G4VK94_SCHMA Loading...

Putative marvel-containing potential lipid raft-associated protein

AlphaFold DB , UniProt , Accession G4VK94, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 167 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
1M60.1Low79.4Confident171 Ų17183 Ų8384%0.84250%0.496SS*.  0115.80-156.8163.7-146.200106.8T65 A67M1-T65 WeakPolarHBondContact CG-O 3.32Å; M1-T65 VanDerWaalsContact SD-CB 3.59Å; M1-T65 HydrophobicContact SD-CG2 4.22Å; M1-A67 HydrophobicContact CE-CB 3.17Å
2S74.8Confident80.1Confident86 Ų8678.4 Ų78.460%0.60147%0.47SS*.  trans-85.9141.7179.3460000109.8
3L77Confident80.7Confident118 Ų11872.4 Ų72.462%0.61843%0.434SS*.  trans-78.3125.1172.7-67.3174000109.1T5 L64 T65L3-T5 PolarHBondContact O-N 3.26Å; L3-L64 HydrophobicContact CD2-CD2 4.35Å; L3-L64 HydrophobicContact CD2-CG 4.22Å; L3-T65 HydrophobicContact CD2-CG2 4.19Å
4N79.3Confident81.5Confident51 Ų5172.6 Ų72.627%0.27344%0.435SS..  trans-9082.4173.1-171.1-6.4000109.6A6 Y7 L64 N66N4-A6 PolarHBondContact O-N 3.31Å; N4-A6 WeakPolarHBondContact OD1-CB 3.47Å; N4-A6 PolarHBondContact OD1-N 3.27Å; N4-Y7 WeakPolarHBondContact O-CB 3.33Å; N4-Y7 PolarHBondContact O-N 3.05Å; N4-Y7 PolarHBondContact OD1-N 2.85Å; N4-L64 WeakPolarHBondContact CB-O 3.27Å; N4-L64 PolarHBondContact N-O 3.19Å; N4-N66 WeakPolarHBondContact CB-OD1 3.01Å; N4-N66 PolarHBondContact ND2-OD1 3.09Å
5T79.6Confident82.3Confident113 Ų11370 Ų7069%0.69342%0.416SS*.THydrogen-bonded Turntrans-61.8-23.517952.80000112.8L3 Y7 A8L3-T5 PolarHBondContact O-N 3.26Å; T5-Y7 VanDerWaalsContact C-N 3.26Å; T5-Y7 PolarHBondContact O-N 3.09Å; T5-A8 WeakPolarHBondContact O-CB 3.39Å; T5-A8 PolarHBondContact O-N 3.24Å
6A82.8Confident83Confident57 Ų5765.6 Ų65.647%0.47139%0.39SS..THydrogen-bonded Turntrans-64.2-32.4174.900000111.8N4 A8 S9N4-A6 PolarHBondContact O-N 3.31Å; N4-A6 WeakPolarHBondContact OD1-CB 3.47Å; N4-A6 PolarHBondContact OD1-N 3.27Å; A6-A8 VanDerWaalsContact C-N 3.28Å; A6-A8 PolarHBondContact O-N 2.62Å; A6-S9 PolarHBondContact O-N 3.16Å; A6-S9 VanDerWaalsContact O-N 3.14Å; A6-S9 PolarHBondContact O-OG 2.82Å
7Y81.4Confident83.7Confident20 Ų2065.4 Ų65.48%0.07839%0.386CS..G310 helixtrans-59.9-38.9176.5178.1-106.1000111.9N4 T5 S9 T10 A13 Y60 H63 L64N4-Y7 WeakPolarHBondContact O-CB 3.33Å; N4-Y7 PolarHBondContact O-N 3.05Å; N4-Y7 PolarHBondContact OD1-N 2.85Å; T5-Y7 VanDerWaalsContact C-N 3.26Å; T5-Y7 PolarHBondContact O-N 3.09Å; Y7-S9 PolarHBondContact O-N 2.9Å; Y7-T10 HydrophobicContact CD2-CG2 4.36Å; Y7-T10 WeakPolarHBondContact CD2-OG1 3.36Å; Y7-T10 WeakPolarHBondContact CE2-OG1 3.16Å; Y7-T10 WeakPolarHBondContact O-CB 3.49Å; Y7-T10 PolarHBondContact O-N 3.04Å; Y7-T10 PolarHBondContact O-OG1 3.33Å; Y7-A13 HydrophobicContact CD1-CB 3.85Å; Y7-A13 HydrophobicContact CE1-CB 3.51Å; Y7-A13 HydrophobicContact CE2-CB 4.23Å; Y7-A13 HydrophobicContact CG-CB 4.34Å; Y7-A13 WeakPolarHBondContact O-CB 3.43Å; Y7-Y60 HydrophobicContact CE1-CD2 4.02Å; Y7-Y60 HydrophobicContact CE1-CE2 4.3Å; Y7-H63 HydrophobicContact CD1-CB 3.66Å; Y7-H63 HydrophobicContact CD2-CB 3.79Å; Y7-H63 HydrophobicContact CE1-CB 3.28Å; Y7-H63 HydrophobicContact CE2-CB 3.42Å; Y7-H63 VanDerWaalsContact CE2-CB 3.42Å; Y7-H63 AromaticContact CE2-CG 3.76Å; Y7-H63 HydrophobicContact CG-CB 3.9Å; Y7-H63 AromaticContact CZ-CD2 3.78Å; Y7-H63 AromaticContact CZ-CG 3.61Å; Y7-H63 PolarHBondContact OH-CD2 2.77Å; Y7-H63 VanDerWaalsContact OH-CD2 3.24Å; Y7-L64 HydrophobicContact CD1-CB 4.37Å
8A80.7Confident84.4Confident39 Ų3964.9 Ų64.932%0.32238%0.383SS..G310 helixtrans-59.4-20.8-179.700000113.5T5 A6T5-A8 WeakPolarHBondContact O-CB 3.39Å; T5-A8 PolarHBondContact O-N 3.24Å; A6-A8 VanDerWaalsContact C-N 3.28Å; A6-A8 PolarHBondContact O-N 2.62Å
9S83.7Confident85Confident100 Ų10061.5 Ų61.570%0.69936%0.363SS*.G310 helixtrans-93.4-0.5175.768.30000114.6A6 Y7A6-S9 PolarHBondContact O-N 3.16Å; A6-S9 VanDerWaalsContact O-N 3.14Å; A6-S9 PolarHBondContact O-OG 2.82Å; Y7-S9 PolarHBondContact O-N 2.9Å
10T87.2Confident85.6Confident49 Ų4959.7 Ų59.730%0.30135%0.352SS..SBendtrans-83.1153.8-179.366.80000111.9Y7 A13 V14Y7-T10 HydrophobicContact CD2-CG2 4.36Å; Y7-T10 WeakPolarHBondContact CD2-OG1 3.36Å; Y7-T10 WeakPolarHBondContact CE2-OG1 3.16Å; Y7-T10 WeakPolarHBondContact O-CB 3.49Å; Y7-T10 PolarHBondContact O-N 3.04Å; Y7-T10 PolarHBondContact O-OG1 3.33Å; T10-A13 WeakPolarHBondContact O-CB 3.48Å; T10-A13 PolarHBondContact O-N 2.87Å; T10-A13 VanDerWaalsContact O-N 3.14Å; T10-V14 PolarHBondContact O-N 3.18Å; T10-V14 VanDerWaalsContact O-N 3.13Å
11I87.3Confident86.1Confident109 Ų10961.2 Ų61.256%0.55936%0.357SS*.Hα-helixtrans-53.9-48.9179.1-62.3169.4000111.8A13 V14 F15I11-A13 VanDerWaalsContact C-N 3.31Å; I11-A13 PolarHBondContact O-N 3.04Å; I11-V14 PolarHBondContact O-N 3.33Å; I11-F15 HydrophobicContact CG2-CD2 3.77Å; I11-F15 HydrophobicContact CG2-CE2 3.5Å; I11-F15 VanDerWaalsContact O-CD2 3.29Å; I11-F15 WeakPolarHBondContact O-CD2 3.12Å; I11-F15 PolarHBondContact O-N 3.38Å; I11-F15 VanDerWaalsContact O-N 3.14Å
12P86.7Confident87.9Confident28 Ų2854.2 Ų54.218%0.18232%0.323CS..Hα-helixtrans-60.6-38.9178.8-23.635.5000112.8V14 F15 K16P12-V14 VanDerWaalsContact C-N 3.34Å; P12-V14 PolarHBondContact O-N 3.25Å; P12-F15 PolarHBondContact O-N 3.01Å; P12-K16 WeakPolarHBondContact O-CG 3.39Å; P12-K16 PolarHBondContact O-N 2.86Å
13A88.6Confident89Confident0 Ų050.1 Ų50.10%029%0.294CS..Hα-helixtrans-63.8-39.9178.900000112.4Y7 T10 I11 K16 I17 Y60Y7-A13 HydrophobicContact CD1-CB 3.85Å; Y7-A13 HydrophobicContact CE1-CB 3.51Å; Y7-A13 HydrophobicContact CE2-CB 4.23Å; Y7-A13 HydrophobicContact CG-CB 4.34Å; Y7-A13 WeakPolarHBondContact O-CB 3.43Å; T10-A13 WeakPolarHBondContact O-CB 3.48Å; T10-A13 PolarHBondContact O-N 2.87Å; T10-A13 VanDerWaalsContact O-N 3.14Å; I11-A13 VanDerWaalsContact C-N 3.31Å; I11-A13 PolarHBondContact O-N 3.04Å; A13-K16 PolarHBondContact O-N 3.47Å; A13-I17 WeakPolarHBondContact O-CG1 3.48Å; A13-I17 PolarHBondContact O-N 2.78Å; A13-Y60 HydrophobicContact CB-CD2 4.5Å; A13-Y60 HydrophobicContact CB-CE2 4.16Å
14V91.7Very high89.9Confident75 Ų7548.3 Ų48.346%0.45529%0.285SS..Hα-helixtrans-62.6-44.5175.6176.30000110.5T10 I11 P12 K16 I17 V18T10-V14 PolarHBondContact O-N 3.18Å; T10-V14 VanDerWaalsContact O-N 3.13Å; I11-V14 PolarHBondContact O-N 3.33Å; P12-V14 VanDerWaalsContact C-N 3.34Å; P12-V14 PolarHBondContact O-N 3.25Å; V14-K16 PolarHBondContact O-N 2.95Å; V14-I17 PolarHBondContact O-N 2.96Å; V14-V18 HydrophobicContact CG1-CG2 4.33Å; V14-V18 WeakPolarHBondContact O-CG2 3.47Å; V14-V18 PolarHBondContact O-N 2.73Å
15F93.2Very high90.7Very high34 Ų3448.7 Ų48.715%0.14929%0.286CS..Hα-helixtrans-56.4-49.6174.7-83-74.5000111.5I11 P12 I17 V18 E19 L120 V123 D124 F127I11-F15 HydrophobicContact CG2-CD2 3.77Å; I11-F15 HydrophobicContact CG2-CE2 3.5Å; I11-F15 VanDerWaalsContact O-CD2 3.29Å; I11-F15 WeakPolarHBondContact O-CD2 3.12Å; I11-F15 PolarHBondContact O-N 3.38Å; I11-F15 VanDerWaalsContact O-N 3.14Å; P12-F15 PolarHBondContact O-N 3.01Å; F15-I17 VanDerWaalsContact C-N 3.32Å; F15-I17 PolarHBondContact O-N 3.2Å; F15-V18 PolarHBondContact O-N 3.5Å; F15-E19 WeakPolarHBondContact O-CB 3.03Å; F15-E19 WeakPolarHBondContact O-CG 3.44Å; F15-E19 PolarHBondContact O-N 3.14Å; F15-L120 HydrophobicContact CD1-CD1 3.62Å; F15-L120 HydrophobicContact CD1-CG 4.07Å; F15-L120 HydrophobicContact CE1-CD1 3.64Å; F15-L120 HydrophobicContact CE1-CG 4.46Å; F15-V123 HydrophobicContact CE1-CB 4.49Å; F15-V123 HydrophobicContact CE1-CG1 4.07Å; F15-V123 HydrophobicContact CZ-CG1 3.8Å; F15-D124 HydrophobicContact CB-CB 4.22Å; F15-D124 HydrophobicContact CD1-CB 4.07Å; F15-D124 HydrophobicContact CG-CB 4.08Å; F15-F127 AromaticContact CE2-CD2 3.84Å; F15-F127 HydrophobicContact CE2-CD2 3.84Å; F15-F127 HydrophobicContact CE2-CE2 4.02Å; F15-F127 HydrophobicContact CZ-CD2 4.05Å; F15-F127 AromaticContact CZ-CE2 3.98Å; F15-F127 HydrophobicContact CZ-CE2 3.98Å
16K93.7Very high91.5Very high0 Ų043.3 Ų43.30%025%0.253CS..Hα-helixtrans-57.9-42.7178.4-60.5-65.9142.6-135.10112.7P12 A13 V14 E19 I20 F59 Y60 D124P12-K16 WeakPolarHBondContact O-CG 3.39Å; P12-K16 PolarHBondContact O-N 2.86Å; A13-K16 PolarHBondContact O-N 3.47Å; V14-K16 PolarHBondContact O-N 2.95Å; K16-E19 IonicContact NZ-OE1 2.64Å; K16-E19 PolarHBondContact NZ-OE1 3.24Å; K16-E19 IonicContact NZ-OE2 3.28Å; K16-E19 PolarHBondContact NZ-OE2 3.09Å; K16-I20 WeakPolarHBondContact O-CB 3.44Å; K16-I20 WeakPolarHBondContact O-CD1 3.16Å; K16-I20 WeakPolarHBondContact O-CG1 3.34Å; K16-I20 PolarHBondContact O-N 2.9Å; K16-F59 HydrophobicContact CD-CB 4.45Å; K16-Y60 HydrophobicContact CB-CD2 4.09Å; K16-D124 WeakPolarHBondContact CE-OD2 3.44Å; K16-D124 IonicContact NZ-OD2 2.76Å; K16-D124 PolarHBondContact NZ-OD2 2.61Å
17I94.3Very high92Very high62 Ų6242.9 Ų42.932%0.31824%0.242SC..Hα-helixtrans-64-46.7178.7-68.2165.7000110.5A13 V14 F15 I20 I21 Y60A13-I17 WeakPolarHBondContact O-CG1 3.48Å; A13-I17 PolarHBondContact O-N 2.78Å; V14-I17 PolarHBondContact O-N 2.96Å; F15-I17 VanDerWaalsContact C-N 3.32Å; F15-I17 PolarHBondContact O-N 3.2Å; I17-I20 PolarHBondContact O-N 3.38Å; I17-I21 HydrophobicContact CG2-CD1 3.82Å; I17-I21 VanDerWaalsContact O-CG1 3.31Å; I17-I21 WeakPolarHBondContact O-CG1 3.08Å; I17-I21 PolarHBondContact O-N 2.78Å; I17-Y60 HydrophobicContact CD1-CE2 3.83Å; I17-Y60 HydrophobicContact CG1-CD2 4.3Å; I17-Y60 HydrophobicContact CG1-CE2 3.76Å
18V96.4Very high92.5Very high56 Ų5646.6 Ų46.634%0.33926%0.262SS..Hα-helixtrans-65.1-43.5180177.70000110.8V14 F15 I20 I21 L22 L120V14-V18 HydrophobicContact CG1-CG2 4.33Å; V14-V18 WeakPolarHBondContact O-CG2 3.47Å; V14-V18 PolarHBondContact O-N 2.73Å; F15-V18 PolarHBondContact O-N 3.5Å; V18-I20 VanDerWaalsContact C-N 3.35Å; V18-I20 PolarHBondContact O-N 2.96Å; V18-I21 PolarHBondContact O-N 3.35Å; V18-L22 HydrophobicContact CG1-CD1 4.11Å; V18-L22 HydrophobicContact CG1-CG 4.27Å; V18-L22 WeakPolarHBondContact O-CG 2.97Å; V18-L22 PolarHBondContact O-N 3.39Å; V18-L120 HydrophobicContact CB-CD2 4.12Å; V18-L120 HydrophobicContact CG1-CD1 4.49Å; V18-L120 HydrophobicContact CG1-CD2 3.61Å
19E95.9Very high93Very high0 Ų046.3 Ų46.30%026%0.255CS..Hα-helixtrans-54.8-48.7173.9-73.3169.1-17700111.5F15 K16 I21 L22 N23 S56 L120 Y121F15-E19 WeakPolarHBondContact O-CB 3.03Å; F15-E19 WeakPolarHBondContact O-CG 3.44Å; F15-E19 PolarHBondContact O-N 3.14Å; K16-E19 IonicContact NZ-OE1 2.64Å; K16-E19 PolarHBondContact NZ-OE1 3.24Å; K16-E19 IonicContact NZ-OE2 3.28Å; K16-E19 PolarHBondContact NZ-OE2 3.09Å; E19-I21 PolarHBondContact O-N 3.34Å; E19-L22 PolarHBondContact O-N 3.39Å; E19-N23 WeakPolarHBondContact O-CB 2.85Å; E19-N23 PolarHBondContact O-N 3.48Å; E19-N23 PolarHBondContact O-ND2 3.13Å; E19-N23 VanDerWaalsContact O-ND2 3.08Å; E19-S56 PolarHBondContact OE2-OG 3.19Å; E19-L120 HydrophobicContact CB-CD2 4.42Å; E19-L120 HydrophobicContact CG-CD2 3.69Å; E19-L120 HydrophobicContact CG-CG 4.17Å; E19-Y121 HydrophobicContact CB-CE2 3.78Å; E19-Y121 HydrophobicContact CG-CD2 3.87Å; E19-Y121 HydrophobicContact CG-CE1 4.28Å; E19-Y121 HydrophobicContact CG-CE2 3.5Å; E19-Y121 HydrophobicContact CG-CG 4.42Å
20I96.7Very high93.2Very high26 Ų2641.7 Ų41.713%0.13322%0.223CC..Hα-helixtrans-61-45.9178.4-70.3163.4000110.9K16 I17 V18 L22 N23 I24 T53 L57K16-I20 WeakPolarHBondContact O-CB 3.44Å; K16-I20 WeakPolarHBondContact O-CD1 3.16Å; K16-I20 WeakPolarHBondContact O-CG1 3.34Å; K16-I20 PolarHBondContact O-N 2.9Å; I17-I20 PolarHBondContact O-N 3.38Å; V18-I20 VanDerWaalsContact C-N 3.35Å; V18-I20 PolarHBondContact O-N 2.96Å; I20-L22 PolarHBondContact O-N 2.98Å; I20-N23 PolarHBondContact O-N 2.9Å; I20-I24 HydrophobicContact CG2-CD1 3.9Å; I20-I24 VanDerWaalsContact O-CG1 3.3Å; I20-I24 WeakPolarHBondContact O-CG1 3.32Å; I20-I24 PolarHBondContact O-N 3.13Å; I20-T53 HydrophobicContact CG2-CG2 4.39Å; I20-L57 HydrophobicContact CD1-CB 4.21Å; I20-L57 HydrophobicContact CD1-CD1 4.36Å
21I97.7Very high93.2Very high91 Ų9142.4 Ų42.447%0.46723%0.234SC..Hα-helixtrans-61.3-47.5179.3-68.5166.3000110.5I17 V18 E19 N23 I24 I25I17-I21 HydrophobicContact CG2-CD1 3.82Å; I17-I21 VanDerWaalsContact O-CG1 3.31Å; I17-I21 WeakPolarHBondContact O-CG1 3.08Å; I17-I21 PolarHBondContact O-N 2.78Å; V18-I21 PolarHBondContact O-N 3.35Å; E19-I21 PolarHBondContact O-N 3.34Å; I21-N23 VanDerWaalsContact C-N 3.31Å; I21-N23 PolarHBondContact O-N 3.3Å; I21-I24 PolarHBondContact O-N 3.22Å; I21-I25 HydrophobicContact CG2-CD1 4.23Å; I21-I25 WeakPolarHBondContact O-CG1 3.45Å; I21-I25 PolarHBondContact O-N 3.43Å
