A0A077ZLU7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZLU7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 144 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
1M75.5Confident93.2Very high147 Ų14781.7 Ų81.772%0.72444%0.437SS*.  0104.30-146.5169.869.400114D52 K54M1-D52 VanDerWaalsContact CA-O 3.22Å; M1-D52 WeakPolarHBondContact CA-O 3.32Å; M1-D52 WeakPolarHBondContact CA-OD2 3.17Å; M1-D52 WeakPolarHBondContact CB-OD2 3.45Å; M1-D52 WeakPolarHBondContact CG-O 3.28Å; M1-D52 PolarHBondContact N-OD2 2.93Å; M1-K54 HydrophobicContact CE-CB 3.83Å; M1-K54 HydrophobicContact CE-CD 3.78Å; M1-K54 HydrophobicContact CE-CG 4.17Å; M1-K54 HydrophobicContact CG-CB 4.14Å; M1-K54 HydrophobicContact SD-CB 4.1Å
2K90.8Very high93.1Very high163 Ų16380.2 Ų80.271%0.70943%0.433SS*.EExtended strand (participates in β ladder)trans-87136.4171-69.5176.5-179.2173.50109.2D52 L53 K54K2-D52 PolarHBondContact N-O 2.96Å; K2-L53 HydrophobicContact CB-CD2 3.94Å; K2-L53 WeakPolarHBondContact O-CA 3.38Å; K2-K54 PolarHBondContact O-N 2.87Å
3T95.3Very high93Very high99 Ų9975.9 Ų75.961%0.60742%0.416SS*.EExtended strand (participates in β ladder)trans-94.6130.1177.8-57.30000109.7K54T3-K54 HydrophobicContact CG2-CB 4.43Å; T3-K54 HydrophobicContact CG2-CD 4.4Å
4V95.7Very high93Very high56 Ų5675.1 Ų75.134%0.33941%0.406SS..EExtended strand (participates in β ladder)trans-127.2128.4178.3-179.30000108.5L53 K54 L55 T56V4-L53 HydrophobicContact CG2-CD2 4.3Å; V4-K54 PolarHBondContact N-O 3.38Å; V4-L55 HydrophobicContact CB-CD1 4.05Å; V4-L55 HydrophobicContact CG1-CD1 3.92Å; V4-L55 WeakPolarHBondContact O-CA 3.41Å; V4-T56 PolarHBondContact O-N 2.87Å; V4-T56 PolarHBondContact O-OG1 2.78Å
5E95.6Very high92.9Very high104 Ų10479.5 Ų79.549%0.48642%0.415SS..EExtended strand (participates in β ladder)trans-107122171.4-172.4-180-147.900108.9M7E5-M7 HydrophobicContact CG-CE 4.35Å; E5-M7 WeakPolarHBondContact OE2-CE 3.48Å
6L94.9Very high92.8Very high66 Ų6679 Ų7935%0.34641%0.406SS..EExtended strand (participates in β ladder)trans-107115.9-177.5-150.8151.9000108.7L55 T56 V57 K58L6-L55 HydrophobicContact CB-CD1 3.96Å; L6-L55 HydrophobicContact CD1-CD1 4.04Å; L6-T56 PolarHBondContact N-O 3.36Å; L6-V57 CarbonylContact O-C 3.53Å; L6-V57 VanDerWaalsContact O-CA 3.26Å; L6-V57 WeakPolarHBondContact O-CA 3.22Å; L6-V57 WeakPolarHBondContact O-CG1 3.42Å; L6-K58 PolarHBondContact O-N 3.34Å
7M95.8Very high92.7Very high99 Ų9975.9 Ų75.949%0.48839%0.39SS..EExtended strand (participates in β ladder)trans-99.5133.2-179.4-61.2-176.6178.300109.8E5 K58 V60E5-M7 HydrophobicContact CG-CE 4.35Å; E5-M7 WeakPolarHBondContact OE2-CE 3.48Å; M7-K58 WeakPolarHBondContact CA-O 3.1Å; M7-K58 HydrophobicContact CG-CB 4.49Å; M7-V60 HydrophobicContact CB-CG1 4.08Å; M7-V60 HydrophobicContact CB-CG2 4.31Å; M7-V60 HydrophobicContact CG-CG1 4.24Å; M7-V60 HydrophobicContact SD-CG1 4.27Å
8T96.1Very high92.7Very high20 Ų2073.4 Ų73.412%0.12338%0.38CS..EExtended strand (participates in β ladder)trans-142.3146.2175.4-174.80000109.9S10 F14 V57 K58 L59 V60T8-S10 PolarHBondContact OG1-N 2.88Å; T8-F14 HydrophobicContact CG2-CB 3.79Å; T8-V57 HydrophobicContact CG2-CG1 4.25Å; T8-K58 PolarHBondContact N-O 2.89Å; T8-L59 CarbonylContact O-C 3.28Å; T8-L59 VanDerWaalsContact O-CA 3.3Å; T8-L59 WeakPolarHBondContact O-CA 3.21Å; T8-L59 WeakPolarHBondContact O-CD1 3.4Å; T8-V60 PolarHBondContact O-N 3.22Å
9D96.6Very high92.6Very high50 Ų5072.5 Ų72.527%0.26738%0.376SS..SBendtrans-94-8170.765.1-25.2000112.9A11 V60 S62 N65D9-A11 PolarHBondContact O-N 3.4Å; D9-V60 VanDerWaalsContact CA-O 3.31Å; D9-V60 WeakPolarHBondContact CA-O 3.2Å; D9-V60 HydrophobicContact CB-CG2 4.48Å; D9-V60 WeakPolarHBondContact CB-O 3.48Å; D9-S62 WeakPolarHBondContact OD2-CA 3.42Å; D9-S62 VanDerWaalsContact OD2-CB 3.27Å; D9-S62 WeakPolarHBondContact OD2-CB 3.26Å; D9-S62 PolarHBondContact OD2-OG 3.31Å; D9-N65 HydrophobicContact CB-CB 4.16Å; D9-N65 PolarHBondContact OD1-ND2 3.25Å
10S94.9Very high92.4Very high49 Ų4969.8 Ų69.834%0.34337%0.367SS..  trans-82.2104.2175.7178.50000110.6T8 T12 A13 F14T8-S10 PolarHBondContact OG1-N 2.88Å; S10-T12 PolarHBondContact O-N 3.07Å; S10-A13 PolarHBondContact O-N 3Å; S10-A13 VanDerWaalsContact O-N 3.13Å; S10-A13 PolarHBondContact OG-N 2.86Å; S10-F14 WeakPolarHBondContact O-CB 3.32Å; S10-F14 PolarHBondContact O-N 3.28Å
11A94.5Very high92.3Very high46 Ų4669.3 Ų69.338%0.3836%0.364SS..Hα-helixtrans-55.6-33.817500000112.6D9 R15 L59D9-A11 PolarHBondContact O-N 3.4Å; A11-R15 WeakPolarHBondContact O-CB 3.46Å; A11-R15 PolarHBondContact O-N 3.02Å; A11-R15 VanDerWaalsContact O-N 3.09Å; A11-L59 HydrophobicContact CB-CD1 4.33Å; A11-L59 HydrophobicContact CB-CD2 4.29Å
12T91.3Very high92.9Very high63 Ų6365.2 Ų65.239%0.38735%0.35SS..Hα-helixtrans-68.8-48.7177-570000111.3S10 R15 W16S10-T12 PolarHBondContact O-N 3.07Å; T12-R15 PolarHBondContact O-N 2.89Å; T12-W16 HydrophobicContact CG2-CD2 3.93Å; T12-W16 VanDerWaalsContact CG2-CE2 3.44Å; T12-W16 HydrophobicContact CG2-CE3 4.21Å; T12-W16 HydrophobicContact CG2-CH2 3.61Å; T12-W16 HydrophobicContact CG2-CZ2 3.29Å; T12-W16 HydrophobicContact CG2-CZ3 4.06Å; T12-W16 VanDerWaalsContact O-CG 3.26Å; T12-W16 PolarHBondContact O-N 3.39Å
13A91.6Very high92.5Very high25 Ų2560.7 Ų60.721%0.20735%0.35CS..Hα-helixtrans-64.6-42.5178.100000111.5S10 R15 W16 I17S10-A13 PolarHBondContact O-N 3Å; S10-A13 VanDerWaalsContact O-N 3.13Å; S10-A13 PolarHBondContact OG-N 2.86Å; A13-R15 VanDerWaalsContact C-N 3.33Å; A13-R15 PolarHBondContact O-N 3.3Å; A13-W16 PolarHBondContact O-N 3.3Å; A13-I17 WeakPolarHBondContact O-CG1 3.47Å; A13-I17 PolarHBondContact O-N 3.27Å
14F94.2Very high91.2Very high64 Ų6466.3 Ų66.328%0.28136%0.36SS..Hα-helixtrans-52.1-51.2173.2169.5-96.9000111.4T8 S10 W16 I17 S18 V57 L59T8-F14 HydrophobicContact CG2-CB 3.79Å; S10-F14 WeakPolarHBondContact O-CB 3.32Å; S10-F14 PolarHBondContact O-N 3.28Å; F14-W16 PolarHBondContact O-N 3.06Å; F14-I17 PolarHBondContact O-N 3.39Å; F14-S18 WeakPolarHBondContact O-CB 3.26Å; F14-S18 PolarHBondContact O-N 2.81Å; F14-S18 PolarHBondContact O-OG 3.17Å; F14-V57 HydrophobicContact CD2-CB 4.25Å; F14-V57 HydrophobicContact CD2-CG1 3.79Å; F14-V57 HydrophobicContact CE2-CB 4.36Å; F14-V57 HydrophobicContact CE2-CG1 4.38Å; F14-V57 WeakPolarHBondContact CE2-O 3.43Å; F14-L59 HydrophobicContact CB-CD1 4.1Å; F14-L59 HydrophobicContact CD1-CB 4.49Å; F14-L59 HydrophobicContact CD2-CB 4Å; F14-L59 HydrophobicContact CE2-CB 4.35Å; F14-L59 HydrophobicContact CG-CB 4.08Å; F14-L59 HydrophobicContact CG-CD1 4.49Å
15R91Very high89.5Confident141 Ų14165.8 Ų65.853%0.53236%0.361SS..Hα-helixtrans-63.2-43.2-179-170.1-177.1-54138.77.4111.8A11 T12 A13 N19A11-R15 WeakPolarHBondContact O-CB 3.46Å; A11-R15 PolarHBondContact O-N 3.02Å; A11-R15 VanDerWaalsContact O-N 3.09Å; T12-R15 PolarHBondContact O-N 2.89Å; A13-R15 VanDerWaalsContact C-N 3.33Å; A13-R15 PolarHBondContact O-N 3.3Å; R15-N19 WeakPolarHBondContact O-CB 3.4Å; R15-N19 PolarHBondContact O-N 3.16Å; R15-N19 PolarHBondContact O-ND2 2.95Å
16W90.4Very high87.9Confident72 Ų7270.9 Ų70.927%0.27338%0.376SS..Hα-helixtrans-61.2-48179.3-74-13.2000112.9T12 A13 F14 G20 L27 T29 I37 I41T12-W16 HydrophobicContact CG2-CD2 3.93Å; T12-W16 VanDerWaalsContact CG2-CE2 3.44Å; T12-W16 HydrophobicContact CG2-CE3 4.21Å; T12-W16 HydrophobicContact CG2-CH2 3.61Å; T12-W16 HydrophobicContact CG2-CZ2 3.29Å; T12-W16 HydrophobicContact CG2-CZ3 4.06Å; T12-W16 VanDerWaalsContact O-CG 3.26Å; T12-W16 PolarHBondContact O-N 3.39Å; A13-W16 PolarHBondContact O-N 3.3Å; F14-W16 PolarHBondContact O-N 3.06Å; W16-G20 PolarHBondContact O-N 2.65Å; W16-L27 HydrophobicContact CB-CD2 4.18Å; W16-L27 HydrophobicContact CD2-CD2 4.05Å; W16-L27 HydrophobicContact CG-CD2 3.6Å; W16-T29 HydrophobicContact CZ2-CG2 4.02Å; W16-I37 HydrophobicContact CD2-CG2 3.82Å; W16-I37 HydrophobicContact CE3-CG2 3.62Å; W16-I37 HydrophobicContact CH2-CD1 3.48Å; W16-I37 VanDerWaalsContact CH2-CD1 3.48Å; W16-I37 HydrophobicContact CH2-CG1 4.04Å; W16-I37 HydrophobicContact CH2-CG2 4.06Å; W16-I37 HydrophobicContact CZ2-CD1 3.86Å; W16-I37 HydrophobicContact CZ2-CG2 4.22Å; W16-I37 HydrophobicContact CZ3-CD1 4.08Å; W16-I37 HydrophobicContact CZ3-CG1 4.11Å; W16-I37 HydrophobicContact CZ3-CG2 3.75Å; W16-I41 HydrophobicContact CB-CD1 3.66Å; W16-I41 HydrophobicContact CG-CD1 4.19Å
17I92.2Very high86.4Confident26 Ų2668.9 Ų68.913%0.13337%0.366CS..Hα-helixtrans-70.5-44.6-179.6-59170.3000110A13 F14 N19 G20 L21 V44 V57A13-I17 WeakPolarHBondContact O-CG1 3.47Å; A13-I17 PolarHBondContact O-N 3.27Å; F14-I17 PolarHBondContact O-N 3.39Å; I17-N19 PolarHBondContact O-N 2.72Å; I17-G20 PolarHBondContact O-N 2.8Å; I17-G20 VanDerWaalsContact O-N 3.13Å; I17-L21 HydrophobicContact CG2-CD1 3.9Å; I17-L21 HydrophobicContact CG2-CG 4.25Å; I17-L21 WeakPolarHBondContact O-CG 3.35Å; I17-L21 PolarHBondContact O-N 3.02Å; I17-V44 HydrophobicContact CG2-CG1 4.44Å; I17-V57 HydrophobicContact CB-CG2 4.24Å; I17-V57 HydrophobicContact CG2-CG2 3.59Å
