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Cytochrome b

Component of the ubiquinol-cytochrome c reductase complex (complex III or cytochrome b-c1 complex) that is part of the mitochondrial respiratory chain. The b-c1 complex mediates electron transfer from ubiquinol to cytochrome c. Contributes to the generation of a proton gradient across the mitochondrial membrane that is then used for ATP synthesis.

AlphaFold DB , UniProt , Accession A0A023QBI1, Species HUMAN (Homo sapiens, Human), Gene CYTB, Length 380 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
1M80.4Confident91.7Very high243 Ų243114.2 Ų114.2100%1.19759%0.59SS**  0133.50-71.7174.7171.900108.5
2T87.4Confident91.8Very high101 Ų101112.9 Ų112.962%0.6258%0.577SS**  trans-66.1133.7173.219.70000109.4I7T2-I7 WeakPolarHBondContact O-CD1 3.46Å
3P92.5Very high91.9Very high60 Ų60113.7 Ų113.739%0.3958%0.582SS.*  trans-70148.4-176.529.2-35.3000110.8R5 K6P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.07Å; P3-R5 PolarHBondContact O-N 3.11Å; P3-K6 HydrophobicContact CG-CB 4.42Å; P3-K6 HydrophobicContact CG-CD 4.05Å; P3-K6 HydrophobicContact CG-CG 4.03Å; P3-K6 PolarHBondContact O-N 3.42Å
4M92.7Very high92Very high151 Ų151112.2 Ų112.274%0.74457%0.574SS**Hα-helixtrans-51.9-34.5178.7-81.9-175.3155.200113.1K6 I7 N8 M11M4-K6 PolarHBondContact O-N 2.97Å; M4-I7 PolarHBondContact O-N 3.22Å; M4-N8 PolarHBondContact O-N 3.13Å; M4-M11 HydrophobicContact CB-SD 4.5Å
5R94.3Very high92.2Very high101 Ų101104.7 Ų104.738%0.38154%0.536SS..Hα-helixtrans-58.7-20.1177.579.4-176.4-162-163.73.2114.7P3 M11 K12 N15 D20P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.07Å; P3-R5 PolarHBondContact O-N 3.11Å; R5-M11 CarbonylContact O-C 3.46Å; R5-K12 VanDerWaalsContact O-CA 3.32Å; R5-K12 WeakPolarHBondContact O-CA 3.35Å; R5-K12 PolarHBondContact O-N 3.43Å; R5-N15 HydrophobicContact CB-CB 4.46Å; R5-N15 WeakPolarHBondContact CD-OD1 3.36Å; R5-N15 HydrophobicContact CG-CB 4.5Å; R5-N15 WeakPolarHBondContact CG-OD1 3.36Å; R5-N15 PolarHBondContact NE-OD1 3.21Å; R5-N15 VanDerWaalsContact O-CB 3.3Å; R5-N15 WeakPolarHBondContact O-CB 3.35Å; R5-D20 IonicContact CZ-OD1 3.88Å; R5-D20 IonicContact NE-OD2 3.32Å; R5-D20 IonicContact NH2-OD1 3.45Å; R5-D20 PolarHBondContact NH2-OD1 3.08Å; R5-D20 IonicContact NH2-OD2 3.91Å; R5-D20 PolarHBondContact NH2-OD2 3.3Å
6K93.1Very high92.3Very high96 Ų96104.8 Ų104.842%0.41753%0.533SS..Hα-helixtrans-100.7-12.3177-66.5-172.7178-170.50113.4P3 M4 D20P3-K6 HydrophobicContact CG-CB 4.42Å; P3-K6 HydrophobicContact CG-CD 4.05Å; P3-K6 HydrophobicContact CG-CG 4.03Å; P3-K6 PolarHBondContact O-N 3.42Å; M4-K6 PolarHBondContact O-N 2.97Å; K6-D20 WeakPolarHBondContact CE-OD2 3.31Å; K6-D20 IonicContact NZ-OD2 3.61Å; K6-D20 PolarHBondContact NZ-OD2 3.49Å
7I94Very high92.3Very high104 Ų104100.9 Ų100.953%0.53352%0.518SS..Hα-helixtrans-105.6-49-173.4-58.1168.6000110.9T2 M4T2-I7 WeakPolarHBondContact O-CD1 3.46Å; M4-I7 PolarHBondContact O-N 3.22Å
8N95.5Very high92.4Very high68 Ų68101.2 Ų101.236%0.36452%0.515SS..SBendtrans-64.7128.3-177.4175.7-79000109.9M4 L10 M11 K12M4-N8 PolarHBondContact O-N 3.13Å; N8-L10 VanDerWaalsContact C-N 3.31Å; N8-L10 PolarHBondContact O-N 3.34Å; N8-L10 PolarHBondContact OD1-N 3.35Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.06Å; N8-M11 HydrophobicContact CB-SD 4.15Å; N8-M11 PolarHBondContact O-N 3.13Å; N8-M11 PolarHBondContact OD1-N 2.89Å; N8-K12 WeakPolarHBondContact O-CB 3.38Å; N8-K12 PolarHBondContact O-N 3.2Å
9P93.5Very high92.6Very high107 Ų10798.1 Ų98.170%0.69550%0.499SS*.Hα-helixtrans-55.7-39.3-173.6-28.935.3000114.8L13P9-L13 PolarHBondContact O-N 3.46Å
10L91.7Very high92.9Very high132 Ų13294.9 Ų94.969%0.69148%0.483SS*.Hα-helixtrans-75.4-47.8179-66.1175.5000111.5N8 K12 L13 I14N8-L10 VanDerWaalsContact C-N 3.31Å; N8-L10 PolarHBondContact O-N 3.34Å; N8-L10 PolarHBondContact OD1-N 3.35Å; L10-K12 PolarHBondContact O-N 2.69Å; L10-L13 WeakPolarHBondContact O-CB 3.18Å; L10-L13 PolarHBondContact O-N 2.91Å; L10-I14 PolarHBondContact O-N 3.08Å
11M93.4Very high93.1Very high93 Ų9391.7 Ų91.746%0.45847%0.467SS..Hα-helixtrans-64.7-30.1178.7-61.1-177.8172.700111.9M4 R5 N8 L13 I14 N15M4-M11 HydrophobicContact CB-SD 4.5Å; R5-M11 CarbonylContact O-C 3.46Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.06Å; N8-M11 HydrophobicContact CB-SD 4.15Å; N8-M11 PolarHBondContact O-N 3.13Å; N8-M11 PolarHBondContact OD1-N 2.89Å; M11-L13 VanDerWaalsContact C-N 3.35Å; M11-I14 PolarHBondContact O-N 2.86Å; M11-N15 VanDerWaalsContact O-CB 3.24Å; M11-N15 WeakPolarHBondContact O-CB 3.19Å; M11-N15 PolarHBondContact O-N 2.89Å
12K93.4Very high93.9Very high99 Ų9983.5 Ų83.543%0.4343%0.432SS..Hα-helixtrans-62.1-42.6175.8-179.7175.4179.2-173.70111.2R5 N8 L10 N15 H16R5-K12 VanDerWaalsContact O-CA 3.32Å; R5-K12 WeakPolarHBondContact O-CA 3.35Å; R5-K12 PolarHBondContact O-N 3.43Å; N8-K12 WeakPolarHBondContact O-CB 3.38Å; N8-K12 PolarHBondContact O-N 3.2Å; L10-K12 PolarHBondContact O-N 2.69Å; K12-N15 PolarHBondContact O-N 3.03Å; K12-H16 WeakPolarHBondContact CE-NE2 3.33Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.45Å; K12-H16 PolarHBondContact O-CD2 3.26Å; K12-H16 PolarHBondContact O-N 3.1Å
13L92.4Very high94.4Very high123 Ų12378.8 Ų78.864%0.64440%0.403SS*.Hα-helixtrans-58.3-52.7174.9-177.466.9000110.6P9 L10 M11 N15 H16 S17P9-L13 PolarHBondContact O-N 3.46Å; L10-L13 WeakPolarHBondContact O-CB 3.18Å; L10-L13 PolarHBondContact O-N 2.91Å; M11-L13 VanDerWaalsContact C-N 3.35Å; L13-N15 VanDerWaalsContact C-N 3.29Å; L13-N15 PolarHBondContact O-N 3.41Å; L13-H16 PolarHBondContact O-N 3.28Å; L13-S17 WeakPolarHBondContact O-CB 3.42Å; L13-S17 PolarHBondContact O-N 3.12Å; L13-S17 PolarHBondContact O-OG 3.02Å
14I93.7Very high94.7Very high93 Ų9376 Ų7648%0.47739%0.385SS..Hα-helixtrans-58.9-41.9177.8-60.5172.2000110.9L10 M11 H16 S17 F18 I19L10-I14 PolarHBondContact O-N 3.08Å; M11-I14 PolarHBondContact O-N 2.86Å; I14-H16 PolarHBondContact O-N 2.96Å; I14-S17 PolarHBondContact O-N 3.44Å; I14-S17 PolarHBondContact O-OG 3.45Å; I14-F18 HydrophobicContact CG2-CB 4.5Å; I14-F18 WeakPolarHBondContact O-CA 3.44Å; I14-F18 VanDerWaalsContact O-CB 3.26Å; I14-F18 WeakPolarHBondContact O-CB 3.48Å; I14-F18 PolarHBondContact O-N 2.79Å; I14-I19 PolarHBondContact O-N 3.41Å
15N95.6Very high95Very high0 Ų070.7 Ų70.70%036%0.363CS..Iπ-helixtrans-63.2-45.4-179-174.579.8000111.5R5 M11 K12 L13 I19 D20R5-N15 HydrophobicContact CB-CB 4.46Å; R5-N15 WeakPolarHBondContact CD-OD1 3.36Å; R5-N15 HydrophobicContact CG-CB 4.5Å; R5-N15 WeakPolarHBondContact CG-OD1 3.36Å; R5-N15 PolarHBondContact NE-OD1 3.21Å; R5-N15 VanDerWaalsContact O-CB 3.3Å; R5-N15 WeakPolarHBondContact O-CB 3.35Å; M11-N15 VanDerWaalsContact O-CB 3.24Å; M11-N15 WeakPolarHBondContact O-CB 3.19Å; M11-N15 PolarHBondContact O-N 2.89Å; K12-N15 PolarHBondContact O-N 3.03Å; L13-N15 VanDerWaalsContact C-N 3.29Å; L13-N15 PolarHBondContact O-N 3.41Å; N15-I19 PolarHBondContact O-N 3.14Å; N15-I19 VanDerWaalsContact O-N 3.1Å; N15-D20 PolarHBondContact ND2-OD2 3.03Å; N15-D20 PolarHBondContact O-N 3.36Å; N15-D20 PolarHBondContact OD1-OD2 3Å
16H93.8Very high95.1Very high105 Ų10568.6 Ų68.649%0.48636%0.359SS..Iπ-helixtrans-73.7-31.3179.6-74.3-66.9000113.4K12 L13 I14 L21K12-H16 WeakPolarHBondContact CE-NE2 3.33Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.45Å; K12-H16 PolarHBondContact O-CD2 3.26Å; K12-H16 PolarHBondContact O-N 3.1Å; L13-H16 PolarHBondContact O-N 3.28Å; I14-H16 PolarHBondContact O-N 2.96Å; H16-L21 WeakPolarHBondContact O-CB 3.47Å; H16-L21 WeakPolarHBondContact O-CD1 3.37Å
17S92.1Very high95.4Very high39 Ų3964.8 Ų64.827%0.27334%0.343SS..Iπ-helixtrans-89.5-14.5-177.671.10000114.2L13 I14L13-S17 WeakPolarHBondContact O-CB 3.42Å; L13-S17 PolarHBondContact O-N 3.12Å; L13-S17 PolarHBondContact O-OG 3.02Å; I14-S17 PolarHBondContact O-N 3.44Å; I14-S17 PolarHBondContact O-OG 3.45Å
18F93.7Very high95.6Very high107 Ų10761.5 Ų61.547%0.46933%0.33SS..Iπ-helixtrans-143.1-36.8-170-163.1-96.6000115.1I14 F220 T225I14-F18 HydrophobicContact CG2-CB 4.5Å; I14-F18 WeakPolarHBondContact O-CA 3.44Å; I14-F18 VanDerWaalsContact O-CB 3.26Å; I14-F18 WeakPolarHBondContact O-CB 3.48Å; I14-F18 PolarHBondContact O-N 2.79Å; F18-F220 HydrophobicContact CD2-CE1 4.36Å; F18-F220 HydrophobicContact CE2-CE1 4.04Å; F18-F220 HydrophobicContact CZ-CE1 4.19Å; F18-F220 WeakPolarHBondContact O-CB 3.5Å; F18-F220 WeakPolarHBondContact O-CD1 3.36Å; F18-T225 HydrophobicContact CD1-CG2 4.5Å; F18-T225 HydrophobicContact CE1-CG2 3.78Å; F18-T225 HydrophobicContact CZ-CG2 4.14Å
19I96.8Very high95.8Very high41 Ų4161.6 Ų61.621%0.2134%0.34CS..Iπ-helixtrans-93-66.5-173.7-56.5176.1000110.9I14 N15 L21 F220 H221I14-I19 PolarHBondContact O-N 3.41Å; N15-I19 PolarHBondContact O-N 3.14Å; N15-I19 VanDerWaalsContact O-N 3.1Å; I19-L21 VanDerWaalsContact C-N 3.27Å; I19-L21 PolarHBondContact O-N 3.47Å; I19-F220 PolarHBondContact O-N 3.37Å; I19-H221 HydrophobicContact CG2-CB 4.1Å; I19-H221 PolarHBondContact O-N 3.32Å
20D97.3Very high96Very high34 Ų3461.1 Ų61.118%0.18232%0.324CS..SBendtrans-90.914.2-176.7-67.8-13.4000111.6R5 K6 N15 P22R5-D20 IonicContact CZ-OD1 3.88Å; R5-D20 IonicContact NE-OD2 3.32Å; R5-D20 IonicContact NH2-OD1 3.45Å; R5-D20 PolarHBondContact NH2-OD1 3.08Å; R5-D20 IonicContact NH2-OD2 3.91Å; R5-D20 PolarHBondContact NH2-OD2 3.3Å; K6-D20 WeakPolarHBondContact CE-OD2 3.31Å; K6-D20 IonicContact NZ-OD2 3.61Å; K6-D20 PolarHBondContact NZ-OD2 3.49Å; N15-D20 PolarHBondContact ND2-OD2 3.03Å; N15-D20 PolarHBondContact O-N 3.36Å; N15-D20 PolarHBondContact OD1-OD2 3Å; D20-P22 WeakPolarHBondContact O-CD 3.4Å
21L97.5Very high96.3Very high28 Ų2855.9 Ų55.915%0.14730%0.295CS..  trans-60.8117.3179.6177.369.3000110.5H16 I19 T23 F220H16-L21 WeakPolarHBondContact O-CB 3.47Å; H16-L21 WeakPolarHBondContact O-CD1 3.37Å; I19-L21 VanDerWaalsContact C-N 3.27Å; I19-L21 PolarHBondContact O-N 3.47Å; L21-T23 PolarHBondContact O-N 3.44Å; L21-T23 PolarHBondContact O-OG1 2.94Å; L21-F220 HydrophobicContact CB-CB 3.91Å; L21-F220 HydrophobicContact CD2-CD2 4.2Å; L21-F220 PolarHBondContact O-N 2.8Å
22P97.5Very high96.6Very high71 Ų7152 Ų5246%0.46128%0.277SS..EExtended strand (participates in β ladder)trans-72.4114.4178.3-17.632.8000111D20 K217D20-P22 WeakPolarHBondContact O-CD 3.4Å; P22-K217 HydrophobicContact CB-CB 4.14Å; P22-K217 HydrophobicContact CB-CD 3.63Å
23T98.1Very high96.8Very high3 Ų348.8 Ų48.82%0.01826%0.262CS..EExtended strand (participates in β ladder)trans-120.4139.6-173.2-52.70000109.9L21 S25 I27 K217 I218 Y224L21-T23 PolarHBondContact O-N 3.44Å; L21-T23 PolarHBondContact O-OG1 2.94Å; T23-S25 PolarHBondContact O-N 2.92Å; T23-I27 HydrophobicContact CG2-CD1 3.52Å; T23-I27 HydrophobicContact CG2-CG1 4.33Å; T23-K217 WeakPolarHBondContact O-CA 3.35Å; T23-I218 PolarHBondContact N-O 2.81Å; T23-I218 PolarHBondContact O-N 2.69Å; T23-Y224 VanDerWaalsContact CB-CE2 3.49Å; T23-Y224 HydrophobicContact CG2-CD2 3.48Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.48Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.35Å
24P98.4Very high97.1Very high0 Ų044.5 Ų44.50%025%0.248CC..EExtended strand (participates in β ladder)trans-56.3130.2177.2-17.225.9000110.7N26 I27 S205 N207 S213 Y224P24-N26 PolarHBondContact O-N 3.46Å; P24-N26 VanDerWaalsContact O-N 3.11Å; P24-I27 HydrophobicContact CB-CG2 4Å; P24-I27 HydrophobicContact CG-CG2 4.08Å; P24-S205 WeakPolarHBondContact CG-O 3.46Å; P24-N207 HydrophobicContact CB-CB 3.81Å; P24-N207 HydrophobicContact CG-CB 4.19Å; P24-S213 WeakPolarHBondContact CB-OG 3.42Å; P24-S213 WeakPolarHBondContact CG-OG 3.14Å; P24-Y224 PolarHBondContact O-OH 3.42Å
25S98.3Very high97.3Very high41 Ų4142.2 Ų42.229%0.28724%0.24SC..THydrogen-bonded Turntrans-59.2-24.8-174.763.90000114.6T23 D216 Y224T23-S25 PolarHBondContact O-N 2.92Å; S25-D216 WeakPolarHBondContact CB-OD2 3.44Å; S25-D216 PolarHBondContact N-O 3.44Å; S25-D216 PolarHBondContact OG-OD2 2.88Å; S25-Y224 WeakPolarHBondContact CA-OH 3.37Å; S25-Y224 PolarHBondContact O-OH 2.89Å
26N98.3Very high97.5Very high56 Ų5642.9 Ų42.930%0.29924%0.244SC..THydrogen-bonded Turntrans-104.513.7-168.769.8-29.5000114.8P24 S28 N207 P208 L209P24-N26 PolarHBondContact O-N 3.46Å; P24-N26 VanDerWaalsContact O-N 3.11Å; N26-S28 PolarHBondContact O-N 3Å; N26-N207 PolarHBondContact ND2-OD1 2.71Å; N26-N207 WeakPolarHBondContact OD1-CB 3.38Å; N26-P208 VanDerWaalsContact O-CD 3.3Å; N26-P208 WeakPolarHBondContact O-CD 3.33Å; N26-P208 WeakPolarHBondContact O-CG 3.4Å; N26-L209 WeakPolarHBondContact ND2-CD1 3.4Å
27I98.4Very high97.7Very high16 Ų1639.2 Ų39.28%0.08223%0.227CC..  trans-65.1128.717761.7172.1000111.6T23 P24 W31 N206 N207 Y224 K227T23-I27 HydrophobicContact CG2-CD1 3.52Å; T23-I27 HydrophobicContact CG2-CG1 4.33Å; P24-I27 HydrophobicContact CB-CG2 4Å; P24-I27 HydrophobicContact CG-CG2 4.08Å; I27-W31 HydrophobicContact CB-CB 4.08Å; I27-W31 HydrophobicContact CB-CD2 3.8Å; I27-W31 HydrophobicContact CB-CE3 4.29Å; I27-W31 HydrophobicContact CB-CG 3.67Å; I27-W31 HydrophobicContact CD1-CB 3.88Å; I27-W31 HydrophobicContact CD1-CG 3.98Å; I27-W31 HydrophobicContact CG1-CB 4.32Å; I27-W31 HydrophobicContact CG1-CG 4.33Å; I27-W31 HydrophobicContact CG2-CD2 3.97Å; I27-W31 HydrophobicContact CG2-CG 3.98Å; I27-W31 HydrophobicContact CG2-CZ2 4.5Å; I27-N206 WeakPolarHBondContact CG2-O 3.29Å; I27-N207 HydrophobicContact CG2-CB 4.15Å; I27-Y224 HydrophobicContact CD1-CD1 3.79Å; I27-Y224 HydrophobicContact CD1-CD2 4.4Å; I27-Y224 HydrophobicContact CD1-CE1 3.54Å; I27-Y224 HydrophobicContact CD1-CE2 4.17Å; I27-Y224 HydrophobicContact CD1-CG 4.25Å; I27-Y224 HydrophobicContact CG1-CD1 3.96Å; I27-Y224 HydrophobicContact CG1-CE1 3.21Å; I27-Y224 HydrophobicContact CG1-CE2 4.24Å; I27-K227 PolarHBondContact O-NZ 3.37Å
28S98.4Very high98Very high36 Ų3639 Ų3925%0.25223%0.231SC..  trans-83.9-178.5-175.565.50000112.7N26 W30 W31 K227N26-S28 PolarHBondContact O-N 3Å; S28-W30 PolarHBondContact O-N 2.61Å; S28-W30 VanDerWaalsContact O-N 3.12Å; S28-W31 PolarHBondContact O-N 3.45Å; S28-W31 VanDerWaalsContact O-N 3.11Å; S28-K227 PolarHBondContact O-NZ 3.22Å
29A98.4Very high98.3Very high69 Ų6935 Ų3557%0.5722%0.219SC*.G310 helixtrans-57.1-24.6178.600000113.5W31 N32A29-W31 PolarHBondContact O-N 2.86Å; A29-W31 VanDerWaalsContact O-N 3.13Å; A29-N32 WeakPolarHBondContact CA-OD1 3.17Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.32Å; A29-N32 PolarHBondContact O-N 2.99Å; A29-N32 PolarHBondContact O-OD1 3.34Å; A29-N32 VanDerWaalsContact O-OD1 3.13Å
30W98.7Very high98.4Very high97 Ų9733.1 Ų33.137%0.36721%0.209SC..G310 helixtrans-61.4-21.3177-59115.8000113.6S28 N32 F33 L96 R100 Y104S28-W30 PolarHBondContact O-N 2.61Å; S28-W30 VanDerWaalsContact O-N 3.12Å; W30-N32 VanDerWaalsContact C-N 3.33Å; W30-F33 HydrophobicContact CE3-CD2 4.19Å; W30-F33 AromaticContact CE3-CE2 3.63Å; W30-F33 HydrophobicContact CE3-CE2 3.63Å; W30-F33 AromaticContact CZ3-CE2 3.97Å; W30-F33 HydrophobicContact CZ3-CE2 3.97Å; W30-L96 HydrophobicContact CZ3-CD2 4.13Å; W30-R100 HydrophobicContact CB-CB 4.06Å; W30-R100 HydrophobicContact CB-CG 3.52Å; W30-Y104 HydrophobicContact CB-CE2 4.26Å; W30-Y104 AromaticContact CD1-CE2 3.8Å; W30-Y104 HydrophobicContact CG-CE2 4.19Å
31W98.7Very high98.5Very high23 Ų2332.3 Ų32.39%0.08720%0.204CC..G310 helixtrans-76.5-18.5175.4-87-113.8000113.8I27 S28 A29 F33 G34 R100 Y104 N206 P208I27-W31 HydrophobicContact CB-CB 4.08Å; I27-W31 HydrophobicContact CB-CD2 3.8Å; I27-W31 HydrophobicContact CB-CE3 4.29Å; I27-W31 HydrophobicContact CB-CG 3.67Å; I27-W31 HydrophobicContact CD1-CB 3.88Å; I27-W31 HydrophobicContact CD1-CG 3.98Å; I27-W31 HydrophobicContact CG1-CB 4.32Å; I27-W31 HydrophobicContact CG1-CG 4.33Å; I27-W31 HydrophobicContact CG2-CD2 3.97Å; I27-W31 HydrophobicContact CG2-CG 3.98Å; I27-W31 HydrophobicContact CG2-CZ2 4.5Å; S28-W31 PolarHBondContact O-N 3.45Å; S28-W31 VanDerWaalsContact O-N 3.11Å; A29-W31 PolarHBondContact O-N 2.86Å; A29-W31 VanDerWaalsContact O-N 3.13Å; W31-F33 PolarHBondContact O-N 2.71Å; W31-G34 PolarHBondContact O-N 3.13Å; W31-R100 VanDerWaalsContact CE2-NH1 3.25Å; W31-R100 HydrophobicContact CE3-CG 4.29Å; W31-R100 HydrophobicContact CZ3-CG 4.19Å; W31-Y104 HydrophobicContact CH2-CD1 4.15Å; W31-Y104 AromaticContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CE2 4.02Å; W31-Y104 AromaticContact CH2-CG 3.61Å; W31-Y104 HydrophobicContact CH2-CG 3.61Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; W31-N206 VanDerWaalsContact CE2-O 3.26Å; W31-N206 HydrophobicContact CZ2-CB 4.29Å; W31-N206 VanDerWaalsContact CZ2-O 3.25Å; W31-N206 WeakPolarHBondContact CZ2-O 3.26Å; W31-N206 PolarHBondContact NE1-O 3.48Å; W31-P208 HydrophobicContact CH2-CG 4.13Å; W31-P208 HydrophobicContact CZ3-CG 3.87Å
32N98.7Very high98.5Very high12 Ų1236.3 Ų36.36%0.06423%0.225CC..G310 helixtrans-66.6-23.1178.9-67.269000112.7A29 W30 G34 S35 L36 K227 D228A29-N32 WeakPolarHBondContact CA-OD1 3.17Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.32Å; A29-N32 PolarHBondContact O-N 2.99Å; A29-N32 PolarHBondContact O-OD1 3.34Å; A29-N32 VanDerWaalsContact O-OD1 3.13Å; W30-N32 VanDerWaalsContact C-N 3.33Å; N32-G34 PolarHBondContact O-N 2.76Å; N32-G34 VanDerWaalsContact O-N 3.09Å; N32-S35 PolarHBondContact O-N 3.34Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 2.69Å; N32-L36 WeakPolarHBondContact O-CG 3.33Å; N32-L36 PolarHBondContact O-N 2.74Å; N32-K227 PolarHBondContact ND2-O 3.24Å; N32-K227 WeakPolarHBondContact OD1-CE 3.26Å; N32-K227 PolarHBondContact OD1-NZ 2.92Å; N32-D228 PolarHBondContact ND2-OD1 3.43Å
33F98.8Very high98.6Very high31 Ų3134.4 Ų34.414%0.13621%0.21CC..Hα-helixtrans-62.8-20.1-179.6-69.9-68.3000113.5W30 W31 L36 L37 C93 L96 H97W30-F33 HydrophobicContact CE3-CD2 4.19Å; W30-F33 AromaticContact CE3-CE2 3.63Å; W30-F33 HydrophobicContact CE3-CE2 3.63Å; W30-F33 AromaticContact CZ3-CE2 3.97Å; W30-F33 HydrophobicContact CZ3-CE2 3.97Å; W31-F33 PolarHBondContact O-N 2.71Å; F33-L36 HydrophobicContact CD1-CD1 3.95Å; F33-L36 HydrophobicContact CE1-CD1 4.07Å; F33-L37 WeakPolarHBondContact O-CB 3.31Å; F33-L37 WeakPolarHBondContact O-CD1 3.38Å; F33-L37 WeakPolarHBondContact O-CG 3.44Å; F33-L37 PolarHBondContact O-N 2.97Å; F33-L37 VanDerWaalsContact O-N 3.07Å; F33-C93 HydrophobicContact CD1-CB 4Å; F33-L96 HydrophobicContact CD1-CB 4.08Å; F33-L96 HydrophobicContact CD1-CD1 4.4Å; F33-L96 HydrophobicContact CD2-CB 3.91Å; F33-L96 HydrophobicContact CE1-CB 3.96Å; F33-L96 HydrophobicContact CE1-CD1 3.5Å; F33-L96 VanDerWaalsContact CE1-CD1 3.5Å; F33-L96 HydrophobicContact CE1-CG 4.36Å; F33-L96 HydrophobicContact CE2-CB 3.78Å; F33-L96 HydrophobicContact CE2-CD1 4.02Å; F33-L96 HydrophobicContact CG-CB 4.08Å; F33-L96 HydrophobicContact CZ-CB 3.82Å; F33-L96 HydrophobicContact CZ-CD1 3.28Å; F33-L96 HydrophobicContact CZ-CG 4.17Å; F33-H97 HydrophobicContact CB-CB 3.92Å
34G98.2Very high98.6Very high33 Ų3335.3 Ų35.334%0.3422%0.215SC..Hα-helixtrans-65-50.8170.900000112.6W31 N32 L37 G38 H97W31-G34 PolarHBondContact O-N 3.13Å; N32-G34 PolarHBondContact O-N 2.76Å; N32-G34 VanDerWaalsContact O-N 3.09Å; G34-L37 PolarHBondContact O-N 3.24Å; G34-G38 PolarHBondContact O-N 3.47Å; G34-H97 PolarHBondContact N-ND1 2.93Å
35S98.3Very high98.6Very high45 Ų4537.2 Ų37.232%0.31522%0.224SC..Hα-helixtrans-70.4-34.6177.846.10000112.5N32 L37 G38 A39 D228N32-S35 PolarHBondContact O-N 3.34Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 2.69Å; S35-L37 PolarHBondContact O-N 3.37Å; S35-G38 PolarHBondContact O-N 3.5Å; S35-A39 PolarHBondContact O-N 3.25Å; S35-D228 WeakPolarHBondContact CB-OD2 2.85Å; S35-D228 PolarHBondContact OG-OD2 3.37Å
36L98.8Very high98.7Very high14 Ų1438.4 Ų38.47%0.07323%0.23CC..Hα-helixtrans-63.3-38.3173.3-65.7-178.8000112.8N32 F33 G38 A39 C40 L232 F235N32-L36 WeakPolarHBondContact O-CG 3.33Å; N32-L36 PolarHBondContact O-N 2.74Å; F33-L36 HydrophobicContact CD1-CD1 3.95Å; F33-L36 HydrophobicContact CE1-CD1 4.07Å; L36-G38 VanDerWaalsContact C-N 3.33Å; L36-A39 WeakPolarHBondContact O-CB 3.49Å; L36-A39 PolarHBondContact O-N 3.31Å; L36-C40 PolarHBondContact O-N 3.13Å; L36-C40 PolarHBondContact O-SG 3Å; L36-L232 HydrophobicContact CD2-CB 4.48Å; L36-F235 HydrophobicContact CD1-CB 4.45Å; L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.41Å; L36-F235 HydrophobicContact CD2-CG 4.05Å
37L98.9Very high98.7Very high27 Ų2736.2 Ų36.214%0.14122%0.219CC..Hα-helixtrans-64-38.7173.3-75.7168.2000112F33 G34 S35 C40 L41 F90 C93 L94 H97F33-L37 WeakPolarHBondContact O-CB 3.31Å; F33-L37 WeakPolarHBondContact O-CD1 3.38Å; F33-L37 WeakPolarHBondContact O-CG 3.44Å; F33-L37 PolarHBondContact O-N 2.97Å; F33-L37 VanDerWaalsContact O-N 3.07Å; G34-L37 PolarHBondContact O-N 3.24Å; S35-L37 PolarHBondContact O-N 3.37Å; L37-C40 PolarHBondContact O-N 3Å; L37-L41 PolarHBondContact O-N 3.3Å; L37-F90 HydrophobicContact CD2-CD1 3.51Å; L37-F90 HydrophobicContact CD2-CE1 3.48Å; L37-F90 VanDerWaalsContact CD2-CE1 3.48Å; L37-C93 HydrophobicContact CD2-CB 3.78Å; L37-C93 HydrophobicContact CG-CB 4.03Å; L37-L94 HydrophobicContact CD2-CB 3.93Å; L37-L94 HydrophobicContact CD2-CG 4.37Å; L37-H97 HydrophobicContact CD1-CB 3.77Å
38G98.7Very high98.7Very high34 Ų3436.2 Ų36.235%0.35122%0.223SC..Hα-helixtrans-60.2-44171.100000112.4G34 S35 L36 L41 I42G34-G38 PolarHBondContact O-N 3.47Å; S35-G38 PolarHBondContact O-N 3.5Å; L36-G38 VanDerWaalsContact C-N 3.33Å; G38-L41 PolarHBondContact O-N 3.15Å; G38-I42 WeakPolarHBondContact O-CG1 3.46Å; G38-I42 PolarHBondContact O-N 3.48Å; G38-I42 VanDerWaalsContact O-N 3.08Å
39A98.8Very high98.7Very high25 Ų2538.2 Ų38.221%0.20723%0.23CC..Hα-helixtrans-64.1-41.2175.200000112.3S35 L36 L41 I42 L43 L232S35-A39 PolarHBondContact O-N 3.25Å; L36-A39 WeakPolarHBondContact O-CB 3.49Å; L36-A39 PolarHBondContact O-N 3.31Å; A39-L41 PolarHBondContact O-N 2.88Å; A39-I42 PolarHBondContact O-N 3.49Å; A39-L43 WeakPolarHBondContact O-CB 3.46Å; A39-L43 PolarHBondContact O-N 2.97Å; A39-L232 HydrophobicContact CB-CD1 3.72Å
40C98.9Very high98.8Very high0 Ų040.3 Ų40.30%023%0.226CC..Hα-helixtrans-59.2-46.2173.8-66.60000111L36 L37 I42 L43 Q44 F90 F235L36-C40 PolarHBondContact O-N 3.13Å; L36-C40 PolarHBondContact O-SG 3Å; L37-C40 PolarHBondContact O-N 3Å; C40-I42 PolarHBondContact O-N 3.32Å; C40-L43 WeakPolarHBondContact O-CB 3.43Å; C40-L43 PolarHBondContact O-N 3.34Å; C40-Q44 WeakPolarHBondContact O-CG 3.4Å; C40-Q44 PolarHBondContact O-N 3.13Å; C40-F90 HydrophobicContact CB-CB 4.07Å; C40-F90 HydrophobicContact CB-CD1 4.4Å; C40-F90 HydrophobicContact CB-CD2 3.52Å; C40-F90 HydrophobicContact CB-CE2 4.02Å; C40-F90 HydrophobicContact CB-CG 3.73Å; C40-F235 WeakPolarHBondContact SG-CE2 3.38Å; C40-F235 WeakPolarHBondContact SG-CZ 3.31Å
41L98.9Very high98.8Very high18 Ų1836.8 Ų36.89%0.09421%0.214CC..Hα-helixtrans-61.2-44.7179.3-177.361.7000112.1L37 G38 A39 Q44 I45 F90 P186 I189 A190L37-L41 PolarHBondContact O-N 3.3Å; G38-L41 PolarHBondContact O-N 3.15Å; A39-L41 PolarHBondContact O-N 2.88Å; L41-Q44 PolarHBondContact O-N 3.44Å; L41-I45 HydrophobicContact CD1-CD1 3.94Å; L41-I45 HydrophobicContact CD1-CG1 4.27Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.32Å; L41-I45 WeakPolarHBondContact O-CG1 3.35Å; L41-I45 PolarHBondContact O-N 3.41Å; L41-F90 HydrophobicContact CB-CE2 4.09Å; L41-F90 HydrophobicContact CB-CZ 4.34Å; L41-F90 HydrophobicContact CD1-CE2 4.28Å; L41-P186 HydrophobicContact CD1-CB 4.49Å; L41-I189 HydrophobicContact CD1-CB 4.35Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 4Å; L41-A190 HydrophobicContact CD2-CB 3.94Å
42I98.9Very high98.8Very high112 Ų11236.8 Ų36.857%0.57422%0.219SC*.Hα-helixtrans-62.8-44.3176-66.5167.7000110.7G38 A39 C40 Q44 I45 T46G38-I42 WeakPolarHBondContact O-CG1 3.46Å; G38-I42 PolarHBondContact O-N 3.48Å; G38-I42 VanDerWaalsContact O-N 3.08Å; A39-I42 PolarHBondContact O-N 3.49Å; C40-I42 PolarHBondContact O-N 3.32Å; I42-Q44 PolarHBondContact O-N 3.3Å; I42-I45 PolarHBondContact O-N 2.9Å; I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.39Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.42Å; I42-T46 PolarHBondContact O-N 2.88Å; I42-T46 PolarHBondContact O-OG1 3.38Å
43L98.9Very high98.8Very high30 Ų3041.9 Ų41.916%0.15724%0.244CC..Hα-helixtrans-58.4-47.4176178.874.6000111.3A39 C40 T46 T47 L239A39-L43 WeakPolarHBondContact O-CB 3.46Å; A39-L43 PolarHBondContact O-N 2.97Å; C40-L43 WeakPolarHBondContact O-CB 3.43Å; C40-L43 PolarHBondContact O-N 3.34Å; L43-T46 PolarHBondContact O-N 2.85Å; L43-T46 PolarHBondContact O-OG1 2.89Å; L43-T47 HydrophobicContact CD1-CG2 4.07Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.47Å; L43-T47 WeakPolarHBondContact O-CG2 3.5Å; L43-T47 PolarHBondContact O-N 3.3Å; L43-T47 PolarHBondContact O-OG1 3.45Å; L43-L239 HydrophobicContact CD2-CD2 3.43Å; L43-L239 VanDerWaalsContact CD2-CD2 3.43Å
44Q98.9Very high98.8Very high23 Ų2344.3 Ų44.311%0.10726%0.256CS..Hα-helixtrans-66.5-43.2-178.9-67.9-49.1106.900112.1C40 L41 I42 T47 G48 H83 G86 F90C40-Q44 WeakPolarHBondContact O-CG 3.4Å; C40-Q44 PolarHBondContact O-N 3.13Å; L41-Q44 PolarHBondContact O-N 3.44Å; I42-Q44 PolarHBondContact O-N 3.3Å; Q44-T47 PolarHBondContact O-OG1 3.44Å; Q44-G48 WeakPolarHBondContact O-CA 3.47Å; Q44-G48 PolarHBondContact O-N 2.67Å; Q44-H83 PolarHBondContact NE2-O 3.33Å; Q44-H83 PolarHBondContact O-CE1 3.15Å; Q44-H83 VanDerWaalsContact O-CE1 3.27Å; Q44-H83 PolarHBondContact O-ND1 3.02Å; Q44-H83 PolarHBondContact OE1-O 3.45Å; Q44-G86 VanDerWaalsContact OE1-CA 3.31Å; Q44-F90 HydrophobicContact CG-CD2 4Å
45I98.9Very high98.8Very high39 Ų3944 Ų4420%0.225%0.245CC..Hα-helixtrans-63.3-46.3177.5-69.6169.6000110.5L41 I42 L49 P186 F187L41-I45 HydrophobicContact CD1-CD1 3.94Å; L41-I45 HydrophobicContact CD1-CG1 4.27Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.32Å; L41-I45 WeakPolarHBondContact O-CG1 3.35Å; L41-I45 PolarHBondContact O-N 3.41Å; I42-I45 PolarHBondContact O-N 2.9Å; I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.49Å; I45-L49 PolarHBondContact O-N 3.48Å; I45-P186 HydrophobicContact CD1-CB 4.21Å; I45-P186 HydrophobicContact CG1-CB 3.69Å; I45-F187 HydrophobicContact CG2-CE1 4.03Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å
46T98.9Very high98.8Very high66 Ų6644 Ų4441%0.40525%0.245SC..Hα-helixtrans-66.3-54.8-177.851.20000111.3I42 L43 G48 L49 F50I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.39Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.42Å; I42-T46 PolarHBondContact O-N 2.88Å; I42-T46 PolarHBondContact O-OG1 3.38Å; L43-T46 PolarHBondContact O-N 2.85Å; L43-T46 PolarHBondContact O-OG1 2.89Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.83Å; T46-L49 PolarHBondContact O-N 3.4Å; T46-F50 VanDerWaalsContact O-CD2 3.28Å; T46-F50 WeakPolarHBondContact O-CD2 3.36Å; T46-F50 PolarHBondContact O-N 3.22Å
47T98.9Very high98.7Very high11 Ų1144.9 Ų44.97%0.06725%0.252CS..Hα-helixtrans-61.3-41.5178.154.60000111.9L43 Q44 L49 F50 L51 I79 L82 H83L43-T47 HydrophobicContact CD1-CG2 4.07Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.47Å; L43-T47 WeakPolarHBondContact O-CG2 3.5Å; L43-T47 PolarHBondContact O-N 3.3Å; L43-T47 PolarHBondContact O-OG1 3.45Å; Q44-T47 PolarHBondContact O-OG1 3.44Å; T47-L49 PolarHBondContact O-N 3.29Å; T47-F50 PolarHBondContact O-N 3.5Å; T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.4Å; T47-L51 PolarHBondContact O-N 3.13Å; T47-I79 HydrophobicContact CG2-CG2 4.31Å; T47-L82 HydrophobicContact CG2-CB 4.08Å; T47-H83 PolarHBondContact OG1-ND1 3.29Å
48G98.8Very high98.6Very high16 Ų1646.3 Ų46.317%0.16526%0.259CS..Hα-helixtrans-62.7-39.8178.200000113Q44 T46 L51 A52 H83Q44-G48 WeakPolarHBondContact O-CA 3.47Å; Q44-G48 PolarHBondContact O-N 2.67Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.83Å; G48-L51 PolarHBondContact O-N 3.47Å; G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.48Å; G48-A52 PolarHBondContact O-N 2.89Å; G48-H83 VanDerWaalsContact CA-CE1 3.46Å; G48-H83 WeakPolarHBondContact CA-CE1 3.48Å; G48-H83 PolarHBondContact N-ND1 3.43Å
49L98.8Very high98.5Very high77 Ų7745.6 Ų45.640%0.40325%0.25SC..Hα-helixtrans-62.1-44.8175.2-179.864.5000111.8I45 T46 T47 A52 M53 F183I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.49Å; I45-L49 PolarHBondContact O-N 3.48Å; T46-L49 PolarHBondContact O-N 3.4Å; T47-L49 PolarHBondContact O-N 3.29Å; L49-A52 PolarHBondContact O-N 3.15Å; L49-M53 HydrophobicContact CD1-CE 4.48Å; L49-M53 HydrophobicContact CG-CE 4.08Å; L49-M53 WeakPolarHBondContact O-CG 3.43Å; L49-M53 PolarHBondContact O-N 2.71Å; L49-F183 HydrophobicContact CD1-CE2 4.28Å; L49-F183 HydrophobicContact CD1-CZ 4.07Å
50F98.8Very high98.5Very high113 Ų11349 Ų4950%0.49627%0.272SS..Hα-helixtrans-65.6-38.1176.4-81.8-79.3000112.4T46 T47 M53 H54 I79T46-F50 VanDerWaalsContact O-CD2 3.28Å; T46-F50 WeakPolarHBondContact O-CD2 3.36Å; T46-F50 PolarHBondContact O-N 3.22Å; T47-F50 PolarHBondContact O-N 3.5Å; F50-M53 HydrophobicContact CD1-SD 4.27Å; F50-M53 PolarHBondContact O-N 3.12Å; F50-H54 PolarHBondContact O-CD2 2.9Å; F50-I79 HydrophobicContact CB-CD1 4.38Å; F50-I79 HydrophobicContact CB-CG2 4.21Å
51L98.9Very high98.4Very high23 Ų2351.2 Ų51.212%0.1229%0.286CS..Hα-helixtrans-64.8-42174.5-67.4170.5000111.7T47 G48 M53 H54 Y55 I69 I79 R80 H83T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.4Å; T47-L51 PolarHBondContact O-N 3.13Å; G48-L51 PolarHBondContact O-N 3.47Å; L51-M53 PolarHBondContact O-N 2.89Å; L51-H54 PolarHBondContact O-N 2.82Å; L51-Y55 PolarHBondContact O-N 3.04Å; L51-Y55 VanDerWaalsContact O-N 3.13Å; L51-I69 HydrophobicContact CD2-CD1 4.24Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; L51-I79 HydrophobicContact CD2-CG2 3.97Å; L51-I79 HydrophobicContact CG-CG2 3.89Å; L51-R80 HydrophobicContact CD2-CB 4.09Å; L51-H83 HydrophobicContact CD1-CB 3.51Å
