A0A087WZ35_HUMAN Loading...

DNA repair protein RAD51 homolog 3

AlphaFold DB , UniProt , Accession A0A087WZ35, Species HUMAN (Homo sapiens, Human), Gene RAD51C, Length 131 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
1E65.7Low73.4Confident186 Ų186114.1 Ų114.187%0.86958%0.577SS**  0-80.50-66.8-173.217700113.6L3 E4 Q5E1-L3 PolarHBondContact O-N 2.71Å; E1-E4 WeakPolarHBondContact CA-OE2 3.41Å; E1-E4 PolarHBondContact N-OE2 3.45Å; E1-E4 PolarHBondContact O-N 3.3Å; E1-Q5 WeakPolarHBondContact O-CG 3.45Å; E1-Q5 PolarHBondContact O-N 2.82Å
2L72.4Confident75.4Confident147 Ų147106.8 Ų106.877%0.7754%0.54SS*.Hα-helixtrans-60.2-41.8-177.5-88.1159000114.5Q5 E6L2-Q5 PolarHBondContact O-N 3.21Å; L2-E6 PolarHBondContact O-N 3.42Å
3L68.2Low77.1Confident128 Ų128100 Ų10067%0.6751%0.506SS*.Hα-helixtrans-67-35.9176.5-74165.1000112.4E1 E6 H7E1-L3 PolarHBondContact O-N 2.71Å; L3-E6 WeakPolarHBondContact O-CB 3.41Å; L3-E6 PolarHBondContact O-N 3.27Å; L3-H7 PolarHBondContact O-CD2 3.22Å; L3-H7 PolarHBondContact O-N 3.44Å
4E68.9Low78.5Confident130 Ų13093.9 Ų93.961%0.60748%0.476SS*.Hα-helixtrans-71.3-35.2178.2-70.2160.514900111.1E1 E6 H7 T8E1-E4 WeakPolarHBondContact CA-OE2 3.41Å; E1-E4 PolarHBondContact N-OE2 3.45Å; E1-E4 PolarHBondContact O-N 3.3Å; E4-E6 VanDerWaalsContact C-N 3.28Å; E4-E6 PolarHBondContact O-N 3.39Å; E4-H7 PolarHBondContact O-N 3.19Å; E4-T8 PolarHBondContact O-N 3.01Å
5Q65.6Low79.5Confident121 Ų12192.7 Ų92.757%0.56547%0.466SS*.Hα-helixtrans-61.3-37.9171.5-73.3176.8-32.400111.7E1 L2 H7 T8E1-Q5 WeakPolarHBondContact O-CG 3.45Å; E1-Q5 PolarHBondContact O-N 2.82Å; L2-Q5 PolarHBondContact O-N 3.21Å; Q5-H7 VanDerWaalsContact C-N 3.32Å; Q5-H7 PolarHBondContact O-N 2.78Å; Q5-T8 PolarHBondContact O-N 3.37Å; Q5-T8 PolarHBondContact O-OG1 2.88Å
6E67.1Low80.5Confident91 Ų9190.8 Ų90.843%0.42546%0.463SS..Hα-helixtrans-63.1-36.1177.2-161.5-175.3167.900112.6L2 L3 E4 T8 Q9 K31L2-E6 PolarHBondContact O-N 3.42Å; L3-E6 WeakPolarHBondContact O-CB 3.41Å; L3-E6 PolarHBondContact O-N 3.27Å; E4-E6 VanDerWaalsContact C-N 3.28Å; E4-E6 PolarHBondContact O-N 3.39Å; E6-T8 VanDerWaalsContact C-N 3.26Å; E6-T8 PolarHBondContact O-N 3.15Å; E6-Q9 PolarHBondContact O-N 3.35Å; E6-K31 IonicContact OE1-NZ 2.73Å; E6-K31 PolarHBondContact OE1-NZ 3.06Å
7H65.4Low81.3Confident166 Ų16690.6 Ų90.677%0.76947%0.473SS*.Hα-helixtrans-74.1-13.8177.8-77.7-71000114.3L3 E4 Q5L3-H7 PolarHBondContact O-CD2 3.22Å; L3-H7 PolarHBondContact O-N 3.44Å; E4-H7 PolarHBondContact O-N 3.19Å; Q5-H7 VanDerWaalsContact C-N 3.32Å; Q5-H7 PolarHBondContact O-N 2.78Å
8T68.6Low82.2Confident115 Ų11588.8 Ų88.871%0.70647%0.473SS*.THydrogen-bonded Turntrans-983.8178.657.40000113.8E4 Q5 E6 G10E4-T8 PolarHBondContact O-N 3.01Å; Q5-T8 PolarHBondContact O-N 3.37Å; Q5-T8 PolarHBondContact O-OG1 2.88Å; E6-T8 VanDerWaalsContact C-N 3.26Å; E6-T8 PolarHBondContact O-N 3.15Å; T8-G10 PolarHBondContact O-N 2.97Å
9Q78.2Confident82.9Confident56 Ų5686.7 Ų86.726%0.26246%0.461SS..  trans-72.5131.3-177.6-71.4178.2-18.200111.1E6 L29 M30E6-Q9 PolarHBondContact O-N 3.35Å; Q9-L29 PolarHBondContact OE1-O 2.79Å; Q9-M30 HydrophobicContact CG-SD 4.26Å; Q9-M30 PolarHBondContact NE2-SD 3.03Å; Q9-M30 VanDerWaalsContact NE2-SD 3.44Å
10G91.1Very high83.5Confident33 Ų3383.4 Ų83.434%0.3444%0.443SS..  trans-71.5179.317400000112.6T8 L29T8-G10 PolarHBondContact O-N 2.97Å; G10-L29 VanDerWaalsContact O-CB 3.32Å; G10-L29 WeakPolarHBondContact O-CB 3.08Å; G10-L29 WeakPolarHBondContact O-CG 3.49Å; G10-L29 PolarHBondContact O-N 3.23Å
11F96.3Very high84.1Confident82 Ų8285.3 Ų85.336%0.3645%0.454SS..EExtended strand (participates in β ladder)trans-138.3156.9-179.841.9-98.2000110.3I13 G25 V27 V63F11-I13 HydrophobicContact CD2-CG2 3.6Å; F11-I13 HydrophobicContact CE2-CG2 3.5Å; F11-G25 WeakPolarHBondContact CD2-O 3.42Å; F11-G25 VanDerWaalsContact CE2-O 3.28Å; F11-G25 WeakPolarHBondContact CE2-O 3.5Å; F11-V27 CarbonylContact C-O 3.59Å; F11-V27 VanDerWaalsContact CA-O 3.23Å; F11-V27 WeakPolarHBondContact CA-O 3.41Å; F11-V27 WeakPolarHBondContact CB-O 3.11Å; F11-V63 WeakPolarHBondContact O-CG1 3.46Å
12I97.9Very high85.5Confident26 Ų2683.2 Ų83.213%0.13345%0.447CS..EExtended strand (participates in β ladder)trans-87.5111.7165.3-56.3169.7000106.5G26 V27 L29 L50 D53 V54 V63I12-G26 CarbonylContact O-C 3.49Å; I12-G26 WeakPolarHBondContact O-CA 3.43Å; I12-V27 HydrophobicContact CB-CB 4.37Å; I12-V27 PolarHBondContact N-O 3.43Å; I12-V27 PolarHBondContact O-N 3.36Å; I12-L29 HydrophobicContact CD1-CD2 4.17Å; I12-L29 HydrophobicContact CG1-CD2 3.83Å; I12-L50 HydrophobicContact CG2-CD2 4.19Å; I12-D53 HydrophobicContact CG2-CB 3.8Å; I12-V54 HydrophobicContact CD1-CB 4.13Å; I12-V54 HydrophobicContact CD1-CG2 3.89Å; I12-V54 HydrophobicContact CG1-CG2 4.22Å; I12-V54 HydrophobicContact CG2-CB 4.42Å; I12-V63 HydrophobicContact CG1-CG2 4.44Å
13I97.3Very high86.5Confident19 Ų1979.5 Ų79.510%0.09743%0.428CS..  trans-67145.1174.458170.6000110.7F11 F15 D53 I56 F60F11-I13 HydrophobicContact CD2-CG2 3.6Å; F11-I13 HydrophobicContact CE2-CG2 3.5Å; I13-F15 HydrophobicContact CD1-CD1 4.48Å; I13-F15 HydrophobicContact CD1-CD2 4.47Å; I13-F15 HydrophobicContact CD1-CE1 3.97Å; I13-F15 HydrophobicContact CD1-CE2 4.01Å; I13-F15 HydrophobicContact CD1-CZ 3.7Å; I13-D53 WeakPolarHBondContact O-CB 3.19Å; I13-I56 HydrophobicContact CD1-CD1 4.23Å; I13-I56 HydrophobicContact CD1-CG2 4.32Å; I13-I56 HydrophobicContact CG1-CD1 4.02Å; I13-F60 WeakPolarHBondContact CD1-O 3.48Å
14T95.9Very high87.6Confident14 Ų1476.7 Ų76.79%0.08643%0.43CS..  trans-105.4-4.7179.768.60000113.6C16 L19 D20 V27 L50T14-C16 PolarHBondContact O-N 3.44Å; T14-C16 PolarHBondContact OG1-N 3.39Å; T14-L19 HydrophobicContact CG2-CD2 3.91Å; T14-L19 HydrophobicContact CG2-CG 4.38Å; T14-D20 WeakPolarHBondContact CB-OD1 3.34Å; T14-D20 WeakPolarHBondContact CG2-OD1 3.3Å; T14-D20 PolarHBondContact N-OD1 3.18Å; T14-D20 PolarHBondContact N-OD2 2.92Å; T14-D20 VanDerWaalsContact OG1-CG 3.27Å; T14-D20 PolarHBondContact OG1-OD1 3.41Å; T14-D20 PolarHBondContact OG1-OD2 3.5Å; T14-V27 HydrophobicContact CG2-CG2 4.44Å; T14-L50 HydrophobicContact CG2-CD2 3.91Å
15F94.5Very high88.7Confident76 Ų7671.6 Ų71.633%0.33341%0.412SS..SBendtrans5513-168.7-75.2-63000114.3I13 D20 I56 H91 L92 I95I13-F15 HydrophobicContact CD1-CD1 4.48Å; I13-F15 HydrophobicContact CD1-CD2 4.47Å; I13-F15 HydrophobicContact CD1-CE1 3.97Å; I13-F15 HydrophobicContact CD1-CE2 4.01Å; I13-F15 HydrophobicContact CD1-CZ 3.7Å; F15-D20 PolarHBondContact N-OD2 3.49Å; F15-I56 HydrophobicContact CD2-CD1 3.67Å; F15-I56 HydrophobicContact CE2-CD1 3.29Å; F15-I56 HydrophobicContact CE2-CG1 4.04Å; F15-I56 HydrophobicContact CE2-CG2 4.23Å; F15-I56 HydrophobicContact CZ-CD1 4.31Å; F15-I56 HydrophobicContact CZ-CG2 4.37Å; F15-H91 AromaticContact CD1-CD2 3.89Å; F15-H91 AromaticContact CD1-NE2 3.54Å; F15-H91 AromaticContact CE1-NE2 3.89Å; F15-H91 AromaticContact CG-CD2 3.89Å; F15-H91 AromaticContact CG-NE2 3.87Å; F15-L92 HydrophobicContact CE2-CD2 3.76Å; F15-L92 HydrophobicContact CZ-CD2 3.58Å; F15-I95 HydrophobicContact CE1-CD1 3.88Å; F15-I95 HydrophobicContact CZ-CD1 4.19Å