22L97.3Very high93.2Very high24 Ų2441.9 Ų41.913%0.12624%0.236CC..Hα-helixtrans-65.7-35.1179.3-66.5-179.2000112.1V18 E19 I20 I25 L26 F113 I116 N117 L120V18-L22 HydrophobicContact CG1-CD1 4.11Å; V18-L22 HydrophobicContact CG1-CG 4.27Å; V18-L22 WeakPolarHBondContact O-CG 2.97Å; V18-L22 PolarHBondContact O-N 3.39Å; E19-L22 PolarHBondContact O-N 3.39Å; I20-L22 PolarHBondContact O-N 2.98Å; L22-I25 HydrophobicContact CD2-CD1 4.3Å; L22-I25 WeakPolarHBondContact O-CB 3.45Å; L22-I25 PolarHBondContact O-N 3.14Å; L22-L26 WeakPolarHBondContact O-CG 3Å; L22-L26 PolarHBondContact O-N 3.38Å; L22-F113 HydrophobicContact CD2-CD1 4.07Å; L22-F113 HydrophobicContact CD2-CE1 4.11Å; L22-I116 HydrophobicContact CD1-CG2 3.95Å; L22-N117 WeakPolarHBondContact CB-ND2 3.37Å; L22-N117 WeakPolarHBondContact CB-OD1 3.29Å; L22-L120 HydrophobicContact CD1-CD2 3.8Å
23N97.8Very high92.7Very high0 Ų040.7 Ų40.70%023%0.228CC..Hα-helixtrans-68.1-36.2174.6-71.4-33.7000112.5E19 I20 I21 I25 L26 I27 T52 T53 H90 Y121E19-N23 WeakPolarHBondContact O-CB 2.85Å; E19-N23 PolarHBondContact O-N 3.48Å; E19-N23 PolarHBondContact O-ND2 3.13Å; E19-N23 VanDerWaalsContact O-ND2 3.08Å; I20-N23 PolarHBondContact O-N 2.9Å; I21-N23 VanDerWaalsContact C-N 3.31Å; I21-N23 PolarHBondContact O-N 3.3Å; N23-I25 VanDerWaalsContact C-N 3.32Å; N23-I25 PolarHBondContact O-N 3.33Å; N23-L26 WeakPolarHBondContact O-CB 3.26Å; N23-L26 PolarHBondContact O-N 2.97Å; N23-I27 VanDerWaalsContact O-CG1 3.3Å; N23-I27 WeakPolarHBondContact O-CG1 3.32Å; N23-I27 PolarHBondContact O-N 3.14Å; N23-T52 PolarHBondContact ND2-OG1 2.88Å; N23-T52 VanDerWaalsContact ND2-OG1 3.17Å; N23-T52 PolarHBondContact OD1-OG1 3.24Å; N23-T53 WeakPolarHBondContact CB-OG1 3.46Å; N23-H90 PolarHBondContact OD1-CE1 3.26Å; N23-H90 PolarHBondContact OD1-NE2 2.96Å; N23-Y121 PolarHBondContact ND2-OH 3.12Å
24I96.8Very high91.6Very high81 Ų8145.4 Ų45.442%0.41526%0.258SS..Hα-helixtrans-62.6-42.5172.4-68.5164.2000110.3I20 I21 L26 I27 I28I20-I24 HydrophobicContact CG2-CD1 3.9Å; I20-I24 VanDerWaalsContact O-CG1 3.3Å; I20-I24 WeakPolarHBondContact O-CG1 3.32Å; I20-I24 PolarHBondContact O-N 3.13Å; I21-I24 PolarHBondContact O-N 3.22Å; I24-L26 VanDerWaalsContact C-N 3.31Å; I24-L26 PolarHBondContact O-N 3.18Å; I24-I27 PolarHBondContact O-N 3.15Å; I24-I28 HydrophobicContact CG2-CD1 4.03Å; I24-I28 WeakPolarHBondContact O-CG1 3.17Å; I24-I28 PolarHBondContact O-N 3.07Å
25I95.9Very high90.4Very high59 Ų5944.2 Ų44.230%0.30325%0.25SC..Hα-helixtrans-59.4-44.2174.1-66.8168.9000110.4I21 L22 N23 I28 L29 F113I21-I25 HydrophobicContact CG2-CD1 4.23Å; I21-I25 WeakPolarHBondContact O-CG1 3.45Å; I21-I25 PolarHBondContact O-N 3.43Å; L22-I25 HydrophobicContact CD2-CD1 4.3Å; L22-I25 WeakPolarHBondContact O-CB 3.45Å; L22-I25 PolarHBondContact O-N 3.14Å; N23-I25 VanDerWaalsContact C-N 3.32Å; N23-I25 PolarHBondContact O-N 3.33Å; I25-I28 PolarHBondContact O-N 3.29Å; I25-L29 HydrophobicContact CG2-CD1 3.92Å; I25-L29 HydrophobicContact CG2-CG 4.27Å; I25-L29 WeakPolarHBondContact O-CG 3.35Å; I25-L29 PolarHBondContact O-N 2.69Å; I25-F113 HydrophobicContact CG2-CD1 4.36Å; I25-F113 HydrophobicContact CG2-CD2 4.42Å; I25-F113 HydrophobicContact CG2-CE1 4.27Å; I25-F113 HydrophobicContact CG2-CE2 4.35Å; I25-F113 HydrophobicContact CG2-CG 4.44Å; I25-F113 HydrophobicContact CG2-CZ 4.27Å
26L94.9Very high88.9Confident0 Ų042.9 Ų42.90%024%0.244CC..Hα-helixtrans-61.1-44.1176-76.3170.9000112.4L22 N23 I24 I28 L29 V30 A49 F113 F114 N117L22-L26 WeakPolarHBondContact O-CG 3Å; L22-L26 PolarHBondContact O-N 3.38Å; N23-L26 WeakPolarHBondContact O-CB 3.26Å; N23-L26 PolarHBondContact O-N 2.97Å; I24-L26 VanDerWaalsContact C-N 3.31Å; I24-L26 PolarHBondContact O-N 3.18Å; L26-I28 VanDerWaalsContact C-N 3.29Å; L26-I28 PolarHBondContact O-N 2.85Å; L26-L29 PolarHBondContact O-N 2.9Å; L26-V30 WeakPolarHBondContact O-CB 3.44Å; L26-V30 VanDerWaalsContact O-CG2 3.25Å; L26-V30 WeakPolarHBondContact O-CG2 3.39Å; L26-V30 PolarHBondContact O-N 3.34Å; L26-A49 HydrophobicContact CB-CB 4.15Å; L26-F113 HydrophobicContact CD2-CB 3.53Å; L26-F113 HydrophobicContact CG-CB 4.09Å; L26-F114 HydrophobicContact CB-CZ 4.4Å; L26-F114 HydrophobicContact CD1-CD1 3.68Å; L26-F114 HydrophobicContact CD1-CE1 3.62Å; L26-F114 HydrophobicContact CD1-CG 4.13Å; L26-F114 HydrophobicContact CD1-CZ 4.06Å; L26-F114 HydrophobicContact CD2-CD1 4.2Å; L26-F114 HydrophobicContact CD2-CD2 3.59Å; L26-F114 HydrophobicContact CD2-CE1 4.22Å; L26-F114 HydrophobicContact CD2-CE2 3.62Å; L26-F114 HydrophobicContact CD2-CG 3.86Å; L26-F114 HydrophobicContact CD2-CZ 3.93Å; L26-F114 HydrophobicContact CG-CE1 4.41Å; L26-F114 HydrophobicContact CG-CZ 4.37Å; L26-N117 WeakPolarHBondContact CD1-ND2 3.44Å
27I94.5Very high87.1Confident48 Ų4848.3 Ų48.325%0.24628%0.276CS..Hα-helixtrans-57.9-44.5175.8-69.2165000110.2N23 I24 A31 F46 A49 I50N23-I27 VanDerWaalsContact O-CG1 3.3Å; N23-I27 WeakPolarHBondContact O-CG1 3.32Å; N23-I27 PolarHBondContact O-N 3.14Å; I24-I27 PolarHBondContact O-N 3.15Å; I27-A31 WeakPolarHBondContact O-CB 3.21Å; I27-A31 PolarHBondContact O-N 2.86Å; I27-F46 HydrophobicContact CG2-CD1 4.48Å; I27-F46 HydrophobicContact CG2-CE1 4.1Å; I27-A49 HydrophobicContact CG1-CB 3.75Å; I27-I50 HydrophobicContact CD1-CG1 3.95Å; I27-I50 HydrophobicContact CG1-CG1 4.24Å
28I92.5Very high85.3Confident97 Ų9752.1 Ų52.150%0.49730%0.296SS..Hα-helixtrans-64.6-47.3177.7-65.7165.4000110.9I24 I25 L26 V30 A31 V32I24-I28 HydrophobicContact CG2-CD1 4.03Å; I24-I28 WeakPolarHBondContact O-CG1 3.17Å; I24-I28 PolarHBondContact O-N 3.07Å; I25-I28 PolarHBondContact O-N 3.29Å; L26-I28 VanDerWaalsContact C-N 3.29Å; L26-I28 PolarHBondContact O-N 2.85Å; I28-V30 VanDerWaalsContact C-N 3.31Å; I28-V30 PolarHBondContact O-N 3.36Å; I28-A31 PolarHBondContact O-N 3.24Å; I28-V32 HydrophobicContact CG2-CG2 4.18Å; I28-V32 WeakPolarHBondContact O-CB 3.33Å; I28-V32 VanDerWaalsContact O-CG2 3.27Å; I28-V32 WeakPolarHBondContact O-CG2 3.23Å; I28-V32 PolarHBondContact O-N 3.29Å
29L89.5Confident83.4Confident33 Ų3354.1 Ų54.117%0.17331%0.31CS..Hα-helixtrans-60.6-40.6-179.9-73.5173.6000112.2I25 L26 A109 A110 F113I25-L29 HydrophobicContact CG2-CD1 3.92Å; I25-L29 HydrophobicContact CG2-CG 4.27Å; I25-L29 WeakPolarHBondContact O-CG 3.35Å; I25-L29 PolarHBondContact O-N 2.69Å; L26-L29 PolarHBondContact O-N 2.9Å; L29-A109 HydrophobicContact CD1-CB 4.37Å; L29-A109 HydrophobicContact CD2-CB 4.39Å; L29-A110 HydrophobicContact CB-CB 4.37Å; L29-F113 HydrophobicContact CD1-CD2 3.57Å; L29-F113 HydrophobicContact CD1-CE2 4.14Å; L29-F113 HydrophobicContact CD1-CG 4.28Å
30V88.7Confident82.3Confident3 Ų356.6 Ų56.62%0.01834%0.336CS..Hα-helixtrans-72.1-38.6177.9179.50000110.8L26 I28 Y36 L45 F46 F114L26-V30 WeakPolarHBondContact O-CB 3.44Å; L26-V30 VanDerWaalsContact O-CG2 3.25Å; L26-V30 WeakPolarHBondContact O-CG2 3.39Å; L26-V30 PolarHBondContact O-N 3.34Å; I28-V30 VanDerWaalsContact C-N 3.31Å; I28-V30 PolarHBondContact O-N 3.36Å; V30-Y36 HydrophobicContact CB-CD2 4.2Å; V30-Y36 HydrophobicContact CB-CE2 4.46Å; V30-Y36 HydrophobicContact CG1-CD2 3.87Å; V30-Y36 HydrophobicContact CG1-CE2 4.5Å; V30-Y36 HydrophobicContact CG1-CG 4.15Å; V30-Y36 HydrophobicContact CG2-CD2 4.44Å; V30-Y36 HydrophobicContact CG2-CE2 4.28Å; V30-Y36 WeakPolarHBondContact O-CD2 3.45Å; V30-L45 HydrophobicContact CG1-CB 4.03Å; V30-L45 HydrophobicContact CG1-CD1 4.5Å; V30-L45 HydrophobicContact CG2-CB 3.84Å; V30-L45 HydrophobicContact CG2-CD1 4.18Å; V30-F46 HydrophobicContact CB-CE1 4.18Å; V30-F46 HydrophobicContact CB-CE2 4.45Å; V30-F46 HydrophobicContact CB-CZ 4.17Å; V30-F46 HydrophobicContact CG1-CD1 4.25Å; V30-F46 HydrophobicContact CG1-CD2 3.73Å; V30-F46 HydrophobicContact CG1-CE1 4.11Å; V30-F46 HydrophobicContact CG1-CE2 3.58Å; V30-F46 HydrophobicContact CG1-CG 4.07Å; V30-F46 HydrophobicContact CG1-CZ 3.79Å; V30-F114 HydrophobicContact CG2-CE2 4.43Å
31A87.6Confident81.6Confident64 Ų6456.3 Ų56.353%0.52934%0.335SS..Hα-helixtrans-67.6-36.5178.200000114I27 I28 S33 F46I27-A31 WeakPolarHBondContact O-CB 3.21Å; I27-A31 PolarHBondContact O-N 2.86Å; I28-A31 PolarHBondContact O-N 3.24Å; A31-S33 VanDerWaalsContact C-N 3.33Å; A31-F46 HydrophobicContact CB-CE1 4.14Å; A31-F46 HydrophobicContact CB-CZ 3.77Å
32V86.1Confident81Confident99 Ų9952.1 Ų52.160%0.632%0.315SS*.Hα-helixtrans-74.4-24.7-177.8169.80000112.3I28 P34I28-V32 HydrophobicContact CG2-CG2 4.18Å; I28-V32 WeakPolarHBondContact O-CB 3.33Å; I28-V32 VanDerWaalsContact O-CG2 3.27Å; I28-V32 WeakPolarHBondContact O-CG2 3.23Å; I28-V32 PolarHBondContact O-N 3.29Å; V32-P34 VanDerWaalsContact O-CD 3.28Å; V32-P34 WeakPolarHBondContact O-CD 3.34Å
33S77.1Confident80.6Confident2 Ų253.4 Ų53.41%0.01433%0.334CS..  trans-89.6111.2-173.2178.50000111.8A31 N35 Y36 T106A31-S33 VanDerWaalsContact C-N 3.33Å; S33-N35 PolarHBondContact O-N 3.5Å; S33-N35 VanDerWaalsContact O-N 3.16Å; S33-Y36 VanDerWaalsContact CB-CD2 3.43Å; S33-Y36 PolarHBondContact O-N 3.34Å; S33-T106 PolarHBondContact OG-OG1 3.26Å
34P66.4Low80.3Confident99 Ų9957.2 Ų57.264%0.64335%0.348SS*.G310 helixtrans-63.4-26.1-176.8-19.532.4000113.1V32 Y36 V37V32-P34 VanDerWaalsContact O-CD 3.28Å; V32-P34 WeakPolarHBondContact O-CD 3.34Å; P34-Y36 PolarHBondContact O-N 2.9Å; P34-V37 VanDerWaalsContact O-CB 3.25Å; P34-V37 WeakPolarHBondContact O-CB 3.37Å; P34-V37 WeakPolarHBondContact O-CG2 3.19Å; P34-V37 PolarHBondContact O-N 2.98Å; P34-V37 VanDerWaalsContact O-N 3.08Å
35N65Low80.1Confident51 Ų5153.3 Ų53.327%0.27333%0.328SS..G310 helixtrans-70.3-19.1-178.9-70.6-52000113.1S33 V37 I38 P39 Y104S33-N35 PolarHBondContact O-N 3.5Å; S33-N35 VanDerWaalsContact O-N 3.16Å; N35-V37 PolarHBondContact O-N 3.27Å; N35-I38 CarbonylContact O-C 3.52Å; N35-I38 PolarHBondContact O-N 3.5Å; N35-P39 WeakPolarHBondContact O-CD 3.39Å; N35-Y104 WeakPolarHBondContact ND2-CD2 3.4Å; N35-Y104 WeakPolarHBondContact ND2-CE2 3.32Å
36Y61.7Low79.9Confident6 Ų653.6 Ų53.62%0.02433%0.327CS..G310 helixtrans-72.8-19.2172.5-69.6-50.3000112.7V30 S33 P34 P41 G42 L45 T100 A107 A110V30-Y36 HydrophobicContact CB-CD2 4.2Å; V30-Y36 HydrophobicContact CB-CE2 4.46Å; V30-Y36 HydrophobicContact CG1-CD2 3.87Å; V30-Y36 HydrophobicContact CG1-CE2 4.5Å; V30-Y36 HydrophobicContact CG1-CG 4.15Å; V30-Y36 HydrophobicContact CG2-CD2 4.44Å; V30-Y36 HydrophobicContact CG2-CE2 4.28Å; V30-Y36 WeakPolarHBondContact O-CD2 3.45Å; S33-Y36 VanDerWaalsContact CB-CD2 3.43Å; S33-Y36 PolarHBondContact O-N 3.34Å; P34-Y36 PolarHBondContact O-N 2.9Å; Y36-P41 HydrophobicContact CD1-CG 4.19Å; Y36-G42 WeakPolarHBondContact O-CA 3.45Å; Y36-G42 PolarHBondContact O-N 2.66Å; Y36-G42 VanDerWaalsContact O-N 3.09Å; Y36-L45 HydrophobicContact CD1-CD1 3.59Å; Y36-L45 HydrophobicContact CE1-CD1 3.29Å; Y36-L45 HydrophobicContact CE2-CD1 4.41Å; Y36-L45 HydrophobicContact CG-CD1 4.26Å; Y36-T100 HydrophobicContact CE1-CG2 4.36Å; Y36-A107 VanDerWaalsContact OH-CA 3.23Å; Y36-A107 WeakPolarHBondContact OH-CA 3.47Å; Y36-A110 WeakPolarHBondContact OH-CB 3.43Å
37V57.4Low80Confident113 Ų11358.2 Ų58.269%0.68535%0.348SS*.THydrogen-bonded Turntrans-73.9-35.2175.5-172.10000110.8P34 N35P34-V37 VanDerWaalsContact O-CB 3.25Å; P34-V37 WeakPolarHBondContact O-CB 3.37Å; P34-V37 WeakPolarHBondContact O-CG2 3.19Å; P34-V37 PolarHBondContact O-N 2.98Å; P34-V37 VanDerWaalsContact O-N 3.08Å; N35-V37 PolarHBondContact O-N 3.27Å
38I54.8Low80.1Confident142 Ų14256 Ų5673%0.72834%0.336SS*.SBendtrans-139.566-171.8-43.2178.7000110.7N35N35-I38 CarbonylContact O-C 3.52Å; N35-I38 PolarHBondContact O-N 3.5Å
39P58.4Low80.2Confident98 Ų9851.3 Ų51.364%0.63631%0.312SS*.SBend-132.132.987.734.9-23.2000115.2N35 P41N35-P39 WeakPolarHBondContact O-CD 3.39Å; P39-P41 HydrophobicContact CG-CG 4.28Å; P39-P41 WeakPolarHBondContact O-CD 2.99Å
40G72.1Confident80.6Confident52 Ų5253.6 Ų53.654%0.53632%0.324SS..SBendtrans81.8-5.7175.500000119.7G42 G43G40-G42 PolarHBondContact O-N 2.89Å; G40-G43 PolarHBondContact O-N 3.29Å
41P81.6Confident81Confident20 Ų2055.8 Ų55.813%0.1334%0.335CS..Hα-helixtrans-67-21177.927-31.6000112.1Y36 P39 G43 W44 L45 V96 T100Y36-P41 HydrophobicContact CD1-CG 4.19Å; P39-P41 HydrophobicContact CG-CG 4.28Å; P39-P41 WeakPolarHBondContact O-CD 2.99Å; P41-G43 PolarHBondContact O-N 3.4Å; P41-W44 PolarHBondContact O-N 3.47Å; P41-W44 VanDerWaalsContact O-N 3.12Å; P41-L45 WeakPolarHBondContact O-CG 3.13Å; P41-L45 PolarHBondContact O-N 3.27Å; P41-V96 HydrophobicContact CB-CG1 3.7Å; P41-T100 HydrophobicContact CG-CG2 3.77Å
