A0A077ZKI2_TRITR Loading...

Serpentine receptor class alpha

AlphaFold DB , UniProt , Accession A0A077ZKI2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 405 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
1M46.5Very low43Very low190 Ų190113 Ų11394%0.93659%0.59SS**  0-51.30-151.7165.617700112.6M3 V4 M5M1-M3 PolarHBondContact O-N 2.95Å; M1-V4 PolarHBondContact O-N 3.45Å; M1-M5 PolarHBondContact O-N 3.33Å; M1-M5 VanDerWaalsContact O-N 3.14Å
2A38.5Very low43.8Very low80 Ų80112.4 Ų112.466%0.66159%0.587SS**Hα-helixtrans-57.4-42.2178.100000114.7V4 M5 L6A2-V4 VanDerWaalsContact C-N 3.3Å; A2-V4 PolarHBondContact O-N 2.86Å; A2-M5 PolarHBondContact O-N 2.87Å; A2-L6 WeakPolarHBondContact O-CB 3.36Å; A2-L6 PolarHBondContact O-N 3.02Å
3M30.8Very low44.4Very low150 Ų150105.2 Ų105.274%0.73955%0.554SS**Hα-helixtrans-64.7-32.7179.3-167.7-176.8168.100113M1 T7M1-M3 PolarHBondContact O-N 2.95Å; M3-T7 PolarHBondContact O-N 3.3Å; M3-T7 PolarHBondContact O-OG1 3.36Å
4V40.8Very low44.9Very low91 Ų9199.4 Ų99.455%0.55252%0.523SS*.Hα-helixtrans-76-37.5177.21790000111.4M1 A2 T7 R8M1-V4 PolarHBondContact O-N 3.45Å; A2-V4 VanDerWaalsContact C-N 3.3Å; A2-V4 PolarHBondContact O-N 2.86Å; V4-T7 WeakPolarHBondContact CA-OG1 3.47Å; V4-T7 PolarHBondContact O-OG1 3.34Å; V4-T7 VanDerWaalsContact O-OG1 3.12Å; V4-R8 WeakPolarHBondContact O-CB 3.42Å; V4-R8 PolarHBondContact O-N 3.14Å
5M38.5Very low45.4Very low123 Ų123101.3 Ų101.361%0.60653%0.525SS*.Hα-helixtrans-65.7-39.1171.4-82.9-172168.300111.7M1 A2 R8 K9M1-M5 PolarHBondContact O-N 3.33Å; M1-M5 VanDerWaalsContact O-N 3.14Å; A2-M5 PolarHBondContact O-N 2.87Å; M5-R8 PolarHBondContact O-N 3Å; M5-K9 PolarHBondContact O-N 3.47Å
6L41Very low45.8Very low109 Ų109100.4 Ų100.457%0.57152%0.518SS*.Hα-helixtrans-65.2-46.9177.3-162.481.4000111.1A2 R8 K9 L10A2-L6 WeakPolarHBondContact O-CB 3.36Å; A2-L6 PolarHBondContact O-N 3.02Å; L6-R8 PolarHBondContact O-N 3.12Å; L6-K9 PolarHBondContact O-N 2.98Å; L6-L10 HydrophobicContact CD2-CD1 4.1Å; L6-L10 HydrophobicContact CG-CD1 3.78Å; L6-L10 WeakPolarHBondContact O-CB 3.4Å; L6-L10 VanDerWaalsContact O-CD1 3.31Å; L6-L10 WeakPolarHBondContact O-CD1 3.28Å; L6-L10 VanDerWaalsContact O-CG 3.23Å; L6-L10 WeakPolarHBondContact O-CG 3.28Å; L6-L10 PolarHBondContact O-N 3.38Å
7T44Very low46.1Very low68 Ų6894.8 Ų94.842%0.41749%0.489SS..Hα-helixtrans-65-36.3176.541.30000112.8M3 V4 L10 A11M3-T7 PolarHBondContact O-N 3.3Å; M3-T7 PolarHBondContact O-OG1 3.36Å; V4-T7 WeakPolarHBondContact CA-OG1 3.47Å; V4-T7 PolarHBondContact O-OG1 3.34Å; V4-T7 VanDerWaalsContact O-OG1 3.12Å; T7-L10 PolarHBondContact O-N 3.02Å; T7-A11 VanDerWaalsContact O-CB 3.31Å; T7-A11 WeakPolarHBondContact O-CB 3.3Å; T7-A11 PolarHBondContact O-N 3.4Å
8R44.5Very low46.3Very low188 Ų18890.3 Ų90.371%0.70947%0.465SS*.Hα-helixtrans-65.7-44.5172.9-85.4-172.3173.2-177.4-1.2112.8V4 M5 L6 L10 A11 L12V4-R8 WeakPolarHBondContact O-CB 3.42Å; V4-R8 PolarHBondContact O-N 3.14Å; M5-R8 PolarHBondContact O-N 3Å; L6-R8 PolarHBondContact O-N 3.12Å; R8-L10 VanDerWaalsContact C-N 3.33Å; R8-A11 PolarHBondContact O-N 3.22Å; R8-L12 PolarHBondContact O-N 2.87Å
9K49.9Very low46.6Very low160 Ų16092.5 Ų92.570%0.69647%0.471SS*.Hα-helixtrans-63.1-40.4175.6-78.6-165.1172.7-164.50111.8M5 L6 L12 A13M5-K9 PolarHBondContact O-N 3.47Å; L6-K9 PolarHBondContact O-N 2.98Å; K9-L12 PolarHBondContact O-N 3.41Å; K9-A13 WeakPolarHBondContact O-CB 3.23Å; K9-A13 PolarHBondContact O-N 3.03Å
10L48.2Very low46.9Very low29 Ų2989.1 Ų89.115%0.15246%0.458CS..Hα-helixtrans-66.8-38.2176.4-73.8159000111.9L6 T7 R8 A13 D14 P204L6-L10 HydrophobicContact CD2-CD1 4.1Å; L6-L10 HydrophobicContact CG-CD1 3.78Å; L6-L10 WeakPolarHBondContact O-CB 3.4Å; L6-L10 VanDerWaalsContact O-CD1 3.31Å; L6-L10 WeakPolarHBondContact O-CD1 3.28Å; L6-L10 VanDerWaalsContact O-CG 3.23Å; L6-L10 WeakPolarHBondContact O-CG 3.28Å; L6-L10 PolarHBondContact O-N 3.38Å; T7-L10 PolarHBondContact O-N 3.02Å; R8-L10 VanDerWaalsContact C-N 3.33Å; L10-A13 PolarHBondContact O-N 3.26Å; L10-D14 VanDerWaalsContact O-CB 3.29Å; L10-D14 WeakPolarHBondContact O-CB 3.33Å; L10-D14 PolarHBondContact O-N 2.84Å; L10-P204 HydrophobicContact CD1-CB 4Å; L10-P204 HydrophobicContact CD1-CG 3.72Å
11A50.5Low47.1Very low55 Ų5585.5 Ų85.546%0.45544%0.439SS..Hα-helixtrans-69.5-31.1175.300000113.4T7 R8 K15T7-A11 VanDerWaalsContact O-CB 3.31Å; T7-A11 WeakPolarHBondContact O-CB 3.3Å; T7-A11 PolarHBondContact O-N 3.4Å; R8-A11 PolarHBondContact O-N 3.22Å; A11-K15 PolarHBondContact O-N 3.42Å
12L51.7Low47.3Very low106 Ų10678.7 Ų78.756%0.55541%0.407SS*.Hα-helixtrans-69.6-48.4170.9-96.8146.4000111R8 K9 D14 K15 E16R8-L12 PolarHBondContact O-N 2.87Å; K9-L12 PolarHBondContact O-N 3.41Å; L12-D14 PolarHBondContact O-N 3.21Å; L12-K15 PolarHBondContact O-N 3.24Å; L12-K15 VanDerWaalsContact O-N 3.1Å; L12-E16 PolarHBondContact O-N 3.05Å
13A52.1Low47.9Very low18 Ų1879 Ų7915%0.14940%0.397CS..Hα-helixtrans-59.4-35.5175.900000112.3K9 L10 E16 F17K9-A13 WeakPolarHBondContact O-CB 3.23Å; K9-A13 PolarHBondContact O-N 3.03Å; L10-A13 PolarHBondContact O-N 3.26Å; A13-E16 PolarHBondContact O-N 3.35Å; A13-F17 VanDerWaalsContact O-CB 3.23Å; A13-F17 WeakPolarHBondContact O-CB 3.29Å; A13-F17 PolarHBondContact O-N 3.45Å
14D51.3Low48.9Very low24 Ų2474.4 Ų74.413%0.12837%0.372CS..Hα-helixtrans-65.3-38.2176.7-165.338.4000112.3L10 L12 F18 N201 I202L10-D14 VanDerWaalsContact O-CB 3.29Å; L10-D14 WeakPolarHBondContact O-CB 3.33Å; L10-D14 PolarHBondContact O-N 2.84Å; L12-D14 PolarHBondContact O-N 3.21Å; D14-F18 VanDerWaalsContact O-CB 3.26Å; D14-F18 WeakPolarHBondContact O-CB 3.33Å; D14-F18 PolarHBondContact O-N 3.35Å; D14-F18 VanDerWaalsContact O-N 3.1Å; D14-N201 VanDerWaalsContact CG-ND2 3.3Å; D14-N201 VanDerWaalsContact OD1-CA 3.24Å; D14-N201 WeakPolarHBondContact OD1-CA 3.43Å; D14-N201 PolarHBondContact OD1-ND2 3.23Å; D14-N201 PolarHBondContact OD1-OD1 3.41Å; D14-N201 VanDerWaalsContact OD2-CG 3.32Å; D14-N201 PolarHBondContact OD2-ND2 3.01Å; D14-N201 PolarHBondContact OD2-OD1 2.85Å; D14-I202 PolarHBondContact OD1-N 2.9Å
15K52.7Low49.4Very low128 Ų12871.1 Ų71.156%0.55735%0.352SS*.Hα-helixtrans-69.1-44174.7-71.9-179.7179.8-175.60111.8A11 L12 F18 F19A11-K15 PolarHBondContact O-N 3.42Å; L12-K15 PolarHBondContact O-N 3.24Å; L12-K15 VanDerWaalsContact O-N 3.1Å; K15-F18 WeakPolarHBondContact O-CB 3.39Å; K15-F18 PolarHBondContact O-N 3.44Å; K15-F19 VanDerWaalsContact O-CD2 3.23Å; K15-F19 WeakPolarHBondContact O-CD2 3.37Å; K15-F19 PolarHBondContact O-N 3.05Å