18S92.5Very high84.9Confident31 Ų3174.2 Ų74.222%0.21739%0.386CS..Hα-helixtrans-59.4-45179.1-58.90000112F14 G20 L21 S22F14-S18 WeakPolarHBondContact O-CB 3.26Å; F14-S18 PolarHBondContact O-N 2.81Å; F14-S18 PolarHBondContact O-OG 3.17Å; S18-G20 VanDerWaalsContact C-N 3.33Å; S18-G20 PolarHBondContact O-N 3.45Å; S18-L21 PolarHBondContact O-N 3.38Å; S18-S22 WeakPolarHBondContact O-CB 3.46Å; S18-S22 PolarHBondContact O-N 3.36Å; S18-S22 PolarHBondContact O-OG 3.22Å
19N89.7Confident83.3Confident56 Ų5674.3 Ų74.330%0.29939%0.386SS..Hα-helixtrans-65.6-36.2176.3-74.1-8.1000112.7R15 I17 S22 G23 R24 A25R15-N19 WeakPolarHBondContact O-CB 3.4Å; R15-N19 PolarHBondContact O-N 3.16Å; R15-N19 PolarHBondContact O-ND2 2.95Å; I17-N19 PolarHBondContact O-N 2.72Å; N19-S22 PolarHBondContact O-OG 3Å; N19-G23 PolarHBondContact O-N 3.29Å; N19-R24 PolarHBondContact O-N 2.89Å; N19-A25 HydrophobicContact CB-CB 4.19Å
20G89.3Confident81.9Confident19 Ų1982.4 Ų82.420%0.19642%0.419CS..Hα-helixtrans-63.9-46.6174.900000111.7W16 I17 S18 G23W16-G20 PolarHBondContact O-N 2.65Å; I17-G20 PolarHBondContact O-N 2.8Å; I17-G20 VanDerWaalsContact O-N 3.13Å; S18-G20 VanDerWaalsContact C-N 3.33Å; S18-G20 PolarHBondContact O-N 3.45Å; G20-G23 PolarHBondContact O-N 2.81Å
21L90.4Very high80.5Confident60 Ų6082.4 Ų82.431%0.31442%0.422SS..Hα-helixtrans-66.6-40179-71.6170.9000112.5I17 S18 G23 L45 V48 L55 V57I17-L21 HydrophobicContact CG2-CD1 3.9Å; I17-L21 HydrophobicContact CG2-CG 4.25Å; I17-L21 WeakPolarHBondContact O-CG 3.35Å; I17-L21 PolarHBondContact O-N 3.02Å; S18-L21 PolarHBondContact O-N 3.38Å; L21-G23 PolarHBondContact O-N 3.16Å; L21-L45 HydrophobicContact CD2-CD2 3.66Å; L21-L45 HydrophobicContact CG-CD2 4.14Å; L21-V48 HydrophobicContact CD2-CG1 4.47Å; L21-V48 HydrophobicContact CD2-CG2 4.36Å; L21-L55 HydrophobicContact CD1-CD2 4.1Å; L21-L55 HydrophobicContact CD1-CG 4.18Å; L21-L55 HydrophobicContact CD2-CD2 4.25Å; L21-V57 HydrophobicContact CD1-CG2 3.84Å
22S88.2Confident79.4Confident60 Ų6085.4 Ų85.442%0.4245%0.447SS..THydrogen-bonded Turntrans-78.4-3.7-179.579.60000113.5S18 N19 R24S18-S22 WeakPolarHBondContact O-CB 3.46Å; S18-S22 PolarHBondContact O-N 3.36Å; S18-S22 PolarHBondContact O-OG 3.22Å; N19-S22 PolarHBondContact O-OG 3Å; S22-R24 PolarHBondContact O-N 2.98Å; S22-R24 WeakPolarHBondContact OG-CB 3.48Å; S22-R24 PolarHBondContact OG-N 2.75Å
23G82Confident78.8Confident69 Ų6987 Ų8771%0.71145%0.454SS*.THydrogen-bonded Turntrans63.16.7-173.900000114.9N19 G20 L21 A25N19-G23 PolarHBondContact O-N 3.29Å; G20-G23 PolarHBondContact O-N 2.81Å; L21-G23 PolarHBondContact O-N 3.16Å; G23-A25 PolarHBondContact O-N 3.07Å
24R67.9Low78.4Confident217 Ų21788.3 Ų88.382%0.81946%0.455SS*.  trans-83.2-9.6-167-76.8-173.2-165.3173.25114.7N19 S22N19-R24 PolarHBondContact O-N 2.89Å; S22-R24 PolarHBondContact O-N 2.98Å; S22-R24 WeakPolarHBondContact OG-CB 3.48Å; S22-R24 PolarHBondContact OG-N 2.75Å
25A60.1Low78Confident44 Ų4492.9 Ų92.936%0.36448%0.479SS..  trans-154.8129.118000000115.2N19 G23 L27N19-A25 HydrophobicContact CB-CB 4.19Å; G23-A25 PolarHBondContact O-N 3.07Å; A25-L27 PolarHBondContact O-N 3.27Å
26R61.8Low77.9Confident212 Ų21290.6 Ų90.680%0.848%0.477SS*.  trans-53.5117.5148.9-147.9174.1-175.9-179.5-0.5107K28R26-K28 PolarHBondContact O-N 3.48Å
27L64.4Low77.8Confident24 Ų2488.5 Ų88.513%0.12647%0.471CS..  trans-48109.7176.2-87.9123.5000110.1W16 A25 T29 E34 I37 R38 I41W16-L27 HydrophobicContact CB-CD2 4.18Å; W16-L27 HydrophobicContact CD2-CD2 4.05Å; W16-L27 HydrophobicContact CG-CD2 3.6Å; A25-L27 PolarHBondContact O-N 3.27Å; L27-T29 HydrophobicContact CD2-CG2 4.08Å; L27-T29 PolarHBondContact O-N 3.03Å; L27-E34 VanDerWaalsContact O-OE1 3.04Å; L27-I37 HydrophobicContact CD2-CG2 3.73Å; L27-R38 HydrophobicContact CB-CG 4.14Å; L27-R38 HydrophobicContact CD1-CB 4.49Å; L27-R38 HydrophobicContact CD1-CG 3.78Å; L27-R38 PolarHBondContact O-NH2 3.35Å; L27-I41 HydrophobicContact CD1-CB 4.46Å; L27-I41 HydrophobicContact CD1-CD1 3.37Å; L27-I41 HydrophobicContact CD2-CD1 3.59Å; L27-I41 HydrophobicContact CG-CD1 4.01Å
28K64.3Low77.4Confident210 Ų21091.5 Ų91.591%0.91348%0.481SS*.  trans-87.281.4172.8-69.6-170-179.8-177.90108.1R26R26-K28 PolarHBondContact O-N 3.48Å
29T62.8Low77.3Confident22 Ų2298.6 Ų98.614%0.13550%0.503CS..  trans-129.5109.3173.870.90000109.1W16 L27 A31 E34W16-T29 HydrophobicContact CZ2-CG2 4.02Å; L27-T29 HydrophobicContact CD2-CG2 4.08Å; L27-T29 PolarHBondContact O-N 3.03Å; T29-A31 PolarHBondContact O-N 3Å; T29-E34 VanDerWaalsContact O-CB 3.27Å; T29-E34 WeakPolarHBondContact O-CB 3.42Å; T29-E34 WeakPolarHBondContact O-CG 3.43Å; T29-E34 WeakPolarHBondContact OG1-CB 3.5Å; T29-E34 WeakPolarHBondContact OG1-CG 3.27Å
30K66.3Low77.5Confident220 Ų220104.7 Ų104.796%0.95752%0.521SS*.  trans-75.824.2177.3-67.2-166.7175.5-173.80113.9
31A65.5Low77.6Confident49 Ų49104.4 Ų104.441%0.40552%0.516SS..SBendtrans-82.1145.5-175.100000110.2T29 N33 E34T29-A31 PolarHBondContact O-N 3Å; A31-N33 PolarHBondContact O-N 3.18Å; A31-E34 VanDerWaalsContact O-CB 3.25Å; A31-E34 WeakPolarHBondContact O-CB 3.5Å; A31-E34 PolarHBondContact O-N 2.85Å
32A71Confident77.7Confident109 Ų109103 Ų10390%0.90152%0.516SS*.THydrogen-bonded Turntrans-51.3-26.1172.600000112.7
33N78.4Confident78Confident98 Ų98104.4 Ų104.452%0.52452%0.518SS..THydrogen-bonded Turntrans-96.411.5-179.8-57.6-21.4000114A31 M35 L36 I37A31-N33 PolarHBondContact O-N 3.18Å; N33-M35 VanDerWaalsContact C-N 3.28Å; N33-M35 PolarHBondContact O-N 3.08Å; N33-L36 HydrophobicContact CB-CD1 4.47Å; N33-L36 WeakPolarHBondContact O-CB 3.46Å; N33-L36 PolarHBondContact O-N 2.93Å; N33-L36 VanDerWaalsContact O-N 3.11Å; N33-I37 WeakPolarHBondContact O-CG1 3.32Å; N33-I37 PolarHBondContact O-N 3.33Å; N33-I37 VanDerWaalsContact O-N 3.1Å
34E83.4Confident78.6Confident51 Ų51103.2 Ų103.224%0.23850%0.496CS..Hα-helixtrans-52.7-46.3-179.1174.7174.6-168.600112L27 T29 A31 L36 I37 R38L27-E34 VanDerWaalsContact O-OE1 3.04Å; T29-E34 VanDerWaalsContact O-CB 3.27Å; T29-E34 WeakPolarHBondContact O-CB 3.42Å; T29-E34 WeakPolarHBondContact O-CG 3.43Å; T29-E34 WeakPolarHBondContact OG1-CB 3.5Å; T29-E34 WeakPolarHBondContact OG1-CG 3.27Å; A31-E34 VanDerWaalsContact O-CB 3.25Å; A31-E34 WeakPolarHBondContact O-CB 3.5Å; A31-E34 PolarHBondContact O-N 2.85Å; E34-L36 VanDerWaalsContact C-N 3.27Å; E34-L36 PolarHBondContact O-N 3.4Å; E34-I37 PolarHBondContact O-N 3.49Å; E34-I37 VanDerWaalsContact O-N 3.12Å; E34-R38 HydrophobicContact CG-CG 4.32Å; E34-R38 WeakPolarHBondContact O-CG 3.31Å; E34-R38 PolarHBondContact O-N 3.36Å; E34-R38 IonicContact OE1-CZ 3.17Å; E34-R38 IonicContact OE1-NE 2.8Å; E34-R38 PolarHBondContact OE1-NE 2.99Å; E34-R38 IonicContact OE1-NH2 2.69Å; E34-R38 PolarHBondContact OE1-NH2 3.35Å
35M85.9Confident79.8Confident161 Ų16195.5 Ų95.579%0.79347%0.471SS*.Hα-helixtrans-62.9-35.4-177.6-169.4170.3161.700111.8N33 R39N33-M35 VanDerWaalsContact C-N 3.28Å; N33-M35 PolarHBondContact O-N 3.08Å; M35-R39 WeakPolarHBondContact O-CB 3.3Å; M35-R39 PolarHBondContact O-N 3.13Å
36L89.6Confident81.5Confident92 Ų9296.9 Ų96.948%0.48248%0.478SS..Hα-helixtrans-67.9-42174.1-69.6172.7000111.7N33 E34 R39 R40N33-L36 HydrophobicContact CB-CD1 4.47Å; N33-L36 WeakPolarHBondContact O-CB 3.46Å; N33-L36 PolarHBondContact O-N 2.93Å; N33-L36 VanDerWaalsContact O-N 3.11Å; E34-L36 VanDerWaalsContact C-N 3.27Å; E34-L36 PolarHBondContact O-N 3.4Å; L36-R39 PolarHBondContact O-N 3.43Å; L36-R40 WeakPolarHBondContact O-CG 3.44Å; L36-R40 PolarHBondContact O-N 3.46Å
37I87.3Confident83.1Confident28 Ų2890.2 Ų90.214%0.14446%0.458CS..Hα-helixtrans-63.4-46.9178.1-64.3160.2000110W16 L27 N33 E34 R39 R40 I41W16-I37 HydrophobicContact CD2-CG2 3.82Å; W16-I37 HydrophobicContact CE3-CG2 3.62Å; W16-I37 HydrophobicContact CH2-CD1 3.48Å; W16-I37 VanDerWaalsContact CH2-CD1 3.48Å; W16-I37 HydrophobicContact CH2-CG1 4.04Å; W16-I37 HydrophobicContact CH2-CG2 4.06Å; W16-I37 HydrophobicContact CZ2-CD1 3.86Å; W16-I37 HydrophobicContact CZ2-CG2 4.22Å; W16-I37 HydrophobicContact CZ3-CD1 4.08Å; W16-I37 HydrophobicContact CZ3-CG1 4.11Å; W16-I37 HydrophobicContact CZ3-CG2 3.75Å; L27-I37 HydrophobicContact CD2-CG2 3.73Å; N33-I37 WeakPolarHBondContact O-CG1 3.32Å; N33-I37 PolarHBondContact O-N 3.33Å; N33-I37 VanDerWaalsContact O-N 3.1Å; E34-I37 PolarHBondContact O-N 3.49Å; E34-I37 VanDerWaalsContact O-N 3.12Å; I37-R39 PolarHBondContact O-N 3.11Å; I37-R40 PolarHBondContact O-N 3.41Å; I37-I41 HydrophobicContact CG2-CD1 3.68Å; I37-I41 WeakPolarHBondContact O-CD1 3.41Å; I37-I41 WeakPolarHBondContact O-CG1 3.48Å; I37-I41 PolarHBondContact O-N 2.82Å