42G85Confident81.5Confident3 Ų352.8 Ų52.83%0.03131%0.31CS..Hα-helixtrans-54.3-36.1178.500000113.9Y36 G40 W44 L45 F46Y36-G42 WeakPolarHBondContact O-CA 3.45Å; Y36-G42 PolarHBondContact O-N 2.66Å; Y36-G42 VanDerWaalsContact O-N 3.09Å; G40-G42 PolarHBondContact O-N 2.89Å; G42-W44 PolarHBondContact O-N 3.44Å; G42-L45 PolarHBondContact O-N 3.04Å; G42-F46 WeakPolarHBondContact O-CB 3.31Å; G42-F46 WeakPolarHBondContact O-CD2 3.38Å; G42-F46 PolarHBondContact O-N 3.32Å
43G88.9Confident82Confident51 Ų5149 Ų4953%0.52629%0.288SS..Hα-helixtrans-60.4-46177.900000112.6G40 P41 F47G40-G43 PolarHBondContact O-N 3.29Å; P41-G43 PolarHBondContact O-N 3.4Å; G43-F47 VanDerWaalsContact O-CB 3.26Å; G43-F47 WeakPolarHBondContact O-CB 3.34Å; G43-F47 PolarHBondContact O-N 3.24Å
44W91.6Very high83Confident80 Ų8053.9 Ų53.930%0.30331%0.313SS..Hα-helixtrans-63.7-45176.1174.5-109000111.7P41 G42 F46 F47 V48 F89 I92P41-W44 PolarHBondContact O-N 3.47Å; P41-W44 VanDerWaalsContact O-N 3.12Å; G42-W44 PolarHBondContact O-N 3.44Å; W44-F46 PolarHBondContact O-N 2.99Å; W44-F47 AromaticContact CE3-CD1 3.85Å; W44-F47 HydrophobicContact CE3-CD1 3.85Å; W44-F47 HydrophobicContact CE3-CE1 4.43Å; W44-F47 HydrophobicContact CH2-CD1 4.41Å; W44-F47 HydrophobicContact CH2-CE1 4.36Å; W44-F47 AromaticContact CZ3-CD1 3.67Å; W44-F47 HydrophobicContact CZ3-CD1 3.67Å; W44-F47 AromaticContact CZ3-CE1 3.79Å; W44-F47 HydrophobicContact CZ3-CE1 3.79Å; W44-F47 WeakPolarHBondContact O-CB 3.42Å; W44-F47 PolarHBondContact O-N 3.09Å; W44-V48 HydrophobicContact CD2-CG2 4.01Å; W44-V48 HydrophobicContact CE3-CG2 4.43Å; W44-V48 HydrophobicContact CH2-CG2 4.05Å; W44-V48 HydrophobicContact CZ2-CG2 3.58Å; W44-V48 HydrophobicContact CZ3-CG2 4.45Å; W44-V48 WeakPolarHBondContact O-CG2 3.46Å; W44-V48 PolarHBondContact O-N 3.03Å; W44-F89 HydrophobicContact CH2-CD1 4.15Å; W44-F89 HydrophobicContact CH2-CE1 4.29Å; W44-F89 HydrophobicContact CZ2-CD1 4.43Å; W44-I92 HydrophobicContact CZ2-CB 4.12Å; W44-I92 HydrophobicContact CZ2-CG2 3.77Å
45L92.6Very high84.4Confident0 Ų051 Ų510%029%0.292CS..Hα-helixtrans-64.9-41.7-178.3-58.1176.9000112.2V30 Y36 P41 G42 A49 A93 V96 C97 F114V30-L45 HydrophobicContact CG1-CB 4.03Å; V30-L45 HydrophobicContact CG1-CD1 4.5Å; V30-L45 HydrophobicContact CG2-CB 3.84Å; V30-L45 HydrophobicContact CG2-CD1 4.18Å; Y36-L45 HydrophobicContact CD1-CD1 3.59Å; Y36-L45 HydrophobicContact CE1-CD1 3.29Å; Y36-L45 HydrophobicContact CE2-CD1 4.41Å; Y36-L45 HydrophobicContact CG-CD1 4.26Å; P41-L45 WeakPolarHBondContact O-CG 3.13Å; P41-L45 PolarHBondContact O-N 3.27Å; G42-L45 PolarHBondContact O-N 3.04Å; L45-A49 WeakPolarHBondContact O-CB 3.42Å; L45-A49 PolarHBondContact O-N 2.96Å; L45-A93 HydrophobicContact CD2-CB 3.82Å; L45-A93 WeakPolarHBondContact CD2-O 3.29Å; L45-V96 HydrophobicContact CD2-CB 4.37Å; L45-V96 HydrophobicContact CD2-CG1 4.22Å; L45-C97 WeakPolarHBondContact CD1-SG 3.47Å; L45-C97 WeakPolarHBondContact CD2-SG 3.12Å; L45-F114 HydrophobicContact CB-CE2 4.28Å; L45-F114 HydrophobicContact CB-CZ 4.13Å; L45-F114 HydrophobicContact CD2-CD2 4.49Å; L45-F114 HydrophobicContact CD2-CE2 3.81Å; L45-F114 HydrophobicContact CD2-CZ 4.06Å; L45-F114 HydrophobicContact CG-CE2 4.43Å
46F92.6Very high85.8Confident65 Ų6548.6 Ų48.629%0.28528%0.279SS..Hα-helixtrans-64.5-44.4172.7-84.3-59000112.1I27 V30 A31 G42 W44 V48 A49 I50I27-F46 HydrophobicContact CG2-CD1 4.48Å; I27-F46 HydrophobicContact CG2-CE1 4.1Å; V30-F46 HydrophobicContact CB-CE1 4.18Å; V30-F46 HydrophobicContact CB-CE2 4.45Å; V30-F46 HydrophobicContact CB-CZ 4.17Å; V30-F46 HydrophobicContact CG1-CD1 4.25Å; V30-F46 HydrophobicContact CG1-CD2 3.73Å; V30-F46 HydrophobicContact CG1-CE1 4.11Å; V30-F46 HydrophobicContact CG1-CE2 3.58Å; V30-F46 HydrophobicContact CG1-CG 4.07Å; V30-F46 HydrophobicContact CG1-CZ 3.79Å; A31-F46 HydrophobicContact CB-CE1 4.14Å; A31-F46 HydrophobicContact CB-CZ 3.77Å; G42-F46 WeakPolarHBondContact O-CB 3.31Å; G42-F46 WeakPolarHBondContact O-CD2 3.38Å; G42-F46 PolarHBondContact O-N 3.32Å; W44-F46 PolarHBondContact O-N 2.99Å; F46-V48 VanDerWaalsContact C-N 3.32Å; F46-V48 PolarHBondContact O-N 3.46Å; F46-A49 PolarHBondContact O-N 3.35Å; F46-I50 HydrophobicContact CB-CD1 4.37Å; F46-I50 HydrophobicContact CD1-CD1 4.45Å; F46-I50 VanDerWaalsContact O-CB 3.29Å; F46-I50 WeakPolarHBondContact O-CB 3.16Å; F46-I50 VanDerWaalsContact O-CG1 3.26Å; F46-I50 WeakPolarHBondContact O-CG1 3.31Å; F46-I50 PolarHBondContact O-N 3.03Å
47F95.2Very high87.4Confident97 Ų9752 Ų5243%0.42530%0.297SS..Hα-helixtrans-55.6-50177.2168.9-103.2000110.8G43 W44 L51 F89G43-F47 VanDerWaalsContact O-CB 3.26Å; G43-F47 WeakPolarHBondContact O-CB 3.34Å; G43-F47 PolarHBondContact O-N 3.24Å; W44-F47 AromaticContact CE3-CD1 3.85Å; W44-F47 HydrophobicContact CE3-CD1 3.85Å; W44-F47 HydrophobicContact CE3-CE1 4.43Å; W44-F47 HydrophobicContact CH2-CD1 4.41Å; W44-F47 HydrophobicContact CH2-CE1 4.36Å; W44-F47 AromaticContact CZ3-CD1 3.67Å; W44-F47 HydrophobicContact CZ3-CD1 3.67Å; W44-F47 AromaticContact CZ3-CE1 3.79Å; W44-F47 HydrophobicContact CZ3-CE1 3.79Å; W44-F47 WeakPolarHBondContact O-CB 3.42Å; W44-F47 PolarHBondContact O-N 3.09Å; F47-L51 HydrophobicContact CE1-CD2 4.01Å; F47-L51 HydrophobicContact CE2-CD2 4.11Å; F47-L51 HydrophobicContact CZ-CD2 3.59Å; F47-L51 WeakPolarHBondContact O-CB 3.36Å; F47-L51 PolarHBondContact O-N 3.04Å; F47-F89 HydrophobicContact CE1-CE2 4.37Å
48V96.6Very high89.1Confident0 Ų051.7 Ų51.70%029%0.287CS..Hα-helixtrans-60.7-54.4178.4173.60000110.6W44 F46 I50 L51 T52 F89 A93 F114W44-V48 HydrophobicContact CD2-CG2 4.01Å; W44-V48 HydrophobicContact CE3-CG2 4.43Å; W44-V48 HydrophobicContact CH2-CG2 4.05Å; W44-V48 HydrophobicContact CZ2-CG2 3.58Å; W44-V48 HydrophobicContact CZ3-CG2 4.45Å; W44-V48 WeakPolarHBondContact O-CG2 3.46Å; W44-V48 PolarHBondContact O-N 3.03Å; F46-V48 VanDerWaalsContact C-N 3.32Å; F46-V48 PolarHBondContact O-N 3.46Å; V48-I50 PolarHBondContact O-N 2.9Å; V48-L51 PolarHBondContact O-N 2.85Å; V48-T52 HydrophobicContact CG1-CG2 4.31Å; V48-T52 WeakPolarHBondContact O-CG2 3.17Å; V48-T52 PolarHBondContact O-N 3.25Å; V48-T52 PolarHBondContact O-OG1 2.76Å; V48-F89 HydrophobicContact CG1-CB 3.88Å; V48-F89 HydrophobicContact CG2-CB 4.02Å; V48-A93 HydrophobicContact CB-CB 4.34Å; V48-A93 HydrophobicContact CG1-CB 4.15Å; V48-A93 HydrophobicContact CG2-CB 4.33Å; V48-F114 HydrophobicContact CG1-CE1 4.13Å
49A96.1Very high90.8Very high0 Ų045.2 Ų45.20%025%0.253CS..Hα-helixtrans-63.5-38.6-174.900000113.2L26 I27 L45 F46 T52 T53L26-A49 HydrophobicContact CB-CB 4.15Å; I27-A49 HydrophobicContact CG1-CB 3.75Å; L45-A49 WeakPolarHBondContact O-CB 3.42Å; L45-A49 PolarHBondContact O-N 2.96Å; F46-A49 PolarHBondContact O-N 3.35Å; A49-T52 PolarHBondContact O-OG1 3.04Å; A49-T53 WeakPolarHBondContact O-CB 3.47Å; A49-T53 PolarHBondContact O-N 3.49Å; A49-T53 VanDerWaalsContact O-N 3.12Å; A49-T53 PolarHBondContact O-OG1 2.83Å
50I97.4Very high92.4Very high80 Ų8042.7 Ų42.741%0.4123%0.231SC..Hα-helixtrans-72.1-46.2177.8-66.2169.1000110.4I27 F46 V48 T52 T53 L54I27-I50 HydrophobicContact CD1-CG1 3.95Å; I27-I50 HydrophobicContact CG1-CG1 4.24Å; F46-I50 HydrophobicContact CB-CD1 4.37Å; F46-I50 HydrophobicContact CD1-CD1 4.45Å; F46-I50 VanDerWaalsContact O-CB 3.29Å; F46-I50 WeakPolarHBondContact O-CB 3.16Å; F46-I50 VanDerWaalsContact O-CG1 3.26Å; F46-I50 WeakPolarHBondContact O-CG1 3.31Å; F46-I50 PolarHBondContact O-N 3.03Å; V48-I50 PolarHBondContact O-N 2.9Å; I50-T52 PolarHBondContact O-N 3.39Å; I50-T53 WeakPolarHBondContact O-CB 3.36Å; I50-T53 PolarHBondContact O-N 2.93Å; I50-L54 HydrophobicContact CG2-CD1 4.1Å; I50-L54 HydrophobicContact CG2-CG 4.4Å; I50-L54 WeakPolarHBondContact O-CG 3.38Å; I50-L54 PolarHBondContact O-N 2.93Å
51L97.6Very high93.2Very high50 Ų5042.9 Ų42.926%0.26222%0.224SC..Hα-helixtrans-60.7-47.7-179.4179.265.6000111.2F47 V48 T53 L54 I55 F89F47-L51 HydrophobicContact CE1-CD2 4.01Å; F47-L51 HydrophobicContact CE2-CD2 4.11Å; F47-L51 HydrophobicContact CZ-CD2 3.59Å; F47-L51 WeakPolarHBondContact O-CB 3.36Å; F47-L51 PolarHBondContact O-N 3.04Å; V48-L51 PolarHBondContact O-N 2.85Å; L51-T53 VanDerWaalsContact C-N 3.33Å; L51-T53 PolarHBondContact O-N 3.39Å; L51-L54 PolarHBondContact O-N 2.91Å; L51-I55 HydrophobicContact CD1-CD1 4.03Å; L51-I55 HydrophobicContact CD1-CG1 4.39Å; L51-I55 HydrophobicContact CG-CD1 3.87Å; L51-I55 VanDerWaalsContact O-CG1 3.32Å; L51-I55 WeakPolarHBondContact O-CG1 3.21Å; L51-I55 PolarHBondContact O-N 3.39Å; L51-F89 HydrophobicContact CD2-CD2 4.13Å; L51-F89 HydrophobicContact CD2-CE2 3.77Å
52T97.5Very high93.5Very high0 Ų042.3 Ų42.30%022%0.22CC..Hα-helixtrans-68.5-33.4-179.760.70000111.8N23 V48 A49 I50 I55 S56 C86 H90 Y121N23-T52 PolarHBondContact ND2-OG1 2.88Å; N23-T52 VanDerWaalsContact ND2-OG1 3.17Å; N23-T52 PolarHBondContact OD1-OG1 3.24Å; V48-T52 HydrophobicContact CG1-CG2 4.31Å; V48-T52 WeakPolarHBondContact O-CG2 3.17Å; V48-T52 PolarHBondContact O-N 3.25Å; V48-T52 PolarHBondContact O-OG1 2.76Å; A49-T52 PolarHBondContact O-OG1 3.04Å; I50-T52 PolarHBondContact O-N 3.39Å; T52-I55 PolarHBondContact O-N 3.5Å; T52-S56 WeakPolarHBondContact O-CB 3.28Å; T52-S56 PolarHBondContact O-N 2.9Å; T52-S56 PolarHBondContact O-OG 3.5Å; T52-C86 HydrophobicContact CG2-CB 3.7Å; T52-H90 PolarHBondContact OG1-NE2 3.17Å; T52-H90 VanDerWaalsContact OG1-NE2 3.1Å; T52-Y121 WeakPolarHBondContact CB-OH 3.43Å; T52-Y121 PolarHBondContact O-OH 3.07Å
53T97.4Very high93.5Very high21 Ų2142.4 Ų42.413%0.12922%0.219CC..Hα-helixtrans-58.8-49.4168.9-60.40000111.8I20 N23 A49 I50 L51 I55 S56 L57I20-T53 HydrophobicContact CG2-CG2 4.39Å; N23-T53 WeakPolarHBondContact CB-OG1 3.46Å; A49-T53 WeakPolarHBondContact O-CB 3.47Å; A49-T53 PolarHBondContact O-N 3.49Å; A49-T53 VanDerWaalsContact O-N 3.12Å; A49-T53 PolarHBondContact O-OG1 2.83Å; I50-T53 WeakPolarHBondContact O-CB 3.36Å; I50-T53 PolarHBondContact O-N 2.93Å; L51-T53 VanDerWaalsContact C-N 3.33Å; L51-T53 PolarHBondContact O-N 3.39Å; T53-I55 VanDerWaalsContact C-N 3.34Å; T53-I55 PolarHBondContact O-N 3.43Å; T53-S56 PolarHBondContact O-N 3Å; T53-L57 WeakPolarHBondContact O-CB 3.4Å; T53-L57 PolarHBondContact O-N 2.93Å
54L97.3Very high93.4Very high103 Ų10341.7 Ų41.754%0.53920%0.203SC..Hα-helixtrans-64.9-39.2-178.9-70.1177.6000111.7I50 L51 F58I50-L54 HydrophobicContact CG2-CD1 4.1Å; I50-L54 HydrophobicContact CG2-CG 4.4Å; I50-L54 WeakPolarHBondContact O-CG 3.38Å; I50-L54 PolarHBondContact O-N 2.93Å; L51-L54 PolarHBondContact O-N 2.91Å; L54-F58 WeakPolarHBondContact O-CB 3.48Å; L54-F58 PolarHBondContact O-N 3.11Å
55I95.6Very high93Very high39 Ų3939.5 Ų39.520%0.220%0.198CC..Hα-helixtrans-64.7-49.8176.5-70.1171000110.8L51 T52 T53 L57 F58 F59 C82 I83L51-I55 HydrophobicContact CD1-CD1 4.03Å; L51-I55 HydrophobicContact CD1-CG1 4.39Å; L51-I55 HydrophobicContact CG-CD1 3.87Å; L51-I55 VanDerWaalsContact O-CG1 3.32Å; L51-I55 WeakPolarHBondContact O-CG1 3.21Å; L51-I55 PolarHBondContact O-N 3.39Å; T52-I55 PolarHBondContact O-N 3.5Å; T53-I55 VanDerWaalsContact C-N 3.34Å; T53-I55 PolarHBondContact O-N 3.43Å; I55-L57 VanDerWaalsContact C-N 3.31Å; I55-L57 PolarHBondContact O-N 3.15Å; I55-F58 WeakPolarHBondContact O-CB 3.33Å; I55-F58 PolarHBondContact O-N 3.03Å; I55-F59 HydrophobicContact CG2-CD2 3.76Å; I55-F59 HydrophobicContact CG2-CE2 3.61Å; I55-F59 VanDerWaalsContact O-CD2 3.28Å; I55-F59 WeakPolarHBondContact O-CD2 3.49Å; I55-F59 PolarHBondContact O-N 3.18Å; I55-C82 HydrophobicContact CG2-CB 4.47Å; I55-I83 HydrophobicContact CG2-CD1 4.29Å
56S94.5Very high92.1Very high0 Ų041.8 Ų41.80%021%0.211CC..Hα-helixtrans-64.2-37.7178.9-65.20000111.6E19 T52 T53 Y60 Y121E19-S56 PolarHBondContact OE2-OG 3.19Å; T52-S56 WeakPolarHBondContact O-CB 3.28Å; T52-S56 PolarHBondContact O-N 2.9Å; T52-S56 PolarHBondContact O-OG 3.5Å; T53-S56 PolarHBondContact O-N 3Å; S56-Y60 VanDerWaalsContact O-CB 3.23Å; S56-Y60 WeakPolarHBondContact O-CB 3.29Å; S56-Y60 PolarHBondContact O-N 2.85Å; S56-Y121 PolarHBondContact OG-OH 3.39Å
57L94.7Very high91.2Very high78 Ų7839.2 Ų39.241%0.40820%0.202SC..Hα-helixtrans-65.8-40.8174.6-177.563.2000112I20 T53 I55 Y60 C61I20-L57 HydrophobicContact CD1-CB 4.21Å; I20-L57 HydrophobicContact CD1-CD1 4.36Å; T53-L57 WeakPolarHBondContact O-CB 3.4Å; T53-L57 PolarHBondContact O-N 2.93Å; I55-L57 VanDerWaalsContact C-N 3.31Å; I55-L57 PolarHBondContact O-N 3.15Å; L57-Y60 PolarHBondContact O-N 2.9Å; L57-C61 WeakPolarHBondContact O-CB 3.46Å; L57-C61 PolarHBondContact O-N 2.9Å; L57-C61 PolarHBondContact O-SG 3.44Å