16E51.9Low50Low88 Ų8869.4 Ų69.441%0.41134%0.344SS..Hα-helixtrans-68.9-38.6179.8-71.5-178.5169.200112L12 A13 F18 F19 A20L12-E16 PolarHBondContact O-N 3.05Å; A13-E16 PolarHBondContact O-N 3.35Å; E16-F18 VanDerWaalsContact C-N 3.3Å; E16-F18 PolarHBondContact O-N 2.89Å; E16-F19 PolarHBondContact O-N 3.29Å; E16-A20 WeakPolarHBondContact O-CB 3.31Å; E16-A20 PolarHBondContact O-N 3.1Å
17F50.9Low50.5Low5 Ų569 Ų692%0.02234%0.342CS..Hα-helixtrans-58.4-44.4171.1-170.6-132.7000112.8A13 F19 A20 I21 L199 I202 F288 L294A13-F17 VanDerWaalsContact O-CB 3.23Å; A13-F17 WeakPolarHBondContact O-CB 3.29Å; A13-F17 PolarHBondContact O-N 3.45Å; F17-F19 PolarHBondContact O-N 2.89Å; F17-A20 PolarHBondContact O-N 3.39Å; F17-I21 HydrophobicContact CD1-CD1 3.75Å; F17-I21 HydrophobicContact CD2-CD1 4.09Å; F17-I21 HydrophobicContact CD2-CG1 4.4Å; F17-I21 HydrophobicContact CE1-CD1 3.5Å; F17-I21 HydrophobicContact CE2-CD1 3.93Å; F17-I21 HydrophobicContact CE2-CG1 4.34Å; F17-I21 HydrophobicContact CG-CD1 4.09Å; F17-I21 HydrophobicContact CZ-CD1 3.61Å; F17-I21 HydrophobicContact CZ-CG1 4.46Å; F17-I21 WeakPolarHBondContact O-CG1 3.34Å; F17-I21 PolarHBondContact O-N 3.01Å; F17-L199 WeakPolarHBondContact CD1-O 3.31Å; F17-L199 WeakPolarHBondContact CE1-O 3.23Å; F17-L199 HydrophobicContact CZ-CD2 4.26Å; F17-I202 HydrophobicContact CB-CD1 4.35Å; F17-I202 HydrophobicContact CD1-CD1 3.67Å; F17-I202 HydrophobicContact CD1-CG1 3.71Å; F17-I202 HydrophobicContact CD2-CD1 3.71Å; F17-I202 HydrophobicContact CE1-CD1 3.62Å; F17-I202 HydrophobicContact CE1-CG1 3.55Å; F17-I202 HydrophobicContact CE2-CD1 3.63Å; F17-I202 HydrophobicContact CE2-CG1 4.46Å; F17-I202 HydrophobicContact CG-CD1 3.68Å; F17-I202 HydrophobicContact CG-CG1 4.22Å; F17-I202 HydrophobicContact CZ-CD1 3.6Å; F17-I202 HydrophobicContact CZ-CG1 3.95Å; F17-F288 HydrophobicContact CB-CD1 3.7Å; F17-F288 HydrophobicContact CB-CE1 3.24Å; F17-F288 HydrophobicContact CB-CZ 3.76Å; F17-F288 HydrophobicContact CD2-CB 4.12Å; F17-F288 AromaticContact CD2-CD1 3.15Å; F17-F288 HydrophobicContact CD2-CD1 3.15Å; F17-F288 AromaticContact CD2-CD2 3.3Å; F17-F288 HydrophobicContact CD2-CD2 3.3Å; F17-F288 AromaticContact CD2-CE1 3.35Å; F17-F288 HydrophobicContact CD2-CE1 3.35Å; F17-F288 AromaticContact CD2-CE2 3.47Å; F17-F288 HydrophobicContact CD2-CE2 3.47Å; F17-F288 VanDerWaalsContact CD2-CE2 3.47Å; F17-F288 AromaticContact CD2-CG 3.15Å; F17-F288 HydrophobicContact CD2-CG 3.15Å; F17-F288 AromaticContact CD2-CZ 3.52Å; F17-F288 HydrophobicContact CD2-CZ 3.52Å; F17-F288 HydrophobicContact CE2-CB 3.89Å; F17-F288 AromaticContact CE2-CD1 3.81Å; F17-F288 HydrophobicContact CE2-CD1 3.81Å; F17-F288 AromaticContact CE2-CD2 3.54Å; F17-F288 HydrophobicContact CE2-CD2 3.54Å; F17-F288 HydrophobicContact CE2-CE1 4.38Å; F17-F288 HydrophobicContact CE2-CE2 4.13Å; F17-F288 AromaticContact CE2-CG 3.37Å; F17-F288 HydrophobicContact CE2-CG 3.37Å; F17-F288 AromaticContact CG-CD1 3.71Å; F17-F288 HydrophobicContact CG-CD1 3.71Å; F17-F288 AromaticContact CG-CE1 3.71Å; F17-F288 HydrophobicContact CG-CE1 3.71Å; F17-F288 HydrophobicContact CG-CE2 4.49Å; F17-F288 HydrophobicContact CG-CG 4.15Å; F17-F288 HydrophobicContact CG-CZ 4.14Å; F17-L294 HydrophobicContact CE2-CD1 3.66Å; F17-L294 HydrophobicContact CZ-CD1 4.18Å
18F50.2Low50.9Low13 Ų1367.4 Ų67.46%0.05733%0.331CS..Hα-helixtrans-61.1-45.6177.7-175.6-87.4000111.4D14 K15 E16 I21 L22 L190 L192D14-F18 VanDerWaalsContact O-CB 3.26Å; D14-F18 WeakPolarHBondContact O-CB 3.33Å; D14-F18 PolarHBondContact O-N 3.35Å; D14-F18 VanDerWaalsContact O-N 3.1Å; K15-F18 WeakPolarHBondContact O-CB 3.39Å; K15-F18 PolarHBondContact O-N 3.44Å; E16-F18 VanDerWaalsContact C-N 3.3Å; E16-F18 PolarHBondContact O-N 2.89Å; F18-I21 PolarHBondContact O-N 2.88Å; F18-L22 HydrophobicContact CE1-CD1 3.69Å; F18-L22 HydrophobicContact CZ-CD1 3.92Å; F18-L22 WeakPolarHBondContact O-CB 3.41Å; F18-L22 PolarHBondContact O-N 3.5Å; F18-L190 HydrophobicContact CD1-CD1 4.34Å; F18-L190 HydrophobicContact CE1-CB 4.27Å; F18-L190 HydrophobicContact CE1-CD1 3.51Å; F18-L190 HydrophobicContact CE1-CG 4.37Å; F18-L190 HydrophobicContact CZ-CB 3.81Å; F18-L190 HydrophobicContact CZ-CD1 3.72Å; F18-L190 HydrophobicContact CZ-CG 4.35Å; F18-L192 HydrophobicContact CE2-CD2 3.64Å; F18-L192 HydrophobicContact CZ-CD2 3.92Å
19F51.9Low51.1Low132 Ų13262.6 Ų62.658%0.57932%0.319SS*.Hα-helixtrans-64.8-38.5174.8-83.7-69.4000112.7K15 E16 F17 L22 N23K15-F19 VanDerWaalsContact O-CD2 3.23Å; K15-F19 WeakPolarHBondContact O-CD2 3.37Å; K15-F19 PolarHBondContact O-N 3.05Å; E16-F19 PolarHBondContact O-N 3.29Å; F17-F19 PolarHBondContact O-N 2.89Å; F19-L22 PolarHBondContact O-N 2.89Å; F19-N23 WeakPolarHBondContact O-CB 3.28Å; F19-N23 PolarHBondContact O-N 2.92Å
20A51.6Low51Low25 Ų2558.4 Ų58.421%0.20731%0.314CS..Hα-helixtrans-63.3-41.8176.100000111.8E16 F17 Y24 F288E16-A20 WeakPolarHBondContact O-CB 3.31Å; E16-A20 PolarHBondContact O-N 3.1Å; F17-A20 PolarHBondContact O-N 3.39Å; A20-Y24 WeakPolarHBondContact O-CB 3.4Å; A20-Y24 PolarHBondContact O-N 3.16Å; A20-F288 HydrophobicContact CB-CE2 3.65Å; A20-F288 HydrophobicContact CB-CZ 3.86Å
21I51.8Low51Low13 Ų1361.9 Ų61.97%0.06733%0.333CS..Hα-helixtrans-67.6-40.3174.5-70.2169.4000111F17 F18 Y24 T25 L199 F200 L294F17-I21 HydrophobicContact CD1-CD1 3.75Å; F17-I21 HydrophobicContact CD2-CD1 4.09Å; F17-I21 HydrophobicContact CD2-CG1 4.4Å; F17-I21 HydrophobicContact CE1-CD1 3.5Å; F17-I21 HydrophobicContact CE2-CD1 3.93Å; F17-I21 HydrophobicContact CE2-CG1 4.34Å; F17-I21 HydrophobicContact CG-CD1 4.09Å; F17-I21 HydrophobicContact CZ-CD1 3.61Å; F17-I21 HydrophobicContact CZ-CG1 4.46Å; F17-I21 WeakPolarHBondContact O-CG1 3.34Å; F17-I21 PolarHBondContact O-N 3.01Å; F18-I21 PolarHBondContact O-N 2.88Å; I21-Y24 WeakPolarHBondContact O-CB 3.41Å; I21-Y24 PolarHBondContact O-N 3.38Å; I21-T25 PolarHBondContact O-N 3.11Å; I21-T25 PolarHBondContact O-OG1 2.9Å; I21-L199 HydrophobicContact CD1-CB 4.11Å; I21-L199 WeakPolarHBondContact CD1-O 3.31Å; I21-F200 HydrophobicContact CG2-CE1 4.31Å; I21-L294 HydrophobicContact CG1-CD2 4.05Å
22L51.3Low51.1Low48 Ų4865.1 Ų65.125%0.25134%0.343SS..Hα-helixtrans-63.8-47.2177.7-144.3106.2000110.8F18 F19 Y24 T25 M26F18-L22 HydrophobicContact CE1-CD1 3.69Å; F18-L22 HydrophobicContact CZ-CD1 3.92Å; F18-L22 WeakPolarHBondContact O-CB 3.41Å; F18-L22 PolarHBondContact O-N 3.5Å; F19-L22 PolarHBondContact O-N 2.89Å; L22-Y24 VanDerWaalsContact C-N 3.34Å; L22-Y24 PolarHBondContact O-N 2.8Å; L22-T25 PolarHBondContact O-N 3.32Å; L22-M26 WeakPolarHBondContact O-CG 3.15Å; L22-M26 PolarHBondContact O-N 3.02Å