52A98.7Very high98.4Very high23 Ų2350.4 Ų50.419%0.1928%0.282CS..Hα-helixtrans-61.6-27.9-179.600000113.2G48 L49 H54 F179 F183G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.48Å; G48-A52 PolarHBondContact O-N 2.89Å; L49-A52 PolarHBondContact O-N 3.15Å; A52-H54 PolarHBondContact O-N 2.92Å; A52-F179 HydrophobicContact CB-CE2 4.22Å; A52-F179 HydrophobicContact CB-CZ 4.11Å; A52-F183 HydrophobicContact CB-CD2 4.26Å; A52-F183 HydrophobicContact CB-CE2 3.95Å
53M98.7Very high98.4Very high120 Ų12047.6 Ų47.659%0.59127%0.266SS*.THydrogen-bonded Turntrans-64.2-17.7175-66.7173.2-176.100113.5L49 F50 L51L49-M53 HydrophobicContact CD1-CE 4.48Å; L49-M53 HydrophobicContact CG-CE 4.08Å; L49-M53 WeakPolarHBondContact O-CG 3.43Å; L49-M53 PolarHBondContact O-N 2.71Å; F50-M53 HydrophobicContact CD1-SD 4.27Å; F50-M53 PolarHBondContact O-N 3.12Å; L51-M53 PolarHBondContact O-N 2.89Å
54H98.6Very high98.4Very high82 Ų8249.3 Ų49.338%0.3828%0.28SS..THydrogen-bonded Turntrans-123.3-2.7-175.2-61.6-68.1000113.6F50 L51 A52 I69 V73F50-H54 PolarHBondContact O-CD2 2.9Å; L51-H54 PolarHBondContact O-N 2.82Å; A52-H54 PolarHBondContact O-N 2.92Å; H54-I69 HydrophobicContact CB-CD1 3.89Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; H54-V73 HydrophobicContact CB-CG2 4.35Å
55Y98.8Very high98.4Very high25 Ų2548.8 Ų48.810%0.09828%0.279CS..  trans-92.3144.8-177.2177-109.3000112L51 P57 A62 S65 I66 L133 F179L51-Y55 PolarHBondContact O-N 3.04Å; L51-Y55 VanDerWaalsContact O-N 3.13Å; Y55-P57 HydrophobicContact CD1-CB 4.39Å; Y55-P57 HydrophobicContact CE1-CB 3.71Å; Y55-A62 HydrophobicContact CE2-CB 4.03Å; Y55-S65 VanDerWaalsContact CD2-OG 3.23Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.29Å; Y55-I66 HydrophobicContact CD2-CD1 3.65Å; Y55-I66 HydrophobicContact CD2-CG1 4.19Å; Y55-I66 HydrophobicContact CE2-CD1 4.03Å; Y55-I66 HydrophobicContact CE2-CG1 4.19Å; Y55-L133 HydrophobicContact CE1-CB 4.42Å; Y55-L133 HydrophobicContact CE2-CB 4.44Å; Y55-L133 WeakPolarHBondContact CE2-O 3.41Å; Y55-L133 WeakPolarHBondContact OH-CA 3.48Å; Y55-L133 PolarHBondContact OH-O 3.34Å; Y55-F179 AromaticContact CD1-CD2 3.65Å; Y55-F179 HydrophobicContact CD1-CD2 3.65Å; Y55-F179 AromaticContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.37Å; Y55-F179 HydrophobicContact CE1-CB 4.35Å; Y55-F179 AromaticContact CE1-CD2 3.63Å; Y55-F179 HydrophobicContact CE1-CD2 3.63Å; Y55-F179 HydrophobicContact CE1-CE2 4.16Å; Y55-F179 HydrophobicContact CE1-CG 4.06Å
56S98.3Very high98.4Very high47 Ų4748.1 Ų48.133%0.32928%0.275SS..  trans-120.9113.7176.4-172.40000110.5D58 T61 A62 S65S56-D58 PolarHBondContact O-N 3.08Å; S56-T61 WeakPolarHBondContact CB-OG1 3.44Å; S56-T61 PolarHBondContact OG-OG1 3.36Å; S56-A62 VanDerWaalsContact O-CA 3.25Å; S56-A62 WeakPolarHBondContact O-CA 3.38Å; S56-S65 PolarHBondContact N-OG 2.87Å
57P97.1Very high98.3Very high32 Ų3246.6 Ų46.621%0.20827%0.27CS..  trans-85.653.7-173.736.5-38.5000113Y55 T176 F179Y55-P57 HydrophobicContact CD1-CB 4.39Å; Y55-P57 HydrophobicContact CE1-CB 3.71Å; P57-T176 PolarHBondContact O-OG1 2.97Å; P57-F179 HydrophobicContact CB-CB 3.79Å; P57-F179 HydrophobicContact CB-CD1 3.99Å; P57-F179 HydrophobicContact CB-CG 3.92Å; P57-F179 HydrophobicContact CG-CD1 3.94Å; P57-F179 HydrophobicContact CG-CE1 4.45Å; P57-F179 HydrophobicContact CG-CG 4.37Å
58D97.4Very high98.3Very high56 Ų5649.9 Ų49.930%0.29928%0.284SS..SBendtrans-125.8140.1173.4178.8-95.6000110.6S56 S60 T61 A62 S172S56-D58 PolarHBondContact O-N 3.08Å; D58-S60 PolarHBondContact O-N 2.84Å; D58-S60 VanDerWaalsContact O-N 3.1Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.3Å; D58-S60 PolarHBondContact OD1-N 2.83Å; D58-S60 PolarHBondContact OD1-OG 3.47Å; D58-T61 PolarHBondContact O-N 3.46Å; D58-A62 WeakPolarHBondContact O-CB 3.26Å; D58-A62 PolarHBondContact O-N 2.86Å; D58-S172 PolarHBondContact OD2-OG 3.5Å
59A96.3Very high98.3Very high19 Ų1949.2 Ų49.216%0.15728%0.277CS..THydrogen-bonded Turntrans-59-26.6-174.500000113.5W135 S172A59-W135 HydrophobicContact CB-CZ2 3.76Å; A59-S172 VanDerWaalsContact CB-OG 3.24Å; A59-S172 WeakPolarHBondContact CB-OG 3.34Å; A59-S172 PolarHBondContact N-OG 2.85Å
60S97.6Very high98.3Very high96 Ų9647.2 Ų47.267%0.67127%0.268SS*.THydrogen-bonded Turntrans-79.7-24.2178.372.80000113.7D58D58-S60 PolarHBondContact O-N 2.84Å; D58-S60 VanDerWaalsContact O-N 3.1Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.3Å; D58-S60 PolarHBondContact OD1-N 2.83Å; D58-S60 PolarHBondContact OD1-OG 3.47Å
61T98.3Very high98.3Very high48 Ų4851.7 Ų51.729%0.29428%0.281SS..THydrogen-bonded Turntrans-121.3-12.8-17356.80000114.5S56 D58 F63 S64 S65S56-T61 WeakPolarHBondContact CB-OG1 3.44Å; S56-T61 PolarHBondContact OG-OG1 3.36Å; D58-T61 PolarHBondContact O-N 3.46Å; T61-F63 PolarHBondContact O-N 3.07Å; T61-S64 WeakPolarHBondContact CA-OG 3.36Å; T61-S64 PolarHBondContact O-N 3.41Å; T61-S64 PolarHBondContact O-OG 2.86Å; T61-S65 VanDerWaalsContact O-CB 3.28Å; T61-S65 WeakPolarHBondContact O-CB 3.23Å; T61-S65 PolarHBondContact O-N 3.42Å; T61-S65 PolarHBondContact O-OG 2.88Å
62A98.6Very high98.3Very high0 Ų055.8 Ų55.80%030%0.303CS..Hα-helixtrans-60.1-52.9-17400000112.4Y55 S56 D58 S64 S65 I66 W135 L175Y55-A62 HydrophobicContact CE2-CB 4.03Å; S56-A62 VanDerWaalsContact O-CA 3.25Å; S56-A62 WeakPolarHBondContact O-CA 3.38Å; D58-A62 WeakPolarHBondContact O-CB 3.26Å; D58-A62 PolarHBondContact O-N 2.86Å; A62-S64 PolarHBondContact O-N 3.41Å; A62-S65 PolarHBondContact O-N 3.26Å; A62-S65 PolarHBondContact O-OG 2.92Å; A62-I66 PolarHBondContact O-N 3.41Å; A62-I66 VanDerWaalsContact O-N 3.13Å; A62-W135 HydrophobicContact CB-CB 3.86Å; A62-W135 HydrophobicContact CB-CG 4.38Å; A62-L175 HydrophobicContact CB-CD2 3.54Å
63F98.6Very high98.3Very high54 Ų5456 Ų5624%0.23730%0.302CS..Hα-helixtrans-60.5-44.5178.9-173.6-91.5000112.2T61 I66 A67 P134 W135 Y256 L258T61-F63 PolarHBondContact O-N 3.07Å; F63-I66 PolarHBondContact O-N 2.91Å; F63-A67 PolarHBondContact O-N 2.99Å; F63-A67 VanDerWaalsContact O-N 3.1Å; F63-P134 WeakPolarHBondContact CA-O 3.43Å; F63-P134 WeakPolarHBondContact CD2-O 3.45Å; F63-W135 HydrophobicContact CB-CB 4.48Å; F63-Y256 WeakPolarHBondContact CZ-O 3.39Å; F63-L258 HydrophobicContact CB-CD1 3.44Å; F63-L258 VanDerWaalsContact CB-CD1 3.44Å; F63-L258 HydrophobicContact CD1-CB 4.2Å; F63-L258 HydrophobicContact CD1-CD1 4.13Å; F63-L258 HydrophobicContact CD2-CB 4.48Å; F63-L258 HydrophobicContact CD2-CD1 4.24Å; F63-L258 HydrophobicContact CE1-CB 4.35Å; F63-L258 HydrophobicContact CG-CB 4.28Å; F63-L258 HydrophobicContact CG-CD1 3.68Å
64S98.6Very high98.3Very high65 Ų6557.1 Ų57.146%0.45531%0.311SS..Hα-helixtrans-69.8-31.7178.9580000112.5T61 A62 A67 H68T61-S64 WeakPolarHBondContact CA-OG 3.36Å; T61-S64 PolarHBondContact O-N 3.41Å; T61-S64 PolarHBondContact O-OG 2.86Å; A62-S64 PolarHBondContact O-N 3.41Å; S64-A67 WeakPolarHBondContact O-CB 3.29Å; S64-A67 PolarHBondContact O-N 3.19Å; S64-H68 WeakPolarHBondContact O-CB 3.34Å; S64-H68 PolarHBondContact O-N 3.31Å
65S98.7Very high98.3Very high12 Ų1261.7 Ų61.78%0.08433%0.326CS..Hα-helixtrans-66.5-36.7174.175.70000112.3Y55 S56 T61 A62 H68 I69Y55-S65 VanDerWaalsContact CD2-OG 3.23Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.29Å; S56-S65 PolarHBondContact N-OG 2.87Å; T61-S65 VanDerWaalsContact O-CB 3.28Å; T61-S65 WeakPolarHBondContact O-CB 3.23Å; T61-S65 PolarHBondContact O-N 3.42Å; T61-S65 PolarHBondContact O-OG 2.88Å; A62-S65 PolarHBondContact O-N 3.26Å; A62-S65 PolarHBondContact O-OG 2.92Å; S65-H68 PolarHBondContact O-N 3.44Å; S65-I69 WeakPolarHBondContact O-CG1 3.32Å; S65-I69 PolarHBondContact O-N 3.15Å
66I98.6Very high98.3Very high25 Ų2560.6 Ų60.613%0.12832%0.322CS..Hα-helixtrans-66.1-40171-64.9-54.7000111.4Y55 A62 F63 I69 T70 R80 P134Y55-I66 HydrophobicContact CD2-CD1 3.65Å; Y55-I66 HydrophobicContact CD2-CG1 4.19Å; Y55-I66 HydrophobicContact CE2-CD1 4.03Å; Y55-I66 HydrophobicContact CE2-CG1 4.19Å; A62-I66 PolarHBondContact O-N 3.41Å; A62-I66 VanDerWaalsContact O-N 3.13Å; F63-I66 PolarHBondContact O-N 2.91Å; I66-I69 HydrophobicContact CD1-CD1 4.17Å; I66-I69 PolarHBondContact O-N 3.21Å; I66-T70 PolarHBondContact O-N 3.13Å; I66-T70 PolarHBondContact O-OG1 2.96Å; I66-R80 VanDerWaalsContact CG2-NE 3.26Å; I66-P134 HydrophobicContact CG1-CB 4.4Å
67A98.4Very high98.3Very high35 Ų3563.5 Ų63.529%0.28933%0.326SS..Hα-helixtrans-62.6-43.5174.400000111.5F63 S64 T70 R71F63-A67 PolarHBondContact O-N 2.99Å; F63-A67 VanDerWaalsContact O-N 3.1Å; S64-A67 WeakPolarHBondContact O-CB 3.29Å; S64-A67 PolarHBondContact O-N 3.19Å; A67-T70 PolarHBondContact O-N 3.21Å; A67-T70 VanDerWaalsContact O-N 3.15Å; A67-R71 WeakPolarHBondContact O-CB 3.21Å; A67-R71 WeakPolarHBondContact O-CG 3.3Å; A67-R71 PolarHBondContact O-N 3.38Å
68H98.8Very high98.4Very high80 Ų8063.4 Ų63.437%0.3732%0.323SS..Hα-helixtrans-60-46.4174.4165.7-92.2000112.1S64 S65 T70 R71 D72 V73S64-H68 WeakPolarHBondContact O-CB 3.34Å; S64-H68 PolarHBondContact O-N 3.31Å; S65-H68 PolarHBondContact O-N 3.44Å; H68-T70 PolarHBondContact O-N 3.37Å; H68-R71 PolarHBondContact O-N 3.41Å; H68-D72 IonicContact CD2-OD2 2.86Å; H68-D72 PolarHBondContact CD2-OD2 3.46Å; H68-D72 IonicContact CG-OD2 3.37Å; H68-D72 WeakPolarHBondContact O-CB 3.4Å; H68-D72 PolarHBondContact O-N 3.37Å; H68-V73 PolarHBondContact O-N 3.06Å
69I98.8Very high98.5Very high2 Ų262.6 Ų62.61%0.0132%0.318CS..Hα-helixtrans-54.2-44.3173.1-73.8168.1000110.7L51 H54 S65 I66 G76 R80L51-I69 HydrophobicContact CD2-CD1 4.24Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; H54-I69 HydrophobicContact CB-CD1 3.89Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; S65-I69 WeakPolarHBondContact O-CG1 3.32Å; S65-I69 PolarHBondContact O-N 3.15Å; I66-I69 HydrophobicContact CD1-CD1 4.17Å; I66-I69 PolarHBondContact O-N 3.21Å; I69-G76 CarbonylContact O-C 3.54Å; I69-G76 WeakPolarHBondContact O-CA 3.41Å; I69-R80 HydrophobicContact CG2-CB 4.42Å
70T98.5Very high98.6Very high35 Ų3563.7 Ų63.722%0.21532%0.319CS..Hα-helixtrans-72.9-34-175-510000112.1I66 A67 H68 W77 R80I66-T70 PolarHBondContact O-N 3.13Å; I66-T70 PolarHBondContact O-OG1 2.96Å; A67-T70 PolarHBondContact O-N 3.21Å; A67-T70 VanDerWaalsContact O-N 3.15Å; H68-T70 PolarHBondContact O-N 3.37Å; T70-W77 HydrophobicContact CG2-CB 3.94Å; T70-W77 WeakPolarHBondContact O-CB 3.36Å; T70-R80 WeakPolarHBondContact OG1-CD 3.49Å
71R98.6Very high98.6Very high206 Ų20660.6 Ų60.678%0.77729%0.292SS*.Hα-helixtrans-103.2-35.8-168.6-66.4179.1176.7-162.8-0.9114.2A67 H68A67-R71 WeakPolarHBondContact O-CB 3.21Å; A67-R71 WeakPolarHBondContact O-CG 3.3Å; A67-R71 PolarHBondContact O-N 3.38Å; H68-R71 PolarHBondContact O-N 3.41Å
72D98.6Very high98.7Very high110 Ų11059.6 Ų59.659%0.58829%0.285SS*.THydrogen-bonded Turntrans-114.8-27-165.4-52.4-42.9000112.6H68H68-D72 IonicContact CD2-OD2 2.86Å; H68-D72 PolarHBondContact CD2-OD2 3.46Å; H68-D72 IonicContact CG-OD2 3.37Å; H68-D72 WeakPolarHBondContact O-CB 3.4Å; H68-D72 PolarHBondContact O-N 3.37Å
73V98.8Very high98.7Very high27 Ų2761.1 Ų61.116%0.16429%0.292CS..SBendtrans-79129.2176.6179.60000110.2H54 H68 Y75 G76H54-V73 HydrophobicContact CB-CG2 4.35Å; H68-V73 PolarHBondContact O-N 3.06Å; V73-Y75 PolarHBondContact O-N 3.04Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; V73-G76 PolarHBondContact O-N 3.39Å
74N98.6Very high98.7Very high144 Ų14461 Ų6177%0.7730%0.301SS*.THydrogen-bonded Turntrans-54.3120.5175.9-70-40.7000111.1G76N74-G76 PolarHBondContact O-N 2.96Å; N74-G76 VanDerWaalsContact O-N 3.09Å
75Y98.6Very high98.7Very high177 Ų17758.1 Ų58.169%0.69428%0.281SS*.THydrogen-bonded Turntrans57.514.5-174.5-55.7-78.7000114.8V73 W77 I78 I79V73-Y75 PolarHBondContact O-N 3.04Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 3.32Å; Y75-I78 HydrophobicContact CD1-CG2 4.3Å; Y75-I78 WeakPolarHBondContact O-CG2 3.41Å; Y75-I78 PolarHBondContact O-N 3.16Å; Y75-I79 WeakPolarHBondContact O-CG1 3.19Å; Y75-I79 PolarHBondContact O-N 2.86Å; Y75-I79 VanDerWaalsContact O-N 3.15Å
76G98.8Very high98.7Very high2 Ų257.6 Ų57.62%0.02128%0.277CS..Hα-helixtrans-65.5-33-178.900000112.8I69 V73 N74 I78 I79 R80I69-G76 CarbonylContact O-C 3.54Å; I69-G76 WeakPolarHBondContact O-CA 3.41Å; V73-G76 PolarHBondContact O-N 3.39Å; N74-G76 PolarHBondContact O-N 2.96Å; N74-G76 VanDerWaalsContact O-N 3.09Å; G76-I78 PolarHBondContact O-N 3.42Å; G76-I79 PolarHBondContact O-N 2.83Å; G76-R80 WeakPolarHBondContact O-CB 3.49Å; G76-R80 PolarHBondContact O-N 3.09Å
77W98.7Very high98.7Very high108 Ų10857.4 Ų57.441%0.40928%0.279SS..Hα-helixtrans-57.8-47.617369.5-90.5000112.5T70 Y75 R80 Y81 L244T70-W77 HydrophobicContact CG2-CB 3.94Å; T70-W77 WeakPolarHBondContact O-CB 3.36Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 3.32Å; W77-R80 PolarHBondContact O-N 3.13Å; W77-Y81 HydrophobicContact CE3-CD2 4.04Å; W77-Y81 HydrophobicContact CE3-CE2 4.47Å; W77-Y81 WeakPolarHBondContact O-CD2 3.33Å; W77-Y81 PolarHBondContact O-N 3.43Å; W77-L244 HydrophobicContact CH2-CD2 3.92Å; W77-L244 HydrophobicContact CZ3-CD2 4.27Å
78I98.7Very high98.7Very high30 Ų3055.9 Ų55.915%0.15427%0.267CS..Hα-helixtrans-72.1-37-177.2-172.8168.3000110.7Y75 G76 R80 Y81 L82 M240 T243 L244Y75-I78 HydrophobicContact CD1-CG2 4.3Å; Y75-I78 WeakPolarHBondContact O-CG2 3.41Å; Y75-I78 PolarHBondContact O-N 3.16Å; G76-I78 PolarHBondContact O-N 3.42Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 2.77Å; I78-Y81 PolarHBondContact O-N 3.25Å; I78-L82 HydrophobicContact CG1-CD1 4.11Å; I78-L82 HydrophobicContact CG1-CG 4.23Å; I78-L82 VanDerWaalsContact O-CB 3.28Å; I78-L82 WeakPolarHBondContact O-CB 3.32Å; I78-L82 VanDerWaalsContact O-CG 3.23Å; I78-L82 WeakPolarHBondContact O-CG 3.41Å; I78-L82 PolarHBondContact O-N 3.08Å; I78-M240 HydrophobicContact CD1-CE 4.23Å; I78-T243 HydrophobicContact CG1-CG2 4.26Å; I78-L244 HydrophobicContact CD1-CD2 3.93Å
79I98.8Very high98.7Very high39 Ų3953 Ų5320%0.225%0.254CS..Hα-helixtrans-62.2-44.1174-62.2169.9000110.2T47 F50 L51 Y75 G76 L82 H83T47-I79 HydrophobicContact CG2-CG2 4.31Å; F50-I79 HydrophobicContact CB-CD1 4.38Å; F50-I79 HydrophobicContact CB-CG2 4.21Å; L51-I79 HydrophobicContact CD2-CG2 3.97Å; L51-I79 HydrophobicContact CG-CG2 3.89Å; Y75-I79 WeakPolarHBondContact O-CG1 3.19Å; Y75-I79 PolarHBondContact O-N 2.86Å; Y75-I79 VanDerWaalsContact O-N 3.15Å; G76-I79 PolarHBondContact O-N 2.83Å; I79-L82 PolarHBondContact O-N 2.94Å; I79-H83 WeakPolarHBondContact O-CB 3.34Å; I79-H83 PolarHBondContact O-N 3.46Å
80R98.8Very high98.7Very high43 Ų4353.8 Ų53.816%0.16226%0.257CS..Hα-helixtrans-59.5-49.7176.2179.1-175.9175-101.41.9111.4L51 I66 I69 T70 G76 W77 I78 H83 A84 Y256L51-R80 HydrophobicContact CD2-CB 4.09Å; I66-R80 VanDerWaalsContact CG2-NE 3.26Å; I69-R80 HydrophobicContact CG2-CB 4.42Å; T70-R80 WeakPolarHBondContact OG1-CD 3.49Å; G76-R80 WeakPolarHBondContact O-CB 3.49Å; G76-R80 PolarHBondContact O-N 3.09Å; W77-R80 PolarHBondContact O-N 3.13Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 2.77Å; R80-H83 WeakPolarHBondContact O-CB 3.42Å; R80-H83 PolarHBondContact O-N 2.85Å; R80-A84 PolarHBondContact O-N 3.49Å; R80-Y256 PolarHBondContact NH1-OH 3.42Å
81Y98.8Very high98.8Very high30 Ų3052.2 Ų52.212%0.11825%0.247CC..Hα-helixtrans-72.4-31.8-178.2-70.2-59.6000113.1W77 I78 H83 A84 N85 P247 Y256W77-Y81 HydrophobicContact CE3-CD2 4.04Å; W77-Y81 HydrophobicContact CE3-CE2 4.47Å; W77-Y81 WeakPolarHBondContact O-CD2 3.33Å; W77-Y81 PolarHBondContact O-N 3.43Å; I78-Y81 PolarHBondContact O-N 3.25Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-A84 PolarHBondContact O-N 3.27Å; Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.27Å; Y81-N85 PolarHBondContact O-N 3.42Å; Y81-N85 PolarHBondContact O-ND2 3.42Å; Y81-P247 HydrophobicContact CD1-CB 3.55Å; Y81-P247 HydrophobicContact CD2-CB 4.03Å; Y81-P247 HydrophobicContact CE1-CB 3.76Å; Y81-P247 HydrophobicContact CE1-CG 4.49Å; Y81-P247 HydrophobicContact CE2-CB 4.22Å; Y81-P247 HydrophobicContact CG-CB 3.7Å; Y81-Y256 PolarHBondContact OH-OH 3.47Å
82L98.9Very high98.8Very high28 Ų2845.2 Ų45.215%0.14723%0.225CC..Hα-helixtrans-61.1-41.3168.8-78.1172.4000111.1T47 I78 I79 G86 L239 M240 T243T47-L82 HydrophobicContact CG2-CB 4.08Å; I78-L82 HydrophobicContact CG1-CD1 4.11Å; I78-L82 HydrophobicContact CG1-CG 4.23Å; I78-L82 VanDerWaalsContact O-CB 3.28Å; I78-L82 WeakPolarHBondContact O-CB 3.32Å; I78-L82 VanDerWaalsContact O-CG 3.23Å; I78-L82 WeakPolarHBondContact O-CG 3.41Å; I78-L82 PolarHBondContact O-N 3.08Å; I79-L82 PolarHBondContact O-N 2.94Å; L82-G86 WeakPolarHBondContact O-CA 3.35Å; L82-G86 PolarHBondContact O-N 2.67Å; L82-L239 HydrophobicContact CD2-CD2 3.93Å; L82-L239 HydrophobicContact CD2-CG 4.06Å; L82-M240 HydrophobicContact CD2-SD 3.81Å; L82-T243 HydrophobicContact CD2-CG2 4.21Å; L82-T243 HydrophobicContact CG-CG2 4.19Å
83H98.9Very high98.8Very high31 Ų3140.1 Ų40.114%0.14420%0.198CC..Hα-helixtrans-68.2-44.1177.8-165.182.1000112.2Q44 T47 G48 L51 I79 R80 Y81 A87 H182Q44-H83 PolarHBondContact NE2-O 3.33Å; Q44-H83 PolarHBondContact O-CE1 3.15Å; Q44-H83 VanDerWaalsContact O-CE1 3.27Å; Q44-H83 PolarHBondContact O-ND1 3.02Å; Q44-H83 PolarHBondContact OE1-O 3.45Å; T47-H83 PolarHBondContact OG1-ND1 3.29Å; G48-H83 VanDerWaalsContact CA-CE1 3.46Å; G48-H83 WeakPolarHBondContact CA-CE1 3.48Å; G48-H83 PolarHBondContact N-ND1 3.43Å; L51-H83 HydrophobicContact CD1-CB 3.51Å; I79-H83 WeakPolarHBondContact O-CB 3.34Å; I79-H83 PolarHBondContact O-N 3.46Å; R80-H83 WeakPolarHBondContact O-CB 3.42Å; R80-H83 PolarHBondContact O-N 2.85Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; H83-A87 PolarHBondContact O-N 3.05Å; H83-A87 VanDerWaalsContact O-N 3.13Å; H83-H182 AromaticContact NE2-NE2 3.96Å
84A98.8Very high98.8Very high51 Ų5139.4 Ų39.442%0.42119%0.193SC..Hα-helixtrans-68.9-51.5-179.700000112.3R80 Y81 G86 A87 S88R80-A84 PolarHBondContact O-N 3.49Å; Y81-A84 PolarHBondContact O-N 3.27Å; A84-G86 VanDerWaalsContact C-N 3.35Å; A84-A87 WeakPolarHBondContact O-CB 3.13Å; A84-A87 PolarHBondContact O-N 2.89Å; A84-S88 PolarHBondContact O-N 3.09Å
85N98.9Very high98.8Very high5 Ų535.6 Ų35.63%0.02717%0.169CC..Hα-helixtrans-71.9-31.5178-70.8-51.9000111.9Y81 A87 S88 M89 L239 L242 P247Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.27Å; Y81-N85 PolarHBondContact O-N 3.42Å; Y81-N85 PolarHBondContact O-ND2 3.42Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.44Å; N85-S88 WeakPolarHBondContact O-CB 3.32Å; N85-S88 PolarHBondContact O-N 3.39Å; N85-S88 VanDerWaalsContact O-N 3.15Å; N85-M89 WeakPolarHBondContact O-CG 3.32Å; N85-M89 PolarHBondContact O-N 3.3Å; N85-L239 HydrophobicContact CB-CD1 3.89Å; N85-L242 HydrophobicContact CB-CD2 3.77Å; N85-L242 HydrophobicContact CB-CG 4.18Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.14Å; N85-P247 PolarHBondContact ND2-O 2.79Å; N85-P247 PolarHBondContact OD1-O 2.94Å
86G98.9Very high98.8Very high1 Ų130.2 Ų30.21%0.0115%0.152CC..Hα-helixtrans-60.5-36172.200000112.7Q44 L82 A84 M89 F90Q44-G86 VanDerWaalsContact OE1-CA 3.31Å; L82-G86 WeakPolarHBondContact O-CA 3.35Å; L82-G86 PolarHBondContact O-N 2.67Å; A84-G86 VanDerWaalsContact C-N 3.35Å; G86-M89 PolarHBondContact O-N 3.48Å; G86-F90 WeakPolarHBondContact O-CB 3.47Å; G86-F90 PolarHBondContact O-N 2.9Å
87A98.8Very high98.8Very high21 Ų2131.9 Ų31.917%0.17416%0.16CC..Hα-helixtrans-62.8-43.717200000111.9H83 A84 N85 F90 F91H83-A87 PolarHBondContact O-N 3.05Å; H83-A87 VanDerWaalsContact O-N 3.13Å; A84-A87 WeakPolarHBondContact O-CB 3.13Å; A84-A87 PolarHBondContact O-N 2.89Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.44Å; A87-F90 VanDerWaalsContact O-CB 3.25Å; A87-F90 WeakPolarHBondContact O-CB 3.37Å; A87-F90 PolarHBondContact O-N 3.14Å; A87-F91 WeakPolarHBondContact O-CD2 3.33Å; A87-F91 PolarHBondContact O-N 3.39Å
88S98.8Very high98.8Very high4 Ų428.1 Ų28.13%0.02815%0.147CC..Hα-helixtrans-61.8-45.5173.8-73.60000111.9A84 N85 F90 F91 I92 W272A84-S88 PolarHBondContact O-N 3.09Å; N85-S88 WeakPolarHBondContact O-CB 3.32Å; N85-S88 PolarHBondContact O-N 3.39Å; N85-S88 VanDerWaalsContact O-N 3.15Å; S88-F90 PolarHBondContact O-N 2.8Å; S88-F91 PolarHBondContact O-N 3.37Å; S88-F91 VanDerWaalsContact O-N 3.14Å; S88-I92 WeakPolarHBondContact O-CG1 3.28Å; S88-I92 PolarHBondContact O-N 2.85Å; S88-W272 WeakPolarHBondContact O-CZ2 3.34Å; S88-W272 PolarHBondContact OG-NE1 3.25Å
89M98.8Very high98.9Very high20 Ų2027.1 Ų27.110%0.09914%0.144CC..Hα-helixtrans-61.9-34.4176.6-67.5-57.9-64.300112.2N85 G86 I92 C93 F235 S238 L239N85-M89 WeakPolarHBondContact O-CG 3.32Å; N85-M89 PolarHBondContact O-N 3.3Å; G86-M89 PolarHBondContact O-N 3.48Å; M89-I92 PolarHBondContact O-N 3.04Å; M89-I92 HydrophobicContact SD-CD1 3.94Å; M89-C93 PolarHBondContact O-N 3.03Å; M89-C93 PolarHBondContact O-SG 3.4Å; M89-C93 VanDerWaalsContact O-SG 3.38Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.04Å; M89-F235 HydrophobicContact CE-CD2 3.9Å; M89-F235 HydrophobicContact CE-CE2 3.98Å; M89-F235 HydrophobicContact CG-CE2 4.42Å; M89-S238 WeakPolarHBondContact CE-OG 3.3Å; M89-L239 HydrophobicContact CG-CB 4.36Å; M89-L239 HydrophobicContact CG-CD1 3.9Å
90F98.9Very high98.9Very high17 Ų1726.3 Ų26.38%0.07514%0.139CC..Hα-helixtrans-57.2-52.5172-154.8-46.4000110.2L37 C40 L41 Q44 G86 A87 S88 I92 C93 L94 T123L37-F90 HydrophobicContact CD2-CD1 3.51Å; L37-F90 HydrophobicContact CD2-CE1 3.48Å; L37-F90 VanDerWaalsContact CD2-CE1 3.48Å; C40-F90 HydrophobicContact CB-CB 4.07Å; C40-F90 HydrophobicContact CB-CD1 4.4Å; C40-F90 HydrophobicContact CB-CD2 3.52Å; C40-F90 HydrophobicContact CB-CE2 4.02Å; C40-F90 HydrophobicContact CB-CG 3.73Å; L41-F90 HydrophobicContact CB-CE2 4.09Å; L41-F90 HydrophobicContact CB-CZ 4.34Å; L41-F90 HydrophobicContact CD1-CE2 4.28Å; Q44-F90 HydrophobicContact CG-CD2 4Å; G86-F90 WeakPolarHBondContact O-CB 3.47Å; G86-F90 PolarHBondContact O-N 2.9Å; A87-F90 VanDerWaalsContact O-CB 3.25Å; A87-F90 WeakPolarHBondContact O-CB 3.37Å; A87-F90 PolarHBondContact O-N 3.14Å; S88-F90 PolarHBondContact O-N 2.8Å; F90-I92 PolarHBondContact O-N 3.26Å; F90-C93 PolarHBondContact O-N 3.22Å; F90-L94 HydrophobicContact CD1-CD1 4.3Å; F90-L94 HydrophobicContact CE1-CD1 4.24Å; F90-L94 VanDerWaalsContact O-CB 3.28Å; F90-L94 WeakPolarHBondContact O-CB 3.4Å; F90-L94 PolarHBondContact O-N 3.31Å; F90-T123 HydrophobicContact CD1-CG2 3.99Å; F90-T123 HydrophobicContact CE1-CG2 3.87Å; F90-T123 HydrophobicContact CG-CG2 4.47Å; F90-T123 HydrophobicContact CZ-CG2 4.23Å
91F98.9Very high98.9Very high3 Ų324.5 Ų24.51%0.01313%0.133CC..Hα-helixtrans-65.8-36.4179.8-81.9-81.6000113.4A87 S88 L94 F95 T123 M124 A127 W272 Y273A87-F91 WeakPolarHBondContact O-CD2 3.33Å; A87-F91 PolarHBondContact O-N 3.39Å; S88-F91 PolarHBondContact O-N 3.37Å; S88-F91 VanDerWaalsContact O-N 3.14Å; F91-L94 PolarHBondContact O-N 2.85Å; F91-F95 HydrophobicContact CB-CD2 4.46Å; F91-F95 HydrophobicContact CB-CE2 4.02Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.28Å; F91-F95 HydrophobicContact CD1-CE2 4.25Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.5Å; F91-F95 PolarHBondContact O-N 3.14Å; F91-T123 HydrophobicContact CE2-CG2 4.27Å; F91-T123 HydrophobicContact CZ-CG2 4Å; F91-M124 HydrophobicContact CE1-CG 3.83Å; F91-M124 HydrophobicContact CZ-CG 4.18Å; F91-A127 HydrophobicContact CE2-CB 3.49Å; F91-A127 VanDerWaalsContact CE2-CB 3.49Å; F91-A127 HydrophobicContact CZ-CB 3.85Å; F91-W272 HydrophobicContact CB-CH2 4.08Å; F91-W272 HydrophobicContact CB-CZ2 4.15Å; F91-Y273 HydrophobicContact CB-CD1 4.28Å; F91-Y273 HydrophobicContact CB-CG 3.99Å; F91-Y273 AromaticContact CD1-CD2 3.95Å; F91-Y273 HydrophobicContact CD1-CD2 3.95Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.78Å; F91-Y273 HydrophobicContact CD2-CD1 3.78Å; F91-Y273 AromaticContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CE1 4.09Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.87Å; F91-Y273 HydrophobicContact CE1-CD2 3.87Å; F91-Y273 HydrophobicContact CE1-CG 4.4Å; F91-Y273 HydrophobicContact CE2-CD1 4.4Å; F91-Y273 AromaticContact CE2-CD2 3.45Å; F91-Y273 HydrophobicContact CE2-CD2 3.45Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.45Å; F91-Y273 HydrophobicContact CE2-CE1 4.43Å; F91-Y273 AromaticContact CE2-CE2 3.41Å; F91-Y273 HydrophobicContact CE2-CE2 3.41Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.41Å; F91-Y273 AromaticContact CE2-CG 3.97Å; F91-Y273 HydrophobicContact CE2-CG 3.97Å; F91-Y273 AromaticContact CE2-CZ 3.97Å; F91-Y273 HydrophobicContact CG-CD1 4.1Å; F91-Y273 AromaticContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CE2 4.49Å; F91-Y273 AromaticContact CG-CG 3.55Å; F91-Y273 HydrophobicContact CG-CG 3.55Å; F91-Y273 AromaticContact CZ-CD2 3.63Å; F91-Y273 HydrophobicContact CZ-CD2 3.63Å; F91-Y273 AromaticContact CZ-CE2 3.82Å; F91-Y273 HydrophobicContact CZ-CE2 3.82Å; F91-Y273 HydrophobicContact CZ-CG 4.39Å
92I98.9Very high98.9Very high59 Ų5924.3 Ų24.330%0.30313%0.134SC..Hα-helixtrans-58-52.2171.9-66.9169.4000109.6S88 M89 F90 L94 F95 L96 W272S88-I92 WeakPolarHBondContact O-CG1 3.28Å; S88-I92 PolarHBondContact O-N 2.85Å; M89-I92 PolarHBondContact O-N 3.04Å; M89-I92 HydrophobicContact SD-CD1 3.94Å; F90-I92 PolarHBondContact O-N 3.26Å; I92-L94 VanDerWaalsContact C-N 3.25Å; I92-L94 PolarHBondContact O-N 3.5Å; I92-F95 PolarHBondContact O-N 3.39Å; I92-L96 HydrophobicContact CG2-CD1 3.97Å; I92-L96 VanDerWaalsContact O-CG 3.27Å; I92-L96 WeakPolarHBondContact O-CG 3.38Å; I92-L96 PolarHBondContact O-N 3.43Å; I92-L96 VanDerWaalsContact O-N 3.07Å; I92-W272 HydrophobicContact CD1-CH2 4.47Å; I92-W272 HydrophobicContact CD1-CZ2 4.28Å; I92-W272 HydrophobicContact CG1-CH2 3.53Å; I92-W272 HydrophobicContact CG1-CZ2 3.71Å
93C98.9Very high98.9Very high3 Ų324.5 Ų24.52%0.0213%0.133CC..Hα-helixtrans-60.3-37.2177.4-70.30000112.1F33 L37 M89 F90 H97F33-C93 HydrophobicContact CD1-CB 4Å; L37-C93 HydrophobicContact CD2-CB 3.78Å; L37-C93 HydrophobicContact CG-CB 4.03Å; M89-C93 PolarHBondContact O-N 3.03Å; M89-C93 PolarHBondContact O-SG 3.4Å; M89-C93 VanDerWaalsContact O-SG 3.38Å; F90-C93 PolarHBondContact O-N 3.22Å; C93-H97 WeakPolarHBondContact O-CB 3.41Å; C93-H97 PolarHBondContact O-N 3.47Å
94L98.8Very high98.9Very high12 Ų1224.2 Ų24.26%0.06313%0.131CC..Hα-helixtrans-68.1-48.9-177.7-157.4164.3000110.7L37 F90 F91 I92 L96 H97 I98 L120 T123L37-L94 HydrophobicContact CD2-CB 3.93Å; L37-L94 HydrophobicContact CD2-CG 4.37Å; F90-L94 HydrophobicContact CD1-CD1 4.3Å; F90-L94 HydrophobicContact CE1-CD1 4.24Å; F90-L94 VanDerWaalsContact O-CB 3.28Å; F90-L94 WeakPolarHBondContact O-CB 3.4Å; F90-L94 PolarHBondContact O-N 3.31Å; F91-L94 PolarHBondContact O-N 2.85Å; I92-L94 VanDerWaalsContact C-N 3.25Å; I92-L94 PolarHBondContact O-N 3.5Å; L94-L96 VanDerWaalsContact C-N 3.35Å; L94-L96 PolarHBondContact O-N 2.96Å; L94-H97 WeakPolarHBondContact O-CB 3.22Å; L94-H97 PolarHBondContact O-N 2.9Å; L94-I98 HydrophobicContact CD2-CD1 3.33Å; L94-I98 HydrophobicContact CD2-CG1 3.99Å; L94-I98 WeakPolarHBondContact O-CG1 3.5Å; L94-I98 PolarHBondContact O-N 3.32Å; L94-L120 HydrophobicContact CD1-CD1 4.13Å; L94-L120 HydrophobicContact CD2-CB 4.27Å; L94-L120 HydrophobicContact CD2-CD1 3.41Å; L94-L120 VanDerWaalsContact CD2-CD1 3.41Å; L94-L120 HydrophobicContact CD2-CG 4.34Å; L94-L120 HydrophobicContact CG-CD1 4.44Å; L94-T123 HydrophobicContact CD1-CG2 3.97Å
95F98.9Very high98.8Very high63 Ų6321.8 Ų21.828%0.27611%0.111SC..Hα-helixtrans-63.4-39.5177.3-62.6-37.4000112.3F91 I92 I98 G99 W272 Y273 F276F91-F95 HydrophobicContact CB-CD2 4.46Å; F91-F95 HydrophobicContact CB-CE2 4.02Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.28Å; F91-F95 HydrophobicContact CD1-CE2 4.25Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.5Å; F91-F95 PolarHBondContact O-N 3.14Å; I92-F95 PolarHBondContact O-N 3.39Å; F95-I98 PolarHBondContact O-N 3.25Å; F95-G99 PolarHBondContact O-N 3.42Å; F95-W272 HydrophobicContact CD2-CH2 4.22Å; F95-W272 HydrophobicContact CD2-CZ3 4.15Å; F95-W272 HydrophobicContact CE2-CH2 4.06Å; F95-W272 AromaticContact CE2-CZ3 3.84Å; F95-W272 HydrophobicContact CE2-CZ3 3.84Å; F95-Y273 WeakPolarHBondContact CZ-O 3.5Å; F95-F276 HydrophobicContact CE1-CE1 4.41Å; F95-F276 HydrophobicContact CZ-CE1 4.27Å
96L98.9Very high98.8Very high64 Ų6422.4 Ų22.434%0.33512%0.116SC..Hα-helixtrans-68.1-36.2174.9-63.9177.4000112W30 F33 I92 L94 G99 R100W30-L96 HydrophobicContact CZ3-CD2 4.13Å; F33-L96 HydrophobicContact CD1-CB 4.08Å; F33-L96 HydrophobicContact CD1-CD1 4.4Å; F33-L96 HydrophobicContact CD2-CB 3.91Å; F33-L96 HydrophobicContact CE1-CB 3.96Å; F33-L96 HydrophobicContact CE1-CD1 3.5Å; F33-L96 VanDerWaalsContact CE1-CD1 3.5Å; F33-L96 HydrophobicContact CE1-CG 4.36Å; F33-L96 HydrophobicContact CE2-CB 3.78Å; F33-L96 HydrophobicContact CE2-CD1 4.02Å; F33-L96 HydrophobicContact CG-CB 4.08Å; F33-L96 HydrophobicContact CZ-CB 3.82Å; F33-L96 HydrophobicContact CZ-CD1 3.28Å; F33-L96 HydrophobicContact CZ-CG 4.17Å; I92-L96 HydrophobicContact CG2-CD1 3.97Å; I92-L96 VanDerWaalsContact O-CG 3.27Å; I92-L96 WeakPolarHBondContact O-CG 3.38Å; I92-L96 PolarHBondContact O-N 3.43Å; I92-L96 VanDerWaalsContact O-N 3.07Å; L94-L96 VanDerWaalsContact C-N 3.35Å; L94-L96 PolarHBondContact O-N 2.96Å; L96-G99 PolarHBondContact O-N 3.2Å; L96-R100 WeakPolarHBondContact O-CB 3.41Å; L96-R100 PolarHBondContact O-N 2.92Å
97H98.9Very high98.8Very high38 Ų3822.9 Ų22.918%0.17612%0.117CC..Hα-helixtrans-64.6-43.8174.7-168.4101.5000112.2F33 G34 L37 C93 L94 R100 G101F33-H97 HydrophobicContact CB-CB 3.92Å; G34-H97 PolarHBondContact N-ND1 2.93Å; L37-H97 HydrophobicContact CD1-CB 3.77Å; C93-H97 WeakPolarHBondContact O-CB 3.41Å; C93-H97 PolarHBondContact O-N 3.47Å; L94-H97 WeakPolarHBondContact O-CB 3.22Å; L94-H97 PolarHBondContact O-N 2.9Å; H97-R100 PolarHBondContact CE1-NH2 2.88Å; H97-R100 PolarHBondContact ND1-NH2 2.85Å; H97-R100 PolarHBondContact NE2-NH2 3.28Å; H97-G101 PolarHBondContact O-N 3.39Å; H97-G101 VanDerWaalsContact O-N 3.1Å