58F93.2Very high89.8Confident107 Ų10735.5 Ų35.547%0.46919%0.186SC..Hα-helixtrans-61.5-50.8178171.2-102.9000111.5L54 I55 C61 I62 F71L54-F58 WeakPolarHBondContact O-CB 3.48Å; L54-F58 PolarHBondContact O-N 3.11Å; I55-F58 WeakPolarHBondContact O-CB 3.33Å; I55-F58 PolarHBondContact O-N 3.03Å; F58-C61 PolarHBondContact O-N 3.11Å; F58-I62 HydrophobicContact CD1-CD1 4.01Å; F58-I62 HydrophobicContact CD2-CD1 4.12Å; F58-I62 HydrophobicContact CE1-CD1 3.4Å; F58-I62 VanDerWaalsContact CE1-CD1 3.4Å; F58-I62 HydrophobicContact CE2-CD1 3.53Å; F58-I62 HydrophobicContact CE2-CG1 4.32Å; F58-I62 HydrophobicContact CG-CD1 4.35Å; F58-I62 HydrophobicContact CZ-CD1 3.15Å; F58-I62 HydrophobicContact CZ-CG1 4.35Å; F58-I62 PolarHBondContact O-N 3Å; F58-F71 HydrophobicContact CZ-CZ 4.37Å
59F91.2Very high88.4Confident6 Ų643.7 Ų43.73%0.02622%0.218CC..Hα-helixtrans-64.8-41.5177.7-74.2-61.1000111.9K16 I55 C61 I62 H63 M75 E79 C82 I83K16-F59 HydrophobicContact CD-CB 4.45Å; I55-F59 HydrophobicContact CG2-CD2 3.76Å; I55-F59 HydrophobicContact CG2-CE2 3.61Å; I55-F59 VanDerWaalsContact O-CD2 3.28Å; I55-F59 WeakPolarHBondContact O-CD2 3.49Å; I55-F59 PolarHBondContact O-N 3.18Å; F59-C61 VanDerWaalsContact C-N 3.33Å; F59-C61 PolarHBondContact O-N 3.46Å; F59-I62 PolarHBondContact O-N 3.47Å; F59-H63 PolarHBondContact O-CD2 3.19Å; F59-H63 PolarHBondContact O-N 3.34Å; F59-M75 HydrophobicContact CE1-CE 4.46Å; F59-E79 HydrophobicContact CB-CG 4.43Å; F59-E79 HydrophobicContact CD1-CB 4.09Å; F59-E79 HydrophobicContact CD1-CG 3.7Å; F59-E79 HydrophobicContact CD2-CG 3.9Å; F59-E79 HydrophobicContact CE1-CB 3.77Å; F59-E79 HydrophobicContact CE1-CG 3.82Å; F59-E79 HydrophobicContact CE2-CB 4.46Å; F59-E79 HydrophobicContact CE2-CG 4Å; F59-E79 HydrophobicContact CG-CG 3.76Å; F59-E79 HydrophobicContact CZ-CB 3.98Å; F59-E79 HydrophobicContact CZ-CG 3.97Å; F59-C82 HydrophobicContact CE2-CB 3.75Å; F59-C82 HydrophobicContact CZ-CB 4Å; F59-I83 HydrophobicContact CD2-CD1 4.47Å
60Y91.1Very high87.1Confident44 Ų4452.1 Ų52.117%0.17326%0.255CS..Hα-helixtrans-56.7-47.2174.1-176.1-98.4000111.8Y7 A13 K16 I17 S56 L57 H63 L64Y7-Y60 HydrophobicContact CE1-CD2 4.02Å; Y7-Y60 HydrophobicContact CE1-CE2 4.3Å; A13-Y60 HydrophobicContact CB-CD2 4.5Å; A13-Y60 HydrophobicContact CB-CE2 4.16Å; K16-Y60 HydrophobicContact CB-CD2 4.09Å; I17-Y60 HydrophobicContact CD1-CE2 3.83Å; I17-Y60 HydrophobicContact CG1-CD2 4.3Å; I17-Y60 HydrophobicContact CG1-CE2 3.76Å; S56-Y60 VanDerWaalsContact O-CB 3.23Å; S56-Y60 WeakPolarHBondContact O-CB 3.29Å; S56-Y60 PolarHBondContact O-N 2.85Å; L57-Y60 PolarHBondContact O-N 2.9Å; Y60-H63 PolarHBondContact O-N 3.07Å; Y60-L64 HydrophobicContact CE1-CD2 3.88Å; Y60-L64 WeakPolarHBondContact O-CB 3.31Å; Y60-L64 PolarHBondContact O-N 2.88Å
61C89.6Confident85.7Confident56 Ų5652.3 Ų52.338%0.37825%0.253SS..Hα-helixtrans-62.9-43.5178.2-69.90000112.4L57 F58 F59 H63 L64 T65L57-C61 WeakPolarHBondContact O-CB 3.46Å; L57-C61 PolarHBondContact O-N 2.9Å; L57-C61 PolarHBondContact O-SG 3.44Å; F58-C61 PolarHBondContact O-N 3.11Å; F59-C61 VanDerWaalsContact C-N 3.33Å; F59-C61 PolarHBondContact O-N 3.46Å; C61-H63 PolarHBondContact O-N 2.91Å; C61-L64 PolarHBondContact O-N 3.42Å; C61-T65 WeakPolarHBondContact O-CB 3.28Å; C61-T65 WeakPolarHBondContact O-CG2 3.3Å; C61-T65 PolarHBondContact O-N 3.05Å; C61-T65 PolarHBondContact O-OG1 3.25Å
62I88.1Confident84.3Confident9 Ų955.8 Ų55.85%0.04628%0.281CS..Hα-helixtrans-61.7-45.6-180-79178.3000111.2F58 F59 T65 N66 A67 I68 F71 M75F58-I62 HydrophobicContact CD1-CD1 4.01Å; F58-I62 HydrophobicContact CD2-CD1 4.12Å; F58-I62 HydrophobicContact CE1-CD1 3.4Å; F58-I62 VanDerWaalsContact CE1-CD1 3.4Å; F58-I62 HydrophobicContact CE2-CD1 3.53Å; F58-I62 HydrophobicContact CE2-CG1 4.32Å; F58-I62 HydrophobicContact CG-CD1 4.35Å; F58-I62 HydrophobicContact CZ-CD1 3.15Å; F58-I62 HydrophobicContact CZ-CG1 4.35Å; F58-I62 PolarHBondContact O-N 3Å; F59-I62 PolarHBondContact O-N 3.47Å; I62-T65 PolarHBondContact O-OG1 2.85Å; I62-N66 PolarHBondContact O-N 2.68Å; I62-A67 HydrophobicContact CB-CB 4.31Å; I62-A67 HydrophobicContact CG1-CB 4.17Å; I62-A67 HydrophobicContact CG2-CB 4.18Å; I62-A67 PolarHBondContact O-N 3.25Å; I62-I68 HydrophobicContact CG2-CB 4.37Å; I62-I68 HydrophobicContact CG2-CG1 3.72Å; I62-F71 HydrophobicContact CD1-CD2 4.08Å; I62-F71 HydrophobicContact CD1-CE2 3.41Å; I62-F71 VanDerWaalsContact CD1-CE2 3.41Å; I62-F71 HydrophobicContact CD1-CZ 4.02Å; I62-F71 HydrophobicContact CG1-CE2 4.09Å; I62-M75 HydrophobicContact CG2-CE 4.47Å
63H85.4Confident83Confident4 Ų457 Ų572%0.01929%0.294CS..Hα-helixtrans-71.5-40.3-179.9-71.9-60000112.2Y7 F59 Y60 C61 T65 N66 I68 E79 Y138Y7-H63 HydrophobicContact CD1-CB 3.66Å; Y7-H63 HydrophobicContact CD2-CB 3.79Å; Y7-H63 HydrophobicContact CE1-CB 3.28Å; Y7-H63 HydrophobicContact CE2-CB 3.42Å; Y7-H63 VanDerWaalsContact CE2-CB 3.42Å; Y7-H63 AromaticContact CE2-CG 3.76Å; Y7-H63 HydrophobicContact CG-CB 3.9Å; Y7-H63 AromaticContact CZ-CD2 3.78Å; Y7-H63 AromaticContact CZ-CG 3.61Å; Y7-H63 PolarHBondContact OH-CD2 2.77Å; Y7-H63 VanDerWaalsContact OH-CD2 3.24Å; F59-H63 PolarHBondContact O-CD2 3.19Å; F59-H63 PolarHBondContact O-N 3.34Å; Y60-H63 PolarHBondContact O-N 3.07Å; C61-H63 PolarHBondContact O-N 2.91Å; H63-T65 VanDerWaalsContact C-N 3.3Å; H63-T65 PolarHBondContact O-N 3.23Å; H63-N66 PolarHBondContact O-N 2.99Å; H63-I68 WeakPolarHBondContact ND1-CD1 3.28Å; H63-E79 IonicContact CD2-OE1 3.89Å; H63-E79 IonicContact CD2-OE2 3.86Å; H63-E79 IonicContact CE1-OE2 3.49Å; H63-E79 IonicContact NE2-OE1 2.87Å; H63-E79 PolarHBondContact NE2-OE1 3.2Å; H63-E79 IonicContact NE2-OE2 3.55Å; H63-E79 PolarHBondContact NE2-OE2 2.99Å; H63-Y138 AromaticContact CE1-CE2 3.65Å; H63-Y138 AromaticContact CE1-CZ 3.68Å
64L85.4Confident82.2Confident36 Ų3658.5 Ų58.519%0.18830%0.304CS..Hα-helixtrans-63.6-36.2177.4-175.568000112.3L3 N4 Y7 Y60 C61L3-L64 HydrophobicContact CD2-CD2 4.35Å; L3-L64 HydrophobicContact CD2-CG 4.22Å; N4-L64 WeakPolarHBondContact CB-O 3.27Å; N4-L64 PolarHBondContact N-O 3.19Å; Y7-L64 HydrophobicContact CD1-CB 4.37Å; Y60-L64 HydrophobicContact CE1-CD2 3.88Å; Y60-L64 WeakPolarHBondContact O-CB 3.31Å; Y60-L64 PolarHBondContact O-N 2.88Å; C61-L64 PolarHBondContact O-N 3.42Å
65T83.8Confident81.4Confident34 Ų3454 Ų5421%0.20928%0.28CS..THydrogen-bonded Turntrans-91.83.1-177.859.20000113.5M1 L3 C61 I62 H63 A67M1-T65 WeakPolarHBondContact CG-O 3.32Å; M1-T65 VanDerWaalsContact SD-CB 3.59Å; M1-T65 HydrophobicContact SD-CG2 4.22Å; L3-T65 HydrophobicContact CD2-CG2 4.19Å; C61-T65 WeakPolarHBondContact O-CB 3.28Å; C61-T65 WeakPolarHBondContact O-CG2 3.3Å; C61-T65 PolarHBondContact O-N 3.05Å; C61-T65 PolarHBondContact O-OG1 3.25Å; I62-T65 PolarHBondContact O-OG1 2.85Å; H63-T65 VanDerWaalsContact C-N 3.3Å; H63-T65 PolarHBondContact O-N 3.23Å; T65-A67 PolarHBondContact O-N 2.87Å; T65-A67 VanDerWaalsContact O-N 3.13Å; T65-A67 WeakPolarHBondContact OG1-CB 3.41Å
66N74.4Confident80.8Confident49 Ų4952.3 Ų52.326%0.26227%0.271SS..THydrogen-bonded Turntrans50.428.9-168.3-67.3-34.2000112.7N4 I62 H63 I68 Y69N4-N66 WeakPolarHBondContact CB-OD1 3.01Å; N4-N66 PolarHBondContact ND2-OD1 3.09Å; I62-N66 PolarHBondContact O-N 2.68Å; H63-N66 PolarHBondContact O-N 2.99Å; N66-I68 PolarHBondContact O-N 2.77Å; N66-I68 VanDerWaalsContact O-N 3.12Å; N66-Y69 HydrophobicContact CB-CD2 4.48Å; N66-Y69 HydrophobicContact CB-CE2 4.36Å; N66-Y69 WeakPolarHBondContact O-CD2 3.21Å
67A72.6Confident80.3Confident11 Ų1154.4 Ų54.49%0.09128%0.282CS..G310 helixtrans-66-10.4175.900000112.9M1 I62 T65 Y69 K70M1-A67 HydrophobicContact CE-CB 3.17Å; I62-A67 HydrophobicContact CB-CB 4.31Å; I62-A67 HydrophobicContact CG1-CB 4.17Å; I62-A67 HydrophobicContact CG2-CB 4.18Å; I62-A67 PolarHBondContact O-N 3.25Å; T65-A67 PolarHBondContact O-N 2.87Å; T65-A67 VanDerWaalsContact O-N 3.13Å; T65-A67 WeakPolarHBondContact OG1-CB 3.41Å; A67-Y69 PolarHBondContact O-N 2.64Å; A67-K70 WeakPolarHBondContact O-CB 3.47Å; A67-K70 PolarHBondContact O-N 3.31Å
68I66.6Low80.1Confident19 Ų1954.1 Ų54.110%0.09728%0.281CS..G310 helixtrans-50.8-42.6-177-49.4164.3000110I62 H63 N66 K70 F71 M75 H140I62-I68 HydrophobicContact CG2-CB 4.37Å; I62-I68 HydrophobicContact CG2-CG1 3.72Å; H63-I68 WeakPolarHBondContact ND1-CD1 3.28Å; N66-I68 PolarHBondContact O-N 2.77Å; N66-I68 VanDerWaalsContact O-N 3.12Å; I68-K70 PolarHBondContact O-N 2.87Å; I68-F71 PolarHBondContact O-N 2.86Å; I68-M75 HydrophobicContact CG2-CB 4.04Å; I68-M75 HydrophobicContact CG2-CG 3.94Å; I68-H140 PolarHBondContact O-CE1 3.3Å; I68-H140 PolarHBondContact O-NE2 3.28Å
69Y66.5Low80Confident171 Ų17149.1 Ų49.167%0.67126%0.259SS*.G310 helixtrans-62.2-15.6-179.8-59.2-67.7000114.5N66 A67N66-Y69 HydrophobicContact CB-CD2 4.48Å; N66-Y69 HydrophobicContact CB-CE2 4.36Å; N66-Y69 WeakPolarHBondContact O-CD2 3.21Å; A67-Y69 PolarHBondContact O-N 2.64Å
70K68.8Low80Confident178 Ų17851.2 Ų51.277%0.77427%0.268SS*.G310 helixtrans-79.8-23.4177.1-168.8173.2178.6-179.10112.6A67 I68A67-K70 WeakPolarHBondContact O-CB 3.47Å; A67-K70 PolarHBondContact O-N 3.31Å; I68-K70 PolarHBondContact O-N 2.87Å
71F69.2Low80.1Confident84 Ų8453.1 Ų53.137%0.36828%0.28SS..SBendtrans-97.6123.7-178.3-66.3-77.7000110F58 I62 I68 M75 H140F58-F71 HydrophobicContact CZ-CZ 4.37Å; I62-F71 HydrophobicContact CD1-CD2 4.08Å; I62-F71 HydrophobicContact CD1-CE2 3.41Å; I62-F71 VanDerWaalsContact CD1-CE2 3.41Å; I62-F71 HydrophobicContact CD1-CZ 4.02Å; I62-F71 HydrophobicContact CG1-CE2 4.09Å; I68-F71 PolarHBondContact O-N 2.86Å; F71-M75 HydrophobicContact CB-CE 4.28Å; F71-M75 HydrophobicContact CB-CG 4.2Å; F71-M75 HydrophobicContact CB-SD 3.53Å; F71-M75 VanDerWaalsContact CB-SD 3.53Å; F71-M75 HydrophobicContact CD2-CE 4.29Å; F71-M75 HydrophobicContact CG-CE 4.39Å; F71-M75 HydrophobicContact CG-SD 4.18Å; F71-H140 PolarHBondContact O-CE1 3.48Å; F71-H140 PolarHBondContact O-NE2 3.12Å; F71-H140 VanDerWaalsContact O-NE2 3.15Å
72S68Low80.4Confident123 Ų12352.4 Ų52.486%0.8628%0.276SS*.  trans-77.3123.5174.3-57.20000110.1
73G69.4Low80.7Confident26 Ų2652 Ų5227%0.26827%0.273SS..SBendtrans131.5179.9168.300000114.2M75 H140G73-M75 VanDerWaalsContact C-N 3.28Å; G73-M75 PolarHBondContact O-N 3.39Å; G73-H140 PolarHBondContact O-CD2 3.16Å; G73-H140 VanDerWaalsContact O-CD2 3.29Å
74P80.8Confident81.2Confident51 Ų5153.7 Ų53.733%0.33129%0.288SS..  trans-74.680.3-178.131.3-35.8000110.9T76 L77 I78 Y132 A137P74-T76 PolarHBondContact O-N 3.4Å; P74-T76 VanDerWaalsContact O-N 3.11Å; P74-L77 HydrophobicContact CB-CB 4Å; P74-L77 HydrophobicContact CG-CB 4.15Å; P74-L77 HydrophobicContact CG-CD2 4.11Å; P74-L77 WeakPolarHBondContact O-CB 3.04Å; P74-L77 PolarHBondContact O-N 3.39Å; P74-I78 PolarHBondContact O-N 2.87Å; P74-I78 VanDerWaalsContact O-N 3.15Å; P74-Y132 HydrophobicContact CB-CE2 4.24Å; P74-A137 HydrophobicContact CB-CB 3.19Å
75M80.1Confident81.8Confident10 Ų1056.3 Ų56.35%0.04930%0.301CS..Hα-helixtrans-55.6-33.8-174.1-77.4-61.3-66.300113.2F59 I62 I68 F71 G73 L77 I78 E79 Y138F59-M75 HydrophobicContact CE1-CE 4.46Å; I62-M75 HydrophobicContact CG2-CE 4.47Å; I68-M75 HydrophobicContact CG2-CB 4.04Å; I68-M75 HydrophobicContact CG2-CG 3.94Å; F71-M75 HydrophobicContact CB-CE 4.28Å; F71-M75 HydrophobicContact CB-CG 4.2Å; F71-M75 HydrophobicContact CB-SD 3.53Å; F71-M75 VanDerWaalsContact CB-SD 3.53Å; F71-M75 HydrophobicContact CD2-CE 4.29Å; F71-M75 HydrophobicContact CG-CE 4.39Å; F71-M75 HydrophobicContact CG-SD 4.18Å; G73-M75 VanDerWaalsContact C-N 3.28Å; G73-M75 PolarHBondContact O-N 3.39Å; M75-L77 VanDerWaalsContact C-N 3.32Å; M75-L77 PolarHBondContact O-N 3.33Å; M75-I78 PolarHBondContact O-N 3.13Å; M75-I78 HydrophobicContact SD-CD1 4.16Å; M75-E79 WeakPolarHBondContact O-CB 3.44Å; M75-E79 PolarHBondContact O-N 2.88Å; M75-Y138 HydrophobicContact CB-CD2 3.85Å
76T83.1Confident82.4Confident2 Ų254.8 Ų54.81%0.01229%0.292CS..Hα-helixtrans-62.5-38.9175.4-34.40000112.3P74 F80 L131 Y138P74-T76 PolarHBondContact O-N 3.4Å; P74-T76 VanDerWaalsContact O-N 3.11Å; T76-F80 VanDerWaalsContact O-CB 3.31Å; T76-F80 WeakPolarHBondContact O-CB 3.33Å; T76-F80 PolarHBondContact O-N 3.35Å; T76-L131 HydrophobicContact CG2-CB 4.23Å; T76-L131 HydrophobicContact CG2-CD2 3.93Å; T76-L131 HydrophobicContact CG2-CG 4.19Å; T76-Y138 HydrophobicContact CG2-CE2 4Å; T76-Y138 WeakPolarHBondContact OG1-CD2 3.49Å; T76-Y138 WeakPolarHBondContact OG1-CE2 3.5Å; T76-Y138 PolarHBondContact OG1-N 2.89Å