23N49.4Very low51.2Low87 Ų8766.8 Ų66.847%0.46535%0.352SS..Hα-helixtrans-60.9-42.4174.3-78.8-7.1000111.4F19 T25 M26 D27F19-N23 WeakPolarHBondContact O-CB 3.28Å; F19-N23 PolarHBondContact O-N 2.92Å; N23-T25 VanDerWaalsContact C-N 3.3Å; N23-T25 PolarHBondContact O-N 2.96Å; N23-M26 CarbonylContact O-C 3.57Å; N23-M26 PolarHBondContact O-N 3.07Å; N23-M26 VanDerWaalsContact O-N 3.11Å; N23-M26 VanDerWaalsContact OD1-CE 3.28Å; N23-M26 WeakPolarHBondContact OD1-CE 3.3Å; N23-D27 PolarHBondContact O-N 3.29Å
24Y53Low51.1Low53 Ų5369.7 Ų69.721%0.20837%0.371CS..Hα-helixtrans-57.4-43.1174.1172.3-118.8000112.4A20 I21 L22 M26 D27 I28 L294 L296A20-Y24 WeakPolarHBondContact O-CB 3.4Å; A20-Y24 PolarHBondContact O-N 3.16Å; I21-Y24 WeakPolarHBondContact O-CB 3.41Å; I21-Y24 PolarHBondContact O-N 3.38Å; L22-Y24 VanDerWaalsContact C-N 3.34Å; L22-Y24 PolarHBondContact O-N 2.8Å; Y24-M26 VanDerWaalsContact C-N 3.28Å; Y24-M26 PolarHBondContact O-N 2.85Å; Y24-D27 PolarHBondContact O-N 3.44Å; Y24-I28 HydrophobicContact CD1-CD1 4.01Å; Y24-I28 HydrophobicContact CD2-CD1 4.09Å; Y24-I28 HydrophobicContact CD2-CG1 4.23Å; Y24-I28 HydrophobicContact CE1-CD1 3.48Å; Y24-I28 VanDerWaalsContact CE1-CD1 3.48Å; Y24-I28 HydrophobicContact CE2-CD1 3.45Å; Y24-I28 VanDerWaalsContact CE2-CD1 3.45Å; Y24-I28 HydrophobicContact CE2-CG1 3.65Å; Y24-I28 HydrophobicContact CG-CD1 4.33Å; Y24-I28 WeakPolarHBondContact O-CG1 3.39Å; Y24-I28 PolarHBondContact O-N 2.89Å; Y24-I28 WeakPolarHBondContact OH-CD1 3.38Å; Y24-L294 HydrophobicContact CD1-CD2 4.16Å; Y24-L294 HydrophobicContact CG-CD2 4.4Å; Y24-L296 HydrophobicContact CD2-CD1 4.12Å; Y24-L296 HydrophobicContact CE2-CD1 3.06Å; Y24-L296 HydrophobicContact CE2-CG 4.39Å; Y24-L296 VanDerWaalsContact CZ-CD1 3.48Å; Y24-L296 WeakPolarHBondContact OH-CD1 3.21Å
25T51.6Low51.3Low21 Ų2170.9 Ų70.913%0.12938%0.379CS..Hα-helixtrans-71.2-27.4179.2-28.30000112I21 L22 N23 N29 Q193I21-T25 PolarHBondContact O-N 3.11Å; I21-T25 PolarHBondContact O-OG1 2.9Å; L22-T25 PolarHBondContact O-N 3.32Å; N23-T25 VanDerWaalsContact C-N 3.3Å; N23-T25 PolarHBondContact O-N 2.96Å; T25-N29 PolarHBondContact O-ND2 3.48Å; T25-Q193 HydrophobicContact CG2-CB 3.47Å; T25-Q193 VanDerWaalsContact CG2-CB 3.47Å; T25-Q193 PolarHBondContact O-OE1 3.44Å
26M50.5Low51.6Low88 Ų8867.5 Ų67.543%0.43337%0.369SS..Hα-helixtrans-74.9-39.8171.4-66.8-166-62.400112L22 N23 Y24 N29 A30L22-M26 WeakPolarHBondContact O-CG 3.15Å; L22-M26 PolarHBondContact O-N 3.02Å; N23-M26 CarbonylContact O-C 3.57Å; N23-M26 PolarHBondContact O-N 3.07Å; N23-M26 VanDerWaalsContact O-N 3.11Å; N23-M26 VanDerWaalsContact OD1-CE 3.28Å; N23-M26 WeakPolarHBondContact OD1-CE 3.3Å; Y24-M26 VanDerWaalsContact C-N 3.28Å; Y24-M26 PolarHBondContact O-N 2.85Å; M26-N29 CarbonylContact O-C 3.59Å; M26-N29 PolarHBondContact O-N 3.4Å; M26-N29 VanDerWaalsContact O-N 3.11Å; M26-A30 PolarHBondContact O-N 2.82Å
27D50.7Low52.1Low100 Ų10067.1 Ų67.154%0.53537%0.373SS..Hα-helixtrans-67.3-37.2179.4-104.4-3.2000112.9N23 Y24 N29 A30 N31N23-D27 PolarHBondContact O-N 3.29Å; Y24-D27 PolarHBondContact O-N 3.44Å; D27-N29 PolarHBondContact O-N 3.11Å; D27-A30 PolarHBondContact O-N 3.49Å; D27-A30 VanDerWaalsContact O-N 3.07Å; D27-N31 PolarHBondContact O-N 2.82Å
28I53.4Low52.7Low35 Ų3568.8 Ų68.818%0.17939%0.392CS..Hα-helixtrans-59.9-32.9172-67.3162.8000111.3Y24 T35 V39Y24-I28 HydrophobicContact CD1-CD1 4.01Å; Y24-I28 HydrophobicContact CD2-CD1 4.09Å; Y24-I28 HydrophobicContact CD2-CG1 4.23Å; Y24-I28 HydrophobicContact CE1-CD1 3.48Å; Y24-I28 VanDerWaalsContact CE1-CD1 3.48Å; Y24-I28 HydrophobicContact CE2-CD1 3.45Å; Y24-I28 VanDerWaalsContact CE2-CD1 3.45Å; Y24-I28 HydrophobicContact CE2-CG1 3.65Å; Y24-I28 HydrophobicContact CG-CD1 4.33Å; Y24-I28 WeakPolarHBondContact O-CG1 3.39Å; Y24-I28 PolarHBondContact O-N 2.89Å; Y24-I28 WeakPolarHBondContact OH-CD1 3.38Å; I28-T35 PolarHBondContact O-OG1 3.07Å; I28-V39 HydrophobicContact CG2-CG2 4.26Å
29N48.1Very low53.2Low86 Ų8670.5 Ų70.546%0.4640%0.403SS..Hα-helixtrans-83.8-18.9177.3-70.1-40.5000112.7T25 M26 D27 Q193T25-N29 PolarHBondContact O-ND2 3.48Å; M26-N29 CarbonylContact O-C 3.59Å; M26-N29 PolarHBondContact O-N 3.4Å; M26-N29 VanDerWaalsContact O-N 3.11Å; D27-N29 PolarHBondContact O-N 3.11Å; N29-Q193 PolarHBondContact ND2-OE1 3.35Å
30A48.4Very low53.9Low72 Ų7266.4 Ų66.460%0.59539%0.394SS*.Hα-helixtrans-90.9-26.5-179.400000113.3M26 D27M26-A30 PolarHBondContact O-N 2.82Å; D27-A30 PolarHBondContact O-N 3.49Å; D27-A30 VanDerWaalsContact O-N 3.07Å
31N49Very low54.8Low103 Ų10370.4 Ų70.455%0.55141%0.411SS*.SBendtrans-116.3116.4-174.7-79.7-25.7000113.6D27 T35D27-N31 PolarHBondContact O-N 2.82Å; N31-T35 WeakPolarHBondContact O-CG2 3.42Å; N31-T35 PolarHBondContact O-OG1 3.28Å
32D51.9Low55.5Low123 Ų12371.5 Ų71.566%0.65841%0.414SS*.  trans62131.6161.9-84.6-20.6000119.7S34 T35D32-S34 WeakPolarHBondContact CB-OG 2.86Å; D32-S34 PolarHBondContact O-N 2.92Å; D32-T35 PolarHBondContact O-N 2.64Å; D32-T35 PolarHBondContact O-OG1 2.96Å
33N53.1Low56.5Low140 Ų14069.7 Ų69.775%0.74941%0.405SS*.Hα-helixtrans-52.6-16.7166.9-72.2-17.8000114.2T36 T37N33-T36 WeakPolarHBondContact CA-OG1 3.23Å; N33-T36 PolarHBondContact O-OG1 3Å; N33-T36 VanDerWaalsContact O-OG1 3.06Å; N33-T37 PolarHBondContact O-N 2.94Å; N33-T37 PolarHBondContact O-OG1 3.47Å
34S50.5Low57.9Low79 Ų7969.6 Ų69.655%0.55241%0.407SS*.Hα-helixtrans-74.2-34.6177.267.60000112.5D32 G38D32-S34 WeakPolarHBondContact CB-OG 2.86Å; D32-S34 PolarHBondContact O-N 2.92Å; S34-G38 PolarHBondContact O-N 2.95Å
35T54.8Low59Low49 Ų4970.3 Ų70.330%0.30141%0.412SS..Hα-helixtrans-76.2-40.6-178.465.30000110.9I28 N31 D32 T37 G38 V39I28-T35 PolarHBondContact O-OG1 3.07Å; N31-T35 WeakPolarHBondContact O-CG2 3.42Å; N31-T35 PolarHBondContact O-OG1 3.28Å; D32-T35 PolarHBondContact O-N 2.64Å; D32-T35 PolarHBondContact O-OG1 2.96Å; T35-T37 VanDerWaalsContact C-N 3.33Å; T35-T37 PolarHBondContact O-N 3.1Å; T35-G38 PolarHBondContact O-N 3.07Å; T35-V39 WeakPolarHBondContact O-CG2 3.26Å; T35-V39 PolarHBondContact O-N 3.23Å
36T60.7Low60.2Low57 Ų5769.4 Ų69.435%0.3541%0.407SS..Hα-helixtrans-61.1-39.9174.644.50000112.1N33 V39 A40N33-T36 WeakPolarHBondContact CA-OG1 3.23Å; N33-T36 PolarHBondContact O-OG1 3Å; N33-T36 VanDerWaalsContact O-OG1 3.06Å; T36-V39 PolarHBondContact O-N 3.5Å; T36-A40 WeakPolarHBondContact O-CB 3.4Å; T36-A40 PolarHBondContact O-N 3.3Å
