CB 4.25Å; F87-A108 HydrophobicContact CZ-CB 4.22Å; K104-A108 PolarHBondContact O-N 3.23Å; K104-A108 VanDerWaalsContact O-N 3.09Å; C105-A108 PolarHBondContact O-N 3.5Å; A108-I112 WeakPolarHBondContact O-CD1 3.46Å; A108-I112 VanDerWaalsContact O-CG1 3.29Å; A108-I112 WeakPolarHBondContact O-CG1 3.21Å; A108-I112 PolarHBondContact O-N 3.16Å
109A92.8Very high90.8Very high0 Ų045.5 Ų45.50%024%0.238CC..Hα-helixtrans-66.1-41.9173.900000112.2F87 I88 C105 L106 N107 I112 Y113F87-A109 HydrophobicContact CB-CB 3.87Å; I88-A109 HydrophobicContact CG1-CB 3.96Å; C105-A109 PolarHBondContact O-N 2.85Å; L106-A109 WeakPolarHBondContact O-CB 3.48Å; L106-A109 PolarHBondContact O-N 3.38Å; N107-A109 VanDerWaalsContact C-N 3.28Å; N107-A109 PolarHBondContact O-N 3.3Å; A109-I112 PolarHBondContact O-N 3.01Å; A109-Y113 HydrophobicContact CB-CD2 4.5Å; A109-Y113 HydrophobicContact CB-CE2 4.42Å; A109-Y113 WeakPolarHBondContact O-CD2 3.48Å; A109-Y113 PolarHBondContact O-N 3.34Å
110I93.4Very high91.1Very high4 Ų446.9 Ų46.92%0.02125%0.246CC..Hα-helixtrans-59.9-46.5177.4-74.9164.1000110.8L106 N107 I112 Y113 T114 A122 H125 H126 I129L106-I110 VanDerWaalsContact O-CG1 3.29Å; L106-I110 WeakPolarHBondContact O-CG1 3.35Å; L106-I110 PolarHBondContact O-N 3.09Å; N107-I110 WeakPolarHBondContact O-CB 3.13Å; N107-I110 PolarHBondContact O-N 3.27Å; N107-I110 VanDerWaalsContact O-N 3.12Å; I110-I112 VanDerWaalsContact C-N 3.28Å; I110-I112 PolarHBondContact O-N 3.11Å; I110-Y113 PolarHBondContact O-N 3.36Å; I110-T114 VanDerWaalsContact O-CB 3.27Å; I110-T114 WeakPolarHBondContact O-CB 3.38Å; I110-T114 PolarHBondContact O-N 3.03Å; I110-T114 PolarHBondContact O-OG1 3.14Å; I110-A122 HydrophobicContact CG2-CB 4.42Å; I110-H125 HydrophobicContact CD1-CB 3.98Å; I110-H125 HydrophobicContact CG1-CB 3.72Å; I110-H126 VanDerWaalsContact CG2-NE2 3.29Å; I110-H126 WeakPolarHBondContact CG2-NE2 3.48Å; I110-I129 HydrophobicContact CD1-CD1 3.42Å; I110-I129 VanDerWaalsContact CD1-CD1 3.42Å; I110-I129 HydrophobicContact CD1-CG1 4.49Å
111D92.7Very high91.4Very high101 Ų10144.8 Ų44.854%0.5423%0.234SC..Hα-helixtrans-57.4-44.9178.6-66.7-21.7000110.4N107 T114 D115N107-D111 PolarHBondContact O-N 2.82Å; D111-T114 PolarHBondContact O-N 3.18Å; D111-D115 WeakPolarHBondContact O-CB 3.38Å; D111-D115 PolarHBondContact O-N 3.31Å
112I93.1Very high91.6Very high16 Ų1641.9 Ų41.98%0.08222%0.221CC..Hα-helixtrans-65.1-44.4177.4-61164.1000111.7K80 A84 F87 A108 A109 I110 T114 D115 M116K80-I112 HydrophobicContact CB-CG2 3.83Å; K80-I112 HydrophobicContact CG-CG2 4.47Å; K80-I112 WeakPolarHBondContact O-CG2 3.31Å; A84-I112 HydrophobicContact CB-CB 4.04Å; A84-I112 HydrophobicContact CB-CD1 4.33Å; A84-I112 HydrophobicContact CB-CG2 3.81Å; F87-I112 HydrophobicContact CD2-CD1 3.81Å; F87-I112 HydrophobicContact CE2-CD1 3.95Å; A108-I112 WeakPolarHBondContact O-CD1 3.46Å; A108-I112 VanDerWaalsContact O-CG1 3.29Å; A108-I112 WeakPolarHBondContact O-CG1 3.21Å; A108-I112 PolarHBondContact O-N 3.16Å; A109-I112 PolarHBondContact O-N 3.01Å; I110-I112 VanDerWaalsContact C-N 3.28Å; I110-I112 PolarHBondContact O-N 3.11Å; I112-T114 VanDerWaalsContact C-N 3.3Å; I112-T114 PolarHBondContact O-N 2.87Å; I112-D115 WeakPolarHBondContact O-CB 3.31Å; I112-D115 PolarHBondContact O-N 3.18Å; I112-M116 HydrophobicContact CG2-CG 4.48Å; I112-M116 HydrophobicContact CG2-SD 3.94Å; I112-M116 WeakPolarHBondContact O-CB 3.44Å; I112-M116 WeakPolarHBondContact O-CG 3.43Å; I112-M116 PolarHBondContact O-N 3.43Å
113Y93.1Very high91.9Very high9 Ų941.9 Ų41.94%0.03522%0.221CC..Hα-helixtrans-67.8-31.9178.7-78.2-59000112.9A84 I88 A109 I110 M116 G117 R118 I121A84-Y113 HydrophobicContact CB-CD1 4.49Å; A84-Y113 HydrophobicContact CB-CD2 4.04Å; A84-Y113 HydrophobicContact CB-CE1 4.03Å; A84-Y113 HydrophobicContact CB-CE2 3.49Å; A84-Y113 VanDerWaalsContact CB-CE2 3.49Å; A84-Y113 HydrophobicContact CB-CG 4.5Å; A84-Y113 VanDerWaalsContact CB-CZ 3.5Å; I88-Y113 HydrophobicContact CD1-CE2 3.49Å; I88-Y113 VanDerWaalsContact CD1-CE2 3.49Å; I88-Y113 WeakPolarHBondContact CD1-OH 3.39Å; I88-Y113 HydrophobicContact CG1-CE2 4.33Å; A109-Y113 HydrophobicContact CB-CD2 4.5Å; A109-Y113 HydrophobicContact CB-CE2 4.42Å; A109-Y113 WeakPolarHBondContact O-CD2 3.48Å; A109-Y113 PolarHBondContact O-N 3.34Å; I110-Y113 PolarHBondContact O-N 3.36Å; Y113-M116 CarbonylContact O-C 3.6Å; Y113-M116 PolarHBondContact O-N 3.43Å; Y113-G117 PolarHBondContact O-N 3.41Å; Y113-R118 HydrophobicContact CD1-CB 4.03Å; Y113-R118 HydrophobicContact CD1-CG 4.49Å; Y113-R118 PolarHBondContact O-N 2.93Å; Y113-I121 HydrophobicContact CD1-CB 4.42Å; Y113-I121 HydrophobicContact CD1-CG2 4.08Å; Y113-I121 HydrophobicContact CD2-CG2 3.86Å; Y113-I121 HydrophobicContact CE1-CD1 4.42Å; Y113-I121 HydrophobicContact CE1-CG2 4.03Å; Y113-I121 HydrophobicContact CE2-CG2 3.84Å; Y113-I121 HydrophobicContact CG-CB 4.45Å; Y113-I121 HydrophobicContact CG-CG2 4Å
114T92Very high92Very high38 Ų3847.3 Ų47.323%0.23324%0.244CC..Hα-helixtrans-67.8-46.5175.7-57.40000109.8I110 D111 I112 M116 G117 F119I110-T114 VanDerWaalsContact O-CB 3.27Å; I110-T114 WeakPolarHBondContact O-CB 3.38Å; I110-T114 PolarHBondContact O-N 3.03Å; I110-T114 PolarHBondContact O-OG1 3.14Å; D111-T114 PolarHBondContact O-N 3.18Å; I112-T114 VanDerWaalsContact C-N 3.3Å; I112-T114 PolarHBondContact O-N 2.87Å; T114-M116 PolarHBondContact O-N 3.24Å; T114-G117 PolarHBondContact O-N 3.09Å; T114-F119 HydrophobicContact CG2-CE1 3.96Å
115D91.2Very high92.2Very high119 Ų11942.8 Ų42.864%0.63623%0.225SC*.Hα-helixtrans-58.5-31.5171.9-84.35.4000113.1K80 D111 I112 G117K80-D115 IonicContact NZ-OD2 3.89Å; D111-D115 WeakPolarHBondContact O-CB 3.38Å; D111-D115 PolarHBondContact O-N 3.31Å; I112-D115 WeakPolarHBondContact O-CB 3.31Å; I112-D115 PolarHBondContact O-N 3.18Å; D115-G117 VanDerWaalsContact C-N 3.31Å
116M89.6Confident92.3Very high65 Ų6542.7 Ų42.732%0.3222%0.224SC..THydrogen-bonded Turntrans-83-4177.1-69.8176.267.100113.5K80 H81 I112 Y113 T114 R118K80-M116 HydrophobicContact CB-CG 4.33Å; K80-M116 HydrophobicContact CB-SD 3.85Å; K80-M116 HydrophobicContact CD-CG 4.38Å; H81-M116 HydrophobicContact CB-CE 3.93Å; I112-M116 HydrophobicContact CG2-CG 4.48Å; I112-M116 HydrophobicContact CG2-SD 3.94Å; I112-M116 WeakPolarHBondContact O-CB 3.44Å; I112-M116 WeakPolarHBondContact O-CG 3.43Å; I112-M116 PolarHBondContact O-N 3.43Å; Y113-M116 CarbonylContact O-C 3.6Å; Y113-M116 PolarHBondContact O-N 3.43Å; T114-M116 PolarHBondContact O-N 3.24Å; M116-R118 VanDerWaalsContact C-N 3.31Å; M116-R118 HydrophobicContact CB-CG 4.15Å; M116-R118 PolarHBondContact O-N 3.03Å
117G90.1Very high92.3Very high38 Ų3844 Ų4439%0.39223%0.23SC..THydrogen-bonded Turntrans71.319.8-175.800000114.4Y113 T114 D115 F119Y113-G117 PolarHBondContact O-N 3.41Å; T114-G117 PolarHBondContact O-N 3.09Å; D115-G117 VanDerWaalsContact C-N 3.31Å; G117-F119 PolarHBondContact O-N 3.46Å
118R91.1Very high92.2Very high115 Ų11543.3 Ų43.343%0.43423%0.23SC..  trans-96.461.1-178.8-59.9-65.1-70.3-77.72.3111Y113 M116 T120 I121 A122Y113-R118 HydrophobicContact CD1-CB 4.03Å; Y113-R118 HydrophobicContact CD1-CG 4.49Å; Y113-R118 PolarHBondContact O-N 2.93Å; M116-R118 VanDerWaalsContact C-N 3.31Å; M116-R118 HydrophobicContact CB-CG 4.15Å; M116-R118 PolarHBondContact O-N 3.03Å; R118-T120 VanDerWaalsContact C-N 3.32Å; R118-T120 PolarHBondContact O-N 3.16Å; R118-I121 HydrophobicContact CB-CD1 4.41Å; R118-I121 PolarHBondContact O-N 3.31Å; R118-I121 VanDerWaalsContact O-N 3.09Å; R118-A122 PolarHBondContact O-N 3.11Å; R118-A122 VanDerWaalsContact O-N 3.11Å
119F91.7Very high92.1Very high67 Ų6742 Ų4229%0.29422%0.218SC..Hα-helixtrans-60.7-35-174.2-59.6-70.8000113.8T114 G117 I121 A122 A123 Y154 E158T114-F119 HydrophobicContact CG2-CE1 3.96Å; G117-F119 PolarHBondContact O-N 3.46Å; F119-I121 VanDerWaalsContact C-N 3.28Å; F119-I121 PolarHBondContact O-N 3.41Å; F119-A122 PolarHBondContact O-N 3.31Å; F119-A123 VanDerWaalsContact O-CB 3.32Å; F119-A123 WeakPolarHBondContact O-CB 3.26Å; F119-A123 PolarHBondContact O-N 3.06Å; F119-Y154 HydrophobicContact CB-CD1 4.3Å; F119-Y154 HydrophobicContact CB-CG 4.36Å; F119-Y154 AromaticContact CD1-CD1 3.73Å; F119-Y154 HydrophobicContact CD1-CD1 3.73Å; F119-Y154 AromaticContact CD1-CE1 3.69Å; F119-Y154 HydrophobicContact CD1-CE1 3.69Å; F119-Y154 HydrophobicContact CD1-CG 4.42Å; F119-Y154 HydrophobicContact CE1-CE1 4.13Å; F119-Y154 HydrophobicContact CG-CD1 4.34Å; F119-E158 HydrophobicContact CB-CG 4.17Å
120T91.6Very high92Very high54 Ų5442 Ų4233%0.33122%0.218SC..Hα-helixtrans-60.6-36.9176-30.60000112.6R118 K124 Y155R118-T120 VanDerWaalsContact C-N 3.32Å; R118-T120 PolarHBondContact O-N 3.16Å; T120-K124 WeakPolarHBondContact O-CG 3.47Å; T120-K124 PolarHBondContact O-N 3.05Å; T120-Y155 HydrophobicContact CG2-CD1 4.49Å; T120-Y155 HydrophobicContact CG2-CE1 3.92Å
121I92.1Very high91.8Very high39 Ų3945.3 Ų45.320%0.223%0.234CC..Hα-helixtrans-77.5-43.8179.6-64174.6000109.5Y113 R118 F119 A123 K124 H125Y113-I121 HydrophobicContact CD1-CB 4.42Å; Y113-I121 HydrophobicContact CD1-CG2 4.08Å; Y113-I121 HydrophobicContact CD2-CG2 3.86Å; Y113-I121 HydrophobicContact CE1-CD1 4.42Å; Y113-I121 HydrophobicContact CE1-CG2 4.03Å; Y113-I121 HydrophobicContact CE2-CG2 3.84Å; Y113-I121 HydrophobicContact CG-CB 4.45Å; Y113-I121 HydrophobicContact CG-CG2 4Å; R118-I121 HydrophobicContact CB-CD1 4.41Å; R118-I121 PolarHBondContact O-N 3.31Å; R118-I121 VanDerWaalsContact O-N 3.09Å; F119-I121 VanDerWaalsContact C-N 3.28Å; F119-I121 PolarHBondContact O-N 3.41Å; I121-A123 VanDerWaalsContact C-N 3.28Å; I121-A123 PolarHBondContact O-N 3.38Å; I121-K124 WeakPolarHBondContact O-CB 3.12Å; I121-K124 PolarHBondContact O-N 2.72Å; I121-K124 VanDerWaalsContact O-N 3.12Å; I121-H125 PolarHBondContact O-CD2 3.39Å; I121-H125 PolarHBondContact O-N 2.64Å
122A92Very high91.5Very high0 Ų040.6 Ų40.60%021%0.209CC..Hα-helixtrans-54.3-45.3173.800000111.5I110 R118 F119 K124 H125 H126 Y154I110-A122 HydrophobicContact CG2-CB 4.42Å; R118-A122 PolarHBondContact O-N 3.11Å; R118-A122 VanDerWaalsContact O-N 3.11Å; F119-A122 PolarHBondContact O-N 3.31Å; A122-K124 VanDerWaalsContact C-N 3.35Å; A122-K124 PolarHBondContact O-N 3.49Å; A122-H125 PolarHBondContact O-N 3.14Å; A122-H125 VanDerWaalsContact O-N 3.09Å; A122-H126 PolarHBondContact O-CD2 2.87Å; A122-H126 PolarHBondContact O-N 2.79Å; A122-Y154 HydrophobicContact CB-CE2 4.4Å
123A93.8Very high91.2Very high0 Ų040.8 Ų40.80%021%0.209CC..Hα-helixtrans-60.9-38.1177.800000113.2F119 I121 H125 H126 I127 A151 Y154 Y155F119-A123 VanDerWaalsContact O-CB 3.32Å; F119-A123 WeakPolarHBondContact O-CB 3.26Å; F119-A123 PolarHBondContact O-N 3.06Å; I121-A123 VanDerWaalsContact C-N 3.28Å; I121-A123 PolarHBondContact O-N 3.38Å; A123-H125 VanDerWaalsContact C-N 3.31Å; A123-H125 PolarHBondContact O-N 3.17Å; A123-H126 PolarHBondContact O-N 3.32Å; A123-I127 WeakPolarHBondContact O-CG1 3.45Å; A123-I127 PolarHBondContact O-N 3.27Å; A123-A151 HydrophobicContact CB-CB 4.41Å; A123-Y154 HydrophobicContact CB-CD2 4.31Å; A123-Y155 HydrophobicContact CB-CD1 4.35Å; A123-Y155 HydrophobicContact CB-CD2 3.83Å; A123-Y155 HydrophobicContact CB-CE1 4.04Å; A123-Y155 HydrophobicContact CB-CE2 3.44Å; A123-Y155 VanDerWaalsContact CB-CE2 3.44Å; A123-Y155 HydrophobicContact CB-CG 4.25Å
124K93Very high90.7Very high120 Ų12043.3 Ų43.352%0.52222%0.22SC..Hα-helixtrans-62-39.6173.6-70.8178.6-177.8179.70112.1T120 I121 A122 I127 S128 Y155T120-K124 WeakPolarHBondContact O-CG 3.47Å; T120-K124 PolarHBondContact O-N 3.05Å; I121-K124 WeakPolarHBondContact O-CB 3.12Å; I121-K124 PolarHBondContact O-N 2.72Å; I121-K124 VanDerWaalsContact O-N 3.12Å; A122-K124 VanDerWaalsContact C-N 3.35Å; A122-K124 PolarHBondContact O-N 3.49Å; K124-I127 PolarHBondContact O-N 3.38Å; K124-S128 PolarHBondContact O-N 2.66Å; K124-S128 PolarHBondContact O-OG 2.76Å; K124-Y155 WeakPolarHBondContact CG-OH 3.48Å; K124-Y155 PolarHBondContact N-OH 2.63Å
125H93.6Very high90.1Very high26 Ų2644.9 Ų44.912%0.1223%0.233CC..Hα-helixtrans-75-33.5178.1-65-55.4000112.2I88 I110 I121 A122 A123 I127 S128 I129I88-H125 WeakPolarHBondContact CD1-NE2 3.37Å; I110-H125 HydrophobicContact CD1-CB 3.98Å; I110-H125 HydrophobicContact CG1-CB 3.72Å; I121-H125 PolarHBondContact O-CD2 3.39Å; I121-H125 PolarHBondContact O-N 2.64Å; A122-H125 PolarHBondContact O-N 3.14Å; A122-H125 VanDerWaalsContact O-N 3.09Å; A123-H125 VanDerWaalsContact C-N 3.31Å; A123-H125 PolarHBondContact O-N 3.17Å; H125-I127 PolarHBondContact O-N 3.43Å; H125-S128 WeakPolarHBondContact O-CB 3.21Å; H125-S128 PolarHBondContact O-N 2.99Å; H125-S128 VanDerWaalsContact O-N 3.13Å; H125-I129 WeakPolarHBondContact O-CG1 3.48Å; H125-I129 PolarHBondContact O-N 2.91Å
126H93.7Very high89.1Confident4 Ų444.7 Ų44.72%0.01923%0.228CC..Hα-helixtrans-58.3-45.5168.7-88.8-82.1000112.2I110 A122 A123 S128 I129 A130 H147 Q150 A151 Y154I110-H126 VanDerWaalsContact CG2-NE2 3.29Å; I110-H126 WeakPolarHBondContact CG2-NE2 3.48Å; A122-H126 PolarHBondContact O-CD2 2.87Å; A122-H126 PolarHBondContact O-N 2.79Å; A123-H126 PolarHBondContact O-N 3.32Å; H126-S128 VanDerWaalsContact C-N 3.31Å; H126-S128 PolarHBondContact O-N 2.78Å; H126-I129 PolarHBondContact O-N 3.03Å; H126-A130 PolarHBondContact O-N 2.92Å; H126-H147 AromaticContact CE1-ND1 3.67Å; H126-H147 AromaticContact ND1-CG 3.97Å; H126-H147 AromaticContact ND1-ND1 3.17Å; H126-H147 PolarHBondContact ND1-ND1 3.02Å; H126-H147 VanDerWaalsContact ND1-ND1 3.17Å; H126-Q150 PolarHBondContact CE1-OE1 3.14Å; H126-A151 HydrophobicContact CB-CB 3.76Å; H126-Y154 AromaticContact CD2-CE2 3.73Å; H126-Y154 AromaticContact NE2-CE2 3.64Å
127I92.7Very high87.8Confident30 Ų3043.2 Ų43.215%0.15422%0.222CC..Hα-helixtrans-58-46.3172.6-68163.5000110.3A123 K124 H125 I129 A130 E131 Y148 A151 Y155 C167A123-I127 WeakPolarHBondContact O-CG1 3.45Å; A123-I127 PolarHBondContact O-N 3.27Å; K124-I127 PolarHBondContact O-N 3.38Å; H125-I127 PolarHBondContact O-N 3.43Å; I127-I129 VanDerWaalsContact C-N 3.3Å; I127-I129 PolarHBondContact O-N 2.67Å; I127-A130 PolarHBondContact O-N 3.42Å; I127-A130 VanDerWaalsContact O-N 3.12Å; I127-E131 HydrophobicContact CG2-CG 4.24Å; I127-E131 WeakPolarHBondContact O-CG 3.1Å; I127-E131 PolarHBondContact O-N 3.12Å; I127-Y148 HydrophobicContact CB-CE1 4.41Å; I127-Y148 HydrophobicContact CG1-CD1 4.37Å; I127-Y148 HydrophobicContact CG1-CE1 4.3Å; I127-Y148 HydrophobicContact CG2-CE1 4.04Å; I127-A151 HydrophobicContact CG1-CB 4.04Å; I127-Y155 HydrophobicContact CD1-CE2 3.67Å; I127-C167 VanDerWaalsContact CD1-SG 3.58Å
128S91.3Very high86.3Confident36 Ų3647 Ų4725%0.25224%0.237SC..Hα-helixtrans-62.1-37.3-178.5-57.60000112.5K124 H125 H126 I132K124-S128 PolarHBondContact O-N 2.66Å; K124-S128 PolarHBondContact O-OG 2.76Å; H125-S128 WeakPolarHBondContact O-CB 3.21Å; H125-S128 PolarHBondContact O-N 2.99Å; H125-S128 VanDerWaalsContact O-N 3.13Å; H126-S128 VanDerWaalsContact C-N 3.31Å; H126-S128 PolarHBondContact O-N 2.78Å; S128-I132 WeakPolarHBondContact O-CD1 3.34Å; S128-I132 VanDerWaalsContact O-CG1 3.27Å; S128-I132 WeakPolarHBondContact O-CG1 3.27Å; S128-I132 PolarHBondContact O-N 3.22Å
129I90.5Very high84.7Confident0 Ų049.2 Ų49.20%026%0.257CS..Hα-helixtrans-65.4-45.2173.5-71.3176.3000110.4I103 L106 N107 I110 H125 H126 I127 E131 I132 Y133I103-I129 HydrophobicContact CG1-CG2 4.3Å; I103-I129 HydrophobicContact CG2-CG2 4.03Å; L106-I129 HydrophobicContact CB-CD1 3.63Å; L106-I129 HydrophobicContact CB-CG1 3.58Å; L106-I129 HydrophobicContact CD1-CG1 3.76Å; L106-I129 HydrophobicContact CG-CG1 4.33Å; N107-I129 WeakPolarHBondContact OD1-CD1 3.19Å; I110-I129 HydrophobicContact CD1-CD1 3.42Å; I110-I129 VanDerWaalsContact CD1-CD1 3.42Å; I110-I129 HydrophobicContact CD1-CG1 4.49Å; H125-I129 WeakPolarHBondContact O-CG1 3.48Å; H125-I129 PolarHBondContact O-N 2.91Å; H126-I129 PolarHBondContact O-N 3.03Å; I127-I129 VanDerWaalsContact C-N 3.3Å; I127-I129 PolarHBondContact O-N 2.67Å; I129-E131 VanDerWaalsContact C-N 3.35Å; I129-E131 PolarHBondContact O-N 3.41Å; I129-I132 WeakPolarHBondContact O-CB 3.09Å; I129-I132 PolarHBondContact O-N 3.15Å; I129-I132 VanDerWaalsContact O-N 3.14Å; I129-Y133 HydrophobicContact CG2-CD2 3.78Å; I129-Y133 HydrophobicContact CG2-CE2 3.55Å; I129-Y133 WeakPolarHBondContact O-CD2 3.33Å; I129-Y133 PolarHBondContact O-N 2.8Å