38R85.6Confident84.5Confident90 Ų9090.4 Ų90.434%0.3446%0.46SS..Hα-helixtrans-57.9-45.7175.3-73.8174.9175.7-111.87.3112L27 E34 R40 I41 G42L27-R38 HydrophobicContact CB-CG 4.14Å; L27-R38 HydrophobicContact CD1-CB 4.49Å; L27-R38 HydrophobicContact CD1-CG 3.78Å; L27-R38 PolarHBondContact O-NH2 3.35Å; E34-R38 HydrophobicContact CG-CG 4.32Å; E34-R38 WeakPolarHBondContact O-CG 3.31Å; E34-R38 PolarHBondContact O-N 3.36Å; E34-R38 IonicContact OE1-CZ 3.17Å; E34-R38 IonicContact OE1-NE 2.8Å; E34-R38 PolarHBondContact OE1-NE 2.99Å; E34-R38 IonicContact OE1-NH2 2.69Å; E34-R38 PolarHBondContact OE1-NH2 3.35Å; R38-R40 PolarHBondContact O-N 3.33Å; R38-I41 PolarHBondContact O-N 3.19Å; R38-G42 PolarHBondContact O-N 3.09Å
39R90.1Very high86Confident179 Ų17990.5 Ų90.568%0.67546%0.455SS*.Hα-helixtrans-59.7-45.6177.1-174.2178.5178.3-155.4-0.9111.4M35 L36 I37 G42 I43M35-R39 WeakPolarHBondContact O-CB 3.3Å; M35-R39 PolarHBondContact O-N 3.13Å; L36-R39 PolarHBondContact O-N 3.43Å; I37-R39 PolarHBondContact O-N 3.11Å; R39-G42 PolarHBondContact O-N 3.22Å; R39-I43 WeakPolarHBondContact O-CG1 3.43Å; R39-I43 PolarHBondContact O-N 3.13Å
40R92.8Very high87.6Confident184 Ų18496 Ų9669%0.69448%0.479SS*.Hα-helixtrans-63.5-41.5179.1-73178.4-178.6-157.90.6112.5L36 I37 R38 G42 I43 V44L36-R40 WeakPolarHBondContact O-CG 3.44Å; L36-R40 PolarHBondContact O-N 3.46Å; I37-R40 PolarHBondContact O-N 3.41Å; R38-R40 PolarHBondContact O-N 3.33Å; R40-G42 VanDerWaalsContact C-N 3.34Å; R40-I43 PolarHBondContact O-N 2.93Å; R40-V44 PolarHBondContact O-N 2.87Å
41I91.2Very high89Confident14 Ų1492.4 Ų92.47%0.07246%0.46CS..Hα-helixtrans-67.7-38.7176.4-67.5158.8000110.6W16 L27 I37 R38 I43 V44 L45W16-I41 HydrophobicContact CB-CD1 3.66Å; W16-I41 HydrophobicContact CG-CD1 4.19Å; L27-I41 HydrophobicContact CD1-CB 4.46Å; L27-I41 HydrophobicContact CD1-CD1 3.37Å; L27-I41 HydrophobicContact CD2-CD1 3.59Å; L27-I41 HydrophobicContact CG-CD1 4.01Å; I37-I41 HydrophobicContact CG2-CD1 3.68Å; I37-I41 WeakPolarHBondContact O-CD1 3.41Å; I37-I41 WeakPolarHBondContact O-CG1 3.48Å; I37-I41 PolarHBondContact O-N 2.82Å; R38-I41 PolarHBondContact O-N 3.19Å; I41-I43 VanDerWaalsContact C-N 3.28Å; I41-I43 PolarHBondContact O-N 3.27Å; I41-V44 PolarHBondContact O-N 3.39Å; I41-V44 VanDerWaalsContact O-N 3.14Å; I41-L45 HydrophobicContact CG2-CD1 4.21Å; I41-L45 HydrophobicContact CG2-CG 4.39Å; I41-L45 WeakPolarHBondContact O-CG 3.34Å; I41-L45 PolarHBondContact O-N 2.91Å
42G92.3Very high90.4Very high31 Ų3194.5 Ų94.532%0.3246%0.464SS..Hα-helixtrans-55-43.8172.600000112.4R38 R39 R40 V44 L45 S46R38-G42 PolarHBondContact O-N 3.09Å; R39-G42 PolarHBondContact O-N 3.22Å; R40-G42 VanDerWaalsContact C-N 3.34Å; G42-V44 PolarHBondContact O-N 3.32Å; G42-L45 PolarHBondContact O-N 3.25Å; G42-S46 PolarHBondContact O-N 3.42Å; G42-S46 PolarHBondContact O-OG 3.26Å
43I95.4Very high91.6Very high89 Ų8991.3 Ų91.346%0.45643%0.432SS..Hα-helixtrans-60.2-47175.5-66.2165.7000111R39 R40 I41 L45 S46 L47R39-I43 WeakPolarHBondContact O-CG1 3.43Å; R39-I43 PolarHBondContact O-N 3.13Å; R40-I43 PolarHBondContact O-N 2.93Å; I41-I43 VanDerWaalsContact C-N 3.28Å; I41-I43 PolarHBondContact O-N 3.27Å; I43-L45 VanDerWaalsContact C-N 3.32Å; I43-L45 PolarHBondContact O-N 2.99Å; I43-S46 PolarHBondContact O-N 3.45Å; I43-L47 HydrophobicContact CG2-CD1 4Å; I43-L47 HydrophobicContact CG2-CG 4.35Å; I43-L47 VanDerWaalsContact O-CG 3.32Å; I43-L47 WeakPolarHBondContact O-CG 3.15Å; I43-L47 PolarHBondContact O-N 3.29Å
44V94Very high92.4Very high44 Ų4491.9 Ų91.927%0.26743%0.43SS..Hα-helixtrans-57.8-45.8177.8175.60000111I17 R40 I41 G42 L47 V48 L55I17-V44 HydrophobicContact CG2-CG1 4.44Å; R40-V44 PolarHBondContact O-N 2.87Å; I41-V44 PolarHBondContact O-N 3.39Å; I41-V44 VanDerWaalsContact O-N 3.14Å; G42-V44 PolarHBondContact O-N 3.32Å; V44-L47 PolarHBondContact O-N 3.47Å; V44-V48 VanDerWaalsContact O-CG2 3.3Å; V44-V48 WeakPolarHBondContact O-CG2 3.41Å; V44-V48 PolarHBondContact O-N 3.48Å; V44-L55 HydrophobicContact CG1-CD2 3.9Å
45L93.6Very high93Very high54 Ų5490.7 Ų90.728%0.28343%0.425SS..Hα-helixtrans-66.5-38.3179.3-63.2177.5000112.7L21 I41 G42 I43 V48 R49L21-L45 HydrophobicContact CD2-CD2 3.66Å; L21-L45 HydrophobicContact CG-CD2 4.14Å; I41-L45 HydrophobicContact CG2-CD1 4.21Å; I41-L45 HydrophobicContact CG2-CG 4.39Å; I41-L45 WeakPolarHBondContact O-CG 3.34Å; I41-L45 PolarHBondContact O-N 2.91Å; G42-L45 PolarHBondContact O-N 3.25Å; I43-L45 VanDerWaalsContact C-N 3.32Å; I43-L45 PolarHBondContact O-N 2.99Å; L45-V48 PolarHBondContact O-N 2.94Å; L45-R49 PolarHBondContact O-N 3.41Å; L45-R49 VanDerWaalsContact O-N 3.13Å
46S95.6Very high93.4Very high73 Ų7385.9 Ų85.951%0.5141%0.405SS..Hα-helixtrans-61.9-45.9174.2-67.70000111.2G42 I43 V48 R49 E50G42-S46 PolarHBondContact O-N 3.42Å; G42-S46 PolarHBondContact O-OG 3.26Å; I43-S46 PolarHBondContact O-N 3.45Å; S46-V48 PolarHBondContact O-N 3.48Å; S46-R49 PolarHBondContact O-N 3.35Å; S46-E50 VanDerWaalsContact O-CB 3.28Å; S46-E50 WeakPolarHBondContact O-CB 3.41Å; S46-E50 PolarHBondContact O-N 3.37Å
47L95.9Very high93.7Very high73 Ų7382.7 Ų82.738%0.38239%0.389SS..Hα-helixtrans-62.2-42.5177.3-69172000111.9I43 V44 R49 E50 Y51I43-L47 HydrophobicContact CG2-CD1 4Å; I43-L47 HydrophobicContact CG2-CG 4.35Å; I43-L47 VanDerWaalsContact O-CG 3.32Å; I43-L47 WeakPolarHBondContact O-CG 3.15Å; I43-L47 PolarHBondContact O-N 3.29Å; V44-L47 PolarHBondContact O-N 3.47Å; L47-R49 PolarHBondContact O-N 2.94Å; L47-E50 PolarHBondContact O-N 3.37Å; L47-Y51 HydrophobicContact CB-CD2 4.45Å; L47-Y51 HydrophobicContact CD2-CD2 4.08Å; L47-Y51 HydrophobicContact CD2-CE2 3.63Å; L47-Y51 WeakPolarHBondContact O-CB 3.38Å; L47-Y51 WeakPolarHBondContact O-CD2 3.3Å; L47-Y51 PolarHBondContact O-N 3.03Å
48V94.6Very high94.1Very high28 Ų2886.4 Ų86.417%0.1740%0.404CS..Hα-helixtrans-57.9-41.7176.5168.90000111.3L21 V44 L45 S46 D52 L53 L55L21-V48 HydrophobicContact CD2-CG1 4.47Å; L21-V48 HydrophobicContact CD2-CG2 4.36Å; V44-V48 VanDerWaalsContact O-CG2 3.3Å; V44-V48 WeakPolarHBondContact O-CG2 3.41Å; V44-V48 PolarHBondContact O-N 3.48Å; L45-V48 PolarHBondContact O-N 2.94Å; S46-V48 PolarHBondContact O-N 3.48Å; V48-D52 PolarHBondContact O-N 2.96Å; V48-L53 HydrophobicContact CG1-CB 4.47Å; V48-L53 WeakPolarHBondContact CG1-O 3.41Å; V48-L53 PolarHBondContact O-N 3.47Å; V48-L55 HydrophobicContact CG1-CB 4.45Å; V48-L55 HydrophobicContact CG2-CB 3.71Å; V48-L55 HydrophobicContact CG2-CD2 3.49Å; V48-L55 VanDerWaalsContact CG2-CD2 3.49Å; V48-L55 HydrophobicContact CG2-CG 4.22Å
49R94.6Very high94.7Very high212 Ų21286.1 Ų86.180%0.841%0.409SS*.Hα-helixtrans-72.4-47.8178.7-171.1-173.8-58.1-175.70.8112.4L45 S46 L47 Y51 D52L45-R49 PolarHBondContact O-N 3.41Å; L45-R49 VanDerWaalsContact O-N 3.13Å; S46-R49 PolarHBondContact O-N 3.35Å; L47-R49 PolarHBondContact O-N 2.94Å; R49-Y51 VanDerWaalsContact C-N 3.34Å; R49-Y51 PolarHBondContact O-N 3.01Å; R49-D52 PolarHBondContact O-N 3.21Å
50E96.6Very high95.1Very high138 Ų13878.9 Ų78.965%0.64538%0.384SS*.Hα-helixtrans-62.5-40.7-175.7-175-178.9169.400111.9S46 L47S46-E50 VanDerWaalsContact O-CB 3.28Å; S46-E50 WeakPolarHBondContact O-CB 3.41Å; S46-E50 PolarHBondContact O-N 3.37Å; L47-E50 PolarHBondContact O-N 3.37Å
51Y95.9Very high95.3Very high144 Ų14477.6 Ų77.657%0.56538%0.384SS*.THydrogen-bonded Turntrans-95.97.6-177.4-69.2-84.4000114.1L47 R49 L53L47-Y51 HydrophobicContact CB-CD2 4.45Å; L47-Y51 HydrophobicContact CD2-CD2 4.08Å; L47-Y51 HydrophobicContact CD2-CE2 3.63Å; L47-Y51 WeakPolarHBondContact O-CB 3.38Å; L47-Y51 WeakPolarHBondContact O-CD2 3.3Å; L47-Y51 PolarHBondContact O-N 3.03Å; R49-Y51 VanDerWaalsContact C-N 3.34Å; R49-Y51 PolarHBondContact O-N 3.01Å; Y51-L53 PolarHBondContact O-N 3.13Å
52D94.9Very high95.4Very high92 Ų9280.7 Ų80.749%0.49241%0.407SS..THydrogen-bonded Turntrans47.756.3-176.2-176.550000112.1M1 K2 V48 R49M1-D52 VanDerWaalsContact CA-O 3.22Å; M1-D52 WeakPolarHBondContact CA-O 3.32Å; M1-D52 WeakPolarHBondContact CA-OD2 3.17Å; M1-D52 WeakPolarHBondContact CB-OD2 3.45Å; M1-D52 WeakPolarHBondContact CG-O 3.28Å; M1-D52 PolarHBondContact N-OD2 2.93Å; K2-D52 PolarHBondContact N-O 2.96Å; V48-D52 PolarHBondContact O-N 2.96Å; R49-D52 PolarHBondContact O-N 3.21Å
53L95.4Very high95.5Very high42 Ų4284 Ų8422%0.2243%0.431CS..EExtended strand (participates in β ladder)trans-95.4135.8-176.5-57.1177.8000111.4K2 V4 V48 Y51 L55K2-L53 HydrophobicContact CB-CD2 3.94Å; K2-L53 WeakPolarHBondContact O-CA 3.38Å; V4-L53 HydrophobicContact CG2-CD2 4.3Å; V48-L53 HydrophobicContact CG1-CB 4.47Å; V48-L53 WeakPolarHBondContact CG1-O 3.41Å; V48-L53 PolarHBondContact O-N 3.47Å; Y51-L53 PolarHBondContact O-N 3.13Å; L53-L55 PolarHBondContact O-N 3.06Å