77L85.4Confident83.5Confident44 Ų4452.9 Ų52.923%0.2328%0.282CS..Hα-helixtrans-72.1-41.5-179.9-177.468.8000110.8P74 M75 F80 I81 Y132P74-L77 HydrophobicContact CB-CB 4Å; P74-L77 HydrophobicContact CG-CB 4.15Å; P74-L77 HydrophobicContact CG-CD2 4.11Å; P74-L77 WeakPolarHBondContact O-CB 3.04Å; P74-L77 PolarHBondContact O-N 3.39Å; M75-L77 VanDerWaalsContact C-N 3.32Å; M75-L77 PolarHBondContact O-N 3.33Å; L77-F80 HydrophobicContact CD1-CD1 4.14Å; L77-F80 WeakPolarHBondContact O-CB 3.35Å; L77-F80 PolarHBondContact O-N 3.26Å; L77-I81 HydrophobicContact CG-CD1 4.2Å; L77-I81 VanDerWaalsContact O-CG1 3.31Å; L77-I81 WeakPolarHBondContact O-CG1 3.37Å; L77-I81 PolarHBondContact O-N 3.37Å; L77-Y132 HydrophobicContact CB-CD2 3.96Å; L77-Y132 HydrophobicContact CB-CE2 3.9Å; L77-Y132 HydrophobicContact CB-CG 4.45Å; L77-Y132 HydrophobicContact CD1-CD1 4.03Å; L77-Y132 HydrophobicContact CD1-CE1 3.86Å; L77-Y132 HydrophobicContact CD1-CE2 4.41Å; L77-Y132 HydrophobicContact CD1-CG 4.37Å; L77-Y132 HydrophobicContact CD2-CE2 4.35Å; L77-Y132 HydrophobicContact CG-CE2 4.45Å
78I89.7Confident84.7Confident73 Ų7353.7 Ų53.737%0.37429%0.292SS..Hα-helixtrans-61.8-47.9176.7-62.6169.7000109.5P74 M75 F80 I81 C82P74-I78 PolarHBondContact O-N 2.87Å; P74-I78 VanDerWaalsContact O-N 3.15Å; M75-I78 PolarHBondContact O-N 3.13Å; M75-I78 HydrophobicContact SD-CD1 4.16Å; I78-F80 PolarHBondContact O-N 3.02Å; I78-I81 PolarHBondContact O-N 3.2Å; I78-C82 PolarHBondContact O-N 2.91Å; I78-C82 PolarHBondContact O-SG 3.48Å; I78-C82 VanDerWaalsContact O-SG 3.37Å
79E90.8Very high86.2Confident1 Ų155.4 Ų55.41%0.00530%0.299CS..Hα-helixtrans-60.8-46177.4-169.7178.8-176.500111.4F59 H63 M75 I81 C82 I83 L128F59-E79 HydrophobicContact CB-CG 4.43Å; F59-E79 HydrophobicContact CD1-CB 4.09Å; F59-E79 HydrophobicContact CD1-CG 3.7Å; F59-E79 HydrophobicContact CD2-CG 3.9Å; F59-E79 HydrophobicContact CE1-CB 3.77Å; F59-E79 HydrophobicContact CE1-CG 3.82Å; F59-E79 HydrophobicContact CE2-CB 4.46Å; F59-E79 HydrophobicContact CE2-CG 4Å; F59-E79 HydrophobicContact CG-CG 3.76Å; F59-E79 HydrophobicContact CZ-CB 3.98Å; F59-E79 HydrophobicContact CZ-CG 3.97Å; H63-E79 IonicContact CD2-OE1 3.89Å; H63-E79 IonicContact CD2-OE2 3.86Å; H63-E79 IonicContact CE1-OE2 3.49Å; H63-E79 IonicContact NE2-OE1 2.87Å; H63-E79 PolarHBondContact NE2-OE1 3.2Å; H63-E79 IonicContact NE2-OE2 3.55Å; H63-E79 PolarHBondContact NE2-OE2 2.99Å; M75-E79 WeakPolarHBondContact O-CB 3.44Å; M75-E79 PolarHBondContact O-N 2.88Å; E79-I81 VanDerWaalsContact C-N 3.34Å; E79-I81 PolarHBondContact O-N 2.96Å; E79-C82 PolarHBondContact O-N 3.05Å; E79-I83 HydrophobicContact CG-CG1 4.22Å; E79-I83 WeakPolarHBondContact O-CB 3.4Å; E79-I83 VanDerWaalsContact O-CG1 3.28Å; E79-I83 WeakPolarHBondContact O-CG1 3.48Å; E79-I83 PolarHBondContact O-N 3.25Å; E79-L128 HydrophobicContact CB-CD2 3.59Å; E79-L128 VanDerWaalsContact CD-CD2 3.43Å; E79-L128 HydrophobicContact CG-CD2 3.31Å
80F91.5Very high87.7Confident51 Ų5147.3 Ų47.322%0.22427%0.267CS..Hα-helixtrans-52.2-50173.6160.9-112000112.4T76 L77 I78 C82 I83 A84 A125 L128 F129T76-F80 VanDerWaalsContact O-CB 3.31Å; T76-F80 WeakPolarHBondContact O-CB 3.33Å; T76-F80 PolarHBondContact O-N 3.35Å; L77-F80 HydrophobicContact CD1-CD1 4.14Å; L77-F80 WeakPolarHBondContact O-CB 3.35Å; L77-F80 PolarHBondContact O-N 3.26Å; I78-F80 PolarHBondContact O-N 3.02Å; F80-C82 PolarHBondContact O-N 3.32Å; F80-I83 PolarHBondContact O-N 2.95Å; F80-A84 HydrophobicContact CE2-CB 4.44Å; F80-A84 VanDerWaalsContact O-CB 3.28Å; F80-A84 WeakPolarHBondContact O-CB 3.35Å; F80-A84 PolarHBondContact O-N 2.87Å; F80-A125 HydrophobicContact CD2-CB 3.96Å; F80-A125 WeakPolarHBondContact CD2-O 3.26Å; F80-A125 HydrophobicContact CE2-CB 4.07Å; F80-L128 HydrophobicContact CB-CB 4.01Å; F80-F129 HydrophobicContact CD1-CD2 4.44Å; F80-F129 HydrophobicContact CD2-CB 3.94Å; F80-F129 HydrophobicContact CE1-CD2 4.07Å; F80-F129 HydrophobicContact CE2-CB 3.86Å; F80-F129 HydrophobicContact CE2-CD2 4.47Å; F80-F129 HydrophobicContact CE2-CG 4.46Å; F80-F129 HydrophobicContact CG-CB 4.45Å; F80-F129 HydrophobicContact CZ-CB 4.31Å; F80-F129 HydrophobicContact CZ-CD2 4.08Å; F80-F129 HydrophobicContact CZ-CG 4.45Å
81I93.6Very high89.1Confident84 Ų8441.7 Ų41.743%0.43125%0.245SC..Hα-helixtrans-62.9-44.8-179.2-66.8165000110.3L77 I78 E79 A84 I85L77-I81 HydrophobicContact CG-CD1 4.2Å; L77-I81 VanDerWaalsContact O-CG1 3.31Å; L77-I81 WeakPolarHBondContact O-CG1 3.37Å; L77-I81 PolarHBondContact O-N 3.37Å; I78-I81 PolarHBondContact O-N 3.2Å; E79-I81 VanDerWaalsContact C-N 3.34Å; E79-I81 PolarHBondContact O-N 2.96Å; I81-A84 PolarHBondContact O-N 3.3Å; I81-I85 HydrophobicContact CG2-CD1 3.92Å; I81-I85 VanDerWaalsContact O-CG1 3.29Å; I81-I85 WeakPolarHBondContact O-CG1 3.42Å; I81-I85 PolarHBondContact O-N 3.15Å
82C95Very high90.4Very high41 Ų4141.5 Ų41.528%0.27725%0.247SC..Hα-helixtrans-60.9-47.3177.9-71.10000112.2I55 F59 I78 E79 F80 I85 C86I55-C82 HydrophobicContact CG2-CB 4.47Å; F59-C82 HydrophobicContact CE2-CB 3.75Å; F59-C82 HydrophobicContact CZ-CB 4Å; I78-C82 PolarHBondContact O-N 2.91Å; I78-C82 PolarHBondContact O-SG 3.48Å; I78-C82 VanDerWaalsContact O-SG 3.37Å; E79-C82 PolarHBondContact O-N 3.05Å; F80-C82 PolarHBondContact O-N 3.32Å; C82-I85 PolarHBondContact O-N 3.5Å; C82-C86 PolarHBondContact O-N 2.64Å; C82-C86 PolarHBondContact O-SG 3.48Å
83I95.2Very high91.7Very high0 Ų035.6 Ų35.60%021%0.206CC..Hα-helixtrans-67.1-37.1179.9-64.3-50000111.3I55 F59 E79 F80 I85 C86 S87 Y121 D124 A125I55-I83 HydrophobicContact CG2-CD1 4.29Å; F59-I83 HydrophobicContact CD2-CD1 4.47Å; E79-I83 HydrophobicContact CG-CG1 4.22Å; E79-I83 WeakPolarHBondContact O-CB 3.4Å; E79-I83 VanDerWaalsContact O-CG1 3.28Å; E79-I83 WeakPolarHBondContact O-CG1 3.48Å; E79-I83 PolarHBondContact O-N 3.25Å; F80-I83 PolarHBondContact O-N 2.95Å; I83-I85 PolarHBondContact O-N 3.44Å; I83-C86 WeakPolarHBondContact O-CB 3.34Å; I83-C86 PolarHBondContact O-N 3.44Å; I83-S87 PolarHBondContact O-N 3.31Å; I83-Y121 HydrophobicContact CB-CD1 4.49Å; I83-Y121 HydrophobicContact CD1-CD1 4.11Å; I83-Y121 HydrophobicContact CD1-CE1 3.94Å; I83-Y121 HydrophobicContact CG2-CD1 3.78Å; I83-Y121 HydrophobicContact CG2-CG 4.48Å; I83-Y121 WeakPolarHBondContact CG2-O 3.25Å; I83-D124 HydrophobicContact CG2-CB 4.15Å; I83-D124 WeakPolarHBondContact CG2-OD2 3.47Å; I83-A125 HydrophobicContact CG2-CB 4.03Å
84A95.7Very high92.8Very high40 Ų4036.7 Ų36.733%0.33121%0.205SC..Hα-helixtrans-62.7-41.6173.500000112.3F80 I81 S87 G88 A125F80-A84 HydrophobicContact CE2-CB 4.44Å; F80-A84 VanDerWaalsContact O-CB 3.28Å; F80-A84 WeakPolarHBondContact O-CB 3.35Å; F80-A84 PolarHBondContact O-N 2.87Å; I81-A84 PolarHBondContact O-N 3.3Å; A84-S87 WeakPolarHBondContact O-CB 3.32Å; A84-S87 PolarHBondContact O-N 3.47Å; A84-G88 PolarHBondContact O-N 2.86Å; A84-A125 HydrophobicContact CB-CB 4.36Å
85I97.6Very high93.4Very high91 Ų9138.3 Ų38.347%0.46721%0.21SC..Hα-helixtrans-64.8-42.3174.3-66.6165.7000110.6I81 C82 I83 S87 G88 F89I81-I85 HydrophobicContact CG2-CD1 3.92Å; I81-I85 VanDerWaalsContact O-CG1 3.29Å; I81-I85 WeakPolarHBondContact O-CG1 3.42Å; I81-I85 PolarHBondContact O-N 3.15Å; C82-I85 PolarHBondContact O-N 3.5Å; I83-I85 PolarHBondContact O-N 3.44Å; I85-S87 VanDerWaalsContact C-N 3.31Å; I85-S87 PolarHBondContact O-N 3.12Å; I85-G88 WeakPolarHBondContact O-CA 3.47Å; I85-G88 PolarHBondContact O-N 3.37Å; I85-G88 VanDerWaalsContact O-N 3.12Å; I85-F89 HydrophobicContact CG2-CE1 4.22Å; I85-F89 HydrophobicContact CG2-CE2 4.14Å; I85-F89 HydrophobicContact CG2-CZ 3.99Å; I85-F89 PolarHBondContact O-N 3.5Å
86C97Very high93.9Very high2 Ų239.8 Ų39.81%0.01422%0.22CC..Hα-helixtrans-59-43.1175.3-65.90000111.5T52 C82 I83 G88 F89 H90 Y121T52-C86 HydrophobicContact CG2-CB 3.7Å; C82-C86 PolarHBondContact O-N 2.64Å; C82-C86 PolarHBondContact O-SG 3.48Å; I83-C86 WeakPolarHBondContact O-CB 3.34Å; I83-C86 PolarHBondContact O-N 3.44Å; C86-G88 PolarHBondContact O-N 2.93Å; C86-F89 PolarHBondContact O-N 2.93Å; C86-F89 VanDerWaalsContact O-N 3.17Å; C86-H90 PolarHBondContact O-CD2 3.17Å; C86-H90 PolarHBondContact O-N 3.22Å; C86-Y121 HydrophobicContact CB-CD1 3.48Å; C86-Y121 VanDerWaalsContact CB-CD1 3.48Å; C86-Y121 HydrophobicContact CB-CE1 3.57Å; C86-Y121 HydrophobicContact CB-CG 4.35Å
87S97.6Very high94.2Very high8 Ų839.7 Ų39.76%0.05622%0.219CC..Hα-helixtrans-56.2-49.7172.8-1770000110.7I83 A84 I85 F89 H90 L91 F118I83-S87 PolarHBondContact O-N 3.31Å; A84-S87 WeakPolarHBondContact O-CB 3.32Å; A84-S87 PolarHBondContact O-N 3.47Å; I85-S87 VanDerWaalsContact C-N 3.31Å; I85-S87 PolarHBondContact O-N 3.12Å; S87-F89 VanDerWaalsContact C-N 3.3Å; S87-F89 PolarHBondContact O-N 2.93Å; S87-H90 WeakPolarHBondContact O-CB 3.32Å; S87-H90 PolarHBondContact O-N 3.37Å; S87-H90 VanDerWaalsContact O-N 3.07Å; S87-L91 PolarHBondContact O-N 3.44Å; S87-F118 VanDerWaalsContact O-CD2 3.32Å; S87-F118 WeakPolarHBondContact O-CD2 3.37Å; S87-F118 WeakPolarHBondContact OG-CD2 3.27Å; S87-F118 WeakPolarHBondContact OG-CE2 3.22Å; S87-F118 PolarHBondContact OG-O 3.07Å
88G97.7Very high94.3Very high29 Ų2940.3 Ų40.330%0.29923%0.23SC..Hα-helixtrans-56-40.4175.200000113.7A84 I85 C86 L91 I92A84-G88 PolarHBondContact O-N 2.86Å; I85-G88 WeakPolarHBondContact O-CA 3.47Å; I85-G88 PolarHBondContact O-N 3.37Å; I85-G88 VanDerWaalsContact O-N 3.12Å; C86-G88 PolarHBondContact O-N 2.93Å; G88-L91 WeakPolarHBondContact O-CB 3.49Å; G88-L91 PolarHBondContact O-N 3.47Å; G88-I92 WeakPolarHBondContact O-CG1 3.35Å; G88-I92 PolarHBondContact O-N 3.36Å
89F98Very high94.1Very high55 Ų5542 Ų4224%0.24125%0.247CC..Hα-helixtrans-65.7-40174.7-72.8-8.3000113W44 F47 V48 L51 I85 C86 S87 L91 I92 A93W44-F89 HydrophobicContact CH2-CD1 4.15Å; W44-F89 HydrophobicContact CH2-CE1 4.29Å; W44-F89 HydrophobicContact CZ2-CD1 4.43Å; F47-F89 HydrophobicContact CE1-CE2 4.37Å; V48-F89 HydrophobicContact CG1-CB 3.88Å; V48-F89 HydrophobicContact CG2-CB 4.02Å; L51-F89 HydrophobicContact CD2-CD2 4.13Å; L51-F89 HydrophobicContact CD2-CE2 3.77Å; I85-F89 HydrophobicContact CG2-CE1 4.22Å; I85-F89 HydrophobicContact CG2-CE2 4.14Å; I85-F89 HydrophobicContact CG2-CZ 3.99Å; I85-F89 PolarHBondContact O-N 3.5Å; C86-F89 PolarHBondContact O-N 2.93Å; C86-F89 VanDerWaalsContact O-N 3.17Å; S87-F89 VanDerWaalsContact C-N 3.3Å; S87-F89 PolarHBondContact O-N 2.93Å; F89-L91 VanDerWaalsContact C-N 3.31Å; F89-L91 PolarHBondContact O-N 3.41Å; F89-I92 PolarHBondContact O-N 3.1Å; F89-A93 WeakPolarHBondContact O-CB 3.34Å; F89-A93 PolarHBondContact O-N 3.06Å
90H98Very high93.5Very high0 Ų043.4 Ų43.40%026%0.256CS..Hα-helixtrans-63.1-37.3173.8-81-71.9000112.2N23 T52 C86 S87 A93 M94 F114 N117 F118 Y121N23-H90 PolarHBondContact OD1-CE1 3.26Å; N23-H90 PolarHBondContact OD1-NE2 2.96Å; T52-H90 PolarHBondContact OG1-NE2 3.17Å; T52-H90 VanDerWaalsContact OG1-NE2 3.1Å; C86-H90 PolarHBondContact O-CD2 3.17Å; C86-H90 PolarHBondContact O-N 3.22Å; S87-H90 WeakPolarHBondContact O-CB 3.32Å; S87-H90 PolarHBondContact O-N 3.37Å; S87-H90 VanDerWaalsContact O-N 3.07Å; H90-A93 PolarHBondContact O-N 3.08Å; H90-M94 WeakPolarHBondContact O-CB 3.43Å; H90-M94 PolarHBondContact O-N 2.97Å; H90-F114 AromaticContact ND1-CD1 3.39Å; H90-F114 WeakPolarHBondContact ND1-CD1 3.15Å; H90-F114 AromaticContact ND1-CE1 3.82Å; H90-N117 HydrophobicContact CB-CB 4.35Å; H90-N117 WeakPolarHBondContact ND1-CB 3.44Å; H90-F118 HydrophobicContact CB-CB 4.01Å; H90-Y121 AromaticContact CD2-CD2 3.73Å; H90-Y121 AromaticContact CD2-CE2 3.77Å; H90-Y121 AromaticContact NE2-CD2 3.94Å; H90-Y121 AromaticContact NE2-CE2 3.48Å; H90-Y121 WeakPolarHBondContact NE2-CE2 3.26Å
91L97.9Very high92.3Very high60 Ų6043.7 Ų43.731%0.31426%0.262SS..Hα-helixtrans-62-47.4173.9-176.365.8000111.6S87 G88 F89 M94 I95 F118S87-L91 PolarHBondContact O-N 3.44Å; G88-L91 WeakPolarHBondContact O-CB 3.49Å; G88-L91 PolarHBondContact O-N 3.47Å; F89-L91 VanDerWaalsContact C-N 3.31Å; F89-L91 PolarHBondContact O-N 3.41Å; L91-M94 HydrophobicContact CD1-CE 3.71Å; L91-M94 WeakPolarHBondContact O-CB 3.43Å; L91-M94 PolarHBondContact O-N 3.49Å; L91-I95 HydrophobicContact CG-CD1 4.4Å; L91-I95 WeakPolarHBondContact O-CG1 3.43Å; L91-I95 PolarHBondContact O-N 2.92Å; L91-I95 VanDerWaalsContact O-N 3.11Å; L91-F118 HydrophobicContact CB-CD2 3.66Å; L91-F118 HydrophobicContact CB-CE2 3.92Å; L91-F118 HydrophobicContact CB-CG 4.1Å; L91-F118 HydrophobicContact CD1-CD1 4.02Å; L91-F118 HydrophobicContact CD1-CD2 4.31Å; L91-F118 HydrophobicContact CD1-CE1 3.97Å; L91-F118 HydrophobicContact CD1-CE2 4.26Å; L91-F118 HydrophobicContact CD1-CG 4.18Å; L91-F118 HydrophobicContact CD1-CZ 4.09Å; L91-F118 HydrophobicContact CD2-CE2 4.13Å; L91-F118 HydrophobicContact CD2-CZ 4.25Å; L91-F118 HydrophobicContact CG-CD2 4.43Å; L91-F118 HydrophobicContact CG-CE2 4.33Å