130A90Very high83.4Confident0 Ų048 Ų480%025%0.253CS..Hα-helixtrans-62.5-41.917900000111.7H126 I127 I132 Y133 E134 H147 Y148H126-A130 PolarHBondContact O-N 2.92Å; I127-A130 PolarHBondContact O-N 3.42Å; I127-A130 VanDerWaalsContact O-N 3.12Å; A130-I132 VanDerWaalsContact C-N 3.29Å; A130-I132 PolarHBondContact O-N 3.43Å; A130-Y133 WeakPolarHBondContact O-CB 3.42Å; A130-Y133 PolarHBondContact O-N 2.84Å; A130-Y133 VanDerWaalsContact O-N 3.12Å; A130-E134 WeakPolarHBondContact O-CG 3.27Å; A130-E134 PolarHBondContact O-N 3.36Å; A130-H147 HydrophobicContact CB-CB 4.08Å; A130-Y148 HydrophobicContact CB-CD1 4.05Å; A130-Y148 HydrophobicContact CB-CD2 3.46Å; A130-Y148 VanDerWaalsContact CB-CD2 3.46Å; A130-Y148 HydrophobicContact CB-CE1 3.92Å; A130-Y148 HydrophobicContact CB-CE2 3.29Å; A130-Y148 HydrophobicContact CB-CG 3.83Å
131E88.4Confident82.4Confident74 Ų7448.7 Ų48.735%0.34625%0.253SS..Hα-helixtrans-60.6-34.2172.9-71.6177.117500113I127 I129 E134 S135I127-E131 HydrophobicContact CG2-CG 4.24Å; I127-E131 WeakPolarHBondContact O-CG 3.1Å; I127-E131 PolarHBondContact O-N 3.12Å; I129-E131 VanDerWaalsContact C-N 3.35Å; I129-E131 PolarHBondContact O-N 3.41Å; E131-E134 PolarHBondContact O-N 3.06Å; E131-S135 PolarHBondContact O-N 3.5Å; E131-S135 VanDerWaalsContact O-N 3.08Å; E131-S135 PolarHBondContact O-OG 3.29Å
132I87.6Confident81.7Confident2 Ų254 Ų541%0.0128%0.275CS..Hα-helixtrans-68.5-40.1174.8-68163.9000110.6K95 P99 A102 I103 L106 S128 I129 A130 E134 S135 E136K95-I132 HydrophobicContact CD-CD1 4.2Å; K95-I132 HydrophobicContact CD-CG1 4.09Å; K95-I132 HydrophobicContact CG-CD1 4.21Å; K95-I132 HydrophobicContact CG-CG1 4.12Å; P99-I132 HydrophobicContact CB-CG2 3.65Å; A102-I132 HydrophobicContact CB-CD1 4.27Å; I103-I132 HydrophobicContact CD1-CG2 3.99Å; I103-I132 HydrophobicContact CG1-CG2 4.05Å; L106-I132 HydrophobicContact CD1-CD1 3.74Å; S128-I132 WeakPolarHBondContact O-CD1 3.34Å; S128-I132 VanDerWaalsContact O-CG1 3.27Å; S128-I132 WeakPolarHBondContact O-CG1 3.27Å; S128-I132 PolarHBondContact O-N 3.22Å; I129-I132 WeakPolarHBondContact O-CB 3.09Å; I129-I132 PolarHBondContact O-N 3.15Å; I129-I132 VanDerWaalsContact O-N 3.14Å; A130-I132 VanDerWaalsContact C-N 3.29Å; A130-I132 PolarHBondContact O-N 3.43Å; I132-E134 VanDerWaalsContact C-N 3.32Å; I132-S135 PolarHBondContact O-N 3.46Å; I132-E136 PolarHBondContact O-N 3.49Å; I132-E136 VanDerWaalsContact O-N 3.13Å
133Y86.8Confident81.3Confident21 Ų2159.4 Ų59.48%0.08230%0.298CS..Hα-helixtrans-63.3-39.3173.6-78.5-60.3000111.7I103 I129 A130 L137 I140 K143 H147I103-Y133 HydrophobicContact CD1-CD1 4.09Å; I103-Y133 HydrophobicContact CD1-CD2 4.41Å; I103-Y133 HydrophobicContact CD1-CE1 3.58Å; I103-Y133 HydrophobicContact CD1-CE2 3.98Å; I103-Y133 HydrophobicContact CD1-CG 4.46Å; I103-Y133 HydrophobicContact CG1-CE2 4.45Å; I103-Y133 HydrophobicContact CG2-CE2 4.28Å; I129-Y133 HydrophobicContact CG2-CD2 3.78Å; I129-Y133 HydrophobicContact CG2-CE2 3.55Å; I129-Y133 WeakPolarHBondContact O-CD2 3.33Å; I129-Y133 PolarHBondContact O-N 2.8Å; A130-Y133 WeakPolarHBondContact O-CB 3.42Å; A130-Y133 PolarHBondContact O-N 2.84Å; A130-Y133 VanDerWaalsContact O-N 3.12Å; Y133-L137 HydrophobicContact CD1-CB 4.12Å; Y133-L137 HydrophobicContact CD1-CD1 3.57Å; Y133-L137 HydrophobicContact CD1-CG 4.47Å; Y133-L137 HydrophobicContact CE1-CD1 3.67Å; Y133-L137 CarbonylContact O-C 3.56Å; Y133-L137 PolarHBondContact O-N 3.22Å; Y133-L137 VanDerWaalsContact O-O 3.11Å; Y133-I140 HydrophobicContact CD1-CB 3.96Å; Y133-I140 HydrophobicContact CD1-CD1 4.13Å; Y133-I140 HydrophobicContact CD1-CG2 4.22Å; Y133-I140 HydrophobicContact CE1-CB 4.33Å; Y133-I140 HydrophobicContact CE1-CD1 3.89Å; Y133-I140 HydrophobicContact CE1-CG2 4.2Å; Y133-K143 HydrophobicContact CD2-CB 4.44Å; Y133-K143 HydrophobicContact CE1-CD 4.46Å; Y133-K143 HydrophobicContact CE2-CB 4.15Å; Y133-H147 AromaticContact CE2-CD2 3.74Å; Y133-H147 AromaticContact CE2-NE2 3.81Å
134E82.4Confident80.9Confident61 Ų6159.5 Ų59.529%0.28530%0.299SS..Hα-helixtrans-62.3-44.1176.2-69.1177.4178.100113A130 E131 I132 Y148 Y174A130-E134 WeakPolarHBondContact O-CG 3.27Å; A130-E134 PolarHBondContact O-N 3.36Å; E131-E134 PolarHBondContact O-N 3.06Å; I132-E134 VanDerWaalsContact C-N 3.32Å; E134-Y148 WeakPolarHBondContact OE1-CE2 3.48Å; E134-Y148 VanDerWaalsContact OE1-CZ 3.24Å; E134-Y148 PolarHBondContact OE1-OH 3.37Å; E134-Y174 HydrophobicContact CG-CE2 4.23Å; E134-Y174 WeakPolarHBondContact CG-OH 3.01Å; E134-Y174 WeakPolarHBondContact OE1-CE2 3.22Å; E134-Y174 VanDerWaalsContact OE1-CZ 3.24Å; E134-Y174 PolarHBondContact OE1-OH 3.17Å; E134-Y174 PolarHBondContact OE2-OH 3.08Å
135S79.3Confident80.7Confident71 Ų7154.1 Ų54.150%0.49728%0.276SS..Hα-helixtrans-85.3-37.6-17066.90000114.2E131 I132E131-S135 PolarHBondContact O-N 3.5Å; E131-S135 VanDerWaalsContact O-N 3.08Å; E131-S135 PolarHBondContact O-OG 3.29Å; I132-S135 PolarHBondContact O-N 3.46Å
136E69.8Low80.6Confident115 Ų11555.3 Ų55.354%0.53729%0.29SS..Hα-helixtrans-111.9-17.3-168.5-57.9-60.7142.900113.8P99 I132P99-E136 HydrophobicContact CB-CB 3.99Å; P99-E136 HydrophobicContact CB-CG 4.12Å; P99-E136 HydrophobicContact CG-CB 3.99Å; P99-E136 HydrophobicContact CG-CG 4.34Å; I132-E136 PolarHBondContact O-N 3.49Å; I132-E136 VanDerWaalsContact O-N 3.13Å
137L62.2Low80.5Confident34 Ų3456.3 Ų56.318%0.17830%0.295CS..  trans-131.769.2-169-63171.9000110.7I103 Y133 D139 I140I103-L137 HydrophobicContact CD1-CD1 4.03Å; Y133-L137 HydrophobicContact CD1-CB 4.12Å; Y133-L137 HydrophobicContact CD1-CD1 3.57Å; Y133-L137 HydrophobicContact CD1-CG 4.47Å; Y133-L137 HydrophobicContact CE1-CD1 3.67Å; Y133-L137 CarbonylContact O-C 3.56Å; Y133-L137 PolarHBondContact O-N 3.22Å; Y133-L137 VanDerWaalsContact O-O 3.11Å; L137-D139 PolarHBondContact O-N 3.47Å; L137-I140 HydrophobicContact CB-CD1 4.14Å; L137-I140 HydrophobicContact CB-CG1 4.2Å; L137-I140 HydrophobicContact CD1-CD1 4.15Å; L137-I140 PolarHBondContact O-N 2.89Å
138V58.7Low80.5Confident117 Ų11755.1 Ų55.171%0.70929%0.288SS*.THydrogen-bonded Turntrans-49.1-23.7-175.4-179.60000114.4
139D56.9Low80.6Confident163 Ų16355.9 Ų55.987%0.87229%0.288SS*.THydrogen-bonded Turntrans-95.36-177.2-87.4-35.6000115.6L137L137-D139 PolarHBondContact O-N 3.47Å
140I64.8Low80.7Confident40 Ų4059.7 Ų59.721%0.20531%0.306CS..  trans-121.437.4-173.1-36.4-176000113.5Y133 L137 K142 K143 A144Y133-I140 HydrophobicContact CD1-CB 3.96Å; Y133-I140 HydrophobicContact CD1-CD1 4.13Å; Y133-I140 HydrophobicContact CD1-CG2 4.22Å; Y133-I140 HydrophobicContact CE1-CB 4.33Å; Y133-I140 HydrophobicContact CE1-CD1 3.89Å; Y133-I140 HydrophobicContact CE1-CG2 4.2Å; L137-I140 HydrophobicContact CB-CD1 4.14Å; L137-I140 HydrophobicContact CB-CG1 4.2Å; L137-I140 HydrophobicContact CD1-CD1 4.15Å; L137-I140 PolarHBondContact O-N 2.89Å; I140-K142 PolarHBondContact O-N 3.39Å; I140-K143 HydrophobicContact CG2-CB 3.44Å; I140-K143 VanDerWaalsContact CG2-CB 3.44Å; I140-K143 HydrophobicContact CG2-CD 3.43Å; I140-K143 VanDerWaalsContact CG2-CD 3.43Å; I140-K143 HydrophobicContact CG2-CG 3.3Å; I140-K143 PolarHBondContact O-N 2.98Å; I140-A144 PolarHBondContact O-N 3.49Å; I140-A144 VanDerWaalsContact O-N 3.14Å
141E70Confident80.8Confident70 Ų7059.7 Ų59.733%0.32731%0.306SS..Hα-helixtrans-54.6-35.5175.4-62.4-177.9153.900112.2K143 A144 I145 L178E141-K143 PolarHBondContact O-N 2.88Å; E141-A144 PolarHBondContact O-N 3.39Å; E141-I145 WeakPolarHBondContact O-CG1 3.44Å; E141-I145 PolarHBondContact O-N 2.86Å; E141-L178 HydrophobicContact CB-CD1 4.05Å; E141-L178 HydrophobicContact CB-CD2 4.33Å; E141-L178 HydrophobicContact CB-CG 4.4Å; E141-L178 WeakPolarHBondContact OE2-CD2 3.32Å
142K78.4Confident81.1Confident150 Ų15056.3 Ų56.365%0.65229%0.29SS*.Hα-helixtrans-62.8-37176.3-68.8-174.3-178.2179.10113.7I140 A146 L178I140-K142 PolarHBondContact O-N 3.39Å; K142-A146 PolarHBondContact O-N 2.89Å; K142-L178 HydrophobicContact CG-CD1 4.06Å
143K83.6Confident81.4Confident113 Ų11361.3 Ų61.349%0.49132%0.317SS..Hα-helixtrans-77-36.8176.8-63.7-172.2-158.7169.50110.9Y133 I140 E141 I145 A146 H147Y133-K143 HydrophobicContact CD2-CB 4.44Å; Y133-K143 HydrophobicContact CE1-CD 4.46Å; Y133-K143 HydrophobicContact CE2-CB 4.15Å; I140-K143 HydrophobicContact CG2-CB 3.44Å; I140-K143 VanDerWaalsContact CG2-CB 3.44Å; I140-K143 HydrophobicContact CG2-CD 3.43Å; I140-K143 VanDerWaalsContact CG2-CD 3.43Å; I140-K143 HydrophobicContact CG2-CG 3.3Å; I140-K143 PolarHBondContact O-N 2.98Å; E141-K143 PolarHBondContact O-N 2.88Å; K143-I145 VanDerWaalsContact C-N 3.29Å; K143-I145 PolarHBondContact O-N 3.06Å; K143-A146 PolarHBondContact O-N 3.07Å; K143-H147 PolarHBondContact O-CD2 3.32Å; K143-H147 PolarHBondContact O-N 2.97Å
144A85.1Confident81.7Confident2 Ų262.4 Ų62.42%0.01732%0.321CS..Hα-helixtrans-57.1-45.7173.400000111I140 E141 A146 H147 Y148I140-A144 PolarHBondContact O-N 3.49Å; I140-A144 VanDerWaalsContact O-N 3.14Å; E141-A144 PolarHBondContact O-N 3.39Å; A144-A146 PolarHBondContact O-N 3.17Å; A144-H147 PolarHBondContact O-N 3.33Å; A144-Y148 VanDerWaalsContact O-CD2 3.27Å; A144-Y148 WeakPolarHBondContact O-CD2 3.42Å; A144-Y148 PolarHBondContact O-N 3.36Å
145I89.2Confident82.2Confident7 Ų759.9 Ų59.94%0.03631%0.309CS..Hα-helixtrans-55.9-52.6174.3-73.5163.7000111.1E141 K143 H147 Y148 E149 V171 L178E141-I145 WeakPolarHBondContact O-CG1 3.44Å; E141-I145 PolarHBondContact O-N 2.86Å; K143-I145 VanDerWaalsContact C-N 3.29Å; K143-I145 PolarHBondContact O-N 3.06Å; I145-H147 VanDerWaalsContact C-N 3.28Å; I145-H147 PolarHBondContact O-N 3.08Å; I145-Y148 PolarHBondContact O-N 3.27Å; I145-Y148 VanDerWaalsContact O-N 3.09Å; I145-E149 HydrophobicContact CG2-CG 4.16Å; I145-E149 WeakPolarHBondContact O-CG 3.12Å; I145-E149 PolarHBondContact O-N 3.49Å; I145-V171 HydrophobicContact CG2-CG1 3.93Å; I145-L178 HydrophobicContact CD1-CD1 3.44Å; I145-L178 VanDerWaalsContact CD1-CD1 3.44Å
146A90.3Very high82.8Confident51 Ų5161.5 Ų61.542%0.42131%0.307SS..Hα-helixtrans-57.5-40.6-178.800000112.6K142 K143 A144 Q150K142-A146 PolarHBondContact O-N 2.89Å; K143-A146 PolarHBondContact O-N 3.07Å; A144-A146 PolarHBondContact O-N 3.17Å; A146-Q150 WeakPolarHBondContact O-CB 3.44Å; A146-Q150 PolarHBondContact O-N 3.12Å
147H92.2Very high83.8Confident25 Ų2559.1 Ų59.112%0.11631%0.313CS..Hα-helixtrans-69.5-37.7176.5-75.8-74.7000112.8H126 A130 Y133 K143 A144 I145 A151H126-H147 AromaticContact CE1-ND1 3.67Å; H126-H147 AromaticContact ND1-CG 3.97Å; H126-H147 AromaticContact ND1-ND1 3.17Å; H126-H147 PolarHBondContact ND1-ND1 3.02Å; H126-H147 VanDerWaalsContact ND1-ND1 3.17Å; A130-H147 HydrophobicContact CB-CB 4.08Å; Y133-H147 AromaticContact CE2-CD2 3.74Å; Y133-H147 AromaticContact CE2-NE2 3.81Å; K143-H147 PolarHBondContact O-CD2 3.32Å; K143-H147 PolarHBondContact O-N 2.97Å; A144-H147 PolarHBondContact O-N 3.33Å; I145-H147 VanDerWaalsContact C-N 3.28Å; I145-H147 PolarHBondContact O-N 3.08Å; H147-A151 WeakPolarHBondContact O-CB 3.29Å; H147-A151 PolarHBondContact O-N 3.04Å
148Y93.4Very high85.1Confident6 Ų661.9 Ų61.92%0.02433%0.326CS..Hα-helixtrans-69-36.8174.6-82.3-61000113.1I127 A130 E134 A144 I145 A151 A152 C167 K170 V171 Y174I127-Y148 HydrophobicContact CB-CE1 4.41Å; I127-Y148 HydrophobicContact CG1-CD1 4.37Å; I127-Y148 HydrophobicContact CG1-CE1 4.3Å; I127-Y148 HydrophobicContact CG2-CE1 4.04Å; A130-Y148 HydrophobicContact CB-CD1 4.05Å; A130-Y148 HydrophobicContact CB-CD2 3.46Å; A130-Y148 VanDerWaalsContact CB-CD2 3.46Å; A130-Y148 HydrophobicContact CB-CE1 3.92Å; A130-Y148 HydrophobicContact CB-CE2 3.29Å; A130-Y148 HydrophobicContact CB-CG 3.83Å; E134-Y148 WeakPolarHBondContact OE1-CE2 3.48Å; E134-Y148 VanDerWaalsContact OE1-CZ 3.24Å; E134-Y148 PolarHBondContact OE1-OH 3.37Å; A144-Y148 VanDerWaalsContact O-CD2 3.27Å; A144-Y148 WeakPolarHBondContact O-CD2 3.42Å; A144-Y148 PolarHBondContact O-N 3.36Å; I145-Y148 PolarHBondContact O-N 3.27Å; I145-Y148 VanDerWaalsContact O-N 3.09Å; Y148-A151 PolarHBondContact O-N 3.47Å; Y148-A152 WeakPolarHBondContact O-CB 3.39Å; Y148-A152 PolarHBondContact O-N 2.65Å; Y148-C167 HydrophobicContact CD1-CB 4.34Å; Y148-K170 HydrophobicContact CD1-CB 4.4Å; Y148-K170 HydrophobicContact CD2-CB 4.28Å; Y148-K170 HydrophobicContact CE1-CB 4.3Å; Y148-K170 HydrophobicContact CE1-CG 4.41Å; Y148-K170 HydrophobicContact CE2-CB 4.18Å; Y148-K170 HydrophobicContact CG-CB 4.39Å; Y148-V171 VanDerWaalsContact CB-CG2 3.43Å; Y148-Y174 HydrophobicContact CE2-CE2 4.05Å
149E92.3Very high86.5Confident51 Ų5164.4 Ų64.424%0.23833%0.33CS..Hα-helixtrans-62.4-49174.5-72.3-171.9129.100110.5I145 A151 A152 D153 V171 K183I145-E149 HydrophobicContact CG2-CG 4.16Å; I145-E149 WeakPolarHBondContact O-CG 3.12Å; I145-E149 PolarHBondContact O-N 3.49Å; E149-A151 VanDerWaalsContact C-N 3.3Å; E149-A151 PolarHBondContact O-N 2.91Å; E149-A152 WeakPolarHBondContact O-CB 3.31Å; E149-A152 PolarHBondContact O-N 3.31Å; E149-D153 PolarHBondContact O-N 2.98Å; E149-V171 HydrophobicContact CG-CB 4.36Å; E149-V171 HydrophobicContact CG-CG1 3.74Å; E149-V171 HydrophobicContact CG-CG2 3.69Å; E149-K183 WeakPolarHBondContact OE1-CE 3.34Å; E149-K183 IonicContact OE1-NZ 3.02Å; E149-K183 PolarHBondContact OE1-NZ 3.39Å; E149-K183 IonicContact OE2-NZ 3.43Å; E149-K183 PolarHBondContact OE2-NZ 3.44Å
150Q92.7Very high87.9Confident81 Ų8158.4 Ų58.438%0.37930%0.301SS..Hα-helixtrans-62.5-37.4177.1-168167.811.600112.4H126 A146 D153 Y154H126-Q150 PolarHBondContact CE1-OE1 3.14Å; A146-Q150 WeakPolarHBondContact O-CB 3.44Å; A146-Q150 PolarHBondContact O-N 3.12Å; Q150-D153 PolarHBondContact O-N 2.68Å; Q150-Y154 HydrophobicContact CG-CD2 4.37Å; Q150-Y154 HydrophobicContact CG-CE2 3.82Å; Q150-Y154 PolarHBondContact NE2-OH 3.13Å; Q150-Y154 VanDerWaalsContact NE2-OH 3.17Å; Q150-Y154 WeakPolarHBondContact O-CD2 3.32Å; Q150-Y154 PolarHBondContact O-N 3.31Å; Q150-Y154 VanDerWaalsContact O-N 3.12Å
151A93.6Very high88.9Confident0 Ų060.4 Ų60.40%031%0.312CS..Hα-helixtrans-63.3-42.1172.400000112.2A123 H126 I127 H147 Y148 E149 D153 Y154 Y155A123-A151 HydrophobicContact CB-CB 4.41Å; H126-A151 HydrophobicContact CB-CB 3.76Å; I127-A151 HydrophobicContact CG1-CB 4.04Å; H147-A151 WeakPolarHBondContact O-CB 3.29Å; H147-A151 PolarHBondContact O-N 3.04Å; Y148-A151 PolarHBondContact O-N 3.47Å; E149-A151 VanDerWaalsContact C-N 3.3Å; E149-A151 PolarHBondContact O-N 2.91Å; A151-D153 VanDerWaalsContact C-N 3.35Å; A151-Y154 PolarHBondContact O-N 3.12Å; A151-Y155 WeakPolarHBondContact O-CD2 3.46Å; A151-Y155 PolarHBondContact O-N 3.47Å
152A93.6Very high89.8Confident2 Ų260.8 Ų60.82%0.01732%0.322CS..Hα-helixtrans-62.5-42.9178.100000111.5Y148 E149 Y155 K156 C167 L168Y148-A152 WeakPolarHBondContact O-CB 3.39Å; Y148-A152 PolarHBondContact O-N 2.65Å; E149-A152 WeakPolarHBondContact O-CB 3.31Å; E149-A152 PolarHBondContact O-N 3.31Å; A152-Y155 PolarHBondContact O-N 3.31Å; A152-K156 VanDerWaalsContact O-CB 3.32Å; A152-K156 WeakPolarHBondContact O-CB 3.35Å; A152-K156 PolarHBondContact O-N 3.36Å; A152-C167 HydrophobicContact CB-CB 3.87Å; A152-L168 HydrophobicContact CB-CD2 3.74Å; A152-L168 HydrophobicContact CB-CG 3.8Å
153D93.1Very high90.3Very high107 Ų10755.7 Ų55.757%0.57231%0.306SS*.Hα-helixtrans-62.6-44177.8-71.3-22.3000111.8E149 Q150 A151 Y155 K156 G157E149-D153 PolarHBondContact O-N 2.98Å; Q150-D153 PolarHBondContact O-N 2.68Å; A151-D153 VanDerWaalsContact C-N 3.35Å; D153-Y155 PolarHBondContact O-N 3.4Å; D153-K156 PolarHBondContact O-N 2.92Å; D153-G157 PolarHBondContact O-N 3.23Å