37T62.2Low61.6Low80 Ų8067.8 Ų67.849%0.49140%0.399SS..Hα-helixtrans-64.2-43.4175.2-530000111.6N33 T35 A40 I41N33-T37 PolarHBondContact O-N 2.94Å; N33-T37 PolarHBondContact O-OG1 3.47Å; T35-T37 VanDerWaalsContact C-N 3.33Å; T35-T37 PolarHBondContact O-N 3.1Å; T37-A40 PolarHBondContact O-N 3.5Å; T37-I41 HydrophobicContact CG2-CD1 4.06Å; T37-I41 VanDerWaalsContact O-CG1 3.3Å; T37-I41 WeakPolarHBondContact O-CG1 3.24Å; T37-I41 PolarHBondContact O-N 3.4Å
38G62.1Low63.2Low40 Ų4068.7 Ų68.741%0.41240%0.403SS..Hα-helixtrans-62.9-42177.500000113.2S34 T35 I41 Y42S34-G38 PolarHBondContact O-N 2.95Å; T35-G38 PolarHBondContact O-N 3.07Å; G38-I41 PolarHBondContact O-N 2.88Å; G38-Y42 WeakPolarHBondContact O-CB 3.1Å; G38-Y42 PolarHBondContact O-N 3.01Å
39V62.3Low64.7Low49 Ų4968.9 Ų68.930%0.29740%0.404SS..Hα-helixtrans-66.6-40.3175.9-179.90000111.1I28 T35 T36 Y42 L43 I106I28-V39 HydrophobicContact CG2-CG2 4.26Å; T35-V39 WeakPolarHBondContact O-CG2 3.26Å; T35-V39 PolarHBondContact O-N 3.23Å; T36-V39 PolarHBondContact O-N 3.5Å; V39-Y42 PolarHBondContact O-N 2.91Å; V39-L43 HydrophobicContact CG1-CD1 4.25Å; V39-L43 HydrophobicContact CG1-CG 4.48Å; V39-L43 WeakPolarHBondContact O-CG 3.43Å; V39-L43 PolarHBondContact O-N 2.73Å; V39-I106 HydrophobicContact CB-CD1 4.33Å; V39-I106 HydrophobicContact CG1-CD1 3.34Å
40A66.2Low66.4Low46 Ų4664.8 Ų64.838%0.3838%0.382SS..Hα-helixtrans-61.8-45.4175.700000112T36 T37 Y42 L43 V44T36-A40 WeakPolarHBondContact O-CB 3.4Å; T36-A40 PolarHBondContact O-N 3.3Å; T37-A40 PolarHBondContact O-N 3.5Å; A40-Y42 VanDerWaalsContact C-N 3.33Å; A40-Y42 PolarHBondContact O-N 2.91Å; A40-L43 PolarHBondContact O-N 3.17Å; A40-V44 WeakPolarHBondContact O-CG2 3.24Å; A40-V44 PolarHBondContact O-N 2.75Å
41I69.7Low68.3Low109 Ų10964.6 Ų64.656%0.55938%0.375SS*.Hα-helixtrans-58.7-46.9174.8-68.3166.2000110.2T37 G38 L43 V44 E45T37-I41 HydrophobicContact CG2-CD1 4.06Å; T37-I41 VanDerWaalsContact O-CG1 3.3Å; T37-I41 WeakPolarHBondContact O-CG1 3.24Å; T37-I41 PolarHBondContact O-N 3.4Å; G38-I41 PolarHBondContact O-N 2.88Å; I41-L43 VanDerWaalsContact C-N 3.32Å; I41-L43 PolarHBondContact O-N 3.28Å; I41-V44 PolarHBondContact O-N 3.45Å; I41-E45 WeakPolarHBondContact O-CB 3.46Å; I41-E45 PolarHBondContact O-N 3.11Å
42Y67.6Low70Confident37 Ų3760.7 Ų60.715%0.14536%0.36CS..Hα-helixtrans-60.2-40.2178.1174.2-99.8000112.6G38 V39 A40 E45 T46 L303 N307G38-Y42 WeakPolarHBondContact O-CB 3.1Å; G38-Y42 PolarHBondContact O-N 3.01Å; V39-Y42 PolarHBondContact O-N 2.91Å; A40-Y42 VanDerWaalsContact C-N 3.33Å; A40-Y42 PolarHBondContact O-N 2.91Å; Y42-E45 PolarHBondContact O-N 2.88Å; Y42-T46 WeakPolarHBondContact CE1-OG1 3.38Å; Y42-T46 VanDerWaalsContact CZ-OG1 3.24Å; Y42-T46 VanDerWaalsContact O-CB 3.27Å; Y42-T46 WeakPolarHBondContact O-CB 3.45Å; Y42-T46 PolarHBondContact O-N 3Å; Y42-T46 PolarHBondContact O-OG1 3.18Å; Y42-L303 HydrophobicContact CD1-CD1 4.47Å; Y42-L303 HydrophobicContact CE1-CB 4.29Å; Y42-L303 HydrophobicContact CE1-CD1 3.98Å; Y42-L303 HydrophobicContact CE1-CD2 4.21Å; Y42-L303 HydrophobicContact CE1-CG 4.38Å; Y42-L303 HydrophobicContact CE2-CB 3.65Å; Y42-L303 WeakPolarHBondContact OH-CB 3.46Å; Y42-L303 WeakPolarHBondContact OH-CD2 3.14Å; Y42-L303 PolarHBondContact OH-O 3.12Å; Y42-L303 VanDerWaalsContact OH-O 3.13Å; Y42-N307 WeakPolarHBondContact CE2-ND2 3.42Å
43L72Confident71.6Confident9 Ų954.9 Ų54.95%0.04733%0.328CS..Hα-helixtrans-68.2-42.1178.2-74.2174.2000112.4V39 A40 I41 E45 T46 M47 I106V39-L43 HydrophobicContact CG1-CD1 4.25Å; V39-L43 HydrophobicContact CG1-CG 4.48Å; V39-L43 WeakPolarHBondContact O-CG 3.43Å; V39-L43 PolarHBondContact O-N 2.73Å; A40-L43 PolarHBondContact O-N 3.17Å; I41-L43 VanDerWaalsContact C-N 3.32Å; I41-L43 PolarHBondContact O-N 3.28Å; L43-E45 VanDerWaalsContact C-N 3.34Å; L43-T46 WeakPolarHBondContact O-CB 3.47Å; L43-T46 PolarHBondContact O-N 2.87Å; L43-M47 WeakPolarHBondContact O-CB 3.44Å; L43-M47 WeakPolarHBondContact O-CG 3.41Å; L43-M47 PolarHBondContact O-N 2.99Å; L43-I106 HydrophobicContact CD1-CD1 3.3Å; L43-I106 HydrophobicContact CD1-CG1 4.4Å
44V77.3Confident73.2Confident85 Ų8550 Ų5052%0.51530%0.302SS..Hα-helixtrans-61.6-45.7174.4172.70000110.1A40 I41 T46 M47 L48A40-V44 WeakPolarHBondContact O-CG2 3.24Å; A40-V44 PolarHBondContact O-N 2.75Å; I41-V44 PolarHBondContact O-N 3.45Å; V44-T46 VanDerWaalsContact C-N 3.34Å; V44-T46 PolarHBondContact O-N 3.17Å; V44-M47 PolarHBondContact O-N 3.25Å; V44-L48 HydrophobicContact CG1-CD1 3.95Å; V44-L48 HydrophobicContact CG1-CG 4.39Å; V44-L48 WeakPolarHBondContact O-CB 3.37Å; V44-L48 VanDerWaalsContact O-CG 3.31Å; V44-L48 WeakPolarHBondContact O-CG 3.29Å; V44-L48 PolarHBondContact O-N 3.01Å
45E77Confident74.9Confident68 Ų6851.8 Ų51.832%0.31830%0.3SS..Hα-helixtrans-59.7-45.7175.5-170.8-173.3168.100111.2I41 Y42 L43 M47 L48 M49I41-E45 WeakPolarHBondContact O-CB 3.46Å; I41-E45 PolarHBondContact O-N 3.11Å; Y42-E45 PolarHBondContact O-N 2.88Å; L43-E45 VanDerWaalsContact C-N 3.34Å; E45-M47 VanDerWaalsContact C-N 3.33Å; E45-M47 PolarHBondContact O-N 3.05Å; E45-L48 PolarHBondContact O-N 3.36Å; E45-M49 HydrophobicContact CG-CG 4.25Å; E45-M49 VanDerWaalsContact O-CB 3.31Å; E45-M49 WeakPolarHBondContact O-CB 3.34Å; E45-M49 WeakPolarHBondContact O-CG 3.23Å; E45-M49 PolarHBondContact O-N 3.4Å
46T75.9Confident76.4Confident2 Ų249.6 Ų49.61%0.01229%0.287CS..Hα-helixtrans-59.1-44.2177.9-63.20000111.6Y42 L43 V44 A50 Q95Y42-T46 WeakPolarHBondContact CE1-OG1 3.38Å; Y42-T46 VanDerWaalsContact CZ-OG1 3.24Å; Y42-T46 VanDerWaalsContact O-CB 3.27Å; Y42-T46 WeakPolarHBondContact O-CB 3.45Å; Y42-T46 PolarHBondContact O-N 3Å; Y42-T46 PolarHBondContact O-OG1 3.18Å; L43-T46 WeakPolarHBondContact O-CB 3.47Å; L43-T46 PolarHBondContact O-N 2.87Å; V44-T46 VanDerWaalsContact C-N 3.34Å; V44-T46 PolarHBondContact O-N 3.17Å; T46-A50 WeakPolarHBondContact O-CB 3.27Å; T46-A50 PolarHBondContact O-N 3.38Å; T46-Q95 HydrophobicContact CG2-CG 3.64Å
47M81.3Confident77.5Confident55 Ų5547.4 Ų47.427%0.27127%0.274SS..Hα-helixtrans-64.5-46.6176.3-75.3-177.6149.800111.9L43 V44 E45 M49 A50 C51 I100L43-M47 WeakPolarHBondContact O-CB 3.44Å; L43-M47 WeakPolarHBondContact O-CG 3.41Å; L43-M47 PolarHBondContact O-N 2.99Å; V44-M47 PolarHBondContact O-N 3.25Å; E45-M47 VanDerWaalsContact C-N 3.33Å; E45-M47 PolarHBondContact O-N 3.05Å; M47-M49 PolarHBondContact O-N 3.49Å; M47-A50 PolarHBondContact O-N 3.17Å; M47-C51 WeakPolarHBondContact O-CB 3.34Å; M47-C51 PolarHBondContact O-N 3.18Å; M47-C51 PolarHBondContact O-SG 2.91Å; M47-I100 VanDerWaalsContact CE-CA 3.43Å; M47-I100 HydrophobicContact CE-CB 3.99Å; M47-I100 HydrophobicContact CE-CG1 3.38Å