98I98.9Very high98.8Very high29 Ų2925.1 Ų25.115%0.14913%0.126CC..Hα-helixtrans-64-49.1174.1-68.6174000109.9L94 F95 R100 G101 L102 W113 L120 L301L94-I98 HydrophobicContact CD2-CD1 3.33Å; L94-I98 HydrophobicContact CD2-CG1 3.99Å; L94-I98 WeakPolarHBondContact O-CG1 3.5Å; L94-I98 PolarHBondContact O-N 3.32Å; F95-I98 PolarHBondContact O-N 3.25Å; I98-R100 VanDerWaalsContact C-N 3.3Å; I98-R100 PolarHBondContact O-N 2.81Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 VanDerWaalsContact O-CA 3.32Å; I98-G101 WeakPolarHBondContact O-CA 3.25Å; I98-G101 PolarHBondContact O-N 3.08Å; I98-L102 HydrophobicContact CG2-CD1 4.13Å; I98-L102 HydrophobicContact CG2-CG 4.27Å; I98-L102 WeakPolarHBondContact O-CG 3.44Å; I98-L102 PolarHBondContact O-N 3.36Å; I98-W113 HydrophobicContact CG2-CH2 4.15Å; I98-L120 HydrophobicContact CD1-CD1 4.29Å; I98-L120 HydrophobicContact CD1-CD2 3.87Å; I98-L120 HydrophobicContact CD1-CG 4.49Å; I98-L301 HydrophobicContact CD1-CD1 4.27Å; I98-L301 HydrophobicContact CG2-CD1 4.44Å; I98-L301 HydrophobicContact CG2-CD2 4.17Å
99G98.9Very high98.8Very high9 Ų927.4 Ų27.49%0.09313%0.134CC..Hα-helixtrans-56-4417900000112.3F95 L96 G101 L102 Y103 Y325F95-G99 PolarHBondContact O-N 3.42Å; L96-G99 PolarHBondContact O-N 3.2Å; G99-G101 VanDerWaalsContact C-N 3.32Å; G99-G101 PolarHBondContact O-N 2.92Å; G99-L102 PolarHBondContact O-N 3.41Å; G99-Y103 WeakPolarHBondContact O-CB 3.31Å; G99-Y103 PolarHBondContact O-N 2.75Å; G99-Y325 WeakPolarHBondContact CA-OH 3.46Å; G99-Y325 WeakPolarHBondContact O-CE2 3.33Å; G99-Y325 PolarHBondContact O-OH 3.47Å
100R98.9Very high98.7Very high22 Ų2228.8 Ų28.88%0.08315%0.146CC..Hα-helixtrans-55.1-48.1169.6179-76.8-66.1-96.2-6111.1W30 W31 L96 H97 I98 L102 Y103 Y104W30-R100 HydrophobicContact CB-CB 4.06Å; W30-R100 HydrophobicContact CB-CG 3.52Å; W31-R100 VanDerWaalsContact CE2-NH1 3.25Å; W31-R100 HydrophobicContact CE3-CG 4.29Å; W31-R100 HydrophobicContact CZ3-CG 4.19Å; L96-R100 WeakPolarHBondContact O-CB 3.41Å; L96-R100 PolarHBondContact O-N 2.92Å; H97-R100 PolarHBondContact CE1-NH2 2.88Å; H97-R100 PolarHBondContact ND1-NH2 2.85Å; H97-R100 PolarHBondContact NE2-NH2 3.28Å; I98-R100 VanDerWaalsContact C-N 3.3Å; I98-R100 PolarHBondContact O-N 2.81Å; R100-L102 VanDerWaalsContact C-N 3.3Å; R100-L102 PolarHBondContact O-N 3.41Å; R100-Y103 PolarHBondContact O-N 3.47Å; R100-Y104 HydrophobicContact CG-CD2 3.77Å; R100-Y104 HydrophobicContact CG-CE2 4.13Å; R100-Y104 WeakPolarHBondContact O-CD2 3.45Å; R100-Y104 PolarHBondContact O-N 2.76Å
101G98.8Very high98.6Very high4 Ų432.8 Ų32.84%0.04117%0.165CC..Hα-helixtrans-60.7-38.9-179.800000113.1H97 I98 G99 G105 S106 F107H97-G101 PolarHBondContact O-N 3.39Å; H97-G101 VanDerWaalsContact O-N 3.1Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 VanDerWaalsContact O-CA 3.32Å; I98-G101 WeakPolarHBondContact O-CA 3.25Å; I98-G101 PolarHBondContact O-N 3.08Å; G99-G101 VanDerWaalsContact C-N 3.32Å; G99-G101 PolarHBondContact O-N 2.92Å; G101-G105 CarbonylContact O-C 3.25Å; G101-G105 PolarHBondContact O-N 3.44Å; G101-S106 PolarHBondContact O-N 3.49Å; G101-F107 WeakPolarHBondContact O-CD1 3.34Å
102L98.8Very high98.6Very high26 Ų2633.3 Ų33.314%0.13617%0.168CC..Hα-helixtrans-67.2-50.6174.5-63.8179.3000112.1I98 G99 R100 Y104 G105 F107 W113 L301 I304 Y325I98-L102 HydrophobicContact CG2-CD1 4.13Å; I98-L102 HydrophobicContact CG2-CG 4.27Å; I98-L102 WeakPolarHBondContact O-CG 3.44Å; I98-L102 PolarHBondContact O-N 3.36Å; G99-L102 PolarHBondContact O-N 3.41Å; R100-L102 VanDerWaalsContact C-N 3.3Å; R100-L102 PolarHBondContact O-N 3.41Å; L102-Y104 PolarHBondContact O-N 3.25Å; L102-G105 PolarHBondContact O-N 3.01Å; L102-F107 HydrophobicContact CD2-CD1 4.21Å; L102-W113 HydrophobicContact CD2-CH2 3.65Å; L102-W113 HydrophobicContact CD2-CZ2 3.9Å; L102-W113 HydrophobicContact CG-CH2 4.13Å; L102-L301 HydrophobicContact CD2-CD2 4.46Å; L102-I304 HydrophobicContact CD2-CD1 3.32Å; L102-I304 HydrophobicContact CD2-CG2 4.02Å; L102-Y325 HydrophobicContact CB-CE2 4.18Å
103Y98.9Very high98.6Very high33 Ų3331.6 Ų31.613%0.12916%0.158CC..Hα-helixtrans-65.5-42.1-174.8-171.2-89.7000112.7G99 R100 M315 Q322 Y325G99-Y103 WeakPolarHBondContact O-CB 3.31Å; G99-Y103 PolarHBondContact O-N 2.75Å; R100-Y103 PolarHBondContact O-N 3.47Å; Y103-M315 HydrophobicContact CD2-CB 4.28Å; Y103-M315 HydrophobicContact CD2-SD 4.28Å; Y103-M315 HydrophobicContact CE1-CB 4.42Å; Y103-M315 HydrophobicContact CE2-CB 4.19Å; Y103-M315 HydrophobicContact CG-CB 4.47Å; Y103-M315 VanDerWaalsContact O-CB 3.29Å; Y103-M315 WeakPolarHBondContact O-CB 3.43Å; Y103-M315 WeakPolarHBondContact O-CG 3.31Å; Y103-M315 PolarHBondContact O-N 3.42Å; Y103-Q322 HydrophobicContact CE2-CB 4.5Å; Y103-Q322 HydrophobicContact CE2-CG 3.94Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.43Å; Y103-Q322 PolarHBondContact OH-OE1 2.91Å; Y103-Y325 AromaticContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CE2-CD1 4.04Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å
104Y98.8Very high98.6Very high24 Ų2434.9 Ų34.99%0.09418%0.175CC..THydrogen-bonded Turntrans-944.1-177.2-63.7-69.4000113.7W30 W31 R100 L102 S106 N206 P208 S314W30-Y104 HydrophobicContact CB-CE2 4.26Å; W30-Y104 AromaticContact CD1-CE2 3.8Å; W30-Y104 HydrophobicContact CG-CE2 4.19Å; W31-Y104 HydrophobicContact CH2-CD1 4.15Å; W31-Y104 AromaticContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CD2 3.56Å; W31-Y104 HydrophobicContact CH2-CE2 4.02Å; W31-Y104 AromaticContact CH2-CG 3.61Å; W31-Y104 HydrophobicContact CH2-CG 3.61Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CG 4.1Å; R100-Y104 HydrophobicContact CG-CD2 3.77Å; R100-Y104 HydrophobicContact CG-CE2 4.13Å; R100-Y104 WeakPolarHBondContact O-CD2 3.45Å; R100-Y104 PolarHBondContact O-N 2.76Å; L102-Y104 PolarHBondContact O-N 3.25Å; Y104-S106 VanDerWaalsContact C-N 3.3Å; Y104-S106 PolarHBondContact O-N 3.07Å; Y104-N206 PolarHBondContact O-ND2 3.5Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.22Å; Y104-P208 WeakPolarHBondContact CD1-O 3.5Å; Y104-P208 VanDerWaalsContact CE1-CA 3.47Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.4Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.42Å
105G98.6Very high98.6Very high0 Ų035 Ų350%018%0.176CC..THydrogen-bonded Turntrans66.629.4179.100000113.6G101 L102 F107 L108 Q313G101-G105 CarbonylContact O-C 3.25Å; G101-G105 PolarHBondContact O-N 3.44Å; L102-G105 PolarHBondContact O-N 3.01Å; G105-F107 PolarHBondContact O-N 2.78Å; G105-L108 WeakPolarHBondContact O-CG 3.39Å; G105-L108 PolarHBondContact O-N 2.74Å; G105-Q313 PolarHBondContact O-NE2 2.96Å
106S98.6Very high98.6Very high19 Ų1933 Ų3313%0.13317%0.174CC..G310 helixtrans-73.1-13.9177.9-53.80000112.7G101 Y104 L108 Y109 N206G101-S106 PolarHBondContact O-N 3.49Å; Y104-S106 VanDerWaalsContact C-N 3.3Å; Y104-S106 PolarHBondContact O-N 3.07Å; S106-L108 PolarHBondContact O-N 3.11Å; S106-L108 VanDerWaalsContact O-N 3.16Å; S106-Y109 PolarHBondContact O-N 3.23Å; S106-Y109 VanDerWaalsContact O-N 3.13Å; S106-N206 PolarHBondContact OG-ND2 3.43Å
107F98.6Very high98.6Very high11 Ų1130.6 Ų30.65%0.04816%0.161CC..G310 helixtrans-62.5-14.4172.557.4-107.2000113.4G101 L102 G105 Y109 W113 I304 P305 H308G101-F107 WeakPolarHBondContact O-CD1 3.34Å; L102-F107 HydrophobicContact CD2-CD1 4.21Å; G105-F107 PolarHBondContact O-N 2.78Å; F107-Y109 PolarHBondContact O-N 3.03Å; F107-W113 HydrophobicContact CB-CB 4.43Å; F107-W113 HydrophobicContact CB-CD2 3.32Å; F107-W113 VanDerWaalsContact CB-CE2 3.48Å; F107-W113 HydrophobicContact CB-CE3 3.61Å; F107-W113 HydrophobicContact CB-CG 3.7Å; F107-W113 HydrophobicContact CB-CH2 4.16Å; F107-W113 HydrophobicContact CB-CZ2 3.91Å; F107-W113 HydrophobicContact CB-CZ3 4.03Å; F107-I304 HydrophobicContact CB-CG2 4.46Å; F107-I304 HydrophobicContact CD1-CG2 3.6Å; F107-I304 HydrophobicContact CD2-CG2 3.92Å; F107-I304 HydrophobicContact CE1-CG2 3.67Å; F107-I304 HydrophobicContact CE2-CG2 4.02Å; F107-I304 HydrophobicContact CG-CG2 3.72Å; F107-I304 HydrophobicContact CZ-CG2 3.89Å; F107-P305 HydrophobicContact CB-CG 4.3Å; F107-P305 HydrophobicContact CD2-CB 4.28Å; F107-P305 HydrophobicContact CD2-CG 4.16Å; F107-P305 WeakPolarHBondContact O-CG 3.42Å; F107-H308 HydrophobicContact CE2-CB 3.85Å; F107-H308 AromaticContact CE2-CG 3.98Å; F107-H308 AromaticContact CE2-ND1 3.84Å; F107-H308 HydrophobicContact CZ-CB 4.33Å; F107-H308 AromaticContact CZ-ND1 3.62Å
108L98.3Very high98.6Very high67 Ų6732.8 Ų32.835%0.35117%0.173SC..G310 helixtrans-66.6-17.7173.1-65.6-178.3000112.9G105 S106 S110 H308 Q313G105-L108 WeakPolarHBondContact O-CG 3.39Å; G105-L108 PolarHBondContact O-N 2.74Å; S106-L108 PolarHBondContact O-N 3.11Å; S106-L108 VanDerWaalsContact O-N 3.16Å; L108-S110 VanDerWaalsContact C-N 3.28Å; L108-S110 PolarHBondContact O-N 3.36Å; L108-S110 VanDerWaalsContact O-N 3.08Å; L108-H308 HydrophobicContact CD2-CB 4.24Å; L108-Q313 HydrophobicContact CD1-CB 4.2Å; L108-Q313 HydrophobicContact CD1-CG 3.75Å
109Y98.1Very high98.6Very high53 Ų5332.6 Ų32.621%0.20817%0.172CC..SBendtrans-80.580.8165.6-54.7-42.2000109S106 F107 E111 T112 W113 T203 N206S106-Y109 PolarHBondContact O-N 3.23Å; S106-Y109 VanDerWaalsContact O-N 3.13Å; F107-Y109 PolarHBondContact O-N 3.03Å; Y109-E111 VanDerWaalsContact C-N 3.35Å; Y109-E111 PolarHBondContact O-N 3.39Å; Y109-T112 PolarHBondContact O-N 3.43Å; Y109-W113 WeakPolarHBondContact O-CB 3.4Å; Y109-W113 PolarHBondContact O-N 2.82Å; Y109-T203 HydrophobicContact CD1-CG2 4.18Å; Y109-T203 HydrophobicContact CE1-CG2 4.42Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å
110S96.9Very high98.6Very high49 Ų4932.7 Ų32.734%0.34317%0.17SC..Hα-helixtrans-52.1-45.8-167.234.20000114.4L108 W113 N114L108-S110 VanDerWaalsContact C-N 3.28Å; L108-S110 PolarHBondContact O-N 3.36Å; L108-S110 VanDerWaalsContact O-N 3.08Å; S110-W113 PolarHBondContact O-N 2.97Å; S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.45Å; S110-N114 PolarHBondContact O-N 3.18Å; S110-N114 PolarHBondContact O-ND2 3.22Å; S110-N114 VanDerWaalsContact O-ND2 3.09Å
111E98.1Very high98.6Very high100 Ų10034.9 Ų34.947%0.46718%0.184SC..Hα-helixtrans-68.4-49.8-176-6682.416800110Y109 W113 N114 I115 F199Y109-E111 VanDerWaalsContact C-N 3.35Å; Y109-E111 PolarHBondContact O-N 3.39Å; E111-W113 VanDerWaalsContact C-N 3.32Å; E111-W113 PolarHBondContact O-N 2.89Å; E111-N114 PolarHBondContact O-N 3.02Å; E111-I115 WeakPolarHBondContact O-CD1 3.39Å; E111-I115 WeakPolarHBondContact O-CG1 3.23Å; E111-I115 PolarHBondContact O-N 3.43Å; E111-F199 HydrophobicContact CB-CB 4.04Å; E111-F199 HydrophobicContact CB-CD1 3.48Å; E111-F199 VanDerWaalsContact CB-CD1 3.48Å; E111-F199 HydrophobicContact CB-CD2 4.19Å; E111-F199 HydrophobicContact CB-CE1 3.88Å; E111-F199 HydrophobicContact CB-CG 3.65Å; E111-F199 HydrophobicContact CB-CZ 4.36Å; E111-F199 HydrophobicContact CG-CD1 3.88Å; E111-F199 HydrophobicContact CG-CE1 3.86Å; E111-F199 HydrophobicContact CG-CZ 4.46Å
112T98.7Very high98.6Very high14 Ų1435.4 Ų35.49%0.08619%0.187CC..Hα-helixtrans-57.5-46.5174.1-550000110.6Y109 G116 H196 L200Y109-T112 PolarHBondContact O-N 3.43Å; T112-G116 PolarHBondContact O-N 2.88Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.41Å; T112-H196 PolarHBondContact O-CE1 2.88Å; T112-H196 PolarHBondContact O-ND1 3.2Å; T112-L200 HydrophobicContact CG2-CB 4.18Å; T112-L200 HydrophobicContact CG2-CD1 4.47Å; T112-L200 PolarHBondContact OG1-N 3.23Å
113W98.8Very high98.6Very high24 Ų2434.6 Ų34.69%0.09118%0.183CC..Hα-helixtrans-63.2-48.7-179.9-176.4-108000112.8I98 L102 F107 Y109 S110 E111 I115 G116 I117 L301 I304I98-W113 HydrophobicContact CG2-CH2 4.15Å; L102-W113 HydrophobicContact CD2-CH2 3.65Å; L102-W113 HydrophobicContact CD2-CZ2 3.9Å; L102-W113 HydrophobicContact CG-CH2 4.13Å; F107-W113 HydrophobicContact CB-CB 4.43Å; F107-W113 HydrophobicContact CB-CD2 3.32Å; F107-W113 VanDerWaalsContact CB-CE2 3.48Å; F107-W113 HydrophobicContact CB-CE3 3.61Å; F107-W113 HydrophobicContact CB-CG 3.7Å; F107-W113 HydrophobicContact CB-CH2 4.16Å; F107-W113 HydrophobicContact CB-CZ2 3.91Å; F107-W113 HydrophobicContact CB-CZ3 4.03Å; Y109-W113 WeakPolarHBondContact O-CB 3.4Å; Y109-W113 PolarHBondContact O-N 2.82Å; S110-W113 PolarHBondContact O-N 2.97Å; E111-W113 VanDerWaalsContact C-N 3.32Å; E111-W113 PolarHBondContact O-N 2.89Å; W113-I115 PolarHBondContact O-N 3.42Å; W113-G116 CarbonylContact O-C 3.58Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.47Å; W113-G116 PolarHBondContact O-N 3.42Å; W113-I117 PolarHBondContact O-N 3.48Å; W113-L301 HydrophobicContact CH2-CD2 4.48Å; W113-L301 HydrophobicContact CZ2-CB 4.15Å; W113-L301 HydrophobicContact CZ2-CD2 4.05Å; W113-L301 PolarHBondContact NE1-O 2.98Å; W113-I304 HydrophobicContact CZ2-CD1 4.47Å
114N98.6Very high98.6Very high71 Ų7133.8 Ų33.838%0.3818%0.181SC..Hα-helixtrans-65.3-39-179.3-71.9-30.3000111.8S110 E111 G116 I117 I118S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.45Å; S110-N114 PolarHBondContact O-N 3.18Å; S110-N114 PolarHBondContact O-ND2 3.22Å; S110-N114 VanDerWaalsContact O-ND2 3.09Å; E111-N114 PolarHBondContact O-N 3.02Å; N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 3.12Å; N114-I117 WeakPolarHBondContact O-CB 3.18Å; N114-I117 PolarHBondContact O-N 3.12Å; N114-I118 WeakPolarHBondContact O-CG1 3.39Å; N114-I118 PolarHBondContact O-N 3.11Å; N114-I118 VanDerWaalsContact O-N 3.07Å
115I98.8Very high98.6Very high14 Ų1434.5 Ų34.57%0.07219%0.192CC..Hα-helixtrans-65-35.7170.7-66.4162.2000110.8E111 W113 I117 I118 L119 L195 H196 F199E111-I115 WeakPolarHBondContact O-CD1 3.39Å; E111-I115 WeakPolarHBondContact O-CG1 3.23Å; E111-I115 PolarHBondContact O-N 3.43Å; W113-I115 PolarHBondContact O-N 3.42Å; I115-I117 VanDerWaalsContact C-N 3.29Å; I115-I117 PolarHBondContact O-N 2.95Å; I115-I118 PolarHBondContact O-N 3.19Å; I115-L119 HydrophobicContact CG2-CD1 4.12Å; I115-L119 HydrophobicContact CG2-CG 4.35Å; I115-L119 WeakPolarHBondContact O-CB 3.36Å; I115-L119 WeakPolarHBondContact O-CG 3.32Å; I115-L119 PolarHBondContact O-N 2.98Å; I115-L195 HydrophobicContact CD1-CD2 3.89Å; I115-L195 HydrophobicContact CD1-CG 3.76Å; I115-L195 HydrophobicContact CG1-CD2 4.48Å; I115-H196 HydrophobicContact CB-CB 4.46Å; I115-H196 HydrophobicContact CG2-CB 3.68Å; I115-F199 HydrophobicContact CD1-CD2 3.16Å; I115-F199 HydrophobicContact CD1-CE2 3.42Å; I115-F199 VanDerWaalsContact CD1-CE2 3.42Å; I115-F199 HydrophobicContact CD1-CG 4.25Å
116G98.8Very high98.6Very high23 Ų2335.1 Ų35.124%0.23720%0.196CC..Hα-helixtrans-57.5-40171.700000112.9T112 W113 N114 L119 L120T112-G116 PolarHBondContact O-N 2.88Å; W113-G116 CarbonylContact O-C 3.58Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.47Å; W113-G116 PolarHBondContact O-N 3.42Å; N114-G116 VanDerWaalsContact C-N 3.27Å; N114-G116 PolarHBondContact O-N 3.12Å; G116-L119 WeakPolarHBondContact O-CB 3.32Å; G116-L119 PolarHBondContact O-N 3.11Å; G116-L120 PolarHBondContact O-N 3.46Å
117I98.8Very high98.6Very high12 Ų1234.9 Ų34.96%0.06220%0.195CC..Hα-helixtrans-66.5-42.4174.5-62.1168.3000110.8W113 N114 I115 L119 L120 L121 L301 A302W113-I117 PolarHBondContact O-N 3.48Å; N114-I117 WeakPolarHBondContact O-CB 3.18Å; N114-I117 PolarHBondContact O-N 3.12Å; I115-I117 VanDerWaalsContact C-N 3.29Å; I115-I117 PolarHBondContact O-N 2.95Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 3.41Å; I117-L120 WeakPolarHBondContact O-CB 3.46Å; I117-L120 PolarHBondContact O-N 3.19Å; I117-L121 HydrophobicContact CG2-CD1 4.27Å; I117-L121 WeakPolarHBondContact O-CG 3.34Å; I117-L121 PolarHBondContact O-N 2.99Å; I117-L301 HydrophobicContact CD1-CB 3.81Å; I117-L301 HydrophobicContact CG1-CB 3.95Å; I117-A302 HydrophobicContact CD1-CB 3.87Å
118I98.9Very high98.6Very high85 Ų8536.3 Ų36.344%0.43620%0.202SC..Hα-helixtrans-62.6-41.9175.8-62.3169.1000110.5N114 I115 L121 A122 L192N114-I118 WeakPolarHBondContact O-CG1 3.39Å; N114-I118 PolarHBondContact O-N 3.11Å; N114-I118 VanDerWaalsContact O-N 3.07Å; I115-I118 PolarHBondContact O-N 3.19Å; I118-L121 PolarHBondContact O-N 3.4Å; I118-A122 WeakPolarHBondContact O-CB 3.42Å; I118-A122 PolarHBondContact O-N 3.07Å; I118-L192 HydrophobicContact CG2-CD1 3.86Å; I118-L192 HydrophobicContact CG2-CD2 4.31Å
119L98.9Very high98.6Very high25 Ų2534 Ų3413%0.13119%0.189CC..Hα-helixtrans-61.5-41.2174.5-79.8167.8000112.3I115 G116 I117 T123 I189 L192 A193 H196I115-L119 HydrophobicContact CG2-CD1 4.12Å; I115-L119 HydrophobicContact CG2-CG 4.35Å; I115-L119 WeakPolarHBondContact O-CB 3.36Å; I115-L119 WeakPolarHBondContact O-CG 3.32Å; I115-L119 PolarHBondContact O-N 2.98Å; G116-L119 WeakPolarHBondContact O-CB 3.32Å; G116-L119 PolarHBondContact O-N 3.11Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 3.41Å; L119-T123 VanDerWaalsContact O-CB 3.32Å; L119-T123 WeakPolarHBondContact O-CB 3.34Å; L119-T123 PolarHBondContact O-N 2.9Å; L119-T123 PolarHBondContact O-OG1 2.91Å; L119-I189 HydrophobicContact CD2-CG2 3.83Å; L119-L192 HydrophobicContact CD2-CB 3.54Å; L119-L192 HydrophobicContact CD2-CD1 4.48Å; L119-L192 HydrophobicContact CG-CB 4.06Å; L119-A193 HydrophobicContact CD2-CB 4.39Å; L119-H196 HydrophobicContact CD1-CB 3.81Å
120L98.8Very high98.7Very high10 Ų1032.3 Ų32.35%0.05219%0.188CC..Hα-helixtrans-59-52.7173.5167.866.1000110.4L94 I98 G116 I117 A122 T123 M124 I298 L301L94-L120 HydrophobicContact CD1-CD1 4.13Å; L94-L120 HydrophobicContact CD2-CB 4.27Å; L94-L120 HydrophobicContact CD2-CD1 3.41Å; L94-L120 VanDerWaalsContact CD2-CD1 3.41Å; L94-L120 HydrophobicContact CD2-CG 4.34Å; L94-L120 HydrophobicContact CG-CD1 4.44Å; I98-L120 HydrophobicContact CD1-CD1 4.29Å; I98-L120 HydrophobicContact CD1-CD2 3.87Å; I98-L120 HydrophobicContact CD1-CG 4.49Å; G116-L120 PolarHBondContact O-N 3.46Å; I117-L120 WeakPolarHBondContact O-CB 3.46Å; I117-L120 PolarHBondContact O-N 3.19Å; L120-A122 PolarHBondContact O-N 3.02Å; L120-T123 PolarHBondContact O-N 3.45Å; L120-M124 HydrophobicContact CD1-CG 4Å; L120-M124 HydrophobicContact CD1-SD 3.72Å; L120-M124 HydrophobicContact CG-CG 4.48Å; L120-M124 HydrophobicContact CG-SD 3.86Å; L120-M124 WeakPolarHBondContact O-CB 3.49Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.27Å; L120-M124 PolarHBondContact O-N 3.49Å; L120-I298 HydrophobicContact CD2-CG2 3.73Å; L120-I298 HydrophobicContact CG-CG2 4.43Å; L120-L301 HydrophobicContact CD2-CD1 3.72Å
121L98.8Very high98.7Very high69 Ų6932 Ų3236%0.36118%0.179SC..Hα-helixtrans-61.8-41.9-179.2-70.5170000112.3I117 I118 M124 A125 I298 L299I117-L121 HydrophobicContact CG2-CD1 4.27Å; I117-L121 WeakPolarHBondContact O-CG 3.34Å; I117-L121 PolarHBondContact O-N 2.99Å; I118-L121 PolarHBondContact O-N 3.4Å; L121-M124 PolarHBondContact O-N 2.99Å; L121-A125 WeakPolarHBondContact O-CB 3.27Å; L121-A125 PolarHBondContact O-N 3.46Å; L121-I298 HydrophobicContact CD2-CG2 3.79Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; L121-L299 HydrophobicContact CD1-CD2 4.19Å
122A98.9Very high98.8Very high14 Ų1427.3 Ų27.312%0.11616%0.157CC..Hα-helixtrans-64.9-42176.600000111.8I118 L120 A125 T126 I189I118-A122 WeakPolarHBondContact O-CB 3.42Å; I118-A122 PolarHBondContact O-N 3.07Å; L120-A122 PolarHBondContact O-N 3.02Å; A122-A125 PolarHBondContact O-N 3.28Å; A122-T126 WeakPolarHBondContact O-CB 3.19Å; A122-T126 PolarHBondContact O-N 3.49Å; A122-T126 PolarHBondContact O-OG1 3.44Å; A122-I189 HydrophobicContact CB-CD1 4.15Å; A122-I189 HydrophobicContact CB-CG1 3.72Å
123T98.9Very high98.8Very high9 Ų927.4 Ų27.46%0.05516%0.157CC..Hα-helixtrans-64.7-42175.7-55.90000111.3F90 F91 L94 L119 L120 T126 A127F90-T123 HydrophobicContact CD1-CG2 3.99Å; F90-T123 HydrophobicContact CE1-CG2 3.87Å; F90-T123 HydrophobicContact CG-CG2 4.47Å; F90-T123 HydrophobicContact CZ-CG2 4.23Å; F91-T123 HydrophobicContact CE2-CG2 4.27Å; F91-T123 HydrophobicContact CZ-CG2 4Å; L94-T123 HydrophobicContact CD1-CG2 3.97Å; L119-T123 VanDerWaalsContact O-CB 3.32Å; L119-T123 WeakPolarHBondContact O-CB 3.34Å; L119-T123 PolarHBondContact O-N 2.9Å; L119-T123 PolarHBondContact O-OG1 2.91Å; L120-T123 PolarHBondContact O-N 3.45Å; T123-T126 PolarHBondContact O-N 3.4Å; T123-A127 WeakPolarHBondContact O-CB 3.35Å; T123-A127 PolarHBondContact O-N 2.96Å
124M98.8Very high98.7Very high16 Ų1627.6 Ų27.68%0.07916%0.161CC..Hα-helixtrans-59-49.6173.6-73.3177.287.400111.8F91 L120 L121 T126 A127 F128 F274 I298F91-M124 HydrophobicContact CE1-CG 3.83Å; F91-M124 HydrophobicContact CZ-CG 4.18Å; L120-M124 HydrophobicContact CD1-CG 4Å; L120-M124 HydrophobicContact CD1-SD 3.72Å; L120-M124 HydrophobicContact CG-CG 4.48Å; L120-M124 HydrophobicContact CG-SD 3.86Å; L120-M124 WeakPolarHBondContact O-CB 3.49Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.27Å; L120-M124 PolarHBondContact O-N 3.49Å; L121-M124 PolarHBondContact O-N 2.99Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.26Å; M124-A127 PolarHBondContact O-N 3.43Å; M124-F128 WeakPolarHBondContact O-CB 3.43Å; M124-F128 PolarHBondContact O-N 2.83Å; M124-F274 HydrophobicContact CB-CE1 3.84Å; M124-F274 HydrophobicContact CB-CZ 4.25Å; M124-F274 HydrophobicContact CE-CD1 3.63Å; M124-F274 HydrophobicContact CE-CE1 3.48Å; M124-F274 VanDerWaalsContact CE-CE1 3.48Å; M124-F274 HydrophobicContact CG-CE1 3.84Å; M124-F274 WeakPolarHBondContact O-CZ 3.46Å; M124-I298 HydrophobicContact CE-CD1 3.41Å; M124-I298 VanDerWaalsContact CE-CD1 3.41Å; M124-I298 HydrophobicContact CE-CG1 4.16Å; M124-I298 HydrophobicContact SD-CD1 3.87Å; M124-I298 HydrophobicContact SD-CG1 4.44Å; M124-I298 HydrophobicContact SD-CG2 4.39Å
125A98.7Very high98.7Very high40 Ų4024.8 Ų24.833%0.33115%0.146SC..Hα-helixtrans-60-45.3176.800000111.6L121 A122 A127 F128 M129 L185L121-A125 WeakPolarHBondContact O-CB 3.27Å; L121-A125 PolarHBondContact O-N 3.46Å; A122-A125 PolarHBondContact O-N 3.28Å; A125-A127 PolarHBondContact O-N 3.27Å; A125-F128 PolarHBondContact O-N 3.42Å; A125-M129 HydrophobicContact CB-CE 4.05Å; A125-M129 WeakPolarHBondContact O-CE 3.4Å; A125-M129 PolarHBondContact O-N 2.79Å; A125-L185 HydrophobicContact CB-CD1 4.3Å
126T98.9Very high98.7Very high13 Ų1324.1 Ų24.18%0.0814%0.142CC..Hα-helixtrans-59.4-49178.9-56.60000111.3A122 T123 M124 M129 G130 H182 L185 P186 I189A122-T126 WeakPolarHBondContact O-CB 3.19Å; A122-T126 PolarHBondContact O-N 3.49Å; A122-T126 PolarHBondContact O-OG1 3.44Å; T123-T126 PolarHBondContact O-N 3.4Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.26Å; T126-M129 PolarHBondContact O-N 2.9Å; T126-G130 PolarHBondContact O-N 2.95Å; T126-H182 PolarHBondContact O-CE1 2.89Å; T126-H182 PolarHBondContact O-ND1 3.46Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 VanDerWaalsContact OG1-CB 3.23Å; T126-L185 WeakPolarHBondContact OG1-CB 3.27Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.2Å
127A98.8Very high98.7Very high14 Ų1423.6 Ų23.612%0.11613%0.133CC..Hα-helixtrans-67.3-41.2-178.600000112.5F91 T123 M124 A125 M129 G130 Y131 Y273F91-A127 HydrophobicContact CE2-CB 3.49Å; F91-A127 VanDerWaalsContact CE2-CB 3.49Å; F91-A127 HydrophobicContact CZ-CB 3.85Å; T123-A127 WeakPolarHBondContact O-CB 3.35Å; T123-A127 PolarHBondContact O-N 2.96Å; M124-A127 PolarHBondContact O-N 3.43Å; A125-A127 PolarHBondContact O-N 3.27Å; A127-M129 PolarHBondContact O-N 3.21Å; A127-G130 PolarHBondContact O-N 2.94Å; A127-Y131 WeakPolarHBondContact O-CB 3.35Å; A127-Y131 PolarHBondContact O-N 3.29Å; A127-Y273 HydrophobicContact CB-CE2 3.97Å
128F98.7Very high98.6Very high41 Ų4123.1 Ų23.118%0.1813%0.131CC..Hα-helixtrans-56.7-51.8174.2169.5-104.3000111.2M124 A125 G130 Y131 V132 I146 T147 F178 F274M124-F128 WeakPolarHBondContact O-CB 3.43Å; M124-F128 PolarHBondContact O-N 2.83Å; A125-F128 PolarHBondContact O-N 3.42Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 2.86Å; F128-Y131 PolarHBondContact O-N 3.01Å; F128-V132 WeakPolarHBondContact O-CG2 3.45Å; F128-V132 PolarHBondContact O-N 3.24Å; F128-I146 HydrophobicContact CD2-CG2 4.38Å; F128-I146 HydrophobicContact CE2-CB 3.75Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.74Å; F128-I146 HydrophobicContact CZ-CB 3.99Å; F128-I146 HydrophobicContact CZ-CG2 3.9Å; F128-T147 HydrophobicContact CE1-CG2 4.23Å; F128-T147 HydrophobicContact CZ-CG2 4.1Å; F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.21Å; F128-F178 HydrophobicContact CZ-CE2 4.48Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.18Å
129M98.7Very high98.5Very high19 Ų1919 Ų199%0.09411%0.11CC..Hα-helixtrans-65.7-37.7179.4-72.3179.1-79.400112.4A125 T126 A127 Y131 V132 L133 F178 F181 H182 L185A125-M129 HydrophobicContact CB-CE 4.05Å; A125-M129 WeakPolarHBondContact O-CE 3.4Å; A125-M129 PolarHBondContact O-N 2.79Å; T126-M129 PolarHBondContact O-N 2.9Å; A127-M129 PolarHBondContact O-N 3.21Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 2.94Å; M129-V132 WeakPolarHBondContact O-CB 3.49Å; M129-V132 PolarHBondContact O-N 2.85Å; M129-V132 VanDerWaalsContact O-N 3.11Å; M129-L133 WeakPolarHBondContact O-CG 3.49Å; M129-F178 HydrophobicContact CB-CB 4.28Å; M129-F178 HydrophobicContact CB-CD2 4.41Å; M129-F178 HydrophobicContact CB-CG 4.36Å; M129-F178 HydrophobicContact CG-CB 4.3Å; M129-F178 HydrophobicContact CG-CD1 4.17Å; M129-F178 HydrophobicContact CG-CD2 4Å; M129-F178 HydrophobicContact CG-CE2 4.36Å; M129-F178 HydrophobicContact CG-CG 3.91Å; M129-F178 HydrophobicContact SD-CD1 4.18Å; M129-F178 HydrophobicContact SD-CG 4.39Å; M129-F181 HydrophobicContact CE-CB 4Å; M129-F181 HydrophobicContact SD-CB 3.46Å; M129-F181 WeakPolarHBondContact SD-CB 3.35Å; M129-F181 HydrophobicContact SD-CG 4.32Å; M129-H182 HydrophobicContact CB-CB 4.1Å; M129-L185 HydrophobicContact CE-CD1 3.23Å
130G98.6Very high98.5Very high17 Ų1718.4 Ų18.418%0.17511%0.106CC..Hα-helixtrans-60-39.1175.100000112.5T126 A127 F128 V132 L133 P134 H182T126-G130 PolarHBondContact O-N 2.95Å; A127-G130 PolarHBondContact O-N 2.94Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 2.86Å; G130-V132 PolarHBondContact O-N 3.5Å; G130-L133 WeakPolarHBondContact O-CB 3.28Å; G130-L133 WeakPolarHBondContact O-CG 3.47Å; G130-L133 PolarHBondContact O-N 3.18Å; G130-P134 WeakPolarHBondContact O-CD 3.3Å; G130-H182 WeakPolarHBondContact CA-CE1 3.3Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.33Å; G130-H182 PolarHBondContact N-ND1 3.34Å
131Y98.6Very high98.5Very high42 Ų4219.5 Ų19.517%0.16511%0.11CC..Hα-helixtrans-68.6-19.1177.5-168.8-104.6000113.5A127 F128 M129 P134 M138 S139 E271A127-Y131 WeakPolarHBondContact O-CB 3.35Å; A127-Y131 PolarHBondContact O-N 3.29Å; F128-Y131 PolarHBondContact O-N 3.01Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 2.94Å; Y131-P134 WeakPolarHBondContact O-CD 2.99Å; Y131-M138 HydrophobicContact CE1-CB 4.16Å; Y131-S139 VanDerWaalsContact O-CB 3.28Å; Y131-S139 WeakPolarHBondContact O-CB 3.41Å; Y131-S139 PolarHBondContact O-OG 2.89Å; Y131-E271 HydrophobicContact CD1-CG 4.22Å; Y131-E271 HydrophobicContact CD2-CG 3.46Å; Y131-E271 VanDerWaalsContact CD2-CG 3.46Å; Y131-E271 HydrophobicContact CE1-CG 4.16Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.1Å; Y131-E271 HydrophobicContact CG-CG 3.87Å; Y131-E271 PolarHBondContact OH-OE1 3.46Å
132V98.6Very high98.3Very high1 Ų116.7 Ų16.71%0.00610%0.098CC..Hα-helixtrans-78.3-28.3174.9-177.70000111.8F128 M129 G130 P134 W135 A143 L175 F178F128-V132 WeakPolarHBondContact O-CG2 3.45Å; F128-V132 PolarHBondContact O-N 3.24Å; M129-V132 WeakPolarHBondContact O-CB 3.49Å; M129-V132 PolarHBondContact O-N 2.85Å; M129-V132 VanDerWaalsContact O-N 3.11Å; G130-V132 PolarHBondContact O-N 3.5Å; V132-P134 VanDerWaalsContact C-CD 3.48Å; V132-W135 HydrophobicContact CG1-CE3 4.14Å; V132-W135 HydrophobicContact CG1-CZ3 3.93Å; V132-W135 PolarHBondContact O-N 2.94Å; V132-A143 HydrophobicContact CG1-CB 4.05Å; V132-A143 HydrophobicContact CG2-CB 3.75Å; V132-L175 HydrophobicContact CG1-CD1 4.39Å; V132-F178 HydrophobicContact CB-CD2 3.94Å; V132-F178 HydrophobicContact CG1-CD2 3.98Å; V132-F178 HydrophobicContact CG2-CD2 3.88Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å
133L98.8Very high98.2Very high17 Ų1716.1 Ų16.19%0.0899%0.093CC..THydrogen-bonded Turntrans-59.5-35.2-171.2-54.6-174.4000115.3Y55 M129 G130 W135 L175 F178 F179 H182Y55-L133 HydrophobicContact CE1-CB 4.42Å; Y55-L133 HydrophobicContact CE2-CB 4.44Å; Y55-L133 WeakPolarHBondContact CE2-O 3.41Å; Y55-L133 WeakPolarHBondContact OH-CA 3.48Å; Y55-L133 PolarHBondContact OH-O 3.34Å; M129-L133 WeakPolarHBondContact O-CG 3.49Å; G130-L133 WeakPolarHBondContact O-CB 3.28Å; G130-L133 WeakPolarHBondContact O-CG 3.47Å; G130-L133 PolarHBondContact O-N 3.18Å; L133-W135 PolarHBondContact O-N 2.91Å; L133-L175 HydrophobicContact CD2-CD1 4.01Å; L133-F178 HydrophobicContact CD2-CB 4.47Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.91Å; L133-H182 HydrophobicContact CD1-CB 4.29Å
134P98.5Very high98.2Very high27 Ų2717.1 Ų17.118%0.17510%0.099CC..THydrogen-bonded Turntrans-63.5-18.5175.7-24.635.7000115F63 I66 G130 Y131 V132 G136F63-P134 WeakPolarHBondContact CA-O 3.43Å; F63-P134 WeakPolarHBondContact CD2-O 3.45Å; I66-P134 HydrophobicContact CG1-CB 4.4Å; G130-P134 WeakPolarHBondContact O-CD 3.3Å; Y131-P134 WeakPolarHBondContact O-CD 2.99Å; V132-P134 VanDerWaalsContact C-CD 3.48Å; P134-G136 VanDerWaalsContact C-N 3.25Å; P134-G136 PolarHBondContact O-N 3.36Å
135W98.5Very high98.1Very high12 Ų1219 Ų195%0.04511%0.111CC..  trans5735.5176.9-150.5-111.4000114.3A59 A62 F63 V132 L133 F140 V170 L175 A259A59-W135 HydrophobicContact CB-CZ2 3.76Å; A62-W135 HydrophobicContact CB-CB 3.86Å; A62-W135 HydrophobicContact CB-CG 4.38Å; F63-W135 HydrophobicContact CB-CB 4.48Å; V132-W135 HydrophobicContact CG1-CE3 4.14Å; V132-W135 HydrophobicContact CG1-CZ3 3.93Å; V132-W135 PolarHBondContact O-N 2.94Å; L133-W135 PolarHBondContact O-N 2.91Å; W135-F140 HydrophobicContact CH2-CD2 4.1Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.32Å; W135-V170 HydrophobicContact CH2-CG1 3.68Å; W135-V170 HydrophobicContact CZ3-CG1 4.02Å; W135-L175 HydrophobicContact CD2-CD2 3.84Å; W135-L175 HydrophobicContact CE3-CB 4.28Å; W135-L175 HydrophobicContact CE3-CD1 3.63Å; W135-L175 HydrophobicContact CE3-CD2 3.69Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.14Å; W135-L175 HydrophobicContact CZ3-CB 3.81Å; W135-L175 HydrophobicContact CZ3-CD1 3.84Å; W135-L175 HydrophobicContact CZ3-CD2 4.06Å; W135-L175 HydrophobicContact CZ3-CG 4.12Å; W135-A259 HydrophobicContact CG-CB 4.42Å; W135-A259 WeakPolarHBondContact O-CB 3.38Å; W135-A259 PolarHBondContact O-N 2.73Å; W135-A259 VanDerWaalsContact O-N 3.12Å