154Y93.5Very high90.7Very high44 Ų4450.5 Ų50.517%0.17328%0.283CS..Hα-helixtrans-61.5-43.8173.9-70.6-32.6000112.5F119 A122 A123 H126 Q150 A151 K156 G157 E158F119-Y154 HydrophobicContact CB-CD1 4.3Å; F119-Y154 HydrophobicContact CB-CG 4.36Å; F119-Y154 AromaticContact CD1-CD1 3.73Å; F119-Y154 HydrophobicContact CD1-CD1 3.73Å; F119-Y154 AromaticContact CD1-CE1 3.69Å; F119-Y154 HydrophobicContact CD1-CE1 3.69Å; F119-Y154 HydrophobicContact CD1-CG 4.42Å; F119-Y154 HydrophobicContact CE1-CE1 4.13Å; F119-Y154 HydrophobicContact CG-CD1 4.34Å; A122-Y154 HydrophobicContact CB-CE2 4.4Å; A123-Y154 HydrophobicContact CB-CD2 4.31Å; H126-Y154 AromaticContact CD2-CE2 3.73Å; H126-Y154 AromaticContact NE2-CE2 3.64Å; Q150-Y154 HydrophobicContact CG-CD2 4.37Å; Q150-Y154 HydrophobicContact CG-CE2 3.82Å; Q150-Y154 PolarHBondContact NE2-OH 3.13Å; Q150-Y154 VanDerWaalsContact NE2-OH 3.17Å; Q150-Y154 WeakPolarHBondContact O-CD2 3.32Å; Q150-Y154 PolarHBondContact O-N 3.31Å; Q150-Y154 VanDerWaalsContact O-N 3.12Å; A151-Y154 PolarHBondContact O-N 3.12Å; Y154-K156 VanDerWaalsContact C-N 3.33Å; Y154-K156 PolarHBondContact O-N 3.42Å; Y154-G157 PolarHBondContact O-N 3.41Å; Y154-E158 WeakPolarHBondContact O-CG 3.45Å; Y154-E158 PolarHBondContact O-N 2.97Å; Y154-E158 VanDerWaalsContact O-N 3.16Å
155Y94.1Very high90.9Very high9 Ų950.8 Ų50.84%0.03529%0.285CS..Hα-helixtrans-67.9-33.4176.6-77.5-57.8000113.2T120 A123 K124 I127 A151 A152 D153 E158 E159 S160T120-Y155 HydrophobicContact CG2-CD1 4.49Å; T120-Y155 HydrophobicContact CG2-CE1 3.92Å; A123-Y155 HydrophobicContact CB-CD1 4.35Å; A123-Y155 HydrophobicContact CB-CD2 3.83Å; A123-Y155 HydrophobicContact CB-CE1 4.04Å; A123-Y155 HydrophobicContact CB-CE2 3.44Å; A123-Y155 VanDerWaalsContact CB-CE2 3.44Å; A123-Y155 HydrophobicContact CB-CG 4.25Å; K124-Y155 WeakPolarHBondContact CG-OH 3.48Å; K124-Y155 PolarHBondContact N-OH 2.63Å; I127-Y155 HydrophobicContact CD1-CE2 3.67Å; A151-Y155 WeakPolarHBondContact O-CD2 3.46Å; A151-Y155 PolarHBondContact O-N 3.47Å; A152-Y155 PolarHBondContact O-N 3.31Å; D153-Y155 PolarHBondContact O-N 3.4Å; Y155-E158 PolarHBondContact O-N 3.24Å; Y155-E159 PolarHBondContact O-N 2.81Å; Y155-S160 WeakPolarHBondContact O-CA 3.29Å; Y155-S160 PolarHBondContact O-N 3.37Å
156K90.8Very high91Very high104 Ų10457.5 Ų57.545%0.45231%0.314SS..Hα-helixtrans-68.2-40.2176.3-171.8176.1178.7-179.50111.1A152 D153 Y154 E158 E159 A164 Q190A152-K156 VanDerWaalsContact O-CB 3.32Å; A152-K156 WeakPolarHBondContact O-CB 3.35Å; A152-K156 PolarHBondContact O-N 3.36Å; D153-K156 PolarHBondContact O-N 2.92Å; Y154-K156 VanDerWaalsContact C-N 3.33Å; Y154-K156 PolarHBondContact O-N 3.42Å; K156-E158 VanDerWaalsContact C-N 3.3Å; K156-E158 PolarHBondContact O-N 3.44Å; K156-E159 PolarHBondContact O-N 3.45Å; K156-A164 HydrophobicContact CB-CB 4.44Å; K156-Q190 VanDerWaalsContact NZ-NE2 3.14Å
157G90.9Very high91.1Very high65 Ų6555.2 Ų55.267%0.6730%0.295SS*.Hα-helixtrans-63.9-33.1174.600000113.6D153 Y154 E159D153-G157 PolarHBondContact O-N 3.23Å; Y154-G157 PolarHBondContact O-N 3.41Å; G157-E159 VanDerWaalsContact C-N 3.27Å; G157-E159 PolarHBondContact O-N 2.94Å
158E90.3Very high91.1Very high93 Ų9354.9 Ų54.944%0.43529%0.293SS..THydrogen-bonded Turntrans-87.915.5176.9-63.6-74.9130.300113.2F119 Y154 Y155 K156 S160F119-E158 HydrophobicContact CB-CG 4.17Å; Y154-E158 WeakPolarHBondContact O-CG 3.45Å; Y154-E158 PolarHBondContact O-N 2.97Å; Y154-E158 VanDerWaalsContact O-N 3.16Å; Y155-E158 PolarHBondContact O-N 3.24Å; K156-E158 VanDerWaalsContact C-N 3.3Å; K156-E158 PolarHBondContact O-N 3.44Å; E158-S160 PolarHBondContact O-N 3.16Å
159E87.3Confident91.1Very high169 Ų16956.3 Ų56.379%0.7930%0.301SS*.THydrogen-bonded Turntrans56.614.7-177.6-56.9-172.7146.300115Y155 K156 G157 N161Y155-E159 PolarHBondContact O-N 2.81Å; K156-E159 PolarHBondContact O-N 3.45Å; G157-E159 VanDerWaalsContact C-N 3.27Å; G157-E159 PolarHBondContact O-N 2.94Å; E159-N161 VanDerWaalsContact C-N 3.29Å; E159-N161 PolarHBondContact O-N 2.97Å
160S87.6Confident91Very high38 Ų3857.7 Ų57.727%0.26631%0.307SS..  trans-8665.7179.6171.70000111.3Y155 E158 S162 S163 A164Y155-S160 WeakPolarHBondContact O-CA 3.29Å; Y155-S160 PolarHBondContact O-N 3.37Å; E158-S160 PolarHBondContact O-N 3.16Å; S160-S162 VanDerWaalsContact C-N 3.33Å; S160-S162 PolarHBondContact O-N 3.44Å; S160-S163 PolarHBondContact O-N 3.27Å; S160-S163 WeakPolarHBondContact OG-CB 3.12Å; S160-S163 PolarHBondContact OG-OG 3.02Å; S160-A164 PolarHBondContact O-N 2.99Å; S160-A164 VanDerWaalsContact O-N 3.09Å
161N86Confident90.9Very high81 Ų8153.9 Ų53.943%0.43329%0.289SS..Hα-helixtrans-56.3-38.8-175.4-72.1-51.6000114.4E159 S163 A164 N165E159-N161 VanDerWaalsContact C-N 3.29Å; E159-N161 PolarHBondContact O-N 2.97Å; N161-S163 PolarHBondContact O-N 3.02Å; N161-A164 PolarHBondContact O-N 3.3Å; N161-N165 WeakPolarHBondContact O-CB 3.41Å; N161-N165 PolarHBondContact O-N 2.71Å; N161-N165 PolarHBondContact O-ND2 3.19Å; N161-N165 PolarHBondContact O-OD1 2.85Å
162S87Confident90.8Very high79 Ų7953.9 Ų53.955%0.55229%0.289SS*.Hα-helixtrans-62-43-179.9-55.30000112.7S160 K166S160-S162 VanDerWaalsContact C-N 3.33Å; S160-S162 PolarHBondContact O-N 3.44Å; S162-K166 PolarHBondContact O-N 2.87Å
163S89.3Confident90.6Very high43 Ų4354.8 Ų54.830%0.30130%0.297SS..Hα-helixtrans-72.5-37.5178.2-53.60000111.5S160 N161 K166 C167S160-S163 PolarHBondContact O-N 3.27Å; S160-S163 WeakPolarHBondContact OG-CB 3.12Å; S160-S163 PolarHBondContact OG-OG 3.02Å; N161-S163 PolarHBondContact O-N 3.02Å; S163-K166 PolarHBondContact O-N 3.07Å; S163-C167 PolarHBondContact O-N 3.31Å; S163-C167 PolarHBondContact O-SG 3.01Å
164A91.6Very high90.3Very high3 Ų351.4 Ų51.43%0.02528%0.276CS..Hα-helixtrans-60.6-48.9174.100000110.9K156 S160 N161 K166 C167 L168K156-A164 HydrophobicContact CB-CB 4.44Å; S160-A164 PolarHBondContact O-N 2.99Å; S160-A164 VanDerWaalsContact O-N 3.09Å; N161-A164 PolarHBondContact O-N 3.3Å; A164-K166 VanDerWaalsContact C-N 3.29Å; A164-K166 PolarHBondContact O-N 3.3Å; A164-C167 WeakPolarHBondContact O-CB 3.49Å; A164-C167 PolarHBondContact O-N 3.36Å; A164-L168 WeakPolarHBondContact O-CG 3.44Å; A164-L168 PolarHBondContact O-N 2.95Å
165N90.7Very high90.1Very high9 Ų949.3 Ų49.35%0.04827%0.268CS..Hα-helixtrans-58-41.5177.6-70.3-14.4000111.6N161 C167 L168 L169 V191N161-N165 WeakPolarHBondContact O-CB 3.41Å; N161-N165 PolarHBondContact O-N 2.71Å; N161-N165 PolarHBondContact O-ND2 3.19Å; N161-N165 PolarHBondContact O-OD1 2.85Å; N165-C167 VanDerWaalsContact C-N 3.31Å; N165-C167 PolarHBondContact O-N 3.33Å; N165-L168 PolarHBondContact O-N 3.26Å; N165-L169 WeakPolarHBondContact O-CB 3.2Å; N165-L169 WeakPolarHBondContact O-CG 3.42Å; N165-L169 PolarHBondContact O-N 3.21Å; N165-V191 HydrophobicContact CB-CG1 4.01Å
166K90.6Very high89.7Confident148 Ų14848.9 Ų48.964%0.64327%0.266SS*.Hα-helixtrans-59.1-41.3175.9-173-178.5176.9-172.90112.5S162 S163 A164 K170S162-K166 PolarHBondContact O-N 2.87Å; S163-K166 PolarHBondContact O-N 3.07Å; A164-K166 VanDerWaalsContact C-N 3.29Å; A164-K166 PolarHBondContact O-N 3.3Å; K166-K170 PolarHBondContact O-N 3.33Å
167C93.1Very high89.4Confident3 Ų347 Ų472%0.0226%0.259CS..Hα-helixtrans-69.9-46.4177.5-590000111.1I127 Y148 A152 S163 A164 N165 L169 K170 V171I127-C167 VanDerWaalsContact CD1-SG 3.58Å; Y148-C167 HydrophobicContact CD1-CB 4.34Å; A152-C167 HydrophobicContact CB-CB 3.87Å; S163-C167 PolarHBondContact O-N 3.31Å; S163-C167 PolarHBondContact O-SG 3.01Å; A164-C167 WeakPolarHBondContact O-CB 3.49Å; A164-C167 PolarHBondContact O-N 3.36Å; N165-C167 VanDerWaalsContact C-N 3.31Å; N165-C167 PolarHBondContact O-N 3.33Å; C167-L169 VanDerWaalsContact C-N 3.31Å; C167-L169 PolarHBondContact O-N 3.31Å; C167-K170 WeakPolarHBondContact O-CB 3.37Å; C167-K170 PolarHBondContact O-N 3.09Å; C167-K170 VanDerWaalsContact O-N 3.08Å; C167-V171 WeakPolarHBondContact O-CG2 3.17Å; C167-V171 PolarHBondContact O-N 3.33Å
168L92.7Very high89.2Confident17 Ų1746.4 Ų46.49%0.08924%0.24CC..Hα-helixtrans-59-40.5178.6-72.4174.6000112.3A152 A164 N165 K170 V171 G172 I187 V191A152-L168 HydrophobicContact CB-CD2 3.74Å; A152-L168 HydrophobicContact CB-CG 3.8Å; A164-L168 WeakPolarHBondContact O-CG 3.44Å; A164-L168 PolarHBondContact O-N 2.95Å; N165-L168 PolarHBondContact O-N 3.26Å; L168-K170 VanDerWaalsContact C-N 3.28Å; L168-K170 PolarHBondContact O-N 3.21Å; L168-V171 WeakPolarHBondContact O-CB 3.4Å; L168-V171 PolarHBondContact O-N 3.35Å; L168-V171 VanDerWaalsContact O-N 3.16Å; L168-G172 PolarHBondContact O-N 3.14Å; L168-I187 HydrophobicContact CB-CG2 3.87Å; L168-I187 HydrophobicContact CD2-CG2 4.3Å; L168-I187 VanDerWaalsContact O-CG2 3.27Å; L168-I187 WeakPolarHBondContact O-CG2 3.42Å; L168-V191 HydrophobicContact CB-CG2 3.58Å; L168-V191 HydrophobicContact CD1-CG2 3.77Å; L168-V191 HydrophobicContact CG-CG2 4.33Å
169L91.9Very high88.9Confident36 Ų3648.2 Ų48.219%0.18825%0.249CC..Hα-helixtrans-62.7-35.7176.4-70.1169.1000112.6N165 C167 A173 Y188 V191 Y208N165-L169 WeakPolarHBondContact O-CB 3.2Å; N165-L169 WeakPolarHBondContact O-CG 3.42Å; N165-L169 PolarHBondContact O-N 3.21Å; C167-L169 VanDerWaalsContact C-N 3.31Å; C167-L169 PolarHBondContact O-N 3.31Å; L169-A173 WeakPolarHBondContact O-CB 3.46Å; L169-A173 PolarHBondContact O-N 3.36Å; L169-Y188 HydrophobicContact CD2-CD1 3.91Å; L169-Y188 HydrophobicContact CD2-CE1 3.8Å; L169-V191 HydrophobicContact CD2-CG1 3.97Å; L169-V191 HydrophobicContact CG-CG1 4.17Å; L169-Y208 HydrophobicContact CD1-CD1 4.46Å; L169-Y208 HydrophobicContact CD1-CE1 3.54Å; L169-Y208 WeakPolarHBondContact CD1-OH 3.38Å; L169-Y208 HydrophobicContact CD2-CD1 3.42Å; L169-Y208 VanDerWaalsContact CD2-CD1 3.42Å; L169-Y208 HydrophobicContact CD2-CE1 3.35Å; L169-Y208 HydrophobicContact CD2-CG 4.15Å; L169-Y208 HydrophobicContact CG-CE1 4.09Å
170K90.8Very high88.9Confident81 Ų8143.7 Ų43.735%0.35223%0.227SC..Hα-helixtrans-66.6-45172.7-73.7-71.9-170.1160.40111.1Y148 K166 C167 L168 G172 A173 Y174Y148-K170 HydrophobicContact CD1-CB 4.4Å; Y148-K170 HydrophobicContact CD2-CB 4.28Å; Y148-K170 HydrophobicContact CE1-CB 4.3Å; Y148-K170 HydrophobicContact CE1-CG 4.41Å; Y148-K170 HydrophobicContact CE2-CB 4.18Å; Y148-K170 HydrophobicContact CG-CB 4.39Å; K166-K170 PolarHBondContact O-N 3.33Å; C167-K170 WeakPolarHBondContact O-CB 3.37Å; C167-K170 PolarHBondContact O-N 3.09Å; C167-K170 VanDerWaalsContact O-N 3.08Å; L168-K170 VanDerWaalsContact C-N 3.28Å; L168-K170 PolarHBondContact O-N 3.21Å; K170-G172 PolarHBondContact O-N 3.18Å; K170-A173 PolarHBondContact O-N 3.25Å; K170-Y174 HydrophobicContact CB-CE2 4.28Å; K170-Y174 HydrophobicContact CD-CE2 4.28Å; K170-Y174 WeakPolarHBondContact O-CD2 3.42Å; K170-Y174 PolarHBondContact O-N 3.34Å; K170-Y174 VanDerWaalsContact O-N 3.11Å
171V91.4Very high88.9Confident0 Ų043 Ų430%022%0.219CC..Hα-helixtrans-57.1-49.4174.6178.70000111.1I145 Y148 E149 C167 L168 A173 Y174 C175 I187I145-V171 HydrophobicContact CG2-CG1 3.93Å; Y148-V171 VanDerWaalsContact CB-CG2 3.43Å; E149-V171 HydrophobicContact CG-CB 4.36Å; E149-V171 HydrophobicContact CG-CG1 3.74Å; E149-V171 HydrophobicContact CG-CG2 3.69Å; C167-V171 WeakPolarHBondContact O-CG2 3.17Å; C167-V171 PolarHBondContact O-N 3.33Å; L168-V171 WeakPolarHBondContact O-CB 3.4Å; L168-V171 PolarHBondContact O-N 3.35Å; L168-V171 VanDerWaalsContact O-N 3.16Å; V171-A173 VanDerWaalsContact C-N 3.33Å; V171-A173 PolarHBondContact O-N 3.43Å; V171-Y174 PolarHBondContact O-N 3.12Å; V171-C175 WeakPolarHBondContact O-CB 3.47Å; V171-C175 PolarHBondContact O-N 2.89Å; V171-C175 PolarHBondContact O-SG 3.49Å; V171-I187 HydrophobicContact CB-CD1 4.16Å; V171-I187 HydrophobicContact CG1-CD1 3.45Å; V171-I187 VanDerWaalsContact CG1-CD1 3.45Å
172G90.4Very high89Confident0 Ų044 Ų440%022%0.221CC..Hα-helixtrans-60.3-40.8179.600000112.8L168 K170 A176L168-G172 PolarHBondContact O-N 3.14Å; K170-G172 PolarHBondContact O-N 3.18Å; G172-A176 WeakPolarHBondContact O-CB 3.36Å; G172-A176 PolarHBondContact O-N 3.49Å
173A88.9Confident89.2Confident22 Ų2243.4 Ų43.418%0.18221%0.208CC..Hα-helixtrans-61.7-47.5176.400000112.5L169 K170 V171 A176 Q177 Y188 W278L169-A173 WeakPolarHBondContact O-CB 3.46Å; L169-A173 PolarHBondContact O-N 3.36Å; K170-A173 PolarHBondContact O-N 3.25Å; V171-A173 VanDerWaalsContact C-N 3.33Å; V171-A173 PolarHBondContact O-N 3.43Å; A173-A176 PolarHBondContact O-N 3.03Å; A173-Q177 PolarHBondContact O-N 3.35Å; A173-Y188 WeakPolarHBondContact CA-OH 3.46Å; A173-Y188 PolarHBondContact N-OH 3.08Å; A173-Y188 VanDerWaalsContact N-OH 3.16Å; A173-W278 PolarHBondContact O-NE1 3.09Å
174Y87.8Confident89.2Confident36 Ų3641.3 Ų41.314%0.14119%0.194CC..Hα-helixtrans-71.7-37.5178.7-64.2-56.4000112.8E134 Y148 K170 V171 A176 Q177 L178E134-Y174 HydrophobicContact CG-CE2 4.23Å; E134-Y174 WeakPolarHBondContact CG-OH 3.01Å; E134-Y174 WeakPolarHBondContact OE1-CE2 3.22Å; E134-Y174 VanDerWaalsContact OE1-CZ 3.24Å; E134-Y174 PolarHBondContact OE1-OH 3.17Å; E134-Y174 PolarHBondContact OE2-OH 3.08Å; Y148-Y174 HydrophobicContact CE2-CE2 4.05Å; K170-Y174 HydrophobicContact CB-CE2 4.28Å; K170-Y174 HydrophobicContact CD-CE2 4.28Å; K170-Y174 WeakPolarHBondContact O-CD2 3.42Å; K170-Y174 PolarHBondContact O-N 3.34Å; K170-Y174 VanDerWaalsContact O-N 3.11Å; V171-Y174 PolarHBondContact O-N 3.12Å; Y174-A176 VanDerWaalsContact C-N 3.27Å; Y174-A176 PolarHBondContact O-N 3.35Å; Y174-Q177 PolarHBondContact O-N 2.89Å; Y174-Q177 VanDerWaalsContact O-N 3.12Å; Y174-L178 WeakPolarHBondContact O-CB 3.05Å; Y174-L178 WeakPolarHBondContact O-CG 3.48Å; Y174-L178 PolarHBondContact O-N 3.37Å
175C88.6Confident89.2Confident0 Ų041.3 Ų41.30%019%0.194CC..Hα-helixtrans-59.6-40.7174.7-70.30000111.1V171 L178 E179 Q180 A184V171-C175 WeakPolarHBondContact O-CB 3.47Å; V171-C175 PolarHBondContact O-N 2.89Å; V171-C175 PolarHBondContact O-SG 3.49Å; C175-L178 CarbonylContact O-C 3.54Å; C175-L178 PolarHBondContact O-N 2.86Å; C175-E179 PolarHBondContact O-N 3.23Å; C175-Q180 HydrophobicContact CB-CB 4.17Å; C175-Q180 CarbonylContact O-C 3.38Å; C175-Q180 WeakPolarHBondContact O-CA 3.45Å; C175-Q180 PolarHBondContact O-N 2.94Å; C175-A184 HydrophobicContact CB-CB 4.01Å
176A86.9Confident89.2Confident0 Ų046 Ų460%022%0.215CC..Hα-helixtrans-65.6-35.9175.400000112.8G172 A173 Y174 E179 Y181 A184 W278 R285G172-A176 WeakPolarHBondContact O-CB 3.36Å; G172-A176 PolarHBondContact O-N 3.49Å; A173-A176 PolarHBondContact O-N 3.03Å; Y174-A176 VanDerWaalsContact C-N 3.27Å; Y174-A176 PolarHBondContact O-N 3.35Å; A176-E179 PolarHBondContact O-N 3.46Å; A176-Y181 WeakPolarHBondContact O-CE1 3.48Å; A176-A184 HydrophobicContact CB-CB 4.18Å; A176-W278 HydrophobicContact CB-CZ2 3.7Å; A176-R285 PolarHBondContact O-NH1 2.87Å; A176-R285 VanDerWaalsContact O-NH1 3.07Å
177Q84.1Confident89.3Confident65 Ų6539.6 Ų39.630%0.30419%0.188SC..Hα-helixtrans-67-43175.6-73.6176.6-27.300111.8A173 Y174 E179 R285A173-Q177 PolarHBondContact O-N 3.35Å; Y174-Q177 PolarHBondContact O-N 2.89Å; Y174-Q177 VanDerWaalsContact O-N 3.12Å; Q177-E179 PolarHBondContact O-N 3.34Å; Q177-R285 PolarHBondContact O-NH1 3.13Å; Q177-R285 PolarHBondContact O-NH2 3.09Å
178L85.4Confident89.3Confident51 Ų5139.6 Ų39.627%0.26719%0.187SC..THydrogen-bonded Turntrans-74.810.7175.6-70.4-179.9000114.7E141 K142 I145 Y174 C175 Q180E141-L178 HydrophobicContact CB-CD1 4.05Å; E141-L178 HydrophobicContact CB-CD2 4.33Å; E141-L178 HydrophobicContact CB-CG 4.4Å; E141-L178 WeakPolarHBondContact OE2-CD2 3.32Å; K142-L178 HydrophobicContact CG-CD1 4.06Å; I145-L178 HydrophobicContact CD1-CD1 3.44Å; I145-L178 VanDerWaalsContact CD1-CD1 3.44Å; Y174-L178 WeakPolarHBondContact O-CB 3.05Å; Y174-L178 WeakPolarHBondContact O-CG 3.48Å; Y174-L178 PolarHBondContact O-N 3.37Å; C175-L178 CarbonylContact O-C 3.54Å; C175-L178 PolarHBondContact O-N 2.86Å; L178-Q180 PolarHBondContact O-N 3.44Å; L178-Q180 VanDerWaalsContact O-N 3.15Å
179E84.8Confident89.1Confident132 Ų13241.2 Ų41.262%0.61719%0.194SC*.THydrogen-bonded Turntrans63.616.9178.3-57.6175-177.100114.5C175 A176 Q177 Y181 R285C175-E179 PolarHBondContact O-N 3.23Å; A176-E179 PolarHBondContact O-N 3.46Å; Q177-E179 PolarHBondContact O-N 3.34Å; E179-Y181 HydrophobicContact CB-CD2 4.45Å; E179-Y181 HydrophobicContact CB-CE2 3.85Å; E179-Y181 HydrophobicContact CG-CE2 4.12Å; E179-Y181 WeakPolarHBondContact O-CD2 3.23Å; E179-Y181 PolarHBondContact O-N 3.03Å; E179-Y181 VanDerWaalsContact O-N 3.09Å; E179-R285 IonicContact OE1-NH2 2.68Å