16C95.4Very high90.2Very high62 Ų6265.9 Ų65.942%0.41939%0.386SS..  trans-107.698.5169.9177.70000107.5T14 A18 L19 D20T14-C16 PolarHBondContact O-N 3.44Å; T14-C16 PolarHBondContact OG1-N 3.39Å; C16-A18 PolarHBondContact O-N 3.2Å; C16-A18 VanDerWaalsContact O-N 3.14Å; C16-L19 HydrophobicContact CB-CB 3.88Å; C16-L19 PolarHBondContact O-N 3.34Å; C16-D20 PolarHBondContact O-N 3.36Å
17S94.2Very high91.6Very high89 Ų8962.5 Ų62.562%0.62237%0.371SS*.Hα-helixtrans-53.5-41.5-174.764.10000112.4L19 D20 D21S17-L19 VanDerWaalsContact C-N 3.32Å; S17-L19 PolarHBondContact O-N 3.29Å; S17-D20 PolarHBondContact O-N 3.48Å; S17-D21 VanDerWaalsContact O-CB 3.24Å; S17-D21 WeakPolarHBondContact O-CB 3.39Å; S17-D21 PolarHBondContact O-N 3.42Å
18A96.7Very high93Very high57 Ų5756.4 Ų56.447%0.47135%0.347SS..Hα-helixtrans-63.6-36.1178.200000113.1C16 I22C16-A18 PolarHBondContact O-N 3.2Å; C16-A18 VanDerWaalsContact O-N 3.14Å; A18-I22 WeakPolarHBondContact O-CD1 3.3Å; A18-I22 VanDerWaalsContact O-CG1 3.23Å; A18-I22 WeakPolarHBondContact O-CG1 3.28Å; A18-I22 PolarHBondContact O-N 3.45Å
19L95.1Very high94.2Very high49 Ų4953.8 Ų53.826%0.25733%0.328SS..Hα-helixtrans-75.6-44.9177.5-179.558.1000110.9T14 C16 S17 D21 I22 L23 L46T14-L19 HydrophobicContact CG2-CD2 3.91Å; T14-L19 HydrophobicContact CG2-CG 4.38Å; C16-L19 HydrophobicContact CB-CB 3.88Å; C16-L19 PolarHBondContact O-N 3.34Å; S17-L19 VanDerWaalsContact C-N 3.32Å; S17-L19 PolarHBondContact O-N 3.29Å; L19-D21 VanDerWaalsContact C-N 3.3Å; L19-D21 PolarHBondContact O-N 3.19Å; L19-I22 PolarHBondContact O-N 3.26Å; L19-L23 HydrophobicContact CD1-CD1 3.91Å; L19-L23 HydrophobicContact CD1-CG 4.21Å; L19-L23 HydrophobicContact CG-CD1 3.97Å; L19-L23 WeakPolarHBondContact O-CG 3.47Å; L19-L23 PolarHBondContact O-N 3.2Å; L19-L46 HydrophobicContact CD2-CD1 4.03Å
20D95.8Very high94.8Very high20 Ų2059.2 Ų59.211%0.10736%0.355CS..Hα-helixtrans-59.7-42.7176.7-67.7-21.9000110.4T14 F15 C16 S17 I22 L23 G24 G25T14-D20 WeakPolarHBondContact CB-OD1 3.34Å; T14-D20 WeakPolarHBondContact CG2-OD1 3.3Å; T14-D20 PolarHBondContact N-OD1 3.18Å; T14-D20 PolarHBondContact N-OD2 2.92Å; T14-D20 VanDerWaalsContact OG1-CG 3.27Å; T14-D20 PolarHBondContact OG1-OD1 3.41Å; T14-D20 PolarHBondContact OG1-OD2 3.5Å; F15-D20 PolarHBondContact N-OD2 3.49Å; C16-D20 PolarHBondContact O-N 3.36Å; S17-D20 PolarHBondContact O-N 3.48Å; D20-I22 PolarHBondContact O-N 3.28Å; D20-L23 CarbonylContact O-C 3.48Å; D20-L23 PolarHBondContact O-N 3.09Å; D20-G24 PolarHBondContact O-N 3.34Å; D20-G25 PolarHBondContact O-N 3.37Å
21D95.5Very high94.8Very high125 Ų12562 Ų6267%0.66836%0.358SS*.Hα-helixtrans-61.4-43.9176.7-71.1-21.1000112.2S17 L19 L23 G24S17-D21 VanDerWaalsContact O-CB 3.24Å; S17-D21 WeakPolarHBondContact O-CB 3.39Å; S17-D21 PolarHBondContact O-N 3.42Å; L19-D21 VanDerWaalsContact C-N 3.3Å; L19-D21 PolarHBondContact O-N 3.19Å; D21-L23 VanDerWaalsContact C-N 3.26Å; D21-L23 PolarHBondContact O-N 3.47Å; D21-G24 PolarHBondContact O-N 3.28Å
22I95.6Very high94.7Very high142 Ų14265 Ų6573%0.72838%0.384SS*.Hα-helixtrans-64.6-33.3177.3-71.5167.4000111.3A18 L19 D20A18-I22 WeakPolarHBondContact O-CD1 3.3Å; A18-I22 VanDerWaalsContact O-CG1 3.23Å; A18-I22 WeakPolarHBondContact O-CG1 3.28Å; A18-I22 PolarHBondContact O-N 3.45Å; L19-I22 PolarHBondContact O-N 3.26Å; D20-I22 PolarHBondContact O-N 3.28Å
23L93.2Very high94.5Very high68 Ų6866.7 Ų66.736%0.35640%0.395SS..Hα-helixtrans-88.9-4.8179.8-63174.5000113.7L19 D20 D21 G26 V27L19-L23 HydrophobicContact CD1-CD1 3.91Å; L19-L23 HydrophobicContact CD1-CG 4.21Å; L19-L23 HydrophobicContact CG-CD1 3.97Å; L19-L23 WeakPolarHBondContact O-CG 3.47Å; L19-L23 PolarHBondContact O-N 3.2Å; D20-L23 CarbonylContact O-C 3.48Å; D20-L23 PolarHBondContact O-N 3.09Å; D21-L23 VanDerWaalsContact C-N 3.26Å; D21-L23 PolarHBondContact O-N 3.47Å; L23-G26 VanDerWaalsContact CB-O 3.26Å; L23-G26 WeakPolarHBondContact CB-O 3.39Å; L23-V27 HydrophobicContact CD1-CG2 3.84Å
24G91.6Very high94.5Very high70 Ų7073.6 Ų73.672%0.72243%0.427SS*.THydrogen-bonded Turntrans78.629.8-17900000114.6D20 D21D20-G24 PolarHBondContact O-N 3.34Å; D21-G24 PolarHBondContact O-N 3.28Å
25G92.1Very high94.5Very high22 Ų2275.8 Ų75.823%0.22744%0.437CS..SBendtrans130.3-19.6176.100000114.1F11 D20F11-G25 WeakPolarHBondContact CD2-O 3.42Å; F11-G25 VanDerWaalsContact CE2-O 3.28Å; F11-G25 WeakPolarHBondContact CE2-O 3.5Å; D20-G25 PolarHBondContact O-N 3.37Å
26G96.3Very high94.6Very high2 Ų276.6 Ų76.62%0.02145%0.451CS..SBendtrans148.5-170.3-177.600000111.1I12 L23 P28I12-G26 CarbonylContact O-C 3.49Å; I12-G26 WeakPolarHBondContact O-CA 3.43Å; L23-G26 VanDerWaalsContact CB-O 3.26Å; L23-G26 WeakPolarHBondContact CB-O 3.39Å; G26-P28 WeakPolarHBondContact O-CD 3.32Å
27V96.9Very high94.7Very high19 Ų1975.8 Ų75.812%0.11545%0.453CS..EExtended strand (participates in β ladder)trans-72.4120177.7178.60000109.7F11 I12 T14 L23 T33 L50F11-V27 CarbonylContact C-O 3.59Å; F11-V27 VanDerWaalsContact CA-O 3.23Å; F11-V27 WeakPolarHBondContact CA-O 3.41Å; F11-V27 WeakPolarHBondContact CB-O 3.11Å; I12-V27 HydrophobicContact CB-CB 4.37Å; I12-V27 PolarHBondContact N-O 3.43Å; I12-V27 PolarHBondContact O-N 3.36Å; T14-V27 HydrophobicContact CG2-CG2 4.44Å; L23-V27 HydrophobicContact CD1-CG2 3.84Å; V27-T33 HydrophobicContact CG1-CG2 4.47Å; V27-L50 HydrophobicContact CB-CD2 4.28Å; V27-L50 HydrophobicContact CG2-CD1 3.93Å; V27-L50 HydrophobicContact CG2-CD2 3.57Å; V27-L50 HydrophobicContact CG2-CG 4.42Å
28P95.2Very high94.8Very high39 Ų3974.4 Ų74.425%0.25345%0.448SS..EExtended strand (participates in β ladder)trans-67.9135.2-171.926.3-34.8000112.6G26 K31G26-P28 WeakPolarHBondContact O-CD 3.32Å; P28-K31 HydrophobicContact CB-CB 4.25Å; P28-K31 HydrophobicContact CB-CD 4.03Å; P28-K31 HydrophobicContact CB-CG 4.29Å; P28-K31 HydrophobicContact CG-CB 4.09Å; P28-K31 HydrophobicContact CG-CD 4.27Å
29L94Very high94.7Very high59 Ų5977.7 Ų77.731%0.30946%0.464SS..THydrogen-bonded Turntrans-72.7157.4170.2-64.8179.2000111.2Q9 G10 I12 K31 V63Q9-L29 PolarHBondContact OE1-O 2.79Å; G10-L29 VanDerWaalsContact O-CB 3.32Å; G10-L29 WeakPolarHBondContact O-CB 3.08Å; G10-L29 WeakPolarHBondContact O-CG 3.49Å; G10-L29 PolarHBondContact O-N 3.23Å; I12-L29 HydrophobicContact CD1-CD2 4.17Å; I12-L29 HydrophobicContact CG1-CD2 3.83Å; L29-K31 PolarHBondContact O-N 3Å; L29-V63 HydrophobicContact CD1-CG1 4.15Å
30M90.2Very high94.7Very high170 Ų17079.5 Ų79.584%0.83749%0.494SS*.THydrogen-bonded Turntrans58.216.1179.4-59.6-178148.700114.6Q9Q9-M30 HydrophobicContact CG-SD 4.26Å; Q9-M30 PolarHBondContact NE2-SD 3.03Å; Q9-M30 VanDerWaalsContact NE2-SD 3.44Å
31K90.6Very high94.8Very high93 Ų9382.8 Ų82.840%0.40452%0.515SS..SBendtrans-127.6152.4174.8-57.6-168.8-168.3-166.80109.5E6 P28 L29E6-K31 IonicContact OE1-NZ 2.73Å; E6-K31 PolarHBondContact OE1-NZ 3.06Å; P28-K31 HydrophobicContact CB-CB 4.25Å; P28-K31 HydrophobicContact CB-CD 4.03Å; P28-K31 HydrophobicContact CB-CG 4.29Å; P28-K31 HydrophobicContact CG-CB 4.09Å; P28-K31 HydrophobicContact CG-CD 4.27Å; L29-K31 PolarHBondContact O-N 3Å
32T94.6Very high94.8Very high145 Ų14578.3 Ų78.389%0.8950%0.499SS*.  trans-88.1124.5171.3-570000108.8