136G98.3Very high97.9Very high0 Ų019.5 Ų19.50%011%0.108CC..BIsolated β-bridgetrans-85-179.5168.700000112.7P134 M138 S139 F140 N255 T257P134-G136 VanDerWaalsContact C-N 3.25Å; P134-G136 PolarHBondContact O-N 3.36Å; G136-M138 PolarHBondContact O-N 3.41Å; G136-S139 WeakPolarHBondContact O-CB 3.4Å; G136-S139 PolarHBondContact O-N 3.39Å; G136-F140 PolarHBondContact O-N 3.46Å; G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.23Å; G136-N255 WeakPolarHBondContact CA-OD1 3.48Å; G136-T257 CarbonylContact C-O 2.93Å; G136-T257 WeakPolarHBondContact CA-O 3.06Å
137Q98.1Very high97.8Very high12 Ų1219.3 Ų19.36%0.05611%0.106CC..Hα-helixtrans-58.6-49.1-179.3-75.2-76.361.800113S139 F140 W141 D254 T257 N263 P265Q137-S139 PolarHBondContact O-N 3.37Å; Q137-F140 PolarHBondContact O-N 2.63Å; Q137-W141 WeakPolarHBondContact O-CB 3.36Å; Q137-W141 PolarHBondContact O-N 3.14Å; Q137-D254 HydrophobicContact CB-CB 4.45Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.25Å; Q137-T257 PolarHBondContact N-O 3.17Å; Q137-N263 PolarHBondContact NE2-O 3.01Å; Q137-P265 HydrophobicContact CB-CG 3.86Å
138M97.3Very high97.8Very high2 Ų221.6 Ų21.61%0.0112%0.117CC..Hα-helixtrans-67.8-36.6179.8-70.6-63.1163.400112Y131 G136 G142 D252 D254 N255 P265Y131-M138 HydrophobicContact CE1-CB 4.16Å; G136-M138 PolarHBondContact O-N 3.41Å; M138-G142 WeakPolarHBondContact O-CA 3.33Å; M138-G142 PolarHBondContact O-N 3.17Å; M138-D252 HydrophobicContact CG-CB 4.09Å; M138-D254 HydrophobicContact CE-CB 3.52Å; M138-D254 WeakPolarHBondContact CE-OD2 3.42Å; M138-D254 HydrophobicContact CG-CB 3.8Å; M138-N255 HydrophobicContact CB-CB 4.16Å; M138-N255 PolarHBondContact N-OD1 2.71Å; M138-P265 HydrophobicContact CE-CB 3.48Å; M138-P265 VanDerWaalsContact CE-CB 3.48Å; M138-P265 HydrophobicContact CE-CG 4Å
139S97.4Very high97.6Very high0 Ų020.9 Ų20.90%012%0.115CC..Hα-helixtrans-55.7-54.3172.1-66.10000111.9Y131 G136 Q137 A143 N255Y131-S139 VanDerWaalsContact O-CB 3.28Å; Y131-S139 WeakPolarHBondContact O-CB 3.41Å; Y131-S139 PolarHBondContact O-OG 2.89Å; G136-S139 WeakPolarHBondContact O-CB 3.4Å; G136-S139 PolarHBondContact O-N 3.39Å; Q137-S139 PolarHBondContact O-N 3.37Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.12Å; S139-A143 PolarHBondContact O-N 2.96Å; S139-N255 PolarHBondContact N-OD1 2.81Å; S139-N255 PolarHBondContact OG-ND2 2.83Å; S139-N255 PolarHBondContact OG-OD1 3.29Å
140F98.1Very high97.4Very high11 Ų1122.6 Ų22.65%0.04812%0.124CC..Hα-helixtrans-68.7-49.5-175.4175.2-90.9000112.6W135 G136 Q137 A143 T144 V170 A259 P261W135-F140 HydrophobicContact CH2-CD2 4.1Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.32Å; G136-F140 PolarHBondContact O-N 3.46Å; Q137-F140 PolarHBondContact O-N 2.63Å; F140-A143 PolarHBondContact O-N 2.93Å; F140-T144 WeakPolarHBondContact O-CB 3.4Å; F140-T144 PolarHBondContact O-N 2.84Å; F140-T144 PolarHBondContact O-OG1 3.34Å; F140-V170 HydrophobicContact CD2-CG1 4.09Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.12Å; F140-V170 VanDerWaalsContact CE2-O 3.3Å; F140-V170 WeakPolarHBondContact CE2-O 3.48Å; F140-A259 HydrophobicContact CB-CB 3.51Å; F140-A259 HydrophobicContact CD2-CB 4.27Å; F140-A259 HydrophobicContact CG-CB 3.93Å; F140-P261 HydrophobicContact CE1-CB 4.1Å; F140-P261 HydrophobicContact CE1-CG 4.27Å; F140-P261 HydrophobicContact CE2-CG 4.23Å; F140-P261 HydrophobicContact CZ-CB 3.85Å; F140-P261 HydrophobicContact CZ-CG 3.8Å
141W98.3Very high97.3Very high34 Ų3423.2 Ų23.213%0.12913%0.126CC..Hα-helixtrans-72-35.8-177.7-73.7105.6000111.9Q137 T144 V145 N260 P261 N263 T264 P265 I268Q137-W141 WeakPolarHBondContact O-CB 3.36Å; Q137-W141 PolarHBondContact O-N 3.14Å; W141-T144 PolarHBondContact O-N 3.25Å; W141-V145 WeakPolarHBondContact O-CB 3.3Å; W141-V145 WeakPolarHBondContact O-CG2 3.38Å; W141-V145 PolarHBondContact O-N 3.46Å; W141-N260 PolarHBondContact NE1-O 3.3Å; W141-P261 WeakPolarHBondContact CH2-O 3.33Å; W141-P261 WeakPolarHBondContact CZ2-O 3.07Å; W141-N263 PolarHBondContact NE1-O 2.76Å; W141-T264 HydrophobicContact CD2-CG2 4.18Å; W141-T264 HydrophobicContact CE3-CG2 4.16Å; W141-T264 HydrophobicContact CH2-CG2 4.49Å; W141-T264 VanDerWaalsContact CH2-OG1 3.26Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.34Å; W141-T264 HydrophobicContact CZ2-CG2 4.49Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.23Å; W141-T264 HydrophobicContact CZ3-CG2 4.33Å; W141-P265 HydrophobicContact CG-CG 4.36Å; W141-I268 HydrophobicContact CB-CD1 3.75Å; W141-I268 HydrophobicContact CB-CG1 3.91Å; W141-I268 HydrophobicContact CB-CG2 4.15Å; W141-I268 HydrophobicContact CD2-CD1 4.32Å; W141-I268 HydrophobicContact CE3-CD1 4.22Å; W141-I268 HydrophobicContact CG-CD1 4.16Å
142G96Very high97.2Very high10 Ų1022 Ų2210%0.10313%0.125CC..Hα-helixtrans-59.4-47.7170.100000111.7M138 T144 V145 I146M138-G142 WeakPolarHBondContact O-CA 3.33Å; M138-G142 PolarHBondContact O-N 3.17Å; G142-T144 PolarHBondContact O-N 2.91Å; G142-V145 PolarHBondContact O-N 3.46Å; G142-I146 WeakPolarHBondContact O-CB 3.25Å; G142-I146 VanDerWaalsContact O-CG1 3.26Å; G142-I146 WeakPolarHBondContact O-CG1 3.47Å; G142-I146 PolarHBondContact O-N 3.39Å
143A96.8Very high97.1Very high1 Ų124.8 Ų24.81%0.00814%0.139CC..Hα-helixtrans-57.5-48.5175.400000111.6V132 S139 F140 T147 V170V132-A143 HydrophobicContact CG1-CB 4.05Å; V132-A143 HydrophobicContact CG2-CB 3.75Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.12Å; S139-A143 PolarHBondContact O-N 2.96Å; F140-A143 PolarHBondContact O-N 2.93Å; A143-T147 WeakPolarHBondContact O-CB 3.34Å; A143-T147 WeakPolarHBondContact O-CG2 3.21Å; A143-T147 PolarHBondContact O-N 3.2Å; A143-T147 PolarHBondContact O-OG1 3.45Å; A143-V170 HydrophobicContact CB-CG1 4.21Å; A143-V170 HydrophobicContact CB-CG2 4.28Å
144T97.4Very high97Very high30 Ų3027.5 Ų27.518%0.18416%0.157CC..Hα-helixtrans-59.6-49.3-179.1-60.30000111.8F140 W141 G142 N148F140-T144 WeakPolarHBondContact O-CB 3.4Å; F140-T144 PolarHBondContact O-N 2.84Å; F140-T144 PolarHBondContact O-OG1 3.34Å; W141-T144 PolarHBondContact O-N 3.25Å; G142-T144 PolarHBondContact O-N 2.91Å; T144-N148 WeakPolarHBondContact O-CB 3.45Å; T144-N148 PolarHBondContact O-N 3.13Å
145V96.6Very high96.9Very high57 Ų5736.9 Ų36.935%0.34519%0.191SC..Hα-helixtrans-67.6-49.9-178171.50000111.3W141 G142 N148 L149 I268W141-V145 WeakPolarHBondContact O-CB 3.3Å; W141-V145 WeakPolarHBondContact O-CG2 3.38Å; W141-V145 PolarHBondContact O-N 3.46Å; G142-V145 PolarHBondContact O-N 3.46Å; V145-N148 PolarHBondContact O-N 3.2Å; V145-L149 PolarHBondContact O-N 3.23Å; V145-I268 HydrophobicContact CG2-CD1 4.23Å; V145-I268 HydrophobicContact CG2-CG2 4.32Å
146I95.7Very high96.9Very high49 Ų4941.2 Ų41.225%0.25121%0.214SC..Hα-helixtrans-68.8-44.2-173-63.5-61.4000111.6F128 G142 N148 L149F128-I146 HydrophobicContact CD2-CG2 4.38Å; F128-I146 HydrophobicContact CE2-CB 3.75Å; F128-I146 HydrophobicContact CE2-CG1 4.09Å; F128-I146 HydrophobicContact CE2-CG2 3.74Å; F128-I146 HydrophobicContact CZ-CB 3.99Å; F128-I146 HydrophobicContact CZ-CG2 3.9Å; G142-I146 WeakPolarHBondContact O-CB 3.25Å; G142-I146 VanDerWaalsContact O-CG1 3.26Å; G142-I146 WeakPolarHBondContact O-CG1 3.47Å; G142-I146 PolarHBondContact O-N 3.39Å; I146-N148 VanDerWaalsContact C-N 3.35Å; I146-N148 PolarHBondContact O-N 3.36Å; I146-L149 HydrophobicContact CD1-CD1 4.24Å; I146-L149 WeakPolarHBondContact O-CB 3.47Å; I146-L149 WeakPolarHBondContact O-CG 3.44Å; I146-L149 PolarHBondContact O-N 3.48Å
147T97.2Very high96.8Very high9 Ų941.3 Ų41.36%0.05521%0.214CC..Hα-helixtrans-68.3-35.3178.755.30000112.1F128 A143 L149 L150 V161 I164 W165 F178F128-T147 HydrophobicContact CE1-CG2 4.23Å; F128-T147 HydrophobicContact CZ-CG2 4.1Å; A143-T147 WeakPolarHBondContact O-CB 3.34Å; A143-T147 WeakPolarHBondContact O-CG2 3.21Å; A143-T147 PolarHBondContact O-N 3.2Å; A143-T147 PolarHBondContact O-OG1 3.45Å; T147-L149 PolarHBondContact O-N 2.9Å; T147-L149 VanDerWaalsContact O-N 3.13Å; T147-L150 WeakPolarHBondContact O-CB 3.44Å; T147-L150 PolarHBondContact O-N 3.34Å; T147-L150 VanDerWaalsContact O-N 3.12Å; T147-V161 WeakPolarHBondContact O-CG2 3.41Å; T147-I164 HydrophobicContact CG2-CG2 4.42Å; T147-W165 PolarHBondContact OG1-NE1 2.88Å; T147-F178 HydrophobicContact CG2-CZ 4.03Å
148N97.1Very high96.8Very high63 Ų6344.5 Ų44.534%0.33724%0.235SC..G310 helixtrans-69.8-4.6175.8-169.335.8000113.7T144 V145 I146 L150 S151 W165 K287T144-N148 WeakPolarHBondContact O-CB 3.45Å; T144-N148 PolarHBondContact O-N 3.13Å; V145-N148 PolarHBondContact O-N 3.2Å; I146-N148 VanDerWaalsContact C-N 3.35Å; I146-N148 PolarHBondContact O-N 3.36Å; N148-L150 PolarHBondContact O-N 3.42Å; N148-S151 PolarHBondContact O-N 3.45Å; N148-S151 PolarHBondContact O-OG 3.11Å; N148-S151 PolarHBondContact OD1-OG 2.57Å; N148-W165 HydrophobicContact CB-CH2 4.28Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; N148-K287 WeakPolarHBondContact O-CE 3.3Å; N148-K287 PolarHBondContact O-NZ 3.04Å
149L95.2Very high96.8Very high25 Ų2549.4 Ų49.413%0.13126%0.261CS..G310 helixtrans-62.5-31.9167.5-66.7179.9000111.6V145 I146 T147 S151 A152 L281 V291V145-L149 PolarHBondContact O-N 3.23Å; I146-L149 HydrophobicContact CD1-CD1 4.24Å; I146-L149 WeakPolarHBondContact O-CB 3.47Å; I146-L149 WeakPolarHBondContact O-CG 3.44Å; I146-L149 PolarHBondContact O-N 3.48Å; T147-L149 PolarHBondContact O-N 2.9Å; T147-L149 VanDerWaalsContact O-N 3.13Å; L149-S151 PolarHBondContact O-N 3.1Å; L149-A152 VanDerWaalsContact O-CB 3.23Å; L149-A152 WeakPolarHBondContact O-CB 3.49Å; L149-A152 PolarHBondContact O-N 3.39Å; L149-L281 HydrophobicContact CD1-CD1 4.32Å; L149-L281 HydrophobicContact CD1-CD2 3.69Å; L149-L281 HydrophobicContact CD2-CD1 4.22Å; L149-L281 HydrophobicContact CD2-CD2 4.15Å; L149-V291 HydrophobicContact CB-CG2 3.74Å; L149-V291 HydrophobicContact CD2-CG2 4.03Å; L149-V291 HydrophobicContact CG-CG2 4.31Å
150L94.9Very high96.9Very high56 Ų5652 Ų5229%0.29327%0.274SS..G310 helixtrans-65.9-20.8179.4-65172.6000113.3T147 N148 A152 I153 G157 L160 V161 I164T147-L150 WeakPolarHBondContact O-CB 3.44Å; T147-L150 PolarHBondContact O-N 3.34Å; T147-L150 VanDerWaalsContact O-N 3.12Å; N148-L150 PolarHBondContact O-N 3.42Å; L150-A152 PolarHBondContact O-N 2.98Å; L150-A152 VanDerWaalsContact O-N 3.11Å; L150-I153 HydrophobicContact CD2-CD1 4.07Å; L150-I153 WeakPolarHBondContact O-CB 3.39Å; L150-I153 WeakPolarHBondContact O-CG1 3.33Å; L150-I153 PolarHBondContact O-N 3.32Å; L150-G157 VanDerWaalsContact O-CA 3.32Å; L150-G157 WeakPolarHBondContact O-CA 3.46Å; L150-L160 HydrophobicContact CB-CD2 4.25Å; L150-L160 HydrophobicContact CD1-CD2 4.21Å; L150-L160 HydrophobicContact CD2-CD2 4.48Å; L150-V161 HydrophobicContact CB-CG2 3.81Å; L150-I164 HydrophobicContact CD1-CD1 3.29Å
151S96.7Very high96.9Very high30 Ų3051.6 Ų51.621%0.2127%0.273CS..G310 helixtrans-68.4-6.9173.665.20000113.6N148 L149 K287N148-S151 PolarHBondContact O-N 3.45Å; N148-S151 PolarHBondContact O-OG 3.11Å; N148-S151 PolarHBondContact OD1-OG 2.57Å; L149-S151 PolarHBondContact O-N 3.1Å; S151-K287 PolarHBondContact OG-NZ 2.91Å
152A96.2Very high96.9Very high17 Ų1753.9 Ų53.914%0.1429%0.285CS..G310 helixtrans-72.4-16.4169.500000113.4L149 L150 P154 K287 L288 V291L149-A152 VanDerWaalsContact O-CB 3.23Å; L149-A152 WeakPolarHBondContact O-CB 3.49Å; L149-A152 PolarHBondContact O-N 3.39Å; L150-A152 PolarHBondContact O-N 2.98Å; L150-A152 VanDerWaalsContact O-N 3.11Å; A152-P154 WeakPolarHBondContact O-CD 3.4Å; A152-K287 HydrophobicContact CB-CD 3.99Å; A152-K287 HydrophobicContact CB-CG 3.91Å; A152-L288 HydrophobicContact CB-CB 4.26Å; A152-L288 HydrophobicContact CB-CD1 4.36Å; A152-V291 HydrophobicContact CB-CG2 4.33Å
153I96.8Very high97Very high59 Ų5962.4 Ų62.430%0.30332%0.315SS..SBendtrans-68.6122.6178.7-61171000108.9L150 I156 G157 L160L150-I153 HydrophobicContact CD2-CD1 4.07Å; L150-I153 WeakPolarHBondContact O-CB 3.39Å; L150-I153 WeakPolarHBondContact O-CG1 3.33Å; L150-I153 PolarHBondContact O-N 3.32Å; I153-I156 HydrophobicContact CG2-CD1 4.17Å; I153-I156 HydrophobicContact CG2-CG1 3.68Å; I153-G157 VanDerWaalsContact O-CA 3.32Å; I153-G157 WeakPolarHBondContact O-CA 3.34Å; I153-G157 PolarHBondContact O-N 3.25Å; I153-L160 HydrophobicContact CD1-CD2 4.06Å
154P96.4Very high97Very high73 Ų7364 Ų6447%0.47432%0.322SS..THydrogen-bonded Turntrans-57.9144.3179.3-25.234.9000112.5A152 I156 L288A152-P154 WeakPolarHBondContact O-CD 3.4Å; P154-I156 PolarHBondContact O-N 2.86Å; P154-L288 HydrophobicContact CG-CD2 4.46Å
155Y96.4Very high97Very high225 Ų22563.6 Ų63.688%0.88232%0.318SS*.THydrogen-bonded Turntrans68.6-51.2176.9-46.4-70.2000115.9
156I97.8Very high97.1Very high103 Ų10362.6 Ų62.653%0.52832%0.319SS..THydrogen-bonded Turntrans-105.6-6.3-170.862.7169.6000114.3I153 P154 T158 D159 L160I153-I156 HydrophobicContact CG2-CD1 4.17Å; I153-I156 HydrophobicContact CG2-CG1 3.68Å; P154-I156 PolarHBondContact O-N 2.86Å; I156-T158 PolarHBondContact O-N 2.92Å; I156-D159 PolarHBondContact O-N 3.39Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 2.95Å
157G97.4Very high97.1Very high1 Ų161.7 Ų61.71%0.0132%0.321CS..Hα-helixtrans-63.2-42.2-168.300000114.3L150 I153 L160 V161L150-G157 VanDerWaalsContact O-CA 3.32Å; L150-G157 WeakPolarHBondContact O-CA 3.46Å; I153-G157 VanDerWaalsContact O-CA 3.32Å; I153-G157 WeakPolarHBondContact O-CA 3.34Å; I153-G157 PolarHBondContact O-N 3.25Å; G157-L160 PolarHBondContact O-N 3.43Å; G157-V161 WeakPolarHBondContact O-CG2 3.2Å; G157-V161 PolarHBondContact O-N 3.26Å; G157-V161 VanDerWaalsContact O-N 3.11Å
158T97.1Very high97.1Very high80 Ų8070.7 Ų70.749%0.49136%0.356SS..Hα-helixtrans-65.2-44.1179.4470000111.8I156 L160 V161 Q162I156-T158 PolarHBondContact O-N 2.92Å; T158-L160 VanDerWaalsContact C-N 3.33Å; T158-L160 PolarHBondContact O-N 3.33Å; T158-V161 PolarHBondContact O-N 3.48Å; T158-Q162 PolarHBondContact O-N 2.72Å
159D98.1Very high97.1Very high104 Ų10470.8 Ų70.856%0.55636%0.362SS*.Hα-helixtrans-66.4-39.3-179.6-60.4-9.3000110.4I156 V161 Q162 W163I156-D159 PolarHBondContact O-N 3.39Å; D159-V161 PolarHBondContact O-N 3.29Å; D159-Q162 PolarHBondContact O-N 2.94Å; D159-W163 WeakPolarHBondContact O-CB 3.29Å; D159-W163 PolarHBondContact O-N 3.38Å
160L97.9Very high97.2Very high54 Ų5469.8 Ų69.828%0.28336%0.356SS..Hα-helixtrans-62.3-43.1175.6-176.664000112L150 I153 I156 G157 T158 W163 I164L150-L160 HydrophobicContact CB-CD2 4.25Å; L150-L160 HydrophobicContact CD1-CD2 4.21Å; L150-L160 HydrophobicContact CD2-CD2 4.48Å; I153-L160 HydrophobicContact CD1-CD2 4.06Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 2.95Å; G157-L160 PolarHBondContact O-N 3.43Å; T158-L160 VanDerWaalsContact C-N 3.33Å; T158-L160 PolarHBondContact O-N 3.33Å; L160-W163 HydrophobicContact CD1-CE3 4.19Å; L160-W163 PolarHBondContact O-N 3.42Å; L160-I164 HydrophobicContact CD1-CD1 4.36Å; L160-I164 HydrophobicContact CG-CD1 4.14Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.35Å; L160-I164 PolarHBondContact O-N 2.95Å
161V98.2Very high97.3Very high4 Ų471 Ų712%0.02436%0.363CS..Hα-helixtrans-63.9-49.2177.8170.40000110.9T147 L150 G157 T158 D159 W163 I164 W165T147-V161 WeakPolarHBondContact O-CG2 3.41Å; L150-V161 HydrophobicContact CB-CG2 3.81Å; G157-V161 WeakPolarHBondContact O-CG2 3.2Å; G157-V161 PolarHBondContact O-N 3.26Å; G157-V161 VanDerWaalsContact O-N 3.11Å; T158-V161 PolarHBondContact O-N 3.48Å; D159-V161 PolarHBondContact O-N 3.29Å; V161-W163 VanDerWaalsContact C-N 3.28Å; V161-W163 PolarHBondContact O-N 3.46Å; V161-I164 PolarHBondContact O-N 3.33Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.69Å; V161-W165 HydrophobicContact CG1-CG 4.47Å; V161-W165 HydrophobicContact CG1-CH2 3.47Å; V161-W165 VanDerWaalsContact CG1-CH2 3.47Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.61Å; V161-W165 PolarHBondContact O-N 3.35Å
162Q98.1Very high97.3Very high82 Ų8270.7 Ų70.738%0.38336%0.361SS..Hα-helixtrans-63.7-35.5178.2-69.7-179-2.300112.1T158 D159 W165 G166 G167T158-Q162 PolarHBondContact O-N 2.72Å; D159-Q162 PolarHBondContact O-N 2.94Å; Q162-W165 PolarHBondContact O-N 2.84Å; Q162-G166 WeakPolarHBondContact O-CA 3.48Å; Q162-G166 PolarHBondContact O-N 3.18Å; Q162-G167 WeakPolarHBondContact CA-O 3.44Å; Q162-G167 PolarHBondContact O-N 2.88Å
163W98.3Very high97.4Very high189 Ų18972.8 Ų72.872%0.71637%0.373SS*.Hα-helixtrans-63.9-44.7173.4-179.579.1000111.7D159 L160 V161 W165 G166 R177D159-W163 WeakPolarHBondContact O-CB 3.29Å; D159-W163 PolarHBondContact O-N 3.38Å; L160-W163 HydrophobicContact CD1-CE3 4.19Å; L160-W163 PolarHBondContact O-N 3.42Å; V161-W163 VanDerWaalsContact C-N 3.28Å; V161-W163 PolarHBondContact O-N 3.46Å; W163-W165 VanDerWaalsContact C-N 3.34Å; W163-W165 PolarHBondContact O-N 3.29Å; W163-G166 PolarHBondContact O-N 2.92Å; W163-R177 PolarHBondContact O-NH1 2.9Å
164I97.5Very high97.5Very high34 Ų3470 Ų7017%0.17436%0.359CS..Hα-helixtrans-63.4-39.1175.2-71.8168.2000111.2T147 L150 L160 V161 R177 F178T147-I164 HydrophobicContact CG2-CG2 4.42Å; L150-I164 HydrophobicContact CD1-CD1 3.29Å; L160-I164 HydrophobicContact CD1-CD1 4.36Å; L160-I164 HydrophobicContact CG-CD1 4.14Å; L160-I164 VanDerWaalsContact O-CG1 3.29Å; L160-I164 WeakPolarHBondContact O-CG1 3.35Å; L160-I164 PolarHBondContact O-N 2.95Å; V161-I164 PolarHBondContact O-N 3.33Å; I164-R177 WeakPolarHBondContact O-CD 3.43Å; I164-R177 PolarHBondContact O-NE 3.05Å; I164-R177 PolarHBondContact O-NH1 3.5Å; I164-F178 HydrophobicContact CG2-CE1 4.22Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å
165W98.4Very high97.6Very high21 Ų2166.5 Ų66.58%0.0834%0.336CS..Hα-helixtrans-73.4-33.1177.7-66.5-16.2000112.6T147 N148 V161 Q162 W163 G167 Y168 V170 T174T147-W165 PolarHBondContact OG1-NE1 2.88Å; N148-W165 HydrophobicContact CB-CH2 4.28Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.69Å; V161-W165 HydrophobicContact CG1-CG 4.47Å; V161-W165 HydrophobicContact CG1-CH2 3.47Å; V161-W165 VanDerWaalsContact CG1-CH2 3.47Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.61Å; V161-W165 PolarHBondContact O-N 3.35Å; Q162-W165 PolarHBondContact O-N 2.84Å; W163-W165 VanDerWaalsContact C-N 3.34Å; W163-W165 PolarHBondContact O-N 3.29Å; W165-G167 VanDerWaalsContact C-N 3.31Å; W165-Y168 VanDerWaalsContact CZ3-O 3.27Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.39Å; W165-V170 HydrophobicContact CD2-CG2 4.39Å; W165-V170 HydrophobicContact CG-CG2 4.36Å; W165-V170 HydrophobicContact CZ2-CG2 4.34Å; W165-T174 WeakPolarHBondContact CA-OG1 3.49Å; W165-T174 PolarHBondContact O-N 3.05Å; W165-T174 PolarHBondContact O-OG1 2.95Å
166G97.5Very high97.7Very high37 Ų3758.7 Ų58.738%0.38131%0.312SS..THydrogen-bonded Turntrans73.826.5-169.100000113Q162 W163Q162-G166 WeakPolarHBondContact O-CA 3.48Å; Q162-G166 PolarHBondContact O-N 3.18Å; W163-G166 PolarHBondContact O-N 2.92Å
167G96.4Very high97.7Very high29 Ų2957.1 Ų57.130%0.29930%0.299SS..SBendtrans172.7-166.7-171.600000110.9Q162 W165Q162-G167 WeakPolarHBondContact CA-O 3.44Å; Q162-G167 PolarHBondContact O-N 2.88Å; W165-G167 VanDerWaalsContact C-N 3.31Å
168Y97.1Very high97.7Very high199 Ų19957.5 Ų57.578%0.7830%0.301SS*.SBendtrans-89.8-10.9-176.7-59.6-71.4000114.1W165W165-Y168 VanDerWaalsContact CZ3-O 3.27Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.39Å
169S96.5Very high97.8Very high65 Ų6555.8 Ų55.846%0.45529%0.287SS..SBendtrans-150.1168.1177.457.10000109.9D171S169-D171 PolarHBondContact O-N 2.82Å
170V97.8Very high97.9Very high3 Ų354.8 Ų54.82%0.01828%0.284CS..SBendtrans-61.7123.6166.9175.20000108.7W135 F140 A143 W165 T174W135-V170 HydrophobicContact CH2-CG1 3.68Å; W135-V170 HydrophobicContact CZ3-CG1 4.02Å; F140-V170 HydrophobicContact CD2-CG1 4.09Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.12Å; F140-V170 VanDerWaalsContact CE2-O 3.3Å; F140-V170 WeakPolarHBondContact CE2-O 3.48Å; A143-V170 HydrophobicContact CB-CG1 4.21Å; A143-V170 HydrophobicContact CB-CG2 4.28Å; W165-V170 HydrophobicContact CD2-CG2 4.39Å; W165-V170 HydrophobicContact CG-CG2 4.36Å; W165-V170 HydrophobicContact CZ2-CG2 4.34Å; V170-T174 HydrophobicContact CG1-CG2 4.21Å
171D97.1Very high97.9Very high82 Ų8257.3 Ų57.344%0.43929%0.293SS..SBendtrans-158.6-170.2-178.6-162.12.1000110.7S169 P173 T174 L175S169-D171 PolarHBondContact O-N 2.82Å; D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; D171-T174 PolarHBondContact N-OG1 3.18Å; D171-T174 WeakPolarHBondContact O-CA 3.47Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.2Å; D171-T174 PolarHBondContact O-N 2.8Å; D171-L175 PolarHBondContact O-N 3.47Å
172S97.1Very high97.9Very high24 Ų2458.4 Ų58.417%0.16830%0.298CS..Hα-helixtrans-43.6-47.2178.7-82.40000114.1D58 A59 T174 L175 T176D58-S172 PolarHBondContact OD2-OG 3.5Å; A59-S172 VanDerWaalsContact CB-OG 3.24Å; A59-S172 WeakPolarHBondContact CB-OG 3.34Å; A59-S172 PolarHBondContact N-OG 2.85Å; S172-T174 PolarHBondContact O-N 3.12Å; S172-L175 PolarHBondContact O-N 3.4Å; S172-L175 VanDerWaalsContact O-N 3.09Å; S172-T176 PolarHBondContact O-N 3.05Å; S172-T176 PolarHBondContact O-OG1 3.44Å; S172-T176 VanDerWaalsContact O-OG1 3.11Å
173P98.1Very high98Very high60 Ų6058.3 Ų58.339%0.3930%0.297SS..Hα-helixtrans-58.6-34.9177.1-25.135.2000113.6D171 R177D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; P173-R177 WeakPolarHBondContact O-CG 3.42Å; P173-R177 PolarHBondContact O-N 3.25Å; P173-R177 PolarHBondContact O-NE 3.3Å
174T98.1Very high98Very high0 Ų053.1 Ų53.10%028%0.282CS..Hα-helixtrans-71.6-40.4175.6-44.50000111.3W165 V170 D171 S172 R177 F178W165-T174 WeakPolarHBondContact CA-OG1 3.49Å; W165-T174 PolarHBondContact O-N 3.05Å; W165-T174 PolarHBondContact O-OG1 2.95Å; V170-T174 HydrophobicContact CG1-CG2 4.21Å; D171-T174 PolarHBondContact N-OG1 3.18Å; D171-T174 WeakPolarHBondContact O-CA 3.47Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.2Å; D171-T174 PolarHBondContact O-N 2.8Å; S172-T174 PolarHBondContact O-N 3.12Å; T174-R177 WeakPolarHBondContact O-CG 3.47Å; T174-F178 HydrophobicContact CG2-CD1 4.31Å; T174-F178 HydrophobicContact CG2-CD2 4.43Å; T174-F178 HydrophobicContact CG2-CE1 4.03Å; T174-F178 HydrophobicContact CG2-CE2 4.18Å; T174-F178 HydrophobicContact CG2-CG 4.49Å; T174-F178 HydrophobicContact CG2-CZ 3.97Å; T174-F178 WeakPolarHBondContact O-CB 3.41Å; T174-F178 WeakPolarHBondContact O-CG 3.4Å; T174-F178 PolarHBondContact O-N 3.21Å
175L98.1Very high98Very high0 Ų053 Ų530%028%0.281CS..Hα-helixtrans-66.5-46.1-179.7-174.255.4000111.9A62 V132 L133 W135 D171 S172 R177 F178 F179A62-L175 HydrophobicContact CB-CD2 3.54Å; V132-L175 HydrophobicContact CG1-CD1 4.39Å; L133-L175 HydrophobicContact CD2-CD1 4.01Å; W135-L175 HydrophobicContact CD2-CD2 3.84Å; W135-L175 HydrophobicContact CE3-CB 4.28Å; W135-L175 HydrophobicContact CE3-CD1 3.63Å; W135-L175 HydrophobicContact CE3-CD2 3.69Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.14Å; W135-L175 HydrophobicContact CZ3-CB 3.81Å; W135-L175 HydrophobicContact CZ3-CD1 3.84Å; W135-L175 HydrophobicContact CZ3-CD2 4.06Å; W135-L175 HydrophobicContact CZ3-CG 4.12Å; D171-L175 PolarHBondContact O-N 3.47Å; S172-L175 PolarHBondContact O-N 3.4Å; S172-L175 VanDerWaalsContact O-N 3.09Å; L175-R177 PolarHBondContact O-N 2.99Å; L175-F178 PolarHBondContact O-N 3.38Å; L175-F179 PolarHBondContact O-N 3.26Å
176T98.4Very high98Very high61 Ų6152.8 Ų52.837%0.37428%0.283SS..Hα-helixtrans-60.1-45.9179.5-51.50000112P57 S172 F179 T180P57-T176 PolarHBondContact O-OG1 2.97Å; S172-T176 PolarHBondContact O-N 3.05Å; S172-T176 PolarHBondContact O-OG1 3.44Å; S172-T176 VanDerWaalsContact O-OG1 3.11Å; T176-F179 PolarHBondContact O-N 3.26Å; T176-T180 PolarHBondContact O-N 3.34Å; T176-T180 PolarHBondContact O-OG1 2.93Å; T176-T180 VanDerWaalsContact O-OG1 3.08Å
177R98.3Very high98.1Very high70 Ų7055.4 Ų55.426%0.26428%0.284SS..Hα-helixtrans-67.4-38.517766.6-174.668-156.1-11.6112.4W163 I164 P173 T174 L175 F179 T180 F181W163-R177 PolarHBondContact O-NH1 2.9Å; I164-R177 WeakPolarHBondContact O-CD 3.43Å; I164-R177 PolarHBondContact O-NE 3.05Å; I164-R177 PolarHBondContact O-NH1 3.5Å; P173-R177 WeakPolarHBondContact O-CG 3.42Å; P173-R177 PolarHBondContact O-N 3.25Å; P173-R177 PolarHBondContact O-NE 3.3Å; T174-R177 WeakPolarHBondContact O-CG 3.47Å; L175-R177 PolarHBondContact O-N 2.99Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 3.48Å; R177-T180 WeakPolarHBondContact O-CB 3.35Å; R177-T180 PolarHBondContact O-N 3.46Å; R177-F181 HydrophobicContact CB-CD2 4.36Å; R177-F181 HydrophobicContact CB-CE2 4.29Å; R177-F181 WeakPolarHBondContact O-CD2 3.49Å; R177-F181 PolarHBondContact O-N 3.07Å
178F98.6Very high98.2Very high10 Ų1057.7 Ų57.74%0.04429%0.288CS..Hα-helixtrans-65.9-37.2178.5-83.216000110.5F128 M129 V132 L133 T147 I164 T174 L175 F181 H182F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.21Å; F128-F178 HydrophobicContact CZ-CE2 4.48Å; M129-F178 HydrophobicContact CB-CB 4.28Å; M129-F178 HydrophobicContact CB-CD2 4.41Å; M129-F178 HydrophobicContact CB-CG 4.36Å; M129-F178 HydrophobicContact CG-CB 4.3Å; M129-F178 HydrophobicContact CG-CD1 4.17Å; M129-F178 HydrophobicContact CG-CD2 4Å; M129-F178 HydrophobicContact CG-CE2 4.36Å; M129-F178 HydrophobicContact CG-CG 3.91Å; M129-F178 HydrophobicContact SD-CD1 4.18Å; M129-F178 HydrophobicContact SD-CG 4.39Å; V132-F178 HydrophobicContact CB-CD2 3.94Å; V132-F178 HydrophobicContact CG1-CD2 3.98Å; V132-F178 HydrophobicContact CG2-CD2 3.88Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å; L133-F178 HydrophobicContact CD2-CB 4.47Å; T147-F178 HydrophobicContact CG2-CZ 4.03Å; I164-F178 HydrophobicContact CG2-CE1 4.22Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å; T174-F178 HydrophobicContact CG2-CD1 4.31Å; T174-F178 HydrophobicContact CG2-CD2 4.43Å; T174-F178 HydrophobicContact CG2-CE1 4.03Å; T174-F178 HydrophobicContact CG2-CE2 4.18Å; T174-F178 HydrophobicContact CG2-CG 4.49Å; T174-F178 HydrophobicContact CG2-CZ 3.97Å; T174-F178 WeakPolarHBondContact O-CB 3.41Å; T174-F178 WeakPolarHBondContact O-CG 3.4Å; T174-F178 PolarHBondContact O-N 3.21Å; L175-F178 PolarHBondContact O-N 3.38Å; F178-F181 PolarHBondContact O-N 3.3Å; F178-H182 WeakPolarHBondContact O-CB 3.46Å; F178-H182 PolarHBondContact O-N 3.19Å
179F98.8Very high98.3Very high44 Ų4448.6 Ų48.619%0.19325%0.253CS..Hα-helixtrans-59.9-48.6169.3175-108.6000111.7A52 Y55 P57 L133 L175 T176 R177 F181 H182 F183A52-F179 HydrophobicContact CB-CE2 4.22Å; A52-F179 HydrophobicContact CB-CZ 4.11Å; Y55-F179 AromaticContact CD1-CD2 3.65Å; Y55-F179 HydrophobicContact CD1-CD2 3.65Å; Y55-F179 AromaticContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CE2 3.67Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.37Å; Y55-F179 HydrophobicContact CE1-CB 4.35Å; Y55-F179 AromaticContact CE1-CD2 3.63Å; Y55-F179 HydrophobicContact CE1-CD2 3.63Å; Y55-F179 HydrophobicContact CE1-CE2 4.16Å; Y55-F179 HydrophobicContact CE1-CG 4.06Å; P57-F179 HydrophobicContact CB-CB 3.79Å; P57-F179 HydrophobicContact CB-CD1 3.99Å; P57-F179 HydrophobicContact CB-CG 3.92Å; P57-F179 HydrophobicContact CG-CD1 3.94Å; P57-F179 HydrophobicContact CG-CE1 4.45Å; P57-F179 HydrophobicContact CG-CG 4.37Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.91Å; L175-F179 PolarHBondContact O-N 3.26Å; T176-F179 PolarHBondContact O-N 3.26Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 3.48Å; F179-F181 PolarHBondContact O-N 3.12Å; F179-H182 PolarHBondContact O-N 2.9Å; F179-F183 HydrophobicContact CZ-CD2 4.32Å; F179-F183 WeakPolarHBondContact O-CB 3.44Å; F179-F183 PolarHBondContact O-N 3.04Å
180T98.7Very high98.4Very high82 Ų8247.3 Ų47.350%0.50325%0.247SC..Hα-helixtrans-58.5-46.9177.9-53.60000112.3T176 R177 F183 I184T176-T180 PolarHBondContact O-N 3.34Å; T176-T180 PolarHBondContact O-OG1 2.93Å; T176-T180 VanDerWaalsContact O-OG1 3.08Å; R177-T180 WeakPolarHBondContact O-CB 3.35Å; R177-T180 PolarHBondContact O-N 3.46Å; T180-F183 PolarHBondContact O-N 3.07Å; T180-I184 WeakPolarHBondContact O-CG2 3.16Å; T180-I184 PolarHBondContact O-N 3.45Å; T180-I184 VanDerWaalsContact O-N 3.11Å
181F98.7Very high98.5Very high108 Ų10850.2 Ų50.247%0.47427%0.271SS..Hα-helixtrans-68.1-42178.7-74.8-58.3000112.5M129 R177 F178 F179 F183 I184 L185M129-F181 HydrophobicContact CE-CB 4Å; M129-F181 HydrophobicContact SD-CB 3.46Å; M129-F181 WeakPolarHBondContact SD-CB 3.35Å; M129-F181 HydrophobicContact SD-CG 4.32Å; R177-F181 HydrophobicContact CB-CD2 4.36Å; R177-F181 HydrophobicContact CB-CE2 4.29Å; R177-F181 WeakPolarHBondContact O-CD2 3.49Å; R177-F181 PolarHBondContact O-N 3.07Å; F178-F181 PolarHBondContact O-N 3.3Å; F179-F181 PolarHBondContact O-N 3.12Å; F181-F183 PolarHBondContact O-N 3.44Å; F181-I184 WeakPolarHBondContact O-CG2 3.28Å; F181-I184 PolarHBondContact O-N 3.36Å; F181-L185 WeakPolarHBondContact O-CB 3.42Å; F181-L185 VanDerWaalsContact O-CG 3.29Å; F181-L185 WeakPolarHBondContact O-CG 3.49Å; F181-L185 PolarHBondContact O-N 3.11Å
182H98.8Very high98.5Very high27 Ų2748 Ų4813%0.12526%0.259CS..Hα-helixtrans-61.3-34.3174.5-179.972.3000112H83 T126 M129 G130 L133 F178 F179 P186H83-H182 AromaticContact NE2-NE2 3.96Å; T126-H182 PolarHBondContact O-CE1 2.89Å; T126-H182 PolarHBondContact O-ND1 3.46Å; M129-H182 HydrophobicContact CB-CB 4.1Å; G130-H182 WeakPolarHBondContact CA-CE1 3.3Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.33Å; G130-H182 PolarHBondContact N-ND1 3.34Å; L133-H182 HydrophobicContact CD1-CB 4.29Å; F178-H182 WeakPolarHBondContact O-CB 3.46Å; F178-H182 PolarHBondContact O-N 3.19Å; F179-H182 PolarHBondContact O-N 2.9Å; H182-P186 WeakPolarHBondContact O-CD 3.38Å; H182-P186 WeakPolarHBondContact O-CG 3.37Å