92I96.6Very high90.9Very high80 Ų8043.8 Ų43.841%0.4127%0.27SS..Hα-helixtrans-63.9-43.8178.2-63165.7000110.2W44 G88 F89 M94 I95 V96W44-I92 HydrophobicContact CZ2-CB 4.12Å; W44-I92 HydrophobicContact CZ2-CG2 3.77Å; G88-I92 WeakPolarHBondContact O-CG1 3.35Å; G88-I92 PolarHBondContact O-N 3.36Å; F89-I92 PolarHBondContact O-N 3.1Å; I92-M94 VanDerWaalsContact C-N 3.34Å; I92-M94 PolarHBondContact O-N 3.45Å; I92-I95 PolarHBondContact O-N 2.87Å; I92-V96 HydrophobicContact CG2-CG2 4.37Å; I92-V96 WeakPolarHBondContact O-CG2 3.49Å; I92-V96 PolarHBondContact O-N 3.21Å
93A94.9Very high89.3Confident0 Ų044.9 Ų44.90%029%0.288CS..Hα-helixtrans-62.1-38.7177.800000112.9L45 V48 F89 H90 V96 C97 F114L45-A93 HydrophobicContact CD2-CB 3.82Å; L45-A93 WeakPolarHBondContact CD2-O 3.29Å; V48-A93 HydrophobicContact CB-CB 4.34Å; V48-A93 HydrophobicContact CG1-CB 4.15Å; V48-A93 HydrophobicContact CG2-CB 4.33Å; F89-A93 WeakPolarHBondContact O-CB 3.34Å; F89-A93 PolarHBondContact O-N 3.06Å; H90-A93 PolarHBondContact O-N 3.08Å; A93-V96 PolarHBondContact O-N 2.99Å; A93-C97 WeakPolarHBondContact O-CB 3.35Å; A93-C97 PolarHBondContact O-N 3.42Å; A93-C97 PolarHBondContact O-SG 2.95Å; A93-C97 VanDerWaalsContact O-SG 3.33Å; A93-F114 HydrophobicContact CB-CD1 3.42Å; A93-F114 VanDerWaalsContact CB-CD1 3.42Å; A93-F114 HydrophobicContact CB-CD2 4.25Å; A93-F114 HydrophobicContact CB-CE1 3.45Å; A93-F114 VanDerWaalsContact CB-CE1 3.45Å; A93-F114 HydrophobicContact CB-CE2 4.26Å; A93-F114 HydrophobicContact CB-CG 3.88Å; A93-F114 HydrophobicContact CB-CZ 3.9Å
94M94Very high88.2Confident48 Ų4850.5 Ų50.524%0.23631%0.31CS..Hα-helixtrans-58.3-48.7171.6177.7-162.875.500111H90 L91 I92 C97 A98 A111 F114 A115H90-M94 WeakPolarHBondContact O-CB 3.43Å; H90-M94 PolarHBondContact O-N 2.97Å; L91-M94 HydrophobicContact CD1-CE 3.71Å; L91-M94 WeakPolarHBondContact O-CB 3.43Å; L91-M94 PolarHBondContact O-N 3.49Å; I92-M94 VanDerWaalsContact C-N 3.34Å; I92-M94 PolarHBondContact O-N 3.45Å; M94-C97 PolarHBondContact O-N 2.87Å; M94-A98 WeakPolarHBondContact O-CB 3.4Å; M94-A98 PolarHBondContact O-N 3.25Å; M94-A111 WeakPolarHBondContact CG-O 3.37Å; M94-F114 HydrophobicContact CB-CB 3.78Å; M94-A115 HydrophobicContact CG-CB 3.98Å; M94-A115 HydrophobicContact SD-CB 3.37Å; M94-A115 WeakPolarHBondContact SD-CB 3.48Å
95I93Very high87.5Confident86 Ų8651.2 Ų51.244%0.44132%0.322SS..Hα-helixtrans-61.6-46.6179.4-65165.3000110.3L91 I92 C97 A98 C99L91-I95 HydrophobicContact CG-CD1 4.4Å; L91-I95 WeakPolarHBondContact O-CG1 3.43Å; L91-I95 PolarHBondContact O-N 2.92Å; L91-I95 VanDerWaalsContact O-N 3.11Å; I92-I95 PolarHBondContact O-N 2.87Å; I95-C97 VanDerWaalsContact C-N 3.32Å; I95-C97 PolarHBondContact O-N 3.34Å; I95-A98 PolarHBondContact O-N 2.94Å; I95-C99 WeakPolarHBondContact O-CB 3.37Å; I95-C99 PolarHBondContact O-N 3.29Å; I95-C99 PolarHBondContact O-SG 3.32Å; I95-C99 VanDerWaalsContact O-SG 3.34Å
96V90.8Very high86.8Confident41 Ų4149.1 Ų49.125%0.24831%0.313CS..Hα-helixtrans-59.2-44.1177.6171.40000111P41 L45 I92 A93 C99 T100P41-V96 HydrophobicContact CB-CG1 3.7Å; L45-V96 HydrophobicContact CD2-CB 4.37Å; L45-V96 HydrophobicContact CD2-CG1 4.22Å; I92-V96 HydrophobicContact CG2-CG2 4.37Å; I92-V96 WeakPolarHBondContact O-CG2 3.49Å; I92-V96 PolarHBondContact O-N 3.21Å; A93-V96 PolarHBondContact O-N 2.99Å; V96-C99 PolarHBondContact O-N 3.12Å; V96-T100 WeakPolarHBondContact O-CB 3.34Å; V96-T100 PolarHBondContact O-N 3.49Å; V96-T100 VanDerWaalsContact O-N 3.07Å; V96-T100 PolarHBondContact O-OG1 3.02Å
97C89Confident86.2Confident0 Ų049.2 Ų49.20%031%0.314CS..Hα-helixtrans-61-48.1175.7-74.70000111.5L45 A93 M94 I95 C99 T100 V101 A111 F114L45-C97 WeakPolarHBondContact CD1-SG 3.47Å; L45-C97 WeakPolarHBondContact CD2-SG 3.12Å; A93-C97 WeakPolarHBondContact O-CB 3.35Å; A93-C97 PolarHBondContact O-N 3.42Å; A93-C97 PolarHBondContact O-SG 2.95Å; A93-C97 VanDerWaalsContact O-SG 3.33Å; M94-C97 PolarHBondContact O-N 2.87Å; I95-C97 VanDerWaalsContact C-N 3.32Å; I95-C97 PolarHBondContact O-N 3.34Å; C97-C99 PolarHBondContact O-N 3.12Å; C97-T100 PolarHBondContact O-N 3.17Å; C97-T100 VanDerWaalsContact O-N 3.11Å; C97-V101 WeakPolarHBondContact O-CG2 3.32Å; C97-V101 PolarHBondContact O-N 3.47Å; C97-A111 HydrophobicContact CB-CB 3.66Å; C97-F114 VanDerWaalsContact SG-CD2 3.55Å
98A87.4Confident85.6Confident56 Ų5653 Ų5346%0.46333%0.333SS..Hα-helixtrans-61.2-42-179.100000112.1M94 I95 T100 V101M94-A98 WeakPolarHBondContact O-CB 3.4Å; M94-A98 PolarHBondContact O-N 3.25Å; I95-A98 PolarHBondContact O-N 2.94Å; A98-T100 VanDerWaalsContact C-N 3.28Å; A98-T100 PolarHBondContact O-N 2.93Å; A98-V101 WeakPolarHBondContact O-CB 3.32Å; A98-V101 PolarHBondContact O-N 2.96Å
99C85.1Confident85.3Confident108 Ų10853.1 Ų53.173%0.7333%0.331SS*.Hα-helixtrans-70.9-20.9176.4-66.40000113.6I95 V96 C97 V101I95-C99 WeakPolarHBondContact O-CB 3.37Å; I95-C99 PolarHBondContact O-N 3.29Å; I95-C99 PolarHBondContact O-SG 3.32Å; I95-C99 VanDerWaalsContact O-SG 3.34Å; V96-C99 PolarHBondContact O-N 3.12Å; C97-C99 PolarHBondContact O-N 3.12Å; C99-V101 VanDerWaalsContact C-N 3.34Å
100T78.8Confident85Confident31 Ų3150.5 Ų50.519%0.1932%0.32CS..Hα-helixtrans-83.8-10.3177.6-53.90000112.2Y36 P41 V96 C97 A98 S102Y36-T100 HydrophobicContact CE1-CG2 4.36Å; P41-T100 HydrophobicContact CG-CG2 3.77Å; V96-T100 WeakPolarHBondContact O-CB 3.34Å; V96-T100 PolarHBondContact O-N 3.49Å; V96-T100 VanDerWaalsContact O-N 3.07Å; V96-T100 PolarHBondContact O-OG1 3.02Å; C97-T100 PolarHBondContact O-N 3.17Å; C97-T100 VanDerWaalsContact O-N 3.11Å; A98-T100 VanDerWaalsContact C-N 3.28Å; A98-T100 PolarHBondContact O-N 2.93Å; T100-S102 PolarHBondContact O-N 3.29Å; T100-S102 PolarHBondContact O-OG 3.29Å
101V64.9Low84.7Confident57 Ų5751.1 Ų51.135%0.34533%0.325SS..  trans-63.5105.5-174.8172.90000111C97 A98 C99 A107 I108C97-V101 WeakPolarHBondContact O-CG2 3.32Å; C97-V101 PolarHBondContact O-N 3.47Å; A98-V101 WeakPolarHBondContact O-CB 3.32Å; A98-V101 PolarHBondContact O-N 2.96Å; C99-V101 VanDerWaalsContact C-N 3.34Å; V101-A107 HydrophobicContact CG2-CB 4.1Å; V101-I108 HydrophobicContact CG1-CD1 4.34Å; V101-I108 HydrophobicContact CG1-CG1 4Å; V101-I108 HydrophobicContact CG2-CG1 3.99Å
102S64.7Low84.6Confident86 Ų8651.9 Ų51.960%0.60133%0.332SS*.SBendtrans-102.732166.234.50000111.3T100T100-S102 PolarHBondContact O-N 3.29Å; T100-S102 PolarHBondContact O-OG 3.29Å
103G62.2Low84.6Confident65 Ų6551 Ų5167%0.6733%0.325SS*.SBendtrans93.213.7174.300000116.6
104Y71.5Confident84.7Confident118 Ų11851 Ų5146%0.46333%0.325SS..  trans-95.3131.9-179.6-62.4-80000113N35 T106 A107 I108N35-Y104 WeakPolarHBondContact ND2-CD2 3.4Å; N35-Y104 WeakPolarHBondContact ND2-CE2 3.32Å; Y104-T106 VanDerWaalsContact C-N 3.29Å; Y104-T106 PolarHBondContact O-N 3.01Å; Y104-A107 PolarHBondContact O-N 2.87Å; Y104-I108 PolarHBondContact O-N 3.44Å
105G80.2Confident84.8Confident55 Ų5550 Ų5057%0.56732%0.324SS*.Hα-helixtrans-61.5-31.4-179.200000114.4I108 A109G105-I108 PolarHBondContact O-N 3.05Å; G105-A109 WeakPolarHBondContact O-CB 3.3Å; G105-A109 PolarHBondContact O-N 3.26Å
106T83.6Confident85.1Confident46 Ų4649.6 Ų49.628%0.28232%0.322SS..Hα-helixtrans-65.2-39.9177.349.30000112.2S33 Y104 A109 A110S33-T106 PolarHBondContact OG-OG1 3.26Å; Y104-T106 VanDerWaalsContact C-N 3.29Å; Y104-T106 PolarHBondContact O-N 3.01Å; T106-A109 PolarHBondContact O-N 3.39Å; T106-A110 WeakPolarHBondContact O-CB 3.36Å; T106-A110 PolarHBondContact O-N 2.93Å
107A83.7Confident85.4Confident5 Ų547.6 Ų47.64%0.04131%0.31CS..Hα-helixtrans-71.2-37.6-179.900000112.4Y36 V101 Y104 A110 A111Y36-A107 VanDerWaalsContact OH-CA 3.23Å; Y36-A107 WeakPolarHBondContact OH-CA 3.47Å; V101-A107 HydrophobicContact CG2-CB 4.1Å; Y104-A107 PolarHBondContact O-N 2.87Å; A107-A110 PolarHBondContact O-N 3.21Å; A107-A111 WeakPolarHBondContact O-CB 3.29Å; A107-A111 PolarHBondContact O-N 3.44Å
108I86.2Confident85.8Confident86 Ų8650.6 Ų50.644%0.44132%0.323SS..Hα-helixtrans-63.9-47.1173.3-60.7167.2000109.8V101 Y104 G105 A110 A111 V112V101-I108 HydrophobicContact CG1-CD1 4.34Å; V101-I108 HydrophobicContact CG1-CG1 4Å; V101-I108 HydrophobicContact CG2-CG1 3.99Å; Y104-I108 PolarHBondContact O-N 3.44Å; G105-I108 PolarHBondContact O-N 3.05Å; I108-A110 PolarHBondContact O-N 2.88Å; I108-A111 PolarHBondContact O-N 2.9Å; I108-V112 WeakPolarHBondContact O-CG2 3.45Å; I108-V112 PolarHBondContact O-N 3.48Å
109A90.8Very high86.3Confident33 Ų3353.2 Ų53.227%0.27333%0.329SS..Hα-helixtrans-58.7-48176.700000111.4L29 G105 T106 A111 V112 F113L29-A109 HydrophobicContact CD1-CB 4.37Å; L29-A109 HydrophobicContact CD2-CB 4.39Å; G105-A109 WeakPolarHBondContact O-CB 3.3Å; G105-A109 PolarHBondContact O-N 3.26Å; T106-A109 PolarHBondContact O-N 3.39Å; A109-A111 VanDerWaalsContact C-N 3.35Å; A109-A111 PolarHBondContact O-N 3.34Å; A109-V112 PolarHBondContact O-N 2.88Å; A109-V112 VanDerWaalsContact O-N 3.17Å; A109-F113 VanDerWaalsContact O-CD2 3.23Å; A109-F113 WeakPolarHBondContact O-CD2 3.06Å; A109-F113 PolarHBondContact O-N 3.02Å
110A91.7Very high86.9Confident0 Ų049.6 Ų49.60%030%0.302CS..Hα-helixtrans-58.1-45.5177.200000111.8L29 Y36 T106 A107 I108 V112 F113 F114L29-A110 HydrophobicContact CB-CB 4.37Å; Y36-A110 WeakPolarHBondContact OH-CB 3.43Å; T106-A110 WeakPolarHBondContact O-CB 3.36Å; T106-A110 PolarHBondContact O-N 2.93Å; A107-A110 PolarHBondContact O-N 3.21Å; I108-A110 PolarHBondContact O-N 2.88Å; A110-V112 VanDerWaalsContact C-N 3.32Å; A110-V112 PolarHBondContact O-N 3.36Å; A110-F113 PolarHBondContact O-N 2.94Å; A110-F114 HydrophobicContact CB-CD2 4.48Å; A110-F114 WeakPolarHBondContact O-CB 3.41Å; A110-F114 WeakPolarHBondContact O-CD2 3.49Å; A110-F114 PolarHBondContact O-N 2.92Å
111A92.4Very high87.8Confident12 Ų1248.1 Ų48.110%0.09929%0.293CS..Hα-helixtrans-57.2-45.1176.200000111.9M94 C97 A107 I108 A109 F114 A115M94-A111 WeakPolarHBondContact CG-O 3.37Å; C97-A111 HydrophobicContact CB-CB 3.66Å; A107-A111 WeakPolarHBondContact O-CB 3.29Å; A107-A111 PolarHBondContact O-N 3.44Å; I108-A111 PolarHBondContact O-N 2.9Å; A109-A111 VanDerWaalsContact C-N 3.35Å; A109-A111 PolarHBondContact O-N 3.34Å; A111-F114 PolarHBondContact O-N 3.23Å; A111-A115 PolarHBondContact O-N 3.03Å
112V94.9Very high89.2Confident77 Ų7746.8 Ų46.847%0.46729%0.291SS..Hα-helixtrans-62.9-45.4177.3173.40000111.4I108 A109 A110 F114 A115 I116I108-V112 WeakPolarHBondContact O-CG2 3.45Å; I108-V112 PolarHBondContact O-N 3.48Å; A109-V112 PolarHBondContact O-N 2.88Å; A109-V112 VanDerWaalsContact O-N 3.17Å; A110-V112 VanDerWaalsContact C-N 3.32Å; A110-V112 PolarHBondContact O-N 3.36Å; V112-F114 VanDerWaalsContact C-N 3.35Å; V112-F114 PolarHBondContact O-N 2.91Å; V112-A115 WeakPolarHBondContact O-CB 3.23Å; V112-A115 PolarHBondContact O-N 3.47Å; V112-A115 VanDerWaalsContact O-N 3.17Å; V112-I116 HydrophobicContact CG1-CD1 3.97Å; V112-I116 WeakPolarHBondContact O-CG1 3.33Å; V112-I116 PolarHBondContact O-N 3.47Å
113F96.5Very high90.8Very high61 Ų6145.9 Ų45.927%0.26828%0.282SS..Hα-helixtrans-66.9-34.1177.8-81.9-75000112.7L22 I25 L26 L29 A109 A110 A115 I116 N117L22-F113 HydrophobicContact CD2-CD1 4.07Å; L22-F113 HydrophobicContact CD2-CE1 4.11Å; I25-F113 HydrophobicContact CG2-CD1 4.36Å; I25-F113 HydrophobicContact CG2-CD2 4.42Å; I25-F113 HydrophobicContact CG2-CE1 4.27Å; I25-F113 HydrophobicContact CG2-CE2 4.35Å; I25-F113 HydrophobicContact CG2-CG 4.44Å; I25-F113 HydrophobicContact CG2-CZ 4.27Å; L26-F113 HydrophobicContact CD2-CB 3.53Å; L26-F113 HydrophobicContact CG-CB 4.09Å; L29-F113 HydrophobicContact CD1-CD2 3.57Å; L29-F113 HydrophobicContact CD1-CE2 4.14Å; L29-F113 HydrophobicContact CD1-CG 4.28Å; A109-F113 VanDerWaalsContact O-CD2 3.23Å; A109-F113 WeakPolarHBondContact O-CD2 3.06Å; A109-F113 PolarHBondContact O-N 3.02Å; A110-F113 PolarHBondContact O-N 2.94Å; F113-A115 VanDerWaalsContact C-N 3.34Å; F113-I116 HydrophobicContact CD1-CD1 4.48Å; F113-I116 PolarHBondContact O-N 3.38Å; F113-N117 PolarHBondContact O-N 2.98Å; F113-N117 PolarHBondContact O-ND2 3.42Å