33T95Very high94.9Very high60 Ų6074.5 Ų74.537%0.36848%0.476SS..  trans-110.5121.9174.2-57.50000109.6V27V27-T33 HydrophobicContact CG1-CG2 4.47Å
34E96.8Very high95.1Very high164 Ų16473.3 Ų73.377%0.76647%0.472SS*.  trans-99.1127177.1-167-174.8-179.200110.4C36E34-C36 VanDerWaalsContact CG-SG 3.57Å; E34-C36 PolarHBondContact OE1-SG 2.89Å
35I95.4Very high95.3Very high61 Ų6174 Ų7431%0.31346%0.457SS..  trans-106.7108.1176.9-59.2160.8000108.4K43 L46 L50I35-K43 HydrophobicContact CG2-CB 4.19Å; I35-K43 HydrophobicContact CG2-CG 4.03Å; I35-K43 WeakPolarHBondContact O-CD 3.33Å; I35-L46 HydrophobicContact CD1-CB 4.49Å; I35-L46 HydrophobicContact CD1-CD2 3.63Å; I35-L46 HydrophobicContact CD1-CG 3.92Å; I35-L46 HydrophobicContact CG1-CD2 4.19Å; I35-L46 HydrophobicContact CG2-CD2 4.24Å; I35-L50 HydrophobicContact CD1-CD1 4.4Å
36C96.4Very high95.6Very high92 Ų9275.2 Ų75.262%0.62246%0.458SS*.  trans-108.3152.2-175.7-680000113E34E34-C36 VanDerWaalsContact CG-SG 3.57Å; E34-C36 PolarHBondContact OE1-SG 2.89Å
37G97.2Very high95.6Very high45 Ų4577.4 Ų77.446%0.46447%0.472SS..  trans153.4172.2172.700000114K43G37-K43 WeakPolarHBondContact O-CE 3.35Å; G37-K43 PolarHBondContact O-NZ 3.1Å
38A97.6Very high95.7Very high61 Ų6176.6 Ų76.650%0.50447%0.467SS..SBendtrans-61.2162.6-177.900000113.2V41 K43A38-V41 HydrophobicContact CB-CG1 3.92Å; A38-V41 WeakPolarHBondContact O-CG1 3.23Å; A38-V41 WeakPolarHBondContact O-CG2 3.28Å; A38-V41 PolarHBondContact O-N 3.07Å; A38-K43 PolarHBondContact O-NZ 3.17Å
39P94.8Very high95.8Very high126 Ų12677.2 Ų77.282%0.81847%0.467SS*.THydrogen-bonded Turntrans-54141.8169.4-25.335.6000111.6V41P39-V41 VanDerWaalsContact C-N 3.32Å; P39-V41 PolarHBondContact O-N 2.97Å
40G94.9Very high96Very high86 Ų8675.6 Ų75.689%0.88746%0.458SS*.THydrogen-bonded Turntrans81.1-5.7178.100000116.6G42G40-G42 PolarHBondContact O-N 2.94Å; G40-G42 VanDerWaalsContact O-N 3.16Å
41V96.8Very high96.4Very high90 Ų9067.8 Ų67.855%0.54542%0.421SS..SBendtrans-75.11.2-179.5-55.20000114.9A38 P39 K43A38-V41 HydrophobicContact CB-CG1 3.92Å; A38-V41 WeakPolarHBondContact O-CG1 3.23Å; A38-V41 WeakPolarHBondContact O-CG2 3.28Å; A38-V41 PolarHBondContact O-N 3.07Å; P39-V41 VanDerWaalsContact C-N 3.32Å; P39-V41 PolarHBondContact O-N 2.97Å; V41-K43 HydrophobicContact CG2-CD 4.34Å; V41-K43 HydrophobicContact CG2-CG 3.72Å
42G96.4Very high96.8Very high31 Ų3163.8 Ų63.832%0.3240%0.404SS..SBendtrans99.28.3174.700000116.6G40 T44 Q45 L46G40-G42 PolarHBondContact O-N 2.94Å; G40-G42 VanDerWaalsContact O-N 3.16Å; G42-T44 PolarHBondContact O-N 3.05Å; G42-Q45 WeakPolarHBondContact O-CB 3.41Å; G42-Q45 PolarHBondContact O-N 3.43Å; G42-Q45 VanDerWaalsContact O-N 3.08Å; G42-L46 PolarHBondContact O-N 3.05Å
43K97.3Very high97Very high61 Ų6157 Ų5727%0.26536%0.362SS..Hα-helixtrans-52.2-54.7180-52.8-173.9-64.6-72.60113.1I35 G37 A38 V41 Q45 L46 C47I35-K43 HydrophobicContact CG2-CB 4.19Å; I35-K43 HydrophobicContact CG2-CG 4.03Å; I35-K43 WeakPolarHBondContact O-CD 3.33Å; G37-K43 WeakPolarHBondContact O-CE 3.35Å; G37-K43 PolarHBondContact O-NZ 3.1Å; A38-K43 PolarHBondContact O-NZ 3.17Å; V41-K43 HydrophobicContact CG2-CD 4.34Å; V41-K43 HydrophobicContact CG2-CG 3.72Å; K43-Q45 VanDerWaalsContact C-N 3.28Å; K43-Q45 PolarHBondContact O-N 2.81Å; K43-L46 PolarHBondContact O-N 3.38Å; K43-C47 PolarHBondContact O-N 2.92Å; K43-C47 PolarHBondContact O-SG 2.91Å; K43-C47 VanDerWaalsContact O-SG 3.36Å
44T96.8Very high97.1Very high44 Ų4454.8 Ų54.827%0.2735%0.349SS..Hα-helixtrans-61.8-36.2178.2-48.30000112.2G42 C47 M48 F69 S75G42-T44 PolarHBondContact O-N 3.05Å; T44-C47 PolarHBondContact O-N 2.73Å; T44-M48 HydrophobicContact CG2-CE 4.26Å; T44-M48 WeakPolarHBondContact O-CG 3.38Å; T44-M48 PolarHBondContact O-N 3.42Å; T44-F69 HydrophobicContact CG2-CZ 4.5Å; T44-S75 VanDerWaalsContact CG2-OG 3.31Å; T44-S75 WeakPolarHBondContact CG2-OG 3.4Å
45Q96.9Very high97.2Very high84 Ų8450.2 Ų50.239%0.39333%0.327SS..Hα-helixtrans-64.4-43.6176.5-68.9-67.9-37.300111.1G42 K43 M48 Q49G42-Q45 WeakPolarHBondContact O-CB 3.41Å; G42-Q45 PolarHBondContact O-N 3.43Å; G42-Q45 VanDerWaalsContact O-N 3.08Å; K43-Q45 VanDerWaalsContact C-N 3.28Å; K43-Q45 PolarHBondContact O-N 2.81Å; Q45-M48 PolarHBondContact O-N 3.13Å; Q45-Q49 WeakPolarHBondContact O-CB 3.36Å; Q45-Q49 PolarHBondContact O-N 3.41Å
46L97.1Very high97.3Very high48 Ų4847.4 Ų47.425%0.25131%0.313SS..Hα-helixtrans-63.6-42.4175.8-178.356.1000111.6L19 I35 G42 K43 M48 Q49 L50L19-L46 HydrophobicContact CD2-CD1 4.03Å; I35-L46 HydrophobicContact CD1-CB 4.49Å; I35-L46 HydrophobicContact CD1-CD2 3.63Å; I35-L46 HydrophobicContact CD1-CG 3.92Å; I35-L46 HydrophobicContact CG1-CD2 4.19Å; I35-L46 HydrophobicContact CG2-CD2 4.24Å; G42-L46 PolarHBondContact O-N 3.05Å; K43-L46 PolarHBondContact O-N 3.38Å; L46-M48 VanDerWaalsContact C-N 3.33Å; L46-M48 PolarHBondContact O-N 2.93Å; L46-Q49 WeakPolarHBondContact O-CB 3.39Å; L46-Q49 PolarHBondContact O-N 3.34Å; L46-L50 HydrophobicContact CD1-CD1 4.38Å; L46-L50 HydrophobicContact CD1-CG 4.25Å; L46-L50 HydrophobicContact CG-CD1 4.23Å; L46-L50 WeakPolarHBondContact O-CG 3.23Å; L46-L50 PolarHBondContact O-N 3.39Å
47C97.5Very high97.2Very high48 Ų4844.6 Ų44.632%0.32429%0.294SS..Hα-helixtrans-61.5-40.5175.6-62.80000112.5K43 T44 A51 F69K43-C47 PolarHBondContact O-N 2.92Å; K43-C47 PolarHBondContact O-SG 2.91Å; K43-C47 VanDerWaalsContact O-SG 3.36Å; T44-C47 PolarHBondContact O-N 2.73Å; C47-A51 PolarHBondContact O-N 3.29Å; C47-A51 VanDerWaalsContact O-N 3.08Å; C47-F69 HydrophobicContact CB-CE2 3.53Å; C47-F69 HydrophobicContact CB-CZ 3.89Å
48M98.1Very high97.1Very high1 Ų149.7 Ų49.71%0.00531%0.306CS..Hα-helixtrans-67.4-37.9176-73.8-173.3-64.300112T44 Q45 L46 A51 V52 F69 F76 R80 V81 L84T44-M48 HydrophobicContact CG2-CE 4.26Å; T44-M48 WeakPolarHBondContact O-CG 3.38Å; T44-M48 PolarHBondContact O-N 3.42Å; Q45-M48 PolarHBondContact O-N 3.13Å; L46-M48 VanDerWaalsContact C-N 3.33Å; L46-M48 PolarHBondContact O-N 2.93Å; M48-A51 PolarHBondContact O-N 2.97Å; M48-V52 PolarHBondContact O-N 3.39Å; M48-F69 HydrophobicContact CG-CE2 3.95Å; M48-F69 HydrophobicContact CG-CZ 4.33Å; M48-F76 HydrophobicContact CG-CD2 4.16Å; M48-F76 HydrophobicContact CG-CE2 4.29Å; M48-F76 HydrophobicContact SD-CD2 4.33Å; M48-R80 HydrophobicContact CE-CB 4.31Å; M48-R80 HydrophobicContact CE-CG 3.71Å; M48-R80 HydrophobicContact SD-CB 4.34Å; M48-R80 HydrophobicContact SD-CG 4.24Å; M48-V81 HydrophobicContact CB-CG2 4.17Å; M48-V81 HydrophobicContact CG-CG2 4.03Å; M48-V81 HydrophobicContact SD-CG2 3.91Å; M48-L84 HydrophobicContact CB-CD1 3.89Å
49Q98.3Very high97Very high53 Ų5350.5 Ų50.525%0.24831%0.307CS..Hα-helixtrans-61.1-49.9173.8-175.863.96400110.9Q45 L46 A51 V52 D53 L84Q45-Q49 WeakPolarHBondContact O-CB 3.36Å; Q45-Q49 PolarHBondContact O-N 3.41Å; L46-Q49 WeakPolarHBondContact O-CB 3.39Å; L46-Q49 PolarHBondContact O-N 3.34Å; Q49-A51 VanDerWaalsContact C-N 3.25Å; Q49-A51 PolarHBondContact O-N 3.41Å; Q49-V52 CarbonylContact O-C 3.56Å; Q49-V52 WeakPolarHBondContact O-CA 3.4Å; Q49-V52 WeakPolarHBondContact O-CB 3.43Å; Q49-V52 PolarHBondContact O-N 3.4Å; Q49-D53 WeakPolarHBondContact CG-OD2 3.49Å; Q49-D53 PolarHBondContact NE2-OD1 2.96Å; Q49-D53 VanDerWaalsContact O-CG 3.26Å; Q49-D53 PolarHBondContact O-N 3.25Å; Q49-L84 HydrophobicContact CB-CD1 4.36Å; Q49-L84 VanDerWaalsContact OE1-CD2 3.28Å