180Q87.4Confident89Confident74 Ų7442.6 Ų42.635%0.34620%0.2SC..  trans-86.359.3170.7-62.1-177.513.800110.4C175 L178 Q182 K183 A184C175-Q180 HydrophobicContact CB-CB 4.17Å; C175-Q180 CarbonylContact O-C 3.38Å; C175-Q180 WeakPolarHBondContact O-CA 3.45Å; C175-Q180 PolarHBondContact O-N 2.94Å; L178-Q180 PolarHBondContact O-N 3.44Å; L178-Q180 VanDerWaalsContact O-N 3.15Å; Q180-Q182 PolarHBondContact O-N 3.19Å; Q180-K183 HydrophobicContact CB-CB 4.38Å; Q180-K183 PolarHBondContact O-N 3.18Å; Q180-A184 PolarHBondContact O-N 3.2Å; Q180-A184 VanDerWaalsContact O-N 3.1Å
181Y88Confident89Confident24 Ų2438.8 Ų38.89%0.09418%0.183CC..Hα-helixtrans-61.1-40.9-173.8-62-68.1000113.2A176 E179 K183 A184 I185 C215 I218 V219 R285A176-Y181 WeakPolarHBondContact O-CE1 3.48Å; E179-Y181 HydrophobicContact CB-CD2 4.45Å; E179-Y181 HydrophobicContact CB-CE2 3.85Å; E179-Y181 HydrophobicContact CG-CE2 4.12Å; E179-Y181 WeakPolarHBondContact O-CD2 3.23Å; E179-Y181 PolarHBondContact O-N 3.03Å; E179-Y181 VanDerWaalsContact O-N 3.09Å; Y181-K183 VanDerWaalsContact C-N 3.33Å; Y181-K183 PolarHBondContact O-N 3.44Å; Y181-A184 PolarHBondContact O-N 3.28Å; Y181-A184 VanDerWaalsContact O-N 3.16Å; Y181-I185 WeakPolarHBondContact O-CD1 3.46Å; Y181-I185 VanDerWaalsContact O-CG1 3.23Å; Y181-I185 WeakPolarHBondContact O-CG1 3.49Å; Y181-I185 PolarHBondContact O-N 3.29Å; Y181-C215 HydrophobicContact CD1-CB 4.35Å; Y181-I218 HydrophobicContact CD1-CB 4.45Å; Y181-I218 HydrophobicContact CD1-CD1 4.07Å; Y181-I218 HydrophobicContact CD2-CG2 3.89Å; Y181-I218 HydrophobicContact CE1-CB 4.33Å; Y181-I218 HydrophobicContact CE1-CD1 3.4Å; Y181-I218 VanDerWaalsContact CE1-CD1 3.4Å; Y181-I218 HydrophobicContact CE1-CG1 4.45Å; Y181-I218 HydrophobicContact CE1-CG2 4.16Å; Y181-I218 HydrophobicContact CE2-CB 4.39Å; Y181-I218 HydrophobicContact CE2-CG2 3.48Å; Y181-I218 VanDerWaalsContact CE2-CG2 3.48Å; Y181-I218 HydrophobicContact CG-CG2 4.37Å; Y181-V219 HydrophobicContact CG-CG2 4.33Å; Y181-R285 WeakPolarHBondContact OH-CD 3.39Å; Y181-R285 PolarHBondContact OH-NH1 2.95Å
182Q88.4Confident88.8Confident102 Ų10238.8 Ų38.848%0.47718%0.183SC..Hα-helixtrans-57.7-45.8178.7-174.456.841.600112.2Q180 I185 E186Q180-Q182 PolarHBondContact O-N 3.19Å; Q182-I185 WeakPolarHBondContact O-CB 3.45Å; Q182-I185 PolarHBondContact O-N 3.48Å; Q182-E186 PolarHBondContact NE2-OE1 3.35Å; Q182-E186 PolarHBondContact O-N 3.31Å
183K89.5Confident88.6Confident65 Ų6540.6 Ų40.628%0.28320%0.198SC..Hα-helixtrans-66.7-40.1177.8-170.8176.4-179.7-175.10111.7E149 Q180 Y181 I185 E186 I187E149-K183 WeakPolarHBondContact OE1-CE 3.34Å; E149-K183 IonicContact OE1-NZ 3.02Å; E149-K183 PolarHBondContact OE1-NZ 3.39Å; E149-K183 IonicContact OE2-NZ 3.43Å; E149-K183 PolarHBondContact OE2-NZ 3.44Å; Q180-K183 HydrophobicContact CB-CB 4.38Å; Q180-K183 PolarHBondContact O-N 3.18Å; Y181-K183 VanDerWaalsContact C-N 3.33Å; Y181-K183 PolarHBondContact O-N 3.44Å; K183-I185 VanDerWaalsContact C-N 3.34Å; K183-I185 PolarHBondContact O-N 2.87Å; K183-E186 PolarHBondContact O-N 3.08Å; K183-I187 HydrophobicContact CG-CD1 4.14Å; K183-I187 VanDerWaalsContact O-CG1 3.27Å; K183-I187 WeakPolarHBondContact O-CG1 3.35Å; K183-I187 PolarHBondContact O-N 3.49Å
184A90.1Very high88.3Confident0 Ų041.9 Ų41.90%020%0.202CC..Hα-helixtrans-63-40.8177.100000112.1C175 A176 Q180 Y181 I187 Y188C175-A184 HydrophobicContact CB-CB 4.01Å; A176-A184 HydrophobicContact CB-CB 4.18Å; Q180-A184 PolarHBondContact O-N 3.2Å; Q180-A184 VanDerWaalsContact O-N 3.1Å; Y181-A184 PolarHBondContact O-N 3.28Å; Y181-A184 VanDerWaalsContact O-N 3.16Å; A184-I187 PolarHBondContact O-N 3.41Å; A184-Y188 HydrophobicContact CB-CD2 4.43Å; A184-Y188 HydrophobicContact CB-CE2 4.28Å; A184-Y188 WeakPolarHBondContact O-CD2 3.44Å; A184-Y188 PolarHBondContact O-N 3.35Å
185I91.7Very high88.1Confident3 Ų340.2 Ų40.22%0.01520%0.196CC..Hα-helixtrans-57.8-54.2176.5-71.7159.3000110.7Y181 Q182 K183 I187 Y188 E189 C215 H216 V219Y181-I185 WeakPolarHBondContact O-CD1 3.46Å; Y181-I185 VanDerWaalsContact O-CG1 3.23Å; Y181-I185 WeakPolarHBondContact O-CG1 3.49Å; Y181-I185 PolarHBondContact O-N 3.29Å; Q182-I185 WeakPolarHBondContact O-CB 3.45Å; Q182-I185 PolarHBondContact O-N 3.48Å; K183-I185 VanDerWaalsContact C-N 3.34Å; K183-I185 PolarHBondContact O-N 2.87Å; I185-I187 PolarHBondContact O-N 3.01Å; I185-Y188 PolarHBondContact O-N 3.06Å; I185-Y188 VanDerWaalsContact O-N 3.12Å; I185-E189 HydrophobicContact CG2-CG 4.38Å; I185-E189 PolarHBondContact O-N 3.3Å; I185-C215 HydrophobicContact CD1-CB 4.07Å; I185-C215 HydrophobicContact CG1-CB 3.5Å; I185-H216 HydrophobicContact CD1-CB 4.37Å; I185-H216 WeakPolarHBondContact CG2-NE2 3.11Å; I185-V219 HydrophobicContact CD1-CG2 4.38Å
186E91.3Very high87.7Confident108 Ų10842.3 Ų42.351%0.50521%0.206SC..Hα-helixtrans-56.9-41.3-178.5-71.7168.6-161.100111.5Q182 K183 Q190Q182-E186 PolarHBondContact NE2-OE1 3.35Å; Q182-E186 PolarHBondContact O-N 3.31Å; K183-E186 PolarHBondContact O-N 3.08Å; E186-Q190 VanDerWaalsContact O-CB 3.29Å; E186-Q190 WeakPolarHBondContact O-CB 3.27Å; E186-Q190 PolarHBondContact O-N 2.84Å
187I92.7Very high87.3Confident12 Ų1248.9 Ų48.96%0.06224%0.241CC..Hα-helixtrans-66-46.6177.4-67.9171.1000111.4L168 V171 K183 A184 I185 Q190 V191L168-I187 HydrophobicContact CB-CG2 3.87Å; L168-I187 HydrophobicContact CD2-CG2 4.3Å; L168-I187 VanDerWaalsContact O-CG2 3.27Å; L168-I187 WeakPolarHBondContact O-CG2 3.42Å; V171-I187 HydrophobicContact CB-CD1 4.16Å; V171-I187 HydrophobicContact CG1-CD1 3.45Å; V171-I187 VanDerWaalsContact CG1-CD1 3.45Å; K183-I187 HydrophobicContact CG-CD1 4.14Å; K183-I187 VanDerWaalsContact O-CG1 3.27Å; K183-I187 WeakPolarHBondContact O-CG1 3.35Å; K183-I187 PolarHBondContact O-N 3.49Å; A184-I187 PolarHBondContact O-N 3.41Å; I185-I187 PolarHBondContact O-N 3.01Å; I187-Q190 PolarHBondContact O-N 3.21Å; I187-V191 HydrophobicContact CG2-CG2 4.49Å; I187-V191 VanDerWaalsContact O-CG2 3.31Å; I187-V191 WeakPolarHBondContact O-CG2 3.45Å; I187-V191 PolarHBondContact O-N 3.3Å
188Y91.8Very high87Confident3 Ų348.5 Ų48.51%0.01224%0.241CC..Hα-helixtrans-67.5-37.5179.5-74-55.2000112.4L169 A173 A184 I185 G192 K211 W278L169-Y188 HydrophobicContact CD2-CD1 3.91Å; L169-Y188 HydrophobicContact CD2-CE1 3.8Å; A173-Y188 WeakPolarHBondContact CA-OH 3.46Å; A173-Y188 PolarHBondContact N-OH 3.08Å; A173-Y188 VanDerWaalsContact N-OH 3.16Å; A184-Y188 HydrophobicContact CB-CD2 4.43Å; A184-Y188 HydrophobicContact CB-CE2 4.28Å; A184-Y188 WeakPolarHBondContact O-CD2 3.44Å; A184-Y188 PolarHBondContact O-N 3.35Å; I185-Y188 PolarHBondContact O-N 3.06Å; I185-Y188 VanDerWaalsContact O-N 3.12Å; Y188-G192 PolarHBondContact O-N 3.09Å; Y188-K211 HydrophobicContact CD1-CB 4.26Å; Y188-K211 HydrophobicContact CD2-CB 4.1Å; Y188-K211 HydrophobicContact CE1-CB 4.13Å; Y188-K211 HydrophobicContact CE1-CD 3.93Å; Y188-K211 HydrophobicContact CE2-CB 3.97Å; Y188-K211 HydrophobicContact CG-CB 4.26Å; Y188-W278 HydrophobicContact CE2-CH2 4.42Å; Y188-W278 HydrophobicContact CE2-CZ2 4.17Å
189E89.8Confident86.5Confident51 Ų5151 Ų5124%0.23826%0.26CS..Hα-helixtrans-64.1-43.9173.2-74.5-155139.800111.4I185 G192 A193 K230 Y231I185-E189 HydrophobicContact CG2-CG 4.38Å; I185-E189 PolarHBondContact O-N 3.3Å; E189-G192 PolarHBondContact O-N 3.47Å; E189-A193 WeakPolarHBondContact O-CB 3.29Å; E189-A193 PolarHBondContact O-N 3.01Å; E189-K230 IonicContact OE1-NZ 2.73Å; E189-K230 PolarHBondContact OE1-NZ 3.4Å; E189-K230 IonicContact OE2-NZ 3.26Å; E189-K230 PolarHBondContact OE2-NZ 3.4Å; E189-Y231 HydrophobicContact CG-CE1 4.26Å; E189-Y231 VanDerWaalsContact CG-OH 3.25Å; E189-Y231 WeakPolarHBondContact CG-OH 3.37Å; E189-Y231 VanDerWaalsContact OE1-CE1 3.22Å; E189-Y231 WeakPolarHBondContact OE1-CE1 3.42Å; E189-Y231 PolarHBondContact OE1-OH 2.89Å
190Q89.8Confident86.1Confident66 Ų6651.7 Ų51.731%0.30827%0.268SS..Hα-helixtrans-62.2-46.4177.3-176.2-173.4-26.700111.4K156 E186 I187 A193 N194K156-Q190 VanDerWaalsContact NZ-NE2 3.14Å; E186-Q190 VanDerWaalsContact O-CB 3.29Å; E186-Q190 WeakPolarHBondContact O-CB 3.27Å; E186-Q190 PolarHBondContact O-N 2.84Å; I187-Q190 PolarHBondContact O-N 3.21Å; Q190-A193 PolarHBondContact O-N 3.31Å; Q190-N194 WeakPolarHBondContact O-CB 3.48Å; Q190-N194 PolarHBondContact O-N 3.38Å; Q190-N194 PolarHBondContact O-ND2 3.05Å
191V89.9Confident85.6Confident0 Ų050.6 Ų50.60%026%0.264CS..Hα-helixtrans-66.2-40.5177.3175.40000110.5N165 L168 L169 I187 N194 T195 Y208N165-V191 HydrophobicContact CB-CG1 4.01Å; L168-V191 HydrophobicContact CB-CG2 3.58Å; L168-V191 HydrophobicContact CD1-CG2 3.77Å; L168-V191 HydrophobicContact CG-CG2 4.33Å; L169-V191 HydrophobicContact CD2-CG1 3.97Å; L169-V191 HydrophobicContact CG-CG1 4.17Å; I187-V191 HydrophobicContact CG2-CG2 4.49Å; I187-V191 VanDerWaalsContact O-CG2 3.31Å; I187-V191 WeakPolarHBondContact O-CG2 3.45Å; I187-V191 PolarHBondContact O-N 3.3Å; V191-N194 PolarHBondContact O-N 3.04Å; V191-T195 HydrophobicContact CG1-CG2 4.19Å; V191-T195 WeakPolarHBondContact O-CB 3.32Å; V191-T195 VanDerWaalsContact O-CG2 3.26Å; V191-T195 WeakPolarHBondContact O-CG2 3.37Å; V191-T195 PolarHBondContact O-N 3.34Å; V191-T195 PolarHBondContact O-OG1 3.11Å; V191-T195 VanDerWaalsContact O-OG1 3.06Å; V191-Y208 HydrophobicContact CG1-CD2 3.84Å; V191-Y208 HydrophobicContact CG1-CE2 3.85Å; V191-Y208 HydrophobicContact CG1-CG 4.37Å
192G87.4Confident84.8Confident0 Ų054.2 Ų54.20%028%0.28CS..Hα-helixtrans-54.9-54.1173.700000111.9Y188 E189 N194 T195 M196Y188-G192 PolarHBondContact O-N 3.09Å; E189-G192 PolarHBondContact O-N 3.47Å; G192-N194 PolarHBondContact O-N 2.92Å; G192-T195 PolarHBondContact O-N 2.92Å; G192-T195 PolarHBondContact O-OG1 3.12Å; G192-M196 WeakPolarHBondContact O-CG 3.41Å; G192-M196 PolarHBondContact O-N 3.36Å
193A85.4Confident84.2Confident38 Ų3858.3 Ų58.331%0.31429%0.293SS..Hα-helixtrans-53.3-52.917500000112.3E189 Q190 T195 M196 D197E189-A193 WeakPolarHBondContact O-CB 3.29Å; E189-A193 PolarHBondContact O-N 3.01Å; Q190-A193 PolarHBondContact O-N 3.31Å; A193-T195 VanDerWaalsContact C-N 3.26Å; A193-T195 PolarHBondContact O-N 3.19Å; A193-M196 HydrophobicContact CB-CE 4.49Å; A193-M196 PolarHBondContact O-N 3.12Å; A193-M196 VanDerWaalsContact O-N 3.13Å; A193-D197 PolarHBondContact O-N 3.49Å
194N84.4Confident83.8Confident50 Ų5057.3 Ų57.327%0.26729%0.293SS..Hα-helixtrans-62.8-31.8-179.7-68.2-12.9000113.2Q190 V191 G192Q190-N194 WeakPolarHBondContact O-CB 3.48Å; Q190-N194 PolarHBondContact O-N 3.38Å; Q190-N194 PolarHBondContact O-ND2 3.05Å; V191-N194 PolarHBondContact O-N 3.04Å; G192-N194 PolarHBondContact O-N 2.92Å
195T83Confident83.5Confident0 Ų057.3 Ų57.30%029%0.293CS..Hα-helixtrans-79.9-21.7178.158.50000113.7V191 G192 A193 N198 L201 Y208V191-T195 HydrophobicContact CG1-CG2 4.19Å; V191-T195 WeakPolarHBondContact O-CB 3.32Å; V191-T195 VanDerWaalsContact O-CG2 3.26Å; V191-T195 WeakPolarHBondContact O-CG2 3.37Å; V191-T195 PolarHBondContact O-N 3.34Å; V191-T195 PolarHBondContact O-OG1 3.11Å; V191-T195 VanDerWaalsContact O-OG1 3.06Å; G192-T195 PolarHBondContact O-N 2.92Å; G192-T195 PolarHBondContact O-OG1 3.12Å; A193-T195 VanDerWaalsContact C-N 3.26Å; A193-T195 PolarHBondContact O-N 3.19Å; T195-N198 PolarHBondContact O-N 3.36Å; T195-L201 HydrophobicContact CG2-CB 4.09Å; T195-L201 HydrophobicContact CG2-CD1 4Å; T195-Y208 HydrophobicContact CG2-CD2 4.23Å; T195-Y208 HydrophobicContact CG2-CE2 3.69Å
196M79.5Confident83.1Confident44 Ų4459.5 Ų59.522%0.21730%0.303CS..Hα-helixtrans-70-34.6172.8-72.7-170.7-65.400112.3G192 A193 N198 A205 F209 M234 F235G192-M196 WeakPolarHBondContact O-CG 3.41Å; G192-M196 PolarHBondContact O-N 3.36Å; A193-M196 HydrophobicContact CB-CE 4.49Å; A193-M196 PolarHBondContact O-N 3.12Å; A193-M196 VanDerWaalsContact O-N 3.13Å; M196-N198 PolarHBondContact O-N 3.17Å; M196-A205 HydrophobicContact CG-CB 4.17Å; M196-F209 HydrophobicContact CE-CE2 4.25Å; M196-F209 HydrophobicContact CE-CZ 3.63Å; M196-F209 HydrophobicContact CG-CE2 4.27Å; M196-F209 HydrophobicContact CG-CZ 4.47Å; M196-F209 HydrophobicContact SD-CE2 3.78Å; M196-F209 HydrophobicContact SD-CZ 3.79Å; M196-M234 HydrophobicContact CE-CE 3.75Å; M196-F235 HydrophobicContact CG-CD2 4.48Å; M196-F235 HydrophobicContact SD-CB 4.31Å; M196-F235 HydrophobicContact SD-CD2 4.18Å
197D78.6Confident82.9Confident138 Ų13858.2 Ų58.274%0.73830%0.297SS*.SBendtrans-63.9-21.5175.6-70.1-20.9000112.5A193 P199A193-D197 PolarHBondContact O-N 3.49Å; D197-P199 WeakPolarHBondContact O-CD 3.4Å
198N78.3Confident82.7Confident58 Ų5859 Ų5931%0.3130%0.299SS..SBendtrans-103.6110.2178.2-168.3-28000111.8T195 M196 L200 L201 K202T195-N198 PolarHBondContact O-N 3.36Å; M196-N198 PolarHBondContact O-N 3.17Å; N198-L200 PolarHBondContact O-N 2.89Å; N198-L200 WeakPolarHBondContact OD1-CB 3.43Å; N198-L200 PolarHBondContact OD1-N 2.67Å; N198-L201 HydrophobicContact CB-CB 4.42Å; N198-L201 HydrophobicContact CB-CD1 4.42Å; N198-L201 HydrophobicContact CB-CG 4.44Å; N198-L201 PolarHBondContact O-N 3.15Å; N198-K202 PolarHBondContact O-N 3.41Å
199P73.8Confident82.5Confident102 Ų10259 Ų5966%0.66230%0.299SS*.THydrogen-bonded Turntrans-55.4-26.1-179.5-2734.9000114.9D197 K202D197-P199 WeakPolarHBondContact O-CD 3.4Å; P199-K202 WeakPolarHBondContact O-CB 3.33Å
200L77.3Confident82.4Confident148 Ų14856.8 Ų56.878%0.77529%0.289SS*.THydrogen-bonded Turntrans-75.3-31.5179.7-60.6175.3000112.9N198N198-L200 PolarHBondContact O-N 2.89Å; N198-L200 WeakPolarHBondContact OD1-CB 3.43Å; N198-L200 PolarHBondContact OD1-N 2.67Å
201L76.1Confident82.4Confident51 Ų5154.9 Ų54.927%0.26728%0.28SS..THydrogen-bonded Turntrans-96.3-1.3-177.2-60.2178.8000112.8T195 N198 Y203 S204 A205T195-L201 HydrophobicContact CG2-CB 4.09Å; T195-L201 HydrophobicContact CG2-CD1 4Å; N198-L201 HydrophobicContact CB-CB 4.42Å; N198-L201 HydrophobicContact CB-CD1 4.42Å; N198-L201 HydrophobicContact CB-CG 4.44Å; N198-L201 PolarHBondContact O-N 3.15Å; L201-Y203 PolarHBondContact O-N 2.95Å; L201-S204 WeakPolarHBondContact O-CB 3.45Å; L201-S204 PolarHBondContact O-N 3.07Å; L201-A205 PolarHBondContact O-N 2.93Å
202K71.7Confident82.4Confident99 Ų9954.9 Ų54.943%0.4328%0.28SS..Hα-helixtrans-51.5-33.6-178.8-164.9-179.4-179.8178.30113.7N198 P199 F235N198-K202 PolarHBondContact O-N 3.41Å; P199-K202 WeakPolarHBondContact O-CB 3.33Å; K202-F235 HydrophobicContact CD-CE2 3.9Å; K202-F235 HydrophobicContact CD-CZ 4.19Å; K202-F235 HydrophobicContact CG-CE2 3.43Å; K202-F235 VanDerWaalsContact CG-CE2 3.43Å; K202-F235 HydrophobicContact CG-CZ 3.64Å
203Y75.9Confident82.4Confident189 Ų18954.9 Ų54.974%0.74128%0.28SS*.Hα-helixtrans-73.6-30.8178.1-67.4-77.7000113.3L201 K206L201-Y203 PolarHBondContact O-N 2.95Å; Y203-K206 VanDerWaalsContact O-CE 3.22Å; Y203-K206 WeakPolarHBondContact O-CE 3.49Å
204S81.5Confident82.6Confident43 Ų4353.1 Ų53.130%0.30127%0.265SS..Hα-helixtrans-77.9-24.9178.7-57.60000112.5L201 K206 E207 Y208L201-S204 WeakPolarHBondContact O-CB 3.45Å; L201-S204 PolarHBondContact O-N 3.07Å; S204-K206 PolarHBondContact O-N 3.33Å; S204-E207 WeakPolarHBondContact O-CB 3.27Å; S204-E207 PolarHBondContact O-N 2.87Å; S204-Y208 PolarHBondContact O-N 3.37Å
205A82.9Confident82.8Confident0 Ų050.8 Ų50.80%025%0.253CS..Hα-helixtrans-54.8-36.1177.800000112.8M196 L201 E207 Y208 F209M196-A205 HydrophobicContact CG-CB 4.17Å; L201-A205 PolarHBondContact O-N 2.93Å; A205-E207 VanDerWaalsContact C-N 3.28Å; A205-E207 PolarHBondContact O-N 3.34Å; A205-Y208 PolarHBondContact O-N 3.47Å; A205-Y208 VanDerWaalsContact O-N 3.11Å; A205-F209 HydrophobicContact CB-CD2 4.44Å; A205-F209 HydrophobicContact CB-CE2 4.13Å; A205-F209 WeakPolarHBondContact O-CD2 3.45Å; A205-F209 PolarHBondContact O-N 2.86Å
206K84.6Confident83Confident49 Ų4951.9 Ų51.921%0.21326%0.258CS..Hα-helixtrans-58.6-39.4177.2-59.6-177.6-71156.40112.6Y203 S204 Y208 F210 F235 F238Y203-K206 VanDerWaalsContact O-CE 3.22Å; Y203-K206 WeakPolarHBondContact O-CE 3.49Å; S204-K206 PolarHBondContact O-N 3.33Å; K206-Y208 VanDerWaalsContact C-N 3.34Å; K206-F210 WeakPolarHBondContact O-CB 3.42Å; K206-F210 PolarHBondContact O-N 2.93Å; K206-F235 HydrophobicContact CD-CE1 4.36Å; K206-F235 HydrophobicContact CG-CE1 3.96Å; K206-F238 HydrophobicContact CB-CD2 4.12Å; K206-F238 HydrophobicContact CB-CE2 4.46Å; K206-F238 HydrophobicContact CG-CD2 4.23Å