54K95.5Very high95.5Very high111 Ų11184.5 Ų84.548%0.48343%0.434SS..EExtended strand (participates in β ladder)trans-87.987.4160.6-170.1-177-174.1176.50108.7M1 K2 T3 V4M1-K54 HydrophobicContact CE-CB 3.83Å; M1-K54 HydrophobicContact CE-CD 3.78Å; M1-K54 HydrophobicContact CE-CG 4.17Å; M1-K54 HydrophobicContact CG-CB 4.14Å; M1-K54 HydrophobicContact SD-CB 4.1Å; K2-K54 PolarHBondContact O-N 2.87Å; T3-K54 HydrophobicContact CG2-CB 4.43Å; T3-K54 HydrophobicContact CG2-CD 4.4Å; V4-K54 PolarHBondContact N-O 3.38Å
55L95.5Very high95.5Very high26 Ų2683.7 Ų83.714%0.13643%0.429CS..EExtended strand (participates in β ladder)trans-85.4125.5178.7-176.363.8000111.2V4 L6 L21 V44 V48 L53V4-L55 HydrophobicContact CB-CD1 4.05Å; V4-L55 HydrophobicContact CG1-CD1 3.92Å; V4-L55 WeakPolarHBondContact O-CA 3.41Å; L6-L55 HydrophobicContact CB-CD1 3.96Å; L6-L55 HydrophobicContact CD1-CD1 4.04Å; L21-L55 HydrophobicContact CD1-CD2 4.1Å; L21-L55 HydrophobicContact CD1-CG 4.18Å; L21-L55 HydrophobicContact CD2-CD2 4.25Å; V44-L55 HydrophobicContact CG1-CD2 3.9Å; V48-L55 HydrophobicContact CG1-CB 4.45Å; V48-L55 HydrophobicContact CG2-CB 3.71Å; V48-L55 HydrophobicContact CG2-CD2 3.49Å; V48-L55 VanDerWaalsContact CG2-CD2 3.49Å; V48-L55 HydrophobicContact CG2-CG 4.22Å; L53-L55 PolarHBondContact O-N 3.06Å
56T95.6Very high95.4Very high59 Ų5989.5 Ų89.536%0.36245%0.452SS..EExtended strand (participates in β ladder)trans-118.1149.6169.152.50000109.6V4 L6V4-T56 PolarHBondContact O-N 2.87Å; V4-T56 PolarHBondContact O-OG1 2.78Å; L6-T56 PolarHBondContact N-O 3.36Å
57V95.5Very high95.3Very high26 Ų2688.3 Ų88.316%0.15845%0.446CS..EExtended strand (participates in β ladder)trans-123.5135.8179.5-164.60000108.9L6 T8 F14 I17 L21L6-V57 CarbonylContact O-C 3.53Å; L6-V57 VanDerWaalsContact O-CA 3.26Å; L6-V57 WeakPolarHBondContact O-CA 3.22Å; L6-V57 WeakPolarHBondContact O-CG1 3.42Å; T8-V57 HydrophobicContact CG2-CG1 4.25Å; F14-V57 HydrophobicContact CD2-CB 4.25Å; F14-V57 HydrophobicContact CD2-CG1 3.79Å; F14-V57 HydrophobicContact CE2-CB 4.36Å; F14-V57 HydrophobicContact CE2-CG1 4.38Å; F14-V57 WeakPolarHBondContact CE2-O 3.43Å; I17-V57 HydrophobicContact CB-CG2 4.24Å; I17-V57 HydrophobicContact CG2-CG2 3.59Å; L21-V57 HydrophobicContact CD1-CG2 3.84Å
58K96.6Very high95.1Very high106 Ų10687.3 Ų87.346%0.46144%0.441SS..EExtended strand (participates in β ladder)trans-126.5131.4179.1-169.5174.7-178.5177.30110.5L6 M7 T8 V60L6-K58 PolarHBondContact O-N 3.34Å; M7-K58 WeakPolarHBondContact CA-O 3.1Å; M7-K58 HydrophobicContact CG-CB 4.49Å; T8-K58 PolarHBondContact N-O 2.89Å; K58-V60 HydrophobicContact CG-CG1 4.34Å
59L97.7Very high94.7Very high83 Ų8392.2 Ų92.244%0.43547%0.466SS..EExtended strand (participates in β ladder)trans-81.1124.6170.4-172.363.9000108.8T8 A11 F14T8-L59 CarbonylContact O-C 3.28Å; T8-L59 VanDerWaalsContact O-CA 3.3Å; T8-L59 WeakPolarHBondContact O-CA 3.21Å; T8-L59 WeakPolarHBondContact O-CD1 3.4Å; A11-L59 HydrophobicContact CB-CD1 4.33Å; A11-L59 HydrophobicContact CB-CD2 4.29Å; F14-L59 HydrophobicContact CB-CD1 4.1Å; F14-L59 HydrophobicContact CD1-CB 4.49Å; F14-L59 HydrophobicContact CD2-CB 4Å; F14-L59 HydrophobicContact CE2-CB 4.35Å; F14-L59 HydrophobicContact CG-CB 4.08Å; F14-L59 HydrophobicContact CG-CD1 4.49Å
60V97.2Very high94.5Very high27 Ų2789.5 Ų89.516%0.16447%0.466CS..  trans-120163.4179.3-61.70000110.6M7 T8 D9 K58 D64 N65M7-V60 HydrophobicContact CB-CG1 4.08Å; M7-V60 HydrophobicContact CB-CG2 4.31Å; M7-V60 HydrophobicContact CG-CG1 4.24Å; M7-V60 HydrophobicContact SD-CG1 4.27Å; T8-V60 PolarHBondContact O-N 3.22Å; D9-V60 VanDerWaalsContact CA-O 3.31Å; D9-V60 WeakPolarHBondContact CA-O 3.2Å; D9-V60 HydrophobicContact CB-CG2 4.48Å; D9-V60 WeakPolarHBondContact CB-O 3.48Å; K58-V60 HydrophobicContact CG-CG1 4.34Å; V60-D64 HydrophobicContact CB-CB 4.36Å; V60-N65 HydrophobicContact CG2-CB 4.45Å
61K97Very high94.2Very high158 Ų15887.9 Ų87.969%0.68747%0.466SS*.  trans-70.8149.6171.9-61.6175.9179.4174.20108.9A63 D64 N65K61-A63 PolarHBondContact O-N 2.99Å; K61-A63 VanDerWaalsContact O-N 3.17Å; K61-D64 WeakPolarHBondContact CB-OD2 3.35Å; K61-D64 WeakPolarHBondContact O-CA 3.41Å; K61-D64 WeakPolarHBondContact O-CB 3.45Å; K61-D64 PolarHBondContact O-N 3.39Å; K61-N65 PolarHBondContact O-N 3.49Å
62S94.6Very high93.8Very high78 Ų7888.8 Ų88.855%0.54547%0.468SS..G310 helixtrans-56.9-32.9177.4-630000113.3D9 D64 N65D9-S62 WeakPolarHBondContact OD2-CA 3.42Å; D9-S62 VanDerWaalsContact OD2-CB 3.27Å; D9-S62 WeakPolarHBondContact OD2-CB 3.26Å; D9-S62 PolarHBondContact OD2-OG 3.31Å; S62-D64 PolarHBondContact O-N 3.29Å; S62-N65 WeakPolarHBondContact O-CB 3.24Å; S62-N65 PolarHBondContact O-N 3.14Å; S62-N65 VanDerWaalsContact O-N 3.16Å
63A93.5Very high93.4Very high100 Ų10088.2 Ų88.283%0.82647%0.468SS*.G310 helixtrans-63-26174.600000113.5K61K61-A63 PolarHBondContact O-N 2.99Å; K61-A63 VanDerWaalsContact O-N 3.17Å
64D94.9Very high92.9Very high100 Ų10088.5 Ų88.554%0.53547%0.473SS..G310 helixtrans-93.5-7.8179.6-55.1-42.5000112V60 K61 S62 K66V60-D64 HydrophobicContact CB-CB 4.36Å; K61-D64 WeakPolarHBondContact CB-OD2 3.35Å; K61-D64 WeakPolarHBondContact O-CA 3.41Å; K61-D64 WeakPolarHBondContact O-CB 3.45Å; K61-D64 PolarHBondContact O-N 3.39Å; S62-D64 PolarHBondContact O-N 3.29Å; D64-K66 PolarHBondContact O-N 3.06Å
65N94.3Very high92.3Very high27 Ų2791 Ų9114%0.14449%0.485CS..  trans-77.488.8179.4-176.59.5000110.9D9 V60 K61 S62 A67 D68D9-N65 HydrophobicContact CB-CB 4.16Å; D9-N65 PolarHBondContact OD1-ND2 3.25Å; V60-N65 HydrophobicContact CG2-CB 4.45Å; K61-N65 PolarHBondContact O-N 3.49Å; S62-N65 WeakPolarHBondContact O-CB 3.24Å; S62-N65 PolarHBondContact O-N 3.14Å; S62-N65 VanDerWaalsContact O-N 3.16Å; N65-A67 PolarHBondContact O-N 3.37Å; N65-A67 VanDerWaalsContact O-N 3.07Å; N65-A67 VanDerWaalsContact OD1-CB 3.32Å; N65-A67 WeakPolarHBondContact OD1-CB 3.38Å; N65-A67 PolarHBondContact OD1-N 2.89Å; N65-A67 VanDerWaalsContact OD1-N 3.16Å; N65-D68 WeakPolarHBondContact O-CB 3.42Å; N65-D68 PolarHBondContact O-N 3.16Å
66K92.3Very high91.7Very high177 Ų17798.1 Ų98.177%0.7751%0.511SS*.Hα-helixtrans-56.3-25.7177.9-61.2-177.2-177.6179.10113.8D64 D68D64-K66 PolarHBondContact O-N 3.06Å; K66-D68 PolarHBondContact O-N 3.17Å
67A93.6Very high91.1Very high47 Ų47102.8 Ų102.839%0.38852%0.522SS..Hα-helixtrans-67.5-27.1179.100000112.1N65 L69 L70 T71N65-A67 PolarHBondContact O-N 3.37Å; N65-A67 VanDerWaalsContact O-N 3.07Å; N65-A67 VanDerWaalsContact OD1-CB 3.32Å; N65-A67 WeakPolarHBondContact OD1-CB 3.38Å; N65-A67 PolarHBondContact OD1-N 2.89Å; N65-A67 VanDerWaalsContact OD1-N 3.16Å; A67-L69 VanDerWaalsContact C-N 3.34Å; A67-L69 PolarHBondContact O-N 3.03Å; A67-L70 PolarHBondContact O-N 3.46Å; A67-T71 WeakPolarHBondContact O-CG2 3.48Å; A67-T71 PolarHBondContact O-N 2.98Å; A67-T71 PolarHBondContact O-OG1 3.05Å
68D90.6Very high90.4Very high52 Ų52105.5 Ų105.528%0.27854%0.535SS..Hα-helixtrans-58.6-47.1179.7-176.567.7000111.1N65 K66 L70 T71 R72N65-D68 WeakPolarHBondContact O-CB 3.42Å; N65-D68 PolarHBondContact O-N 3.16Å; K66-D68 PolarHBondContact O-N 3.17Å; D68-L70 VanDerWaalsContact C-N 3.26Å; D68-L70 PolarHBondContact O-N 3.1Å; D68-T71 PolarHBondContact O-N 3.26Å; D68-T71 VanDerWaalsContact O-N 3.08Å; D68-T71 PolarHBondContact O-OG1 3.38Å; D68-R72 WeakPolarHBondContact O-CG 3.29Å; D68-R72 PolarHBondContact O-N 3.25Å; D68-R72 IonicContact OD2-CZ 3.12Å; D68-R72 IonicContact OD2-NE 2.8Å; D68-R72 PolarHBondContact OD2-NE 2.83Å; D68-R72 IonicContact OD2-NH2 2.65Å; D68-R72 PolarHBondContact OD2-NH2 3.42Å
69L87.9Confident89Confident132 Ų132102.8 Ų102.869%0.69153%0.532SS*.Hα-helixtrans-57.9-37.2175-69.6173.1000112.9A67A67-L69 VanDerWaalsContact C-N 3.34Å; A67-L69 PolarHBondContact O-N 3.03Å
70L89.5Confident87.2Confident154 Ų154106.4 Ų106.481%0.80655%0.545SS*.Hα-helixtrans-75.9-25.1179.6-59.9177.5000112.7A67 D68A67-L70 PolarHBondContact O-N 3.46Å; D68-L70 VanDerWaalsContact C-N 3.26Å; D68-L70 PolarHBondContact O-N 3.1Å
71T90.4Very high85.4Confident105 Ų105107.8 Ų107.864%0.64456%0.559SS**Hα-helixtrans-93.4-11.7-179.960.40000113.8A67 D68 V73A67-T71 WeakPolarHBondContact O-CG2 3.48Å; A67-T71 PolarHBondContact O-N 2.98Å; A67-T71 PolarHBondContact O-OG1 3.05Å; D68-T71 PolarHBondContact O-N 3.26Å; D68-T71 VanDerWaalsContact O-N 3.08Å; D68-T71 PolarHBondContact O-OG1 3.38Å; T71-V73 PolarHBondContact O-N 3.44Å
72R88.2Confident83.4Confident162 Ų162103.5 Ų103.561%0.61155%0.549SS*.SBendtrans-65.3133.6176.8-80174.7-166.5-106.80.3111.1D68 P74D68-R72 WeakPolarHBondContact O-CG 3.29Å; D68-R72 PolarHBondContact O-N 3.25Å; D68-R72 IonicContact OD2-CZ 3.12Å; D68-R72 IonicContact OD2-NE 2.8Å; D68-R72 PolarHBondContact OD2-NE 2.83Å; D68-R72 IonicContact OD2-NH2 2.65Å; D68-R72 PolarHBondContact OD2-NH2 3.42Å; R72-P74 WeakPolarHBondContact O-CD 3.41Å