48L84.7Confident78.7Confident119 Ų11946.7 Ų46.762%0.62327%0.267SS*.Hα-helixtrans-61.8-44.3178.5-72.2173.6000111.5V44 E45 C51 G52V44-L48 HydrophobicContact CG1-CD1 3.95Å; V44-L48 HydrophobicContact CG1-CG 4.39Å; V44-L48 WeakPolarHBondContact O-CB 3.37Å; V44-L48 VanDerWaalsContact O-CG 3.31Å; V44-L48 WeakPolarHBondContact O-CG 3.29Å; V44-L48 PolarHBondContact O-N 3.01Å; E45-L48 PolarHBondContact O-N 3.36Å; L48-C51 PolarHBondContact O-N 2.99Å; L48-G52 PolarHBondContact O-N 3.42Å
49M83.7Confident79.7Confident39 Ų3945.7 Ų45.719%0.19225%0.253CS..Hα-helixtrans-65.4-40.4176.7-71.2-63.1-158.300112.2E45 M47 G52 G53 C310 I311E45-M49 HydrophobicContact CG-CG 4.25Å; E45-M49 VanDerWaalsContact O-CB 3.31Å; E45-M49 WeakPolarHBondContact O-CB 3.34Å; E45-M49 WeakPolarHBondContact O-CG 3.23Å; E45-M49 PolarHBondContact O-N 3.4Å; M47-M49 PolarHBondContact O-N 3.49Å; M49-G52 PolarHBondContact O-N 2.88Å; M49-G53 PolarHBondContact O-N 3.32Å; M49-C310 HydrophobicContact CB-CB 4.18Å; M49-I311 HydrophobicContact CE-CD1 3.32Å; M49-I311 HydrophobicContact CE-CG1 3.32Å; M49-I311 HydrophobicContact SD-CD1 4.25Å; M49-I311 HydrophobicContact SD-CG1 3.55Å; M49-I311 VanDerWaalsContact SD-CG1 3.55Å
50A84.6Confident80.6Confident0 Ų043.4 Ų43.40%024%0.239CC..Hα-helixtrans-64.7-45.6175.900000111.5T46 M47 G53 I54 Q95 M96T46-A50 WeakPolarHBondContact O-CB 3.27Å; T46-A50 PolarHBondContact O-N 3.38Å; M47-A50 PolarHBondContact O-N 3.17Å; A50-G53 PolarHBondContact O-N 3.38Å; A50-I54 VanDerWaalsContact O-CG1 3.26Å; A50-I54 WeakPolarHBondContact O-CG1 2.81Å; A50-I54 PolarHBondContact O-N 2.76Å; A50-Q95 HydrophobicContact CB-CB 4.14Å; A50-Q95 HydrophobicContact CB-CG 4.32Å; A50-M96 HydrophobicContact CB-CB 3.81Å
51C87.7Confident81.5Confident67 Ų6742.4 Ų42.445%0.45323%0.227SC..Hα-helixtrans-59.4-46.4174.4-73.80000111.8M47 L48 G53 I54 F55M47-C51 WeakPolarHBondContact O-CB 3.34Å; M47-C51 PolarHBondContact O-N 3.18Å; M47-C51 PolarHBondContact O-SG 2.91Å; L48-C51 PolarHBondContact O-N 2.99Å; C51-G53 VanDerWaalsContact C-N 3.34Å; C51-G53 PolarHBondContact O-N 3.42Å; C51-I54 PolarHBondContact O-N 2.7Å; C51-F55 WeakPolarHBondContact O-CB 3.46Å; C51-F55 PolarHBondContact O-N 2.83Å
52G85.3Confident82Confident22 Ų2237.4 Ų37.423%0.22720%0.202CC..Hα-helixtrans-59.4-44.7174.200000112L48 M49 F55 G56 I314L48-G52 PolarHBondContact O-N 3.42Å; M49-G52 PolarHBondContact O-N 2.88Å; G52-F55 PolarHBondContact O-N 3.47Å; G52-G56 PolarHBondContact O-N 3.4Å; G52-I314 VanDerWaalsContact C-CG1 3.41Å; G52-I314 WeakPolarHBondContact O-CG1 3.08Å
53G85.1Confident82.5Confident0 Ų036 Ų360%020%0.197CC..Hα-helixtrans-62.3-42.6177.700000112.9M49 A50 C51 G56 S57M49-G53 PolarHBondContact O-N 3.32Å; A50-G53 PolarHBondContact O-N 3.38Å; C51-G53 VanDerWaalsContact C-N 3.34Å; C51-G53 PolarHBondContact O-N 3.42Å; G53-G56 PolarHBondContact O-N 3.13Å; G53-S57 WeakPolarHBondContact O-CB 3.2Å; G53-S57 PolarHBondContact O-N 3.24Å; G53-S57 PolarHBondContact O-OG 3.13Å
54I86.5Confident82.8Confident37 Ų3735.7 Ų35.719%0.1920%0.195CC..Hα-helixtrans-60.8-50.7173.5-66.6162.6000109.7A50 C51 G56 S57 L58 C92 F93 M96A50-I54 VanDerWaalsContact O-CG1 3.26Å; A50-I54 WeakPolarHBondContact O-CG1 2.81Å; A50-I54 PolarHBondContact O-N 2.76Å; C51-I54 PolarHBondContact O-N 2.7Å; I54-G56 VanDerWaalsContact C-N 3.34Å; I54-G56 PolarHBondContact O-N 2.81Å; I54-S57 PolarHBondContact O-N 2.95Å; I54-S57 VanDerWaalsContact O-N 3.15Å; I54-S57 PolarHBondContact O-OG 2.94Å; I54-L58 HydrophobicContact CG2-CD1 4.1Å; I54-L58 HydrophobicContact CG2-CG 4.48Å; I54-L58 WeakPolarHBondContact O-CG 3.4Å; I54-L58 PolarHBondContact O-N 2.81Å; I54-C92 HydrophobicContact CG1-CB 3.91Å; I54-F93 HydrophobicContact CD1-CB 4.48Å; I54-F93 HydrophobicContact CD1-CD2 4.28Å; I54-M96 HydrophobicContact CD1-CB 4.28Å; I54-M96 HydrophobicContact CD1-CE 4.24Å; I54-M96 HydrophobicContact CD1-SD 3.71Å
55F87.4Confident82.9Confident117 Ų11737.1 Ų37.151%0.51319%0.191SC..Hα-helixtrans-59.6-43.1178.5-176.6-90.9000112.5C51 G52 L58 T59 W334C51-F55 WeakPolarHBondContact O-CB 3.46Å; C51-F55 PolarHBondContact O-N 2.83Å; G52-F55 PolarHBondContact O-N 3.47Å; F55-L58 PolarHBondContact O-N 3.41Å; F55-T59 WeakPolarHBondContact O-CB 3.25Å; F55-T59 PolarHBondContact O-N 2.99Å; F55-T59 PolarHBondContact O-OG1 3Å; F55-W334 AromaticContact CD2-CH2 3.7Å; F55-W334 HydrophobicContact CD2-CH2 3.7Å; F55-W334 AromaticContact CD2-CZ2 3.8Å; F55-W334 HydrophobicContact CD2-CZ2 3.8Å; F55-W334 HydrophobicContact CE1-CZ2 4.28Å; F55-W334 AromaticContact CE2-CH2 3.18Å; F55-W334 HydrophobicContact CE2-CH2 3.18Å; F55-W334 AromaticContact CE2-CZ2 3.14Å; F55-W334 HydrophobicContact CE2-CZ2 3.14Å; F55-W334 HydrophobicContact CE2-CZ3 4.19Å; F55-W334 AromaticContact CZ-CH2 3.95Å; F55-W334 HydrophobicContact CZ-CH2 3.95Å; F55-W334 AromaticContact CZ-CZ2 3.42Å; F55-W334 HydrophobicContact CZ-CZ2 3.42Å; F55-W334 VanDerWaalsContact CZ-CZ2 3.42Å
56G84.7Confident82.7Confident4 Ų434.3 Ų34.34%0.04118%0.18CC..Hα-helixtrans-62.1-42.4174.600000112.2G52 G53 I54 T59 N60G52-G56 PolarHBondContact O-N 3.4Å; G53-G56 PolarHBondContact O-N 3.13Å; I54-G56 VanDerWaalsContact C-N 3.34Å; I54-G56 PolarHBondContact O-N 2.81Å; G56-T59 PolarHBondContact O-N 3.16Å; G56-N60 WeakPolarHBondContact O-CB 3.4Å; G56-N60 PolarHBondContact O-N 3.3Å; G56-N60 PolarHBondContact O-ND2 3.24Å
57S85.1Confident82.1Confident10 Ų1039.1 Ų39.17%0.0721%0.209CC..Hα-helixtrans-64.8-42.7177.576.50000112.2G53 I54 N60 L61 I85G53-S57 WeakPolarHBondContact O-CB 3.2Å; G53-S57 PolarHBondContact O-N 3.24Å; G53-S57 PolarHBondContact O-OG 3.13Å; I54-S57 PolarHBondContact O-N 2.95Å; I54-S57 VanDerWaalsContact O-N 3.15Å; I54-S57 PolarHBondContact O-OG 2.94Å; S57-N60 PolarHBondContact O-N 2.81Å; S57-L61 WeakPolarHBondContact O-CB 3.38Å; S57-L61 PolarHBondContact O-N 3.21Å; S57-I85 VanDerWaalsContact O-CG2 3.29Å; S57-I85 WeakPolarHBondContact O-CG2 2.91Å
58L86.8Confident81.3Confident65 Ų6542.7 Ų42.734%0.3422%0.219SC..Hα-helixtrans-64.9-41.9175.8-69.7174.9000111.7I54 F55 L61 A62 L338I54-L58 HydrophobicContact CG2-CD1 4.1Å; I54-L58 HydrophobicContact CG2-CG 4.48Å; I54-L58 WeakPolarHBondContact O-CG 3.4Å; I54-L58 PolarHBondContact O-N 2.81Å; F55-L58 PolarHBondContact O-N 3.41Å; L58-L61 PolarHBondContact O-N 3.42Å; L58-A62 WeakPolarHBondContact O-CB 3.47Å; L58-A62 PolarHBondContact O-N 3.22Å; L58-L338 HydrophobicContact CD2-CD2 4.48Å