183F98.8Very high98.6Very high80 Ų8048.2 Ų48.235%0.35126%0.262SS..Hα-helixtrans-72.3-43.2177.5-166.8-83.9000112.5L49 A52 F179 T180 F181 F187L49-F183 HydrophobicContact CD1-CE2 4.28Å; L49-F183 HydrophobicContact CD1-CZ 4.07Å; A52-F183 HydrophobicContact CB-CD2 4.26Å; A52-F183 HydrophobicContact CB-CE2 3.95Å; F179-F183 HydrophobicContact CZ-CD2 4.32Å; F179-F183 WeakPolarHBondContact O-CB 3.44Å; F179-F183 PolarHBondContact O-N 3.04Å; T180-F183 PolarHBondContact O-N 3.07Å; F181-F183 PolarHBondContact O-N 3.44Å; F183-F187 HydrophobicContact CD1-CE2 4.08Å; F183-F187 AromaticContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CZ 4.45Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.35Å; F183-F187 VanDerWaalsContact O-CE2 3.24Å; F183-F187 WeakPolarHBondContact O-CE2 3.44Å
184I98.8Very high98.6Very high80 Ų8048.4 Ų48.441%0.4127%0.269SS..Hα-helixtrans-78.8-35.1-175.7-169.360.6000113.5T180 F181 F187 I188T180-I184 WeakPolarHBondContact O-CG2 3.16Å; T180-I184 PolarHBondContact O-N 3.45Å; T180-I184 VanDerWaalsContact O-N 3.11Å; F181-I184 WeakPolarHBondContact O-CG2 3.28Å; F181-I184 PolarHBondContact O-N 3.36Å; I184-F187 PolarHBondContact O-N 3.46Å; I184-F187 VanDerWaalsContact O-N 3.12Å; I184-I188 HydrophobicContact CG1-CD1 4.2Å; I184-I188 PolarHBondContact O-N 3.32Å
185L98.7Very high98.6Very high31 Ų3151.9 Ų51.916%0.16229%0.287CS..Hα-helixtrans-60.2-39.5-174.1-81170.9000115A125 T126 M129 F181 F187 I188 I189A125-L185 HydrophobicContact CB-CD1 4.3Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 VanDerWaalsContact OG1-CB 3.23Å; T126-L185 WeakPolarHBondContact OG1-CB 3.27Å; M129-L185 HydrophobicContact CE-CD1 3.23Å; F181-L185 WeakPolarHBondContact O-CB 3.42Å; F181-L185 VanDerWaalsContact O-CG 3.29Å; F181-L185 WeakPolarHBondContact O-CG 3.49Å; F181-L185 PolarHBondContact O-N 3.11Å; L185-F187 PolarHBondContact O-N 3.12Å; L185-I188 HydrophobicContact CD2-CD1 4.18Å; L185-I188 CarbonylContact O-C 3.5Å; L185-I188 WeakPolarHBondContact O-CA 3.25Å; L185-I188 WeakPolarHBondContact O-CB 3.45Å; L185-I188 PolarHBondContact O-N 3.45Å; L185-I189 WeakPolarHBondContact O-CG1 3.28Å; L185-I189 PolarHBondContact O-N 3.04Å
186P98.8Very high98.7Very high16 Ų1653.2 Ų53.210%0.10429%0.293CS..Hα-helixtrans-54.1-34.8174.1-29.134.9000113.9L41 I45 T126 H182 I189 A190L41-P186 HydrophobicContact CD1-CB 4.49Å; I45-P186 HydrophobicContact CD1-CB 4.21Å; I45-P186 HydrophobicContact CG1-CB 3.69Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; H182-P186 WeakPolarHBondContact O-CD 3.38Å; H182-P186 WeakPolarHBondContact O-CG 3.37Å; P186-I189 PolarHBondContact O-N 2.98Å; P186-A190 PolarHBondContact O-N 2.87Å
187F98.7Very high98.7Very high92 Ų9254.4 Ų54.440%0.40430%0.297SS..Hα-helixtrans-74.3-35.7176.3-58.4-76.5000112.1I45 F183 I184 L185 I189 A190 A191I45-F187 HydrophobicContact CG2-CE1 4.03Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å; F183-F187 HydrophobicContact CD1-CE2 4.08Å; F183-F187 AromaticContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CZ 4.45Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.35Å; F183-F187 VanDerWaalsContact O-CE2 3.24Å; F183-F187 WeakPolarHBondContact O-CE2 3.44Å; I184-F187 PolarHBondContact O-N 3.46Å; I184-F187 VanDerWaalsContact O-N 3.12Å; L185-F187 PolarHBondContact O-N 3.12Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.26Å; F187-A190 PolarHBondContact O-N 3.2Å; F187-A191 PolarHBondContact O-N 3.22Å; F187-A191 VanDerWaalsContact O-N 3.09Å
188I98.8Very high98.6Very high77 Ų7755.4 Ų55.440%0.39531%0.307SS..Hα-helixtrans-64.3-42.1171.2-64169.2000110I184 L185 A190 A191 L192I184-I188 HydrophobicContact CG1-CD1 4.2Å; I184-I188 PolarHBondContact O-N 3.32Å; L185-I188 HydrophobicContact CD2-CD1 4.18Å; L185-I188 CarbonylContact O-C 3.5Å; L185-I188 WeakPolarHBondContact O-CA 3.25Å; L185-I188 WeakPolarHBondContact O-CB 3.45Å; L185-I188 PolarHBondContact O-N 3.45Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.96Å; I188-A191 PolarHBondContact O-N 3.44Å; I188-L192 HydrophobicContact CG2-CD1 4.05Å; I188-L192 HydrophobicContact CG2-CG 4.41Å; I188-L192 WeakPolarHBondContact O-CG 3.26Å; I188-L192 PolarHBondContact O-N 2.6Å
189I98.9Very high98.6Very high8 Ų858.1 Ų58.14%0.04132%0.319CS..Hα-helixtrans-60.1-41.4174.4-68.7167000110.4L41 L119 A122 T126 L185 P186 F187 A191 L192 A193L41-I189 HydrophobicContact CD1-CB 4.35Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 4Å; L119-I189 HydrophobicContact CD2-CG2 3.83Å; A122-I189 HydrophobicContact CB-CD1 4.15Å; A122-I189 HydrophobicContact CB-CG1 3.72Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.2Å; L185-I189 WeakPolarHBondContact O-CG1 3.28Å; L185-I189 PolarHBondContact O-N 3.04Å; P186-I189 PolarHBondContact O-N 2.98Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 2.83Å; I189-L192 PolarHBondContact O-N 2.87Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.27Å; I189-A193 PolarHBondContact O-N 3.02Å
190A98.8Very high98.5Very high39 Ų3957.7 Ų57.732%0.32232%0.318SS..Hα-helixtrans-61.3-42.4175.600000112.3L41 P186 F187 I188 A193 A194L41-A190 HydrophobicContact CD2-CB 3.94Å; P186-A190 PolarHBondContact O-N 2.87Å; F187-A190 WeakPolarHBondContact O-CB 3.26Å; F187-A190 PolarHBondContact O-N 3.2Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.96Å; A190-A193 PolarHBondContact O-N 3.13Å; A190-A194 PolarHBondContact O-N 3.13Å
191A98.8Very high98.4Very high64 Ų6457.1 Ų57.153%0.52931%0.31SS..Hα-helixtrans-65.2-43.4175.200000112.1F187 I188 I189 A193 A194 L195F187-A191 PolarHBondContact O-N 3.22Å; F187-A191 VanDerWaalsContact O-N 3.09Å; I188-A191 PolarHBondContact O-N 3.44Å; I189-A191 PolarHBondContact O-N 2.83Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.11Å; A191-A194 PolarHBondContact O-N 2.76Å; A191-L195 PolarHBondContact O-N 2.75Å
192L98.8Very high98.3Very high35 Ų3559.2 Ų59.218%0.18332%0.321CS..Hα-helixtrans-63.9-35.8175-72.2170.8000112.2I118 L119 I188 I189 L195 H196I118-L192 HydrophobicContact CG2-CD1 3.86Å; I118-L192 HydrophobicContact CG2-CD2 4.31Å; L119-L192 HydrophobicContact CD2-CB 3.54Å; L119-L192 HydrophobicContact CD2-CD1 4.48Å; L119-L192 HydrophobicContact CG-CB 4.06Å; I188-L192 HydrophobicContact CG2-CD1 4.05Å; I188-L192 HydrophobicContact CG2-CG 4.41Å; I188-L192 WeakPolarHBondContact O-CG 3.26Å; I188-L192 PolarHBondContact O-N 2.6Å; I189-L192 PolarHBondContact O-N 2.87Å; L192-L195 PolarHBondContact O-N 3.35Å; L192-H196 WeakPolarHBondContact O-CB 3.39Å; L192-H196 PolarHBondContact O-N 3.28Å
193A98.8Very high98.1Very high29 Ų2961.4 Ų61.424%0.2434%0.336CS..Hα-helixtrans-67.6-38.3176.100000111.6L119 I189 A190 A191 L195 H196 L197L119-A193 HydrophobicContact CD2-CB 4.39Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.27Å; I189-A193 PolarHBondContact O-N 3.02Å; A190-A193 PolarHBondContact O-N 3.13Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.11Å; A193-L195 VanDerWaalsContact C-N 3.35Å; A193-H196 WeakPolarHBondContact O-CB 3.32Å; A193-H196 PolarHBondContact O-N 2.94Å; A193-L197 WeakPolarHBondContact O-CG 3.41Å; A193-L197 PolarHBondContact O-N 3.05Å
194A98.3Very high97.9Very high63 Ų6358.1 Ų58.152%0.52133%0.325SS..Hα-helixtrans-62.5-42.3171.600000111.6A190 A191 L197 L198A190-A194 PolarHBondContact O-N 3.13Å; A191-A194 PolarHBondContact O-N 2.76Å; A194-L197 PolarHBondContact O-N 3.45Å; A194-L198 WeakPolarHBondContact O-CB 3.39Å; A194-L198 PolarHBondContact O-N 3.44Å
195L98.4Very high97.8Very high74 Ų7455.7 Ų55.739%0.38732%0.315SS..Hα-helixtrans-64.7-40.6174.8-172.864.5000112.1I115 A191 L192 A193 L197 L198 F199I115-L195 HydrophobicContact CD1-CD2 3.89Å; I115-L195 HydrophobicContact CD1-CG 3.76Å; I115-L195 HydrophobicContact CG1-CD2 4.48Å; A191-L195 PolarHBondContact O-N 2.75Å; L192-L195 PolarHBondContact O-N 3.35Å; A193-L195 VanDerWaalsContact C-N 3.35Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.5Å; L195-L198 WeakPolarHBondContact O-CB 3.11Å; L195-L198 PolarHBondContact O-N 3.34Å; L195-F199 HydrophobicContact CD1-CD2 4.15Å; L195-F199 HydrophobicContact CD1-CE2 3.7Å; L195-F199 HydrophobicContact CD2-CE2 4.38Å; L195-F199 HydrophobicContact CG-CD2 4.09Å; L195-F199 HydrophobicContact CG-CE2 3.86Å; L195-F199 WeakPolarHBondContact O-CD2 3.16Å; L195-F199 PolarHBondContact O-N 2.92Å; L195-F199 VanDerWaalsContact O-N 3.12Å
196H98.6Very high97.8Very high28 Ų2854.5 Ų54.513%0.1331%0.309CS..Hα-helixtrans-58.5-45.8175.5-17583.2000111.7T112 I115 L119 L192 A193 L200T112-H196 WeakPolarHBondContact CG2-CE1 3.41Å; T112-H196 PolarHBondContact O-CE1 2.88Å; T112-H196 PolarHBondContact O-ND1 3.2Å; I115-H196 HydrophobicContact CB-CB 4.46Å; I115-H196 HydrophobicContact CG2-CB 3.68Å; L119-H196 HydrophobicContact CD1-CB 3.81Å; L192-H196 WeakPolarHBondContact O-CB 3.39Å; L192-H196 PolarHBondContact O-N 3.28Å; A193-H196 WeakPolarHBondContact O-CB 3.32Å; A193-H196 PolarHBondContact O-N 2.94Å; H196-L200 WeakPolarHBondContact O-CB 3.42Å; H196-L200 PolarHBondContact O-N 2.77Å
197L98.1Very high97.8Very high86 Ų8654 Ų5445%0.4531%0.305SS..Hα-helixtrans-67.6-34.7176.1-70.5174.4000112.5A193 A194 L195 L200 H201A193-L197 WeakPolarHBondContact O-CG 3.41Å; A193-L197 PolarHBondContact O-N 3.05Å; A194-L197 PolarHBondContact O-N 3.45Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.5Å; L197-L200 HydrophobicContact CD2-CD2 4.13Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 3.4Å; L197-H201 WeakPolarHBondContact O-CB 3.35Å; L197-H201 PolarHBondContact O-CD2 3.4Å; L197-H201 PolarHBondContact O-N 2.92Å
198L97.5Very high97.8Very high90 Ų9050.2 Ų50.247%0.47129%0.29SS..Hα-helixtrans-58.9-52.9174.9-177.3149.8000110.8A194 L195 L200 H201 E202A194-L198 WeakPolarHBondContact O-CB 3.39Å; A194-L198 PolarHBondContact O-N 3.44Å; L195-L198 WeakPolarHBondContact O-CB 3.11Å; L195-L198 PolarHBondContact O-N 3.34Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 2.96Å; L198-H201 PolarHBondContact O-N 3.32Å; L198-H201 VanDerWaalsContact O-N 3.07Å; L198-E202 PolarHBondContact O-N 3.07Å
199F98.3Very high97.8Very high67 Ų6749.1 Ų49.129%0.29429%0.285SS..Hα-helixtrans-64.5-33.5176.8-76.2-70.2000113.1E111 I115 L195 H201 E202E111-F199 HydrophobicContact CB-CB 4.04Å; E111-F199 HydrophobicContact CB-CD1 3.48Å; E111-F199 VanDerWaalsContact CB-CD1 3.48Å; E111-F199 HydrophobicContact CB-CD2 4.19Å; E111-F199 HydrophobicContact CB-CE1 3.88Å; E111-F199 HydrophobicContact CB-CG 3.65Å; E111-F199 HydrophobicContact CB-CZ 4.36Å; E111-F199 HydrophobicContact CG-CD1 3.88Å; E111-F199 HydrophobicContact CG-CE1 3.86Å; E111-F199 HydrophobicContact CG-CZ 4.46Å; I115-F199 HydrophobicContact CD1-CD2 3.16Å; I115-F199 HydrophobicContact CD1-CE2 3.42Å; I115-F199 VanDerWaalsContact CD1-CE2 3.42Å; I115-F199 HydrophobicContact CD1-CG 4.25Å; L195-F199 HydrophobicContact CD1-CD2 4.15Å; L195-F199 HydrophobicContact CD1-CE2 3.7Å; L195-F199 HydrophobicContact CD2-CE2 4.38Å; L195-F199 HydrophobicContact CG-CD2 4.09Å; L195-F199 HydrophobicContact CG-CE2 3.86Å; L195-F199 WeakPolarHBondContact O-CD2 3.16Å; L195-F199 PolarHBondContact O-N 2.92Å; L195-F199 VanDerWaalsContact O-N 3.12Å; F199-H201 VanDerWaalsContact C-N 3.29Å; F199-H201 PolarHBondContact O-N 3.42Å; F199-E202 PolarHBondContact O-N 3.3Å
200L97.7Very high97.7Very high35 Ų3549.3 Ų49.318%0.18329%0.288CS..Hα-helixtrans-62.8-38172.8178.764.7000111.5T112 H196 L197 L198 E202 T203 G204T112-L200 HydrophobicContact CG2-CB 4.18Å; T112-L200 HydrophobicContact CG2-CD1 4.47Å; T112-L200 PolarHBondContact OG1-N 3.23Å; H196-L200 WeakPolarHBondContact O-CB 3.42Å; H196-L200 PolarHBondContact O-N 2.77Å; L197-L200 HydrophobicContact CD2-CD2 4.13Å; L197-L200 WeakPolarHBondContact O-CB 3.49Å; L197-L200 PolarHBondContact O-N 3.4Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 2.96Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.9Å; L200-T203 PolarHBondContact O-N 2.74Å; L200-T203 PolarHBondContact O-OG1 3.33Å; L200-G204 VanDerWaalsContact O-CA 3.3Å; L200-G204 WeakPolarHBondContact O-CA 3.03Å; L200-G204 PolarHBondContact O-N 3.37Å
201H96.4Very high97.6Very high70 Ų7052.4 Ų52.432%0.32430%0.299SS..Hα-helixtrans-74.3-21.2-178.6-69.1170000113.6L197 L198 F199 T203L197-H201 WeakPolarHBondContact O-CB 3.35Å; L197-H201 PolarHBondContact O-CD2 3.4Å; L197-H201 PolarHBondContact O-N 2.92Å; L198-H201 PolarHBondContact O-N 3.32Å; L198-H201 VanDerWaalsContact O-N 3.07Å; F199-H201 VanDerWaalsContact C-N 3.29Å; F199-H201 PolarHBondContact O-N 3.42Å; H201-T203 VanDerWaalsContact C-N 3.32Å; H201-T203 PolarHBondContact O-N 2.8Å
202E95.9Very high97.5Very high152 Ų15254 Ų5471%0.7130%0.302SS*.Hα-helixtrans-62.5-38.8172-67.6-60.8133.400112L198 F199 L200L198-E202 PolarHBondContact O-N 3.07Å; F199-E202 PolarHBondContact O-N 3.3Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.9Å
203T94.3Very high97.4Very high73 Ų7353.1 Ų53.145%0.44830%0.299SS..Hα-helixtrans-101.2-28.1-178.354.40000113.1Y109 L200 H201Y109-T203 HydrophobicContact CD1-CG2 4.18Å; Y109-T203 HydrophobicContact CE1-CG2 4.42Å; L200-T203 PolarHBondContact O-N 2.74Å; L200-T203 PolarHBondContact O-OG1 3.33Å; H201-T203 VanDerWaalsContact C-N 3.32Å; H201-T203 PolarHBondContact O-N 2.8Å
204G95.4Very high97.2Very high11 Ų1158.6 Ų58.611%0.11332%0.319CS..  trans79.9170.3-166.800000112.5L200L200-G204 VanDerWaalsContact O-CA 3.3Å; L200-G204 WeakPolarHBondContact O-CA 3.03Å; L200-G204 PolarHBondContact O-N 3.37Å
205S96.9Very high97.2Very high30 Ų3061.4 Ų61.421%0.2134%0.335CS..  trans-66.8140.3178.9-73.10000112.6P24P24-S205 WeakPolarHBondContact CG-O 3.46Å
206N97.9Very high97.1Very high6 Ų662 Ų623%0.03234%0.338CS..  trans-65.1173.6159-174.222.3000110.1I27 W31 Y104 S106 Y109 Q313I27-N206 WeakPolarHBondContact CG2-O 3.29Å; W31-N206 VanDerWaalsContact CE2-O 3.26Å; W31-N206 HydrophobicContact CZ2-CB 4.29Å; W31-N206 VanDerWaalsContact CZ2-O 3.25Å; W31-N206 WeakPolarHBondContact CZ2-O 3.26Å; W31-N206 PolarHBondContact NE1-O 3.48Å; Y104-N206 PolarHBondContact O-ND2 3.5Å; S106-N206 PolarHBondContact OG-ND2 3.43Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å; N206-Q313 PolarHBondContact ND2-NE2 2.72Å
207N98.6Very high97.1Very high4 Ų464 Ų642%0.02135%0.346CS..  trans-140.8167.2175.870.885000112.7P24 N26 I27 L209 G210 I211P24-N207 HydrophobicContact CB-CB 3.81Å; P24-N207 HydrophobicContact CG-CB 4.19Å; N26-N207 PolarHBondContact ND2-OD1 2.71Å; N26-N207 WeakPolarHBondContact OD1-CB 3.38Å; I27-N207 HydrophobicContact CG2-CB 4.15Å; N207-L209 PolarHBondContact O-N 2.93Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 3.3Å; N207-L209 PolarHBondContact OD1-N 3.5Å; N207-L209 VanDerWaalsContact OD1-N 3.11Å; N207-G210 PolarHBondContact O-N 3.47Å; N207-I211 PolarHBondContact ND2-O 3.44Å
208P98.6Very high97.1Very high13 Ų1361.9 Ų61.98%0.08434%0.335CS..THydrogen-bonded Turntrans-56.8-32-173.3-30.237.5000115.7N26 W31 Y104 G210 S314 M316N26-P208 VanDerWaalsContact O-CD 3.3Å; N26-P208 WeakPolarHBondContact O-CD 3.33Å; N26-P208 WeakPolarHBondContact O-CG 3.4Å; W31-P208 HydrophobicContact CH2-CG 4.13Å; W31-P208 HydrophobicContact CZ3-CG 3.87Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.22Å; Y104-P208 WeakPolarHBondContact CD1-O 3.5Å; Y104-P208 VanDerWaalsContact CE1-CA 3.47Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.4Å; P208-G210 VanDerWaalsContact C-N 3.29Å; P208-G210 PolarHBondContact O-N 3.19Å; P208-S314 WeakPolarHBondContact O-CB 3.48Å; P208-S314 PolarHBondContact O-OG 2.86Å; P208-M316 HydrophobicContact CB-SD 4.32Å
209L98.3Very high97.1Very high55 Ų5560.4 Ų60.429%0.28833%0.33SS..THydrogen-bonded Turntrans-75.2-19.4-178.6-60.2171000112.4N26 N207 I211 M316 F317N26-L209 WeakPolarHBondContact ND2-CD1 3.4Å; N207-L209 PolarHBondContact O-N 2.93Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 3.3Å; N207-L209 PolarHBondContact OD1-N 3.5Å; N207-L209 VanDerWaalsContact OD1-N 3.11Å; L209-I211 HydrophobicContact CB-CD1 4.24Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 4.14Å; L209-I211 HydrophobicContact CD1-CG1 4.42Å; L209-I211 PolarHBondContact O-N 2.69Å; L209-M316 HydrophobicContact CD2-CE 3.81Å; L209-M316 HydrophobicContact CD2-SD 3.68Å; L209-M316 HydrophobicContact CG-SD 4.5Å; L209-F317 HydrophobicContact CD2-CE2 4.05Å; L209-F317 HydrophobicContact CD2-CZ 3.66Å
210G97.4Very high97.1Very high11 Ų1158.6 Ų58.611%0.11332%0.322CS..  trans63.827.2-176.800000113.8N207 P208N207-G210 PolarHBondContact O-N 3.47Å; P208-G210 VanDerWaalsContact C-N 3.29Å; P208-G210 PolarHBondContact O-N 3.19Å
211I96.9Very high97.1Very high105 Ų10561.4 Ų61.454%0.53833%0.334SS..SBendtrans-117.9163.1173.763.9176.9000109.7N207 L209 S213N207-I211 PolarHBondContact ND2-O 3.44Å; L209-I211 HydrophobicContact CB-CD1 4.24Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 4.14Å; L209-I211 HydrophobicContact CD1-CG1 4.42Å; L209-I211 PolarHBondContact O-N 2.69Å; I211-S213 PolarHBondContact O-N 2.8Å
212T96.8Very high97.2Very high97 Ų9761.3 Ų61.360%0.59534%0.34SS*.  trans-59.1135.8176.4-177.10000111.9H214T212-H214 PolarHBondContact OG1-CD2 3.29Å; T212-H214 PolarHBondContact OG1-N 3.43Å
213S96.6Very high97.3Very high17 Ų1760.3 Ų60.312%0.11933%0.331CS..  trans-107.514178.679.20000112.9P24 I211 S215 D216 K217P24-S213 WeakPolarHBondContact CB-OG 3.42Å; P24-S213 WeakPolarHBondContact CG-OG 3.14Å; I211-S213 PolarHBondContact O-N 2.8Å; S213-S215 PolarHBondContact O-N 2.89Å; S213-D216 CarbonylContact O-C 3.6Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 3.2Å; S213-K217 VanDerWaalsContact O-CG 3.27Å; S213-K217 WeakPolarHBondContact O-CG 3.4Å
214H95.4Very high97.5Very high144 Ų14457.3 Ų57.367%0.66731%0.311SS*.THydrogen-bonded Turntrans-59-30.2-176.6-71.7-60.6000113.2T212 D216T212-H214 PolarHBondContact OG1-CD2 3.29Å; T212-H214 PolarHBondContact OG1-N 3.43Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 3.05Å
215S96.6Very high97.7Very high122 Ų12258.3 Ų58.385%0.85332%0.315SS*.THydrogen-bonded Turntrans-70.5-20.6177.355.70000113.8S213S213-S215 PolarHBondContact O-N 2.89Å
216D97.6Very high97.7Very high86 Ų8662.6 Ų62.646%0.4633%0.334SS..SBendtrans-145.584.3-177.2-173.319.1000111.2S25 S213 H214S25-D216 WeakPolarHBondContact CB-OD2 3.44Å; S25-D216 PolarHBondContact N-O 3.44Å; S25-D216 PolarHBondContact OG-OD2 2.88Å; S213-D216 CarbonylContact O-C 3.6Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 3.2Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 3.05Å
217K97.9Very high97.8Very high69 Ų6964.6 Ų64.630%0.334%0.343SS..EExtended strand (participates in β ladder)trans-114.9140.4170.3-64.4-165175.7-170.50109.8P22 T23 S213P22-K217 HydrophobicContact CB-CB 4.14Å; P22-K217 HydrophobicContact CB-CD 3.63Å; T23-K217 WeakPolarHBondContact O-CA 3.35Å; S213-K217 VanDerWaalsContact O-CG 3.27Å; S213-K217 WeakPolarHBondContact O-CG 3.4Å
218I98.2Very high97.8Very high42 Ų4265.8 Ų65.822%0.21535%0.349CS..EExtended strand (participates in β ladder)trans-111.4158.6170.763.8-177.6000109.5T23 Y223 Y224T23-I218 PolarHBondContact N-O 2.81Å; T23-I218 PolarHBondContact O-N 2.69Å; I218-Y223 HydrophobicContact CB-CD2 4.06Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.18Å; I218-Y223 HydrophobicContact CD1-CD2 3.8Å; I218-Y223 HydrophobicContact CD1-CE2 4.45Å; I218-Y223 HydrophobicContact CD1-CG 3.64Å; I218-Y223 HydrophobicContact CG1-CD2 4.15Å; I218-Y223 HydrophobicContact CG1-CG 4.44Å; I218-Y224 HydrophobicContact CD1-CE2 3.72Å; I218-Y224 HydrophobicContact CG1-CE2 3.71Å
219T97.5Very high97.8Very high60 Ų6067.7 Ų67.737%0.36837%0.366SS..EExtended strand (participates in β ladder)trans-69.2145.7172.750.80000110.3H221 Y223T219-H221 WeakPolarHBondContact CB-O 3.47Å; T219-H221 PolarHBondContact O-N 3.46Å; T219-H221 PolarHBondContact OG1-O 3.47Å; T219-Y223 WeakPolarHBondContact O-CD2 3.46Å
220F98.3Very high97.8Very high28 Ų2869.8 Ų69.812%0.12338%0.377CS..SBendtrans-62.1-44.2-179.9-171.7-82.2000112.3F18 I19 L21 P222 Y223 Y224 T225F18-F220 HydrophobicContact CD2-CE1 4.36Å; F18-F220 HydrophobicContact CE2-CE1 4.04Å; F18-F220 HydrophobicContact CZ-CE1 4.19Å; F18-F220 WeakPolarHBondContact O-CB 3.5Å; F18-F220 WeakPolarHBondContact O-CD1 3.36Å; I19-F220 PolarHBondContact O-N 3.37Å; L21-F220 HydrophobicContact CB-CB 3.91Å; L21-F220 HydrophobicContact CD2-CD2 4.2Å; L21-F220 PolarHBondContact O-N 2.8Å; F220-P222 CarbonylContact O-C 3.36Å; F220-Y223 PolarHBondContact O-N 3.01Å; F220-Y224 VanDerWaalsContact CD2-CB 3.49Å; F220-Y224 HydrophobicContact CD2-CD2 4.06Å; F220-Y224 HydrophobicContact CD2-CG 4.12Å; F220-Y224 HydrophobicContact CE2-CG 4.19Å; F220-Y224 PolarHBondContact O-N 2.95Å; F220-T225 HydrophobicContact CD1-CG2 3.68Å; F220-T225 HydrophobicContact CE1-CG2 3.69Å; F220-T225 PolarHBondContact O-N 3.11Å
221H98.1Very high97.9Very high95 Ų9569.9 Ų69.944%0.4438%0.378SS..THydrogen-bonded Turntrans-89.4134168.2-174.671.5000110.6I19 T219 T225I19-H221 HydrophobicContact CG2-CB 4.1Å; I19-H221 PolarHBondContact O-N 3.32Å; T219-H221 WeakPolarHBondContact CB-O 3.47Å; T219-H221 PolarHBondContact O-N 3.46Å; T219-H221 PolarHBondContact OG1-O 3.47Å; H221-T225 HydrophobicContact CB-CG2 3.96Å; H221-T225 PolarHBondContact ND1-OG1 2.97Å
222P98.1Very high97.9Very high68 Ų6868 Ų6844%0.44237%0.368SS..THydrogen-bonded Turncis-88.4-15.61.634.9-35.3000114.9F220 Y224 T225 I226F220-P222 CarbonylContact O-C 3.36Å; P222-Y224 PolarHBondContact O-N 3.1Å; P222-T225 VanDerWaalsContact C-OG1 3.29Å; P222-T225 WeakPolarHBondContact CA-OG1 3.48Å; P222-T225 PolarHBondContact O-N 3.27Å; P222-T225 PolarHBondContact O-OG1 3.09Å; P222-I226 WeakPolarHBondContact O-CG2 3.48Å; P222-I226 PolarHBondContact O-N 3.47Å
223Y98.5Very high98Very high131 Ų13168.7 Ų68.751%0.51437%0.368SS..Hα-helixtrans-57.3-54-164.1-62.5-78.6000114.5I218 T219 F220 I226 K227I218-Y223 HydrophobicContact CB-CD2 4.06Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.18Å; I218-Y223 HydrophobicContact CD1-CD2 3.8Å; I218-Y223 HydrophobicContact CD1-CE2 4.45Å; I218-Y223 HydrophobicContact CD1-CG 3.64Å; I218-Y223 HydrophobicContact CG1-CD2 4.15Å; I218-Y223 HydrophobicContact CG1-CG 4.44Å; T219-Y223 WeakPolarHBondContact O-CD2 3.46Å; F220-Y223 PolarHBondContact O-N 3.01Å; Y223-I226 VanDerWaalsContact O-CG2 3.27Å; Y223-I226 WeakPolarHBondContact O-CG2 3.48Å; Y223-K227 WeakPolarHBondContact O-CB 3.44Å; Y223-K227 PolarHBondContact O-N 3.45Å
224Y98.4Very high98.1Very high10 Ų1072.8 Ų72.84%0.03939%0.388CS..Hα-helixtrans-83.8-25-179.8-64.2-60.2000112.2T23 P24 S25 I27 I218 F220 P222 I226 K227 D228T23-Y224 VanDerWaalsContact CB-CE2 3.49Å; T23-Y224 HydrophobicContact CG2-CD2 3.48Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.48Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.35Å; P24-Y224 PolarHBondContact O-OH 3.42Å; S25-Y224 WeakPolarHBondContact CA-OH 3.37Å; S25-Y224 PolarHBondContact O-OH 2.89Å; I27-Y224 HydrophobicContact CD1-CD1 3.79Å; I27-Y224 HydrophobicContact CD1-CD2 4.4Å; I27-Y224 HydrophobicContact CD1-CE1 3.54Å; I27-Y224 HydrophobicContact CD1-CE2 4.17Å; I27-Y224 HydrophobicContact CD1-CG 4.25Å; I27-Y224 HydrophobicContact CG1-CD1 3.96Å; I27-Y224 HydrophobicContact CG1-CE1 3.21Å; I27-Y224 HydrophobicContact CG1-CE2 4.24Å; I218-Y224 HydrophobicContact CD1-CE2 3.72Å; I218-Y224 HydrophobicContact CG1-CE2 3.71Å; F220-Y224 VanDerWaalsContact CD2-CB 3.49Å; F220-Y224 HydrophobicContact CD2-CD2 4.06Å; F220-Y224 HydrophobicContact CD2-CG 4.12Å; F220-Y224 HydrophobicContact CE2-CG 4.19Å; F220-Y224 PolarHBondContact O-N 2.95Å; P222-Y224 PolarHBondContact O-N 3.1Å; Y224-I226 PolarHBondContact O-N 2.81Å; Y224-K227 HydrophobicContact CD1-CD 3.78Å; Y224-K227 HydrophobicContact CE1-CD 4.05Å; Y224-K227 PolarHBondContact O-N 3.44Å; Y224-D228 WeakPolarHBondContact O-CB 3Å; Y224-D228 VanDerWaalsContact O-CG 3.28Å; Y224-D228 PolarHBondContact O-N 3.06Å
225T98.4Very high98.3Very high31 Ų3166.4 Ų66.419%0.1936%0.358CS..Hα-helixtrans-61.2-43.6170.455.50000112.6F18 F220 H221 P222 A229F18-T225 HydrophobicContact CD1-CG2 4.5Å; F18-T225 HydrophobicContact CE1-CG2 3.78Å; F18-T225 HydrophobicContact CZ-CG2 4.14Å; F220-T225 HydrophobicContact CD1-CG2 3.68Å; F220-T225 HydrophobicContact CE1-CG2 3.69Å; F220-T225 PolarHBondContact O-N 3.11Å; H221-T225 HydrophobicContact CB-CG2 3.96Å; H221-T225 PolarHBondContact ND1-OG1 2.97Å; P222-T225 VanDerWaalsContact C-OG1 3.29Å; P222-T225 WeakPolarHBondContact CA-OG1 3.48Å; P222-T225 PolarHBondContact O-N 3.27Å; P222-T225 PolarHBondContact O-OG1 3.09Å; T225-A229 WeakPolarHBondContact O-CB 3.34Å; T225-A229 PolarHBondContact O-N 2.87Å
226I98.5Very high98.4Very high120 Ų12064.1 Ų64.162%0.61534%0.336SS*.Hα-helixtrans-73.6-37.2178.7-168.961.1000111.7P222 Y223 Y224 A229 L230P222-I226 WeakPolarHBondContact O-CG2 3.48Å; P222-I226 PolarHBondContact O-N 3.47Å; Y223-I226 VanDerWaalsContact O-CG2 3.27Å; Y223-I226 WeakPolarHBondContact O-CG2 3.48Å; Y224-I226 PolarHBondContact O-N 2.81Å; I226-A229 PolarHBondContact O-N 3.5Å; I226-L230 PolarHBondContact O-N 2.67Å
227K98.6Very high98.4Very high49 Ų4965.2 Ų65.221%0.21334%0.341CS..Hα-helixtrans-63.7-42.3175.6-170.2-166.8173.1-161.10111.5I27 S28 N32 Y223 Y224 L230 G231I27-K227 PolarHBondContact O-NZ 3.37Å; S28-K227 PolarHBondContact O-NZ 3.22Å; N32-K227 PolarHBondContact ND2-O 3.24Å; N32-K227 WeakPolarHBondContact OD1-CE 3.26Å; N32-K227 PolarHBondContact OD1-NZ 2.92Å; Y223-K227 WeakPolarHBondContact O-CB 3.44Å; Y223-K227 PolarHBondContact O-N 3.45Å; Y224-K227 HydrophobicContact CD1-CD 3.78Å; Y224-K227 HydrophobicContact CE1-CD 4.05Å; Y224-K227 PolarHBondContact O-N 3.44Å; K227-L230 WeakPolarHBondContact O-CB 3.39Å; K227-L230 PolarHBondContact O-N 3.35Å; K227-G231 PolarHBondContact O-N 3.3Å
228D98.6Very high98.5Very high28 Ų2864.3 Ų64.315%0.1534%0.344CS..Hα-helixtrans-69.8-36.3177.6-77.412000111.7N32 S35 Y224 L230 G231 L232N32-D228 PolarHBondContact ND2-OD1 3.43Å; S35-D228 WeakPolarHBondContact CB-OD2 2.85Å; S35-D228 PolarHBondContact OG-OD2 3.37Å; Y224-D228 WeakPolarHBondContact O-CB 3Å; Y224-D228 VanDerWaalsContact O-CG 3.28Å; Y224-D228 PolarHBondContact O-N 3.06Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 2.95Å; D228-G231 PolarHBondContact O-N 3.14Å; D228-L232 WeakPolarHBondContact O-CB 3.41Å; D228-L232 PolarHBondContact O-N 3.33Å
229A98.7Very high98.5Very high53 Ų5362.4 Ų62.444%0.43833%0.334SS..Hα-helixtrans-60.7-40.8171.400000112.2T225 I226 L232 L233T225-A229 WeakPolarHBondContact O-CB 3.34Å; T225-A229 PolarHBondContact O-N 2.87Å; I226-A229 PolarHBondContact O-N 3.5Å; A229-L232 PolarHBondContact O-N 2.98Å; A229-L233 PolarHBondContact O-N 2.91Å
230L98.7Very high98.5Very high100 Ų10062.6 Ų62.652%0.52433%0.331SS..Hα-helixtrans-63.5-44.9173176.462.8000111.7I226 K227 D228 L232 L233 L234I226-L230 PolarHBondContact O-N 2.67Å; K227-L230 WeakPolarHBondContact O-CB 3.39Å; K227-L230 PolarHBondContact O-N 3.35Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 2.95Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.47Å; L230-L233 WeakPolarHBondContact O-CB 3.34Å; L230-L233 PolarHBondContact O-N 3.35Å; L230-L234 WeakPolarHBondContact O-CG 3.48Å; L230-L234 PolarHBondContact O-N 3.18Å; L230-L234 VanDerWaalsContact O-N 3.08Å
231G98.7Very high98.6Very high13 Ų1364.3 Ų64.313%0.13435%0.345CS..Hα-helixtrans-57.8-44.6175.200000112.2K227 D228 L234 F235K227-G231 PolarHBondContact O-N 3.3Å; D228-G231 PolarHBondContact O-N 3.14Å; G231-L234 PolarHBondContact O-N 3.25Å; G231-F235 WeakPolarHBondContact O-CB 3.44Å; G231-F235 PolarHBondContact O-N 2.84Å
232L98.8Very high98.6Very high64 Ų6460.8 Ų60.834%0.33533%0.329SS..Hα-helixtrans-63.4-40.7176.7-178.962.3000111.9L36 A39 D228 A229 L230 F235 L236L36-L232 HydrophobicContact CD2-CB 4.48Å; A39-L232 HydrophobicContact CB-CD1 3.72Å; D228-L232 WeakPolarHBondContact O-CB 3.41Å; D228-L232 PolarHBondContact O-N 3.33Å; A229-L232 PolarHBondContact O-N 2.98Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.47Å; L232-F235 HydrophobicContact CD1-CD1 4.2Å; L232-F235 WeakPolarHBondContact O-CB 3.3Å; L232-F235 PolarHBondContact O-N 3.38Å; L232-L236 HydrophobicContact CD1-CD1 4.26Å; L232-L236 HydrophobicContact CD1-CG 4.14Å; L232-L236 HydrophobicContact CG-CD1 4.06Å; L232-L236 HydrophobicContact CG-CG 4.36Å; L232-L236 WeakPolarHBondContact O-CB 3.34Å; L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 2.96Å; L232-L236 PolarHBondContact O-N 3.4Å
233L98.8Very high98.6Very high112 Ų11257.6 Ų57.659%0.58631%0.308SS*.Hα-helixtrans-60-46.6176.1178.365.2000111.5A229 L230 L236 L237A229-L233 PolarHBondContact O-N 2.91Å; L230-L233 WeakPolarHBondContact O-CB 3.34Å; L230-L233 PolarHBondContact O-N 3.35Å; L233-L236 PolarHBondContact O-N 3.01Å; L233-L237 WeakPolarHBondContact O-CB 3.38Å; L233-L237 PolarHBondContact O-N 2.98Å
234L98.7Very high98.6Very high104 Ų10455.2 Ų55.255%0.54530%0.304SS..Hα-helixtrans-65-40.8177.7-66.7175000111.9L230 G231 L237 S238L230-L234 WeakPolarHBondContact O-CG 3.48Å; L230-L234 PolarHBondContact O-N 3.18Å; L230-L234 VanDerWaalsContact O-N 3.08Å; G231-L234 PolarHBondContact O-N 3.25Å; L234-L237 PolarHBondContact O-N 3.24Å; L234-S238 PolarHBondContact O-N 2.95Å; L234-S238 PolarHBondContact O-OG 3.12Å
235F98.6Very high98.6Very high10 Ų1062.7 Ų62.74%0.04434%0.337CS..Hα-helixtrans-58.1-52.6173.2169.2-89.8000111.4L36 C40 M89 G231 L232 L237 S238 L239L36-F235 HydrophobicContact CD1-CB 4.45Å; L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.41Å; L36-F235 HydrophobicContact CD2-CG 4.05Å; C40-F235 WeakPolarHBondContact SG-CE2 3.38Å; C40-F235 WeakPolarHBondContact SG-CZ 3.31Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.04Å; M89-F235 HydrophobicContact CE-CD2 3.9Å; M89-F235 HydrophobicContact CE-CE2 3.98Å; M89-F235 HydrophobicContact CG-CE2 4.42Å; G231-F235 WeakPolarHBondContact O-CB 3.44Å; G231-F235 PolarHBondContact O-N 2.84Å; L232-F235 HydrophobicContact CD1-CD1 4.2Å; L232-F235 WeakPolarHBondContact O-CB 3.3Å; L232-F235 PolarHBondContact O-N 3.38Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.14Å; F235-S238 PolarHBondContact O-N 3.03Å; F235-S238 PolarHBondContact O-OG 3.09Å; F235-L239 HydrophobicContact CE1-CD2 4.09Å; F235-L239 HydrophobicContact CZ-CD2 4.36Å; F235-L239 PolarHBondContact O-N 3.19Å