73V86.1Confident81.4Confident80 Ų80102 Ų10249%0.48554%0.542SS..PPolyproline II helixtrans-65125.5173.8-179.20000108.8T71 H75 W77 L78T71-V73 PolarHBondContact O-N 3.44Å; V73-H75 PolarHBondContact O-N 3.37Å; V73-W77 HydrophobicContact CG1-CB 4.06Å; V73-W77 HydrophobicContact CG1-CE3 4.2Å; V73-L78 HydrophobicContact CB-CD2 4.32Å; V73-L78 HydrophobicContact CB-CG 4.47Å; V73-L78 HydrophobicContact CG1-CD2 3.82Å; V73-L78 HydrophobicContact CG1-CG 3.98Å
74P85.3Confident79.6Confident49 Ų49101.1 Ų101.132%0.31853%0.534SS..PPolyproline II helixtrans-54.8132.9176.9-27.334.6000111.8R72 R76 W77 L78R72-P74 WeakPolarHBondContact O-CD 3.41Å; P74-R76 HydrophobicContact CB-CG 4Å; P74-R76 PolarHBondContact O-N 3.44Å; P74-R76 VanDerWaalsContact O-N 3.11Å; P74-W77 HydrophobicContact CB-CD2 4.26Å; P74-W77 HydrophobicContact CB-CG 4.22Å; P74-W77 HydrophobicContact CG-CD2 3.99Å; P74-W77 HydrophobicContact CG-CE3 4.16Å; P74-W77 HydrophobicContact CG-CG 4.47Å; P74-W77 HydrophobicContact CG-CZ2 4.48Å; P74-W77 HydrophobicContact CG-CZ3 4.45Å; P74-W77 WeakPolarHBondContact O-CB 3.25Å; P74-W77 PolarHBondContact O-N 2.93Å; P74-L78 PolarHBondContact O-N 2.98Å
75H81.4Confident77.6Confident162 Ų162101.6 Ų101.675%0.7554%0.537SS*.Hα-helixtrans-54.8-34.9-179.3-98.5-84.1000113.2V73 W77 L78 A79V73-H75 PolarHBondContact O-N 3.37Å; H75-W77 PolarHBondContact O-N 3.24Å; H75-L78 CarbonylContact O-C 3.56Å; H75-L78 WeakPolarHBondContact O-CA 3.34Å; H75-L78 WeakPolarHBondContact O-CB 3.48Å; H75-L78 PolarHBondContact O-N 2.96Å; H75-A79 PolarHBondContact O-N 3.47Å
76R83.6Confident75.5Confident176 Ų176107.4 Ų107.466%0.66456%0.56SS**Hα-helixtrans-58.8-32.4174.763.1176-176.8-169.9-0.5113.2P74 A79 F80P74-R76 HydrophobicContact CB-CG 4Å; P74-R76 PolarHBondContact O-N 3.44Å; P74-R76 VanDerWaalsContact O-N 3.11Å; R76-A79 WeakPolarHBondContact O-CB 3.33Å; R76-A79 PolarHBondContact O-N 2.88Å; R76-F80 WeakPolarHBondContact O-CD2 3.47Å; R76-F80 PolarHBondContact O-N 3.26Å
77W83.9Confident73.5Confident157 Ų157104.3 Ų104.360%0.59556%0.558SS**Hα-helixtrans-75.6-33.8176.4-62.8-6.8000111.3V73 P74 H75 A79V73-W77 HydrophobicContact CG1-CB 4.06Å; V73-W77 HydrophobicContact CG1-CE3 4.2Å; P74-W77 HydrophobicContact CB-CD2 4.26Å; P74-W77 HydrophobicContact CB-CG 4.22Å; P74-W77 HydrophobicContact CG-CD2 3.99Å; P74-W77 HydrophobicContact CG-CE3 4.16Å; P74-W77 HydrophobicContact CG-CG 4.47Å; P74-W77 HydrophobicContact CG-CZ2 4.48Å; P74-W77 HydrophobicContact CG-CZ3 4.45Å; P74-W77 WeakPolarHBondContact O-CB 3.25Å; P74-W77 PolarHBondContact O-N 2.93Å; H75-W77 PolarHBondContact O-N 3.24Å; W77-A79 VanDerWaalsContact C-N 3.31Å
78L78.9Confident71.3Confident84 Ų84107.8 Ų107.844%0.4457%0.574SS.*Hα-helixtrans-70.4-28.8171-57.6177000112.1V73 P74 H75 F80 A81 S82V73-L78 HydrophobicContact CB-CD2 4.32Å; V73-L78 HydrophobicContact CB-CG 4.47Å; V73-L78 HydrophobicContact CG1-CD2 3.82Å; V73-L78 HydrophobicContact CG1-CG 3.98Å; P74-L78 PolarHBondContact O-N 2.98Å; H75-L78 CarbonylContact O-C 3.56Å; H75-L78 WeakPolarHBondContact O-CA 3.34Å; H75-L78 WeakPolarHBondContact O-CB 3.48Å; H75-L78 PolarHBondContact O-N 2.96Å; L78-F80 VanDerWaalsContact C-N 3.33Å; L78-F80 PolarHBondContact O-N 2.86Å; L78-A81 PolarHBondContact O-N 2.8Å; L78-S82 PolarHBondContact O-N 2.91Å; L78-S82 PolarHBondContact O-OG 3.37Å
79A68.5Low69.1Low49 Ų49110.6 Ų110.641%0.40560%0.597SS.*Hα-helixtrans-63.1-37.8176.600000111.8H75 R76 W77 S82 A83H75-A79 PolarHBondContact O-N 3.47Å; R76-A79 WeakPolarHBondContact O-CB 3.33Å; R76-A79 PolarHBondContact O-N 2.88Å; W77-A79 VanDerWaalsContact C-N 3.31Å; A79-S82 VanDerWaalsContact CA-OG 3.26Å; A79-S82 WeakPolarHBondContact CA-OG 3.44Å; A79-S82 PolarHBondContact O-N 2.84Å; A79-S82 PolarHBondContact O-OG 2.97Å; A79-A83 VanDerWaalsContact O-CB 3.24Å; A79-A83 WeakPolarHBondContact O-CB 3.33Å; A79-A83 PolarHBondContact O-N 2.66Å
80F60.4Low67.1Low159 Ų159107.9 Ų107.970%0.69759%0.593SS**Hα-helixtrans-65.9-39.8172.8-73.6-76.1000112.3R76 L78 S82 A83 A84R76-F80 WeakPolarHBondContact O-CD2 3.47Å; R76-F80 PolarHBondContact O-N 3.26Å; L78-F80 VanDerWaalsContact C-N 3.33Å; L78-F80 PolarHBondContact O-N 2.86Å; F80-S82 VanDerWaalsContact C-N 3.3Å; F80-S82 PolarHBondContact O-N 3.29Å; F80-A83 PolarHBondContact O-N 2.89Å; F80-A84 VanDerWaalsContact O-CB 3.25Å; F80-A84 WeakPolarHBondContact O-CB 3.25Å; F80-A84 PolarHBondContact O-N 3.33Å
81A58.1Low65.1Low55 Ų55105.5 Ų105.546%0.45560%0.596SS.*Hα-helixtrans-66.9-32.1175.800000112.5L78 N85L78-A81 PolarHBondContact O-N 2.8Å; A81-N85 PolarHBondContact O-N 2.71Å; A81-N85 PolarHBondContact O-ND2 3.25Å
82S54.7Low63Low69 Ų69103.8 Ų103.848%0.48359%0.592SS.*Hα-helixtrans-81.6-31.9175.347.90000113.1L78 A79 F80 N85 K86L78-S82 PolarHBondContact O-N 2.91Å; L78-S82 PolarHBondContact O-OG 3.37Å; A79-S82 VanDerWaalsContact CA-OG 3.26Å; A79-S82 WeakPolarHBondContact CA-OG 3.44Å; A79-S82 PolarHBondContact O-N 2.84Å; A79-S82 PolarHBondContact O-OG 2.97Å; F80-S82 VanDerWaalsContact C-N 3.3Å; F80-S82 PolarHBondContact O-N 3.29Å; S82-N85 CarbonylContact O-C 3.52Å; S82-N85 VanDerWaalsContact O-C 3.28Å; S82-N85 WeakPolarHBondContact O-CA 3.46Å; S82-N85 WeakPolarHBondContact O-CB 3.37Å; S82-N85 PolarHBondContact O-N 3.1Å; S82-N85 VanDerWaalsContact O-N 3.1Å; S82-K86 PolarHBondContact O-N 3.11Å
83A54.1Low61.1Low47 Ų4799 Ų9939%0.38859%0.594SS.*Hα-helixtrans-70.1-34.5170.300000112.1A79 F80 N85 K86A79-A83 VanDerWaalsContact O-CB 3.24Å; A79-A83 WeakPolarHBondContact O-CB 3.33Å; A79-A83 PolarHBondContact O-N 2.66Å; F80-A83 PolarHBondContact O-N 2.89Å; A83-N85 PolarHBondContact O-N 3.12Å; A83-K86 VanDerWaalsContact O-CB 3.29Å; A83-K86 WeakPolarHBondContact O-CB 3.27Å; A83-K86 PolarHBondContact O-N 3.24Å
84A55Low59.4Low80 Ų80103.8 Ų103.866%0.66162%0.617SS**THydrogen-bonded Turntrans-67.6-19.8167.600000112.7F80F80-A84 VanDerWaalsContact O-CB 3.25Å; F80-A84 WeakPolarHBondContact O-CB 3.25Å; F80-A84 PolarHBondContact O-N 3.33Å
85N52.8Low58.2Low111 Ų111102.7 Ų102.759%0.59462%0.615SS**THydrogen-bonded Turntrans-93.40169.2-75-48.7000113.3A81 S82 A83A81-N85 PolarHBondContact O-N 2.71Å; A81-N85 PolarHBondContact O-ND2 3.25Å; S82-N85 CarbonylContact O-C 3.52Å; S82-N85 VanDerWaalsContact O-C 3.28Å; S82-N85 WeakPolarHBondContact O-CA 3.46Å; S82-N85 WeakPolarHBondContact O-CB 3.37Å; S82-N85 PolarHBondContact O-N 3.1Å; S82-N85 VanDerWaalsContact O-N 3.1Å; A83-N85 PolarHBondContact O-N 3.12Å
86K49.3Very low58.2Low148 Ų14897.4 Ų97.464%0.64360%0.596SS**SBendtrans-61.5131.2156.9-74.7-178.9174.3-179.20104.6S82 A83 V88S82-K86 PolarHBondContact O-N 3.11Å; A83-K86 VanDerWaalsContact O-CB 3.29Å; A83-K86 WeakPolarHBondContact O-CB 3.27Å; A83-K86 PolarHBondContact O-N 3.24Å; K86-V88 PolarHBondContact O-N 3.05Å
87P50.6Low58.2Low112 Ų11291.8 Ų91.873%0.72759%0.587SS**  trans-60.894167.426.9-31000105.6C89P87-C89 PolarHBondContact O-N 2.93Å
88V47.8Very low58.5Low120 Ų12088.4 Ų88.473%0.72758%0.578SS**  trans-66.690.7158.4178.20000101.6K86 A90K86-V88 PolarHBondContact O-N 3.05Å; V88-A90 PolarHBondContact O-N 2.97Å
89C44.3Very low59.1Low112 Ų11289.8 Ų89.876%0.75758%0.582SS**  trans-62.576.2164.6-60.80000105.8P87 A91P87-C89 PolarHBondContact O-N 2.93Å; C89-A91 PolarHBondContact O-N 2.85Å
90A46.4Very low60.1Low74 Ų7490.1 Ų90.161%0.61257%0.573SS**  trans-54.2123.4144.600000103.5V88 A92V88-A90 PolarHBondContact O-N 2.97Å; A90-A92 PolarHBondContact O-N 2.63Å
91A47.5Very low61.6Low104 Ų10482.6 Ų82.686%0.8654%0.54SS*.  trans-5782.9161.600000106.2C89 G93C89-A91 PolarHBondContact O-N 2.85Å; A91-G93 PolarHBondContact O-N 2.69Å
92A46Very low63.3Low69 Ų6981.7 Ų81.757%0.5753%0.53SS*.  trans-68.298.4168.900000102.6A90A90-A92 PolarHBondContact O-N 2.63Å
93G48.7Very low65.1Low62 Ų6285 Ų8564%0.63953%0.532SS*.  trans-43.4142.4178.800000110.4A91 G95A91-G93 PolarHBondContact O-N 2.69Å; G93-G95 PolarHBondContact O-N 2.92Å
94D49.3Very low67Low180 Ų18083.7 Ų83.796%0.96352%0.519SS*.SBendtrans-34.465.5-173.9-66.3-39.7000116.5
95G61.5Low68.9Low27 Ų2779.9 Ų79.928%0.27849%0.488SS..  trans-86.2131.6166.800000108.2G93G93-G95 PolarHBondContact O-N 2.92Å
96S81Confident70.9Confident51 Ų5178.8 Ų78.836%0.35748%0.479SS..  trans-52.2151.8176.476.70000110.5E98 Q99 W100S96-E98 PolarHBondContact O-N 2.91Å; S96-E98 PolarHBondContact OG-OE2 3.23Å; S96-Q99 PolarHBondContact O-N 3.11Å; S96-W100 PolarHBondContact O-N 3.36Å
97A84.4Confident73Confident57 Ų5776.3 Ų76.347%0.47149%0.486SS..Hα-helixtrans-51.3-27.5178.400000112.6I101 L131A97-I101 WeakPolarHBondContact O-CD1 3.4Å; A97-I101 WeakPolarHBondContact O-CG1 3.35Å; A97-I101 PolarHBondContact O-N 3.48Å; A97-L131 HydrophobicContact CB-CD2 3.7Å