50L98.1Very high97Very high24 Ų2445.9 Ų45.913%0.12627%0.274CS..Hα-helixtrans-61.2-32.4177.9-68.9171.5000113.1I12 T14 V27 I35 L46 V52 D53 V54I12-L50 HydrophobicContact CG2-CD2 4.19Å; T14-L50 HydrophobicContact CG2-CD2 3.91Å; V27-L50 HydrophobicContact CB-CD2 4.28Å; V27-L50 HydrophobicContact CG2-CD1 3.93Å; V27-L50 HydrophobicContact CG2-CD2 3.57Å; V27-L50 HydrophobicContact CG2-CG 4.42Å; I35-L50 HydrophobicContact CD1-CD1 4.4Å; L46-L50 HydrophobicContact CD1-CD1 4.38Å; L46-L50 HydrophobicContact CD1-CG 4.25Å; L46-L50 HydrophobicContact CG-CD1 4.23Å; L46-L50 WeakPolarHBondContact O-CG 3.23Å; L46-L50 PolarHBondContact O-N 3.39Å; L50-V52 PolarHBondContact O-N 2.9Å; L50-D53 PolarHBondContact O-N 3.25Å; L50-V54 PolarHBondContact O-N 3.33Å
51A98.1Very high96.8Very high7 Ų743.9 Ų43.96%0.05825%0.253CS..Hα-helixtrans-66.5-26.1174.200000113.1C47 M48 Q49 Q55 A67 F69C47-A51 PolarHBondContact O-N 3.29Å; C47-A51 VanDerWaalsContact O-N 3.08Å; M48-A51 PolarHBondContact O-N 2.97Å; Q49-A51 VanDerWaalsContact C-N 3.25Å; Q49-A51 PolarHBondContact O-N 3.41Å; A51-Q55 PolarHBondContact O-NE2 3.21Å; A51-A67 HydrophobicContact CB-CB 3.78Å; A51-F69 HydrophobicContact CB-CD2 4.46Å
52V98.4Very high96.7Very high8 Ų840.1 Ų40.15%0.04823%0.232CC..Hα-helixtrans-82.4-46.5170174.80000110.1M48 Q49 L50 V54 Q55 V81 L84 A85 C88M48-V52 PolarHBondContact O-N 3.39Å; Q49-V52 CarbonylContact O-C 3.56Å; Q49-V52 WeakPolarHBondContact O-CA 3.4Å; Q49-V52 WeakPolarHBondContact O-CB 3.43Å; Q49-V52 PolarHBondContact O-N 3.4Å; L50-V52 PolarHBondContact O-N 2.9Å; V52-V54 VanDerWaalsContact C-N 3.3Å; V52-V54 PolarHBondContact O-N 3.22Å; V52-Q55 WeakPolarHBondContact O-CB 3.34Å; V52-Q55 PolarHBondContact O-N 3.06Å; V52-V81 HydrophobicContact CG2-CG1 3.82Å; V52-L84 HydrophobicContact CG2-CB 4.01Å; V52-A85 HydrophobicContact CG1-CB 4.32Å; V52-A85 HydrophobicContact CG2-CB 4.36Å; V52-C88 HydrophobicContact CG1-CB 3.82Å
53D98.3Very high96.7Very high2 Ų240.6 Ų40.61%0.01123%0.229CC..Hα-helixtrans-63-33.5-173.1-65-16.7000113.3I12 I13 Q49 L50 Q55 I56I12-D53 HydrophobicContact CG2-CB 3.8Å; I13-D53 WeakPolarHBondContact O-CB 3.19Å; Q49-D53 WeakPolarHBondContact CG-OD2 3.49Å; Q49-D53 PolarHBondContact NE2-OD1 2.96Å; Q49-D53 VanDerWaalsContact O-CG 3.26Å; Q49-D53 PolarHBondContact O-N 3.25Å; L50-D53 PolarHBondContact O-N 3.25Å; D53-Q55 PolarHBondContact O-N 3.02Å; D53-I56 HydrophobicContact CB-CD1 3.83Å; D53-I56 VanDerWaalsContact O-CB 3.28Å; D53-I56 WeakPolarHBondContact O-CB 3.4Å; D53-I56 VanDerWaalsContact O-CD1 3.26Å; D53-I56 WeakPolarHBondContact O-CD1 3.26Å; D53-I56 WeakPolarHBondContact O-CG1 3.26Å; D53-I56 PolarHBondContact O-N 3.09Å
54V98.1Very high96.7Very high15 Ų1540.8 Ų40.89%0.09124%0.242CC..THydrogen-bonded Turntrans-58.6-24.8175.8760000112.5I12 L50 V52 I56 V63 A64 G65 A67I12-V54 HydrophobicContact CD1-CB 4.13Å; I12-V54 HydrophobicContact CD1-CG2 3.89Å; I12-V54 HydrophobicContact CG1-CG2 4.22Å; I12-V54 HydrophobicContact CG2-CB 4.42Å; L50-V54 PolarHBondContact O-N 3.33Å; V52-V54 VanDerWaalsContact C-N 3.3Å; V52-V54 PolarHBondContact O-N 3.22Å; V54-I56 VanDerWaalsContact C-N 3.33Å; V54-V63 HydrophobicContact CG2-CG2 3.66Å; V54-V63 VanDerWaalsContact O-CG2 3.3Å; V54-V63 WeakPolarHBondContact O-CG2 3.5Å; V54-A64 PolarHBondContact O-N 3.46Å; V54-G65 PolarHBondContact O-N 3.35Å; V54-A67 HydrophobicContact CG1-CB 3.95Å
55Q98Very high96.7Very high67 Ų6739.9 Ų39.931%0.31324%0.241SC..THydrogen-bonded Turntrans-84.4-5.3-179.9-60.2172.368.200113A51 V52 D53 G65A51-Q55 PolarHBondContact O-NE2 3.21Å; V52-Q55 WeakPolarHBondContact O-CB 3.34Å; V52-Q55 PolarHBondContact O-N 3.06Å; D53-Q55 PolarHBondContact O-N 3.02Å; Q55-G65 WeakPolarHBondContact CG-O 3.35Å
56I97.3Very high96.7Very high2 Ų243.9 Ų43.91%0.0126%0.26CS..SBendtrans-59.6131.7178.6-65.9159.6000109.3I13 F15 D53 V54 F60 G62 V63 A64 L92I13-I56 HydrophobicContact CD1-CD1 4.23Å; I13-I56 HydrophobicContact CD1-CG2 4.32Å; I13-I56 HydrophobicContact CG1-CD1 4.02Å; F15-I56 HydrophobicContact CD2-CD1 3.67Å; F15-I56 HydrophobicContact CE2-CD1 3.29Å; F15-I56 HydrophobicContact CE2-CG1 4.04Å; F15-I56 HydrophobicContact CE2-CG2 4.23Å; F15-I56 HydrophobicContact CZ-CD1 4.31Å; F15-I56 HydrophobicContact CZ-CG2 4.37Å; D53-I56 HydrophobicContact CB-CD1 3.83Å; D53-I56 VanDerWaalsContact O-CB 3.28Å; D53-I56 WeakPolarHBondContact O-CB 3.4Å; D53-I56 VanDerWaalsContact O-CD1 3.26Å; D53-I56 WeakPolarHBondContact O-CD1 3.26Å; D53-I56 WeakPolarHBondContact O-CG1 3.26Å; D53-I56 PolarHBondContact O-N 3.09Å; V54-I56 VanDerWaalsContact C-N 3.33Å; I56-F60 HydrophobicContact CG2-CB 3.79Å; I56-G62 CarbonylContact O-C 3.34Å; I56-G62 VanDerWaalsContact O-CA 3.3Å; I56-G62 WeakPolarHBondContact O-CA 3.45Å; I56-V63 PolarHBondContact O-N 3.22Å; I56-A64 PolarHBondContact O-N 3.37Å; I56-L92 HydrophobicContact CG2-CD1 4.45Å; I56-L92 HydrophobicContact CG2-CD2 4.26Å
57P96.4Very high96.7Very high34 Ų3443.1 Ų43.122%0.22126%0.261CS..  trans-65.1151.3179-21.332.2000113.6C59 F60 G62P57-C59 PolarHBondContact O-N 3.34Å; P57-F60 HydrophobicContact CB-CD2 4.13Å; P57-F60 HydrophobicContact CG-CD2 4.12Å; P57-F60 PolarHBondContact O-N 2.88Å; P57-G62 PolarHBondContact O-N 3.36Å; P57-G62 VanDerWaalsContact O-N 3.17Å
58E94.9Very high96.7Very high152 Ų15246.7 Ų46.771%0.7128%0.281SS*.G310 helixtrans-56.8-32.8178-64.7179.2-175.900113.5F60 G61 G62E58-F60 PolarHBondContact O-N 2.85Å; E58-F60 VanDerWaalsContact O-N 3.1Å; E58-G61 PolarHBondContact O-N 3.43Å; E58-G62 WeakPolarHBondContact CA-O 3.34Å
59C93.9Very high96.6Very high78 Ų7849.2 Ų49.253%0.52729%0.292SS..G310 helixtrans-66.1-11.6176.961.90000114P57P57-C59 PolarHBondContact O-N 3.34Å
60F94.6Very high96.5Very high29 Ų2953.4 Ų53.413%0.12732%0.315CS..G310 helixtrans-110.112.9171.8-63.8-78.8000112.5I13 I56 P57 E58 L92 I95 A96I13-F60 WeakPolarHBondContact CD1-O 3.48Å; I56-F60 HydrophobicContact CG2-CB 3.79Å; P57-F60 HydrophobicContact CB-CD2 4.13Å; P57-F60 HydrophobicContact CG-CD2 4.12Å; P57-F60 PolarHBondContact O-N 2.88Å; E58-F60 PolarHBondContact O-N 2.85Å; E58-F60 VanDerWaalsContact O-N 3.1Å; F60-L92 HydrophobicContact CB-CD2 3.81Å; F60-L92 HydrophobicContact CD1-CD2 3.81Å; F60-L92 HydrophobicContact CD2-CD1 4.24Å; F60-L92 HydrophobicContact CD2-CD2 4.13Å; F60-L92 HydrophobicContact CE1-CB 4.22Å; F60-L92 HydrophobicContact CE1-CD2 4.37Å; F60-L92 WeakPolarHBondContact CE1-O 3.39Å; F60-L92 HydrophobicContact CE2-CB 4.34Å; F60-L92 HydrophobicContact CE2-CD1 4.49Å; F60-L92 HydrophobicContact CG-CD2 3.67Å; F60-L92 HydrophobicContact CZ-CB 4.14Å; F60-I95 HydrophobicContact CD1-CB 4.35Å; F60-I95 HydrophobicContact CD1-CG2 3.95Å; F60-I95 HydrophobicContact CE1-CB 4.18Å; F60-I95 HydrophobicContact CE1-CG2 3.99Å; F60-A96 HydrophobicContact CE1-CB 4.21Å; F60-A96 HydrophobicContact CZ-CB 4.12Å
61G91.8Very high96.4Very high44 Ų4455 Ų5545%0.45432%0.323SS..THydrogen-bonded Turntrans82.19.4-178.700000115E58E58-G61 PolarHBondContact O-N 3.43Å