59T82.7Confident80.4Confident20 Ų2037 Ų3712%0.12319%0.189CC..Hα-helixtrans-61.6-46.2175.9-60.90000111.1F55 G56 A62 L63 L332F55-T59 WeakPolarHBondContact O-CB 3.25Å; F55-T59 PolarHBondContact O-N 2.99Å; F55-T59 PolarHBondContact O-OG1 3Å; G56-T59 PolarHBondContact O-N 3.16Å; T59-A62 PolarHBondContact O-N 3.43Å; T59-L63 WeakPolarHBondContact O-CB 3.49Å; T59-L63 PolarHBondContact O-N 3.46Å; T59-L332 HydrophobicContact CG2-CD2 4.08Å
60N81.7Confident79.3Confident1 Ų137.2 Ų37.21%0.00519%0.194CC..Hα-helixtrans-60.7-45.5173.8-80.9-55.5000111.4G56 S57 A62 L63 F64 I85 P317G56-N60 WeakPolarHBondContact O-CB 3.4Å; G56-N60 PolarHBondContact O-N 3.3Å; G56-N60 PolarHBondContact O-ND2 3.24Å; S57-N60 PolarHBondContact O-N 2.81Å; N60-A62 VanDerWaalsContact C-N 3.33Å; N60-A62 PolarHBondContact O-N 2.99Å; N60-L63 PolarHBondContact O-N 3.24Å; N60-F64 HydrophobicContact CB-CD2 4.28Å; N60-F64 HydrophobicContact CB-CE2 4.34Å; N60-F64 WeakPolarHBondContact O-CD2 3.46Å; N60-F64 PolarHBondContact O-N 3.23Å; N60-I85 HydrophobicContact CB-CD1 3.76Å; N60-I85 HydrophobicContact CB-CG1 4.04Å; N60-I85 HydrophobicContact CB-CG2 3.91Å; N60-P317 WeakPolarHBondContact ND2-CD 3.05Å; N60-P317 VanDerWaalsContact OD1-CB 3.31Å; N60-P317 WeakPolarHBondContact OD1-CB 3.49Å
61L84.6Confident78.3Confident25 Ų2547.5 Ų47.513%0.13123%0.233CC..Hα-helixtrans-59.3-45.5-179.6-172.466.4000111.4S57 L58 R65 L82 I85 I86S57-L61 WeakPolarHBondContact O-CB 3.38Å; S57-L61 PolarHBondContact O-N 3.21Å; L58-L61 PolarHBondContact O-N 3.42Å; L61-R65 VanDerWaalsContact O-CB 3.29Å; L61-R65 WeakPolarHBondContact O-CB 3.44Å; L61-R65 WeakPolarHBondContact O-CG 3.37Å; L61-R65 PolarHBondContact O-N 3.24Å; L61-L82 HydrophobicContact CD1-CD2 3.73Å; L61-I85 HydrophobicContact CB-CG2 4.38Å; L61-I86 HydrophobicContact CD1-CG1 4.3Å
62A81Confident77.2Confident4 Ų445.7 Ų45.73%0.03322%0.219CC..Hα-helixtrans-62.2-44.6174.900000111.7L58 T59 N60 R65 S66 N337L58-A62 WeakPolarHBondContact O-CB 3.47Å; L58-A62 PolarHBondContact O-N 3.22Å; T59-A62 PolarHBondContact O-N 3.43Å; N60-A62 VanDerWaalsContact C-N 3.33Å; N60-A62 PolarHBondContact O-N 2.99Å; A62-R65 PolarHBondContact O-N 3.06Å; A62-S66 PolarHBondContact O-N 2.82Å; A62-S66 VanDerWaalsContact O-N 3.07Å; A62-N337 HydrophobicContact CB-CB 4.27Å
63L77.9Confident76.6Confident6 Ų645.5 Ų45.53%0.03121%0.213CC..Hα-helixtrans-60.8-48.5178.9-174.969000111.9T59 N60 S66 C69 L321 I330 L332T59-L63 WeakPolarHBondContact O-CB 3.49Å; T59-L63 PolarHBondContact O-N 3.46Å; N60-L63 PolarHBondContact O-N 3.24Å; L63-S66 WeakPolarHBondContact O-CB 3.25Å; L63-S66 PolarHBondContact O-N 3Å; L63-S66 PolarHBondContact O-OG 3.46Å; L63-C69 WeakPolarHBondContact O-CB 3.22Å; L63-L321 HydrophobicContact CD1-CD2 4.38Å; L63-L321 HydrophobicContact CD2-CD2 4.19Å; L63-L321 HydrophobicContact CD2-CG 4.49Å; L63-I330 HydrophobicContact CD1-CB 4.36Å; L63-I330 HydrophobicContact CD1-CD1 3.98Å; L63-I330 HydrophobicContact CD1-CG2 4.19Å; L63-L332 HydrophobicContact CD1-CD1 4.35Å
64F78.5Confident76.2Confident3 Ų347.2 Ų47.21%0.01322%0.221CC..Hα-helixtrans-78.5-20.3-176.4-71-67.2000114.2N60 C69 L73 R78 L81 L82 I85 L320N60-F64 HydrophobicContact CB-CD2 4.28Å; N60-F64 HydrophobicContact CB-CE2 4.34Å; N60-F64 WeakPolarHBondContact O-CD2 3.46Å; N60-F64 PolarHBondContact O-N 3.23Å; F64-C69 WeakPolarHBondContact CD1-SG 3.26Å; F64-L73 HydrophobicContact CD1-CD1 3.95Å; F64-L73 HydrophobicContact CE1-CD1 3.73Å; F64-R78 WeakPolarHBondContact O-CD 3.43Å; F64-L81 HydrophobicContact CD1-CD2 3.62Å; F64-L81 HydrophobicContact CD2-CD2 3.77Å; F64-L81 HydrophobicContact CE1-CD2 3.26Å; F64-L81 HydrophobicContact CE2-CD2 3.44Å; F64-L81 VanDerWaalsContact CE2-CD2 3.44Å; F64-L81 HydrophobicContact CG-CD2 3.9Å; F64-L81 HydrophobicContact CZ-CD2 3.2Å; F64-L82 HydrophobicContact CB-CD2 3.74Å; F64-L82 HydrophobicContact CB-CG 4.28Å; F64-I85 HydrophobicContact CD2-CD1 3.4Å; F64-I85 VanDerWaalsContact CD2-CD1 3.4Å; F64-I85 HydrophobicContact CE2-CD1 3.92Å; F64-I85 HydrophobicContact CG-CD1 4.28Å; F64-L320 HydrophobicContact CE2-CD1 4.26Å; F64-L320 HydrophobicContact CZ-CD1 3.82Å
65R78.4Confident75.9Confident115 Ų11546.1 Ų46.143%0.43422%0.217SC..Hα-helixtrans-81.2-22.3169.3-76.8-175.8170.2158.9-0.8113.6L61 A62 V67 L82 C341L61-R65 VanDerWaalsContact O-CB 3.29Å; L61-R65 WeakPolarHBondContact O-CB 3.44Å; L61-R65 WeakPolarHBondContact O-CG 3.37Å; L61-R65 PolarHBondContact O-N 3.24Å; A62-R65 PolarHBondContact O-N 3.06Å; R65-V67 PolarHBondContact O-N 2.93Å; R65-L82 HydrophobicContact CG-CD2 3.98Å; R65-C341 VanDerWaalsContact CD-SG 3.54Å; R65-C341 PolarHBondContact NH1-SG 3.26Å
66S73.8Confident75.9Confident10 Ų1041.9 Ų41.97%0.0720%0.2CC..SBendtrans-54.7139.6179.975.60000112.2A62 L63 R68 C69 S70A62-S66 PolarHBondContact O-N 2.82Å; A62-S66 VanDerWaalsContact O-N 3.07Å; L63-S66 WeakPolarHBondContact O-CB 3.25Å; L63-S66 PolarHBondContact O-N 3Å; L63-S66 PolarHBondContact O-OG 3.46Å; S66-R68 PolarHBondContact O-N 3.23Å; S66-R68 VanDerWaalsContact O-N 3.13Å; S66-C69 WeakPolarHBondContact O-CB 3.33Å; S66-C69 PolarHBondContact O-N 3.36Å; S66-C69 WeakPolarHBondContact OG-CB 3.49Å; S66-C69 PolarHBondContact OG-N 2.98Å; S66-S70 PolarHBondContact O-N 2.83Å; S66-S70 VanDerWaalsContact O-N 3.16Å
67V62.7Low75.9Confident102 Ų10241.7 Ų41.762%0.61820%0.198SC*.Hα-helixtrans-58.9-26.8179.7-179.10000112R65 S70R65-V67 PolarHBondContact O-N 2.93Å; V67-S70 PolarHBondContact O-OG 2.82Å
68R65.7Low75.9Confident130 Ų13044.3 Ų44.349%0.49121%0.206SC..Hα-helixtrans-69.5-40.4176-63.3-174.3-170.31749.4111.3S66 S70 R71 L72 L329 I330S66-R68 PolarHBondContact O-N 3.23Å; S66-R68 VanDerWaalsContact O-N 3.13Å; R68-S70 VanDerWaalsContact C-N 3.32Å; R68-R71 PolarHBondContact O-N 3.39Å; R68-L72 WeakPolarHBondContact O-CG 3.28Å; R68-L329 PolarHBondContact NH1-O 2.84Å; R68-I330 HydrophobicContact CB-CD1 4.03Å; R68-I330 HydrophobicContact CB-CG1 3.92Å
69C65.4Low75.9Confident0 Ų043.1 Ų43.10%020%0.199CC..Hα-helixtrans-68.8-32.7178.3-160.80000111.9L63 F64 S66 R71 L72 L73 I330L63-C69 WeakPolarHBondContact O-CB 3.22Å; F64-C69 WeakPolarHBondContact CD1-SG 3.26Å; S66-C69 WeakPolarHBondContact O-CB 3.33Å; S66-C69 PolarHBondContact O-N 3.36Å; S66-C69 WeakPolarHBondContact OG-CB 3.49Å; S66-C69 PolarHBondContact OG-N 2.98Å; C69-R71 PolarHBondContact O-N 3.39Å; C69-L72 PolarHBondContact O-N 2.96Å; C69-L73 PolarHBondContact O-N 3.44Å; C69-L73 VanDerWaalsContact O-N 3.14Å; C69-L73 WeakPolarHBondContact SG-CD1 3.31Å; C69-I330 HydrophobicContact CB-CD1 4.33Å