98E90.2Very high75Confident87 Ų8772.7 Ų72.741%0.40747%0.466SS..Hα-helixtrans-66.8-46.8176-61.6151.1164.900112.7S96 W100 I101 S102 L131 V135S96-E98 PolarHBondContact O-N 2.91Å; S96-E98 PolarHBondContact OG-OE2 3.23Å; E98-W100 PolarHBondContact O-N 3.42Å; E98-I101 PolarHBondContact O-N 2.88Å; E98-S102 WeakPolarHBondContact O-CB 3.41Å; E98-S102 PolarHBondContact O-N 2.89Å; E98-L131 HydrophobicContact CG-CD1 3.57Å; E98-L131 HydrophobicContact CG-CD2 4.37Å; E98-L131 HydrophobicContact CG-CG 4.16Å; E98-V135 HydrophobicContact CB-CG2 3.99Å; E98-V135 HydrophobicContact CG-CG2 4.24Å
99Q89.7Confident77.2Confident112 Ų11269.6 Ų69.652%0.52346%0.458SS..Hα-helixtrans-61.8-38.3179.5-69.8-179.5-8.100111.3S96 R103S96-Q99 PolarHBondContact O-N 3.11Å; Q99-R103 WeakPolarHBondContact O-CG 3.41Å; Q99-R103 PolarHBondContact O-N 3.33Å; Q99-R103 VanDerWaalsContact O-N 3.07Å
100W89.5Confident79.6Confident57 Ų5767.1 Ų67.122%0.21644%0.435CS..Hα-helixtrans-70.8-43.2176.2170.786.5000111.9S96 E98 S102 R103 V104 A120 I123 Q124 V127S96-W100 PolarHBondContact O-N 3.36Å; E98-W100 PolarHBondContact O-N 3.42Å; W100-S102 VanDerWaalsContact C-N 3.27Å; W100-S102 PolarHBondContact O-N 3.41Å; W100-R103 WeakPolarHBondContact O-CB 3.22Å; W100-R103 PolarHBondContact O-N 3.45Å; W100-V104 HydrophobicContact CD2-CG2 4.38Å; W100-V104 HydrophobicContact CH2-CG2 4.29Å; W100-V104 HydrophobicContact CZ2-CG2 3.73Å; W100-V104 PolarHBondContact O-N 2.96Å; W100-A120 VanDerWaalsContact CH2-CA 3.48Å; W100-A120 HydrophobicContact CH2-CB 3.56Å; W100-A120 WeakPolarHBondContact CH2-O 3.5Å; W100-A120 HydrophobicContact CZ3-CB 3.85Å; W100-I123 HydrophobicContact CH2-CB 4.46Å; W100-I123 HydrophobicContact CZ2-CB 3.76Å; W100-I123 HydrophobicContact CZ2-CD1 3.97Å; W100-I123 HydrophobicContact CZ2-CG1 4.43Å; W100-I123 HydrophobicContact CZ2-CG2 3.84Å; W100-Q124 HydrophobicContact CH2-CB 4.08Å; W100-Q124 HydrophobicContact CZ3-CB 4.49Å; W100-V127 HydrophobicContact CH2-CG2 3.97Å; W100-V127 HydrophobicContact CZ3-CG2 3.53Å
101I93.6Very high81.9Confident0 Ų065.2 Ų65.20%042%0.416CS..Hα-helixtrans-59.9-40.8173.9-69.8162.3000110.6A97 E98 V104 H105 T116 V127 L131 V132 V135A97-I101 WeakPolarHBondContact O-CD1 3.4Å; A97-I101 WeakPolarHBondContact O-CG1 3.35Å; A97-I101 PolarHBondContact O-N 3.48Å; E98-I101 PolarHBondContact O-N 2.88Å; I101-V104 PolarHBondContact O-N 3.36Å; I101-H105 WeakPolarHBondContact O-CB 3.45Å; I101-H105 PolarHBondContact O-N 2.95Å; I101-T116 HydrophobicContact CG2-CG2 4.1Å; I101-V127 HydrophobicContact CD1-CG1 3.95Å; I101-V127 HydrophobicContact CG1-CG1 4.29Å; I101-L131 HydrophobicContact CD1-CB 4.13Å; I101-L131 HydrophobicContact CD1-CD2 3.57Å; I101-L131 HydrophobicContact CD1-CG 3.66Å; I101-V132 HydrophobicContact CD1-CG2 3.88Å; I101-V132 HydrophobicContact CG1-CG2 4.21Å; I101-V132 HydrophobicContact CG2-CB 4.27Å; I101-V132 HydrophobicContact CG2-CG1 4.18Å; I101-V132 HydrophobicContact CG2-CG2 3.92Å; I101-V135 HydrophobicContact CB-CG1 4.36Å; I101-V135 HydrophobicContact CB-CG2 4.19Å; I101-V135 HydrophobicContact CG2-CB 3.86Å; I101-V135 HydrophobicContact CG2-CG1 3.81Å; I101-V135 HydrophobicContact CG2-CG2 4.02Å
102S93.5Very high84.1Confident37 Ų3761.5 Ų61.526%0.25939%0.388SS..Hα-helixtrans-60.4-45.5178.1179.20000111E98 W100 V104 H105 H106E98-S102 WeakPolarHBondContact O-CB 3.41Å; E98-S102 PolarHBondContact O-N 2.89Å; W100-S102 VanDerWaalsContact C-N 3.27Å; W100-S102 PolarHBondContact O-N 3.41Å; S102-V104 PolarHBondContact O-N 3.27Å; S102-H105 WeakPolarHBondContact O-CB 3.22Å; S102-H105 PolarHBondContact O-N 3.21Å; S102-H105 VanDerWaalsContact O-N 3.16Å; S102-H106 PolarHBondContact O-CD2 2.62Å; S102-H106 PolarHBondContact O-N 3.09Å
103R92.4Very high86.5Confident137 Ų13760 Ų6052%0.51737%0.372SS..Hα-helixtrans-58-45.9173.1-78.1-175-85179.3-7.9112.6Q99 W100 H105 H106 A107Q99-R103 WeakPolarHBondContact O-CG 3.41Å; Q99-R103 PolarHBondContact O-N 3.33Å; Q99-R103 VanDerWaalsContact O-N 3.07Å; W100-R103 WeakPolarHBondContact O-CB 3.22Å; W100-R103 PolarHBondContact O-N 3.45Å; R103-H105 VanDerWaalsContact C-N 3.33Å; R103-H105 PolarHBondContact O-N 3.24Å; R103-H106 PolarHBondContact O-N 3.23Å; R103-A107 VanDerWaalsContact O-CB 3.23Å; R103-A107 WeakPolarHBondContact O-CB 3.23Å; R103-A107 PolarHBondContact O-N 3.49Å
104V93.1Very high88.8Confident20 Ų2067.4 Ų67.412%0.12138%0.381CS..Hα-helixtrans-62.1-41.5176.3172.90000111.3W100 I101 S102 A108 F119 I123W100-V104 HydrophobicContact CD2-CG2 4.38Å; W100-V104 HydrophobicContact CH2-CG2 4.29Å; W100-V104 HydrophobicContact CZ2-CG2 3.73Å; W100-V104 PolarHBondContact O-N 2.96Å; I101-V104 PolarHBondContact O-N 3.36Å; S102-V104 PolarHBondContact O-N 3.27Å; V104-A108 WeakPolarHBondContact O-CB 3.26Å; V104-A108 PolarHBondContact O-N 3.23Å; V104-A108 VanDerWaalsContact O-N 3.09Å; V104-F119 HydrophobicContact CG1-CB 3.63Å; V104-I123 HydrophobicContact CG2-CD1 4.42Å
105H95.6Very high91Very high0 Ų066.4 Ų66.40%036%0.363CS..Hα-helixtrans-63.6-46.3179.2178.454.2000112.4I101 S102 R103 H110 T116 C142I101-H105 WeakPolarHBondContact O-CB 3.45Å; I101-H105 PolarHBondContact O-N 2.95Å; S102-H105 WeakPolarHBondContact O-CB 3.22Å; S102-H105 PolarHBondContact O-N 3.21Å; S102-H105 VanDerWaalsContact O-N 3.16Å; R103-H105 VanDerWaalsContact C-N 3.33Å; R103-H105 PolarHBondContact O-N 3.24Å; H105-H110 AromaticContact CD2-ND1 3.69Å; H105-H110 VanDerWaalsContact CE1-CA 3.41Å; H105-H110 WeakPolarHBondContact CE1-CA 3.23Å; H105-H110 AromaticContact CE1-ND1 3.9Å; H105-H110 AromaticContact NE2-ND1 3.23Å; H105-H110 PolarHBondContact NE2-ND1 3.12Å; H105-H110 PolarHBondContact O-N 3.42Å; H105-T116 HydrophobicContact CB-CG2 3.79Å; H105-T116 PolarHBondContact ND1-OG1 3.22Å; H105-C142 PolarHBondContact NE2-SG 3.27Å
106H95.3Very high92.6Very high89 Ų8965.1 Ų65.141%0.41235%0.35SS..Hα-helixtrans-68.7-47.1179.5-67-174.4000111.2S102 R103 A108 G109 H110S102-H106 PolarHBondContact O-CD2 2.62Å; S102-H106 PolarHBondContact O-N 3.09Å; R103-H106 PolarHBondContact O-N 3.23Å; H106-A108 PolarHBondContact O-N 3.4Å; H106-G109 PolarHBondContact O-N 3.41Å; H106-H110 AromaticContact CD2-CE1 3.3Å; H106-H110 PolarHBondContact CD2-CE1 3.43Å; H106-H110 AromaticContact CD2-ND1 3.93Å; H106-H110 AromaticContact NE2-CE1 3.76Å
107A93Very high93.4Very high95 Ų9563.4 Ų63.479%0.78534%0.337SS*.Hα-helixtrans-62.6-29.3179.600000113R103 G109R103-A107 VanDerWaalsContact O-CB 3.23Å; R103-A107 WeakPolarHBondContact O-CB 3.23Å; R103-A107 PolarHBondContact O-N 3.49Å; A107-G109 VanDerWaalsContact C-N 3.28Å; A107-G109 PolarHBondContact O-N 2.93Å
108A91.9Very high93.9Very high37 Ų3767.1 Ų67.131%0.30634%0.34SS..THydrogen-bonded Turntrans-84.44.4176.300000114.1V104 H106 P111 F119V104-A108 WeakPolarHBondContact O-CB 3.26Å; V104-A108 PolarHBondContact O-N 3.23Å; V104-A108 VanDerWaalsContact O-N 3.09Å; H106-A108 PolarHBondContact O-N 3.4Å; A108-P111 HydrophobicContact CB-CG 3.85Å; A108-F119 HydrophobicContact CB-CD2 3.7Å; A108-F119 HydrophobicContact CB-CE2 3.81Å
109G94Very high94Very high54 Ų5466.6 Ų66.656%0.55734%0.337SS*.THydrogen-bonded Turntrans72.945.4177.700000113.5H106 A107H106-G109 PolarHBondContact O-N 3.41Å; A107-G109 VanDerWaalsContact C-N 3.28Å; A107-G109 PolarHBondContact O-N 2.93Å
110H95Very high94.2Very high60 Ų6061.3 Ų61.328%0.27831%0.312SS..SBendtrans53.149.7174.5-59-83.1000115.6H105 H106 G112 C139 C142H105-H110 AromaticContact CD2-ND1 3.69Å; H105-H110 VanDerWaalsContact CE1-CA 3.41Å; H105-H110 WeakPolarHBondContact CE1-CA 3.23Å; H105-H110 AromaticContact CE1-ND1 3.9Å; H105-H110 AromaticContact NE2-ND1 3.23Å; H105-H110 PolarHBondContact NE2-ND1 3.12Å; H105-H110 PolarHBondContact O-N 3.42Å; H106-H110 AromaticContact CD2-CE1 3.3Å; H106-H110 PolarHBondContact CD2-CE1 3.43Å; H106-H110 AromaticContact CD2-ND1 3.93Å; H106-H110 AromaticContact NE2-CE1 3.76Å; H110-G112 PolarHBondContact O-N 3.2Å; H110-C139 VanDerWaalsContact CE1-SG 3.53Å; H110-C139 PolarHBondContact ND1-SG 3.15Å; H110-C142 PolarHBondContact ND1-SG 3Å
111P93.9Very high94.3Very high34 Ų3464.3 Ų64.322%0.22132%0.323CS..  trans-79.912.2-16538.2-43.1000114.7A108 R115 F119A108-P111 HydrophobicContact CB-CG 3.85Å; P111-R115 HydrophobicContact CB-CB 3.58Å; P111-R115 HydrophobicContact CB-CG 4.3Å; P111-R115 HydrophobicContact CG-CB 3.77Å; P111-F119 HydrophobicContact CG-CD2 4.36Å; P111-F119 HydrophobicContact CG-CE2 4.19Å
112G94.9Very high94.1Very high27 Ų2772 Ų7228%0.27835%0.352SS..Hα-helixtrans72.4170.3-173.500000114.7H110 R114 R115 T116H110-G112 PolarHBondContact O-N 3.2Å; G112-R114 VanDerWaalsContact C-N 3.35Å; G112-R114 PolarHBondContact O-N 3Å; G112-R115 PolarHBondContact O-N 3.31Å; G112-T116 PolarHBondContact O-N 3.37Å; G112-T116 PolarHBondContact O-OG1 2.93Å