114F97Very high92.3Very high0 Ų042.8 Ų42.80%025%0.25CS..Hα-helixtrans-64.8-39.6171-83.8-66.5000111.3L26 V30 L45 V48 H90 A93 M94 C97 A110 A111 V112 N117 F118L26-F114 HydrophobicContact CB-CZ 4.4Å; L26-F114 HydrophobicContact CD1-CD1 3.68Å; L26-F114 HydrophobicContact CD1-CE1 3.62Å; L26-F114 HydrophobicContact CD1-CG 4.13Å; L26-F114 HydrophobicContact CD1-CZ 4.06Å; L26-F114 HydrophobicContact CD2-CD1 4.2Å; L26-F114 HydrophobicContact CD2-CD2 3.59Å; L26-F114 HydrophobicContact CD2-CE1 4.22Å; L26-F114 HydrophobicContact CD2-CE2 3.62Å; L26-F114 HydrophobicContact CD2-CG 3.86Å; L26-F114 HydrophobicContact CD2-CZ 3.93Å; L26-F114 HydrophobicContact CG-CE1 4.41Å; L26-F114 HydrophobicContact CG-CZ 4.37Å; V30-F114 HydrophobicContact CG2-CE2 4.43Å; L45-F114 HydrophobicContact CB-CE2 4.28Å; L45-F114 HydrophobicContact CB-CZ 4.13Å; L45-F114 HydrophobicContact CD2-CD2 4.49Å; L45-F114 HydrophobicContact CD2-CE2 3.81Å; L45-F114 HydrophobicContact CD2-CZ 4.06Å; L45-F114 HydrophobicContact CG-CE2 4.43Å; V48-F114 HydrophobicContact CG1-CE1 4.13Å; H90-F114 AromaticContact ND1-CD1 3.39Å; H90-F114 WeakPolarHBondContact ND1-CD1 3.15Å; H90-F114 AromaticContact ND1-CE1 3.82Å; A93-F114 HydrophobicContact CB-CD1 3.42Å; A93-F114 VanDerWaalsContact CB-CD1 3.42Å; A93-F114 HydrophobicContact CB-CD2 4.25Å; A93-F114 HydrophobicContact CB-CE1 3.45Å; A93-F114 VanDerWaalsContact CB-CE1 3.45Å; A93-F114 HydrophobicContact CB-CE2 4.26Å; A93-F114 HydrophobicContact CB-CG 3.88Å; A93-F114 HydrophobicContact CB-CZ 3.9Å; M94-F114 HydrophobicContact CB-CB 3.78Å; C97-F114 VanDerWaalsContact SG-CD2 3.55Å; A110-F114 HydrophobicContact CB-CD2 4.48Å; A110-F114 WeakPolarHBondContact O-CB 3.41Å; A110-F114 WeakPolarHBondContact O-CD2 3.49Å; A110-F114 PolarHBondContact O-N 2.92Å; A111-F114 PolarHBondContact O-N 3.23Å; V112-F114 VanDerWaalsContact C-N 3.35Å; V112-F114 PolarHBondContact O-N 2.91Å; F114-N117 PolarHBondContact O-N 2.93Å; F114-F118 PolarHBondContact O-N 3.17Å
115A97.5Very high93.4Very high27 Ų2737.5 Ų37.522%0.22323%0.231CC..Hα-helixtrans-63.1-44.1175.100000112.2M94 A111 V112 F113 N117 F118 L119M94-A115 HydrophobicContact CG-CB 3.98Å; M94-A115 HydrophobicContact SD-CB 3.37Å; M94-A115 WeakPolarHBondContact SD-CB 3.48Å; A111-A115 PolarHBondContact O-N 3.03Å; V112-A115 WeakPolarHBondContact O-CB 3.23Å; V112-A115 PolarHBondContact O-N 3.47Å; V112-A115 VanDerWaalsContact O-N 3.17Å; F113-A115 VanDerWaalsContact C-N 3.34Å; A115-N117 VanDerWaalsContact C-N 3.34Å; A115-N117 PolarHBondContact O-N 3.34Å; A115-F118 WeakPolarHBondContact O-CB 3.39Å; A115-F118 PolarHBondContact O-N 2.89Å; A115-L119 PolarHBondContact O-N 2.86Å; A115-L119 VanDerWaalsContact O-N 3.15Å
116I98.1Very high93.9Very high77 Ų7741.3 Ų41.340%0.39523%0.232SC..Hα-helixtrans-61.4-44.8176.4-67.1166.2000110.2L22 V112 F113 L119 L120L22-I116 HydrophobicContact CD1-CG2 3.95Å; V112-I116 HydrophobicContact CG1-CD1 3.97Å; V112-I116 WeakPolarHBondContact O-CG1 3.33Å; V112-I116 PolarHBondContact O-N 3.47Å; F113-I116 HydrophobicContact CD1-CD1 4.48Å; F113-I116 PolarHBondContact O-N 3.38Å; I116-L119 PolarHBondContact O-N 3.4Å; I116-L120 WeakPolarHBondContact O-CB 3.4Å; I116-L120 PolarHBondContact O-N 3.27Å
117N97.4Very high94.3Very high0 Ų043.5 Ų43.50%024%0.238CC..Hα-helixtrans-64.6-40.1176.2-82.8-74000112.5L22 L26 H90 F113 F114 A115 L119 L120 Y121L22-N117 WeakPolarHBondContact CB-ND2 3.37Å; L22-N117 WeakPolarHBondContact CB-OD1 3.29Å; L26-N117 WeakPolarHBondContact CD1-ND2 3.44Å; H90-N117 HydrophobicContact CB-CB 4.35Å; H90-N117 WeakPolarHBondContact ND1-CB 3.44Å; F113-N117 PolarHBondContact O-N 2.98Å; F113-N117 PolarHBondContact O-ND2 3.42Å; F114-N117 PolarHBondContact O-N 2.93Å; A115-N117 VanDerWaalsContact C-N 3.34Å; A115-N117 PolarHBondContact O-N 3.34Å; N117-L119 VanDerWaalsContact C-N 3.26Å; N117-L119 PolarHBondContact O-N 2.83Å; N117-L120 PolarHBondContact O-N 3.31Å; N117-L120 VanDerWaalsContact O-N 3.13Å; N117-Y121 HydrophobicContact CB-CD2 4.33Å; N117-Y121 WeakPolarHBondContact O-CB 3.46Å; N117-Y121 VanDerWaalsContact O-CD2 3.32Å; N117-Y121 WeakPolarHBondContact O-CD2 3.42Å; N117-Y121 PolarHBondContact O-N 3.36Å
118F98Very high94.5Very high62 Ų6243.4 Ų43.427%0.27224%0.236SC..Hα-helixtrans-52.9-47.9174.6162.9-114.4000111.2S87 H90 L91 F114 A115 G122S87-F118 VanDerWaalsContact O-CD2 3.32Å; S87-F118 WeakPolarHBondContact O-CD2 3.37Å; S87-F118 WeakPolarHBondContact OG-CD2 3.27Å; S87-F118 WeakPolarHBondContact OG-CE2 3.22Å; S87-F118 PolarHBondContact OG-O 3.07Å; H90-F118 HydrophobicContact CB-CB 4.01Å; L91-F118 HydrophobicContact CB-CD2 3.66Å; L91-F118 HydrophobicContact CB-CE2 3.92Å; L91-F118 HydrophobicContact CB-CG 4.1Å; L91-F118 HydrophobicContact CD1-CD1 4.02Å; L91-F118 HydrophobicContact CD1-CD2 4.31Å; L91-F118 HydrophobicContact CD1-CE1 3.97Å; L91-F118 HydrophobicContact CD1-CE2 4.26Å; L91-F118 HydrophobicContact CD1-CG 4.18Å; L91-F118 HydrophobicContact CD1-CZ 4.09Å; L91-F118 HydrophobicContact CD2-CE2 4.13Å; L91-F118 HydrophobicContact CD2-CZ 4.25Å; L91-F118 HydrophobicContact CG-CD2 4.43Å; L91-F118 HydrophobicContact CG-CE2 4.33Å; F114-F118 PolarHBondContact O-N 3.17Å; A115-F118 WeakPolarHBondContact O-CB 3.39Å; A115-F118 PolarHBondContact O-N 2.89Å; F118-G122 PolarHBondContact O-N 3.11Å
119L97.9Very high94.6Very high112 Ų11243.5 Ų43.559%0.58623%0.234SC*.Hα-helixtrans-66.6-42.6176.4-64.4177.9000112.1A115 I116 N117 G122 V123A115-L119 PolarHBondContact O-N 2.86Å; A115-L119 VanDerWaalsContact O-N 3.15Å; I116-L119 PolarHBondContact O-N 3.4Å; N117-L119 VanDerWaalsContact C-N 3.26Å; N117-L119 PolarHBondContact O-N 2.83Å; L119-G122 PolarHBondContact O-N 3.31Å; L119-V123 WeakPolarHBondContact O-CG2 3.37Å; L119-V123 PolarHBondContact O-N 3.26Å
120L97.2Very high94.5Very high31 Ų3143.7 Ų43.716%0.16224%0.235CC..Hα-helixtrans-61.6-51.6-178.9-169.970.9000111.7F15 V18 E19 L22 I116 N117 G122 V123 D124F15-L120 HydrophobicContact CD1-CD1 3.62Å; F15-L120 HydrophobicContact CD1-CG 4.07Å; F15-L120 HydrophobicContact CE1-CD1 3.64Å; F15-L120 HydrophobicContact CE1-CG 4.46Å; V18-L120 HydrophobicContact CB-CD2 4.12Å; V18-L120 HydrophobicContact CG1-CD1 4.49Å; V18-L120 HydrophobicContact CG1-CD2 3.61Å; E19-L120 HydrophobicContact CB-CD2 4.42Å; E19-L120 HydrophobicContact CG-CD2 3.69Å; E19-L120 HydrophobicContact CG-CG 4.17Å; L22-L120 HydrophobicContact CD1-CD2 3.8Å; I116-L120 WeakPolarHBondContact O-CB 3.4Å; I116-L120 PolarHBondContact O-N 3.27Å; N117-L120 PolarHBondContact O-N 3.31Å; N117-L120 VanDerWaalsContact O-N 3.13Å; L120-G122 VanDerWaalsContact C-N 3.27Å; L120-G122 PolarHBondContact O-N 3.47Å; L120-V123 PolarHBondContact O-N 3.44Å; L120-D124 WeakPolarHBondContact O-CB 3.23Å; L120-D124 PolarHBondContact O-N 3.38Å
121Y97Very high94.1Very high0 Ų046.3 Ų46.30%025%0.249CC..Hα-helixtrans-63.3-33.8174.4-83.1-97.4000111.6E19 N23 T52 S56 I83 C86 H90 N117 A125E19-Y121 HydrophobicContact CB-CE2 3.78Å; E19-Y121 HydrophobicContact CG-CD2 3.87Å; E19-Y121 HydrophobicContact CG-CE1 4.28Å; E19-Y121 HydrophobicContact CG-CE2 3.5Å; E19-Y121 HydrophobicContact CG-CG 4.42Å; N23-Y121 PolarHBondContact ND2-OH 3.12Å; T52-Y121 WeakPolarHBondContact CB-OH 3.43Å; T52-Y121 PolarHBondContact O-OH 3.07Å; S56-Y121 PolarHBondContact OG-OH 3.39Å; I83-Y121 HydrophobicContact CB-CD1 4.49Å; I83-Y121 HydrophobicContact CD1-CD1 4.11Å; I83-Y121 HydrophobicContact CD1-CE1 3.94Å; I83-Y121 HydrophobicContact CG2-CD1 3.78Å; I83-Y121 HydrophobicContact CG2-CG 4.48Å; I83-Y121 WeakPolarHBondContact CG2-O 3.25Å; C86-Y121 HydrophobicContact CB-CD1 3.48Å; C86-Y121 VanDerWaalsContact CB-CD1 3.48Å; C86-Y121 HydrophobicContact CB-CE1 3.57Å; C86-Y121 HydrophobicContact CB-CG 4.35Å; H90-Y121 AromaticContact CD2-CD2 3.73Å; H90-Y121 AromaticContact CD2-CE2 3.77Å; H90-Y121 AromaticContact NE2-CD2 3.94Å; H90-Y121 AromaticContact NE2-CE2 3.48Å; H90-Y121 WeakPolarHBondContact NE2-CE2 3.26Å; N117-Y121 HydrophobicContact CB-CD2 4.33Å; N117-Y121 WeakPolarHBondContact O-CB 3.46Å; N117-Y121 VanDerWaalsContact O-CD2 3.32Å; N117-Y121 WeakPolarHBondContact O-CD2 3.42Å; N117-Y121 PolarHBondContact O-N 3.36Å; Y121-A125 VanDerWaalsContact O-CB 3.29Å; Y121-A125 WeakPolarHBondContact O-CB 3.49Å; Y121-A125 PolarHBondContact O-N 3.43Å
122G96.1Very high93.7Very high29 Ų2949.1 Ų49.130%0.29926%0.258SS..Hα-helixtrans-66.1-43.5176.700000112.9F118 L119 L120 F126F118-G122 PolarHBondContact O-N 3.11Å; L119-G122 PolarHBondContact O-N 3.31Å; L120-G122 VanDerWaalsContact C-N 3.27Å; L120-G122 PolarHBondContact O-N 3.47Å; G122-F126 PolarHBondContact O-N 3.29Å; G122-F126 VanDerWaalsContact O-N 3.07Å
123V96.6Very high93.1Very high68 Ų6851.9 Ų51.941%0.41226%0.26SS..Hα-helixtrans-67.9-42.3175.8171.60000110.7F15 L119 L120 F126 F127F15-V123 HydrophobicContact CE1-CB 4.49Å; F15-V123 HydrophobicContact CE1-CG1 4.07Å; F15-V123 HydrophobicContact CZ-CG1 3.8Å; L119-V123 WeakPolarHBondContact O-CG2 3.37Å; L119-V123 PolarHBondContact O-N 3.26Å; L120-V123 PolarHBondContact O-N 3.44Å; V123-F126 WeakPolarHBondContact O-CB 3.44Å; V123-F126 PolarHBondContact O-N 2.94Å; V123-F127 HydrophobicContact CG1-CD2 3.76Å; V123-F127 HydrophobicContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact O-CD2 3.26Å; V123-F127 WeakPolarHBondContact O-CD2 3.42Å; V123-F127 PolarHBondContact O-N 3.23Å
124D94.5Very high92.3Very high0 Ų054.3 Ų54.30%028%0.279CS..Hα-helixtrans-58.9-49.6174.9-173.746.7000110.7F15 K16 I83 L120 F126 F127 L128F15-D124 HydrophobicContact CB-CB 4.22Å; F15-D124 HydrophobicContact CD1-CB 4.07Å; F15-D124 HydrophobicContact CG-CB 4.08Å; K16-D124 WeakPolarHBondContact CE-OD2 3.44Å; K16-D124 IonicContact NZ-OD2 2.76Å; K16-D124 PolarHBondContact NZ-OD2 2.61Å; I83-D124 HydrophobicContact CG2-CB 4.15Å; I83-D124 WeakPolarHBondContact CG2-OD2 3.47Å; L120-D124 WeakPolarHBondContact O-CB 3.23Å; L120-D124 PolarHBondContact O-N 3.38Å; D124-F126 PolarHBondContact O-N 2.92Å; D124-F127 PolarHBondContact O-N 2.92Å; D124-L128 HydrophobicContact CB-CD1 4.48Å; D124-L128 VanDerWaalsContact CG-CD1 3.43Å; D124-L128 WeakPolarHBondContact O-CD1 3.45Å; D124-L128 PolarHBondContact O-N 2.89Å; D124-L128 WeakPolarHBondContact OD1-CD1 3.42Å; D124-L128 WeakPolarHBondContact OD2-CD1 3.48Å
125A93.6Very high91Very high7 Ų759.2 Ų59.26%0.05831%0.305CS..Hα-helixtrans-55-39.5175.300000112.5F80 I83 A84 Y121 L128 F129F80-A125 HydrophobicContact CD2-CB 3.96Å; F80-A125 WeakPolarHBondContact CD2-O 3.26Å; F80-A125 HydrophobicContact CE2-CB 4.07Å; I83-A125 HydrophobicContact CG2-CB 4.03Å; A84-A125 HydrophobicContact CB-CB 4.36Å; Y121-A125 VanDerWaalsContact O-CB 3.29Å; Y121-A125 WeakPolarHBondContact O-CB 3.49Å; Y121-A125 PolarHBondContact O-N 3.43Å; A125-L128 PolarHBondContact O-N 3.49Å; A125-F129 WeakPolarHBondContact O-CB 3.4Å; A125-F129 PolarHBondContact O-N 3.38Å
126F92.6Very high89.3Confident135 Ų13560.5 Ų60.559%0.59232%0.321SS*.Hα-helixtrans-63-44.8175.1179.2-97000112.5G122 V123 D124 L128 F129 A130G122-F126 PolarHBondContact O-N 3.29Å; G122-F126 VanDerWaalsContact O-N 3.07Å; V123-F126 WeakPolarHBondContact O-CB 3.44Å; V123-F126 PolarHBondContact O-N 2.94Å; D124-F126 PolarHBondContact O-N 2.92Å; F126-L128 VanDerWaalsContact C-N 3.35Å; F126-L128 PolarHBondContact O-N 3.3Å; F126-F129 PolarHBondContact O-N 2.93Å; F126-A130 WeakPolarHBondContact O-CB 3.48Å; F126-A130 PolarHBondContact O-N 3.48Å
127F90.6Very high87.4Confident92 Ų9257.3 Ų57.340%0.40431%0.306SS..Hα-helixtrans-63.3-40.3176-79.3-65.5000112.2F15 V123 D124 A130 L131F15-F127 AromaticContact CE2-CD2 3.84Å; F15-F127 HydrophobicContact CE2-CD2 3.84Å; F15-F127 HydrophobicContact CE2-CE2 4.02Å; F15-F127 HydrophobicContact CZ-CD2 4.05Å; F15-F127 AromaticContact CZ-CE2 3.98Å; F15-F127 HydrophobicContact CZ-CE2 3.98Å; V123-F127 HydrophobicContact CG1-CD2 3.76Å; V123-F127 HydrophobicContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact CG1-CE2 3.48Å; V123-F127 VanDerWaalsContact O-CD2 3.26Å; V123-F127 WeakPolarHBondContact O-CD2 3.42Å; V123-F127 PolarHBondContact O-N 3.23Å; D124-F127 PolarHBondContact O-N 2.92Å; F127-A130 PolarHBondContact O-N 3.22Å; F127-L131 WeakPolarHBondContact O-CB 3.49Å; F127-L131 PolarHBondContact O-N 3.43Å
128L88.6Confident85.3Confident3 Ų360 Ų602%0.01632%0.317CS..Hα-helixtrans-65-39.5175.1-82.788.9000112.3E79 F80 D124 A125 F126 L131 Y132E79-L128 HydrophobicContact CB-CD2 3.59Å; E79-L128 VanDerWaalsContact CD-CD2 3.43Å; E79-L128 HydrophobicContact CG-CD2 3.31Å; F80-L128 HydrophobicContact CB-CB 4.01Å; D124-L128 HydrophobicContact CB-CD1 4.48Å; D124-L128 VanDerWaalsContact CG-CD1 3.43Å; D124-L128 WeakPolarHBondContact O-CD1 3.45Å; D124-L128 PolarHBondContact O-N 2.89Å; D124-L128 WeakPolarHBondContact OD1-CD1 3.42Å; D124-L128 WeakPolarHBondContact OD2-CD1 3.48Å; A125-L128 PolarHBondContact O-N 3.49Å; F126-L128 VanDerWaalsContact C-N 3.35Å; F126-L128 PolarHBondContact O-N 3.3Å; L128-L131 PolarHBondContact O-N 2.92Å; L128-Y132 WeakPolarHBondContact O-CB 3.48Å; L128-Y132 PolarHBondContact O-N 3.29Å