236L98.6Very high98.6Very high74 Ų7463.2 Ų63.239%0.38734%0.342SS..Hα-helixtrans-62.6-39.9180-71.5174.4000111.2L232 L233 S238 L239 M240L232-L236 HydrophobicContact CD1-CD1 4.26Å; L232-L236 HydrophobicContact CD1-CG 4.14Å; L232-L236 HydrophobicContact CG-CD1 4.06Å; L232-L236 HydrophobicContact CG-CG 4.36Å; L232-L236 WeakPolarHBondContact O-CB 3.34Å; L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 2.96Å; L232-L236 PolarHBondContact O-N 3.4Å; L233-L236 PolarHBondContact O-N 3.01Å; L236-S238 PolarHBondContact O-N 2.99Å; L236-L239 PolarHBondContact O-N 3.34Å; L236-M240 VanDerWaalsContact O-CB 3.26Å; L236-M240 WeakPolarHBondContact O-CB 3.31Å; L236-M240 WeakPolarHBondContact O-CG 3.46Å; L236-M240 PolarHBondContact O-N 3.33Å
237L98.7Very high98.6Very high108 Ų10859 Ų5957%0.56532%0.322SS*.Hα-helixtrans-56.9-51174.1-179.263.2000110.6L233 L234 F235 L239 M240 T241L233-L237 WeakPolarHBondContact O-CB 3.38Å; L233-L237 PolarHBondContact O-N 2.98Å; L234-L237 PolarHBondContact O-N 3.24Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.14Å; L237-L239 PolarHBondContact O-N 3Å; L237-M240 PolarHBondContact O-N 3.31Å; L237-T241 WeakPolarHBondContact O-CB 3.25Å; L237-T241 PolarHBondContact O-N 3.11Å; L237-T241 PolarHBondContact O-OG1 3.4Å
238S98.6Very high98.6Very high51 Ų5160.1 Ų60.136%0.35733%0.33SS..Hα-helixtrans-61.9-44.2179.568.40000113.1M89 L234 F235 L236 T241 L242M89-S238 WeakPolarHBondContact CE-OG 3.3Å; L234-S238 PolarHBondContact O-N 2.95Å; L234-S238 PolarHBondContact O-OG 3.12Å; F235-S238 PolarHBondContact O-N 3.03Å; F235-S238 PolarHBondContact O-OG 3.09Å; L236-S238 PolarHBondContact O-N 2.99Å; S238-T241 PolarHBondContact O-N 3.42Å; S238-L242 WeakPolarHBondContact O-CB 3.4Å; S238-L242 PolarHBondContact O-N 3.25Å
239L98.8Very high98.6Very high1 Ų164.7 Ų64.71%0.00535%0.354CS..Hα-helixtrans-64-43.9178.2173.564.2000111.4L43 L82 N85 M89 F235 L236 L237 L242 T243L43-L239 HydrophobicContact CD2-CD2 3.43Å; L43-L239 VanDerWaalsContact CD2-CD2 3.43Å; L82-L239 HydrophobicContact CD2-CD2 3.93Å; L82-L239 HydrophobicContact CD2-CG 4.06Å; N85-L239 HydrophobicContact CB-CD1 3.89Å; M89-L239 HydrophobicContact CG-CB 4.36Å; M89-L239 HydrophobicContact CG-CD1 3.9Å; F235-L239 HydrophobicContact CE1-CD2 4.09Å; F235-L239 HydrophobicContact CZ-CD2 4.36Å; F235-L239 PolarHBondContact O-N 3.19Å; L236-L239 PolarHBondContact O-N 3.34Å; L237-L239 PolarHBondContact O-N 3Å; L239-L242 PolarHBondContact O-N 2.92Å; L239-T243 WeakPolarHBondContact O-CB 3.5Å; L239-T243 PolarHBondContact O-N 3.28Å; L239-T243 PolarHBondContact O-OG1 3.49Å
240M98.6Very high98.5Very high64 Ų6464.8 Ų64.832%0.31535%0.347SS..Hα-helixtrans-69.5-37.8179-68.5-56.8-60.200111.3I78 L82 L236 L237 T243 L244I78-M240 HydrophobicContact CD1-CE 4.23Å; L82-M240 HydrophobicContact CD2-SD 3.81Å; L236-M240 VanDerWaalsContact O-CB 3.26Å; L236-M240 WeakPolarHBondContact O-CB 3.31Å; L236-M240 WeakPolarHBondContact O-CG 3.46Å; L236-M240 PolarHBondContact O-N 3.33Å; L237-M240 PolarHBondContact O-N 3.31Å; M240-T243 PolarHBondContact O-N 2.91Å; M240-L244 HydrophobicContact CE-CD1 3.68Å; M240-L244 HydrophobicContact CE-CD2 4.17Å; M240-L244 HydrophobicContact CE-CG 3.91Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.39Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.49Å; M240-L244 PolarHBondContact O-N 3.45Å
241T98.8Very high98.4Very high65 Ų6562 Ų6240%0.39934%0.342SS..Hα-helixtrans-60.7-47.8173.5-60.50000110.8L237 S238 F245L237-T241 WeakPolarHBondContact O-CB 3.25Å; L237-T241 PolarHBondContact O-N 3.11Å; L237-T241 PolarHBondContact O-OG1 3.4Å; S238-T241 PolarHBondContact O-N 3.42Å; T241-F245 HydrophobicContact CG2-CD2 4.11Å; T241-F245 WeakPolarHBondContact O-CB 3.45Å; T241-F245 WeakPolarHBondContact O-CD2 3.41Å; T241-F245 PolarHBondContact O-N 3.31Å
242L98.5Very high98.3Very high20 Ų2062.4 Ų62.411%0.10534%0.342CS..Hα-helixtrans-59.3-52.1175.7179.961.4000110.9N85 S238 L239 L244 S246 P247 L249 L250N85-L242 HydrophobicContact CB-CD2 3.77Å; N85-L242 HydrophobicContact CB-CG 4.18Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.14Å; S238-L242 WeakPolarHBondContact O-CB 3.4Å; S238-L242 PolarHBondContact O-N 3.25Å; L239-L242 PolarHBondContact O-N 2.92Å; L242-L244 PolarHBondContact O-N 3.46Å; L242-S246 WeakPolarHBondContact CD1-O 3.46Å; L242-S246 CarbonylContact O-C 3.33Å; L242-S246 WeakPolarHBondContact O-CA 3.48Å; L242-S246 PolarHBondContact O-N 3.31Å; L242-S246 PolarHBondContact O-OG 3.45Å; L242-P247 WeakPolarHBondContact O-CA 3.42Å; L242-P247 VanDerWaalsContact O-N 3.08Å; L242-L249 HydrophobicContact CD1-CB 4Å; L242-L249 HydrophobicContact CD1-CD2 4.09Å; L242-L250 HydrophobicContact CD1-CG 4.42Å; L242-L250 HydrophobicContact CD2-CD1 3.66Å; L242-L250 HydrophobicContact CD2-CG 4.33Å
243T98.4Very high98.2Very high1 Ų163.9 Ų63.91%0.00636%0.355CS..Hα-helixtrans-64.3-38-175.2-61.50000113.6I78 L82 L239 M240 P247I78-T243 HydrophobicContact CG1-CG2 4.26Å; L82-T243 HydrophobicContact CD2-CG2 4.21Å; L82-T243 HydrophobicContact CG-CG2 4.19Å; L239-T243 WeakPolarHBondContact O-CB 3.5Å; L239-T243 PolarHBondContact O-N 3.28Å; L239-T243 PolarHBondContact O-OG1 3.49Å; M240-T243 PolarHBondContact O-N 2.91Å; T243-P247 WeakPolarHBondContact O-CB 3.5Å
244L98.6Very high98.1Very high81 Ų8161 Ų6142%0.42434%0.34SS..Hα-helixtrans-90.2-33.5-174.6-63.7177.6000113.2W77 I78 M240 L242W77-L244 HydrophobicContact CH2-CD2 3.92Å; W77-L244 HydrophobicContact CZ3-CD2 4.27Å; I78-L244 HydrophobicContact CD1-CD2 3.93Å; M240-L244 HydrophobicContact CE-CD1 3.68Å; M240-L244 HydrophobicContact CE-CD2 4.17Å; M240-L244 HydrophobicContact CE-CG 3.91Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.39Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.49Å; M240-L244 PolarHBondContact O-N 3.45Å; L242-L244 PolarHBondContact O-N 3.46Å
245F98.6Very high98.1Very high168 Ų16857 Ų5774%0.73732%0.319SS*.Hα-helixtrans-106.4-25.7-174-64-76.9000113.9T241T241-F245 HydrophobicContact CG2-CD2 4.11Å; T241-F245 WeakPolarHBondContact O-CB 3.45Å; T241-F245 WeakPolarHBondContact O-CD2 3.41Å; T241-F245 PolarHBondContact O-N 3.31Å
246S98.4Very high98Very high42 Ų4261.5 Ų61.529%0.29434%0.337SS..  trans-147.651.7-174.452.90000112.6L242 D248 L249L242-S246 WeakPolarHBondContact CD1-O 3.46Å; L242-S246 CarbonylContact O-C 3.33Å; L242-S246 WeakPolarHBondContact O-CA 3.48Å; L242-S246 PolarHBondContact O-N 3.31Å; L242-S246 PolarHBondContact O-OG 3.45Å; S246-D248 PolarHBondContact O-N 3.5Å; S246-L249 VanDerWaalsContact O-CB 3.3Å; S246-L249 WeakPolarHBondContact O-CB 3.17Å; S246-L249 PolarHBondContact O-N 3.33Å; S246-L249 VanDerWaalsContact O-N 3.08Å
247P98.1Very high98Very high31 Ų3161.3 Ų61.320%0.20134%0.339CS..THydrogen-bonded Turntrans-59.9-25.7-167.520.9-33000114.9Y81 N85 L242 T243Y81-P247 HydrophobicContact CD1-CB 3.55Å; Y81-P247 HydrophobicContact CD2-CB 4.03Å; Y81-P247 HydrophobicContact CE1-CB 3.76Å; Y81-P247 HydrophobicContact CE1-CG 4.49Å; Y81-P247 HydrophobicContact CE2-CB 4.22Å; Y81-P247 HydrophobicContact CG-CB 3.7Å; N85-P247 PolarHBondContact ND2-O 2.79Å; N85-P247 PolarHBondContact OD1-O 2.94Å; L242-P247 WeakPolarHBondContact O-CA 3.42Å; L242-P247 VanDerWaalsContact O-N 3.08Å; T243-P247 WeakPolarHBondContact O-CB 3.5Å
248D98.2Very high98Very high72 Ų7260.8 Ų60.839%0.38534%0.336SS..THydrogen-bonded Turntrans-100.51.7-176.8-63.5-53.1000113.7S246 L250 G251 Y256S246-D248 PolarHBondContact O-N 3.5Å; D248-L250 PolarHBondContact O-N 3.33Å; D248-L250 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact O-N 3.23Å; D248-G251 VanDerWaalsContact O-N 3.14Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.34Å; D248-Y256 PolarHBondContact OD1-OH 3.44Å
249L98.4Very high97.9Very high124 Ų12459 Ų5965%0.64933%0.325SS*.THydrogen-bonded Turntrans-56.5-33.9-173178.964.1000113.7L242 S246L242-L249 HydrophobicContact CD1-CB 4Å; L242-L249 HydrophobicContact CD1-CD2 4.09Å; S246-L249 VanDerWaalsContact O-CB 3.3Å; S246-L249 WeakPolarHBondContact O-CB 3.17Å; S246-L249 PolarHBondContact O-N 3.33Å; S246-L249 VanDerWaalsContact O-N 3.08Å
250L97.9Very high97.8Very high56 Ų5662.1 Ų62.129%0.29334%0.341SS..THydrogen-bonded Turntrans-99.4-5.9-175.8-58.3-177.3000113.7L242 D248L242-L250 HydrophobicContact CD1-CG 4.42Å; L242-L250 HydrophobicContact CD2-CD1 3.66Å; L242-L250 HydrophobicContact CD2-CG 4.33Å; D248-L250 PolarHBondContact O-N 3.33Å; D248-L250 VanDerWaalsContact O-N 3.12Å
251G95.6Very high97.7Very high41 Ų4162.9 Ų62.942%0.42335%0.351SS..SBendtrans-98170.5-178.600000113D248D248-G251 PolarHBondContact O-N 3.23Å; D248-G251 VanDerWaalsContact O-N 3.14Å
252D97.1Very high97.6Very high22 Ų2267.6 Ų67.612%0.11837%0.372CS..  trans-100.6129.2175.9-161.4-72.3000111.6M138 D254 N255 K269M138-D252 HydrophobicContact CG-CB 4.09Å; D252-D254 PolarHBondContact O-N 3.48Å; D252-D254 WeakPolarHBondContact OD1-CB 3.4Å; D252-D254 PolarHBondContact OD1-N 3.41Å; D252-N255 WeakPolarHBondContact O-CB 3.18Å; D252-N255 PolarHBondContact O-N 2.94Å; D252-N255 VanDerWaalsContact O-N 3.1Å; D252-K269 WeakPolarHBondContact OD2-CE 3.36Å; D252-K269 IonicContact OD2-NZ 3.45Å; D252-K269 PolarHBondContact OD2-NZ 2.79Å
253P97.1Very high97.4Very high94 Ų9471 Ų7161%0.6139%0.391SS*.G310 helixtrans-62-27-17825.7-35.9000113.5N255 Y256P253-N255 PolarHBondContact O-N 3.2Å; P253-N255 VanDerWaalsContact O-N 3.14Å; P253-Y256 WeakPolarHBondContact O-CB 3.27Å; P253-Y256 PolarHBondContact O-N 3.26Å
254D96.9Very high97.3Very high53 Ų5374.5 Ų74.528%0.28341%0.412SS..G310 helixtrans-63.4-23.3178.9-76.6-9.2000111.2Q137 M138 D252 Y256 T257Q137-D254 HydrophobicContact CB-CB 4.45Å; M138-D254 HydrophobicContact CE-CB 3.52Å; M138-D254 WeakPolarHBondContact CE-OD2 3.42Å; M138-D254 HydrophobicContact CG-CB 3.8Å; D252-D254 PolarHBondContact O-N 3.48Å; D252-D254 WeakPolarHBondContact OD1-CB 3.4Å; D252-D254 PolarHBondContact OD1-N 3.41Å; D254-Y256 PolarHBondContact O-N 3.29Å; D254-T257 PolarHBondContact O-N 2.79Å; D254-T257 PolarHBondContact O-OG1 3.24Å
255N97.5Very high97Very high19 Ų1971.1 Ų71.110%0.10240%0.395CS..G310 helixtrans-73.3-4.9176.9-139.831.8000114.2G136 M138 S139 D252 P253 T257G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.23Å; G136-N255 WeakPolarHBondContact CA-OD1 3.48Å; M138-N255 HydrophobicContact CB-CB 4.16Å; M138-N255 PolarHBondContact N-OD1 2.71Å; S139-N255 PolarHBondContact N-OD1 2.81Å; S139-N255 PolarHBondContact OG-ND2 2.83Å; S139-N255 PolarHBondContact OG-OD1 3.29Å; D252-N255 WeakPolarHBondContact O-CB 3.18Å; D252-N255 PolarHBondContact O-N 2.94Å; D252-N255 VanDerWaalsContact O-N 3.1Å; P253-N255 PolarHBondContact O-N 3.2Å; P253-N255 VanDerWaalsContact O-N 3.14Å; N255-T257 VanDerWaalsContact C-N 3.31Å
256Y97.6Very high96.7Very high104 Ų10469.5 Ų69.541%0.40840%0.401SS..G310 helixtrans-87.63.6167.6-75.2-72000113.7F63 R80 Y81 D248 P253 D254F63-Y256 WeakPolarHBondContact CZ-O 3.39Å; R80-Y256 PolarHBondContact NH1-OH 3.42Å; Y81-Y256 PolarHBondContact OH-OH 3.47Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.34Å; D248-Y256 PolarHBondContact OD1-OH 3.44Å; P253-Y256 WeakPolarHBondContact O-CB 3.27Å; P253-Y256 PolarHBondContact O-N 3.26Å; D254-Y256 PolarHBondContact O-N 3.29Å
257T97.9Very high96.4Very high70 Ų7069.9 Ų69.943%0.42940%0.399SS..SBendtrans-108.6135.2170.5610000110.1G136 Q137 D254 N255 A259G136-T257 CarbonylContact C-O 2.93Å; G136-T257 WeakPolarHBondContact CA-O 3.06Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.25Å; Q137-T257 PolarHBondContact N-O 3.17Å; D254-T257 PolarHBondContact O-N 2.79Å; D254-T257 PolarHBondContact O-OG1 3.24Å; N255-T257 VanDerWaalsContact C-N 3.31Å; T257-A259 PolarHBondContact O-N 3.25Å
258L97.7Very high96.2Very high98 Ų9869.9 Ų69.951%0.51340%0.397SS..BIsolated β-bridgetrans-56.6138179175.165.5000110.3F63 N260F63-L258 HydrophobicContact CB-CD1 3.44Å; F63-L258 VanDerWaalsContact CB-CD1 3.44Å; F63-L258 HydrophobicContact CD1-CB 4.2Å; F63-L258 HydrophobicContact CD1-CD1 4.13Å; F63-L258 HydrophobicContact CD2-CB 4.48Å; F63-L258 HydrophobicContact CD2-CD1 4.24Å; F63-L258 HydrophobicContact CE1-CB 4.35Å; F63-L258 HydrophobicContact CG-CB 4.28Å; F63-L258 HydrophobicContact CG-CD1 3.68Å; L258-N260 PolarHBondContact O-N 2.96Å
259A97.1Very high96.1Very high14 Ų1469.2 Ų69.212%0.11639%0.39CS..  trans-52.9128.7176.200000112.2W135 F140 T257W135-A259 HydrophobicContact CG-CB 4.42Å; W135-A259 WeakPolarHBondContact O-CB 3.38Å; W135-A259 PolarHBondContact O-N 2.73Å; W135-A259 VanDerWaalsContact O-N 3.12Å; F140-A259 HydrophobicContact CB-CB 3.51Å; F140-A259 HydrophobicContact CD2-CB 4.27Å; F140-A259 HydrophobicContact CG-CB 3.93Å; T257-A259 PolarHBondContact O-N 3.25Å
260N97.1Very high96Very high66 Ų6664.3 Ų64.335%0.35337%0.366SS..  trans-125.9108.3173-177.4-12.3000109.2W141 L258 L262 N263W141-N260 PolarHBondContact NE1-O 3.3Å; L258-N260 PolarHBondContact O-N 2.96Å; N260-L262 PolarHBondContact O-N 3.03Å; N260-L262 WeakPolarHBondContact OD1-CB 2.92Å; N260-L262 PolarHBondContact OD1-N 3.09Å; N260-N263 HydrophobicContact CB-CB 4.17Å; N260-N263 PolarHBondContact O-N 2.72Å; N260-N263 VanDerWaalsContact O-N 3.09Å
261P95.8Very high96Very high80 Ų8062.7 Ų62.752%0.51936%0.357SS..THydrogen-bonded Turntrans-60.3-15.7179.2-24.234.1000114.8F140 W141F140-P261 HydrophobicContact CE1-CB 4.1Å; F140-P261 HydrophobicContact CE1-CG 4.27Å; F140-P261 HydrophobicContact CE2-CG 4.23Å; F140-P261 HydrophobicContact CZ-CB 3.85Å; F140-P261 HydrophobicContact CZ-CG 3.8Å; W141-P261 WeakPolarHBondContact CH2-O 3.33Å; W141-P261 WeakPolarHBondContact CZ2-O 3.07Å
262L96.4Very high96.1Very high163 Ų16363.8 Ų63.885%0.85335%0.348SS*.THydrogen-bonded Turntrans-100.4-5.3-179-55.4179.5000113.5N260N260-L262 PolarHBondContact O-N 3.03Å; N260-L262 WeakPolarHBondContact OD1-CB 2.92Å; N260-L262 PolarHBondContact OD1-N 3.09Å
263N95.9Very high96.2Very high92 Ų9263.1 Ų63.149%0.49234%0.344SS..  trans-128.7101.2-179.4-174.515.4000110.9Q137 W141 N260Q137-N263 PolarHBondContact NE2-O 3.01Å; W141-N263 PolarHBondContact NE1-O 2.76Å; N260-N263 HydrophobicContact CB-CB 4.17Å; N260-N263 PolarHBondContact O-N 2.72Å; N260-N263 VanDerWaalsContact O-N 3.09Å
264T94.4Very high96.3Very high74 Ų7460 Ų6045%0.45432%0.321SS..  trans-79128.5179.3-48.10000110.8W141 I268W141-T264 HydrophobicContact CD2-CG2 4.18Å; W141-T264 HydrophobicContact CE3-CG2 4.16Å; W141-T264 HydrophobicContact CH2-CG2 4.49Å; W141-T264 VanDerWaalsContact CH2-OG1 3.26Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.34Å; W141-T264 HydrophobicContact CZ2-CG2 4.49Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.23Å; W141-T264 HydrophobicContact CZ3-CG2 4.33Å; T264-I268 HydrophobicContact CG2-CD1 3.41Å; T264-I268 VanDerWaalsContact CG2-CD1 3.41Å; T264-I268 HydrophobicContact CG2-CG1 4.23Å
265P94.1Very high96.4Very high11 Ų1158.3 Ų58.37%0.07131%0.312CS..  trans-57.2151173.2-28.335.7000112.6Q137 M138 W141 H267 I268Q137-P265 HydrophobicContact CB-CG 3.86Å; M138-P265 HydrophobicContact CE-CB 3.48Å; M138-P265 VanDerWaalsContact CE-CB 3.48Å; M138-P265 HydrophobicContact CE-CG 4Å; W141-P265 HydrophobicContact CG-CG 4.36Å; P265-H267 VanDerWaalsContact C-N 3.25Å; P265-H267 PolarHBondContact O-N 2.84Å; P265-I268 HydrophobicContact CB-CG1 4.37Å
266P90.9Very high96.4Very high133 Ų13358.4 Ų58.486%0.86431%0.311SS*.SBendtrans-58.1-34.8-178.7-24.833.8000114
267H92.6Very high96.5Very high50 Ų5053.6 Ų53.623%0.23129%0.293CS..SBendtrans-142.392.6-179.5-173.3-130.8000111.6P265 K269 G340 Q341P265-H267 VanDerWaalsContact C-N 3.25Å; P265-H267 PolarHBondContact O-N 2.84Å; H267-K269 PolarHBondContact O-N 3.23Å; H267-G340 PolarHBondContact CE1-O 3.31Å; H267-G340 VanDerWaalsContact CE1-O 3.26Å; H267-Q341 PolarHBondContact NE2-O 3.41Å
268I94.3Very high96.5Very high31 Ų3152 Ų5216%0.15928%0.28CS..  trans-74.1122.3175.1-57.1161.4000109.5W141 V145 T264 P265 Y278W141-I268 HydrophobicContact CB-CD1 3.75Å; W141-I268 HydrophobicContact CB-CG1 3.91Å; W141-I268 HydrophobicContact CB-CG2 4.15Å; W141-I268 HydrophobicContact CD2-CD1 4.32Å; W141-I268 HydrophobicContact CE3-CD1 4.22Å; W141-I268 HydrophobicContact CG-CD1 4.16Å; V145-I268 HydrophobicContact CG2-CD1 4.23Å; V145-I268 HydrophobicContact CG2-CG2 4.32Å; T264-I268 HydrophobicContact CG2-CD1 3.41Å; T264-I268 VanDerWaalsContact CG2-CD1 3.41Å; T264-I268 HydrophobicContact CG2-CG1 4.23Å; P265-I268 HydrophobicContact CB-CG1 4.37Å; I268-Y278 PolarHBondContact O-OH 3.02Å
269K95.2Very high96.6Very high59 Ų5947.3 Ų47.326%0.25726%0.255SS..  trans-143.6153176.860.3-177.1174.7-179.40109.4D252 H267 L275 Y278D252-K269 WeakPolarHBondContact OD2-CE 3.36Å; D252-K269 IonicContact OD2-NZ 3.45Å; D252-K269 PolarHBondContact OD2-NZ 2.79Å; H267-K269 PolarHBondContact O-N 3.23Å; K269-L275 HydrophobicContact CB-CD2 4.15Å; K269-Y278 HydrophobicContact CB-CE1 4.49Å
270P96.9Very high96.6Very high21 Ų2146.7 Ų46.714%0.13625%0.25CC..  trans-77.3173.9170.736.2-37000111.1F274 L275 Y278P270-F274 HydrophobicContact CB-CB 3.79Å; P270-F274 HydrophobicContact CB-CD2 4.15Å; P270-F274 HydrophobicContact CB-CG 4.4Å; P270-F274 HydrophobicContact CG-CB 3.71Å; P270-L275 HydrophobicContact CG-CD2 4.11Å; P270-L275 WeakPolarHBondContact O-CD2 3.48Å; P270-Y278 HydrophobicContact CG-CD2 4.49Å; P270-Y278 HydrophobicContact CG-CG 4.11Å
271E97.9Very high96.7Very high22 Ų2244.5 Ų44.510%0.10324%0.238CC..  trans-57.9156.6171.7-69.3-67.9109.200112.8Y131 Y273 F274Y131-E271 HydrophobicContact CD1-CG 4.22Å; Y131-E271 HydrophobicContact CD2-CG 3.46Å; Y131-E271 VanDerWaalsContact CD2-CG 3.46Å; Y131-E271 HydrophobicContact CE1-CG 4.16Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.1Å; Y131-E271 HydrophobicContact CG-CG 3.87Å; Y131-E271 PolarHBondContact OH-OE1 3.46Å; E271-Y273 HydrophobicContact CB-CD1 4.17Å; E271-Y273 HydrophobicContact CB-CE1 3.54Å; E271-Y273 HydrophobicContact CB-CE2 4.12Å; E271-Y273 HydrophobicContact CG-CE1 4.28Å; E271-Y273 PolarHBondContact O-N 2.81Å; E271-F274 PolarHBondContact O-N 3.36Å
272W98.6Very high96.8Very high63 Ų6343 Ų4324%0.23922%0.222CC..G310 helixtrans-53.5-36.8-166.671.1-93.6000114.2S88 F91 I92 F95 F274 L275S88-W272 WeakPolarHBondContact O-CZ2 3.34Å; S88-W272 PolarHBondContact OG-NE1 3.25Å; F91-W272 HydrophobicContact CB-CH2 4.08Å; F91-W272 HydrophobicContact CB-CZ2 4.15Å; I92-W272 HydrophobicContact CD1-CH2 4.47Å; I92-W272 HydrophobicContact CD1-CZ2 4.28Å; I92-W272 HydrophobicContact CG1-CH2 3.53Å; I92-W272 HydrophobicContact CG1-CZ2 3.71Å; F95-W272 HydrophobicContact CD2-CH2 4.22Å; F95-W272 HydrophobicContact CD2-CZ3 4.15Å; F95-W272 HydrophobicContact CE2-CH2 4.06Å; F95-W272 AromaticContact CE2-CZ3 3.84Å; F95-W272 HydrophobicContact CE2-CZ3 3.84Å; W272-F274 PolarHBondContact O-N 3.49Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.45Å; W272-L275 PolarHBondContact O-N 2.77Å; W272-L275 VanDerWaalsContact O-N 3.11Å
273Y98.5Very high96.8Very high9 Ų935.9 Ų35.94%0.03519%0.186CC..G310 helixtrans-70.6-8.4-178.846.6-96000114F91 F95 A127 E271F91-Y273 HydrophobicContact CB-CD1 4.28Å; F91-Y273 HydrophobicContact CB-CG 3.99Å; F91-Y273 AromaticContact CD1-CD2 3.95Å; F91-Y273 HydrophobicContact CD1-CD2 3.95Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.78Å; F91-Y273 HydrophobicContact CD2-CD1 3.78Å; F91-Y273 AromaticContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CE1 4.09Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.87Å; F91-Y273 HydrophobicContact CE1-CD2 3.87Å; F91-Y273 HydrophobicContact CE1-CG 4.4Å; F91-Y273 HydrophobicContact CE2-CD1 4.4Å; F91-Y273 AromaticContact CE2-CD2 3.45Å; F91-Y273 HydrophobicContact CE2-CD2 3.45Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.45Å; F91-Y273 HydrophobicContact CE2-CE1 4.43Å; F91-Y273 AromaticContact CE2-CE2 3.41Å; F91-Y273 HydrophobicContact CE2-CE2 3.41Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.41Å; F91-Y273 AromaticContact CE2-CG 3.97Å; F91-Y273 HydrophobicContact CE2-CG 3.97Å; F91-Y273 AromaticContact CE2-CZ 3.97Å; F91-Y273 HydrophobicContact CG-CD1 4.1Å; F91-Y273 AromaticContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CE2 4.49Å; F91-Y273 AromaticContact CG-CG 3.55Å; F91-Y273 HydrophobicContact CG-CG 3.55Å; F91-Y273 AromaticContact CZ-CD2 3.63Å; F91-Y273 HydrophobicContact CZ-CD2 3.63Å; F91-Y273 AromaticContact CZ-CE2 3.82Å; F91-Y273 HydrophobicContact CZ-CE2 3.82Å; F91-Y273 HydrophobicContact CZ-CG 4.39Å; F95-Y273 WeakPolarHBondContact CZ-O 3.5Å; A127-Y273 HydrophobicContact CB-CE2 3.97Å; E271-Y273 HydrophobicContact CB-CD1 4.17Å; E271-Y273 HydrophobicContact CB-CE1 3.54Å; E271-Y273 HydrophobicContact CB-CE2 4.12Å; E271-Y273 HydrophobicContact CG-CE1 4.28Å; E271-Y273 PolarHBondContact O-N 2.81Å
274F98.6Very high96.9Very high28 Ų2834 Ų3412%0.12318%0.177CC..G310 helixtrans-103.6-9.6171.3-66.6-58.7000113.9M124 F128 P270 E271 W272 F276 A277 Y278M124-F274 HydrophobicContact CB-CE1 3.84Å; M124-F274 HydrophobicContact CB-CZ 4.25Å; M124-F274 HydrophobicContact CE-CD1 3.63Å; M124-F274 HydrophobicContact CE-CE1 3.48Å; M124-F274 VanDerWaalsContact CE-CE1 3.48Å; M124-F274 HydrophobicContact CG-CE1 3.84Å; M124-F274 WeakPolarHBondContact O-CZ 3.46Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.18Å; P270-F274 HydrophobicContact CB-CB 3.79Å; P270-F274 HydrophobicContact CB-CD2 4.15Å; P270-F274 HydrophobicContact CB-CG 4.4Å; P270-F274 HydrophobicContact CG-CB 3.71Å; E271-F274 PolarHBondContact O-N 3.36Å; W272-F274 PolarHBondContact O-N 3.49Å; F274-F276 VanDerWaalsContact C-N 3.29Å; F274-F276 PolarHBondContact O-N 2.85Å; F274-A277 PolarHBondContact O-N 3.03Å; F274-Y278 PolarHBondContact O-N 3.38Å
275L98.7Very high97Very high17 Ų1736.7 Ų36.79%0.08920%0.196CC..Hα-helixtrans-62.7-33.9-170.2-67.4178.2000113.2K269 P270 W272 A277 Y278 T279 T336K269-L275 HydrophobicContact CB-CD2 4.15Å; P270-L275 HydrophobicContact CG-CD2 4.11Å; P270-L275 WeakPolarHBondContact O-CD2 3.48Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.45Å; W272-L275 PolarHBondContact O-N 2.77Å; W272-L275 VanDerWaalsContact O-N 3.11Å; L275-A277 PolarHBondContact O-N 3.04Å; L275-Y278 HydrophobicContact CD2-CD1 4.41Å; L275-Y278 PolarHBondContact O-N 3.17Å; L275-T279 PolarHBondContact O-N 3.2Å; L275-T279 PolarHBondContact O-OG1 2.96Å; L275-T336 HydrophobicContact CB-CG2 4.08Å; L275-T336 WeakPolarHBondContact CB-O 3.43Å; L275-T336 HydrophobicContact CD1-CG2 4.34Å
276F98.9Very high97.2Very high22 Ų2240.7 Ų40.710%0.09622%0.217CC..Hα-helixtrans-61-45.417880.8-84.1000111.9F95 F274 T279 I280 L332 L335F95-F276 HydrophobicContact CE1-CE1 4.41Å; F95-F276 HydrophobicContact CZ-CE1 4.27Å; F274-F276 VanDerWaalsContact C-N 3.29Å; F274-F276 PolarHBondContact O-N 2.85Å; F276-T279 PolarHBondContact O-N 3.32Å; F276-I280 PolarHBondContact O-N 2.92Å; F276-L332 HydrophobicContact CB-CD2 4.19Å; F276-L332 HydrophobicContact CD2-CD2 3.65Å; F276-L332 HydrophobicContact CE2-CD2 4.33Å; F276-L332 HydrophobicContact CG-CD2 4.04Å; F276-L335 HydrophobicContact CB-CB 3.92Å
277A98.6Very high97.4Very high3 Ų339 Ų393%0.02520%0.196CC..Hα-helixtrans-72.4-36.1178.300000111F274 L275 T279 I280 L281 L294F274-A277 PolarHBondContact O-N 3.03Å; L275-A277 PolarHBondContact O-N 3.04Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.12Å; A277-I280 PolarHBondContact O-N 2.77Å; A277-I280 VanDerWaalsContact O-N 3.14Å; A277-L281 PolarHBondContact O-N 2.78Å; A277-L294 HydrophobicContact CB-CD1 4.11Å; A277-L294 HydrophobicContact CB-CG 4.29Å
278Y98.6Very high97.6Very high36 Ų3639.5 Ų39.514%0.14120%0.2CC..Hα-helixtrans-60.3-37.4173.4179.5-115.2000112.2I268 K269 P270 F274 L275 L281 R282I268-Y278 PolarHBondContact O-OH 3.02Å; K269-Y278 HydrophobicContact CB-CE1 4.49Å; P270-Y278 HydrophobicContact CG-CD2 4.49Å; P270-Y278 HydrophobicContact CG-CG 4.11Å; F274-Y278 PolarHBondContact O-N 3.38Å; L275-Y278 HydrophobicContact CD2-CD1 4.41Å; L275-Y278 PolarHBondContact O-N 3.17Å; Y278-L281 HydrophobicContact CD2-CD2 4.12Å; Y278-L281 HydrophobicContact CE2-CD2 4.44Å; Y278-L281 WeakPolarHBondContact O-CB 3.26Å; Y278-L281 PolarHBondContact O-N 3.11Å; Y278-R282 VanDerWaalsContact O-CG 3.3Å; Y278-R282 WeakPolarHBondContact O-CG 3.15Å; Y278-R282 PolarHBondContact O-N 3.36Å
279T98.8Very high97.8Very high0 Ų039 Ų390%020%0.203CC..Hα-helixtrans-63.3-44.9171.5-63.20000112L275 F276 A277 L281 R282 S283 L335 I338 G339L275-T279 PolarHBondContact O-N 3.2Å; L275-T279 PolarHBondContact O-OG1 2.96Å; F276-T279 PolarHBondContact O-N 3.32Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.12Å; T279-L281 VanDerWaalsContact C-N 3.32Å; T279-L281 PolarHBondContact O-N 3.3Å; T279-R282 VanDerWaalsContact O-CG 3.22Å; T279-R282 WeakPolarHBondContact O-CG 3.24Å; T279-R282 PolarHBondContact O-N 3.34Å; T279-S283 PolarHBondContact O-N 2.96Å; T279-S283 PolarHBondContact O-OG 3.48Å; T279-L335 WeakPolarHBondContact CB-O 3.5Å; T279-L335 HydrophobicContact CG2-CD2 3.5Å; T279-L335 VanDerWaalsContact CG2-CD2 3.5Å; T279-L335 PolarHBondContact OG1-O 3.48Å; T279-I338 HydrophobicContact CG2-CB 4.02Å; T279-I338 HydrophobicContact CG2-CG2 3.63Å; T279-G339 WeakPolarHBondContact OG1-CA 3.44Å; T279-G339 PolarHBondContact OG1-N 3.17Å
280I98.8Very high97.9Very high1 Ų136.3 Ų36.31%0.00519%0.191CC..Hα-helixtrans-62-41.3178.3-67.1170.8000111.2F276 A277 R282 S283 A293 S297 L335 Y358 F359F276-I280 PolarHBondContact O-N 2.92Å; A277-I280 PolarHBondContact O-N 2.77Å; A277-I280 VanDerWaalsContact O-N 3.14Å; I280-R282 PolarHBondContact O-N 3.31Å; I280-S283 PolarHBondContact O-N 3.19Å; I280-A293 HydrophobicContact CG2-CB 3.78Å; I280-S297 VanDerWaalsContact CD1-CB 3.41Å; I280-L335 HydrophobicContact CD1-CD1 4.07Å; I280-L335 HydrophobicContact CG1-CD1 4.23Å; I280-L335 HydrophobicContact CG1-CD2 4.16Å; I280-Y358 HydrophobicContact CD1-CD1 3.93Å; I280-Y358 HydrophobicContact CD1-CE1 4.26Å; I280-Y358 HydrophobicContact CD1-CG 4.26Å; I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.32Å
281L98.4Very high98Very high19 Ų1935.9 Ų35.910%0.09919%0.188CC..Hα-helixtrans-53.7-53174.5169.865.7000111.9L149 A277 Y278 T279 S283 G290 V291 L294L149-L281 HydrophobicContact CD1-CD1 4.32Å; L149-L281 HydrophobicContact CD1-CD2 3.69Å; L149-L281 HydrophobicContact CD2-CD1 4.22Å; L149-L281 HydrophobicContact CD2-CD2 4.15Å; A277-L281 PolarHBondContact O-N 2.78Å; Y278-L281 HydrophobicContact CD2-CD2 4.12Å; Y278-L281 HydrophobicContact CE2-CD2 4.44Å; Y278-L281 WeakPolarHBondContact O-CB 3.26Å; Y278-L281 PolarHBondContact O-N 3.11Å; T279-L281 VanDerWaalsContact C-N 3.32Å; T279-L281 PolarHBondContact O-N 3.3Å; L281-S283 VanDerWaalsContact C-N 3.34Å; L281-S283 PolarHBondContact O-N 3.3Å; L281-G290 WeakPolarHBondContact CD1-O 3.32Å; L281-G290 WeakPolarHBondContact O-CA 2.93Å; L281-V291 HydrophobicContact CD1-CG2 4.23Å; L281-L294 HydrophobicContact CB-CB 4.11Å; L281-L294 HydrophobicContact CB-CD1 3.9Å; L281-L294 HydrophobicContact CD2-CD1 4.23Å
282R97.2Very high98Very high50 Ų5039 Ų3919%0.18921%0.206CC..Hα-helixtrans-78.6-14.1-174.465.2-169-79.4-175-20.4114.2Y278 T279 I280 V284 Q341 P342Y278-R282 VanDerWaalsContact O-CG 3.3Å; Y278-R282 WeakPolarHBondContact O-CG 3.15Å; Y278-R282 PolarHBondContact O-N 3.36Å; T279-R282 VanDerWaalsContact O-CG 3.22Å; T279-R282 WeakPolarHBondContact O-CG 3.24Å; T279-R282 PolarHBondContact O-N 3.34Å; I280-R282 PolarHBondContact O-N 3.31Å; R282-V284 VanDerWaalsContact C-N 3.26Å; R282-V284 PolarHBondContact O-N 2.8Å; R282-Q341 PolarHBondContact NH1-O 2.87Å; R282-Q341 PolarHBondContact NH2-O 3.45Å; R282-P342 PolarHBondContact NH2-O 2.85Å
283S98Very high98Very high13 Ų1336.7 Ų36.79%0.09120%0.2CC..Hα-helixtrans-68.3-26.3175.3-70.40000112.8T279 I280 L281 G351 Q352 S355T279-S283 PolarHBondContact O-N 2.96Å; T279-S283 PolarHBondContact O-OG 3.48Å; I280-S283 PolarHBondContact O-N 3.19Å; L281-S283 VanDerWaalsContact C-N 3.34Å; L281-S283 PolarHBondContact O-N 3.3Å; S283-G351 PolarHBondContact OG-O 2.82Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; S283-Q352 WeakPolarHBondContact O-CG 3.24Å; S283-Q352 PolarHBondContact O-NE2 3.13Å; S283-Q352 PolarHBondContact OG-N 2.9Å; S283-S355 WeakPolarHBondContact CB-OG 3.28Å; S283-S355 PolarHBondContact OG-OG 2.95Å
284V98Very high97.9Very high52 Ų5238 Ų3832%0.31521%0.207SC..SBendtrans-92.2117.9-179.8-175.70000109.9R282 N286 A293R282-V284 VanDerWaalsContact C-N 3.26Å; R282-V284 PolarHBondContact O-N 2.8Å; V284-N286 HydrophobicContact CG1-CB 4.25Å; V284-N286 PolarHBondContact O-N 3.34Å; V284-A293 HydrophobicContact CG2-CB 3.89Å
285P96.1Very high97.9Very high130 Ų13040.6 Ų40.684%0.84422%0.222SC*.SBendtrans-78.844.4-178.934.8-37.1000112.3
286N97.6Very high97.9Very high95 Ų9544.3 Ų44.351%0.50824%0.241SC..SBendtrans-151.9129.6176.2179.8-80.5000108.8V284 L288 G289 G290V284-N286 HydrophobicContact CG1-CB 4.25Å; V284-N286 PolarHBondContact O-N 3.34Å; N286-L288 PolarHBondContact O-N 3.21Å; N286-L288 PolarHBondContact OD1-N 3.06Å; N286-L288 VanDerWaalsContact OD1-N 3.08Å; N286-G289 PolarHBondContact O-N 2.98Å; N286-G289 PolarHBondContact OD1-N 3.25Å; N286-G290 PolarHBondContact O-N 2.93Å
287K95Very high97.9Very high97 Ų9743.4 Ų43.442%0.42224%0.237SC..Hα-helixtrans-58-52.9-175.7-168-175.2177.8179.50112.2N148 S151 A152 G290 V291N148-K287 WeakPolarHBondContact O-CE 3.3Å; N148-K287 PolarHBondContact O-NZ 3.04Å; S151-K287 PolarHBondContact OG-NZ 2.91Å; A152-K287 HydrophobicContact CB-CD 3.99Å; A152-K287 HydrophobicContact CB-CG 3.91Å; K287-G290 PolarHBondContact O-N 3.06Å; K287-V291 VanDerWaalsContact O-CG2 3.31Å; K287-V291 WeakPolarHBondContact O-CG2 3.37Å; K287-V291 PolarHBondContact O-N 3.1Å; K287-V291 VanDerWaalsContact O-N 3.08Å