207E85.8Confident83.1Confident81 Ų8150.1 Ų50.138%0.37925%0.249SC..Hα-helixtrans-67.8-38.3178.2-167.7-171.8150.100110.5S204 A205 F210 K211S204-E207 WeakPolarHBondContact O-CB 3.27Å; S204-E207 PolarHBondContact O-N 2.87Å; A205-E207 VanDerWaalsContact C-N 3.28Å; A205-E207 PolarHBondContact O-N 3.34Å; E207-F210 WeakPolarHBondContact O-CB 3.2Å; E207-F210 PolarHBondContact O-N 3.35Å; E207-K211 VanDerWaalsContact O-CG 3.31Å; E207-K211 WeakPolarHBondContact O-CG 3.44Å; E207-K211 PolarHBondContact O-N 3.15Å; E207-K211 VanDerWaalsContact OE1-CE 3.29Å; E207-K211 WeakPolarHBondContact OE1-CE 3.37Å; E207-K211 IonicContact OE1-NZ 2.64Å; E207-K211 PolarHBondContact OE1-NZ 3.3Å
208Y88.6Confident83.2Confident29 Ų2945.1 Ų45.111%0.11422%0.222CC..Hα-helixtrans-69.2-42.7179.7-51.2-33.9000112.1L169 V191 T195 S204 A205 K206 F210 K211 A212L169-Y208 HydrophobicContact CD1-CD1 4.46Å; L169-Y208 HydrophobicContact CD1-CE1 3.54Å; L169-Y208 WeakPolarHBondContact CD1-OH 3.38Å; L169-Y208 HydrophobicContact CD2-CD1 3.42Å; L169-Y208 VanDerWaalsContact CD2-CD1 3.42Å; L169-Y208 HydrophobicContact CD2-CE1 3.35Å; L169-Y208 HydrophobicContact CD2-CG 4.15Å; L169-Y208 HydrophobicContact CG-CE1 4.09Å; V191-Y208 HydrophobicContact CG1-CD2 3.84Å; V191-Y208 HydrophobicContact CG1-CE2 3.85Å; V191-Y208 HydrophobicContact CG1-CG 4.37Å; T195-Y208 HydrophobicContact CG2-CD2 4.23Å; T195-Y208 HydrophobicContact CG2-CE2 3.69Å; S204-Y208 PolarHBondContact O-N 3.37Å; A205-Y208 PolarHBondContact O-N 3.47Å; A205-Y208 VanDerWaalsContact O-N 3.11Å; K206-Y208 VanDerWaalsContact C-N 3.34Å; Y208-F210 VanDerWaalsContact C-N 3.31Å; Y208-F210 PolarHBondContact O-N 2.96Å; Y208-K211 PolarHBondContact O-N 2.79Å; Y208-A212 PolarHBondContact O-N 3.14Å
209F87.8Confident83.4Confident3 Ų345.8 Ų45.81%0.01323%0.228CC..Hα-helixtrans-64.6-36.2173.6-68.5-54.7000112.5M196 A205 A212 S213 Y231 F238M196-F209 HydrophobicContact CE-CE2 4.25Å; M196-F209 HydrophobicContact CE-CZ 3.63Å; M196-F209 HydrophobicContact CG-CE2 4.27Å; M196-F209 HydrophobicContact CG-CZ 4.47Å; M196-F209 HydrophobicContact SD-CE2 3.78Å; M196-F209 HydrophobicContact SD-CZ 3.79Å; A205-F209 HydrophobicContact CB-CD2 4.44Å; A205-F209 HydrophobicContact CB-CE2 4.13Å; A205-F209 WeakPolarHBondContact O-CD2 3.45Å; A205-F209 PolarHBondContact O-N 2.86Å; F209-A212 PolarHBondContact O-N 3Å; F209-S213 WeakPolarHBondContact O-CB 3.48Å; F209-S213 PolarHBondContact O-N 3.03Å; F209-S213 PolarHBondContact O-OG 3.25Å; F209-Y231 HydrophobicContact CB-CD2 3.85Å; F209-Y231 HydrophobicContact CB-CE2 4.28Å; F209-Y231 HydrophobicContact CB-CG 4.11Å; F209-Y231 AromaticContact CD1-CD1 3.39Å; F209-Y231 HydrophobicContact CD1-CD1 3.39Å; F209-Y231 AromaticContact CD1-CD2 3.89Å; F209-Y231 HydrophobicContact CD1-CD2 3.89Å; F209-Y231 AromaticContact CD1-CE1 3.55Å; F209-Y231 HydrophobicContact CD1-CE1 3.55Å; F209-Y231 HydrophobicContact CD1-CE2 4.01Å; F209-Y231 AromaticContact CD1-CG 3.6Å; F209-Y231 HydrophobicContact CD1-CG 3.6Å; F209-Y231 AromaticContact CD1-CZ 3.87Å; F209-Y231 AromaticContact CE1-CD1 3.62Å; F209-Y231 HydrophobicContact CE1-CD1 3.62Å; F209-Y231 AromaticContact CE1-CE1 3.79Å; F209-Y231 HydrophobicContact CE1-CE1 3.79Å; F209-Y231 HydrophobicContact CE1-CG 4.23Å; F209-Y231 HydrophobicContact CG-CD1 4.2Å; F209-Y231 HydrophobicContact CG-CD2 4.16Å; F209-Y231 AromaticContact CG-CG 3.97Å; F209-Y231 HydrophobicContact CG-CG 3.97Å; F209-F238 HydrophobicContact CB-CE2 4.05Å; F209-F238 HydrophobicContact CB-CZ 4.03Å
210F88.4Confident83.7Confident4 Ų444.2 Ų44.22%0.01821%0.214CC..Hα-helixtrans-61-47.3172.5-178.7-119.5000111.5K206 E207 Y208 A212 S213 L214 E243 L246 L247 H279K206-F210 WeakPolarHBondContact O-CB 3.42Å; K206-F210 PolarHBondContact O-N 2.93Å; E207-F210 WeakPolarHBondContact O-CB 3.2Å; E207-F210 PolarHBondContact O-N 3.35Å; Y208-F210 VanDerWaalsContact C-N 3.31Å; Y208-F210 PolarHBondContact O-N 2.96Å; F210-A212 PolarHBondContact O-N 2.96Å; F210-S213 PolarHBondContact O-N 3.14Å; F210-L214 HydrophobicContact CD1-CD1 4.16Å; F210-L214 HydrophobicContact CE1-CD1 3.72Å; F210-L214 HydrophobicContact CE2-CD1 4.25Å; F210-L214 HydrophobicContact CE2-CD2 4.35Å; F210-L214 HydrophobicContact CE2-CG 4.25Å; F210-L214 HydrophobicContact CZ-CD1 3.75Å; F210-L214 HydrophobicContact CZ-CD2 4.37Å; F210-L214 HydrophobicContact CZ-CG 4.23Å; F210-L214 WeakPolarHBondContact O-CG 3.47Å; F210-L214 PolarHBondContact O-N 2.74Å; F210-E243 HydrophobicContact CB-CB 3.94Å; F210-E243 HydrophobicContact CB-CG 4.29Å; F210-E243 HydrophobicContact CD1-CG 4.44Å; F210-E243 HydrophobicContact CD2-CB 3.72Å; F210-E243 HydrophobicContact CD2-CG 4.46Å; F210-E243 HydrophobicContact CE2-CB 4.39Å; F210-E243 HydrophobicContact CG-CB 3.83Å; F210-E243 HydrophobicContact CG-CG 4.16Å; F210-L246 HydrophobicContact CE2-CD2 4.05Å; F210-L246 HydrophobicContact CZ-CD2 3.8Å; F210-L247 HydrophobicContact CD2-CD1 3.73Å; F210-L247 HydrophobicContact CD2-CD2 3.84Å; F210-L247 HydrophobicContact CD2-CG 3.62Å; F210-L247 HydrophobicContact CE2-CD1 4.36Å; F210-L247 HydrophobicContact CE2-CD2 3.73Å; F210-L247 HydrophobicContact CE2-CG 3.73Å; F210-H279 AromaticContact CD1-CD2 3.87Å; F210-H279 AromaticContact CD1-NE2 3.77Å; F210-H279 AromaticContact CE1-CD2 3.44Å; F210-H279 VanDerWaalsContact CE1-CD2 3.44Å; F210-H279 WeakPolarHBondContact CE1-CD2 3.49Å; F210-H279 AromaticContact CE1-NE2 3.78Å
211K89.5Confident83.6Confident26 Ų2639.8 Ų39.811%0.11319%0.189CC..Hα-helixtrans-63.1-41.5176.8-68.3-175.5-179171.30112.7Y188 E207 Y208 L214 C215 W278 H279Y188-K211 HydrophobicContact CD1-CB 4.26Å; Y188-K211 HydrophobicContact CD2-CB 4.1Å; Y188-K211 HydrophobicContact CE1-CB 4.13Å; Y188-K211 HydrophobicContact CE1-CD 3.93Å; Y188-K211 HydrophobicContact CE2-CB 3.97Å; Y188-K211 HydrophobicContact CG-CB 4.26Å; E207-K211 VanDerWaalsContact O-CG 3.31Å; E207-K211 WeakPolarHBondContact O-CG 3.44Å; E207-K211 PolarHBondContact O-N 3.15Å; E207-K211 VanDerWaalsContact OE1-CE 3.29Å; E207-K211 WeakPolarHBondContact OE1-CE 3.37Å; E207-K211 IonicContact OE1-NZ 2.64Å; E207-K211 PolarHBondContact OE1-NZ 3.3Å; Y208-K211 PolarHBondContact O-N 2.79Å; K211-L214 PolarHBondContact O-N 3.02Å; K211-C215 PolarHBondContact O-N 3.41Å; K211-C215 VanDerWaalsContact O-N 3.13Å; K211-C215 PolarHBondContact O-SG 3.03Å; K211-W278 HydrophobicContact CB-CH2 3.68Å; K211-W278 HydrophobicContact CB-CZ3 3.96Å; K211-W278 HydrophobicContact CD-CE3 4.34Å; K211-W278 HydrophobicContact CD-CH2 4.15Å; K211-W278 HydrophobicContact CD-CZ3 3.96Å; K211-W278 HydrophobicContact CG-CE3 4.28Å; K211-W278 HydrophobicContact CG-CH2 3.73Å; K211-W278 HydrophobicContact CG-CZ3 3.49Å; K211-W278 VanDerWaalsContact CG-CZ3 3.49Å; K211-H279 WeakPolarHBondContact CE-NE2 3.29Å
212A89.6Confident83.9Confident0 Ų042.5 Ų42.50%020%0.203CC..Hα-helixtrans-61.5-45.8174.800000111.5Y208 F209 F210 L214 C215 H216 Y231Y208-A212 PolarHBondContact O-N 3.14Å; F209-A212 PolarHBondContact O-N 3Å; F210-A212 PolarHBondContact O-N 2.96Å; A212-L214 PolarHBondContact O-N 3.47Å; A212-C215 WeakPolarHBondContact O-CB 3.11Å; A212-C215 PolarHBondContact O-N 2.99Å; A212-C215 VanDerWaalsContact O-N 3.13Å; A212-H216 PolarHBondContact O-CD2 3.44Å; A212-H216 PolarHBondContact O-N 3.3Å; A212-Y231 HydrophobicContact CB-CE2 4.34Å
213S88.4Confident84.4Confident1 Ų141 Ų411%0.00720%0.2CC..Hα-helixtrans-62.6-42.2179.5-55.50000112.1F209 F210 C215 H216 F217 Y231 L247F209-S213 WeakPolarHBondContact O-CB 3.48Å; F209-S213 PolarHBondContact O-N 3.03Å; F209-S213 PolarHBondContact O-OG 3.25Å; F210-S213 PolarHBondContact O-N 3.14Å; S213-C215 VanDerWaalsContact C-N 3.3Å; S213-C215 PolarHBondContact O-N 3.36Å; S213-H216 WeakPolarHBondContact O-CB 3.44Å; S213-H216 PolarHBondContact O-N 3.39Å; S213-F217 WeakPolarHBondContact O-CB 3.45Å; S213-F217 PolarHBondContact O-N 2.96Å; S213-Y231 WeakPolarHBondContact OG-CE2 3.41Å; S213-L247 VanDerWaalsContact CB-CD1 3.42Å
214L88.3Confident84.7Confident1 Ų132.1 Ų32.11%0.00517%0.166CC..Hα-helixtrans-62.6-36.9174.4-70.5176000112.3F210 K211 A212 F217 I218 L247 W278 L282 L283 I286F210-L214 HydrophobicContact CD1-CD1 4.16Å; F210-L214 HydrophobicContact CE1-CD1 3.72Å; F210-L214 HydrophobicContact CE2-CD1 4.25Å; F210-L214 HydrophobicContact CE2-CD2 4.35Å; F210-L214 HydrophobicContact CE2-CG 4.25Å; F210-L214 HydrophobicContact CZ-CD1 3.75Å; F210-L214 HydrophobicContact CZ-CD2 4.37Å; F210-L214 HydrophobicContact CZ-CG 4.23Å; F210-L214 WeakPolarHBondContact O-CG 3.47Å; F210-L214 PolarHBondContact O-N 2.74Å; K211-L214 PolarHBondContact O-N 3.02Å; A212-L214 PolarHBondContact O-N 3.47Å; L214-F217 WeakPolarHBondContact O-CB 3.3Å; L214-F217 PolarHBondContact O-N 3.42Å; L214-I218 PolarHBondContact O-N 3.07Å; L214-L247 HydrophobicContact CD2-CD2 3.97Å; L214-L247 HydrophobicContact CG-CD2 4.29Å; L214-W278 HydrophobicContact CD1-CZ3 4.31Å; L214-L282 HydrophobicContact CB-CD2 4.2Å; L214-L283 HydrophobicContact CD2-CD2 3.81Å; L214-I286 HydrophobicContact CD2-CD1 3.93Å
215C88.7Confident84.9Confident0 Ų033.8 Ų33.80%017%0.167CC..Hα-helixtrans-69.3-41175.3-640000111.5Y181 I185 K211 A212 S213 F217 I218 V219Y181-C215 HydrophobicContact CD1-CB 4.35Å; I185-C215 HydrophobicContact CD1-CB 4.07Å; I185-C215 HydrophobicContact CG1-CB 3.5Å; K211-C215 PolarHBondContact O-N 3.41Å; K211-C215 VanDerWaalsContact O-N 3.13Å; K211-C215 PolarHBondContact O-SG 3.03Å; A212-C215 WeakPolarHBondContact O-CB 3.11Å; A212-C215 PolarHBondContact O-N 2.99Å; A212-C215 VanDerWaalsContact O-N 3.13Å; S213-C215 VanDerWaalsContact C-N 3.3Å; S213-C215 PolarHBondContact O-N 3.36Å; C215-F217 VanDerWaalsContact C-N 3.26Å; C215-F217 PolarHBondContact O-N 3.49Å; C215-I218 PolarHBondContact O-N 2.93Å; C215-V219 PolarHBondContact O-N 2.9Å
216H86.9Confident85.2Confident23 Ų2338 Ų3811%0.10619%0.189CC..Hα-helixtrans-57.8-42.4172.9-87.6-69.4000111.5I185 A212 S213 I218 V219 D220 A224I185-H216 HydrophobicContact CD1-CB 4.37Å; I185-H216 WeakPolarHBondContact CG2-NE2 3.11Å; A212-H216 PolarHBondContact O-CD2 3.44Å; A212-H216 PolarHBondContact O-N 3.3Å; S213-H216 WeakPolarHBondContact O-CB 3.44Å; S213-H216 PolarHBondContact O-N 3.39Å; H216-I218 PolarHBondContact O-N 3.43Å; H216-V219 PolarHBondContact O-N 3.15Å; H216-D220 CarbonylContact O-C 3.3Å; H216-D220 PolarHBondContact O-N 3.05Å; H216-A224 HydrophobicContact CB-CB 3.92Å
217F81.6Confident85.3Confident8 Ų836 Ų364%0.03518%0.181CC..Hα-helixtrans-59-34.2-178.5-155.1-82000113.3S213 L214 C215 A224 L251 H254 I286S213-F217 WeakPolarHBondContact O-CB 3.45Å; S213-F217 PolarHBondContact O-N 2.96Å; L214-F217 WeakPolarHBondContact O-CB 3.3Å; L214-F217 PolarHBondContact O-N 3.42Å; C215-F217 VanDerWaalsContact C-N 3.26Å; C215-F217 PolarHBondContact O-N 3.49Å; F217-A224 HydrophobicContact CB-CB 4.12Å; F217-A224 HydrophobicContact CD2-CB 3.91Å; F217-A224 HydrophobicContact CG-CB 4.41Å; F217-L251 HydrophobicContact CD2-CD2 3.73Å; F217-L251 HydrophobicContact CD2-CG 4.26Å; F217-L251 HydrophobicContact CE2-CB 4.36Å; F217-L251 HydrophobicContact CE2-CD2 3.38Å; F217-L251 HydrophobicContact CE2-CG 3.73Å; F217-L251 HydrophobicContact CZ-CD2 4.47Å; F217-H254 HydrophobicContact CE1-CB 4.01Å; F217-H254 AromaticContact CE1-CD2 3.34Å; F217-H254 WeakPolarHBondContact CE1-CD2 3.45Å; F217-H254 AromaticContact CE1-CG 3.77Å; F217-H254 HydrophobicContact CE2-CB 4.5Å; F217-H254 HydrophobicContact CZ-CB 3.47Å; F217-H254 VanDerWaalsContact CZ-CB 3.47Å; F217-H254 AromaticContact CZ-CD2 3.76Å; F217-H254 AromaticContact CZ-CG 3.69Å; F217-I286 HydrophobicContact CB-CD1 3.96Å; F217-I286 HydrophobicContact CB-CG1 4.48Å; F217-I286 HydrophobicContact CD1-CB 4.13Å; F217-I286 HydrophobicContact CD1-CD1 3.78Å; F217-I286 HydrophobicContact CD1-CG1 3.77Å; F217-I286 HydrophobicContact CD1-CG2 3.25Å; F217-I286 HydrophobicContact CE1-CB 4.38Å; F217-I286 HydrophobicContact CE1-CG2 3.11Å; F217-I286 HydrophobicContact CG-CD1 4.08Å; F217-I286 HydrophobicContact CG-CG1 4.5Å; F217-I286 HydrophobicContact CG-CG2 4.42Å; F217-I286 HydrophobicContact CZ-CG2 4.18Å
218I81.9Confident85.3Confident32 Ų3232.3 Ų32.316%0.16417%0.165CC..Hα-helixtrans-73.8-30.9177.2-62.5167.3000111.4Y181 L214 C215 H216 L282 R285 I286Y181-I218 HydrophobicContact CD1-CB 4.45Å; Y181-I218 HydrophobicContact CD1-CD1 4.07Å; Y181-I218 HydrophobicContact CD2-CG2 3.89Å; Y181-I218 HydrophobicContact CE1-CB 4.33Å; Y181-I218 HydrophobicContact CE1-CD1 3.4Å; Y181-I218 VanDerWaalsContact CE1-CD1 3.4Å; Y181-I218 HydrophobicContact CE1-CG1 4.45Å; Y181-I218 HydrophobicContact CE1-CG2 4.16Å; Y181-I218 HydrophobicContact CE2-CB 4.39Å; Y181-I218 HydrophobicContact CE2-CG2 3.48Å; Y181-I218 VanDerWaalsContact CE2-CG2 3.48Å; Y181-I218 HydrophobicContact CG-CG2 4.37Å; L214-I218 PolarHBondContact O-N 3.07Å; C215-I218 PolarHBondContact O-N 2.93Å; H216-I218 PolarHBondContact O-N 3.43Å; I218-L282 HydrophobicContact CD1-CB 4.23Å; I218-L282 HydrophobicContact CD1-CD2 3.85Å; I218-L282 HydrophobicContact CD1-CG 3.95Å; I218-R285 HydrophobicContact CD1-CB 4.47Å; I218-I286 HydrophobicContact CD1-CG1 4.19Å; I218-I286 HydrophobicContact CG1-CD1 4.1Å; I218-I286 HydrophobicContact CG1-CG1 3.46Å; I218-I286 VanDerWaalsContact CG1-CG1 3.46Å
219V81.4Confident85.2Confident73 Ų7335.9 Ų35.944%0.44218%0.182SC..Hα-helixtrans-80.3-54.1-179.4178.70000110.8Y181 I185 C215 H216Y181-V219 HydrophobicContact CG-CG2 4.33Å; I185-V219 HydrophobicContact CD1-CG2 4.38Å; C215-V219 PolarHBondContact O-N 2.9Å; H216-V219 PolarHBondContact O-N 3.15Å
220D80.8Confident85.2Confident68 Ų6839.9 Ų39.936%0.36420%0.2SC..  trans-161.5128.6-177.7-179.19.5000110.4H216 L222 N223 A224H216-D220 CarbonylContact O-C 3.3Å; H216-D220 PolarHBondContact O-N 3.05Å; D220-L222 VanDerWaalsContact C-N 3.32Å; D220-L222 PolarHBondContact O-N 3.38Å; D220-L222 PolarHBondContact OD1-N 3.49Å; D220-L222 VanDerWaalsContact OD1-N 3.1Å; D220-N223 HydrophobicContact CB-CB 4.12Å; D220-N223 WeakPolarHBondContact CB-ND2 3.37Å; D220-N223 PolarHBondContact O-N 2.8Å; D220-N223 PolarHBondContact OD2-ND2 3.13Å; D220-A224 PolarHBondContact O-N 3.43Å; D220-A224 VanDerWaalsContact O-N 3.11Å
221E76.4Confident85Confident56 Ų5639.8 Ų39.826%0.26220%0.199SC..Hα-helixtrans-58.6-42.7177.6-175.7-163.5128.600111.9N223 A224 K225 L251 H254 E255E221-N223 VanDerWaalsContact C-N 3.31Å; E221-N223 PolarHBondContact O-N 3.49Å; E221-A224 WeakPolarHBondContact O-CB 3.24Å; E221-A224 PolarHBondContact O-N 3.24Å; E221-A224 VanDerWaalsContact O-N 3.12Å; E221-K225 PolarHBondContact O-N 3.24Å; E221-L251 HydrophobicContact CG-CD2 4.29Å; E221-H254 IonicContact OE2-CE1 3.64Å; E221-H254 PolarHBondContact OE2-CE1 3.08Å; E221-H254 VanDerWaalsContact OE2-CE1 3.26Å; E221-H254 IonicContact OE2-CG 2.8Å; E221-H254 IonicContact OE2-ND1 3.95Å; E221-H254 PolarHBondContact OE2-ND1 3.29Å; E221-E255 WeakPolarHBondContact OE1-CG 2.99Å
222L80.8Confident84.8Confident108 Ų10840.2 Ų40.257%0.56520%0.201SC*.Hα-helixtrans-64.3-41.4-178-176.466.1000110.7D220 A224 K225 I226D220-L222 VanDerWaalsContact C-N 3.32Å; D220-L222 PolarHBondContact O-N 3.38Å; D220-L222 PolarHBondContact OD1-N 3.49Å; D220-L222 VanDerWaalsContact OD1-N 3.1Å; L222-A224 VanDerWaalsContact C-N 3.3Å; L222-A224 PolarHBondContact O-N 2.94Å; L222-K225 PolarHBondContact O-N 2.92Å; L222-I226 HydrophobicContact CD1-CD1 4.48Å; L222-I226 HydrophobicContact CG-CD1 4.04Å; L222-I226 VanDerWaalsContact O-CG1 3.32Å; L222-I226 WeakPolarHBondContact O-CG1 3.34Å; L222-I226 PolarHBondContact O-N 3.44Å
223N82.5Confident84.6Confident67 Ų6748.2 Ų48.236%0.35824%0.239SC..Hα-helixtrans-64.4-36.2175.7-73.1-34.4000111.9D220 E221 A227D220-N223 HydrophobicContact CB-CB 4.12Å; D220-N223 WeakPolarHBondContact CB-ND2 3.37Å; D220-N223 PolarHBondContact O-N 2.8Å; D220-N223 PolarHBondContact OD2-ND2 3.13Å; E221-N223 VanDerWaalsContact C-N 3.31Å; E221-N223 PolarHBondContact O-N 3.49Å; N223-A227 WeakPolarHBondContact O-CB 3.27Å; N223-A227 PolarHBondContact O-N 2.81Å