129F88.2Confident82.9Confident87 Ų8764 Ų6438%0.38234%0.34SS..Hα-helixtrans-64.8-42.8175.2-178.2-106.2000111.7F80 A125 F126 L131 Y132 R133F80-F129 HydrophobicContact CD1-CD2 4.44Å; F80-F129 HydrophobicContact CD2-CB 3.94Å; F80-F129 HydrophobicContact CE1-CD2 4.07Å; F80-F129 HydrophobicContact CE2-CB 3.86Å; F80-F129 HydrophobicContact CE2-CD2 4.47Å; F80-F129 HydrophobicContact CE2-CG 4.46Å; F80-F129 HydrophobicContact CG-CB 4.45Å; F80-F129 HydrophobicContact CZ-CB 4.31Å; F80-F129 HydrophobicContact CZ-CD2 4.08Å; F80-F129 HydrophobicContact CZ-CG 4.45Å; A125-F129 WeakPolarHBondContact O-CB 3.4Å; A125-F129 PolarHBondContact O-N 3.38Å; F126-F129 PolarHBondContact O-N 2.93Å; F129-L131 VanDerWaalsContact C-N 3.34Å; F129-L131 PolarHBondContact O-N 3.34Å; F129-Y132 PolarHBondContact O-N 3.42Å; F129-R133 HydrophobicContact CD1-CG 4.36Å; F129-R133 HydrophobicContact CE1-CG 3.93Å; F129-R133 HydrophobicContact CE2-CG 4.45Å; F129-R133 HydrophobicContact CZ-CG 3.98Å; F129-R133 WeakPolarHBondContact O-CB 3.36Å; F129-R133 WeakPolarHBondContact O-CG 3.28Å; F129-R133 PolarHBondContact O-N 3.18Å
130A87.9Confident80.5Confident37 Ų3761.7 Ų61.731%0.30633%0.326SS..Hα-helixtrans-61.5-42.5174.100000111.5F126 F127 R133 V134F126-A130 WeakPolarHBondContact O-CB 3.48Å; F126-A130 PolarHBondContact O-N 3.48Å; F127-A130 PolarHBondContact O-N 3.22Å; A130-R133 WeakPolarHBondContact O-CB 3.18Å; A130-R133 PolarHBondContact O-N 2.93Å; A130-V134 WeakPolarHBondContact O-CG2 3.42Å; A130-V134 PolarHBondContact O-N 3.26Å; A130-V134 VanDerWaalsContact O-N 3.09Å
131L84.3Confident77.8Confident56 Ų5666.4 Ų66.429%0.29335%0.347SS..Hα-helixtrans-62.8-43.5176.6-173.669000111.6T76 F127 L128 F129 R133 V134 N135 Y138T76-L131 HydrophobicContact CG2-CB 4.23Å; T76-L131 HydrophobicContact CG2-CD2 3.93Å; T76-L131 HydrophobicContact CG2-CG 4.19Å; F127-L131 WeakPolarHBondContact O-CB 3.49Å; F127-L131 PolarHBondContact O-N 3.43Å; L128-L131 PolarHBondContact O-N 2.92Å; F129-L131 VanDerWaalsContact C-N 3.34Å; F129-L131 PolarHBondContact O-N 3.34Å; L131-R133 VanDerWaalsContact C-N 3.33Å; L131-R133 PolarHBondContact O-N 3.33Å; L131-V134 PolarHBondContact O-N 2.9Å; L131-N135 WeakPolarHBondContact CD1-ND2 3.48Å; L131-N135 PolarHBondContact O-N 3.4Å; L131-Y138 HydrophobicContact CD2-CE1 4.18Å
132Y83.5Confident75.4Confident70 Ų7075.4 Ų75.428%0.27539%0.389SS..Hα-helixtrans-61.4-42.6174.7174-108.2000111.5P74 L77 L128 F129 V134 G136 A137P74-Y132 HydrophobicContact CB-CE2 4.24Å; L77-Y132 HydrophobicContact CB-CD2 3.96Å; L77-Y132 HydrophobicContact CB-CE2 3.9Å; L77-Y132 HydrophobicContact CB-CG 4.45Å; L77-Y132 HydrophobicContact CD1-CD1 4.03Å; L77-Y132 HydrophobicContact CD1-CE1 3.86Å; L77-Y132 HydrophobicContact CD1-CE2 4.41Å; L77-Y132 HydrophobicContact CD1-CG 4.37Å; L77-Y132 HydrophobicContact CD2-CE2 4.35Å; L77-Y132 HydrophobicContact CG-CE2 4.45Å; L128-Y132 WeakPolarHBondContact O-CB 3.48Å; L128-Y132 PolarHBondContact O-N 3.29Å; F129-Y132 PolarHBondContact O-N 3.42Å; Y132-V134 VanDerWaalsContact C-N 3.31Å; Y132-V134 PolarHBondContact O-N 3.2Å; Y132-G136 WeakPolarHBondContact O-CA 3.42Å; Y132-G136 PolarHBondContact O-N 2.92Å; Y132-A137 HydrophobicContact CD2-CB 3.97Å; Y132-A137 HydrophobicContact CE2-CB 3.99Å
133R82.3Confident72.9Confident136 Ų13678.9 Ų78.951%0.51341%0.405SS..Hα-helixtrans-63.3-32178.3-85.1-58.6-34.6-157.33.7113.9F129 A130 L131 I149F129-R133 HydrophobicContact CD1-CG 4.36Å; F129-R133 HydrophobicContact CE1-CG 3.93Å; F129-R133 HydrophobicContact CE2-CG 4.45Å; F129-R133 HydrophobicContact CZ-CG 3.98Å; F129-R133 WeakPolarHBondContact O-CB 3.36Å; F129-R133 WeakPolarHBondContact O-CG 3.28Å; F129-R133 PolarHBondContact O-N 3.18Å; A130-R133 WeakPolarHBondContact O-CB 3.18Å; A130-R133 PolarHBondContact O-N 2.93Å; L131-R133 VanDerWaalsContact C-N 3.33Å; L131-R133 PolarHBondContact O-N 3.33Å; R133-I149 WeakPolarHBondContact O-CD1 3.35Å
134V80.1Confident70.3Confident111 Ų11181.3 Ų81.367%0.67342%0.415SS*.Hα-helixtrans-86.4-43.9-179.7175.10000111.4A130 L131 Y132A130-V134 WeakPolarHBondContact O-CG2 3.42Å; A130-V134 PolarHBondContact O-N 3.26Å; A130-V134 VanDerWaalsContact O-N 3.09Å; L131-V134 PolarHBondContact O-N 2.9Å; Y132-V134 VanDerWaalsContact C-N 3.31Å; Y132-V134 PolarHBondContact O-N 3.2Å
135N70.1Confident67.8Low103 Ų10386.8 Ų86.855%0.55145%0.451SS*.Hα-helixtrans-102.5-6.1-169.5-65.4-44.5000114.9L131 A137L131-N135 WeakPolarHBondContact CD1-ND2 3.48Å; L131-N135 PolarHBondContact O-N 3.4Å; N135-A137 VanDerWaalsContact C-N 3.28Å; N135-A137 PolarHBondContact O-N 2.91Å
136G61.1Low65.4Low54 Ų5492.1 Ų92.156%0.55748%0.478SS*.SBendtrans7122.5177.200000114.6Y132Y132-G136 WeakPolarHBondContact O-CA 3.42Å; Y132-G136 PolarHBondContact O-N 2.92Å
137A57.8Low63.2Low10 Ų1090.5 Ų90.58%0.08348%0.482CS..SBendtrans82.4154.3-165.100000114.9P74 Y132 N135 L139P74-A137 HydrophobicContact CB-CB 3.19Å; Y132-A137 HydrophobicContact CD2-CB 3.97Å; Y132-A137 HydrophobicContact CE2-CB 3.99Å; N135-A137 VanDerWaalsContact C-N 3.28Å; N135-A137 PolarHBondContact O-N 2.91Å; A137-L139 PolarHBondContact O-N 3.34Å
138Y54.1Low61.2Low58 Ų5894.1 Ų94.123%0.22750%0.5CS..SBendtrans-52.199177.1-63.4-71.4000110.4H63 M75 T76 L131 H140H63-Y138 AromaticContact CE1-CE2 3.65Å; H63-Y138 AromaticContact CE1-CZ 3.68Å; M75-Y138 HydrophobicContact CB-CD2 3.85Å; T76-Y138 HydrophobicContact CG2-CE2 4Å; T76-Y138 WeakPolarHBondContact OG1-CD2 3.49Å; T76-Y138 WeakPolarHBondContact OG1-CE2 3.5Å; T76-Y138 PolarHBondContact OG1-N 2.89Å; L131-Y138 HydrophobicContact CD2-CE1 4.18Å; Y138-H140 PolarHBondContact O-CD2 3.17Å; Y138-H140 PolarHBondContact O-N 3.18Å
139L47Very low59.3Low144 Ų14498.6 Ų98.675%0.75452%0.523SS*.SBendtrans22.835.2148.5-94.2149.4000119.3A137A137-L139 PolarHBondContact O-N 3.34Å
140H47.3Very low57.2Low65 Ų6598 Ų9830%0.30153%0.534SS..  trans-77.4-8.8160.8-73.2-79.2000110.8I68 F71 G73 Y138 H142I68-H140 PolarHBondContact O-CE1 3.3Å; I68-H140 PolarHBondContact O-NE2 3.28Å; F71-H140 PolarHBondContact O-CE1 3.48Å; F71-H140 PolarHBondContact O-NE2 3.12Å; F71-H140 VanDerWaalsContact O-NE2 3.15Å; G73-H140 PolarHBondContact O-CD2 3.16Å; G73-H140 VanDerWaalsContact O-CD2 3.29Å; Y138-H140 PolarHBondContact O-CD2 3.17Å; Y138-H140 PolarHBondContact O-N 3.18Å; H140-H142 VanDerWaalsContact C-N 3.3Å; H140-H142 PolarHBondContact O-N 3.43Å
141E41.2Very low55.1Low129 Ų129101.5 Ų101.560%0.60355%0.553SS**  trans-79.579.8176.8-144.376-133.200109.8T143E141-T143 WeakPolarHBondContact CG-O 3.25Å; E141-T143 PolarHBondContact O-N 3.18Å
142H45.6Very low53.3Low189 Ų189108.3 Ų108.388%0.87558%0.581SS**SBendtrans-660.6155.9-87.4-65.4000112.1H140H140-H142 VanDerWaalsContact C-N 3.3Å; H140-H142 PolarHBondContact O-N 3.43Å
143T44Very low51.6Low102 Ų102109.9 Ų109.963%0.62660%0.598SS**SBendtrans-148.2107.1-167.5-32.90000112.2E141E141-T143 WeakPolarHBondContact CG-O 3.25Å; E141-T143 PolarHBondContact O-N 3.18Å
144N41Very low50.1Low119 Ų119110.5 Ų110.564%0.63661%0.611SS**  trans97.786.8165.5-150.2-9.9000115.5N146N144-N146 PolarHBondContact O-N 3.2Å
145P43.4Very low48.5Very low115 Ų115113.2 Ų113.275%0.74762%0.617SS**  trans-64.690.1161.828.7-31.3000107.8P147P145-P147 WeakPolarHBondContact O-CD 3.24Å; P145-P147 WeakPolarHBondContact O-CG 3.07Å
146N42.8Very low47.4Very low119 Ų119116.4 Ų116.464%0.63663%0.63SS**  trans-74.2103.8167.2-160.92.1000107N144 Q148N144-N146 PolarHBondContact O-N 3.2Å; N146-Q148 PolarHBondContact O-N 3.09Å
147P46.4Very low46.9Very low101 Ų101118.6 Ų118.666%0.65663%0.634SS**  trans-79.625-164.8-7.826.9000113.3P145 I149 A150P145-P147 WeakPolarHBondContact O-CD 3.24Å; P145-P147 WeakPolarHBondContact O-CG 3.07Å; P147-I149 CarbonylContact O-C 3.51Å; P147-I149 PolarHBondContact O-N 2.92Å; P147-A150 PolarHBondContact O-N 3.48Å
148Q49Very low46.5Very low169 Ų169124.8 Ų124.879%0.7967%0.672SS**SBendtrans-692.6-168.9-65.7-127.4-5900114.6N146N146-Q148 PolarHBondContact O-N 3.09Å
149I48.7Very low46.6Very low97 Ų97132.1 Ų132.150%0.49770%0.7SS.*SBendtrans-129.270.7162.3-43.4166.5000106.9R133 P147 P151R133-I149 WeakPolarHBondContact O-CD1 3.35Å; P147-I149 CarbonylContact O-C 3.51Å; P147-I149 PolarHBondContact O-N 2.92Å; I149-P151 VanDerWaalsContact O-CD 3.27Å; I149-P151 WeakPolarHBondContact O-CD 2.85Å
150A43.7Very low47.1Very low75 Ų75133.4 Ų133.462%0.6270%0.702SS**  trans-52.7119.2160.500000106.1P147 K152P147-A150 PolarHBondContact O-N 3.48Å; A150-K152 PolarHBondContact O-N 3.38Å; A150-K152 VanDerWaalsContact O-N 3.16Å
151P44.9Very low47.6Very low109 Ų109137.4 Ų137.471%0.70873%0.726SS**  trans-51.3132.1169.919.1-28000105.8I149 T153I149-P151 VanDerWaalsContact O-CD 3.27Å; I149-P151 WeakPolarHBondContact O-CD 2.85Å; P151-T153 PolarHBondContact O-N 3.11Å
152K44.5Very low48.4Very low199 Ų199137.1 Ų137.187%0.86573%0.733SS**  trans-59.187.5171.9-72.7-172.8177.8-176.40106.6A150 N154A150-K152 PolarHBondContact O-N 3.38Å; A150-K152 VanDerWaalsContact O-N 3.16Å; K152-N154 PolarHBondContact O-N 3.45Å; K152-N154 VanDerWaalsContact O-N 3.09Å
153T48.7Very low48.8Very low104 Ų104131.9 Ų131.964%0.63872%0.723SS**  trans-65.7112.7171.31760000103.8P151 Q155P151-T153 PolarHBondContact O-N 3.11Å; T153-Q155 HydrophobicContact CG2-CG 4.13Å; T153-Q155 PolarHBondContact O-N 3.34Å
154N51.4Low49.5Very low148 Ų148136.7 Ų136.779%0.79173%0.731SS**  trans-62.190.5168.8-67.4-39.2000105.2K152 M156K152-N154 PolarHBondContact O-N 3.45Å; K152-N154 VanDerWaalsContact O-N 3.09Å; N154-M156 VanDerWaalsContact C-N 3.33Å; N154-M156 PolarHBondContact O-N 2.68Å
155Q45.1Very low50.4Low169 Ų169137.7 Ų137.779%0.7974%0.737SS**  trans-60.9100.9175.9-69.3-177.2-24.800106.4T153T153-Q155 HydrophobicContact CG2-CG 4.13Å; T153-Q155 PolarHBondContact O-N 3.34Å
156M47.2Very low51.5Low170 Ų170136.6 Ų136.684%0.83773%0.729SS**  trans-63125.9167.4-77.1-179.7-176.600106.8N154 T158N154-M156 VanDerWaalsContact C-N 3.33Å; N154-M156 PolarHBondContact O-N 2.68Å; M156-T158 PolarHBondContact O-N 3.41Å
157P51Low51.9Low99 Ų99143.1 Ų143.164%0.64376%0.756SS**  trans-61.5114-179.921.4-29.4000109.3Y159P157-Y159 PolarHBondContact O-N 3.07Å
158T50.1Low52.2Low141 Ų141145.3 Ų145.387%0.86576%0.761SS**  trans-68.7112.2169.832.50000108.6M156 E160M156-T158 PolarHBondContact O-N 3.41Å; T158-E160 PolarHBondContact O-N 3.48Å
159Y55.6Low52.3Low211 Ų211144 Ų14483%0.82776%0.759SS**  trans-72.2113170.5-69.1-85.2000108.9P157 N161P157-Y159 PolarHBondContact O-N 3.07Å; Y159-N161 PolarHBondContact O-N 3.08Å
160E57.6Low52.5Low171 Ų171146.6 Ų146.680%0.79977%0.774SS**  trans-70.6110.6177.4-164.4159.5-178.400109.6T158 T162T158-E160 PolarHBondContact O-N 3.48Å; E160-T162 HydrophobicContact CG-CG2 4.28Å; E160-T162 PolarHBondContact O-N 3.32Å; E160-T162 VanDerWaalsContact O-N 3.09Å
161N58.6Low53.1Low149 Ų149150.8 Ų150.880%0.79778%0.783SS**  trans-82.482.2179.4-164.3-74.9000109.1Y159 A163Y159-N161 PolarHBondContact O-N 3.08Å; N161-A163 PolarHBondContact O-N 3.43Å
162T56.5Low53.6Low123 Ų123153.4 Ų153.476%0.75579%0.788SS**  trans-81.479.7173.638.80000110.7E160E160-T162 HydrophobicContact CG-CG2 4.28Å; E160-T162 PolarHBondContact O-N 3.32Å; E160-T162 VanDerWaalsContact O-N 3.09Å
163A55.1Low54.2Low80 Ų80150.4 Ų150.466%0.66178%0.783SS**  trans-165.9106.6159.200000112.6N161N161-A163 PolarHBondContact O-N 3.43Å
164Y57.5Low54.6Low203 Ų203153.7 Ų153.780%0.79679%0.793SS**  160.2107116.9-169.9-109.3000109.4P166Y164-P166 HydrophobicContact CD1-CB 4.47Å; Y164-P166 HydrophobicContact CE1-CB 3.99Å; Y164-P166 HydrophobicContact CE1-CG 4.49Å; Y164-P166 VanDerWaalsContact O-CD 3.32Å; Y164-P166 WeakPolarHBondContact O-CD 3.19Å
165N61.8Low54.8Low140 Ų140154.2 Ų154.275%0.74979%0.793SS**  trans-99.4101.8173.2-179.914.6000107.9Q167N165-Q167 PolarHBondContact O-N 3.41Å
166P64.5Low55.6Low91 Ų91152.9 Ų152.959%0.59179%0.793SS**  trans-73111.9172.327.3-28.6000108.8Y164Y164-P166 HydrophobicContact CD1-CB 4.47Å; Y164-P166 HydrophobicContact CE1-CB 3.99Å; Y164-P166 HydrophobicContact CE1-CG 4.49Å; Y164-P166 VanDerWaalsContact O-CD 3.32Å; Y164-P166 WeakPolarHBondContact O-CD 3.19Å
167Q51.9Low56.4Low257 Ų257151.4 Ų151.4100%1.20179%0.789SS**  trans-61.50162.6-62-159.7-63.400111.3N165N165-Q167 PolarHBondContact O-N 3.41Å

Retrieved 167 of 167 residues in 36.5 ms (Link to these results)

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