113V96.2Very high93.6Very high36 Ų3675.5 Ų75.522%0.21837%0.367CS..Hα-helixtrans-53.1-46.3-169.9-178.20000113.1R115 T116 V117 V132 R133 V136V113-R115 PolarHBondContact O-N 2.95Å; V113-T116 PolarHBondContact O-N 3Å; V113-V117 HydrophobicContact CG1-CG2 4.27Å; V113-V117 VanDerWaalsContact O-CG2 3.26Å; V113-V117 WeakPolarHBondContact O-CG2 3.39Å; V113-V117 PolarHBondContact O-N 3.22Å; V113-V132 HydrophobicContact CG1-CG1 4.45Å; V113-R133 HydrophobicContact CG1-CB 4.16Å; V113-R133 HydrophobicContact CG2-CB 4.41Å; V113-R133 HydrophobicContact CG2-CG 4.32Å; V113-V136 HydrophobicContact CG2-CB 3.94Å; V113-V136 HydrophobicContact CG2-CG1 3.89Å; V113-V136 HydrophobicContact CG2-CG2 4.28Å
114R96.1Very high93.3Very high219 Ų21973.3 Ų73.383%0.82636%0.363SS*.Hα-helixtrans-63.4-44.1-172.8-163176.883.6-177.35.5112.1G112 Y118G112-R114 VanDerWaalsContact C-N 3.35Å; G112-R114 PolarHBondContact O-N 3Å; R114-Y118 PolarHBondContact O-N 3.04Å
115R95.8Very high93.1Very high159 Ų15976.9 Ų76.960%0.639%0.386SS*.Hα-helixtrans-76.6-37.3178.9-81.3-175.5175.2177.73.6111.6P111 G112 V113 V117 Y118 F119P111-R115 HydrophobicContact CB-CB 3.58Å; P111-R115 HydrophobicContact CB-CG 4.3Å; P111-R115 HydrophobicContact CG-CB 3.77Å; G112-R115 PolarHBondContact O-N 3.31Å; V113-R115 PolarHBondContact O-N 2.95Å; R115-V117 VanDerWaalsContact C-N 3.32Å; R115-V117 PolarHBondContact O-N 2.85Å; R115-Y118 WeakPolarHBondContact O-CB 3.18Å; R115-Y118 PolarHBondContact O-N 3.24Å; R115-Y118 VanDerWaalsContact O-N 3.12Å; R115-F119 HydrophobicContact CB-CD2 4.46Å; R115-F119 HydrophobicContact CB-CE2 4.11Å; R115-F119 WeakPolarHBondContact O-CD2 3.11Å; R115-F119 PolarHBondContact O-N 3.06Å
116T96.2Very high92.7Very high0 Ų082.2 Ų82.20%042%0.419CS..Hα-helixtrans-59.5-43.1173.9-53.60000111.2I101 H105 G112 V113 Y118 F119 A120 V132 V136I101-T116 HydrophobicContact CG2-CG2 4.1Å; H105-T116 HydrophobicContact CB-CG2 3.79Å; H105-T116 PolarHBondContact ND1-OG1 3.22Å; G112-T116 PolarHBondContact O-N 3.37Å; G112-T116 PolarHBondContact O-OG1 2.93Å; V113-T116 PolarHBondContact O-N 3Å; T116-Y118 VanDerWaalsContact C-N 3.32Å; T116-Y118 PolarHBondContact O-N 3.37Å; T116-F119 PolarHBondContact O-N 3.47Å; T116-A120 VanDerWaalsContact O-CB 3.23Å; T116-A120 WeakPolarHBondContact O-CB 3.4Å; T116-A120 PolarHBondContact O-N 3.16Å; T116-V132 HydrophobicContact CG2-CG1 3.5Å; T116-V136 HydrophobicContact CG2-CG2 4.41Å
117V96.5Very high92.5Very high14 Ų1478.7 Ų78.79%0.08540%0.403CS..Hα-helixtrans-60-43.1174.41710000111.4V113 R115 A120 R121 K129 V132V113-V117 HydrophobicContact CG1-CG2 4.27Å; V113-V117 VanDerWaalsContact O-CG2 3.26Å; V113-V117 WeakPolarHBondContact O-CG2 3.39Å; V113-V117 PolarHBondContact O-N 3.22Å; R115-V117 VanDerWaalsContact C-N 3.32Å; R115-V117 PolarHBondContact O-N 2.85Å; V117-A120 PolarHBondContact O-N 3.07Å; V117-R121 HydrophobicContact CG1-CG 4.37Å; V117-R121 WeakPolarHBondContact O-CB 3.44Å; V117-R121 WeakPolarHBondContact O-CG 3.47Å; V117-R121 PolarHBondContact O-N 3.42Å; V117-K129 HydrophobicContact CG2-CB 4.34Å; V117-K129 HydrophobicContact CG2-CG 4.09Å; V117-V132 HydrophobicContact CG2-CB 3.69Å; V117-V132 HydrophobicContact CG2-CG1 3.65Å; V117-V132 HydrophobicContact CG2-CG2 3.92Å
118Y94.7Very high92.5Very high136 Ų13676.8 Ų76.853%0.53338%0.384SS..Hα-helixtrans-60.7-48.7178.6171.9-98.2000111.7R114 R115 T116 R122R114-Y118 PolarHBondContact O-N 3.04Å; R115-Y118 WeakPolarHBondContact O-CB 3.18Å; R115-Y118 PolarHBondContact O-N 3.24Å; R115-Y118 VanDerWaalsContact O-N 3.12Å; T116-Y118 VanDerWaalsContact C-N 3.32Å; T116-Y118 PolarHBondContact O-N 3.37Å; Y118-R122 PolarHBondContact O-N 3.46Å
119F93.7Very high92.7Very high76 Ų7680.4 Ų80.433%0.33339%0.393SS..Hα-helixtrans-66.4-42.6178.7-64.8-53.3000112.1V104 A108 P111 R115 T116 R121 R122V104-F119 HydrophobicContact CG1-CB 3.63Å; A108-F119 HydrophobicContact CB-CD2 3.7Å; A108-F119 HydrophobicContact CB-CE2 3.81Å; P111-F119 HydrophobicContact CG-CD2 4.36Å; P111-F119 HydrophobicContact CG-CE2 4.19Å; R115-F119 HydrophobicContact CB-CD2 4.46Å; R115-F119 HydrophobicContact CB-CE2 4.11Å; R115-F119 WeakPolarHBondContact O-CD2 3.11Å; R115-F119 PolarHBondContact O-N 3.06Å; T116-F119 PolarHBondContact O-N 3.47Å; F119-R121 PolarHBondContact O-N 2.94Å; F119-R122 PolarHBondContact O-N 2.91Å
120A92.4Very high92.8Very high0 Ų087.5 Ų87.50%040%0.403CS..Hα-helixtrans-59.6-46.917800000111.7W100 T116 V117 R122 I123 Q124 V127W100-A120 VanDerWaalsContact CH2-CA 3.48Å; W100-A120 HydrophobicContact CH2-CB 3.56Å; W100-A120 WeakPolarHBondContact CH2-O 3.5Å; W100-A120 HydrophobicContact CZ3-CB 3.85Å; T116-A120 VanDerWaalsContact O-CB 3.23Å; T116-A120 WeakPolarHBondContact O-CB 3.4Å; T116-A120 PolarHBondContact O-N 3.16Å; V117-A120 PolarHBondContact O-N 3.07Å; A120-R122 VanDerWaalsContact C-N 3.25Å; A120-R122 PolarHBondContact O-N 2.99Å; A120-I123 PolarHBondContact O-N 3.05Å; A120-Q124 PolarHBondContact O-N 3.07Å; A120-V127 HydrophobicContact CB-CB 4.44Å; A120-V127 HydrophobicContact CB-CG1 4.07Å; A120-V127 HydrophobicContact CB-CG2 4.42Å
121R93Very high92.8Very high120 Ų12086.3 Ų86.345%0.45340%0.399SS..Hα-helixtrans-68.6-18.5-177.5-75.6-178.9174.2-177.6-5.1115.2V117 F119 I123 Q124 V127V117-R121 HydrophobicContact CG1-CG 4.37Å; V117-R121 WeakPolarHBondContact O-CB 3.44Å; V117-R121 WeakPolarHBondContact O-CG 3.47Å; V117-R121 PolarHBondContact O-N 3.42Å; F119-R121 PolarHBondContact O-N 2.94Å; R121-I123 PolarHBondContact O-N 3.47Å; R121-Q124 WeakPolarHBondContact CA-O 3.26Å; R121-V127 HydrophobicContact CG-CB 4.43Å; R121-V127 PolarHBondContact NE-O 3.22Å; R121-V127 PolarHBondContact NH2-O 3.48Å
122R88.7Confident92.9Very high161 Ų16184.7 Ų84.761%0.60839%0.388SS*.Hα-helixtrans-68.8-22.6172.3-73.9-172.668.7-177.11112.8Y118 F119 A120Y118-R122 PolarHBondContact O-N 3.46Å; F119-R122 PolarHBondContact O-N 2.91Å; A120-R122 VanDerWaalsContact C-N 3.25Å; A120-R122 PolarHBondContact O-N 2.99Å
123I84Confident93Very high111 Ų11189.8 Ų89.857%0.56940%0.399SS*.Hα-helixtrans-102.6-52.8179.7-58170.4000109.2W100 V104 A120 R121W100-I123 HydrophobicContact CH2-CB 4.46Å; W100-I123 HydrophobicContact CZ2-CB 3.76Å; W100-I123 HydrophobicContact CZ2-CD1 3.97Å; W100-I123 HydrophobicContact CZ2-CG1 4.43Å; W100-I123 HydrophobicContact CZ2-CG2 3.84Å; V104-I123 HydrophobicContact CG2-CD1 4.42Å; A120-I123 PolarHBondContact O-N 3.05Å; R121-I123 PolarHBondContact O-N 3.47Å
124Q85.6Confident93Very high92 Ų9292.6 Ų92.643%0.4341%0.41SS..  trans-12297.7178.8-173.763.322.900110.5W100 A120 R121 T126 V127W100-Q124 HydrophobicContact CH2-CB 4.08Å; W100-Q124 HydrophobicContact CZ3-CB 4.49Å; A120-Q124 PolarHBondContact O-N 3.07Å; R121-Q124 WeakPolarHBondContact CA-O 3.26Å; Q124-T126 PolarHBondContact NE2-OG1 3.31Å; Q124-T126 PolarHBondContact O-N 2.98Å; Q124-T126 VanDerWaalsContact O-N 3.11Å; Q124-V127 HydrophobicContact CB-CG2 3.73Å; Q124-V127 HydrophobicContact CG-CG2 3.86Å; Q124-V127 WeakPolarHBondContact O-CG2 3.46Å; Q124-V127 PolarHBondContact O-N 3.39Å
125P88.1Confident93Very high94 Ų9482.9 Ų82.961%0.6138%0.375SS*.THydrogen-bonded Turntrans-59.6-27.1-174.5-27.135.6000114.6V127P125-V127 VanDerWaalsContact C-N 3.28Å; P125-V127 PolarHBondContact O-N 3.29Å
126T88.3Confident93Very high113 Ų11376 Ų7669%0.69335%0.351SS*.THydrogen-bonded Turntrans-81.31-17659.60000114.5Q124 S128Q124-T126 PolarHBondContact NE2-OG1 3.31Å; Q124-T126 PolarHBondContact O-N 2.98Å; Q124-T126 VanDerWaalsContact O-N 3.11Å; T126-S128 PolarHBondContact O-N 3.05Å
127V90.3Very high92.9Very high14 Ų1480 Ų809%0.08538%0.375CS..  trans-60.2126.7-179170.60000111.4W100 I101 A120 R121 Q124 P125 V132W100-V127 HydrophobicContact CH2-CG2 3.97Å; W100-V127 HydrophobicContact CZ3-CG2 3.53Å; I101-V127 HydrophobicContact CD1-CG1 3.95Å; I101-V127 HydrophobicContact CG1-CG1 4.29Å; A120-V127 HydrophobicContact CB-CB 4.44Å; A120-V127 HydrophobicContact CB-CG1 4.07Å; A120-V127 HydrophobicContact CB-CG2 4.42Å; R121-V127 HydrophobicContact CG-CB 4.43Å; R121-V127 PolarHBondContact NE-O 3.22Å; R121-V127 PolarHBondContact NH2-O 3.48Å; Q124-V127 HydrophobicContact CB-CG2 3.73Å; Q124-V127 HydrophobicContact CG-CG2 3.86Å; Q124-V127 WeakPolarHBondContact O-CG2 3.46Å; Q124-V127 PolarHBondContact O-N 3.39Å; P125-V127 VanDerWaalsContact C-N 3.28Å; P125-V127 PolarHBondContact O-N 3.29Å; V127-V132 HydrophobicContact CG1-CG2 3.43Å; V127-V132 VanDerWaalsContact CG1-CG2 3.43Å
128S92.9Very high92.9Very high55 Ų5583.6 Ų83.639%0.38539%0.394SS..  trans-77.6135.317991.50000110.8T126 R130 L131 V132T126-S128 PolarHBondContact O-N 3.05Å; S128-R130 PolarHBondContact O-N 3.2Å; S128-L131 PolarHBondContact O-N 3Å; S128-L131 VanDerWaalsContact OG-CB 3.26Å; S128-L131 WeakPolarHBondContact OG-CB 3.28Å; S128-L131 PolarHBondContact OG-N 3.24Å; S128-L131 VanDerWaalsContact OG-N 3.07Å; S128-V132 PolarHBondContact O-N 2.81Å