224A83.4Confident84.2Confident2 Ų252.7 Ų52.72%0.01726%0.261CS..Hα-helixtrans-65-41.3175.500000112H216 F217 D220 E221 L222 A227 V228 L251H216-A224 HydrophobicContact CB-CB 3.92Å; F217-A224 HydrophobicContact CB-CB 4.12Å; F217-A224 HydrophobicContact CD2-CB 3.91Å; F217-A224 HydrophobicContact CG-CB 4.41Å; D220-A224 PolarHBondContact O-N 3.43Å; D220-A224 VanDerWaalsContact O-N 3.11Å; E221-A224 WeakPolarHBondContact O-CB 3.24Å; E221-A224 PolarHBondContact O-N 3.24Å; E221-A224 VanDerWaalsContact O-N 3.12Å; L222-A224 VanDerWaalsContact C-N 3.3Å; L222-A224 PolarHBondContact O-N 2.94Å; A224-A227 PolarHBondContact O-N 3.26Å; A224-V228 VanDerWaalsContact O-CG2 3.28Å; A224-V228 WeakPolarHBondContact O-CG2 3.43Å; A224-V228 PolarHBondContact O-N 3.47Å; A224-L251 HydrophobicContact CB-CD2 4.05Å
225K84.6Confident83.6Confident78 Ų7853.4 Ų53.434%0.33926%0.264SS..Hα-helixtrans-63-48.1176.8-166.3171.2-170.5161.90112E221 L222 A227 V228 E229 L251 E255E221-K225 PolarHBondContact O-N 3.24Å; L222-K225 PolarHBondContact O-N 2.92Å; K225-A227 VanDerWaalsContact C-N 3.33Å; K225-A227 PolarHBondContact O-N 2.98Å; K225-V228 PolarHBondContact O-N 2.98Å; K225-E229 WeakPolarHBondContact O-CG 3.5Å; K225-E229 PolarHBondContact O-N 3.42Å; K225-L251 HydrophobicContact CB-CD2 4.46Å; K225-E255 IonicContact NZ-OE1 2.69Å; K225-E255 PolarHBondContact NZ-OE1 3.18Å; K225-E255 IonicContact NZ-OE2 3.87Å
226I88.4Confident83.2Confident90 Ų9058 Ų5846%0.46229%0.293SS..Hα-helixtrans-61.4-42.3176.6-64165.8000110.8L222 E229 K230L222-I226 HydrophobicContact CD1-CD1 4.48Å; L222-I226 HydrophobicContact CG-CD1 4.04Å; L222-I226 VanDerWaalsContact O-CG1 3.32Å; L222-I226 WeakPolarHBondContact O-CG1 3.34Å; L222-I226 PolarHBondContact O-N 3.44Å; I226-E229 PolarHBondContact O-N 3.48Å; I226-K230 WeakPolarHBondContact O-CB 3.46Å; I226-K230 PolarHBondContact O-N 2.99Å
227A87Confident82.8Confident5 Ų559.2 Ų59.24%0.04131%0.308CS..Hα-helixtrans-63.7-43.7178.100000111.7N223 A224 K225 K230 Y231N223-A227 WeakPolarHBondContact O-CB 3.27Å; N223-A227 PolarHBondContact O-N 2.81Å; A224-A227 PolarHBondContact O-N 3.26Å; K225-A227 VanDerWaalsContact C-N 3.33Å; K225-A227 PolarHBondContact O-N 2.98Å; A227-K230 PolarHBondContact O-N 3.46Å; A227-Y231 HydrophobicContact CB-CE2 3.92Å; A227-Y231 WeakPolarHBondContact O-CD1 3.08Å; A227-Y231 WeakPolarHBondContact O-CD2 3.44Å; A227-Y231 PolarHBondContact O-N 3.31Å
228V86.4Confident82.6Confident5 Ų558.9 Ų58.93%0.0331%0.306CS..Hα-helixtrans-61.1-48.5176.6170.50000110.8A224 K225 K230 Y231 E232 L247 L251A224-V228 VanDerWaalsContact O-CG2 3.28Å; A224-V228 WeakPolarHBondContact O-CG2 3.43Å; A224-V228 PolarHBondContact O-N 3.47Å; K225-V228 PolarHBondContact O-N 2.98Å; V228-K230 VanDerWaalsContact C-N 3.35Å; V228-K230 PolarHBondContact O-N 3.43Å; V228-Y231 PolarHBondContact O-N 2.87Å; V228-Y231 VanDerWaalsContact O-N 3.13Å; V228-E232 WeakPolarHBondContact O-CG 3.46Å; V228-E232 PolarHBondContact O-N 2.91Å; V228-L247 HydrophobicContact CG2-CB 4.32Å; V228-L247 HydrophobicContact CG2-CD1 4Å; V228-L251 HydrophobicContact CG2-CD1 4.31Å
229E87.2Confident82.4Confident103 Ų10359 Ų5948%0.48131%0.311SS..Hα-helixtrans-57.7-46.2176.9-72.5176.5-176.700111.7K225 I226 Y231 E232 E233K225-E229 WeakPolarHBondContact O-CG 3.5Å; K225-E229 PolarHBondContact O-N 3.42Å; I226-E229 PolarHBondContact O-N 3.48Å; E229-Y231 VanDerWaalsContact C-N 3.33Å; E229-Y231 PolarHBondContact O-N 3.05Å; E229-E232 WeakPolarHBondContact O-CB 3.44Å; E229-E232 PolarHBondContact O-N 2.85Å; E229-E233 PolarHBondContact O-N 2.94Å
230K87.4Confident82.3Confident88 Ų8861.5 Ų61.538%0.38332%0.321SS..Hα-helixtrans-57.9-43.5174.6177.2-172.2169.4-159.90111.8E189 I226 A227 V228 E232 E233 M234E189-K230 IonicContact OE1-NZ 2.73Å; E189-K230 PolarHBondContact OE1-NZ 3.4Å; E189-K230 IonicContact OE2-NZ 3.26Å; E189-K230 PolarHBondContact OE2-NZ 3.4Å; I226-K230 WeakPolarHBondContact O-CB 3.46Å; I226-K230 PolarHBondContact O-N 2.99Å; A227-K230 PolarHBondContact O-N 3.46Å; V228-K230 VanDerWaalsContact C-N 3.35Å; V228-K230 PolarHBondContact O-N 3.43Å; K230-E232 VanDerWaalsContact C-N 3.32Å; K230-E232 PolarHBondContact O-N 3.28Å; K230-E233 PolarHBondContact O-N 3.06Å; K230-M234 HydrophobicContact CG-CG 4.46Å; K230-M234 HydrophobicContact CG-SD 3.91Å; K230-M234 WeakPolarHBondContact O-CB 3.36Å; K230-M234 WeakPolarHBondContact O-CG 3.48Å; K230-M234 PolarHBondContact O-N 3.4Å
231Y84.8Confident82.4Confident1 Ų158.7 Ų58.70%0.00431%0.307CS..Hα-helixtrans-68.3-31.6179.2-58.2-27.5000112.6E189 F209 A212 S213 A227 V228 E229 F235 F238E189-Y231 HydrophobicContact CG-CE1 4.26Å; E189-Y231 VanDerWaalsContact CG-OH 3.25Å; E189-Y231 WeakPolarHBondContact CG-OH 3.37Å; E189-Y231 VanDerWaalsContact OE1-CE1 3.22Å; E189-Y231 WeakPolarHBondContact OE1-CE1 3.42Å; E189-Y231 PolarHBondContact OE1-OH 2.89Å; F209-Y231 HydrophobicContact CB-CD2 3.85Å; F209-Y231 HydrophobicContact CB-CE2 4.28Å; F209-Y231 HydrophobicContact CB-CG 4.11Å; F209-Y231 AromaticContact CD1-CD1 3.39Å; F209-Y231 HydrophobicContact CD1-CD1 3.39Å; F209-Y231 AromaticContact CD1-CD2 3.89Å; F209-Y231 HydrophobicContact CD1-CD2 3.89Å; F209-Y231 AromaticContact CD1-CE1 3.55Å; F209-Y231 HydrophobicContact CD1-CE1 3.55Å; F209-Y231 HydrophobicContact CD1-CE2 4.01Å; F209-Y231 AromaticContact CD1-CG 3.6Å; F209-Y231 HydrophobicContact CD1-CG 3.6Å; F209-Y231 AromaticContact CD1-CZ 3.87Å; F209-Y231 AromaticContact CE1-CD1 3.62Å; F209-Y231 HydrophobicContact CE1-CD1 3.62Å; F209-Y231 AromaticContact CE1-CE1 3.79Å; F209-Y231 HydrophobicContact CE1-CE1 3.79Å; F209-Y231 HydrophobicContact CE1-CG 4.23Å; F209-Y231 HydrophobicContact CG-CD1 4.2Å; F209-Y231 HydrophobicContact CG-CD2 4.16Å; F209-Y231 AromaticContact CG-CG 3.97Å; F209-Y231 HydrophobicContact CG-CG 3.97Å; A212-Y231 HydrophobicContact CB-CE2 4.34Å; S213-Y231 WeakPolarHBondContact OG-CE2 3.41Å; A227-Y231 HydrophobicContact CB-CE2 3.92Å; A227-Y231 WeakPolarHBondContact O-CD1 3.08Å; A227-Y231 WeakPolarHBondContact O-CD2 3.44Å; A227-Y231 PolarHBondContact O-N 3.31Å; V228-Y231 PolarHBondContact O-N 2.87Å; V228-Y231 VanDerWaalsContact O-N 3.13Å; E229-Y231 VanDerWaalsContact C-N 3.33Å; E229-Y231 PolarHBondContact O-N 3.05Å; Y231-F235 PolarHBondContact O-N 3.35Å; Y231-F238 HydrophobicContact CD2-CE1 4.49Å
232E84.2Confident82.7Confident35 Ų3562.8 Ų62.816%0.16432%0.32CS..Hα-helixtrans-67.7-43.3172.6-67.4-163.611500112.2V228 E229 K230 F235 F238 S239 C244 K248V228-E232 WeakPolarHBondContact O-CG 3.46Å; V228-E232 PolarHBondContact O-N 2.91Å; E229-E232 WeakPolarHBondContact O-CB 3.44Å; E229-E232 PolarHBondContact O-N 2.85Å; K230-E232 VanDerWaalsContact C-N 3.32Å; K230-E232 PolarHBondContact O-N 3.28Å; E232-F235 CarbonylContact O-C 3.6Å; E232-F235 VanDerWaalsContact O-C 3.3Å; E232-F235 PolarHBondContact O-N 3.08Å; E232-F238 HydrophobicContact CG-CD1 4.37Å; E232-S239 WeakPolarHBondContact CB-OG 3.34Å; E232-S239 VanDerWaalsContact CD-OG 3.27Å; E232-S239 VanDerWaalsContact CG-OG 3.25Å; E232-S239 WeakPolarHBondContact CG-OG 3.35Å; E232-S239 WeakPolarHBondContact OE1-CA 3.33Å; E232-S239 VanDerWaalsContact OE1-CB 3.27Å; E232-S239 WeakPolarHBondContact OE1-CB 3.47Å; E232-S239 PolarHBondContact OE1-OG 3.09Å; E232-C244 PolarHBondContact OE1-SG 3.49Å; E232-C244 VanDerWaalsContact OE1-SG 3.42Å; E232-K248 WeakPolarHBondContact OE1-CE 3.37Å; E232-K248 IonicContact OE1-NZ 3.86Å; E232-K248 PolarHBondContact OE1-NZ 3.15Å; E232-K248 VanDerWaalsContact OE2-CE 3.3Å; E232-K248 WeakPolarHBondContact OE2-CE 3.37Å; E232-K248 IonicContact OE2-NZ 3.95Å; E232-K248 PolarHBondContact OE2-NZ 3.47Å
233E84.9Confident82.9Confident168 Ų16859.5 Ų59.579%0.78530%0.302SS*.Hα-helixtrans-63.8-43.3175.7-71.5-174.3170.100111.8E229 K230E229-E233 PolarHBondContact O-N 2.94Å; K230-E233 PolarHBondContact O-N 3.06Å
234M80.3Confident83Confident96 Ų9656.3 Ų56.347%0.47329%0.285SS..Hα-helixtrans-69.9-34.5178.8-69.7179.380.700112.3M196 K230M196-M234 HydrophobicContact CE-CE 3.75Å; K230-M234 HydrophobicContact CG-CG 4.46Å; K230-M234 HydrophobicContact CG-SD 3.91Å; K230-M234 WeakPolarHBondContact O-CB 3.36Å; K230-M234 WeakPolarHBondContact O-CG 3.48Å; K230-M234 PolarHBondContact O-N 3.4Å
235F76.9Confident83.2Confident16 Ų1661.5 Ų61.57%0.0731%0.307CS..  trans-139.791-174.6-165-100000111.9M196 K202 K206 Y231 E232 A237 F238M196-F235 HydrophobicContact CG-CD2 4.48Å; M196-F235 HydrophobicContact SD-CB 4.31Å; M196-F235 HydrophobicContact SD-CD2 4.18Å; K202-F235 HydrophobicContact CD-CE2 3.9Å; K202-F235 HydrophobicContact CD-CZ 4.19Å; K202-F235 HydrophobicContact CG-CE2 3.43Å; K202-F235 VanDerWaalsContact CG-CE2 3.43Å; K202-F235 HydrophobicContact CG-CZ 3.64Å; K206-F235 HydrophobicContact CD-CE1 4.36Å; K206-F235 HydrophobicContact CG-CE1 3.96Å; Y231-F235 PolarHBondContact O-N 3.35Å; E232-F235 CarbonylContact O-C 3.6Å; E232-F235 VanDerWaalsContact O-C 3.3Å; E232-F235 PolarHBondContact O-N 3.08Å; F235-A237 HydrophobicContact CD1-CB 3.95Å; F235-A237 HydrophobicContact CE1-CB 3.39Å; F235-A237 HydrophobicContact CZ-CB 3.85Å; F235-A237 PolarHBondContact O-N 2.79Å; F235-F238 HydrophobicContact CB-CB 4.31Å; F235-F238 HydrophobicContact CD1-CB 3.7Å; F235-F238 HydrophobicContact CG-CB 4.49Å; F235-F238 WeakPolarHBondContact O-CB 3.41Å; F235-F238 PolarHBondContact O-N 3.31Å
236P80.1Confident83.4Confident95 Ų9558.1 Ų58.162%0.61729%0.292SS*.Hα-helixtrans-58.1-26.9-178.5-29.135.8000114.6F238 S239P236-F238 PolarHBondContact O-N 3.12Å; P236-S239 WeakPolarHBondContact O-CB 3.36Å; P236-S239 PolarHBondContact O-N 3.15Å
237A78Confident83.4Confident50 Ų5054 Ų5441%0.41327%0.271SS..Hα-helixtrans-75.6-5176.100000113.8F235F235-A237 HydrophobicContact CD1-CB 3.95Å; F235-A237 HydrophobicContact CE1-CB 3.39Å; F235-A237 HydrophobicContact CZ-CB 3.85Å; F235-A237 PolarHBondContact O-N 2.79Å
238F78.2Confident83.4Confident0 Ų057.4 Ų57.40%029%0.285CS..Hα-helixtrans-79.1-39.4172.5-175.2-121.5000109K206 F209 Y231 E232 F235 P236 D240 S241 E243 C244 L247K206-F238 HydrophobicContact CB-CD2 4.12Å; K206-F238 HydrophobicContact CB-CE2 4.46Å; K206-F238 HydrophobicContact CG-CD2 4.23Å; F209-F238 HydrophobicContact CB-CE2 4.05Å; F209-F238 HydrophobicContact CB-CZ 4.03Å; Y231-F238 HydrophobicContact CD2-CE1 4.49Å; E232-F238 HydrophobicContact CG-CD1 4.37Å; F235-F238 HydrophobicContact CB-CB 4.31Å; F235-F238 HydrophobicContact CD1-CB 3.7Å; F235-F238 HydrophobicContact CG-CB 4.49Å; F235-F238 WeakPolarHBondContact O-CB 3.41Å; F235-F238 PolarHBondContact O-N 3.31Å; P236-F238 PolarHBondContact O-N 3.12Å; F238-D240 VanDerWaalsContact C-N 3.25Å; F238-D240 PolarHBondContact O-N 3.03Å; F238-S241 WeakPolarHBondContact O-CA 3.34Å; F238-S241 WeakPolarHBondContact O-CB 3.48Å; F238-S241 PolarHBondContact O-N 3.38Å; F238-S241 PolarHBondContact O-OG 3.47Å; F238-S241 VanDerWaalsContact O-OG 3.09Å; F238-E243 HydrophobicContact CE2-CB 4.34Å; F238-C244 HydrophobicContact CD1-CB 3.85Å; F238-C244 HydrophobicContact CD2-CB 4.36Å; F238-C244 HydrophobicContact CE1-CB 3.78Å; F238-C244 HydrophobicContact CE2-CB 4.3Å; F238-C244 HydrophobicContact CG-CB 4.14Å; F238-C244 HydrophobicContact CZ-CB 4.01Å; F238-C244 WeakPolarHBondContact O-CB 3.44Å; F238-L247 HydrophobicContact CE1-CD1 4.46Å; F238-L247 HydrophobicContact CZ-CD1 3.96Å
239S76.4Confident83.6Confident36 Ų3661.8 Ų61.825%0.25230%0.304SS..Hα-helixtrans-56-38.9177.6-610000113.2E232 P236 S241E232-S239 WeakPolarHBondContact CB-OG 3.34Å; E232-S239 VanDerWaalsContact CD-OG 3.27Å; E232-S239 VanDerWaalsContact CG-OG 3.25Å; E232-S239 WeakPolarHBondContact CG-OG 3.35Å; E232-S239 WeakPolarHBondContact OE1-CA 3.33Å; E232-S239 VanDerWaalsContact OE1-CB 3.27Å; E232-S239 WeakPolarHBondContact OE1-CB 3.47Å; E232-S239 PolarHBondContact OE1-OG 3.09Å; P236-S239 WeakPolarHBondContact O-CB 3.36Å; P236-S239 PolarHBondContact O-N 3.15Å; S239-S241 PolarHBondContact O-N 2.94Å
240D80.4Confident83.6Confident125 Ų12557 Ų5767%0.66828%0.281SS*.THydrogen-bonded Turntrans-77.7-12.7177.3-73.6-36.6000113.5F238 K245F238-D240 VanDerWaalsContact C-N 3.25Å; F238-D240 PolarHBondContact O-N 3.03Å; D240-K245 PolarHBondContact O-NZ 2.55Å; D240-K245 VanDerWaalsContact O-NZ 3.14Å
241S82.3Confident83.5Confident8 Ų853.4 Ų53.46%0.05627%0.266CS..SBendtrans-71.8154-175.3107.20000112F238 S239 E243 C244 K245F238-S241 WeakPolarHBondContact O-CA 3.34Å; F238-S241 WeakPolarHBondContact O-CB 3.48Å; F238-S241 PolarHBondContact O-N 3.38Å; F238-S241 PolarHBondContact O-OG 3.47Å; F238-S241 VanDerWaalsContact O-OG 3.09Å; S239-S241 PolarHBondContact O-N 2.94Å; S241-E243 VanDerWaalsContact C-N 3.26Å; S241-E243 WeakPolarHBondContact CB-OE2 3.46Å; S241-E243 PolarHBondContact O-N 2.84Å; S241-E243 PolarHBondContact OG-N 3.49Å; S241-E243 PolarHBondContact OG-OE2 3.43Å; S241-C244 PolarHBondContact OG-N 3.48Å; S241-K245 WeakPolarHBondContact O-CG 3.31Å; S241-K245 PolarHBondContact O-N 3.42Å
242R83.3Confident83.6Confident142 Ų14258.8 Ų58.854%0.53629%0.291SS..Hα-helixtrans-70.3-32.9-179-57.3177.7-155.3165.53.5110.5K245 L246 F269R242-K245 PolarHBondContact O-N 3.16Å; R242-L246 WeakPolarHBondContact O-CB 2.97Å; R242-L246 PolarHBondContact O-N 2.8Å; R242-F269 HydrophobicContact CB-CE2 3.96Å
243E85.1Confident83.7Confident40 Ų4057.3 Ų57.319%0.18729%0.285CS..Hα-helixtrans-63.2-46.7178.6-57.380.1-174.800110.9F210 F238 S241 L246 L247 F269F210-E243 HydrophobicContact CB-CB 3.94Å; F210-E243 HydrophobicContact CB-CG 4.29Å; F210-E243 HydrophobicContact CD1-CG 4.44Å; F210-E243 HydrophobicContact CD2-CB 3.72Å; F210-E243 HydrophobicContact CD2-CG 4.46Å; F210-E243 HydrophobicContact CE2-CB 4.39Å; F210-E243 HydrophobicContact CG-CB 3.83Å; F210-E243 HydrophobicContact CG-CG 4.16Å; F238-E243 HydrophobicContact CE2-CB 4.34Å; S241-E243 VanDerWaalsContact C-N 3.26Å; S241-E243 WeakPolarHBondContact CB-OE2 3.46Å; S241-E243 PolarHBondContact O-N 2.84Å; S241-E243 PolarHBondContact OG-N 3.49Å; S241-E243 PolarHBondContact OG-OE2 3.43Å; E243-L246 PolarHBondContact O-N 3.28Å; E243-L247 WeakPolarHBondContact O-CG 3.44Å; E243-L247 PolarHBondContact O-N 2.94Å; E243-F269 HydrophobicContact CG-CZ 4.44Å
244C84.8Confident83.6Confident0 Ų050.8 Ų50.80%026%0.255CS..Hα-helixtrans-65.6-42.9175.8-173.10000112.1E232 F238 S241 L246 L247 K248E232-C244 PolarHBondContact OE1-SG 3.49Å; E232-C244 VanDerWaalsContact OE1-SG 3.42Å; F238-C244 HydrophobicContact CD1-CB 3.85Å; F238-C244 HydrophobicContact CD2-CB 4.36Å; F238-C244 HydrophobicContact CE1-CB 3.78Å; F238-C244 HydrophobicContact CE2-CB 4.3Å; F238-C244 HydrophobicContact CG-CB 4.14Å; F238-C244 HydrophobicContact CZ-CB 4.01Å; F238-C244 WeakPolarHBondContact O-CB 3.44Å; S241-C244 PolarHBondContact OG-N 3.48Å; C244-L246 VanDerWaalsContact C-N 3.31Å; C244-L246 PolarHBondContact O-N 2.81Å; C244-L247 PolarHBondContact O-N 2.71Å; C244-L247 VanDerWaalsContact O-N 3.16Å; C244-K248 PolarHBondContact O-N 3.39Å
245K87.3Confident83.7Confident111 Ų11150.6 Ų50.648%0.48325%0.253SS..Hα-helixtrans-59.9-40.1175.5-72.5170.6-178.9160.50112.4D240 S241 R242 K249D240-K245 PolarHBondContact O-NZ 2.55Å; D240-K245 VanDerWaalsContact O-NZ 3.14Å; S241-K245 WeakPolarHBondContact O-CG 3.31Å; S241-K245 PolarHBondContact O-N 3.42Å; R242-K245 PolarHBondContact O-N 3.16Å; K245-K249 WeakPolarHBondContact O-CG 3.28Å; K245-K249 PolarHBondContact O-N 3.48Å
246L88.3Confident84.2Confident7 Ų756.5 Ų56.54%0.03728%0.281CS..Hα-helixtrans-62.8-51.6172.817765.2000110.3F210 R242 E243 C244 K248 K249 L250 A265 F269F210-L246 HydrophobicContact CE2-CD2 4.05Å; F210-L246 HydrophobicContact CZ-CD2 3.8Å; R242-L246 WeakPolarHBondContact O-CB 2.97Å; R242-L246 PolarHBondContact O-N 2.8Å; E243-L246 PolarHBondContact O-N 3.28Å; C244-L246 VanDerWaalsContact C-N 3.31Å; C244-L246 PolarHBondContact O-N 2.81Å; L246-K248 VanDerWaalsContact C-N 3.27Å; L246-K248 PolarHBondContact O-N 3.02Å; L246-K249 PolarHBondContact O-N 3.24Å; L246-K249 VanDerWaalsContact O-N 3.1Å; L246-L250 HydrophobicContact CD1-CD1 4.12Å; L246-L250 HydrophobicContact CD1-CD2 3.99Å; L246-L250 HydrophobicContact CD1-CG 3.91Å; L246-L250 HydrophobicContact CD2-CD1 4.27Å; L246-L250 HydrophobicContact CG-CD1 3.84Å; L246-L250 HydrophobicContact CG-CG 4.04Å; L246-L250 VanDerWaalsContact O-CG 3.3Å; L246-L250 WeakPolarHBondContact O-CG 3.39Å; L246-L250 PolarHBondContact O-N 3.11Å; L246-A265 HydrophobicContact CD1-CB 4.19Å; L246-F269 HydrophobicContact CB-CD2 3.89Å; L246-F269 HydrophobicContact CB-CE2 4.24Å; L246-F269 HydrophobicContact CD1-CB 4Å; L246-F269 HydrophobicContact CD1-CG 4.44Å; L246-F269 HydrophobicContact CD2-CB 3.95Å; L246-F269 HydrophobicContact CD2-CD1 3.84Å; L246-F269 HydrophobicContact CD2-CD2 3.7Å; L246-F269 HydrophobicContact CD2-CE1 4.2Å; L246-F269 HydrophobicContact CD2-CE2 4.07Å; L246-F269 HydrophobicContact CD2-CG 3.56Å; L246-F269 HydrophobicContact CD2-CZ 4.3Å; L246-F269 HydrophobicContact CG-CB 4.46Å; L246-F269 HydrophobicContact CG-CD2 4.24Å; L246-F269 HydrophobicContact CG-CG 4.37Å