62G95.5Very high96.2Very high10 Ų1060.8 Ų60.810%0.10336%0.358CS..  trans-87.3-167.3173.900000113.5I56 P57 E58I56-G62 CarbonylContact O-C 3.34Å; I56-G62 VanDerWaalsContact O-CA 3.3Å; I56-G62 WeakPolarHBondContact O-CA 3.45Å; P57-G62 PolarHBondContact O-N 3.36Å; P57-G62 VanDerWaalsContact O-N 3.17Å; E58-G62 WeakPolarHBondContact CA-O 3.34Å
63V96.3Very high96Very high42 Ų4268.3 Ų68.326%0.25539%0.392SS..  trans-122.71.6-173.7-58.10000114F11 I12 L29 V54 I56 G65F11-V63 WeakPolarHBondContact O-CG1 3.46Å; I12-V63 HydrophobicContact CG1-CG2 4.44Å; L29-V63 HydrophobicContact CD1-CG1 4.15Å; V54-V63 HydrophobicContact CG2-CG2 3.66Å; V54-V63 VanDerWaalsContact O-CG2 3.3Å; V54-V63 WeakPolarHBondContact O-CG2 3.5Å; I56-V63 PolarHBondContact O-N 3.22Å; V63-G65 PolarHBondContact O-N 3.28Å
64A97.1Very high95.7Very high64 Ų6470.9 Ų70.953%0.52942%0.42SS..  trans47.435.4179.100000114.4V54 I56V54-A64 PolarHBondContact O-N 3.46Å; I56-A64 PolarHBondContact O-N 3.37Å
65G96Very high95.4Very high26 Ų2672 Ų7227%0.26843%0.429SS..  trans-93.2-171.2-174.700000114.2V54 Q55 V63V54-G65 PolarHBondContact O-N 3.35Å; Q55-G65 WeakPolarHBondContact CG-O 3.35Å; V63-G65 PolarHBondContact O-N 3.28Å
66E96.9Very high95.2Very high168 Ų16871 Ų7179%0.78542%0.423SS*.  trans-125.4154.1177.5-62.5-172.9143.600110.4
67A96.9Very high95.1Very high32 Ų3276.2 Ų76.226%0.26445%0.449SS..  trans-116141.1179.600000111.9A51 V54A51-A67 HydrophobicContact CB-CB 3.78Å; V54-A67 HydrophobicContact CG1-CB 3.95Å
68V97.2Very high95.1Very high123 Ų12378.8 Ų78.875%0.74546%0.463SS*.  trans-111.6120.5163.2178.60000107.6I70V68-I70 HydrophobicContact CG1-CG1 4.36Å
69F96.7Very high95.2Very high53 Ų5377.6 Ų77.623%0.23246%0.462CS..  trans-106.4119.2178.5-160.2-70.2000109.5T44 C47 M48 A51 D71 F76T44-F69 HydrophobicContact CG2-CZ 4.5Å; C47-F69 HydrophobicContact CB-CE2 3.53Å; C47-F69 HydrophobicContact CB-CZ 3.89Å; M48-F69 HydrophobicContact CG-CE2 3.95Å; M48-F69 HydrophobicContact CG-CZ 4.33Å; A51-F69 HydrophobicContact CB-CD2 4.46Å; F69-D71 HydrophobicContact CD1-CB 4.14Å; F69-D71 HydrophobicContact CE1-CB 4.04Å; F69-F76 HydrophobicContact CB-CD2 4.37Å; F69-F76 HydrophobicContact CB-CE2 4.18Å; F69-F76 HydrophobicContact CD1-CB 4.48Å; F69-F76 AromaticContact CD1-CD2 3.62Å; F69-F76 HydrophobicContact CD1-CD2 3.62Å; F69-F76 HydrophobicContact CD1-CE2 4.26Å; F69-F76 HydrophobicContact CD1-CG 4.35Å; F69-F76 AromaticContact CD2-CD2 3.98Å; F69-F76 HydrophobicContact CD2-CD2 3.98Å; F69-F76 HydrophobicContact CD2-CE2 4Å; F69-F76 HydrophobicContact CE1-CB 4.3Å; F69-F76 AromaticContact CE1-CD2 3.82Å; F69-F76 HydrophobicContact CE1-CD2 3.82Å; F69-F76 HydrophobicContact CE2-CD2 4.13Å; F69-F76 HydrophobicContact CE2-CE2 4.45Å; F69-F76 AromaticContact CG-CD2 3.72Å; F69-F76 HydrophobicContact CG-CD2 3.72Å; F69-F76 AromaticContact CG-CE2 3.88Å; F69-F76 HydrophobicContact CG-CE2 3.88Å; F69-F76 HydrophobicContact CZ-CD2 4.06Å
70I96.6Very high95.4Very high142 Ų14278.3 Ų78.373%0.72845%0.454SS*.  trans-104.8114175.4-57.6174.9000107.5V68V68-I70 HydrophobicContact CG1-CG1 4.36Å
71D95.1Very high95.5Very high56 Ų5677 Ų7730%0.29945%0.448SS..  trans-107.7118.7-179.4-17915.7000110.2F69 E73 G74 S75 F76F69-D71 HydrophobicContact CD1-CB 4.14Å; F69-D71 HydrophobicContact CE1-CB 4.04Å; D71-E73 PolarHBondContact OD1-N 3.4Å; D71-E73 VanDerWaalsContact OD1-N 3.09Å; D71-G74 PolarHBondContact OD1-N 3.33Å; D71-G74 WeakPolarHBondContact OD2-CA 3.34Å; D71-G74 PolarHBondContact OD2-N 3.08Å; D71-S75 PolarHBondContact OD1-N 3.25Å; D71-S75 PolarHBondContact OD1-OG 2.93Å; D71-S75 PolarHBondContact OD2-N 3.04Å; D71-F76 HydrophobicContact CB-CB 4.01Å; D71-F76 VanDerWaalsContact OD2-CB 3.27Å; D71-F76 WeakPolarHBondContact OD2-CB 3.48Å; D71-F76 PolarHBondContact OD2-N 2.88Å
72T94.7Very high95.8Very high129 Ų12978.5 Ų78.579%0.79145%0.448SS*.SBendtrans-98.3-13.4-179.156.10000113.1
73E93.7Very high96Very high166 Ų16682.4 Ų82.478%0.77647%0.467SS*.SBendtrans-115.6-7.4-173.4-64.8-174.7179.200113.1D71D71-E73 PolarHBondContact OD1-N 3.4Å; D71-E73 VanDerWaalsContact OD1-N 3.09Å
74G91.6Very high96.1Very high57 Ų5780.9 Ų80.959%0.58846%0.457SS*.SBendtrans76.624.3-176.800000113.1D71D71-G74 PolarHBondContact OD1-N 3.33Å; D71-G74 WeakPolarHBondContact OD2-CA 3.34Å; D71-G74 PolarHBondContact OD2-N 3.08Å
75S91.9Very high96.1Very high39 Ų3978.7 Ų78.727%0.27344%0.439SS..  trans-90.3-6.3-176.865.40000114T44 D71 M77T44-S75 VanDerWaalsContact CG2-OG 3.31Å; T44-S75 WeakPolarHBondContact CG2-OG 3.4Å; D71-S75 PolarHBondContact OD1-N 3.25Å; D71-S75 PolarHBondContact OD1-OG 2.93Å; D71-S75 PolarHBondContact OD2-N 3.04Å; S75-M77 PolarHBondContact O-N 2.96Å
76F93.8Very high96.2Very high44 Ų4480.5 Ų80.519%0.19345%0.445CS..  trans-72.8122.5177.3-176.3-92000111.4M48 F69 D71 V78 V81 F127M48-F76 HydrophobicContact CG-CD2 4.16Å; M48-F76 HydrophobicContact CG-CE2 4.29Å; M48-F76 HydrophobicContact SD-CD2 4.33Å; F69-F76 HydrophobicContact CB-CD2 4.37Å; F69-F76 HydrophobicContact CB-CE2 4.18Å; F69-F76 HydrophobicContact CD1-CB 4.48Å; F69-F76 AromaticContact CD1-CD2 3.62Å; F69-F76 HydrophobicContact CD1-CD2 3.62Å; F69-F76 HydrophobicContact CD1-CE2 4.26Å; F69-F76 HydrophobicContact CD1-CG 4.35Å; F69-F76 AromaticContact CD2-CD2 3.98Å; F69-F76 HydrophobicContact CD2-CD2 3.98Å; F69-F76 HydrophobicContact CD2-CE2 4Å; F69-F76 HydrophobicContact CE1-CB 4.3Å; F69-F76 AromaticContact CE1-CD2 3.82Å; F69-F76 HydrophobicContact CE1-CD2 3.82Å; F69-F76 HydrophobicContact CE2-CD2 4.13Å; F69-F76 HydrophobicContact CE2-CE2 4.45Å; F69-F76 AromaticContact CG-CD2 3.72Å; F69-F76 HydrophobicContact CG-CD2 3.72Å; F69-F76 AromaticContact CG-CE2 3.88Å; F69-F76 HydrophobicContact CG-CE2 3.88Å; F69-F76 HydrophobicContact CZ-CD2 4.06Å; D71-F76 HydrophobicContact CB-CB 4.01Å; D71-F76 VanDerWaalsContact OD2-CB 3.27Å; D71-F76 WeakPolarHBondContact OD2-CB 3.48Å; D71-F76 PolarHBondContact OD2-N 2.88Å; F76-V78 HydrophobicContact CD1-CG2 4.36Å; F76-V78 HydrophobicContact CE1-CG2 3.82Å; F76-V81 HydrophobicContact CE2-CG2 3.75Å; F76-V81 HydrophobicContact CZ-CG2 3.71Å; F76-F127 HydrophobicContact CE1-CD1 4.49Å; F76-F127 HydrophobicContact CE2-CD1 4.3Å; F76-F127 AromaticContact CE2-CE1 3.93Å; F76-F127 HydrophobicContact CE2-CE1 3.93Å; F76-F127 HydrophobicContact CE2-CZ 4.39Å; F76-F127 AromaticContact CZ-CD1 3.67Å; F76-F127 HydrophobicContact CZ-CD1 3.67Å; F76-F127 HydrophobicContact CZ-CD2 4.39Å; F76-F127 AromaticContact CZ-CE1 3.64Å; F76-F127 HydrophobicContact CZ-CE1 3.64Å; F76-F127 HydrophobicContact CZ-CE2 4.33Å; F76-F127 HydrophobicContact CZ-CG 4.08Å; F76-F127 AromaticContact CZ-CZ 4Å; F76-F127 HydrophobicContact CZ-CZ 4Å
77M95.6Very high96.3Very high112 Ų11275 Ų7555%0.55243%0.428SS*.  trans-118.8110.6-177.5-65.7-68.1174.900109.8S75 D79 R80 V81S75-M77 PolarHBondContact O-N 2.96Å; M77-D79 VanDerWaalsContact C-N 3.32Å; M77-D79 PolarHBondContact O-N 3.27Å; M77-R80 HydrophobicContact CB-CB 3.87Å; M77-R80 WeakPolarHBondContact O-CB 3.37Å; M77-R80 PolarHBondContact O-N 2.77Å; M77-R80 VanDerWaalsContact O-N 3.11Å; M77-V81 PolarHBondContact O-N 3.17Å