288L97Very high97.9Very high61 Ų6144 Ų4432%0.31924%0.24SC..Hα-helixtrans-65.3-44.6180176.960.1000111.3A152 P154 N286 G290 V291 L292A152-L288 HydrophobicContact CB-CB 4.26Å; A152-L288 HydrophobicContact CB-CD1 4.36Å; P154-L288 HydrophobicContact CG-CD2 4.46Å; N286-L288 PolarHBondContact O-N 3.21Å; N286-L288 PolarHBondContact OD1-N 3.06Å; N286-L288 VanDerWaalsContact OD1-N 3.08Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3Å; L288-V291 PolarHBondContact O-N 3.14Å; L288-L292 HydrophobicContact CD1-CD1 4.28Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.15Å; L288-L292 HydrophobicContact CG-CG 4.47Å; L288-L292 WeakPolarHBondContact O-CG 3.43Å; L288-L292 PolarHBondContact O-N 3.12Å
289G98.3Very high97.8Very high22 Ų2245.9 Ų45.923%0.22725%0.252CS..Hα-helixtrans-58.6-42.8177.600000112.7N286 L292 A293N286-G289 PolarHBondContact O-N 2.98Å; N286-G289 PolarHBondContact OD1-N 3.25Å; G289-L292 PolarHBondContact O-N 3.07Å; G289-A293 WeakPolarHBondContact O-CB 3.17Å; G289-A293 PolarHBondContact O-N 2.92Å
290G98Very high97.8Very high1 Ų146.3 Ų46.31%0.0125%0.254CS..Hα-helixtrans-65-41.9175.200000112.6L281 N286 K287 L288 A293 L294L281-G290 WeakPolarHBondContact CD1-O 3.32Å; L281-G290 WeakPolarHBondContact O-CA 2.93Å; N286-G290 PolarHBondContact O-N 2.93Å; K287-G290 PolarHBondContact O-N 3.06Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3Å; G290-A293 PolarHBondContact O-N 2.86Å; G290-L294 WeakPolarHBondContact O-CB 3.35Å; G290-L294 PolarHBondContact O-N 3.24Å
291V97.8Very high97.8Very high12 Ų1247 Ų477%0.07326%0.258CS..Hα-helixtrans-61.9-44.4175.7172.10000111.2L149 A152 L281 K287 L288 L294 L295L149-V291 HydrophobicContact CB-CG2 3.74Å; L149-V291 HydrophobicContact CD2-CG2 4.03Å; L149-V291 HydrophobicContact CG-CG2 4.31Å; A152-V291 HydrophobicContact CB-CG2 4.33Å; L281-V291 HydrophobicContact CD1-CG2 4.23Å; K287-V291 VanDerWaalsContact O-CG2 3.31Å; K287-V291 WeakPolarHBondContact O-CG2 3.37Å; K287-V291 PolarHBondContact O-N 3.1Å; K287-V291 VanDerWaalsContact O-N 3.08Å; L288-V291 PolarHBondContact O-N 3.14Å; V291-L294 PolarHBondContact O-N 3.42Å; V291-L295 HydrophobicContact CG1-CD1 4.31Å; V291-L295 WeakPolarHBondContact O-CG 3.43Å; V291-L295 PolarHBondContact O-N 2.94Å
292L98.3Very high97.8Very high89 Ų8948.1 Ų48.147%0.46627%0.27SS..Hα-helixtrans-62.9-42.7174.9-67.8175000111.5L288 G289 L294 L295 L296L288-L292 HydrophobicContact CD1-CD1 4.28Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.15Å; L288-L292 HydrophobicContact CG-CG 4.47Å; L288-L292 WeakPolarHBondContact O-CG 3.43Å; L288-L292 PolarHBondContact O-N 3.12Å; G289-L292 PolarHBondContact O-N 3.07Å; L292-L294 PolarHBondContact O-N 2.99Å; L292-L295 PolarHBondContact O-N 2.91Å; L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.39Å; L292-L296 WeakPolarHBondContact O-CG 3.46Å; L292-L296 PolarHBondContact O-N 3.03Å
293A98.4Very high97.8Very high14 Ų1448.5 Ų48.512%0.11628%0.278CS..Hα-helixtrans-62.4-41.2177.900000112.4I280 V284 G289 G290 L296 S297I280-A293 HydrophobicContact CG2-CB 3.78Å; V284-A293 HydrophobicContact CG2-CB 3.89Å; G289-A293 WeakPolarHBondContact O-CB 3.17Å; G289-A293 PolarHBondContact O-N 2.92Å; G290-A293 PolarHBondContact O-N 2.86Å; A293-L296 PolarHBondContact O-N 3.09Å; A293-S297 PolarHBondContact O-N 3.32Å
294L97.9Very high97.9Very high35 Ų3548.8 Ų48.818%0.18328%0.278CS..Hα-helixtrans-63.6-44.2174.4172.6136.5000112.4A277 L281 G290 V291 L292 S297A277-L294 HydrophobicContact CB-CD1 4.11Å; A277-L294 HydrophobicContact CB-CG 4.29Å; L281-L294 HydrophobicContact CB-CB 4.11Å; L281-L294 HydrophobicContact CB-CD1 3.9Å; L281-L294 HydrophobicContact CD2-CD1 4.23Å; G290-L294 WeakPolarHBondContact O-CB 3.35Å; G290-L294 PolarHBondContact O-N 3.24Å; V291-L294 PolarHBondContact O-N 3.42Å; L292-L294 PolarHBondContact O-N 2.99Å; L294-S297 PolarHBondContact O-N 3.5Å; L294-S297 PolarHBondContact O-OG 3.35Å
295L97.6Very high97.8Very high84 Ų8448 Ų4844%0.4427%0.274SS..Hα-helixtrans-63.5-45.2176.1-70.2173.9000110.7V291 L292 S297 I298 L299V291-L295 HydrophobicContact CG1-CD1 4.31Å; V291-L295 WeakPolarHBondContact O-CG 3.43Å; V291-L295 PolarHBondContact O-N 2.94Å; L292-L295 PolarHBondContact O-N 2.91Å; L295-S297 VanDerWaalsContact C-N 3.3Å; L295-S297 PolarHBondContact O-N 2.98Å; L295-I298 PolarHBondContact O-N 3.49Å; L295-L299 WeakPolarHBondContact O-CG 3.23Å; L295-L299 PolarHBondContact O-N 2.69Å
296L98.4Very high97.9Very high95 Ų9547.9 Ų47.950%0.49727%0.265SS..Hα-helixtrans-66.1-29.1178.8-70.9172.2000112.6L292 A293 I298 L299 I300 F359L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.39Å; L292-L296 WeakPolarHBondContact O-CG 3.46Å; L292-L296 PolarHBondContact O-N 3.03Å; A293-L296 PolarHBondContact O-N 3.09Å; L296-I298 PolarHBondContact O-N 2.94Å; L296-I298 VanDerWaalsContact O-N 3.15Å; L296-L299 PolarHBondContact O-N 3.33Å; L296-I300 WeakPolarHBondContact O-CB 3.43Å; L296-I300 WeakPolarHBondContact O-CG2 3.16Å; L296-I300 PolarHBondContact O-N 2.97Å; L296-F359 HydrophobicContact CB-CE1 4.19Å; L296-F359 HydrophobicContact CB-CZ 4.3Å
297S98.4Very high97.9Very high2 Ų245.1 Ų45.11%0.01425%0.25CC..Hα-helixtrans-65.7-16176.169.50000113.7I280 A293 L294 L295 Y358I280-S297 VanDerWaalsContact CD1-CB 3.41Å; A293-S297 PolarHBondContact O-N 3.32Å; L294-S297 PolarHBondContact O-N 3.5Å; L294-S297 PolarHBondContact O-OG 3.35Å; L295-S297 VanDerWaalsContact C-N 3.3Å; L295-S297 PolarHBondContact O-N 2.98Å; S297-Y358 PolarHBondContact O-OH 2.92Å
298I98.4Very high98.1Very high15 Ų1542.4 Ų42.48%0.07724%0.239CC..Hα-helixtrans-102.5-47.3173.8-54.7161.4000109.5L120 L121 M124 L295 L296 I300 L301L120-I298 HydrophobicContact CD2-CG2 3.73Å; L120-I298 HydrophobicContact CG-CG2 4.43Å; L121-I298 HydrophobicContact CD2-CG2 3.79Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; M124-I298 HydrophobicContact CE-CD1 3.41Å; M124-I298 VanDerWaalsContact CE-CD1 3.41Å; M124-I298 HydrophobicContact CE-CG1 4.16Å; M124-I298 HydrophobicContact SD-CD1 3.87Å; M124-I298 HydrophobicContact SD-CG1 4.44Å; M124-I298 HydrophobicContact SD-CG2 4.39Å; L295-I298 PolarHBondContact O-N 3.49Å; L296-I298 PolarHBondContact O-N 2.94Å; L296-I298 VanDerWaalsContact O-N 3.15Å; I298-I300 PolarHBondContact O-N 3.41Å; I298-L301 WeakPolarHBondContact O-CB 3.39Å; I298-L301 WeakPolarHBondContact O-CG 3.49Å; I298-L301 PolarHBondContact O-N 3.34Å
299L98.3Very high98.1Very high76 Ų7643.6 Ų43.640%0.39824%0.243SC..Hα-helixtrans-68.1-16.6-177.3-65.8-180000113.7L121 L295 L296 L301 A302L121-L299 HydrophobicContact CD1-CD2 4.19Å; L295-L299 WeakPolarHBondContact O-CG 3.23Å; L295-L299 PolarHBondContact O-N 2.69Å; L296-L299 PolarHBondContact O-N 3.33Å; L299-L301 PolarHBondContact O-N 2.95Å; L299-L301 VanDerWaalsContact O-N 3.13Å; L299-A302 WeakPolarHBondContact O-CB 3.34Å; L299-A302 PolarHBondContact O-N 3.42Å
300I98.6Very high98.1Very high9 Ų943 Ų435%0.04624%0.236CC..G310 helixtrans-56-27.5172.2-168.5163.7000112.5L296 I298 A302 V303 I304 Y358 F359 I362 L363L296-I300 WeakPolarHBondContact O-CB 3.43Å; L296-I300 WeakPolarHBondContact O-CG2 3.16Å; L296-I300 PolarHBondContact O-N 2.97Å; I298-I300 PolarHBondContact O-N 3.41Å; I300-A302 PolarHBondContact O-N 3.18Å; I300-V303 PolarHBondContact O-N 3.4Å; I300-I304 PolarHBondContact O-N 2.92Å; I300-Y358 HydrophobicContact CG2-CE1 4.14Å; I300-Y358 VanDerWaalsContact CG2-OH 3.25Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.23Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.09Å; I300-I362 HydrophobicContact CD1-CB 3.83Å; I300-I362 HydrophobicContact CD1-CD1 3.95Å; I300-I362 HydrophobicContact CD1-CG2 3.64Å; I300-I362 HydrophobicContact CG1-CD1 4.5Å; I300-I362 HydrophobicContact CG1-CG2 3.81Å; I300-I362 HydrophobicContact CG2-CD1 4.3Å; I300-L363 HydrophobicContact CD1-CD1 4.41Å; I300-L363 HydrophobicContact CD1-CD2 3.73Å; I300-L363 HydrophobicContact CD1-CG 3.87Å; I300-L363 HydrophobicContact CG1-CD2 4.11Å
301L98.6Very high98.1Very high17 Ų1749.1 Ų49.19%0.08926%0.262CS..G310 helixtrans-56.2-32.3173.9-66.2177.4000112.4I98 L102 W113 I117 L120 I298 L299 V303 I304I98-L301 HydrophobicContact CD1-CD1 4.27Å; I98-L301 HydrophobicContact CG2-CD1 4.44Å; I98-L301 HydrophobicContact CG2-CD2 4.17Å; L102-L301 HydrophobicContact CD2-CD2 4.46Å; W113-L301 HydrophobicContact CH2-CD2 4.48Å; W113-L301 HydrophobicContact CZ2-CB 4.15Å; W113-L301 HydrophobicContact CZ2-CD2 4.05Å; W113-L301 PolarHBondContact NE1-O 2.98Å; I117-L301 HydrophobicContact CD1-CB 3.81Å; I117-L301 HydrophobicContact CG1-CB 3.95Å; L120-L301 HydrophobicContact CD2-CD1 3.72Å; I298-L301 WeakPolarHBondContact O-CB 3.39Å; I298-L301 WeakPolarHBondContact O-CG 3.49Å; I298-L301 PolarHBondContact O-N 3.34Å; L299-L301 PolarHBondContact O-N 2.95Å; L299-L301 VanDerWaalsContact O-N 3.13Å; L301-V303 PolarHBondContact O-N 3.37Å; L301-I304 HydrophobicContact CD2-CD1 3.7Å; L301-I304 WeakPolarHBondContact O-CB 3.28Å; L301-I304 PolarHBondContact O-N 2.98Å
302A98.3Very high98.1Very high42 Ų4250.7 Ų50.735%0.34727%0.269SS..G310 helixtrans-70.5-22.8179.100000112.8I117 L299 I300I117-A302 HydrophobicContact CD1-CB 3.87Å; L299-A302 WeakPolarHBondContact O-CB 3.34Å; L299-A302 PolarHBondContact O-N 3.42Å; I300-A302 PolarHBondContact O-N 3.18Å
303V97.8Very high98.1Very high58 Ų5848.5 Ų48.535%0.35226%0.256SS..THydrogen-bonded Turntrans-87.1-17.7-179.5-170.70000111.3I300 L301 I306 L307I300-V303 PolarHBondContact O-N 3.4Å; L301-V303 PolarHBondContact O-N 3.37Å; V303-I306 WeakPolarHBondContact O-CB 3.39Å; V303-I306 PolarHBondContact O-N 3.08Å; V303-L307 HydrophobicContact CB-CD1 4.46Å; V303-L307 HydrophobicContact CG1-CD1 3.94Å; V303-L307 HydrophobicContact CG1-CD2 4.43Å; V303-L307 HydrophobicContact CG1-CG 3.97Å; V303-L307 WeakPolarHBondContact O-CG 3.43Å; V303-L307 PolarHBondContact O-N 3.02Å; V303-L307 VanDerWaalsContact O-N 3.13Å
304I98.1Very high98.1Very high18 Ų1847.9 Ų47.99%0.09225%0.251CS..THydrogen-bonded Turntrans-56.1-44.4-176.2-66-177.5000114L102 F107 W113 I300 L301 I306 L307 H308 I362L102-I304 HydrophobicContact CD2-CD1 3.32Å; L102-I304 HydrophobicContact CD2-CG2 4.02Å; F107-I304 HydrophobicContact CB-CG2 4.46Å; F107-I304 HydrophobicContact CD1-CG2 3.6Å; F107-I304 HydrophobicContact CD2-CG2 3.92Å; F107-I304 HydrophobicContact CE1-CG2 3.67Å; F107-I304 HydrophobicContact CE2-CG2 4.02Å; F107-I304 HydrophobicContact CG-CG2 3.72Å; F107-I304 HydrophobicContact CZ-CG2 3.89Å; W113-I304 HydrophobicContact CZ2-CD1 4.47Å; I300-I304 PolarHBondContact O-N 2.92Å; L301-I304 HydrophobicContact CD2-CD1 3.7Å; L301-I304 WeakPolarHBondContact O-CB 3.28Å; L301-I304 PolarHBondContact O-N 2.98Å; I304-I306 PolarHBondContact O-N 2.58Å; I304-L307 PolarHBondContact O-N 3.48Å; I304-L307 VanDerWaalsContact O-N 3.13Å; I304-H308 PolarHBondContact O-N 3.28Å; I304-I362 HydrophobicContact CG1-CG2 4.25Å
305P97.8Very high98.1Very high35 Ų3546.9 Ų46.923%0.22725%0.246CC..THydrogen-bonded Turntrans-57.8-34.9175.8-24.834.7000113.2F107 H308F107-P305 HydrophobicContact CB-CG 4.3Å; F107-P305 HydrophobicContact CD2-CB 4.28Å; F107-P305 HydrophobicContact CD2-CG 4.16Å; F107-P305 WeakPolarHBondContact O-CG 3.42Å; P305-H308 WeakPolarHBondContact O-CB 3.45Å; P305-H308 PolarHBondContact O-N 3.32Å
306I97.3Very high98.1Very high129 Ų12946.6 Ų46.666%0.66224%0.243SC*.THydrogen-bonded Turntrans-75-30.6-179.5-54.8168.9000111.1V303 I304 H308V303-I306 WeakPolarHBondContact O-CB 3.39Å; V303-I306 PolarHBondContact O-N 3.08Å; I304-I306 PolarHBondContact O-N 2.58Å; I306-H308 PolarHBondContact O-N 3.19Å
307L97.8Very high98.1Very high36 Ų3647.2 Ų47.219%0.18824%0.242CC..THydrogen-bonded Turntrans-80.1-3178.6-62.7170.2000113.3V303 I304 M309 I362 L363V303-L307 HydrophobicContact CB-CD1 4.46Å; V303-L307 HydrophobicContact CG1-CD1 3.94Å; V303-L307 HydrophobicContact CG1-CD2 4.43Å; V303-L307 HydrophobicContact CG1-CG 3.97Å; V303-L307 WeakPolarHBondContact O-CG 3.43Å; V303-L307 PolarHBondContact O-N 3.02Å; V303-L307 VanDerWaalsContact O-N 3.13Å; I304-L307 PolarHBondContact O-N 3.48Å; I304-L307 VanDerWaalsContact O-N 3.13Å; L307-M309 PolarHBondContact O-N 3.34Å; L307-M309 VanDerWaalsContact O-N 3.08Å; L307-I362 HydrophobicContact CD1-CG2 4.19Å; L307-L363 HydrophobicContact CD1-CD2 3.87Å
308H98.1Very high98.1Very high41 Ų4147.3 Ų47.319%0.1924%0.242CC..  trans-75.499.8-178.6-17278.2000111.9F107 L108 I304 P305 I306 S310 Q312F107-H308 HydrophobicContact CE2-CB 3.85Å; F107-H308 AromaticContact CE2-CG 3.98Å; F107-H308 AromaticContact CE2-ND1 3.84Å; F107-H308 HydrophobicContact CZ-CB 4.33Å; F107-H308 AromaticContact CZ-ND1 3.62Å; L108-H308 HydrophobicContact CD2-CB 4.24Å; I304-H308 PolarHBondContact O-N 3.28Å; P305-H308 WeakPolarHBondContact O-CB 3.45Å; P305-H308 PolarHBondContact O-N 3.32Å; I306-H308 PolarHBondContact O-N 3.19Å; H308-S310 PolarHBondContact NE2-O 2.9Å; H308-Q312 PolarHBondContact CE1-O 2.79Å
309M97.8Very high98.1Very high85 Ų8551 Ų5142%0.41927%0.266SS..  trans-101.3-5.9-179.3-60.5-59.9173.600114.3L307 P367 L371 N374L307-M309 PolarHBondContact O-N 3.34Å; L307-M309 VanDerWaalsContact O-N 3.08Å; M309-P367 HydrophobicContact CG-CB 3.98Å; M309-L371 HydrophobicContact CB-CD2 3.82Å; M309-L371 HydrophobicContact CB-CG 3.88Å; M309-L371 HydrophobicContact CG-CD2 4.44Å; M309-L371 HydrophobicContact CG-CG 4.37Å; M309-N374 PolarHBondContact O-ND2 3.2Å
310S98.1Very high98.1Very high9 Ų950.4 Ų50.46%0.06326%0.263CS..  trans-74.5148.7-179.3171.50000111.3H308 Q312 R318H308-S310 PolarHBondContact NE2-O 2.9Å; S310-Q312 WeakPolarHBondContact CB-O 3.15Å; S310-Q312 PolarHBondContact OG-N 3.15Å; S310-Q312 PolarHBondContact OG-O 3.42Å; S310-R318 WeakPolarHBondContact OG-CD 3.5Å; S310-R318 PolarHBondContact OG-NE 3.4Å; S310-R318 PolarHBondContact OG-NH1 2.83Å
311K98Very high98.1Very high131 Ų13150 Ų5057%0.5726%0.262SS*.SBendtrans-88.6-6166.7-31.9-83.5-169.9168.20113.6N374 W379 P380K311-N374 PolarHBondContact N-OD1 3.38Å; K311-W379 VanDerWaalsContact C-CZ3 3.45Å; K311-W379 HydrophobicContact CB-CD2 4.07Å; K311-W379 HydrophobicContact CB-CE3 3.45Å; K311-W379 VanDerWaalsContact CB-CE3 3.45Å; K311-W379 HydrophobicContact CB-CH2 3.71Å; K311-W379 HydrophobicContact CB-CZ2 4.4Å; K311-W379 HydrophobicContact CB-CZ3 3.28Å; K311-W379 HydrophobicContact CG-CB 4.39Å; K311-W379 HydrophobicContact CG-CD2 4.08Å; K311-W379 HydrophobicContact CG-CE3 3.58Å; K311-W379 HydrophobicContact CG-CG 4.5Å; K311-W379 HydrophobicContact CG-CZ3 3.95Å; K311-P380 WeakPolarHBondContact CE-O 3.47Å; K311-P380 PolarHBondContact NZ-O 3.13Å
312Q98.1Very high98.1Very high44 Ų4451.6 Ų51.621%0.20627%0.269CS..SBendtrans-98.7130.7165.5-59.1171.9-42.700109.4H308 S310 R318 W379H308-Q312 PolarHBondContact CE1-O 2.79Å; S310-Q312 WeakPolarHBondContact CB-O 3.15Å; S310-Q312 PolarHBondContact OG-N 3.15Å; S310-Q312 PolarHBondContact OG-O 3.42Å; Q312-R318 HydrophobicContact CB-CG 4.47Å; Q312-W379 HydrophobicContact CB-CH2 4.26Å; Q312-W379 HydrophobicContact CB-CZ3 4.39Å; Q312-W379 HydrophobicContact CG-CH2 3.17Å; Q312-W379 HydrophobicContact CG-CZ2 4.28Å; Q312-W379 HydrophobicContact CG-CZ3 3.5Å
313Q97.9Very high98.2Very high43 Ų4352.9 Ų52.920%0.20128%0.275CS..SBendtrans-66.1-53.9177.7174.8169.7400112G105 L108 N206G105-Q313 PolarHBondContact O-NE2 2.96Å; L108-Q313 HydrophobicContact CD1-CB 4.2Å; L108-Q313 HydrophobicContact CD1-CG 3.75Å; N206-Q313 PolarHBondContact ND2-NE2 2.72Å
314S98.4Very high98.2Very high2 Ų251 Ų511%0.01426%0.263CS..SBendtrans-83.2148.5-177.6174.40000112.4Y104 P208 M316 R318Y104-S314 WeakPolarHBondContact CD1-OG 3.42Å; P208-S314 WeakPolarHBondContact O-CB 3.48Å; P208-S314 PolarHBondContact O-OG 2.86Å; S314-M316 PolarHBondContact O-N 2.85Å; S314-M316 WeakPolarHBondContact OG-CB 3.44Å; S314-M316 PolarHBondContact OG-N 3.44Å; S314-R318 WeakPolarHBondContact O-CD 3.24Å
315M98.6Very high98.2Very high14 Ų1451.7 Ų51.77%0.06926%0.264CS..G310 helixtrans-75.5-5.4170.1-64.9-175.4-174.800113.5Y103 F317 R318 Q322 Y325 M366Y103-M315 HydrophobicContact CD2-CB 4.28Å; Y103-M315 HydrophobicContact CD2-SD 4.28Å; Y103-M315 HydrophobicContact CE1-CB 4.42Å; Y103-M315 HydrophobicContact CE2-CB 4.19Å; Y103-M315 HydrophobicContact CG-CB 4.47Å; Y103-M315 VanDerWaalsContact O-CB 3.29Å; Y103-M315 WeakPolarHBondContact O-CB 3.43Å; Y103-M315 WeakPolarHBondContact O-CG 3.31Å; Y103-M315 PolarHBondContact O-N 3.42Å; M315-F317 PolarHBondContact O-N 2.87Å; M315-R318 PolarHBondContact O-N 3.24Å; M315-Q322 HydrophobicContact CB-CG 4.17Å; M315-Q322 VanDerWaalsContact O-CG 3.26Å; M315-Q322 WeakPolarHBondContact O-CG 3.26Å; M315-Q322 PolarHBondContact O-NE2 2.94Å; M315-Y325 HydrophobicContact SD-CG 4.4Å; M315-M366 HydrophobicContact CE-CE 4.49Å
316M98.1Very high98.3Very high78 Ų7856.9 Ų56.938%0.38428%0.28SS..G310 helixtrans-52.3-33.1-176-178.5166.2177.800114.3P208 L209 S314 Q322P208-M316 HydrophobicContact CB-SD 4.32Å; L209-M316 HydrophobicContact CD2-CE 3.81Å; L209-M316 HydrophobicContact CD2-SD 3.68Å; L209-M316 HydrophobicContact CG-SD 4.5Å; S314-M316 PolarHBondContact O-N 2.85Å; S314-M316 WeakPolarHBondContact OG-CB 3.44Å; S314-M316 PolarHBondContact OG-N 3.44Å; M316-Q322 PolarHBondContact O-NE2 3.45Å
317F98.1Very high98.3Very high107 Ų10754.2 Ų54.247%0.46927%0.266SS..G310 helixtrans-108.618.3179.4-56-62.1000113.7L209 M315 P319L209-F317 HydrophobicContact CD2-CE2 4.05Å; L209-F317 HydrophobicContact CD2-CZ 3.66Å; M315-F317 PolarHBondContact O-N 2.87Å; F317-P319 WeakPolarHBondContact O-CD 3.48Å
318R98.5Very high98.4Very high5 Ų552.9 Ų52.92%0.01926%0.259CS..  trans-125.177.4-171.1-67.9177.552.4-164.10.7111.2S310 Q312 S314 M315 L320 S321 Q322 S370 E373S310-R318 WeakPolarHBondContact OG-CD 3.5Å; S310-R318 PolarHBondContact OG-NE 3.4Å; S310-R318 PolarHBondContact OG-NH1 2.83Å; Q312-R318 HydrophobicContact CB-CG 4.47Å; S314-R318 WeakPolarHBondContact O-CD 3.24Å; M315-R318 PolarHBondContact O-N 3.24Å; R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.03Å; R318-S321 PolarHBondContact NE-OG 3.27Å; R318-S321 PolarHBondContact NH2-OG 3.49Å; R318-S321 PolarHBondContact O-N 3.21Å; R318-S321 VanDerWaalsContact O-N 3.15Å; R318-Q322 WeakPolarHBondContact O-CG 3.36Å; R318-Q322 PolarHBondContact O-N 3.36Å; R318-S370 PolarHBondContact NH2-OG 3.37Å; R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.39Å; R318-E373 WeakPolarHBondContact CB-OE1 3.36Å; R318-E373 WeakPolarHBondContact CB-OE2 3.38Å; R318-E373 IonicContact CZ-OE2 2.92Å; R318-E373 IonicContact NE-OE2 2.77Å; R318-E373 PolarHBondContact NE-OE2 2.9Å; R318-E373 IonicContact NH2-OE2 3.6Å; R318-E373 PolarHBondContact NH2-OE2 3.42Å
319P98.4Very high98.4Very high91 Ų9152.3 Ų52.359%0.59126%0.261SS*.Hα-helixtrans-62.6-34.3-168.124.2-34.3000113.6F317 Q322 S323F317-P319 WeakPolarHBondContact O-CD 3.48Å; P319-Q322 PolarHBondContact O-N 3.22Å; P319-S323 PolarHBondContact O-N 3.39Å; P319-S323 VanDerWaalsContact O-N 3.13Å
320L98.6Very high98.5Very high64 Ų6450.4 Ų50.434%0.33526%0.26SS..Hα-helixtrans-69.5-42.8177.4-60177.8000109.9R318 Q322 S323 L324 I369 I372 E373 M376R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.03Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.37Å; L320-S323 PolarHBondContact O-N 3.02Å; L320-S323 PolarHBondContact O-OG 3.11Å; L320-L324 PolarHBondContact O-N 2.92Å; L320-L324 VanDerWaalsContact O-N 3.13Å; L320-I369 HydrophobicContact CB-CD1 4.45Å; L320-I369 HydrophobicContact CB-CG2 3.43Å; L320-I369 VanDerWaalsContact CB-CG2 3.43Å; L320-I369 HydrophobicContact CD1-CD1 4.37Å; L320-I369 HydrophobicContact CD1-CG2 4.48Å; L320-I372 HydrophobicContact CD1-CG2 4.36Å; L320-E373 HydrophobicContact CB-CG 4.24Å; L320-E373 WeakPolarHBondContact CB-OE1 3.49Å; L320-E373 HydrophobicContact CD1-CG 4.19Å; L320-E373 HydrophobicContact CG-CG 4.49Å; L320-E373 PolarHBondContact N-OE1 3.46Å; L320-M376 HydrophobicContact CD1-SD 4.05Å
321S98.6Very high98.5Very high1 Ų150.2 Ų50.21%0.00726%0.258CS..Hα-helixtrans-64.4-35.9175.2-63.50000113.1R318 S323 L324 Y325 E373R318-S321 PolarHBondContact NE-OG 3.27Å; R318-S321 PolarHBondContact NH2-OG 3.49Å; R318-S321 PolarHBondContact O-N 3.21Å; R318-S321 VanDerWaalsContact O-N 3.15Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 2.78Å; S321-L324 PolarHBondContact O-N 3.41Å; S321-Y325 PolarHBondContact O-N 2.88Å; S321-E373 PolarHBondContact N-OE1 2.9Å; S321-E373 PolarHBondContact OG-OE1 2.82Å; S321-E373 PolarHBondContact OG-OE2 3.15Å
322Q98.8Very high98.6Very high51 Ų5146.5 Ų46.524%0.23824%0.244CC..Hα-helixtrans-60.6-43.9172.9-69.9178.340.400111.7Y103 M315 M316 R318 P319 L320 L324 Y325 W326Y103-Q322 HydrophobicContact CE2-CB 4.5Å; Y103-Q322 HydrophobicContact CE2-CG 3.94Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.43Å; Y103-Q322 PolarHBondContact OH-OE1 2.91Å; M315-Q322 HydrophobicContact CB-CG 4.17Å; M315-Q322 VanDerWaalsContact O-CG 3.26Å; M315-Q322 WeakPolarHBondContact O-CG 3.26Å; M315-Q322 PolarHBondContact O-NE2 2.94Å; M316-Q322 PolarHBondContact O-NE2 3.45Å; R318-Q322 WeakPolarHBondContact O-CG 3.36Å; R318-Q322 PolarHBondContact O-N 3.36Å; P319-Q322 PolarHBondContact O-N 3.22Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.37Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 3.48Å; Q322-Y325 PolarHBondContact O-N 2.85Å; Q322-W326 PolarHBondContact O-N 3.25Å
323S98.6Very high98.6Very high69 Ų6950.5 Ų50.548%0.48327%0.266SS..Hα-helixtrans-61.4-40.9177.375.70000111.9P319 L320 S321 W326 L327P319-S323 PolarHBondContact O-N 3.39Å; P319-S323 VanDerWaalsContact O-N 3.13Å; L320-S323 PolarHBondContact O-N 3.02Å; L320-S323 PolarHBondContact O-OG 3.11Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 2.78Å; S323-W326 PolarHBondContact O-N 2.95Å; S323-L327 WeakPolarHBondContact O-CB 3.36Å; S323-L327 PolarHBondContact O-N 2.95Å
324L98.5Very high98.6Very high17 Ų1751.7 Ų51.79%0.08927%0.273CS..Hα-helixtrans-68.3-36.7175.5-74.2-173.1000113.1L320 S321 Q322 L327 L328 L365 M366 I369L320-L324 PolarHBondContact O-N 2.92Å; L320-L324 VanDerWaalsContact O-N 3.13Å; S321-L324 PolarHBondContact O-N 3.41Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 3.48Å; L324-L327 HydrophobicContact CD2-CD2 4.11Å; L324-L327 PolarHBondContact O-N 3.43Å; L324-L328 WeakPolarHBondContact O-CB 3.46Å; L324-L328 PolarHBondContact O-N 3.44Å; L324-L365 HydrophobicContact CD1-CB 3.74Å; L324-L365 WeakPolarHBondContact CD1-O 3.06Å; L324-L365 HydrophobicContact CD2-CB 4.19Å; L324-L365 HydrophobicContact CD2-CD1 4.24Å; L324-M366 HydrophobicContact CB-CG 4.47Å; L324-M366 HydrophobicContact CD1-CG 4.27Å; L324-I369 HydrophobicContact CD1-CB 3.87Å; L324-I369 HydrophobicContact CD1-CG1 3.51Å; L324-I369 HydrophobicContact CD1-CG2 4.34Å; L324-I369 HydrophobicContact CG-CG1 4.38Å
325Y98.8Very high98.7Very high33 Ų3351.6 Ų51.613%0.12927%0.272CS..Hα-helixtrans-61.1-46.1174.1170.8-91.3000111.3G99 L102 Y103 M315 S321 Q322 L328 A329G99-Y325 WeakPolarHBondContact CA-OH 3.46Å; G99-Y325 WeakPolarHBondContact O-CE2 3.33Å; G99-Y325 PolarHBondContact O-OH 3.47Å; L102-Y325 HydrophobicContact CB-CE2 4.18Å; Y103-Y325 AromaticContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CD2-CG 3.67Å; Y103-Y325 HydrophobicContact CE2-CD1 4.04Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å; M315-Y325 HydrophobicContact SD-CG 4.4Å; S321-Y325 PolarHBondContact O-N 2.88Å; Q322-Y325 PolarHBondContact O-N 2.85Å; Y325-L328 WeakPolarHBondContact O-CB 3.42Å; Y325-L328 PolarHBondContact O-N 2.85Å; Y325-A329 PolarHBondContact O-N 2.76Å
326W98.8Very high98.7Very high145 Ų14552.7 Ų52.755%0.54928%0.28SS..Hα-helixtrans-71.3-31.7178.3-71.6116.6000112.7Q322 S323 A329 A330Q322-W326 PolarHBondContact O-N 3.25Å; S323-W326 PolarHBondContact O-N 2.95Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 3.37Å; W326-A330 WeakPolarHBondContact O-CB 3.41Å; W326-A330 PolarHBondContact O-N 3.35Å
327L98.8Very high98.7Very high72 Ų7255.1 Ų55.138%0.37729%0.285SS..Hα-helixtrans-60.2-46.8168.6-179.464.8000111S323 L324 A329 A330 D331 L357S323-L327 WeakPolarHBondContact O-CB 3.36Å; S323-L327 PolarHBondContact O-N 2.95Å; L324-L327 HydrophobicContact CD2-CD2 4.11Å; L324-L327 PolarHBondContact O-N 3.43Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.48Å; L327-A330 PolarHBondContact O-N 2.95Å; L327-D331 WeakPolarHBondContact O-CB 3.34Å; L327-D331 PolarHBondContact O-N 3.08Å; L327-L357 HydrophobicContact CD1-CD2 4.3Å; L327-L357 HydrophobicContact CD2-CD1 4.34Å; L327-L357 HydrophobicContact CG-CD2 4.5Å
328L98.8Very high98.7Very high9 Ų950.1 Ų50.15%0.04726%0.263CS..Hα-helixtrans-61.7-42.1176.317963.4000111.9L324 Y325 D331 L332 Y358 T361 I362 M366L324-L328 WeakPolarHBondContact O-CB 3.46Å; L324-L328 PolarHBondContact O-N 3.44Å; Y325-L328 WeakPolarHBondContact O-CB 3.42Å; Y325-L328 PolarHBondContact O-N 2.85Å; L328-D331 PolarHBondContact O-N 2.91Å; L328-L332 WeakPolarHBondContact O-CG 3.27Å; L328-L332 PolarHBondContact O-N 3.01Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.95Å; L328-T361 HydrophobicContact CB-CG2 4.1Å; L328-I362 HydrophobicContact CD1-CD1 4.1Å; L328-I362 HydrophobicContact CD1-CG1 4.08Å; L328-I362 HydrophobicContact CD2-CD1 4.21Å; L328-I362 HydrophobicContact CD2-CG1 3.91Å; L328-M366 HydrophobicContact CB-CE 4.36Å; L328-M366 HydrophobicContact CD2-CE 3.77Å
329A98.8Very high98.7Very high28 Ų2849.9 Ų49.923%0.23126%0.262CS..Hα-helixtrans-63.3-43.4176.400000111.8Y325 W326 L327 L332 L333Y325-A329 PolarHBondContact O-N 2.76Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 3.37Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.48Å; A329-L332 PolarHBondContact O-N 3.14Å; A329-L333 WeakPolarHBondContact O-CG 3.26Å; A329-L333 PolarHBondContact O-N 3.08Å
330A98.9Very high98.7Very high46 Ų4646.6 Ų46.638%0.3824%0.244SC..Hα-helixtrans-64.8-40.5175.700000111.9W326 L327 L333 I334W326-A330 WeakPolarHBondContact O-CB 3.41Å; W326-A330 PolarHBondContact O-N 3.35Å; L327-A330 PolarHBondContact O-N 2.95Å; A330-L333 WeakPolarHBondContact O-CB 3.39Å; A330-L333 PolarHBondContact O-N 2.95Å; A330-I334 WeakPolarHBondContact O-CG1 3.04Å; A330-I334 PolarHBondContact O-N 2.93Å
331D98.9Very high98.6Very high4 Ų446 Ų462%0.02124%0.24CC..Hα-helixtrans-63.1-41.2176.6-172.955.6000112L327 L328 L333 I334 L335 A354 L357 Y358L327-D331 WeakPolarHBondContact O-CB 3.34Å; L327-D331 PolarHBondContact O-N 3.08Å; L328-D331 PolarHBondContact O-N 2.91Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.08Å; D331-I334 CarbonylContact O-C 3.52Å; D331-I334 WeakPolarHBondContact O-CB 3.32Å; D331-I334 PolarHBondContact O-N 3.05Å; D331-I334 VanDerWaalsContact O-N 3.14Å; D331-L335 WeakPolarHBondContact O-CG 3.38Å; D331-L335 PolarHBondContact O-N 2.71Å; D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.26Å; D331-A354 VanDerWaalsContact OD1-CB 3.32Å; D331-A354 WeakPolarHBondContact OD1-CB 3.15Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; D331-L357 HydrophobicContact CB-CD2 4.23Å; D331-Y358 VanDerWaalsContact OD2-CA 3.3Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.2Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.25Å; D331-Y358 PolarHBondContact OD2-N 3.01Å; D331-Y358 VanDerWaalsContact OD2-N 3.12Å
332L98.9Very high98.5Very high54 Ų5448.9 Ų48.928%0.28326%0.258SS..Hα-helixtrans-60.9-37.3172-79169000112.9F276 L328 A329 L335 T336 Y358F276-L332 HydrophobicContact CB-CD2 4.19Å; F276-L332 HydrophobicContact CD2-CD2 3.65Å; F276-L332 HydrophobicContact CE2-CD2 4.33Å; F276-L332 HydrophobicContact CG-CD2 4.04Å; L328-L332 WeakPolarHBondContact O-CG 3.27Å; L328-L332 PolarHBondContact O-N 3.01Å; A329-L332 PolarHBondContact O-N 3.14Å; L332-L335 HydrophobicContact CD2-CD1 4.4Å; L332-L335 PolarHBondContact O-N 2.99Å; L332-T336 WeakPolarHBondContact O-CB 3.41Å; L332-T336 PolarHBondContact O-N 3.06Å; L332-T336 PolarHBondContact O-OG1 2.94Å; L332-Y358 HydrophobicContact CD2-CD2 4.03Å; L332-Y358 HydrophobicContact CD2-CE2 3.78Å; L332-Y358 HydrophobicContact CG-CD2 4.38Å; L332-Y358 HydrophobicContact CG-CE2 4.3Å
333L98.8Very high98.3Very high127 Ų12751.4 Ų51.467%0.66528%0.277SS*.Hα-helixtrans-67.2-39.3173.8-67.4173.8000111.4A329 A330 D331 T336 W337A329-L333 WeakPolarHBondContact O-CG 3.26Å; A329-L333 PolarHBondContact O-N 3.08Å; A330-L333 WeakPolarHBondContact O-CB 3.39Å; A330-L333 PolarHBondContact O-N 2.95Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.08Å; L333-T336 PolarHBondContact O-N 3.06Å; L333-W337 WeakPolarHBondContact O-CB 3.24Å; L333-W337 PolarHBondContact O-N 3.47Å
334I98.9Very high98.2Very high69 Ų6950.3 Ų50.335%0.35427%0.269SS..Hα-helixtrans-63.2-48.4173.7-68.3167.5000110.2A330 D331 T336 W337 I338 I350 A354A330-I334 WeakPolarHBondContact O-CG1 3.04Å; A330-I334 PolarHBondContact O-N 2.93Å; D331-I334 CarbonylContact O-C 3.52Å; D331-I334 WeakPolarHBondContact O-CB 3.32Å; D331-I334 PolarHBondContact O-N 3.05Å; D331-I334 VanDerWaalsContact O-N 3.14Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.43Å; I334-W337 HydrophobicContact CG2-CE3 4.42Å; I334-W337 PolarHBondContact O-N 3.44Å; I334-I338 HydrophobicContact CG2-CG1 4.15Å; I334-I338 WeakPolarHBondContact O-CB 3.3Å; I334-I338 VanDerWaalsContact O-CG1 3.28Å; I334-I338 WeakPolarHBondContact O-CG1 3.36Å; I334-I338 PolarHBondContact O-N 3.5Å; I334-I350 HydrophobicContact CG2-CG2 3.99Å; I334-A354 HydrophobicContact CG2-CB 4.09Å
335L98.9Very high98.1Very high0 Ų059 Ų590%030%0.303CS..Hα-helixtrans-57.5-41.4176.2-72.6170.4000111.5F276 T279 I280 D331 L332 G339 A354 Y358F276-L335 HydrophobicContact CB-CB 3.92Å; T279-L335 WeakPolarHBondContact CB-O 3.5Å; T279-L335 HydrophobicContact CG2-CD2 3.5Å; T279-L335 VanDerWaalsContact CG2-CD2 3.5Å; T279-L335 PolarHBondContact OG1-O 3.48Å; I280-L335 HydrophobicContact CD1-CD1 4.07Å; I280-L335 HydrophobicContact CG1-CD1 4.23Å; I280-L335 HydrophobicContact CG1-CD2 4.16Å; D331-L335 WeakPolarHBondContact O-CG 3.38Å; D331-L335 PolarHBondContact O-N 2.71Å; L332-L335 HydrophobicContact CD2-CD1 4.4Å; L332-L335 PolarHBondContact O-N 2.99Å; L335-G339 PolarHBondContact O-N 3.32Å; L335-A354 HydrophobicContact CD2-CB 3.58Å; L335-A354 HydrophobicContact CG-CB 3.95Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.31Å