247L87.8Confident84.2Confident2 Ų259.6 Ų59.61%0.0129%0.287CS..Hα-helixtrans-54.4-42.8-179.7-72.3170.2000112.6F210 S213 L214 V228 F238 E243 C244 L250 L251F210-L247 HydrophobicContact CD2-CD1 3.73Å; F210-L247 HydrophobicContact CD2-CD2 3.84Å; F210-L247 HydrophobicContact CD2-CG 3.62Å; F210-L247 HydrophobicContact CE2-CD1 4.36Å; F210-L247 HydrophobicContact CE2-CD2 3.73Å; F210-L247 HydrophobicContact CE2-CG 3.73Å; S213-L247 VanDerWaalsContact CB-CD1 3.42Å; L214-L247 HydrophobicContact CD2-CD2 3.97Å; L214-L247 HydrophobicContact CG-CD2 4.29Å; V228-L247 HydrophobicContact CG2-CB 4.32Å; V228-L247 HydrophobicContact CG2-CD1 4Å; F238-L247 HydrophobicContact CE1-CD1 4.46Å; F238-L247 HydrophobicContact CZ-CD1 3.96Å; E243-L247 WeakPolarHBondContact O-CG 3.44Å; E243-L247 PolarHBondContact O-N 2.94Å; C244-L247 PolarHBondContact O-N 2.71Å; C244-L247 VanDerWaalsContact O-N 3.16Å; L247-L250 PolarHBondContact O-N 3.48Å; L247-L251 WeakPolarHBondContact O-CG 3.42Å; L247-L251 PolarHBondContact O-N 2.99Å
248K88.2Confident84.6Confident78 Ų7860 Ų6034%0.33928%0.282SS..Hα-helixtrans-61.6-47.6176.2-71-177.8173.7-176.40112.2E232 C244 L246 L250 L251 E252E232-K248 WeakPolarHBondContact OE1-CE 3.37Å; E232-K248 IonicContact OE1-NZ 3.86Å; E232-K248 PolarHBondContact OE1-NZ 3.15Å; E232-K248 VanDerWaalsContact OE2-CE 3.3Å; E232-K248 WeakPolarHBondContact OE2-CE 3.37Å; E232-K248 IonicContact OE2-NZ 3.95Å; E232-K248 PolarHBondContact OE2-NZ 3.47Å; C244-K248 PolarHBondContact O-N 3.39Å; L246-K248 VanDerWaalsContact C-N 3.27Å; L246-K248 PolarHBondContact O-N 3.02Å; K248-L250 VanDerWaalsContact C-N 3.28Å; K248-L250 PolarHBondContact O-N 3.42Å; K248-L251 PolarHBondContact O-N 3.1Å; K248-E252 WeakPolarHBondContact O-CG 3.5Å; K248-E252 PolarHBondContact O-N 3.44Å
249K89.1Confident85Confident96 Ų9661.5 Ų61.542%0.41729%0.292SS..Hα-helixtrans-60-37.7174.1-72.9-172.2176.1-163.20112.4K245 L246 A253 A265 E268K245-K249 WeakPolarHBondContact O-CG 3.28Å; K245-K249 PolarHBondContact O-N 3.48Å; L246-K249 PolarHBondContact O-N 3.24Å; L246-K249 VanDerWaalsContact O-N 3.1Å; K249-A253 WeakPolarHBondContact O-CB 3.37Å; K249-A253 PolarHBondContact O-N 3.11Å; K249-A265 HydrophobicContact CB-CB 4.17Å; K249-A265 HydrophobicContact CD-CB 4.29Å; K249-E268 IonicContact NZ-OE2 2.75Å; K249-E268 PolarHBondContact NZ-OE2 3.31Å
250L87.1Confident85.5Confident2 Ų267.1 Ų67.11%0.0132%0.315CS..Hα-helixtrans-70.6-38.3178.3-62.5179.9000111.9L246 L247 K248 H254 F262 A265 V266 L283L246-L250 HydrophobicContact CD1-CD1 4.12Å; L246-L250 HydrophobicContact CD1-CD2 3.99Å; L246-L250 HydrophobicContact CD1-CG 3.91Å; L246-L250 HydrophobicContact CD2-CD1 4.27Å; L246-L250 HydrophobicContact CG-CD1 3.84Å; L246-L250 HydrophobicContact CG-CG 4.04Å; L246-L250 VanDerWaalsContact O-CG 3.3Å; L246-L250 WeakPolarHBondContact O-CG 3.39Å; L246-L250 PolarHBondContact O-N 3.11Å; L247-L250 PolarHBondContact O-N 3.48Å; K248-L250 VanDerWaalsContact C-N 3.28Å; K248-L250 PolarHBondContact O-N 3.42Å; L250-H254 WeakPolarHBondContact O-CB 3.19Å; L250-H254 PolarHBondContact O-N 3.16Å; L250-F262 HydrophobicContact CB-CD2 4.25Å; L250-F262 HydrophobicContact CB-CE2 3.97Å; L250-F262 HydrophobicContact CD1-CE2 4.24Å; L250-F262 HydrophobicContact CD1-CZ 4.41Å; L250-F262 HydrophobicContact CD2-CD1 4.42Å; L250-F262 HydrophobicContact CD2-CD2 3.57Å; L250-F262 HydrophobicContact CD2-CE1 4.38Å; L250-F262 HydrophobicContact CD2-CE2 3.54Å; L250-F262 HydrophobicContact CD2-CG 4.03Å; L250-F262 HydrophobicContact CD2-CZ 3.96Å; L250-F262 HydrophobicContact CG-CD2 4.41Å; L250-F262 HydrophobicContact CG-CE2 4.08Å; L250-A265 HydrophobicContact CD2-CB 4.1Å; L250-V266 HydrophobicContact CD2-CG2 3.83Å; L250-L283 HydrophobicContact CD1-CD2 3.68Å
251L85.8Confident85.9Confident13 Ų1362.7 Ų62.77%0.06830%0.295CS..Hα-helixtrans-62-49.7173-75.5163.5000110.8F217 E221 A224 K225 V228 L247 K248 A253 H254 E255F217-L251 HydrophobicContact CD2-CD2 3.73Å; F217-L251 HydrophobicContact CD2-CG 4.26Å; F217-L251 HydrophobicContact CE2-CB 4.36Å; F217-L251 HydrophobicContact CE2-CD2 3.38Å; F217-L251 HydrophobicContact CE2-CG 3.73Å; F217-L251 HydrophobicContact CZ-CD2 4.47Å; E221-L251 HydrophobicContact CG-CD2 4.29Å; A224-L251 HydrophobicContact CB-CD2 4.05Å; K225-L251 HydrophobicContact CB-CD2 4.46Å; V228-L251 HydrophobicContact CG2-CD1 4.31Å; L247-L251 WeakPolarHBondContact O-CG 3.42Å; L247-L251 PolarHBondContact O-N 2.99Å; K248-L251 PolarHBondContact O-N 3.1Å; L251-A253 PolarHBondContact O-N 3.31Å; L251-H254 PolarHBondContact O-N 2.51Å; L251-H254 VanDerWaalsContact O-N 3.15Å; L251-E255 WeakPolarHBondContact O-CG 3.46Å; L251-E255 PolarHBondContact O-N 3.47Å
252E87.6Confident86.2Confident114 Ų11462.5 Ų62.553%0.53329%0.293SS..Hα-helixtrans-58.4-46.9176.6-71.5170.2-174.200111.7K248 H254 E255 E256K248-E252 WeakPolarHBondContact O-CG 3.5Å; K248-E252 PolarHBondContact O-N 3.44Å; E252-H254 VanDerWaalsContact C-N 3.25Å; E252-H254 PolarHBondContact O-N 3.38Å; E252-E255 PolarHBondContact O-N 2.9Å; E252-E256 WeakPolarHBondContact O-CG 3.34Å; E252-E256 PolarHBondContact O-N 3.1Å
253A86.2Confident86.4Confident4 Ų458.5 Ų58.53%0.03329%0.285CS..Hα-helixtrans-64.2-29.3178.300000113.2K249 L251 Q257 N258 A261 F262K249-A253 WeakPolarHBondContact O-CB 3.37Å; K249-A253 PolarHBondContact O-N 3.11Å; L251-A253 PolarHBondContact O-N 3.31Å; A253-Q257 PolarHBondContact O-N 3.16Å; A253-N258 PolarHBondContact O-N 2.98Å; A253-A261 HydrophobicContact CB-CB 4.03Å; A253-F262 HydrophobicContact CB-CB 4.12Å
254H82.4Confident86.7Confident32 Ų3262.4 Ų62.415%0.14830%0.303CS..Hα-helixtrans-79-41.5176.1-171.9-76.4000112.1F217 E221 L250 L251 E252 E256 Q257 I290F217-H254 HydrophobicContact CE1-CB 4.01Å; F217-H254 AromaticContact CE1-CD2 3.34Å; F217-H254 WeakPolarHBondContact CE1-CD2 3.45Å; F217-H254 AromaticContact CE1-CG 3.77Å; F217-H254 HydrophobicContact CE2-CB 4.5Å; F217-H254 HydrophobicContact CZ-CB 3.47Å; F217-H254 VanDerWaalsContact CZ-CB 3.47Å; F217-H254 AromaticContact CZ-CD2 3.76Å; F217-H254 AromaticContact CZ-CG 3.69Å; E221-H254 IonicContact OE2-CE1 3.64Å; E221-H254 PolarHBondContact OE2-CE1 3.08Å; E221-H254 VanDerWaalsContact OE2-CE1 3.26Å; E221-H254 IonicContact OE2-CG 2.8Å; E221-H254 IonicContact OE2-ND1 3.95Å; E221-H254 PolarHBondContact OE2-ND1 3.29Å; L250-H254 WeakPolarHBondContact O-CB 3.19Å; L250-H254 PolarHBondContact O-N 3.16Å; L251-H254 PolarHBondContact O-N 2.51Å; L251-H254 VanDerWaalsContact O-N 3.15Å; E252-H254 VanDerWaalsContact C-N 3.25Å; E252-H254 PolarHBondContact O-N 3.38Å; H254-E256 PolarHBondContact O-N 3.01Å; H254-Q257 PolarHBondContact O-N 3Å; H254-I290 HydrophobicContact CB-CD1 4.13Å; H254-I290 HydrophobicContact CB-CG1 4.33Å; H254-I290 WeakPolarHBondContact CD2-CG1 3.24Å
255E83.4Confident86.9Confident91 Ų9162.7 Ų62.743%0.42531%0.306SS..Hα-helixtrans-55.6-39171.7-78.3-179.7-175.900111E221 K225 L251 E252 Q257E221-E255 WeakPolarHBondContact OE1-CG 2.99Å; K225-E255 IonicContact NZ-OE1 2.69Å; K225-E255 PolarHBondContact NZ-OE1 3.18Å; K225-E255 IonicContact NZ-OE2 3.87Å; L251-E255 WeakPolarHBondContact O-CG 3.46Å; L251-E255 PolarHBondContact O-N 3.47Å; E252-E255 PolarHBondContact O-N 2.9Å; E255-Q257 VanDerWaalsContact C-N 3.33Å
256E85.6Confident87Confident141 Ų14158.7 Ų58.766%0.65929%0.29SS*.THydrogen-bonded Turntrans-83.8-1.5177.2-66.2-178.1176.300114.4E252 H254 N258E252-E256 WeakPolarHBondContact O-CG 3.34Å; E252-E256 PolarHBondContact O-N 3.1Å; H254-E256 PolarHBondContact O-N 3.01Å; E256-N258 HydrophobicContact CB-CB 4.24Å; E256-N258 PolarHBondContact O-N 3.34Å
257Q81.6Confident87.1Confident159 Ų15966 Ų6674%0.74332%0.322SS*.THydrogen-bonded Turntrans51.431.2-172-60.5-167.8-25.200114.2A253 H254 E255 S259A253-Q257 PolarHBondContact O-N 3.16Å; H254-Q257 PolarHBondContact O-N 3Å; E255-Q257 VanDerWaalsContact C-N 3.33Å; Q257-S259 PolarHBondContact O-N 3.29Å
258N86.3Confident87.2Confident59 Ų5970 Ų7032%0.31634%0.341SS..  trans-97.391.8-174.1-170.5-17.8000111.7A253 E256 E260 A261 F262A253-N258 PolarHBondContact O-N 2.98Å; E256-N258 HydrophobicContact CB-CB 4.24Å; E256-N258 PolarHBondContact O-N 3.34Å; N258-E260 PolarHBondContact O-N 3.36Å; N258-E260 PolarHBondContact OD1-N 2.86Å; N258-A261 HydrophobicContact CB-CB 4.01Å; N258-A261 PolarHBondContact O-N 3.14Å; N258-A261 PolarHBondContact OD1-N 2.95Å; N258-F262 PolarHBondContact O-N 3.32Å; N258-F262 VanDerWaalsContact O-N 3.14Å
259S85.2Confident87.2Confident31 Ų3167.5 Ų67.522%0.21733%0.33CS..Hα-helixtrans-66.8-21.6-179.878.50000114.4Q257 T263 Q291Q257-S259 PolarHBondContact O-N 3.29Å; S259-T263 PolarHBondContact O-N 3.03Å; S259-T263 PolarHBondContact O-OG1 3.5Å; S259-Q291 PolarHBondContact OG-NE2 2.67Å
260E87.9Confident87.2Confident155 Ų15564.9 Ų64.972%0.72432%0.32SS*.Hα-helixtrans-74.6-48.8176.3-65.7-173.5172.200110.6N258 F262 T263 E264N258-E260 PolarHBondContact O-N 3.36Å; N258-E260 PolarHBondContact OD1-N 2.86Å; E260-F262 VanDerWaalsContact C-N 3.28Å; E260-F262 PolarHBondContact O-N 3.46Å; E260-T263 PolarHBondContact O-N 3.43Å; E260-E264 PolarHBondContact O-N 3.14Å
261A88.4Confident87.2Confident31 Ų3169.4 Ų69.426%0.25635%0.352SS..Hα-helixtrans-58.9-40175.200000111.8A253 N258 T263 E264 A265A253-A261 HydrophobicContact CB-CB 4.03Å; N258-A261 HydrophobicContact CB-CB 4.01Å; N258-A261 PolarHBondContact O-N 3.14Å; N258-A261 PolarHBondContact OD1-N 2.95Å; A261-T263 VanDerWaalsContact C-N 3.35Å; A261-T263 PolarHBondContact O-N 3.46Å; A261-E264 PolarHBondContact O-N 3.28Å; A261-A265 WeakPolarHBondContact O-CB 3.31Å; A261-A265 PolarHBondContact O-N 3Å
262F88.3Confident87.2Confident4 Ų474.3 Ų74.32%0.01838%0.377CS..Hα-helixtrans-59.1-46.1173.3-173.2-83000111.6L250 A253 N258 E260 A265 V266 L283 I286 K287 I290L250-F262 HydrophobicContact CB-CD2 4.25Å; L250-F262 HydrophobicContact CB-CE2 3.97Å; L250-F262 HydrophobicContact CD1-CE2 4.24Å; L250-F262 HydrophobicContact CD1-CZ 4.41Å; L250-F262 HydrophobicContact CD2-CD1 4.42Å; L250-F262 HydrophobicContact CD2-CD2 3.57Å; L250-F262 HydrophobicContact CD2-CE1 4.38Å; L250-F262 HydrophobicContact CD2-CE2 3.54Å; L250-F262 HydrophobicContact CD2-CG 4.03Å; L250-F262 HydrophobicContact CD2-CZ 3.96Å; L250-F262 HydrophobicContact CG-CD2 4.41Å; L250-F262 HydrophobicContact CG-CE2 4.08Å; A253-F262 HydrophobicContact CB-CB 4.12Å; N258-F262 PolarHBondContact O-N 3.32Å; N258-F262 VanDerWaalsContact O-N 3.14Å; E260-F262 VanDerWaalsContact C-N 3.28Å; E260-F262 PolarHBondContact O-N 3.46Å; F262-A265 PolarHBondContact O-N 3.31Å; F262-V266 HydrophobicContact CD1-CG2 4.11Å; F262-V266 HydrophobicContact CE1-CG2 3.83Å; F262-V266 HydrophobicContact CZ-CG2 4.4Å; F262-V266 VanDerWaalsContact O-CG2 3.31Å; F262-V266 WeakPolarHBondContact O-CG2 3.46Å; F262-V266 PolarHBondContact O-N 2.99Å; F262-V266 VanDerWaalsContact O-N 3.08Å; F262-L283 HydrophobicContact CZ-CD2 4.01Å; F262-I286 HydrophobicContact CE2-CB 4.47Å; F262-I286 HydrophobicContact CE2-CG2 3.49Å; F262-I286 VanDerWaalsContact CE2-CG2 3.49Å; F262-I286 HydrophobicContact CZ-CB 4.04Å; F262-I286 HydrophobicContact CZ-CG2 3.54Å; F262-K287 HydrophobicContact CD1-CB 4.15Å; F262-K287 HydrophobicContact CD1-CG 4.43Å; F262-K287 HydrophobicContact CE1-CB 3.94Å; F262-I290 HydrophobicContact CB-CD1 4.16Å; F262-I290 HydrophobicContact CD2-CD1 3.5Å; F262-I290 VanDerWaalsContact CD2-CD1 3.5Å; F262-I290 HydrophobicContact CE2-CD1 4.02Å; F262-I290 HydrophobicContact CG-CD1 3.88Å
263T88.2Confident86.9Confident58 Ų5870.3 Ų70.336%0.35636%0.362SS..Hα-helixtrans-68.1-37.9-178.5-54.40000111.6S259 E260 A261 K267 K287S259-T263 PolarHBondContact O-N 3.03Å; S259-T263 PolarHBondContact O-OG1 3.5Å; E260-T263 PolarHBondContact O-N 3.43Å; A261-T263 VanDerWaalsContact C-N 3.35Å; A261-T263 PolarHBondContact O-N 3.46Å; T263-K267 WeakPolarHBondContact O-CB 3.37Å; T263-K267 PolarHBondContact O-N 3.21Å; T263-K287 WeakPolarHBondContact OG1-CE 3.48Å; T263-K287 PolarHBondContact OG1-NZ 3.35Å
264E91.4Very high86.9Confident122 Ų12279.9 Ų79.957%0.5740%0.397SS*.Hα-helixtrans-64.7-47.3175.6-174.9168.6-152.500111.5E260 A261 V266 K267 E268E260-E264 PolarHBondContact O-N 3.14Å; A261-E264 PolarHBondContact O-N 3.28Å; E264-V266 VanDerWaalsContact C-N 3.33Å; E264-V266 PolarHBondContact O-N 3.04Å; E264-K267 WeakPolarHBondContact O-CB 3.35Å; E264-K267 PolarHBondContact O-N 3.45Å; E264-K267 VanDerWaalsContact O-N 3.09Å; E264-E268 WeakPolarHBondContact O-CG 3.1Å; E264-E268 PolarHBondContact O-N 3.25Å
265A89.6Confident87.1Confident7 Ų779.8 Ų79.86%0.05840%0.397CS..Hα-helixtrans-59-42.8177.200000112.3L246 K249 L250 A261 F262 F269L246-A265 HydrophobicContact CD1-CB 4.19Å; K249-A265 HydrophobicContact CB-CB 4.17Å; K249-A265 HydrophobicContact CD-CB 4.29Å; L250-A265 HydrophobicContact CD2-CB 4.1Å; A261-A265 WeakPolarHBondContact O-CB 3.31Å; A261-A265 PolarHBondContact O-N 3Å; F262-A265 PolarHBondContact O-N 3.31Å; A265-F269 PolarHBondContact O-N 3.38Å; A265-F269 VanDerWaalsContact O-N 3.08Å
266V88.9Confident87.2Confident26 Ų2678.6 Ų78.616%0.15839%0.394CS..Hα-helixtrans-64.1-40.4175.1172.70000111.4L250 F262 E264 F269 D270 L275 L283L250-V266 HydrophobicContact CD2-CG2 3.83Å; F262-V266 HydrophobicContact CD1-CG2 4.11Å; F262-V266 HydrophobicContact CE1-CG2 3.83Å; F262-V266 HydrophobicContact CZ-CG2 4.4Å; F262-V266 VanDerWaalsContact O-CG2 3.31Å; F262-V266 WeakPolarHBondContact O-CG2 3.46Å; F262-V266 PolarHBondContact O-N 2.99Å; F262-V266 VanDerWaalsContact O-N 3.08Å; E264-V266 VanDerWaalsContact C-N 3.33Å; E264-V266 PolarHBondContact O-N 3.04Å; V266-F269 PolarHBondContact O-N 3.41Å; V266-D270 PolarHBondContact O-N 2.85Å; V266-L275 HydrophobicContact CG1-CD1 3.65Å; V266-L283 HydrophobicContact CG1-CD1 4.07Å; V266-L283 HydrophobicContact CG2-CD1 4.2Å; V266-L283 HydrophobicContact CG2-CD2 4.24Å
267K89.6Confident87.2Confident161 Ų16179.7 Ų79.770%0.740%0.399SS*.Hα-helixtrans-67.7-42.4179.2-175.6-177.1178.1-173.80112.4T263 E264 F269 D270 S271T263-K267 WeakPolarHBondContact O-CB 3.37Å; T263-K267 PolarHBondContact O-N 3.21Å; E264-K267 WeakPolarHBondContact O-CB 3.35Å; E264-K267 PolarHBondContact O-N 3.45Å; E264-K267 VanDerWaalsContact O-N 3.09Å; K267-F269 VanDerWaalsContact C-N 3.29Å; K267-F269 PolarHBondContact O-N 2.68Å; K267-D270 PolarHBondContact O-N 2.97Å; K267-S271 PolarHBondContact O-N 2.97Å; K267-S271 VanDerWaalsContact O-N 3.15Å
268E89.4Confident87.4Confident87 Ų8773.1 Ų73.141%0.40737%0.367SS..Hα-helixtrans-57.5-46172.7-73.5-175.4166.100110.4K249 E264 S271K249-E268 IonicContact NZ-OE2 2.75Å; K249-E268 PolarHBondContact NZ-OE2 3.31Å; E264-E268 WeakPolarHBondContact O-CG 3.1Å; E264-E268 PolarHBondContact O-N 3.25Å; E268-S271 PolarHBondContact O-N 3.31Å; E268-S271 PolarHBondContact O-OG 3.23Å
269F88.4Confident87.4Confident24 Ų2471 Ų7111%0.10536%0.356CS..Hα-helixtrans-65.1-46.3178.8-172.6-92000112.5R242 E243 L246 A265 V266 K267 S271 I272 S273 L275R242-F269 HydrophobicContact CB-CE2 3.96Å; E243-F269 HydrophobicContact CG-CZ 4.44Å; L246-F269 HydrophobicContact CB-CD2 3.89Å; L246-F269 HydrophobicContact CB-CE2 4.24Å; L246-F269 HydrophobicContact CD1-CB 4Å; L246-F269 HydrophobicContact CD1-CG 4.44Å; L246-F269 HydrophobicContact CD2-CB 3.95Å; L246-F269 HydrophobicContact CD2-CD1 3.84Å; L246-F269 HydrophobicContact CD2-CD2 3.7Å; L246-F269 HydrophobicContact CD2-CE1 4.2Å; L246-F269 HydrophobicContact CD2-CE2 4.07Å; L246-F269 HydrophobicContact CD2-CG 3.56Å; L246-F269 HydrophobicContact CD2-CZ 4.3Å; L246-F269 HydrophobicContact CG-CB 4.46Å; L246-F269 HydrophobicContact CG-CD2 4.24Å; L246-F269 HydrophobicContact CG-CG 4.37Å; A265-F269 PolarHBondContact O-N 3.38Å; A265-F269 VanDerWaalsContact O-N 3.08Å; V266-F269 PolarHBondContact O-N 3.41Å; K267-F269 VanDerWaalsContact C-N 3.29Å; K267-F269 PolarHBondContact O-N 2.68Å; F269-S271 PolarHBondContact O-N 3.43Å; F269-I272 PolarHBondContact O-N 3.39Å; F269-S273 PolarHBondContact O-N 3.5Å; F269-L275 HydrophobicContact CD1-CD2 3.7Å; F269-L275 HydrophobicContact CD1-CG 4.27Å; F269-L275 HydrophobicContact CE1-CD2 3.72Å