70S60.5Low76.3Confident43 Ų4342.3 Ų42.330%0.30119%0.194SC..Hα-helixtrans-60.7-26.5176.776.40000114.2S66 V67 R68S66-S70 PolarHBondContact O-N 2.83Å; S66-S70 VanDerWaalsContact O-N 3.16Å; V67-S70 PolarHBondContact O-OG 2.82Å; R68-S70 VanDerWaalsContact C-N 3.32Å
71R62.2Low76.6Confident217 Ų21742.3 Ų42.382%0.81919%0.194SC*.THydrogen-bonded Turntrans-86.9-16.2177.6-64.7-176.7-179.3173.90.4113.4R68 C69R68-R71 PolarHBondContact O-N 3.39Å; C69-R71 PolarHBondContact O-N 3.39Å
72L66.3Low76.8Confident29 Ų2942.4 Ų42.415%0.15220%0.195CC..THydrogen-bonded Turntrans-98-34.5-173.2-69.6174.6000112.9R68 C69 N255 K326 L327R68-L72 WeakPolarHBondContact O-CG 3.28Å; C69-L72 PolarHBondContact O-N 2.96Å; L72-N255 PolarHBondContact O-ND2 3.01Å; L72-K326 HydrophobicContact CD1-CB 3.76Å; L72-K326 HydrophobicContact CD2-CB 3.87Å; L72-K326 HydrophobicContact CD2-CD 3.51Å; L72-K326 HydrophobicContact CD2-CG 4.28Å; L72-K326 HydrophobicContact CG-CB 4.44Å; L72-L327 HydrophobicContact CD1-CD2 4.32Å
73L71.2Confident77.3Confident18 Ų1844.6 Ų44.69%0.09420%0.204CC..SBendtrans-111.4131.7-177.8-77.7138.6000110.3F64 C69 V77 R78 I259F64-L73 HydrophobicContact CD1-CD1 3.95Å; F64-L73 HydrophobicContact CE1-CD1 3.73Å; C69-L73 PolarHBondContact O-N 3.44Å; C69-L73 VanDerWaalsContact O-N 3.14Å; C69-L73 WeakPolarHBondContact SG-CD1 3.31Å; L73-V77 HydrophobicContact CD2-CB 4.29Å; L73-V77 HydrophobicContact CD2-CG1 3.59Å; L73-R78 HydrophobicContact CB-CB 4.47Å; L73-I259 HydrophobicContact CD2-CD1 4.13Å; L73-I259 HydrophobicContact CD2-CG2 4.06Å; L73-I259 HydrophobicContact CG-CD1 4.48Å
74H77.3Confident77.9Confident36 Ų3644.4 Ų44.417%0.16720%0.203CC..  trans-53.2142.3172.4-67.3-81000110.8N76 V77 R78 Y154H74-N76 PolarHBondContact O-N 2.75Å; H74-N76 VanDerWaalsContact O-N 3.13Å; H74-V77 HydrophobicContact CB-CG2 4.04Å; H74-V77 WeakPolarHBondContact O-CB 2.82Å; H74-V77 PolarHBondContact O-N 3.46Å; H74-R78 PolarHBondContact O-N 2.93Å; H74-Y154 HydrophobicContact CB-CE1 4.47Å; H74-Y154 AromaticContact CD2-CD1 3.78Å; H74-Y154 AromaticContact CD2-CE1 3.47Å; H74-Y154 VanDerWaalsContact CD2-CE1 3.47Å; H74-Y154 WeakPolarHBondContact CD2-CE1 3.49Å; H74-Y154 AromaticContact CD2-CE2 3.99Å; H74-Y154 AromaticContact CD2-CZ 3.55Å; H74-Y154 VanDerWaalsContact CE1-CB 3.49Å; H74-Y154 WeakPolarHBondContact CE1-CB 3.19Å; H74-Y154 AromaticContact CE1-CD1 3.3Å; H74-Y154 WeakPolarHBondContact CE1-CD1 3.27Å; H74-Y154 AromaticContact CE1-CD2 3.58Å; H74-Y154 AromaticContact CE1-CE1 3.83Å; H74-Y154 AromaticContact CE1-CG 3.15Å; H74-Y154 AromaticContact CG-CD1 3.73Å; H74-Y154 AromaticContact CG-CE1 3.69Å; H74-Y154 AromaticContact ND1-CD1 3.42Å; H74-Y154 WeakPolarHBondContact ND1-CD1 3.48Å; H74-Y154 AromaticContact ND1-CE1 3.89Å; H74-Y154 AromaticContact ND1-CG 3.75Å; H74-Y154 AromaticContact NE2-CD1 3.54Å; H74-Y154 AromaticContact NE2-CD2 3.41Å; H74-Y154 WeakPolarHBondContact NE2-CD2 3.34Å; H74-Y154 AromaticContact NE2-CE1 3.58Å; H74-Y154 AromaticContact NE2-CE2 3.42Å; H74-Y154 WeakPolarHBondContact NE2-CE2 3.19Å; H74-Y154 AromaticContact NE2-CG 3.44Å; H74-Y154 AromaticContact NE2-CZ 3.48Å
75A81Confident78.3Confident14 Ų1444.5 Ų44.512%0.11620%0.204CC..Hα-helixtrans-54.8-37.6-174.500000113.1M79 E158A75-M79 WeakPolarHBondContact O-CB 3.17Å; A75-M79 PolarHBondContact O-N 3.4Å; A75-E158 VanDerWaalsContact CB-O 3.31Å; A75-E158 WeakPolarHBondContact CB-O 3.48Å
76N86.1Confident78.9Confident27 Ų2741.8 Ų41.814%0.14420%0.197CC..Hα-helixtrans-60.5-49.1175.7-67.81000112.5H74 R78 M79 L80 E144 S160 S161 V164H74-N76 PolarHBondContact O-N 2.75Å; H74-N76 VanDerWaalsContact O-N 3.13Å; N76-R78 VanDerWaalsContact C-N 3.35Å; N76-R78 PolarHBondContact O-N 3.27Å; N76-M79 PolarHBondContact O-N 3.26Å; N76-L80 WeakPolarHBondContact O-CG 3.31Å; N76-L80 PolarHBondContact O-N 2.94Å; N76-E144 WeakPolarHBondContact CB-OE2 3.46Å; N76-E144 PolarHBondContact ND2-OE2 3.37Å; N76-S160 WeakPolarHBondContact OD1-CA 3.43Å; N76-S161 PolarHBondContact OD1-N 2.88Å; N76-V164 HydrophobicContact CB-CB 4.47Å; N76-V164 HydrophobicContact CB-CG1 4.34Å; N76-V164 HydrophobicContact CB-CG2 3.95Å
77V84.4Confident79.7Confident0 Ų041.3 Ų41.30%019%0.194CC..Hα-helixtrans-61.4-48.6-180-174.40000109.7L73 H74 M79 L80 L81 L141L73-V77 HydrophobicContact CD2-CB 4.29Å; L73-V77 HydrophobicContact CD2-CG1 3.59Å; H74-V77 HydrophobicContact CB-CG2 4.04Å; H74-V77 WeakPolarHBondContact O-CB 2.82Å; H74-V77 PolarHBondContact O-N 3.46Å; V77-M79 VanDerWaalsContact C-N 3.31Å; V77-M79 PolarHBondContact O-N 2.88Å; V77-L80 PolarHBondContact O-N 2.83Å; V77-L81 VanDerWaalsContact O-CB 3.29Å; V77-L81 WeakPolarHBondContact O-CB 3.34Å; V77-L81 PolarHBondContact O-N 2.89Å; V77-L141 HydrophobicContact CB-CD1 4.19Å; V77-L141 HydrophobicContact CG1-CD1 3.5Å
78R85.8Confident80.8Confident66 Ų6636.7 Ų36.725%0.24917%0.166CC..Hα-helixtrans-59.7-44.1179.9-177.6178.159.9157.3-5.5110.8F64 L73 H74 N76 L81 L82F64-R78 WeakPolarHBondContact O-CD 3.43Å; L73-R78 HydrophobicContact CB-CB 4.47Å; H74-R78 PolarHBondContact O-N 2.93Å; N76-R78 VanDerWaalsContact C-N 3.35Å; N76-R78 PolarHBondContact O-N 3.27Å; R78-L81 PolarHBondContact O-N 2.98Å; R78-L82 HydrophobicContact CG-CD1 3.9Å; R78-L82 HydrophobicContact CG-CG 4.35Å; R78-L82 WeakPolarHBondContact O-CB 3.07Å; R78-L82 WeakPolarHBondContact O-CG 3.35Å; R78-L82 PolarHBondContact O-N 3.11Å
79M87.5Confident81.9Confident40 Ų4031.1 Ų31.120%0.19715%0.149CC..Hα-helixtrans-61.1-52.3177.5-176.7173.8-74.900111.7A75 N76 V77 L81 L82 H83 S160 V164 K165 V168A75-M79 WeakPolarHBondContact O-CB 3.17Å; A75-M79 PolarHBondContact O-N 3.4Å; N76-M79 PolarHBondContact O-N 3.26Å; V77-M79 VanDerWaalsContact C-N 3.31Å; V77-M79 PolarHBondContact O-N 2.88Å; M79-L81 VanDerWaalsContact C-N 3.29Å; M79-L81 PolarHBondContact O-N 3.14Å; M79-L82 PolarHBondContact O-N 3.26Å; M79-H83 PolarHBondContact O-CD2 2.86Å; M79-H83 PolarHBondContact O-N 3.05Å; M79-S160 WeakPolarHBondContact CE-OG 3.35Å; M79-V164 HydrophobicContact SD-CG1 4.27Å; M79-K165 HydrophobicContact CE-CD 4.49Å; M79-K165 HydrophobicContact CE-CG 3.73Å; M79-K165 HydrophobicContact SD-CB 4.48Å; M79-K165 HydrophobicContact SD-CG 3.65Å; M79-V168 HydrophobicContact CG-CG2 4.37Å