336T98.8Very high98Very high37 Ų3759.9 Ų59.923%0.22731%0.312CS..Hα-helixtrans-63.4-47.5176.1-57.90000111.1L275 L332 L333 I334 G339 G340L275-T336 HydrophobicContact CB-CG2 4.08Å; L275-T336 WeakPolarHBondContact CB-O 3.43Å; L275-T336 HydrophobicContact CD1-CG2 4.34Å; L332-T336 WeakPolarHBondContact O-CB 3.41Å; L332-T336 PolarHBondContact O-N 3.06Å; L332-T336 PolarHBondContact O-OG1 2.94Å; L333-T336 PolarHBondContact O-N 3.06Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.43Å; T336-G339 PolarHBondContact O-N 2.53Å; T336-G340 PolarHBondContact O-N 3.06Å
337W98.7Very high98Very high129 Ų12954.9 Ų54.949%0.48929%0.294SS..Hα-helixtrans-59.6-49.1177.1165.558.3000112L333 I334 G339 G340 Q341 F347 I350L333-W337 WeakPolarHBondContact O-CB 3.24Å; L333-W337 PolarHBondContact O-N 3.47Å; I334-W337 HydrophobicContact CG2-CE3 4.42Å; I334-W337 PolarHBondContact O-N 3.44Å; W337-G339 VanDerWaalsContact C-N 3.25Å; W337-G339 PolarHBondContact O-N 3.38Å; W337-G340 PolarHBondContact O-N 2.75Å; W337-G340 VanDerWaalsContact O-N 3.12Å; W337-Q341 WeakPolarHBondContact O-CG 3.49Å; W337-F347 HydrophobicContact CH2-CD1 4.36Å; W337-F347 HydrophobicContact CH2-CE1 4.03Å; W337-F347 HydrophobicContact CZ2-CD1 4.36Å; W337-F347 AromaticContact CZ2-CE1 3.73Å; W337-F347 HydrophobicContact CZ2-CE1 3.73Å; W337-I350 HydrophobicContact CH2-CD1 4.44Å; W337-I350 HydrophobicContact CZ3-CG2 4.47Å
338I98.7Very high98Very high2 Ų253.7 Ų53.71%0.0129%0.29CS..Hα-helixtrans-62.2-33.3179.4-66.2-62000111.8T279 I334 G340 Q341 F347 I350T279-I338 HydrophobicContact CG2-CB 4.02Å; T279-I338 HydrophobicContact CG2-CG2 3.63Å; I334-I338 HydrophobicContact CG2-CG1 4.15Å; I334-I338 WeakPolarHBondContact O-CB 3.3Å; I334-I338 VanDerWaalsContact O-CG1 3.28Å; I334-I338 WeakPolarHBondContact O-CG1 3.36Å; I334-I338 PolarHBondContact O-N 3.5Å; I338-G340 PolarHBondContact O-N 3.04Å; I338-Q341 WeakPolarHBondContact O-CB 3.39Å; I338-Q341 PolarHBondContact O-N 3.2Å; I338-F347 HydrophobicContact CD1-CB 4.26Å; I338-F347 HydrophobicContact CD1-CD1 3.73Å; I338-F347 HydrophobicContact CD1-CG 4.45Å; I338-I350 HydrophobicContact CD1-CB 3.85Å; I338-I350 HydrophobicContact CD1-CD1 4.34Å; I338-I350 HydrophobicContact CD1-CG2 3.64Å; I338-I350 HydrophobicContact CG1-CB 4.36Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å
339G98.1Very high98Very high0 Ų057.1 Ų57.10%031%0.308CS..Hα-helixtrans-64-28.3178.900000112.1T279 L335 T336 W337 Q341T279-G339 WeakPolarHBondContact OG1-CA 3.44Å; T279-G339 PolarHBondContact OG1-N 3.17Å; L335-G339 PolarHBondContact O-N 3.32Å; T336-G339 PolarHBondContact O-N 2.53Å; W337-G339 VanDerWaalsContact C-N 3.25Å; W337-G339 PolarHBondContact O-N 3.38Å; G339-Q341 VanDerWaalsContact C-N 3.32Å
340G97.2Very high98Very high21 Ų2158.4 Ų58.422%0.21631%0.31CS..THydrogen-bonded Turntrans-80.1-6.5173.500000114.8H267 T336 W337 I338H267-G340 PolarHBondContact CE1-O 3.31Å; H267-G340 VanDerWaalsContact CE1-O 3.26Å; T336-G340 PolarHBondContact O-N 3.06Å; W337-G340 PolarHBondContact O-N 2.75Å; W337-G340 VanDerWaalsContact O-N 3.12Å; I338-G340 PolarHBondContact O-N 3.04Å
341Q98Very high97.9Very high53 Ų5356.3 Ų56.325%0.24829%0.293CS..SBendtrans-98.8151.6-177.5-57.1-52.7-4200112.8H267 R282 W337 I338 G339 F347H267-Q341 PolarHBondContact NE2-O 3.41Å; R282-Q341 PolarHBondContact NH1-O 2.87Å; R282-Q341 PolarHBondContact NH2-O 3.45Å; W337-Q341 WeakPolarHBondContact O-CG 3.49Å; I338-Q341 WeakPolarHBondContact O-CB 3.39Å; I338-Q341 PolarHBondContact O-N 3.2Å; G339-Q341 VanDerWaalsContact C-N 3.32Å; Q341-F347 HydrophobicContact CB-CB 4.09Å; Q341-F347 HydrophobicContact CB-CD1 3.91Å; Q341-F347 HydrophobicContact CB-CD2 3.69Å; Q341-F347 HydrophobicContact CB-CE1 4.24Å; Q341-F347 HydrophobicContact CB-CE2 4.03Å; Q341-F347 HydrophobicContact CB-CG 3.61Å; Q341-F347 HydrophobicContact CB-CZ 4.28Å; Q341-F347 HydrophobicContact CG-CD1 3.79Å; Q341-F347 HydrophobicContact CG-CD2 4.3Å; Q341-F347 HydrophobicContact CG-CE1 3.79Å; Q341-F347 HydrophobicContact CG-CE2 4.28Å; Q341-F347 HydrophobicContact CG-CG 4.05Å; Q341-F347 HydrophobicContact CG-CZ 4.03Å
342P96Very high97.9Very high60 Ų6059.4 Ų59.439%0.3931%0.307SS..  trans-63.6156.4176.927.2-35.9000112.7R282 S344 F347R282-P342 PolarHBondContact NH2-O 2.85Å; P342-S344 VanDerWaalsContact C-N 3.31Å; P342-S344 PolarHBondContact O-N 3.23Å; P342-F347 HydrophobicContact CG-CD2 4.41Å; P342-F347 HydrophobicContact CG-CE2 4.47Å
343V95.1Very high97.9Very high104 Ų10461.1 Ų61.163%0.6332%0.32SS*.SBendtrans-74.884.6176.3-172.10000109.2
344S96.1Very high97.9Very high46 Ų4655.3 Ų55.332%0.32229%0.29SS..  trans-153163.4-177.558.40000110.9P342 F347 T348P342-S344 VanDerWaalsContact C-N 3.31Å; P342-S344 PolarHBondContact O-N 3.23Å; S344-F347 WeakPolarHBondContact O-CA 3.4Å; S344-F347 PolarHBondContact O-N 3.4Å; S344-T348 PolarHBondContact N-OG1 3.48Å; S344-T348 PolarHBondContact O-N 3.37Å; S344-T348 PolarHBondContact O-OG1 3.4Å
345Y96.1Very high97.9Very high201 Ų20152.5 Ų52.579%0.78828%0.276SS*.THydrogen-bonded Turntrans-68.7136.6170.5-179.9-91.3000110.1I349Y345-I349 HydrophobicContact CD2-CG2 4.47Å; Y345-I349 HydrophobicContact CE2-CG2 4.33Å
346P97.5Very high97.9Very high50 Ų5057 Ų5733%0.32530%0.304SS..THydrogen-bonded Turncis-92.40.52.736.6-35.6000114.7T348 I349 I350P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 2.85Å; P346-I349 HydrophobicContact CB-CG2 4.46Å; P346-I349 WeakPolarHBondContact O-CG2 3.16Å; P346-I349 PolarHBondContact O-N 3.48Å; P346-I350 HydrophobicContact CB-CD1 4.21Å; P346-I350 HydrophobicContact CG-CD1 4.22Å; P346-I350 WeakPolarHBondContact O-CG1 3.42Å; P346-I350 PolarHBondContact O-N 3.47Å; P346-I350 VanDerWaalsContact O-N 3.15Å
347F98.4Very high97.9Very high41 Ų4157.7 Ų57.718%0.1831%0.306CS..Hα-helixtrans-62.1-35-173.2-56.5-55.5000114W337 I338 Q341 P342 S344 I349 I350 G351W337-F347 HydrophobicContact CH2-CD1 4.36Å; W337-F347 HydrophobicContact CH2-CE1 4.03Å; W337-F347 HydrophobicContact CZ2-CD1 4.36Å; W337-F347 AromaticContact CZ2-CE1 3.73Å; W337-F347 HydrophobicContact CZ2-CE1 3.73Å; I338-F347 HydrophobicContact CD1-CB 4.26Å; I338-F347 HydrophobicContact CD1-CD1 3.73Å; I338-F347 HydrophobicContact CD1-CG 4.45Å; Q341-F347 HydrophobicContact CB-CB 4.09Å; Q341-F347 HydrophobicContact CB-CD1 3.91Å; Q341-F347 HydrophobicContact CB-CD2 3.69Å; Q341-F347 HydrophobicContact CB-CE1 4.24Å; Q341-F347 HydrophobicContact CB-CE2 4.03Å; Q341-F347 HydrophobicContact CB-CG 3.61Å; Q341-F347 HydrophobicContact CB-CZ 4.28Å; Q341-F347 HydrophobicContact CG-CD1 3.79Å; Q341-F347 HydrophobicContact CG-CD2 4.3Å; Q341-F347 HydrophobicContact CG-CE1 3.79Å; Q341-F347 HydrophobicContact CG-CE2 4.28Å; Q341-F347 HydrophobicContact CG-CG 4.05Å; Q341-F347 HydrophobicContact CG-CZ 4.03Å; P342-F347 HydrophobicContact CG-CD2 4.41Å; P342-F347 HydrophobicContact CG-CE2 4.47Å; S344-F347 WeakPolarHBondContact O-CA 3.4Å; S344-F347 PolarHBondContact O-N 3.4Å; F347-I349 PolarHBondContact O-N 2.89Å; F347-I350 PolarHBondContact O-N 3.24Å; F347-G351 PolarHBondContact O-N 2.86Å
348T97.9Very high97.9Very high47 Ų4752.1 Ų52.129%0.28829%0.285SS..Hα-helixtrans-59.9-47.3177.2-55.30000111.9S344 P346 G351 Q352S344-T348 PolarHBondContact N-OG1 3.48Å; S344-T348 PolarHBondContact O-N 3.37Å; S344-T348 PolarHBondContact O-OG1 3.4Å; P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 2.85Å; T348-G351 PolarHBondContact O-N 2.98Å; T348-Q352 WeakPolarHBondContact O-CG 3.49Å; T348-Q352 PolarHBondContact O-N 3.1Å; T348-Q352 VanDerWaalsContact O-N 3.09Å
349I98.5Very high97.9Very high81 Ų8154.2 Ų54.242%0.41529%0.294SS..Hα-helixtrans-72.1-36.6-179-173.162.1000111.5Y345 P346 F347 G351 Q352 V353Y345-I349 HydrophobicContact CD2-CG2 4.47Å; Y345-I349 HydrophobicContact CE2-CG2 4.33Å; P346-I349 HydrophobicContact CB-CG2 4.46Å; P346-I349 WeakPolarHBondContact O-CG2 3.16Å; P346-I349 PolarHBondContact O-N 3.48Å; F347-I349 PolarHBondContact O-N 2.89Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 3.4Å; I349-Q352 PolarHBondContact O-N 3.12Å; I349-V353 HydrophobicContact CD1-CG2 4.36Å; I349-V353 HydrophobicContact CG1-CG2 4.41Å; I349-V353 WeakPolarHBondContact O-CG2 3.43Å; I349-V353 PolarHBondContact O-N 2.92Å
350I98.8Very high98Very high54 Ų5456.4 Ų56.428%0.27731%0.308SS..Hα-helixtrans-61.7-45.5174.8-61.1165.5000110.1I334 W337 I338 P346 F347 Q352 V353 A354I334-I350 HydrophobicContact CG2-CG2 3.99Å; W337-I350 HydrophobicContact CH2-CD1 4.44Å; W337-I350 HydrophobicContact CZ3-CG2 4.47Å; I338-I350 HydrophobicContact CD1-CB 3.85Å; I338-I350 HydrophobicContact CD1-CD1 4.34Å; I338-I350 HydrophobicContact CD1-CG2 3.64Å; I338-I350 HydrophobicContact CG1-CB 4.36Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å; P346-I350 HydrophobicContact CB-CD1 4.21Å; P346-I350 HydrophobicContact CG-CD1 4.22Å; P346-I350 WeakPolarHBondContact O-CG1 3.42Å; P346-I350 PolarHBondContact O-N 3.47Å; P346-I350 VanDerWaalsContact O-N 3.15Å; F347-I350 PolarHBondContact O-N 3.24Å; I350-Q352 VanDerWaalsContact C-N 3.33Å; I350-Q352 PolarHBondContact O-N 2.77Å; I350-V353 PolarHBondContact O-N 2.75Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.38Å; I350-A354 PolarHBondContact O-N 3.43Å
351G98.7Very high98.1Very high2 Ų255.4 Ų55.42%0.02130%0.297CS..Hα-helixtrans-59.1-42.6176.800000112.8S283 F347 T348 I349 S355S283-G351 PolarHBondContact OG-O 2.82Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; F347-G351 PolarHBondContact O-N 2.86Å; T348-G351 PolarHBondContact O-N 2.98Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 3.4Å; G351-S355 WeakPolarHBondContact O-CB 3.2Å; G351-S355 PolarHBondContact O-N 2.86Å; G351-S355 PolarHBondContact O-OG 3.46Å
352Q98.8Very high98.1Very high69 Ų6953.3 Ų53.332%0.32229%0.287SS..Hα-helixtrans-63.4-48.4176.6-74.2173.5-24.300112.3S283 T348 I349 I350 S355 V356S283-Q352 WeakPolarHBondContact O-CG 3.24Å; S283-Q352 PolarHBondContact O-NE2 3.13Å; S283-Q352 PolarHBondContact OG-N 2.9Å; T348-Q352 WeakPolarHBondContact O-CG 3.49Å; T348-Q352 PolarHBondContact O-N 3.1Å; T348-Q352 VanDerWaalsContact O-N 3.09Å; I349-Q352 PolarHBondContact O-N 3.12Å; I350-Q352 VanDerWaalsContact C-N 3.33Å; I350-Q352 PolarHBondContact O-N 2.77Å; Q352-S355 PolarHBondContact O-N 2.73Å; Q352-V356 WeakPolarHBondContact O-CG2 3.27Å; Q352-V356 PolarHBondContact O-N 3.48Å
353V98.8Very high98.2Very high90 Ų9054.1 Ų54.155%0.54529%0.288SS..Hα-helixtrans-62.7-45.4178.9172.90000110.9I349 I350 S355 V356 L357I349-V353 HydrophobicContact CD1-CG2 4.36Å; I349-V353 HydrophobicContact CG1-CG2 4.41Å; I349-V353 WeakPolarHBondContact O-CG2 3.43Å; I349-V353 PolarHBondContact O-N 2.92Å; I350-V353 PolarHBondContact O-N 2.75Å; V353-S355 PolarHBondContact O-N 2.67Å; V353-V356 PolarHBondContact O-N 3.25Å; V353-L357 WeakPolarHBondContact O-CB 3.37Å; V353-L357 PolarHBondContact O-N 3Å
354A98.9Very high98.4Very high5 Ų553.7 Ų53.74%0.04128%0.281CS..Hα-helixtrans-61.8-42.2176.300000111.6D331 I334 L335 I350 V356 L357 Y358D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.26Å; D331-A354 VanDerWaalsContact OD1-CB 3.32Å; D331-A354 WeakPolarHBondContact OD1-CB 3.15Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; I334-A354 HydrophobicContact CG2-CB 4.09Å; L335-A354 HydrophobicContact CD2-CB 3.58Å; L335-A354 HydrophobicContact CG-CB 3.95Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.38Å; I350-A354 PolarHBondContact O-N 3.43Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.28Å; A354-L357 WeakPolarHBondContact O-CB 3.38Å; A354-L357 PolarHBondContact O-N 2.55Å; A354-L357 VanDerWaalsContact O-N 3.15Å; A354-Y358 PolarHBondContact O-N 3.38Å
355S98.8Very high98.5Very high10 Ų1054.2 Ų54.27%0.0728%0.28CS..Hα-helixtrans-63.1-40.3177.5-56.60000111.9S283 G351 Q352 V353 F359S283-S355 WeakPolarHBondContact CB-OG 3.28Å; S283-S355 PolarHBondContact OG-OG 2.95Å; G351-S355 WeakPolarHBondContact O-CB 3.2Å; G351-S355 PolarHBondContact O-N 2.86Å; G351-S355 PolarHBondContact O-OG 3.46Å; Q352-S355 PolarHBondContact O-N 2.73Å; V353-S355 PolarHBondContact O-N 2.67Å; S355-F359 VanDerWaalsContact O-CD2 3.29Å; S355-F359 WeakPolarHBondContact O-CD2 3.49Å; S355-F359 PolarHBondContact O-N 3.42Å
356V98.8Very high98.6Very high94 Ų9446.2 Ų46.257%0.5725%0.25SS*.Hα-helixtrans-65.2-43.3173.7171.40000110.7Q352 V353 A354 Y358 T360Q352-V356 WeakPolarHBondContact O-CG2 3.27Å; Q352-V356 PolarHBondContact O-N 3.48Å; V353-V356 PolarHBondContact O-N 3.25Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.28Å; V356-Y358 PolarHBondContact O-N 3.48Å; V356-T360 WeakPolarHBondContact O-CB 3.39Å; V356-T360 PolarHBondContact O-N 3.45Å; V356-T360 PolarHBondContact O-OG1 3.33Å
357L98.8Very high98.7Very high53 Ų5344.5 Ų44.528%0.27724%0.239SC..Hα-helixtrans-61.4-42.6178.7-176.860.3000111.7L327 D331 V353 A354 T360 T361L327-L357 HydrophobicContact CD1-CD2 4.3Å; L327-L357 HydrophobicContact CD2-CD1 4.34Å; L327-L357 HydrophobicContact CG-CD2 4.5Å; D331-L357 HydrophobicContact CB-CD2 4.23Å; V353-L357 WeakPolarHBondContact O-CB 3.37Å; V353-L357 PolarHBondContact O-N 3Å; A354-L357 WeakPolarHBondContact O-CB 3.38Å; A354-L357 PolarHBondContact O-N 2.55Å; A354-L357 VanDerWaalsContact O-N 3.15Å; L357-T360 PolarHBondContact O-N 3.31Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.35Å; L357-T361 PolarHBondContact O-N 2.97Å; L357-T361 PolarHBondContact O-OG1 3.24Å
358Y98.9Very high98.7Very high11 Ų1145.4 Ų45.44%0.04325%0.248CC..Hα-helixtrans-53.2-58.6176.2175.9-97.6000112.1I280 S297 I300 L328 D331 L332 L335 A354 V356 T361 I362I280-Y358 HydrophobicContact CD1-CD1 3.93Å; I280-Y358 HydrophobicContact CD1-CE1 4.26Å; I280-Y358 HydrophobicContact CD1-CG 4.26Å; S297-Y358 PolarHBondContact O-OH 2.92Å; I300-Y358 HydrophobicContact CG2-CE1 4.14Å; I300-Y358 VanDerWaalsContact CG2-OH 3.25Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.23Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.95Å; D331-Y358 VanDerWaalsContact OD2-CA 3.3Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.2Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.25Å; D331-Y358 PolarHBondContact OD2-N 3.01Å; D331-Y358 VanDerWaalsContact OD2-N 3.12Å; L332-Y358 HydrophobicContact CD2-CD2 4.03Å; L332-Y358 HydrophobicContact CD2-CE2 3.78Å; L332-Y358 HydrophobicContact CG-CD2 4.38Å; L332-Y358 HydrophobicContact CG-CE2 4.3Å; L335-Y358 HydrophobicContact CD1-CD2 4.26Å; L335-Y358 HydrophobicContact CD1-CG 4.31Å; A354-Y358 PolarHBondContact O-N 3.38Å; V356-Y358 PolarHBondContact O-N 3.48Å; Y358-T361 PolarHBondContact O-N 3.27Å; Y358-I362 HydrophobicContact CD1-CD1 4.47Å; Y358-I362 HydrophobicContact CD2-CD1 4.25Å; Y358-I362 HydrophobicContact CE1-CD1 3.94Å; Y358-I362 HydrophobicContact CE2-CD1 3.7Å; Y358-I362 PolarHBondContact O-N 3.33Å
359F98.8Very high98.7Very high47 Ų4744.8 Ų44.821%0.20624%0.243CC..Hα-helixtrans-67.3-40.1-178.8-74.5-71.6000112I280 L296 I300 S355 T361 I362 L363I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.32Å; L296-F359 HydrophobicContact CB-CE1 4.19Å; L296-F359 HydrophobicContact CB-CZ 4.3Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.09Å; S355-F359 VanDerWaalsContact O-CD2 3.29Å; S355-F359 WeakPolarHBondContact O-CD2 3.49Å; S355-F359 PolarHBondContact O-N 3.42Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 3.41Å; F359-I362 PolarHBondContact O-N 2.88Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.41Å; F359-L363 VanDerWaalsContact O-CB 3.26Å; F359-L363 WeakPolarHBondContact O-CB 3.44Å; F359-L363 WeakPolarHBondContact O-CG 3.29Å; F359-L363 PolarHBondContact O-N 3.35Å
360T98.8Very high98.7Very high46 Ų4641.1 Ų41.128%0.28223%0.225SC..Hα-helixtrans-64.3-40.5179.3-58.40000111.3V356 L357 I364 L365V356-T360 WeakPolarHBondContact O-CB 3.39Å; V356-T360 PolarHBondContact O-N 3.45Å; V356-T360 PolarHBondContact O-OG1 3.33Å; L357-T360 PolarHBondContact O-N 3.31Å; T360-I364 HydrophobicContact CG2-CB 4.42Å; T360-I364 HydrophobicContact CG2-CD1 4.41Å; T360-I364 WeakPolarHBondContact O-CA 3.27Å; T360-I364 WeakPolarHBondContact O-CB 3.46Å; T360-I364 PolarHBondContact O-N 2.86Å; T360-L365 HydrophobicContact CG2-CD1 4.36Å; T360-L365 HydrophobicContact CG2-CG 4.12Å; T360-L365 PolarHBondContact O-N 2.96Å
361T98.8Very high98.6Very high0 Ų042.6 Ų42.60%023%0.233CC..Iπ-helixtrans-62.3-47.6179.5-60.30000110.9L328 L357 Y358 F359 L365 M366L328-T361 HydrophobicContact CB-CG2 4.1Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.35Å; L357-T361 PolarHBondContact O-N 2.97Å; L357-T361 PolarHBondContact O-OG1 3.24Å; Y358-T361 PolarHBondContact O-N 3.27Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 3.41Å; T361-L365 PolarHBondContact O-N 3.23Å; T361-M366 HydrophobicContact CG2-CE 4.28Å; T361-M366 HydrophobicContact CG2-CG 4.44Å; T361-M366 WeakPolarHBondContact O-CB 3.39Å; T361-M366 WeakPolarHBondContact O-CG 3.32Å; T361-M366 PolarHBondContact O-N 3.35Å
362I98.7Very high98.6Very high8 Ų846.3 Ų46.34%0.04125%0.251CS..Iπ-helixtrans-73.4-50-177.5-61.4167.3000111.6I300 I304 L307 L328 Y358 F359 P367I300-I362 HydrophobicContact CD1-CB 3.83Å; I300-I362 HydrophobicContact CD1-CD1 3.95Å; I300-I362 HydrophobicContact CD1-CG2 3.64Å; I300-I362 HydrophobicContact CG1-CD1 4.5Å; I300-I362 HydrophobicContact CG1-CG2 3.81Å; I300-I362 HydrophobicContact CG2-CD1 4.3Å; I304-I362 HydrophobicContact CG1-CG2 4.25Å; L307-I362 HydrophobicContact CD1-CG2 4.19Å; L328-I362 HydrophobicContact CD1-CD1 4.1Å; L328-I362 HydrophobicContact CD1-CG1 4.08Å; L328-I362 HydrophobicContact CD2-CD1 4.21Å; L328-I362 HydrophobicContact CD2-CG1 3.91Å; Y358-I362 HydrophobicContact CD1-CD1 4.47Å; Y358-I362 HydrophobicContact CD2-CD1 4.25Å; Y358-I362 HydrophobicContact CE1-CD1 3.94Å; Y358-I362 HydrophobicContact CE2-CD1 3.7Å; Y358-I362 PolarHBondContact O-N 3.33Å; F359-I362 PolarHBondContact O-N 2.88Å; I362-P367 WeakPolarHBondContact O-CD 3.45Å
363L98.7Very high98.6Very high77 Ų7743.6 Ų43.640%0.40324%0.238SC..Iπ-helixtrans-80.1-27.9-170.3-61.5178.4000113.6I300 L307 F359 P367I300-L363 HydrophobicContact CD1-CD1 4.41Å; I300-L363 HydrophobicContact CD1-CD2 3.73Å; I300-L363 HydrophobicContact CD1-CG 3.87Å; I300-L363 HydrophobicContact CG1-CD2 4.11Å; L307-L363 HydrophobicContact CD1-CD2 3.87Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.41Å; F359-L363 VanDerWaalsContact O-CB 3.26Å; F359-L363 WeakPolarHBondContact O-CB 3.44Å; F359-L363 WeakPolarHBondContact O-CG 3.29Å; F359-L363 PolarHBondContact O-N 3.35Å; L363-P367 VanDerWaalsContact O-CG 3.31Å; L363-P367 WeakPolarHBondContact O-CG 3.28Å
364I98.7Very high98.6Very high96 Ų9639.8 Ų39.849%0.49222%0.215SC..Iπ-helixtrans-122.1-58-170.3-55177.3000111T360 P367 T368T360-I364 HydrophobicContact CG2-CB 4.42Å; T360-I364 HydrophobicContact CG2-CD1 4.41Å; T360-I364 WeakPolarHBondContact O-CA 3.27Å; T360-I364 WeakPolarHBondContact O-CB 3.46Å; T360-I364 PolarHBondContact O-N 2.86Å; I364-P367 WeakPolarHBondContact O-CD 3.46Å; I364-P367 WeakPolarHBondContact O-CG 3.42Å; I364-T368 HydrophobicContact CG2-CG2 4.44Å; I364-T368 WeakPolarHBondContact O-CB 3.1Å; I364-T368 WeakPolarHBondContact O-CG2 3.36Å; I364-T368 PolarHBondContact O-N 3.1Å; I364-T368 VanDerWaalsContact O-N 3.13Å; I364-T368 PolarHBondContact O-OG1 3.4Å
365L98.7Very high98.6Very high56 Ų5647.2 Ų47.229%0.29325%0.246SC..Iπ-helixtrans-68.5-44.9-170.5-56.8179.3000112.7L324 T360 T361 T368 I369L324-L365 HydrophobicContact CD1-CB 3.74Å; L324-L365 WeakPolarHBondContact CD1-O 3.06Å; L324-L365 HydrophobicContact CD2-CB 4.19Å; L324-L365 HydrophobicContact CD2-CD1 4.24Å; T360-L365 HydrophobicContact CG2-CD1 4.36Å; T360-L365 HydrophobicContact CG2-CG 4.12Å; T360-L365 PolarHBondContact O-N 2.96Å; T361-L365 PolarHBondContact O-N 3.23Å; L365-T368 WeakPolarHBondContact CA-OG1 3.23Å; L365-T368 PolarHBondContact O-N 2.82Å; L365-T368 PolarHBondContact O-OG1 3.36Å; L365-I369 VanDerWaalsContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CB 3.24Å; L365-I369 WeakPolarHBondContact O-CG1 3.28Å; L365-I369 PolarHBondContact O-N 3.5Å
366M98.3Very high98.5Very high33 Ų3352.9 Ų52.916%0.16327%0.273CS..Hα-helixtrans-60.1-51.2178.1-78-173.6173.800113.8M315 L324 L328 T361 S370M315-M366 HydrophobicContact CE-CE 4.49Å; L324-M366 HydrophobicContact CB-CG 4.47Å; L324-M366 HydrophobicContact CD1-CG 4.27Å; L328-M366 HydrophobicContact CB-CE 4.36Å; L328-M366 HydrophobicContact CD2-CE 3.77Å; T361-M366 HydrophobicContact CG2-CE 4.28Å; T361-M366 HydrophobicContact CG2-CG 4.44Å; T361-M366 WeakPolarHBondContact O-CB 3.39Å; T361-M366 WeakPolarHBondContact O-CG 3.32Å; T361-M366 PolarHBondContact O-N 3.35Å; M366-S370 WeakPolarHBondContact O-CB 3.32Å; M366-S370 PolarHBondContact O-N 3.47Å; M366-S370 PolarHBondContact O-OG 2.79Å
367P98.4Very high98.5Very high14 Ų1452.6 Ų52.69%0.09127%0.268CS..Hα-helixtrans-64.9-39.3177.620.3-29.9000112.5M309 I362 L363 I364 S370 L371M309-P367 HydrophobicContact CG-CB 3.98Å; I362-P367 WeakPolarHBondContact O-CD 3.45Å; L363-P367 VanDerWaalsContact O-CG 3.31Å; L363-P367 WeakPolarHBondContact O-CG 3.28Å; I364-P367 WeakPolarHBondContact O-CD 3.46Å; I364-P367 WeakPolarHBondContact O-CG 3.42Å; P367-S370 WeakPolarHBondContact O-CB 3.24Å; P367-S370 PolarHBondContact O-N 3.01Å; P367-L371 WeakPolarHBondContact O-CG 3.41Å; P367-L371 PolarHBondContact O-N 3.36Å; P367-L371 VanDerWaalsContact O-N 3.12Å
368T98.6Very high98.4Very high60 Ų6059.2 Ų59.237%0.36829%0.294SS..Hα-helixtrans-65.4-45.9178.352.20000112.6I364 L365 S370 L371 I372I364-T368 HydrophobicContact CG2-CG2 4.44Å; I364-T368 WeakPolarHBondContact O-CB 3.1Å; I364-T368 WeakPolarHBondContact O-CG2 3.36Å; I364-T368 PolarHBondContact O-N 3.1Å; I364-T368 VanDerWaalsContact O-N 3.13Å; I364-T368 PolarHBondContact O-OG1 3.4Å; L365-T368 WeakPolarHBondContact CA-OG1 3.23Å; L365-T368 PolarHBondContact O-N 2.82Å; L365-T368 PolarHBondContact O-OG1 3.36Å; T368-S370 VanDerWaalsContact C-N 3.3Å; T368-S370 PolarHBondContact O-N 3.06Å; T368-L371 PolarHBondContact O-N 3.42Å; T368-I372 WeakPolarHBondContact O-CG1 3.39Å; T368-I372 PolarHBondContact O-N 2.97Å
369I98.3Very high98.1Very high34 Ų3463 Ų6317%0.17431%0.309CS..Hα-helixtrans-62.4-38.7174.8-73.6-59.7000111.2L320 L324 L365 L371 I372 E373L320-I369 HydrophobicContact CB-CD1 4.45Å; L320-I369 HydrophobicContact CB-CG2 3.43Å; L320-I369 VanDerWaalsContact CB-CG2 3.43Å; L320-I369 HydrophobicContact CD1-CD1 4.37Å; L320-I369 HydrophobicContact CD1-CG2 4.48Å; L324-I369 HydrophobicContact CD1-CB 3.87Å; L324-I369 HydrophobicContact CD1-CG1 3.51Å; L324-I369 HydrophobicContact CD1-CG2 4.34Å; L324-I369 HydrophobicContact CG-CG1 4.38Å; L365-I369 VanDerWaalsContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CB 3.24Å; L365-I369 WeakPolarHBondContact O-CG1 3.28Å; L365-I369 PolarHBondContact O-N 3.5Å; I369-L371 VanDerWaalsContact C-N 3.29Å; I369-L371 PolarHBondContact O-N 3.26Å; I369-I372 HydrophobicContact CD1-CD1 4.08Å; I369-I372 PolarHBondContact O-N 3.04Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I369-E373 HydrophobicContact CG2-CG 4.23Å; I369-E373 WeakPolarHBondContact O-CG 3.49Å; I369-E373 PolarHBondContact O-N 3.38Å
370S98Very high97Very high5 Ų568.6 Ų68.64%0.03535%0.35CS..Hα-helixtrans-56.8-43.6174.8-57.70000111.9R318 M366 P367 T368 N374R318-S370 PolarHBondContact NH2-OG 3.37Å; M366-S370 WeakPolarHBondContact O-CB 3.32Å; M366-S370 PolarHBondContact O-N 3.47Å; M366-S370 PolarHBondContact O-OG 2.79Å; P367-S370 WeakPolarHBondContact O-CB 3.24Å; P367-S370 PolarHBondContact O-N 3.01Å; T368-S370 VanDerWaalsContact C-N 3.3Å; T368-S370 PolarHBondContact O-N 3.06Å; S370-N374 PolarHBondContact O-N 2.94Å; S370-N374 VanDerWaalsContact O-N 3.08Å; S370-N374 PolarHBondContact O-ND2 3.24Å; S370-N374 PolarHBondContact O-OD1 3.45Å
371L98.3Very high96.9Very high85 Ų8569.8 Ų69.845%0.44535%0.353SS..Hα-helixtrans-67.6-37.2176.6-68.6172000112.5M309 P367 T368 I369 K375M309-L371 HydrophobicContact CB-CD2 3.82Å; M309-L371 HydrophobicContact CB-CG 3.88Å; M309-L371 HydrophobicContact CG-CD2 4.44Å; M309-L371 HydrophobicContact CG-CG 4.37Å; P367-L371 WeakPolarHBondContact O-CG 3.41Å; P367-L371 PolarHBondContact O-N 3.36Å; P367-L371 VanDerWaalsContact O-N 3.12Å; T368-L371 PolarHBondContact O-N 3.42Å; I369-L371 VanDerWaalsContact C-N 3.29Å; I369-L371 PolarHBondContact O-N 3.26Å; L371-K375 WeakPolarHBondContact O-CG 3.48Å; L371-K375 PolarHBondContact O-N 2.93Å; L371-K375 VanDerWaalsContact O-N 3.13Å
372I98.4Very high96.8Very high80 Ų8073.4 Ų73.441%0.4137%0.372SS..Hα-helixtrans-64.3-47.7175.7-69.9163.3000110.3L320 T368 I369 N374 K375 M376L320-I372 HydrophobicContact CD1-CG2 4.36Å; T368-I372 WeakPolarHBondContact O-CG1 3.39Å; T368-I372 PolarHBondContact O-N 2.97Å; I369-I372 HydrophobicContact CD1-CD1 4.08Å; I369-I372 PolarHBondContact O-N 3.04Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.13Å; I372-K375 PolarHBondContact O-N 3.26Å; I372-K375 VanDerWaalsContact O-N 3.11Å; I372-M376 HydrophobicContact CG2-CG 4.34Å; I372-M376 HydrophobicContact CG2-SD 3.96Å; I372-M376 WeakPolarHBondContact O-CG 3.08Å; I372-M376 PolarHBondContact O-N 3.26Å
373E98.5Very high96.7Very high11 Ų1177.1 Ų77.15%0.05139%0.39CS..Hα-helixtrans-60.1-41.9178-72.9176.8146.800111.6R318 L320 S321 I369 K375 M376 L377R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.39Å; R318-E373 WeakPolarHBondContact CB-OE1 3.36Å; R318-E373 WeakPolarHBondContact CB-OE2 3.38Å; R318-E373 IonicContact CZ-OE2 2.92Å; R318-E373 IonicContact NE-OE2 2.77Å; R318-E373 PolarHBondContact NE-OE2 2.9Å; R318-E373 IonicContact NH2-OE2 3.6Å; R318-E373 PolarHBondContact NH2-OE2 3.42Å; L320-E373 HydrophobicContact CB-CG 4.24Å; L320-E373 WeakPolarHBondContact CB-OE1 3.49Å; L320-E373 HydrophobicContact CD1-CG 4.19Å; L320-E373 HydrophobicContact CG-CG 4.49Å; L320-E373 PolarHBondContact N-OE1 3.46Å; S321-E373 PolarHBondContact N-OE1 2.9Å; S321-E373 PolarHBondContact OG-OE1 2.82Å; S321-E373 PolarHBondContact OG-OE2 3.15Å; I369-E373 HydrophobicContact CG2-CG 4.23Å; I369-E373 WeakPolarHBondContact O-CG 3.49Å; I369-E373 PolarHBondContact O-N 3.38Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.15Å; E373-M376 PolarHBondContact O-N 3.35Å; E373-L377 WeakPolarHBondContact O-CG 3.2Å; E373-L377 PolarHBondContact O-N 3.32Å; E373-L377 VanDerWaalsContact O-N 3.1Å
374N98.4Very high96.6Very high10 Ų1077.1 Ų77.15%0.05339%0.39CS..Hα-helixtrans-57.2-46.9173.2-68.3-18.7000111.6M309 K311 S370 I372 L377 K378 W379M309-N374 PolarHBondContact O-ND2 3.2Å; K311-N374 PolarHBondContact N-OD1 3.38Å; S370-N374 PolarHBondContact O-N 2.94Å; S370-N374 VanDerWaalsContact O-N 3.08Å; S370-N374 PolarHBondContact O-ND2 3.24Å; S370-N374 PolarHBondContact O-OD1 3.45Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.13Å; N374-L377 CarbonylContact O-C 3.52Å; N374-L377 PolarHBondContact O-N 3.3Å; N374-K378 PolarHBondContact O-N 3.09Å; N374-W379 HydrophobicContact CB-CB 4.32Å; N374-W379 HydrophobicContact CB-CE3 4.37Å; N374-W379 PolarHBondContact O-N 3.03Å
375K98Very high96.5Very high161 Ų16175.9 Ų75.970%0.738%0.383SS*.Hα-helixtrans-65.1-38.7178.8-73.7-179.7179-178.40112.4L371 I372 E373 L377 K378L371-K375 WeakPolarHBondContact O-CG 3.48Å; L371-K375 PolarHBondContact O-N 2.93Å; L371-K375 VanDerWaalsContact O-N 3.13Å; I372-K375 PolarHBondContact O-N 3.26Å; I372-K375 VanDerWaalsContact O-N 3.11Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.15Å; K375-L377 PolarHBondContact O-N 3.27Å; K375-K378 PolarHBondContact O-N 2.86Å
376M98.1Very high96.3Very high129 Ų12977.2 Ų77.264%0.63539%0.389SS*.Hα-helixtrans-60.1-34.8175-70.5173.366.300111.8L320 I372 E373 K378L320-M376 HydrophobicContact CD1-SD 4.05Å; I372-M376 HydrophobicContact CG2-CG 4.34Å; I372-M376 HydrophobicContact CG2-SD 3.96Å; I372-M376 WeakPolarHBondContact O-CG 3.08Å; I372-M376 PolarHBondContact O-N 3.26Å; E373-M376 PolarHBondContact O-N 3.35Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 3.15Å
377L97.8Very high96.2Very high89 Ų8980.4 Ų80.447%0.46641%0.405SS..THydrogen-bonded Turntrans-84.64.6174.8-64177.2000113.8E373 N374 K375 W379E373-L377 WeakPolarHBondContact O-CG 3.2Å; E373-L377 PolarHBondContact O-N 3.32Å; E373-L377 VanDerWaalsContact O-N 3.1Å; N374-L377 CarbonylContact O-C 3.52Å; N374-L377 PolarHBondContact O-N 3.3Å; K375-L377 PolarHBondContact O-N 3.27Å; L377-W379 HydrophobicContact CB-CD2 4.35Å; L377-W379 HydrophobicContact CB-CG 4.45Å; L377-W379 HydrophobicContact CD1-CE3 4.28Å; L377-W379 HydrophobicContact CD1-CZ3 4.29Å; L377-W379 PolarHBondContact O-N 2.82Å
378K96.6Very high96Very high191 Ų19185.5 Ų85.583%0.8343%0.43SS*.THydrogen-bonded Turntrans55.432.7-176.1-53.6178.3-177.9177.20113N374 K375 M376N374-K378 PolarHBondContact O-N 3.09Å; K375-K378 PolarHBondContact O-N 2.86Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 3.15Å
379W93.1Very high95.8Very high91 Ų9187.6 Ų87.635%0.34544%0.435SS..  trans-76.7145.3172.7-81-17.7000112K311 Q312 N374 L377K311-W379 VanDerWaalsContact C-CZ3 3.45Å; K311-W379 HydrophobicContact CB-CD2 4.07Å; K311-W379 HydrophobicContact CB-CE3 3.45Å; K311-W379 VanDerWaalsContact CB-CE3 3.45Å; K311-W379 HydrophobicContact CB-CH2 3.71Å; K311-W379 HydrophobicContact CB-CZ2 4.4Å; K311-W379 HydrophobicContact CB-CZ3 3.28Å; K311-W379 HydrophobicContact CG-CB 4.39Å; K311-W379 HydrophobicContact CG-CD2 4.08Å; K311-W379 HydrophobicContact CG-CE3 3.58Å; K311-W379 HydrophobicContact CG-CG 4.5Å; K311-W379 HydrophobicContact CG-CZ3 3.95Å; Q312-W379 HydrophobicContact CB-CH2 4.26Å; Q312-W379 HydrophobicContact CB-CZ3 4.39Å; Q312-W379 HydrophobicContact CG-CH2 3.17Å; Q312-W379 HydrophobicContact CG-CZ2 4.28Å; Q312-W379 HydrophobicContact CG-CZ3 3.5Å; N374-W379 HydrophobicContact CB-CB 4.32Å; N374-W379 HydrophobicContact CB-CE3 4.37Å; N374-W379 PolarHBondContact O-N 3.03Å; L377-W379 HydrophobicContact CB-CD2 4.35Å; L377-W379 HydrophobicContact CB-CG 4.45Å; L377-W379 HydrophobicContact CD1-CE3 4.28Å; L377-W379 HydrophobicContact CD1-CZ3 4.29Å; L377-W379 PolarHBondContact O-N 2.82Å
380P76.3Confident95.6Very high165 Ų16592.5 Ų92.5100%1.07146%0.458SS*.  trans-68.80-177.729.8-35.7000113.3K311K311-P380 WeakPolarHBondContact CE-O 3.47Å; K311-P380 PolarHBondContact NZ-O 3.13Å

Retrieved 380 of 380 residues in 295.9 ms (Link to these results)

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