129K95.9Very high92.9Very high113 Ų11377.6 Ų77.649%0.49137%0.372SS..Hα-helixtrans-62.3-29.4175.3179.6173.3-178.9-175.10111.9V117 R133V117-K129 HydrophobicContact CG2-CB 4.34Å; V117-K129 HydrophobicContact CG2-CG 4.09Å; K129-R133 WeakPolarHBondContact O-CB 3.5Å; K129-R133 PolarHBondContact O-N 3.5Å
130R96.3Very high92.9Very high203 Ų20381.1 Ų81.177%0.76639%0.389SS*.Hα-helixtrans-63.8-48.1177.6-177.7177.2176.1164.2-0.5110.9S128 V132 R133 Q134S128-R130 PolarHBondContact O-N 3.2Å; R130-V132 PolarHBondContact O-N 3.23Å; R130-R133 WeakPolarHBondContact O-CB 3.44Å; R130-R133 PolarHBondContact O-N 2.95Å; R130-Q134 PolarHBondContact O-N 3.31Å
131L94.9Very high92.9Very high36 Ų3685.4 Ų85.419%0.18842%0.415CS..Hα-helixtrans-63.5-43.5179-168.762.6000111.4A97 E98 I101 S128 R133 Q134 V135A97-L131 HydrophobicContact CB-CD2 3.7Å; E98-L131 HydrophobicContact CG-CD1 3.57Å; E98-L131 HydrophobicContact CG-CD2 4.37Å; E98-L131 HydrophobicContact CG-CG 4.16Å; I101-L131 HydrophobicContact CD1-CB 4.13Å; I101-L131 HydrophobicContact CD1-CD2 3.57Å; I101-L131 HydrophobicContact CD1-CG 3.66Å; S128-L131 PolarHBondContact O-N 3Å; S128-L131 VanDerWaalsContact OG-CB 3.26Å; S128-L131 WeakPolarHBondContact OG-CB 3.28Å; S128-L131 PolarHBondContact OG-N 3.24Å; S128-L131 VanDerWaalsContact OG-N 3.07Å; L131-R133 VanDerWaalsContact C-N 3.31Å; L131-R133 PolarHBondContact O-N 3.47Å; L131-Q134 WeakPolarHBondContact O-CB 3.45Å; L131-Q134 PolarHBondContact O-N 3.16Å; L131-V135 WeakPolarHBondContact O-CG2 3.32Å; L131-V135 PolarHBondContact O-N 3.35Å
132V96.3Very high92.9Very high0 Ų081.9 Ų81.90%041%0.408CS..Hα-helixtrans-61.9-39.8175.8179.70000112.1I101 V113 T116 V117 V127 S128 R130 Q134 V135 V136I101-V132 HydrophobicContact CD1-CG2 3.88Å; I101-V132 HydrophobicContact CG1-CG2 4.21Å; I101-V132 HydrophobicContact CG2-CB 4.27Å; I101-V132 HydrophobicContact CG2-CG1 4.18Å; I101-V132 HydrophobicContact CG2-CG2 3.92Å; V113-V132 HydrophobicContact CG1-CG1 4.45Å; T116-V132 HydrophobicContact CG2-CG1 3.5Å; V117-V132 HydrophobicContact CG2-CB 3.69Å; V117-V132 HydrophobicContact CG2-CG1 3.65Å; V117-V132 HydrophobicContact CG2-CG2 3.92Å; V127-V132 HydrophobicContact CG1-CG2 3.43Å; V127-V132 VanDerWaalsContact CG1-CG2 3.43Å; S128-V132 PolarHBondContact O-N 2.81Å; R130-V132 PolarHBondContact O-N 3.23Å; V132-Q134 VanDerWaalsContact C-N 3.34Å; V132-V135 PolarHBondContact O-N 3.23Å; V132-V136 HydrophobicContact CG1-CG2 4.31Å; V132-V136 VanDerWaalsContact O-CG2 3.28Å; V132-V136 WeakPolarHBondContact O-CG2 3.41Å; V132-V136 PolarHBondContact O-N 3.28Å
133R97.1Very high92.9Very high134 Ų13481.9 Ų81.951%0.50641%0.408SS..Hα-helixtrans-60.2-46.5175.7-177.8-178-71.7146.7-9.2110.8V113 K129 R130 L131 V136 T137V113-R133 HydrophobicContact CG1-CB 4.16Å; V113-R133 HydrophobicContact CG2-CB 4.41Å; V113-R133 HydrophobicContact CG2-CG 4.32Å; K129-R133 WeakPolarHBondContact O-CB 3.5Å; K129-R133 PolarHBondContact O-N 3.5Å; R130-R133 WeakPolarHBondContact O-CB 3.44Å; R130-R133 PolarHBondContact O-N 2.95Å; L131-R133 VanDerWaalsContact C-N 3.31Å; L131-R133 PolarHBondContact O-N 3.47Å; R133-V136 PolarHBondContact O-N 3.3Å; R133-T137 WeakPolarHBondContact O-CB 3.48Å; R133-T137 PolarHBondContact O-N 3.49Å; R133-T137 PolarHBondContact O-OG1 3.05Å; R133-T137 VanDerWaalsContact O-OG1 3.05Å
134Q96.2Very high92.5Very high95 Ų9584.8 Ų84.844%0.44443%0.431SS..Hα-helixtrans-58.7-51.4178.5-175.1171-3.600111.4R130 L131 V132 V136 T137 D138R130-Q134 PolarHBondContact O-N 3.31Å; L131-Q134 WeakPolarHBondContact O-CB 3.45Å; L131-Q134 PolarHBondContact O-N 3.16Å; V132-Q134 VanDerWaalsContact C-N 3.34Å; Q134-V136 VanDerWaalsContact C-N 3.29Å; Q134-V136 PolarHBondContact O-N 2.87Å; Q134-T137 PolarHBondContact O-N 3.05Å; Q134-D138 WeakPolarHBondContact CG-OD2 3.41Å; Q134-D138 VanDerWaalsContact O-CG 3.25Å; Q134-D138 PolarHBondContact O-N 3.04Å
135V95.8Very high92.9Very high15 Ų1584.5 Ų84.59%0.09143%0.431CS..Hα-helixtrans-57.1-40.1178172.90000112.9E98 I101 L131 V132 C139E98-V135 HydrophobicContact CB-CG2 3.99Å; E98-V135 HydrophobicContact CG-CG2 4.24Å; I101-V135 HydrophobicContact CB-CG1 4.36Å; I101-V135 HydrophobicContact CB-CG2 4.19Å; I101-V135 HydrophobicContact CG2-CB 3.86Å; I101-V135 HydrophobicContact CG2-CG1 3.81Å; I101-V135 HydrophobicContact CG2-CG2 4.02Å; L131-V135 WeakPolarHBondContact O-CG2 3.32Å; L131-V135 PolarHBondContact O-N 3.35Å; V132-V135 PolarHBondContact O-N 3.23Å; V135-C139 PolarHBondContact O-N 2.9Å; V135-C139 VanDerWaalsContact O-N 3.17Å
136V95.9Very high93.1Very high15 Ų1583.9 Ų83.99%0.09142%0.422CS..Hα-helixtrans-71.9-36.9177.8174.20000111.5V113 T116 V132 R133 Q134 D138 C139V113-V136 HydrophobicContact CG2-CB 3.94Å; V113-V136 HydrophobicContact CG2-CG1 3.89Å; V113-V136 HydrophobicContact CG2-CG2 4.28Å; T116-V136 HydrophobicContact CG2-CG2 4.41Å; V132-V136 HydrophobicContact CG1-CG2 4.31Å; V132-V136 VanDerWaalsContact O-CG2 3.28Å; V132-V136 WeakPolarHBondContact O-CG2 3.41Å; V132-V136 PolarHBondContact O-N 3.28Å; R133-V136 PolarHBondContact O-N 3.3Å; Q134-V136 VanDerWaalsContact C-N 3.29Å; Q134-V136 PolarHBondContact O-N 2.87Å; V136-D138 VanDerWaalsContact C-N 3.33Å; V136-C139 WeakPolarHBondContact O-CB 3.35Å; V136-C139 PolarHBondContact O-N 3.17Å
137T95.5Very high93.4Very high84 Ų8482.3 Ų82.352%0.51541%0.407SS..Hα-helixtrans-66.7-35.6175.4-65.10000111.9R133 Q134 C139 R143R133-T137 WeakPolarHBondContact O-CB 3.48Å; R133-T137 PolarHBondContact O-N 3.49Å; R133-T137 PolarHBondContact O-OG1 3.05Å; R133-T137 VanDerWaalsContact O-OG1 3.05Å; Q134-T137 PolarHBondContact O-N 3.05Å; T137-C139 VanDerWaalsContact C-N 3.33Å; T137-R143 VanDerWaalsContact O-CD 3.26Å; T137-R143 WeakPolarHBondContact O-CD 3.26Å; T137-R143 VanDerWaalsContact O-CG 3.26Å; T137-R143 WeakPolarHBondContact O-CG 3.26Å
138D95Very high93.6Very high89 Ų8986.4 Ų86.448%0.47643%0.426SS..Hα-helixtrans-81.6-14.4-179.3-61.9-23000112.7Q134 V136 E140 R143Q134-D138 WeakPolarHBondContact CG-OD2 3.41Å; Q134-D138 VanDerWaalsContact O-CG 3.25Å; Q134-D138 PolarHBondContact O-N 3.04Å; V136-D138 VanDerWaalsContact C-N 3.33Å; D138-E140 PolarHBondContact O-N 3.46Å; D138-R143 PolarHBondContact O-NE 3.01Å; D138-R143 PolarHBondContact O-NH2 3.41Å
139C95.8Very high93.6Very high10 Ų1088.3 Ų88.37%0.06843%0.429CS..  trans-62.3117.5178.8-176.70000111.4H110 V135 V136 T137 V141 C142 R143H110-C139 VanDerWaalsContact CE1-SG 3.53Å; H110-C139 PolarHBondContact ND1-SG 3.15Å; V135-C139 PolarHBondContact O-N 2.9Å; V135-C139 VanDerWaalsContact O-N 3.17Å; V136-C139 WeakPolarHBondContact O-CB 3.35Å; V136-C139 PolarHBondContact O-N 3.17Å; T137-C139 VanDerWaalsContact C-N 3.33Å; C139-V141 VanDerWaalsContact C-N 3.33Å; C139-V141 PolarHBondContact O-N 3.21Å; C139-C142 HydrophobicContact CB-CB 4.09Å; C139-C142 PolarHBondContact O-N 3.38Å; C139-C142 VanDerWaalsContact O-N 3.15Å; C139-R143 WeakPolarHBondContact O-CG 3.49Å; C139-R143 PolarHBondContact O-N 3.17Å
140E93.5Very high93.5Very high150 Ų15086.7 Ų86.770%0.70142%0.424SS*.Hα-helixtrans-57.8-43.4-179.2-69.2178.3175.200112.5D138 C142 R143D138-E140 PolarHBondContact O-N 3.46Å; E140-C142 PolarHBondContact O-N 3.29Å; E140-R143 PolarHBondContact O-N 3.06Å
141V92.4Very high93.3Very high89 Ų8978.4 Ų78.454%0.53940%0.4SS..Hα-helixtrans-64.6-28.3179.8-177.40000112.4C139 T144C139-V141 VanDerWaalsContact C-N 3.33Å; C139-V141 PolarHBondContact O-N 3.21Å; V141-T144 PolarHBondContact O-OG1 3.17Å; V141-T144 VanDerWaalsContact O-OG1 3.06Å
142C92.9Very high93.2Very high47 Ų4781.6 Ų81.632%0.31842%0.416SS..Hα-helixtrans-90.8-11.2178.7-65.10000113.8H105 H110 C139 E140H105-C142 PolarHBondContact NE2-SG 3.27Å; H110-C142 PolarHBondContact ND1-SG 3Å; C139-C142 HydrophobicContact CB-CB 4.09Å; C139-C142 PolarHBondContact O-N 3.38Å; C139-C142 VanDerWaalsContact O-N 3.15Å; E140-C142 PolarHBondContact O-N 3.29Å
143R88.2Confident92.9Very high161 Ų16188.4 Ų88.461%0.60845%0.451SS*.Hα-helixtrans-85.6-19.1178.9-79.9-170.9-76.4162.9-4.8113.3T137 D138 C139 E140T137-R143 VanDerWaalsContact O-CD 3.26Å; T137-R143 WeakPolarHBondContact O-CD 3.26Å; T137-R143 VanDerWaalsContact O-CG 3.26Å; T137-R143 WeakPolarHBondContact O-CG 3.26Å; D138-R143 PolarHBondContact O-NE 3.01Å; D138-R143 PolarHBondContact O-NH2 3.41Å; C139-R143 WeakPolarHBondContact O-CG 3.49Å; C139-R143 PolarHBondContact O-N 3.17Å; E140-R143 PolarHBondContact O-N 3.06Å
144T76.5Confident92.5Very high172 Ų17284.3 Ų84.3100%1.05545%0.446SS*.  trans-77.2017152.70000111.3V141V141-T144 PolarHBondContact O-OG1 3.17Å; V141-T144 VanDerWaalsContact O-OG1 3.06Å

Retrieved 144 of 144 residues in 30.1 ms (Link to these results)

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