270D89.3Confident87.6Confident42 Ų4272.3 Ų72.323%0.22536%0.363CS..Hα-helixtrans-60.7-30.1179.6-173.657.1000112.9V266 K267 I272 S273 R274 L275V266-D270 PolarHBondContact O-N 2.85Å; K267-D270 PolarHBondContact O-N 2.97Å; D270-I272 VanDerWaalsContact C-N 3.25Å; D270-I272 PolarHBondContact O-N 3.45Å; D270-S273 WeakPolarHBondContact CA-O 3.28Å; D270-R274 WeakPolarHBondContact OD1-CA 3.32Å; D270-R274 IonicContact OD1-NH1 3.82Å; D270-R274 IonicContact OD2-CZ 3.05Å; D270-R274 IonicContact OD2-NH1 2.89Å; D270-R274 PolarHBondContact OD2-NH1 3.18Å; D270-L275 HydrophobicContact CB-CD1 3.97Å; D270-L275 HydrophobicContact CB-CG 4.18Å; D270-L275 PolarHBondContact OD1-N 3.11Å
271S86.9Confident87.6Confident97 Ų9767.2 Ų67.268%0.67834%0.342SS*.Hα-helixtrans-67-26.8176.878.20000113.4K267 E268 F269K267-S271 PolarHBondContact O-N 2.97Å; K267-S271 VanDerWaalsContact O-N 3.15Å; E268-S271 PolarHBondContact O-N 3.31Å; E268-S271 PolarHBondContact O-OG 3.23Å; F269-S271 PolarHBondContact O-N 3.43Å
272I85.7Confident87.5Confident115 Ų11565.8 Ų65.859%0.5933%0.33SS*.Hα-helixtrans-102.5-41.5-177.2-57.7171.2000110.8F269 D270F269-I272 PolarHBondContact O-N 3.39Å; D270-I272 VanDerWaalsContact C-N 3.25Å; D270-I272 PolarHBondContact O-N 3.45Å
273S83.1Confident87.5Confident30 Ų3065.9 Ų65.921%0.2133%0.331CS..SBendtrans-131.8102.4-176.4-68.90000108.3F269 D270 L275F269-S273 PolarHBondContact O-N 3.5Å; D270-S273 WeakPolarHBondContact CA-O 3.28Å; S273-L275 PolarHBondContact O-N 3.39Å
274R85.8Confident87.4Confident205 Ų20567.8 Ų67.877%0.77434%0.338SS*.PPolyproline II helixtrans-59.4126.4-176.7-68.5-70-78.9167.8-7.5111.3D270D270-R274 WeakPolarHBondContact OD1-CA 3.32Å; D270-R274 IonicContact OD1-NH1 3.82Å; D270-R274 IonicContact OD2-CZ 3.05Å; D270-R274 IonicContact OD2-NH1 2.89Å; D270-R274 PolarHBondContact OD2-NH1 3.18Å
275L85.5Confident87.2Confident30 Ų3065.2 Ų65.216%0.15732%0.323CS..PPolyproline II helixtrans-75.5135.2177.2-65.5170.2000110.1V266 F269 D270 S273 H279 L283V266-L275 HydrophobicContact CG1-CD1 3.65Å; F269-L275 HydrophobicContact CD1-CD2 3.7Å; F269-L275 HydrophobicContact CD1-CG 4.27Å; F269-L275 HydrophobicContact CE1-CD2 3.72Å; D270-L275 HydrophobicContact CB-CD1 3.97Å; D270-L275 HydrophobicContact CB-CG 4.18Å; D270-L275 PolarHBondContact OD1-N 3.11Å; S273-L275 PolarHBondContact O-N 3.39Å; L275-H279 HydrophobicContact CD2-CB 3.97Å; L275-L283 HydrophobicContact CD1-CD1 3.9Å; L275-L283 HydrophobicContact CD2-CD1 4.14Å
276D85.9Confident87Confident67 Ų6764.9 Ų64.936%0.35832%0.32SS..PPolyproline II helixtrans-79.9173.3170.472.415.7000111W278 H279 T280D276-W278 PolarHBondContact O-N 3.39Å; D276-W278 WeakPolarHBondContact OD1-CA 3.44Å; D276-W278 WeakPolarHBondContact OD1-CB 3.44Å; D276-W278 PolarHBondContact OD1-N 3.04Å; D276-H279 IonicContact OD1-CE1 2.65Å; D276-H279 IonicContact OD1-CG 3.38Å; D276-H279 PolarHBondContact OD1-N 3.09Å; D276-H279 IonicContact OD1-ND1 2.72Å; D276-H279 PolarHBondContact OD1-ND1 3.05Å; D276-H279 IonicContact OD2-CE1 2.96Å; D276-H279 PolarHBondContact OD2-CE1 2.94Å; D276-H279 IonicContact OD2-ND1 2.79Å; D276-H279 PolarHBondContact OD2-ND1 3.37Å; D276-T280 WeakPolarHBondContact O-CB 3.49Å; D276-T280 PolarHBondContact O-N 3.48Å; D276-T280 PolarHBondContact O-OG1 2.96Å
277Q85.6Confident86.8Confident163 Ų16366.1 Ų66.176%0.76232%0.324SS*.Hα-helixtrans-59.5-35.7178-175.3176.7-5.200112.2T280 T281Q277-T280 PolarHBondContact O-N 2.89Å; Q277-T281 PolarHBondContact O-N 3.23Å; Q277-T281 PolarHBondContact O-OG1 2.89Å
278W86.8Confident86.6Confident21 Ų2165.7 Ų65.78%0.0832%0.322CS..Hα-helixtrans-68-50.5-177.7-174.991.7000111.2A173 A176 Y188 K211 L214 D276 T280 T281 L282A173-W278 PolarHBondContact O-NE1 3.09Å; A176-W278 HydrophobicContact CB-CZ2 3.7Å; Y188-W278 HydrophobicContact CE2-CH2 4.42Å; Y188-W278 HydrophobicContact CE2-CZ2 4.17Å; K211-W278 HydrophobicContact CB-CH2 3.68Å; K211-W278 HydrophobicContact CB-CZ3 3.96Å; K211-W278 HydrophobicContact CD-CE3 4.34Å; K211-W278 HydrophobicContact CD-CH2 4.15Å; K211-W278 HydrophobicContact CD-CZ3 3.96Å; K211-W278 HydrophobicContact CG-CE3 4.28Å; K211-W278 HydrophobicContact CG-CH2 3.73Å; K211-W278 HydrophobicContact CG-CZ3 3.49Å; K211-W278 VanDerWaalsContact CG-CZ3 3.49Å; L214-W278 HydrophobicContact CD1-CZ3 4.31Å; D276-W278 PolarHBondContact O-N 3.39Å; D276-W278 WeakPolarHBondContact OD1-CA 3.44Å; D276-W278 WeakPolarHBondContact OD1-CB 3.44Å; D276-W278 PolarHBondContact OD1-N 3.04Å; W278-T280 VanDerWaalsContact C-N 3.29Å; W278-T280 PolarHBondContact O-N 3.42Å; W278-T281 PolarHBondContact O-N 2.99Å; W278-L282 HydrophobicContact CD2-CD1 3.61Å; W278-L282 VanDerWaalsContact CE2-CD1 3.43Å; W278-L282 HydrophobicContact CE3-CD1 3.94Å; W278-L282 HydrophobicContact CG-CD1 4.14Å; W278-L282 HydrophobicContact CH2-CD1 3.92Å; W278-L282 HydrophobicContact CH2-CD2 3.55Å; W278-L282 HydrophobicContact CH2-CG 4.35Å; W278-L282 HydrophobicContact CZ2-CD1 3.62Å; W278-L282 HydrophobicContact CZ2-CD2 3.76Å; W278-L282 HydrophobicContact CZ2-CG 4.36Å; W278-L282 HydrophobicContact CZ3-CD1 4.05Å; W278-L282 HydrophobicContact CZ3-CD2 4.1Å; W278-L282 WeakPolarHBondContact O-CD1 3.4Å; W278-L282 PolarHBondContact O-N 2.95Å; W278-L282 VanDerWaalsContact O-N 3.08Å
279H86.5Confident86.2Confident16 Ų1665.1 Ų65.17%0.07433%0.325CS..Hα-helixtrans-60.9-41.2176.5-62.399.6000110.7F210 K211 L275 D276 T281 L282 L283F210-H279 AromaticContact CD1-CD2 3.87Å; F210-H279 AromaticContact CD1-NE2 3.77Å; F210-H279 AromaticContact CE1-CD2 3.44Å; F210-H279 VanDerWaalsContact CE1-CD2 3.44Å; F210-H279 WeakPolarHBondContact CE1-CD2 3.49Å; F210-H279 AromaticContact CE1-NE2 3.78Å; K211-H279 WeakPolarHBondContact CE-NE2 3.29Å; L275-H279 HydrophobicContact CD2-CB 3.97Å; D276-H279 IonicContact OD1-CE1 2.65Å; D276-H279 IonicContact OD1-CG 3.38Å; D276-H279 PolarHBondContact OD1-N 3.09Å; D276-H279 IonicContact OD1-ND1 2.72Å; D276-H279 PolarHBondContact OD1-ND1 3.05Å; D276-H279 IonicContact OD2-CE1 2.96Å; D276-H279 PolarHBondContact OD2-CE1 2.94Å; D276-H279 IonicContact OD2-ND1 2.79Å; D276-H279 PolarHBondContact OD2-ND1 3.37Å; H279-T281 PolarHBondContact O-N 3.42Å; H279-L282 PolarHBondContact O-N 3.45Å; H279-L283 VanDerWaalsContact O-CB 3.31Å; H279-L283 WeakPolarHBondContact O-CB 3.4Å; H279-L283 WeakPolarHBondContact O-CG 3.27Å; H279-L283 PolarHBondContact O-N 3.38Å
280T88.3Confident85.6Confident58 Ų5864.9 Ų64.936%0.35632%0.324SS..Hα-helixtrans-59.8-46177.4-56.10000111.2D276 Q277 W278 L284D276-T280 WeakPolarHBondContact O-CB 3.49Å; D276-T280 PolarHBondContact O-N 3.48Å; D276-T280 PolarHBondContact O-OG1 2.96Å; Q277-T280 PolarHBondContact O-N 2.89Å; W278-T280 VanDerWaalsContact C-N 3.29Å; W278-T280 PolarHBondContact O-N 3.42Å; T280-L284 HydrophobicContact CG2-CD1 3.95Å; T280-L284 HydrophobicContact CG2-CG 4.43Å; T280-L284 WeakPolarHBondContact O-CB 3.37Å; T280-L284 WeakPolarHBondContact O-CG 3.42Å; T280-L284 PolarHBondContact O-N 3Å
281T87.8Confident84.8Confident48 Ų4867.4 Ų67.429%0.29434%0.335SS..Hα-helixtrans-61.7-45.8177.9-61.10000112Q277 W278 H279 L284 R285Q277-T281 PolarHBondContact O-N 3.23Å; Q277-T281 PolarHBondContact O-OG1 2.89Å; W278-T281 PolarHBondContact O-N 2.99Å; H279-T281 PolarHBondContact O-N 3.42Å; T281-L284 PolarHBondContact O-N 3.35Å; T281-R285 WeakPolarHBondContact O-CG 3.35Å; T281-R285 PolarHBondContact O-N 2.95Å
282L86.3Confident83.4Confident1 Ų164.8 Ų64.81%0.00532%0.322CS..Hα-helixtrans-67.6-44.7179.3-84.187.1000112.2L214 I218 W278 H279 L284 R285 I286L214-L282 HydrophobicContact CB-CD2 4.2Å; I218-L282 HydrophobicContact CD1-CB 4.23Å; I218-L282 HydrophobicContact CD1-CD2 3.85Å; I218-L282 HydrophobicContact CD1-CG 3.95Å; W278-L282 HydrophobicContact CD2-CD1 3.61Å; W278-L282 VanDerWaalsContact CE2-CD1 3.43Å; W278-L282 HydrophobicContact CE3-CD1 3.94Å; W278-L282 HydrophobicContact CG-CD1 4.14Å; W278-L282 HydrophobicContact CH2-CD1 3.92Å; W278-L282 HydrophobicContact CH2-CD2 3.55Å; W278-L282 HydrophobicContact CH2-CG 4.35Å; W278-L282 HydrophobicContact CZ2-CD1 3.62Å; W278-L282 HydrophobicContact CZ2-CD2 3.76Å; W278-L282 HydrophobicContact CZ2-CG 4.36Å; W278-L282 HydrophobicContact CZ3-CD1 4.05Å; W278-L282 HydrophobicContact CZ3-CD2 4.1Å; W278-L282 WeakPolarHBondContact O-CD1 3.4Å; W278-L282 PolarHBondContact O-N 2.95Å; W278-L282 VanDerWaalsContact O-N 3.08Å; H279-L282 PolarHBondContact O-N 3.45Å; L282-L284 VanDerWaalsContact C-N 3.27Å; L282-L284 PolarHBondContact O-N 3.37Å; L282-R285 WeakPolarHBondContact O-CB 3.48Å; L282-R285 PolarHBondContact O-N 3.03Å; L282-R285 VanDerWaalsContact O-N 3.08Å; L282-I286 WeakPolarHBondContact O-CG1 3.45Å; L282-I286 PolarHBondContact O-N 3.29Å
283L87.6Confident81.5Confident6 Ų666.5 Ų66.53%0.03133%0.333CS..Hα-helixtrans-62.3-36178.4-71.1169.1000111.9L214 L250 F262 V266 L275 H279 I286 K287L214-L283 HydrophobicContact CD2-CD2 3.81Å; L250-L283 HydrophobicContact CD1-CD2 3.68Å; F262-L283 HydrophobicContact CZ-CD2 4.01Å; V266-L283 HydrophobicContact CG1-CD1 4.07Å; V266-L283 HydrophobicContact CG2-CD1 4.2Å; V266-L283 HydrophobicContact CG2-CD2 4.24Å; L275-L283 HydrophobicContact CD1-CD1 3.9Å; L275-L283 HydrophobicContact CD2-CD1 4.14Å; H279-L283 VanDerWaalsContact O-CB 3.31Å; H279-L283 WeakPolarHBondContact O-CB 3.4Å; H279-L283 WeakPolarHBondContact O-CG 3.27Å; H279-L283 PolarHBondContact O-N 3.38Å; L283-I286 PolarHBondContact O-N 3.49Å; L283-K287 WeakPolarHBondContact O-CB 3.38Å; L283-K287 PolarHBondContact O-N 3.34Å
284L88.1Confident79.4Confident97 Ų9774.3 Ų74.351%0.50837%0.366SS..Hα-helixtrans-67.3-39.3172.8-73.1172.4000112.1T280 T281 L282 K287 K288T280-L284 HydrophobicContact CG2-CD1 3.95Å; T280-L284 HydrophobicContact CG2-CG 4.43Å; T280-L284 WeakPolarHBondContact O-CB 3.37Å; T280-L284 WeakPolarHBondContact O-CG 3.42Å; T280-L284 PolarHBondContact O-N 3Å; T281-L284 PolarHBondContact O-N 3.35Å; L282-L284 VanDerWaalsContact C-N 3.27Å; L282-L284 PolarHBondContact O-N 3.37Å; L284-K287 PolarHBondContact O-N 3.02Å; L284-K288 WeakPolarHBondContact O-CG 3.3Å; L284-K288 PolarHBondContact O-N 2.94Å
285R85.8Confident77.3Confident68 Ų6867.3 Ų67.326%0.25736%0.358SS..Hα-helixtrans-62.1-44.6174.1-74.9-175.2178.4168.5-0.4111A176 Q177 E179 Y181 I218 T281 L282 K288 T289A176-R285 PolarHBondContact O-NH1 2.87Å; A176-R285 VanDerWaalsContact O-NH1 3.07Å; Q177-R285 PolarHBondContact O-NH1 3.13Å; Q177-R285 PolarHBondContact O-NH2 3.09Å; E179-R285 IonicContact OE1-NH2 2.68Å; Y181-R285 WeakPolarHBondContact OH-CD 3.39Å; Y181-R285 PolarHBondContact OH-NH1 2.95Å; I218-R285 HydrophobicContact CD1-CB 4.47Å; T281-R285 WeakPolarHBondContact O-CG 3.35Å; T281-R285 PolarHBondContact O-N 2.95Å; L282-R285 WeakPolarHBondContact O-CB 3.48Å; L282-R285 PolarHBondContact O-N 3.03Å; L282-R285 VanDerWaalsContact O-N 3.08Å; R285-K288 WeakPolarHBondContact O-CB 3.21Å; R285-K288 PolarHBondContact O-N 3.27Å; R285-T289 PolarHBondContact O-N 3.27Å
286I85.6Confident75Confident0 Ų072.8 Ų72.80%039%0.387CS..Hα-helixtrans-61-44.8174.2-67.8169.8000111.4L214 F217 I218 F262 L282 L283 K288 T289 I290L214-I286 HydrophobicContact CD2-CD1 3.93Å; F217-I286 HydrophobicContact CB-CD1 3.96Å; F217-I286 HydrophobicContact CB-CG1 4.48Å; F217-I286 HydrophobicContact CD1-CB 4.13Å; F217-I286 HydrophobicContact CD1-CD1 3.78Å; F217-I286 HydrophobicContact CD1-CG1 3.77Å; F217-I286 HydrophobicContact CD1-CG2 3.25Å; F217-I286 HydrophobicContact CE1-CB 4.38Å; F217-I286 HydrophobicContact CE1-CG2 3.11Å; F217-I286 HydrophobicContact CG-CD1 4.08Å; F217-I286 HydrophobicContact CG-CG1 4.5Å; F217-I286 HydrophobicContact CG-CG2 4.42Å; F217-I286 HydrophobicContact CZ-CG2 4.18Å; I218-I286 HydrophobicContact CD1-CG1 4.19Å; I218-I286 HydrophobicContact CG1-CD1 4.1Å; I218-I286 HydrophobicContact CG1-CG1 3.46Å; I218-I286 VanDerWaalsContact CG1-CG1 3.46Å; F262-I286 HydrophobicContact CE2-CB 4.47Å; F262-I286 HydrophobicContact CE2-CG2 3.49Å; F262-I286 VanDerWaalsContact CE2-CG2 3.49Å; F262-I286 HydrophobicContact CZ-CB 4.04Å; F262-I286 HydrophobicContact CZ-CG2 3.54Å; L282-I286 WeakPolarHBondContact O-CG1 3.45Å; L282-I286 PolarHBondContact O-N 3.29Å; L283-I286 PolarHBondContact O-N 3.49Å; I286-K288 PolarHBondContact O-N 3.01Å; I286-T289 PolarHBondContact O-N 3.39Å; I286-T289 PolarHBondContact O-OG1 3.25Å; I286-I290 PolarHBondContact O-N 3.48Å
287K85Confident72.6Confident52 Ų5277.7 Ų77.723%0.22641%0.413CS..Hα-helixtrans-59.5-36.9177.9-179.7174.3173.5170.60112F262 T263 L283 L284 T289 I290 Q291F262-K287 HydrophobicContact CD1-CB 4.15Å; F262-K287 HydrophobicContact CD1-CG 4.43Å; F262-K287 HydrophobicContact CE1-CB 3.94Å; T263-K287 WeakPolarHBondContact OG1-CE 3.48Å; T263-K287 PolarHBondContact OG1-NZ 3.35Å; L283-K287 WeakPolarHBondContact O-CB 3.38Å; L283-K287 PolarHBondContact O-N 3.34Å; L284-K287 PolarHBondContact O-N 3.02Å; K287-T289 VanDerWaalsContact C-N 3.31Å; K287-T289 PolarHBondContact O-N 3.24Å; K287-I290 PolarHBondContact O-N 3.18Å; K287-Q291 WeakPolarHBondContact O-CG 3.46Å; K287-Q291 PolarHBondContact O-N 2.76Å
288K85.6Confident70Confident153 Ų15383 Ų8367%0.66543%0.433SS*.Hα-helixtrans-64.2-34176.1-73.2-178.9175.1-165.40112.6L284 R285 I286 I290 Q291 G292L284-K288 WeakPolarHBondContact O-CG 3.3Å; L284-K288 PolarHBondContact O-N 2.94Å; R285-K288 WeakPolarHBondContact O-CB 3.21Å; R285-K288 PolarHBondContact O-N 3.27Å; I286-K288 PolarHBondContact O-N 3.01Å; K288-I290 VanDerWaalsContact C-N 3.31Å; K288-I290 PolarHBondContact O-N 3.49Å; K288-Q291 PolarHBondContact O-N 3.13Å; K288-G292 PolarHBondContact O-N 3Å
289T81.4Confident69.2Low75 Ų7586.2 Ų86.246%0.4645%0.451SS..Hα-helixtrans-67.3-34176.764.10000111.9R285 I286 K287R285-T289 PolarHBondContact O-N 3.27Å; I286-T289 PolarHBondContact O-N 3.39Å; I286-T289 PolarHBondContact O-OG1 3.25Å; K287-T289 VanDerWaalsContact C-N 3.31Å; K287-T289 PolarHBondContact O-N 3.24Å
290I75.6Confident68.3Low18 Ų1889.8 Ų89.89%0.09247%0.471CS..Hα-helixtrans-68.5-42.5175.7-60.3170.7000111.8H254 F262 I286 K287 K288 G292H254-I290 HydrophobicContact CB-CD1 4.13Å; H254-I290 HydrophobicContact CB-CG1 4.33Å; H254-I290 WeakPolarHBondContact CD2-CG1 3.24Å; F262-I290 HydrophobicContact CB-CD1 4.16Å; F262-I290 HydrophobicContact CD2-CD1 3.5Å; F262-I290 VanDerWaalsContact CD2-CD1 3.5Å; F262-I290 HydrophobicContact CE2-CD1 4.02Å; F262-I290 HydrophobicContact CG-CD1 3.88Å; I286-I290 PolarHBondContact O-N 3.48Å; K287-I290 PolarHBondContact O-N 3.18Å; K288-I290 VanDerWaalsContact C-N 3.31Å; K288-I290 PolarHBondContact O-N 3.49Å; I290-G292 PolarHBondContact O-N 3.11Å
291Q71.6Confident67.1Low96 Ų9691.6 Ų91.645%0.44948%0.477SS..Hα-helixtrans-74-10.1-174.2-69.6-174.8-3200113.3S259 K287 K288S259-Q291 PolarHBondContact OG-NE2 2.67Å; K287-Q291 WeakPolarHBondContact O-CG 3.46Å; K287-Q291 PolarHBondContact O-N 2.76Å; K288-Q291 PolarHBondContact O-N 3.13Å
292G57.9Low65.9Low41 Ų4194.2 Ų94.242%0.42349%0.488SS..  trans68158-170.400000111.3K288 I290 E294K288-G292 PolarHBondContact O-N 3Å; I290-G292 PolarHBondContact O-N 3.11Å; G292-E294 PolarHBondContact O-N 3.47Å
293D45.3Very low64.7Low151 Ų151100 Ų10081%0.80752%0.518SS*.SBendtrans-70.652-172.6-137.47.3000113.5G295D293-G295 PolarHBondContact O-N 3.26Å; D293-G295 VanDerWaalsContact O-N 3.13Å
294E39.6Very low63.1Low194 Ų194106.3 Ų106.391%0.90755%0.551SS**  trans-76.215.1176.8-74.7-160.115000113.5G292G292-E294 PolarHBondContact O-N 3.47Å
295G40.6Very low61.3Low58 Ų58106.9 Ų106.960%0.59855%0.554SS**SBendtrans-108.4-29.7-169.400000117.6D293D293-G295 PolarHBondContact O-N 3.26Å; D293-G295 VanDerWaalsContact O-N 3.13Å
296D38Very low59.5Low145 Ų145109.9 Ų109.978%0.77558%0.576SS**SBendtrans-109.729.8-166.4-81.2-4.6000114.5
297L36.2Very low57.3Low171 Ų171119.1 Ų119.190%0.89562%0.624SS**  trans-117.164.1165.2-78.3167.8000111.3
298K30.6Very low54.8Low275 Ų275125.2 Ų125.2100%1.19666%0.661SS**  trans-146.20153.9-78.1-162.9179.4169.70112.5

Retrieved 298 of 298 residues in 874.8 ms (Link to these results)

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