78V95.6Very high96.3Very high88 Ų8874.3 Ų74.353%0.53342%0.421SS..Hα-helixtrans-57.8-45.7-178.8174.70000111.3F76 R80 V81 V82F76-V78 HydrophobicContact CD1-CG2 4.36Å; F76-V78 HydrophobicContact CE1-CG2 3.82Å; V78-R80 PolarHBondContact O-N 3.35Å; V78-V81 WeakPolarHBondContact O-CA 3.35Å; V78-V81 PolarHBondContact O-N 2.77Å; V78-V82 HydrophobicContact CG1-CG2 4.39Å; V78-V82 WeakPolarHBondContact O-CG2 3.46Å; V78-V82 PolarHBondContact O-N 3.49Å
79D97.5Very high96.4Very high127 Ų12771.3 Ų71.368%0.67940%0.4SS*.Hα-helixtrans-58.1-38.4179.8-62.1-26.6000111.2M77 V81 V82 D83M77-D79 VanDerWaalsContact C-N 3.32Å; M77-D79 PolarHBondContact O-N 3.27Å; D79-V81 PolarHBondContact O-N 2.94Å; D79-V82 WeakPolarHBondContact O-CB 3.41Å; D79-V82 PolarHBondContact O-N 3.23Å; D79-D83 PolarHBondContact O-N 2.91Å
80R97.4Very high96.4Very high93 Ų9374.1 Ų74.135%0.35141%0.414SS..Hα-helixtrans-64.3-41.2175.5-177.855.6179.7153.73.7111.8M48 M77 V78 V82 D83 L84M48-R80 HydrophobicContact CE-CB 4.31Å; M48-R80 HydrophobicContact CE-CG 3.71Å; M48-R80 HydrophobicContact SD-CB 4.34Å; M48-R80 HydrophobicContact SD-CG 4.24Å; M77-R80 HydrophobicContact CB-CB 3.87Å; M77-R80 WeakPolarHBondContact O-CB 3.37Å; M77-R80 PolarHBondContact O-N 2.77Å; M77-R80 VanDerWaalsContact O-N 3.11Å; V78-R80 PolarHBondContact O-N 3.35Å; R80-V82 VanDerWaalsContact C-N 3.3Å; R80-V82 PolarHBondContact O-N 2.98Å; R80-D83 WeakPolarHBondContact O-CB 3.27Å; R80-D83 PolarHBondContact O-N 3.47Å; R80-L84 VanDerWaalsContact O-CG 3.31Å; R80-L84 WeakPolarHBondContact O-CG 3.45Å; R80-L84 PolarHBondContact O-N 3.46Å
81V97.8Very high96.4Very high2 Ų271 Ų711%0.01240%0.396CS..Hα-helixtrans-66.3-35.7176.7-178.50000111.6M48 V52 F76 M77 V78 D79 D83 L84 A85 F127M48-V81 HydrophobicContact CB-CG2 4.17Å; M48-V81 HydrophobicContact CG-CG2 4.03Å; M48-V81 HydrophobicContact SD-CG2 3.91Å; V52-V81 HydrophobicContact CG2-CG1 3.82Å; F76-V81 HydrophobicContact CE2-CG2 3.75Å; F76-V81 HydrophobicContact CZ-CG2 3.71Å; M77-V81 PolarHBondContact O-N 3.17Å; V78-V81 WeakPolarHBondContact O-CA 3.35Å; V78-V81 PolarHBondContact O-N 2.77Å; D79-V81 PolarHBondContact O-N 2.94Å; V81-D83 VanDerWaalsContact C-N 3.34Å; V81-L84 PolarHBondContact O-N 3.18Å; V81-A85 WeakPolarHBondContact O-CB 3.4Å; V81-A85 PolarHBondContact O-N 3.25Å; V81-F127 HydrophobicContact CB-CE2 4.33Å; V81-F127 HydrophobicContact CG1-CE2 3.48Å; V81-F127 VanDerWaalsContact CG1-CE2 3.48Å; V81-F127 HydrophobicContact CG1-CZ 3.65Å; V81-F127 HydrophobicContact CG2-CZ 4.46Å
82V98.3Very high96.4Very high75 Ų7569.3 Ų69.346%0.45539%0.387SS..Hα-helixtrans-61.8-42.8173.2173.90000110.9V78 D79 R80 A85 T86V78-V82 HydrophobicContact CG1-CG2 4.39Å; V78-V82 WeakPolarHBondContact O-CG2 3.46Å; V78-V82 PolarHBondContact O-N 3.49Å; D79-V82 WeakPolarHBondContact O-CB 3.41Å; D79-V82 PolarHBondContact O-N 3.23Å; R80-V82 VanDerWaalsContact C-N 3.3Å; R80-V82 PolarHBondContact O-N 2.98Å; V82-A85 PolarHBondContact O-N 2.9Å; V82-T86 WeakPolarHBondContact O-CB 3.33Å; V82-T86 PolarHBondContact O-N 3.32Å; V82-T86 PolarHBondContact O-OG1 2.86Å
83D98.5Very high96.5Very high92 Ų9268.4 Ų68.449%0.49237%0.374SS..Hα-helixtrans-60-47.5174.9-66.1-26000111.5D79 R80 V81 T86 A87D79-D83 PolarHBondContact O-N 2.91Å; R80-D83 WeakPolarHBondContact O-CB 3.27Å; R80-D83 PolarHBondContact O-N 3.47Å; V81-D83 VanDerWaalsContact C-N 3.34Å; D83-T86 PolarHBondContact O-N 3.44Å; D83-A87 WeakPolarHBondContact O-CB 3.45Å; D83-A87 PolarHBondContact O-N 3.33Å
84L98.4Very high96.6Very high11 Ų1165.7 Ų65.76%0.05836%0.364CS..Hα-helixtrans-62.2-44.8179.3-67.1179.7000111.7M48 Q49 V52 R80 V81 A87 C88M48-L84 HydrophobicContact CB-CD1 3.89Å; Q49-L84 HydrophobicContact CB-CD1 4.36Å; Q49-L84 VanDerWaalsContact OE1-CD2 3.28Å; V52-L84 HydrophobicContact CG2-CB 4.01Å; R80-L84 VanDerWaalsContact O-CG 3.31Å; R80-L84 WeakPolarHBondContact O-CG 3.45Å; R80-L84 PolarHBondContact O-N 3.46Å; V81-L84 PolarHBondContact O-N 3.18Å; L84-A87 PolarHBondContact O-N 3.02Å; L84-C88 WeakPolarHBondContact O-CB 3.36Å; L84-C88 PolarHBondContact O-N 3.06Å
85A98.3Very high96.7Very high17 Ų1765 Ų6514%0.1435%0.347CS..Hα-helixtrans-63.2-42176.700000111.7V52 V81 V82 C88 I89V52-A85 HydrophobicContact CG1-CB 4.32Å; V52-A85 HydrophobicContact CG2-CB 4.36Å; V81-A85 WeakPolarHBondContact O-CB 3.4Å; V81-A85 PolarHBondContact O-N 3.25Å; V82-A85 PolarHBondContact O-N 2.9Å; A85-C88 PolarHBondContact O-N 3.37Å; A85-I89 WeakPolarHBondContact O-CD1 3.46Å; A85-I89 VanDerWaalsContact O-CG1 3.23Å; A85-I89 WeakPolarHBondContact O-CG1 3.44Å; A85-I89 PolarHBondContact O-N 2.92Å
86T98.4Very high96.7Very high65 Ų6563.9 Ų63.940%0.39934%0.34SS..Hα-helixtrans-62-46.3177.4-58.60000111V82 D83 I89 Q90V82-T86 WeakPolarHBondContact O-CB 3.33Å; V82-T86 PolarHBondContact O-N 3.32Å; V82-T86 PolarHBondContact O-OG1 2.86Å; D83-T86 PolarHBondContact O-N 3.44Å; T86-I89 PolarHBondContact O-N 2.94Å; T86-Q90 WeakPolarHBondContact O-CG 3.06Å; T86-Q90 PolarHBondContact O-N 3.38Å
87A98.3Very high96.6Very high52 Ų5267.5 Ų67.543%0.4336%0.357SS..Hα-helixtrans-62.9-42.2176.200000112.1D83 L84 Q90 H91D83-A87 WeakPolarHBondContact O-CB 3.45Å; D83-A87 PolarHBondContact O-N 3.33Å; L84-A87 PolarHBondContact O-N 3.02Å; A87-Q90 PolarHBondContact O-N 2.78Å; A87-H91 WeakPolarHBondContact O-CB 3.24Å; A87-H91 PolarHBondContact O-N 3.38Å
88C98Very high96.1Very high17 Ų1768.9 Ų68.912%0.11536%0.36CS..Hα-helixtrans-58.5-48.7175.5-178.10000111.2V52 L84 A85 Q90 H91 L92V52-C88 HydrophobicContact CG1-CB 3.82Å; L84-C88 WeakPolarHBondContact O-CB 3.36Å; L84-C88 PolarHBondContact O-N 3.06Å; A85-C88 PolarHBondContact O-N 3.37Å; C88-Q90 PolarHBondContact O-N 2.95Å; C88-H91 WeakPolarHBondContact O-CB 3.32Å; C88-H91 PolarHBondContact O-N 3.32Å; C88-H91 VanDerWaalsContact O-N 3.13Å; C88-L92 WeakPolarHBondContact O-CG 3.31Å; C88-L92 PolarHBondContact O-N 2.89Å
89I97.7Very high95.1Very high61 Ų6168.9 Ų68.931%0.31335%0.354SS..Hα-helixtrans-59.9-46.9179-67.3161000111.3A85 T86 H91 L92 Q93 P122A85-I89 WeakPolarHBondContact O-CD1 3.46Å; A85-I89 VanDerWaalsContact O-CG1 3.23Å; A85-I89 WeakPolarHBondContact O-CG1 3.44Å; A85-I89 PolarHBondContact O-N 2.92Å; T86-I89 PolarHBondContact O-N 2.94Å; I89-H91 VanDerWaalsContact C-N 3.28Å; I89-H91 PolarHBondContact O-N 3.39Å; I89-L92 PolarHBondContact O-N 3.31Å; I89-Q93 WeakPolarHBondContact O-CG 3.45Å; I89-Q93 PolarHBondContact O-N 3.39Å; I89-P122 HydrophobicContact CD1-CB 4.49Å; I89-P122 HydrophobicContact CD1-CG 3.42Å; I89-P122 VanDerWaalsContact CD1-CG 3.42Å; I89-P122 HydrophobicContact CG1-CG 3.88Å
90Q97.8Very high94Very high111 Ų11168.2 Ų68.252%0.51935%0.345SS..Hα-helixtrans-59.2-42.1176.8-71.9172.4-7.300111.1T86 A87 C88 Q93 L94T86-Q90 WeakPolarHBondContact O-CG 3.06Å; T86-Q90 PolarHBondContact O-N 3.38Å; A87-Q90 PolarHBondContact O-N 2.78Å; C88-Q90 PolarHBondContact O-N 2.95Å; Q90-Q93 PolarHBondContact O-N 3Å; Q90-L94 WeakPolarHBondContact O-CG 3.39Å; Q90-L94 PolarHBondContact O-N 3.23Å; Q90-L94 VanDerWaalsContact O-N 3.09Å
91H96.3Very high92.1Very high77 Ų7766.3 Ų66.336%0.35635%0.354SS..Hα-helixtrans-61.6-46.7177-173.362.6000112.3F15 A87 C88 I89 Q93 L94 I95F15-H91 AromaticContact CD1-CD2 3.89Å; F15-H91 AromaticContact CD1-NE2 3.54Å; F15-H91 AromaticContact CE1-NE2 3.89Å; F15-H91 AromaticContact CG-CD2 3.89Å; F15-H91 AromaticContact CG-NE2 3.87Å; A87-H91 WeakPolarHBondContact O-CB 3.24Å; A87-H91 PolarHBondContact O-N 3.38Å; C88-H91 WeakPolarHBondContact O-CB 3.32Å; C88-H91 PolarHBondContact O-N 3.32Å; C88-H91 VanDerWaalsContact O-N 3.13Å; I89-H91 VanDerWaalsContact C-N 3.28Å; I89-H91 PolarHBondContact O-N 3.39Å; H91-Q93 VanDerWaalsContact C-N 3.31Å; H91-Q93 PolarHBondContact O-N 2.9Å; H91-L94 PolarHBondContact O-N 2.93Å; H91-I95 WeakPolarHBondContact O-CG1 3.31Å; H91-I95 PolarHBondContact O-N 3Å
92L96Very high90.3Very high20 Ų2071.1 Ų71.111%0.10538%0.377CS..Hα-helixtrans-63.7-36.4177.8-63.2-176.5000112.4F15 I56 F60 C88 I89 I95 A96F15-L92 HydrophobicContact CE2-CD2 3.76Å; F15-L92 HydrophobicContact CZ-CD2 3.58Å; I56-L92 HydrophobicContact CG2-CD1 4.45Å; I56-L92 HydrophobicContact CG2-CD2 4.26Å; F60-L92 HydrophobicContact CB-CD2 3.81Å; F60-L92 HydrophobicContact CD1-CD2 3.81Å; F60-L92 HydrophobicContact CD2-CD1 4.24Å; F60-L92 HydrophobicContact CD2-CD2 4.13Å; F60-L92 HydrophobicContact CE1-CB 4.22Å; F60-L92 HydrophobicContact CE1-CD2 4.37Å; F60-L92 WeakPolarHBondContact CE1-O 3.39Å; F60-L92 HydrophobicContact CE2-CB 4.34Å; F60-L92 HydrophobicContact CE2-CD1 4.49Å; F60-L92 HydrophobicContact CG-CD2 3.67Å; F60-L92 HydrophobicContact CZ-CB 4.14Å; C88-L92 WeakPolarHBondContact O-CG 3.31Å; C88-L92 PolarHBondContact O-N 2.89Å; I89-L92 PolarHBondContact O-N 3.31Å; L92-I95 HydrophobicContact CD2-CD1 4.38Å; L92-I95 PolarHBondContact O-N 3.01Å; L92-A96 WeakPolarHBondContact O-CB 3.36Å; L92-A96 PolarHBondContact O-N 3.41Å
93Q96.1Very high88.2Confident111 Ų11172.9 Ų72.952%0.51938%0.38SS..Hα-helixtrans-61.6-44.9174.1-74.1172.2-17.300111.5I89 Q90 H91 I95 A96 E97I89-Q93 WeakPolarHBondContact O-CG 3.45Å; I89-Q93 PolarHBondContact O-N 3.39Å; Q90-Q93 PolarHBondContact O-N 3Å; H91-Q93 VanDerWaalsContact C-N 3.31Å; H91-Q93 PolarHBondContact O-N 2.9Å; Q93-I95 PolarHBondContact O-N 3.33Å; Q93-A96 PolarHBondContact O-N 2.87Å; Q93-E97 WeakPolarHBondContact O-CG 3.23Å; Q93-E97 PolarHBondContact O-N 3.38Å
94L95.1Very high85.9Confident109 Ų10974 Ų7457%0.57140%0.395SS*.Hα-helixtrans-62.3-41.4177.2-68.5170.4000112.1Q90 H91 E97 K98Q90-L94 WeakPolarHBondContact O-CG 3.39Å; Q90-L94 PolarHBondContact O-N 3.23Å; Q90-L94 VanDerWaalsContact O-N 3.09Å; H91-L94 PolarHBondContact O-N 2.93Å; L94-E97 PolarHBondContact O-N 2.91Å; L94-K98 WeakPolarHBondContact O-CB 3.46Å; L94-K98 PolarHBondContact O-N 3.43Å
95I93.4Very high83.6Confident42 Ų4277 Ų7722%0.21543%0.428CS..Hα-helixtrans-60.6-47.6174.4-66.9167.4000110.2F15 F60 H91 L92 Q93 E97 K98 H99F15-I95 HydrophobicContact CE1-CD1 3.88Å; F15-I95 HydrophobicContact CZ-CD1 4.19Å; F60-I95 HydrophobicContact CD1-CB 4.35Å; F60-I95 HydrophobicContact CD1-CG2 3.95Å; F60-I95 HydrophobicContact CE1-CB 4.18Å; F60-I95 HydrophobicContact CE1-CG2 3.99Å; H91-I95 WeakPolarHBondContact O-CG1 3.31Å; H91-I95 PolarHBondContact O-N 3Å; L92-I95 HydrophobicContact CD2-CD1 4.38Å; L92-I95 PolarHBondContact O-N 3.01Å; Q93-I95 PolarHBondContact O-N 3.33Å; I95-E97 VanDerWaalsContact C-N 3.32Å; I95-E97 PolarHBondContact O-N 2.82Å; I95-K98 PolarHBondContact O-N 3.36Å; I95-H99 PolarHBondContact O-CD2 3.4Å; I95-H99 VanDerWaalsContact O-CD2 3.25Å; I95-H99 PolarHBondContact O-N 2.61Å
96A91.8Very high80.9Confident15 Ų1580.2 Ų80.212%0.12445%0.45CS..Hα-helixtrans-63.4-35.7-179.800000113F60 L92 Q93 K100 L117F60-A96 HydrophobicContact CE1-CB 4.21Å; F60-A96 HydrophobicContact CZ-CB 4.12Å; L92-A96 WeakPolarHBondContact O-CB 3.36Å; L92-A96 PolarHBondContact O-N 3.41Å; Q93-A96 PolarHBondContact O-N 2.87Å; A96-K100 PolarHBondContact O-N 3.49Å; A96-L117 HydrophobicContact CB-CD1 4.22Å
97E92.4Very high78.4Confident121 Ų12184 Ų8457%0.56547%0.474SS*.Hα-helixtrans-69.4-43176.2-75174.4178.600112.3Q93 L94 I95 H99 K100 G101Q93-E97 WeakPolarHBondContact O-CG 3.23Å; Q93-E97 PolarHBondContact O-N 3.38Å; L94-E97 PolarHBondContact O-N 2.91Å; I95-E97 VanDerWaalsContact C-N 3.32Å; I95-E97 PolarHBondContact O-N 2.82Å; E97-H99 VanDerWaalsContact C-N 3.3Å; E97-H99 PolarHBondContact O-N 3.02Å; E97-K100 PolarHBondContact O-N 3.25Å; E97-G101 PolarHBondContact O-N 3.11Å
98K85.7Confident75.8Confident141 Ų14185 Ų8561%0.61348%0.481SS*.Hα-helixtrans-56.9-44.4177.7-173.2-178.2174.6-172.20111.7L94 I95 K100 G101 E102L94-K98 WeakPolarHBondContact O-CB 3.46Å; L94-K98 PolarHBondContact O-N 3.43Å; I95-K98 PolarHBondContact O-N 3.36Å; K98-K100 PolarHBondContact O-N 3.28Å; K98-G101 PolarHBondContact O-N 2.97Å; K98-E102 PolarHBondContact O-N 3.14Å
99H75Confident73.1Confident87 Ų8795.8 Ų95.840%0.40352%0.52SS..Hα-helixtrans-70.3-27.2-179.7-75.8-62.3000114.2I95 E97 G101 E102 E103I95-H99 PolarHBondContact O-CD2 3.4Å; I95-H99 VanDerWaalsContact O-CD2 3.25Å; I95-H99 PolarHBondContact O-N 2.61Å; E97-H99 VanDerWaalsContact C-N 3.3Å; E97-H99 PolarHBondContact O-N 3.02Å; H99-G101 VanDerWaalsContact C-N 3.3Å; H99-G101 PolarHBondContact O-N 3.39Å; H99-E102 IonicContact CE1-OE2 3.67Å; H99-E102 IonicContact ND1-OE2 3.05Å; H99-E102 PolarHBondContact ND1-OE2 3.27Å; H99-E102 PolarHBondContact O-N 3.25Å; H99-E103 PolarHBondContact O-N 3.43Å
100K72.6Confident70.3Confident113 Ų11397.4 Ų97.449%0.49154%0.542SS..Hα-helixtrans-66.6-32.2171.7-73.7175.8-178.4173.20112.9A96 E97 K98 S104A96-K100 PolarHBondContact O-N 3.49Å; E97-K100 PolarHBondContact O-N 3.25Å; K98-K100 PolarHBondContact O-N 3.28Å; K100-S104 PolarHBondContact O-OG 2.84Å
101G58.4Low67.5Low53 Ų5396.3 Ų96.355%0.54656%0.56SS.*Hα-helixtrans-68.7-34.4175.700000112.8E97 K98 H99E97-G101 PolarHBondContact O-N 3.11Å; K98-G101 PolarHBondContact O-N 2.97Å; H99-G101 VanDerWaalsContact C-N 3.3Å; H99-G101 PolarHBondContact O-N 3.39Å
102E58.9Low65.1Low103 Ų10397.1 Ų97.148%0.48157%0.57SS.*Hα-helixtrans-73.9-35.7179.9-67.6170.517600112.3K98 H99 S104 G105K98-E102 PolarHBondContact O-N 3.14Å; H99-E102 IonicContact CE1-OE2 3.67Å; H99-E102 IonicContact ND1-OE2 3.05Å; H99-E102 PolarHBondContact ND1-OE2 3.27Å; H99-E102 PolarHBondContact O-N 3.25Å; E102-S104 VanDerWaalsContact C-N 3.28Å; E102-S104 PolarHBondContact O-N 2.85Å; E102-G105 PolarHBondContact O-N 3.38Å
103E54.7Low62.4Low113 Ų113102.9 Ų102.953%0.52860%0.597SS.*Hα-helixtrans-66.9-25175.3-75.6-174.7176.600113.5H99 G105 W114H99-E103 PolarHBondContact O-N 3.43Å; E103-G105 PolarHBondContact O-N 3.45Å; E103-W114 VanDerWaalsContact OE1-CD1 3.3Å; E103-W114 PolarHBondContact OE1-NE1 3.09Å
104S50.6Low60.2Low114 Ų114101.5 Ų101.580%0.79759%0.587SS**THydrogen-bonded Turntrans-75.6-9.6176.6-63.70000113.6K100 E102K100-S104 PolarHBondContact O-OG 2.84Å; E102-S104 VanDerWaalsContact C-N 3.28Å; E102-S104 PolarHBondContact O-N 2.85Å
105G49.7Very low57.6Low74 Ų74106.1 Ų106.176%0.76360%0.597SS**THydrogen-bonded Turntrans-103.1-8.8-179.600000115.8E102 E103E102-G105 PolarHBondContact O-N 3.38Å; E103-G105 PolarHBondContact O-N 3.45Å
106S42.1Very low55.2Low86 Ų86109.9 Ų109.960%0.60162%0.618SS**  trans-133.8109.3-175.6-167.10000111.6A108S106-A108 PolarHBondContact O-N 3.24Å
107T45.2Very low53.3Low145 Ų145111.4 Ų111.489%0.8962%0.623SS**  trans-73.6120.3169.7-58.50000109.2
108A43.8Very low50.9Low72 Ų72109.6 Ų109.660%0.59564%0.638SS**  trans75.3138.2173.700000114.5S106S106-A108 PolarHBondContact O-N 3.24Å
109R41.6Very low48.9Very low244 Ų244109.6 Ų109.692%0.92164%0.643SS**  cis-153.4164.122.4-74.3178.2170.2-177.5-2.9109.3
110A38.9Very low47.5Very low95 Ų95110 Ų11079%0.78565%0.648SS**  trans82.379.6166.700000118.8V112A110-V112 PolarHBondContact O-N 3.23Å
111G39Very low46Very low87 Ų87115.5 Ų115.590%0.89767%0.666SS**  76.421.610700000121.5
112V47.2Very low45.2Very low94 Ų94116.5 Ų116.557%0.5766%0.663SS**  trans-114.5112164.7-175.20000109.8A110 W114A110-V112 PolarHBondContact O-N 3.23Å; V112-W114 HydrophobicContact CG1-CD2 4.14Å; V112-W114 HydrophobicContact CG1-CZ2 4.06Å; V112-W114 PolarHBondContact O-N 2.99Å
113Q39.2Very low44.2Very low142 Ų142115.4 Ų115.466%0.66467%0.666SS**  trans-91.691.1-177.7-172.6166-34.700110.7R115Q113-R115 HydrophobicContact CG-CB 4.2Å; Q113-R115 HydrophobicContact CG-CG 3.77Å; Q113-R115 PolarHBondContact O-N 3.48Å
114W49.8Very low43.7Very low81 Ų81115.2 Ų115.231%0.30768%0.675SS.*  trans-67.121.6-179.3-60.7103.3000116.5E103 V112 N116 L117E103-W114 VanDerWaalsContact OE1-CD1 3.3Å; E103-W114 PolarHBondContact OE1-NE1 3.09Å; V112-W114 HydrophobicContact CG1-CD2 4.14Å; V112-W114 HydrophobicContact CG1-CZ2 4.06Å; V112-W114 PolarHBondContact O-N 2.99Å; W114-N116 VanDerWaalsContact C-N 3.27Å; W114-N116 PolarHBondContact O-N 3.18Å; W114-N116 VanDerWaalsContact O-N 3.15Å; W114-L117 HydrophobicContact CE3-CD1 3.88Å; W114-L117 HydrophobicContact CZ3-CD1 4.48Å
115R40.7Very low43.5Very low206 Ų206111.6 Ų111.678%0.77765%0.649SS**THydrogen-bonded Turntrans-74.9-1.2-168.2-70.3-168.5-164.2170.42.5115.8Q113Q113-R115 HydrophobicContact CG-CB 4.2Å; Q113-R115 HydrophobicContact CG-CG 3.77Å; Q113-R115 PolarHBondContact O-N 3.48Å
116N41.1Very low43.5Very low122 Ų122117.9 Ų117.965%0.65265%0.649SS**THydrogen-bonded Turntrans-122.817.3-170.7-106-21.5000116.3W114 G118W114-N116 VanDerWaalsContact C-N 3.27Å; W114-N116 PolarHBondContact O-N 3.18Å; W114-N116 VanDerWaalsContact O-N 3.15Å; N116-G118 VanDerWaalsContact C-N 3.27Å; N116-G118 PolarHBondContact O-N 2.9Å
117L52.9Low44Very low46 Ų46116.9 Ų116.924%0.24163%0.634CS.*G310 helixtrans-73.1-15.3178.3-66.9169.9000114A96 W114 L119 L120A96-L117 HydrophobicContact CB-CD1 4.22Å; W114-L117 HydrophobicContact CE3-CD1 3.88Å; W114-L117 HydrophobicContact CZ3-CD1 4.48Å; L117-L119 PolarHBondContact O-N 3.34Å; L117-L120 HydrophobicContact CB-CD1 4.46Å; L117-L120 HydrophobicContact CD2-CD1 3.3Å; L117-L120 HydrophobicContact CD2-CG 4.35Å; L117-L120 HydrophobicContact CG-CD1 4.46Å; L117-L120 PolarHBondContact O-N 3.4Å
118G42Very low44.1Very low84 Ų84118 Ų11887%0.86663%0.627SS**G310 helixtrans-70.5-6.5176.200000114.9N116N116-G118 VanDerWaalsContact C-N 3.27Å; N116-G118 PolarHBondContact O-N 2.9Å
119L43.6Very low44Very low140 Ų140125.9 Ų125.973%0.73364%0.641SS**G310 helixtrans-109.92.2178.3-75.3166.6000113.5L117 R121L117-L119 PolarHBondContact O-N 3.34Å; L119-R121 PolarHBondContact O-N 3.08Å
120L46.5Very low44Very low96 Ų96122.4 Ų122.450%0.50363%0.633SS.*  trans-71.771.9168.8-71.5171.4000109.2L117 P122L117-L120 HydrophobicContact CB-CD1 4.46Å; L117-L120 HydrophobicContact CD2-CD1 3.3Å; L117-L120 HydrophobicContact CD2-CG 4.35Å; L117-L120 HydrophobicContact CG-CD1 4.46Å; L117-L120 PolarHBondContact O-N 3.4Å; L120-P122 WeakPolarHBondContact O-CD 3.12Å
121R39.8Very low44.2Very low229 Ų229126.6 Ų126.686%0.86466%0.656SS**  trans-79.6102.6148.7-68.1-168.4-172.8-158.42.8104.8L119 S123L119-R121 PolarHBondContact O-N 3.08Å; R121-S123 PolarHBondContact O-N 2.79Å
122P43Very low44.5Very low74 Ų74128.6 Ų128.648%0.48164%0.644SS.*PPolyproline II helixtrans-55133.8169.822.1-29.4000107.3I89 L120I89-P122 HydrophobicContact CD1-CB 4.49Å; I89-P122 HydrophobicContact CD1-CG 3.42Å; I89-P122 VanDerWaalsContact CD1-CG 3.42Å; I89-P122 HydrophobicContact CG1-CG 3.88Å; L120-P122 WeakPolarHBondContact O-CD 3.12Å
123S37.8Very low44.3Very low80 Ų80130.4 Ų130.456%0.55965%0.648SS**PPolyproline II helixtrans-55.6134.7169-560000106.7R121R121-S123 PolarHBondContact O-N 2.79Å
124P42.5Very low44.6Very low109 Ų109129.7 Ų129.771%0.70865%0.647SS**PPolyproline II helixtrans-52.4137.3169.520.5-29.4000108R126P124-R126 PolarHBondContact O-N 2.84Å; P124-R126 VanDerWaalsContact O-N 3.09Å
125P47.6Very low44.3Very low38 Ų38132.6 Ų132.625%0.24767%0.668CS.*PPolyproline II helixtrans-56.6123-175.922.7-33.4000108.9F127P125-F127 VanDerWaalsContact C-N 3.26Å; P125-F127 HydrophobicContact CB-CD2 3.86Å; P125-F127 HydrophobicContact CB-CE2 3.41Å; P125-F127 VanDerWaalsContact CB-CE2 3.41Å; P125-F127 HydrophobicContact CB-CZ 4.21Å; P125-F127 HydrophobicContact CG-CD2 4.03Å; P125-F127 HydrophobicContact CG-CE2 3.59Å; P125-F127 PolarHBondContact O-N 3.37Å
126R49Very low44.5Very low205 Ų205128 Ų12877%0.77466%0.661SS**  trans-7977.9-176.8-68.6-170.5-163.4-169.57.9109.7P124 K128P124-R126 PolarHBondContact O-N 2.84Å; P124-R126 VanDerWaalsContact O-N 3.09Å; R126-K128 PolarHBondContact O-N 3.16Å
127F53.8Low44.7Very low65 Ų65128.4 Ų128.429%0.28566%0.661SS.*  trans-75.3110.9169.2-70.5-75.7000109.7F76 V81 P125F76-F127 HydrophobicContact CE1-CD1 4.49Å; F76-F127 HydrophobicContact CE2-CD1 4.3Å; F76-F127 AromaticContact CE2-CE1 3.93Å; F76-F127 HydrophobicContact CE2-CE1 3.93Å; F76-F127 HydrophobicContact CE2-CZ 4.39Å; F76-F127 AromaticContact CZ-CD1 3.67Å; F76-F127 HydrophobicContact CZ-CD1 3.67Å; F76-F127 HydrophobicContact CZ-CD2 4.39Å; F76-F127 AromaticContact CZ-CE1 3.64Å; F76-F127 HydrophobicContact CZ-CE1 3.64Å; F76-F127 HydrophobicContact CZ-CE2 4.33Å; F76-F127 HydrophobicContact CZ-CG 4.08Å; F76-F127 AromaticContact CZ-CZ 4Å; F76-F127 HydrophobicContact CZ-CZ 4Å; V81-F127 HydrophobicContact CB-CE2 4.33Å; V81-F127 HydrophobicContact CG1-CE2 3.48Å; V81-F127 VanDerWaalsContact CG1-CE2 3.48Å; V81-F127 HydrophobicContact CG1-CZ 3.65Å; V81-F127 HydrophobicContact CG2-CZ 4.46Å; P125-F127 VanDerWaalsContact C-N 3.26Å; P125-F127 HydrophobicContact CB-CD2 3.86Å; P125-F127 HydrophobicContact CB-CE2 3.41Å; P125-F127 VanDerWaalsContact CB-CE2 3.41Å; P125-F127 HydrophobicContact CB-CZ 4.21Å; P125-F127 HydrophobicContact CG-CD2 4.03Å; P125-F127 HydrophobicContact CG-CE2 3.59Å; P125-F127 PolarHBondContact O-N 3.37Å
128K45.8Very low44.2Very low168 Ų168134.3 Ų134.373%0.7369%0.691SS**  trans-85.8110.9162.1-76.4-176.2179.5177.70108R126 F130R126-K128 PolarHBondContact O-N 3.16Å; K128-F130 HydrophobicContact CB-CD2 4.44Å; K128-F130 HydrophobicContact CB-CE2 3.84Å; K128-F130 HydrophobicContact CB-CZ 4.14Å; K128-F130 HydrophobicContact CD-CZ 4.29Å; K128-F130 WeakPolarHBondContact O-CD2 3.37Å; K128-F130 PolarHBondContact O-N 3.44Å
129R42.3Very low44.3Very low238 Ų238138.2 Ų138.290%0.89868%0.678SS**  trans-74.7113.6168.5-170.2174.3-175.9167.62.2107.8
130F41.2Very low44.4Very low171 Ų171138 Ų13875%0.7567%0.673SS**  trans-89.5120.4165.5-64.5-83.8000107K128K128-F130 HydrophobicContact CB-CD2 4.44Å; K128-F130 HydrophobicContact CB-CE2 3.84Å; K128-F130 HydrophobicContact CB-CZ 4.14Å; K128-F130 HydrophobicContact CD-CZ 4.29Å; K128-F130 WeakPolarHBondContact O-CD2 3.37Å; K128-F130 PolarHBondContact O-N 3.44Å
131S43.5Very low44.2Very low183 Ų183141.8 Ų141.8100%1.2869%0.689SS**  trans-108.80174.159.10000109.7

Retrieved 131 of 131 residues in 21.8 ms (Link to these results)