80L90Very high83Confident2 Ų233.4 Ų33.41%0.0116%0.163CC..Hα-helixtrans-58.7-42178.2-70.6169000111.9N76 V77 S84 A140 L141 E144 V164 F167 V168N76-L80 WeakPolarHBondContact O-CG 3.31Å; N76-L80 PolarHBondContact O-N 2.94Å; V77-L80 PolarHBondContact O-N 2.83Å; L80-S84 WeakPolarHBondContact O-CB 3.49Å; L80-S84 PolarHBondContact O-N 3.44Å; L80-A140 HydrophobicContact CD1-CB 4.14Å; L80-A140 HydrophobicContact CD2-CB 3.89Å; L80-L141 HydrophobicContact CB-CD1 4.16Å; L80-L141 HydrophobicContact CD1-CB 4.5Å; L80-L141 HydrophobicContact CD1-CD1 4.48Å; L80-E144 HydrophobicContact CD1-CB 4.43Å; L80-E144 HydrophobicContact CD1-CG 3.71Å; L80-V164 HydrophobicContact CD1-CG1 4.21Å; L80-V164 HydrophobicContact CD2-CG1 4.07Å; L80-V164 HydrophobicContact CG-CG1 3.84Å; L80-F167 HydrophobicContact CD2-CD1 4.18Å; L80-F167 HydrophobicContact CD2-CE1 4.41Å; L80-V168 HydrophobicContact CD2-CG2 3.93Å
81L87.6Confident84.2Confident2 Ų231.6 Ų31.61%0.0115%0.15CC..Hα-helixtrans-65.3-45.8178-145.682.8000111.5F64 V77 R78 M79 H83 S84 I85 L141 L263F64-L81 HydrophobicContact CD1-CD2 3.62Å; F64-L81 HydrophobicContact CD2-CD2 3.77Å; F64-L81 HydrophobicContact CE1-CD2 3.26Å; F64-L81 HydrophobicContact CE2-CD2 3.44Å; F64-L81 VanDerWaalsContact CE2-CD2 3.44Å; F64-L81 HydrophobicContact CG-CD2 3.9Å; F64-L81 HydrophobicContact CZ-CD2 3.2Å; V77-L81 VanDerWaalsContact O-CB 3.29Å; V77-L81 WeakPolarHBondContact O-CB 3.34Å; V77-L81 PolarHBondContact O-N 2.89Å; R78-L81 PolarHBondContact O-N 2.98Å; M79-L81 VanDerWaalsContact C-N 3.29Å; M79-L81 PolarHBondContact O-N 3.14Å; L81-H83 PolarHBondContact O-N 3.27Å; L81-S84 WeakPolarHBondContact CA-OG 3.46Å; L81-S84 PolarHBondContact O-N 2.88Å; L81-S84 PolarHBondContact O-OG 2.88Å; L81-I85 HydrophobicContact CD2-CD1 4.38Å; L81-I85 HydrophobicContact CG-CD1 4.28Å; L81-I85 WeakPolarHBondContact O-CD1 2.99Å; L81-I85 VanDerWaalsContact O-CG1 3.27Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 3.21Å; L81-L141 HydrophobicContact CD1-CD1 4.4Å; L81-L141 HydrophobicContact CD1-CD2 3.51Å; L81-L263 HydrophobicContact CD1-CD2 4Å
82L89Confident85.4Confident27 Ų2721.3 Ų21.314%0.14111%0.111CC..Hα-helixtrans-58.6-45.8177.9-75.6168.5000111.6L61 F64 R65 R78 M79 I85 I86L61-L82 HydrophobicContact CD1-CD2 3.73Å; F64-L82 HydrophobicContact CB-CD2 3.74Å; F64-L82 HydrophobicContact CB-CG 4.28Å; R65-L82 HydrophobicContact CG-CD2 3.98Å; R78-L82 HydrophobicContact CG-CD1 3.9Å; R78-L82 HydrophobicContact CG-CG 4.35Å; R78-L82 WeakPolarHBondContact O-CB 3.07Å; R78-L82 WeakPolarHBondContact O-CG 3.35Å; R78-L82 PolarHBondContact O-N 3.11Å; M79-L82 PolarHBondContact O-N 3.26Å; L82-I85 PolarHBondContact O-N 2.96Å; L82-I86 VanDerWaalsContact O-CG1 3.27Å; L82-I86 WeakPolarHBondContact O-CG1 2.94Å; L82-I86 PolarHBondContact O-N 3.32Å
83H91.9Very high86.4Confident50 Ų5025 Ų2523%0.23113%0.126CC..Hα-helixtrans-67.1-35.5177.3-76.6-78.5000112.6M79 L81 I86 A87 V168 W172M79-H83 PolarHBondContact O-CD2 2.86Å; M79-H83 PolarHBondContact O-N 3.05Å; L81-H83 PolarHBondContact O-N 3.27Å; H83-I86 PolarHBondContact O-N 2.85Å; H83-A87 WeakPolarHBondContact O-CB 3.35Å; H83-A87 PolarHBondContact O-N 3.49Å; H83-V168 HydrophobicContact CB-CG1 4.3Å; H83-V168 VanDerWaalsContact CD2-CG1 3.44Å; H83-V168 WeakPolarHBondContact CD2-CG1 3.5Å; H83-V168 WeakPolarHBondContact NE2-CG1 3.32Å; H83-W172 AromaticContact CE1-NE1 3.94Å; H83-W172 AromaticContact CG-NE1 3.96Å; H83-W172 AromaticContact ND1-NE1 3.15Å; H83-W172 PolarHBondContact ND1-NE1 3.43Å; H83-W172 VanDerWaalsContact ND1-NE1 3.15Å
84S89.8Confident87.1Confident1 Ų124.8 Ų24.81%0.00712%0.124CC..Hα-helixtrans-63.3-41.4171.975.20000112.2L80 L81 A87 C88 F134L80-S84 WeakPolarHBondContact O-CB 3.49Å; L80-S84 PolarHBondContact O-N 3.44Å; L81-S84 WeakPolarHBondContact CA-OG 3.46Å; L81-S84 PolarHBondContact O-N 2.88Å; L81-S84 PolarHBondContact O-OG 2.88Å; S84-A87 PolarHBondContact O-N 2.94Å; S84-C88 WeakPolarHBondContact O-CB 3.47Å; S84-C88 PolarHBondContact O-N 3.28Å; S84-F134 WeakPolarHBondContact O-CD2 3.22Å
85I88.2Confident87.3Confident6 Ų623.1 Ų23.13%0.03112%0.117CC..Hα-helixtrans-66.2-42178.4-68.6155.5000110.9S57 N60 L61 F64 L81 L82 C88 G89S57-I85 VanDerWaalsContact O-CG2 3.29Å; S57-I85 WeakPolarHBondContact O-CG2 2.91Å; N60-I85 HydrophobicContact CB-CD1 3.76Å; N60-I85 HydrophobicContact CB-CG1 4.04Å; N60-I85 HydrophobicContact CB-CG2 3.91Å; L61-I85 HydrophobicContact CB-CG2 4.38Å; F64-I85 HydrophobicContact CD2-CD1 3.4Å; F64-I85 VanDerWaalsContact CD2-CD1 3.4Å; F64-I85 HydrophobicContact CE2-CD1 3.92Å; F64-I85 HydrophobicContact CG-CD1 4.28Å; L81-I85 HydrophobicContact CD2-CD1 4.38Å; L81-I85 HydrophobicContact CG-CD1 4.28Å; L81-I85 WeakPolarHBondContact O-CD1 2.99Å; L81-I85 VanDerWaalsContact O-CG1 3.27Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 3.21Å; L82-I85 PolarHBondContact O-N 2.96Å; I85-C88 WeakPolarHBondContact O-CB 3.47Å; I85-C88 PolarHBondContact O-N 3.44Å; I85-G89 PolarHBondContact O-N 2.9Å
86I90.6Very high87.5Confident57 Ų5724.4 Ų24.429%0.29212%0.121SC..Hα-helixtrans-61.6-48.4176.4-69.6165.3000110.2L61 L82 H83 C88 G89 V90 W172L61-I86 HydrophobicContact CD1-CG1 4.3Å; L82-I86 VanDerWaalsContact O-CG1 3.27Å; L82-I86 WeakPolarHBondContact O-CG1 2.94Å; L82-I86 PolarHBondContact O-N 3.32Å; H83-I86 PolarHBondContact O-N 2.85Å; I86-C88 VanDerWaalsContact C-N 3.34Å; I86-C88 PolarHBondContact O-N 3.21Å; I86-G89 PolarHBondContact O-N 3.19Å; I86-G89 VanDerWaalsContact O-N 3.17Å; I86-V90 WeakPolarHBondContact O-CG2 3.07Å; I86-V90 PolarHBondContact O-N 3.15Å; I86-W172 HydrophobicContact CG2-CH2 4.31Å; I86-W172 HydrophobicContact CG2-CZ2 4.19Å
87A90.2Very high87.3Confident0 Ų026.2 Ų26.20%013%0.13CC..Hα-helixtrans-58.5-46.1177.700000111.5H83 S84 G89 V90 V91 C130 V133 F134H83-A87 WeakPolarHBondContact O-CB 3.35Å; H83-A87 PolarHBondContact O-N 3.49Å; S84-A87 PolarHBondContact O-N 2.94Å; A87-G89 PolarHBondContact O-N 3.4Å; A87-V90 PolarHBondContact O-N 3.31Å; A87-V91 WeakPolarHBondContact O-CG2 3.42Å; A87-V91 PolarHBondContact O-N 3.24Å; A87-V91 VanDerWaalsContact O-N 3.08Å; A87-C130 HydrophobicContact CB-CB 3.91Å; A87-C130 WeakPolarHBondContact O-CB 3.37Å; A87-V133 HydrophobicContact CB-CB 4.26Å; A87-V133 HydrophobicContact CB-CG1 4.06Å; A87-F134 HydrophobicContact CB-CB 4.08Å
88C86.7Confident87Confident6 Ų626.7 Ų26.74%0.04113%0.132CC..Hα-helixtrans-58-45.4173.1-84.50000113.3S84 I85 I86 V90 V91 C92 F134 I313S84-C88 WeakPolarHBondContact O-CB 3.47Å; S84-C88 PolarHBondContact O-N 3.28Å; I85-C88 WeakPolarHBondContact O-CB 3.47Å; I85-C88 PolarHBondContact O-N 3.44Å; I86-C88 VanDerWaalsContact C-N 3.34Å; I86-C88 PolarHBondContact O-N 3.21Å; C88-V90 VanDerWaalsContact C-N 3.29Å; C88-V90 PolarHBondContact O-N 3.06Å; C88-V91 WeakPolarHBondContact O-CB 3.46Å; C88-V91 PolarHBondContact O-N 3.17Å; C88-V91 VanDerWaalsContact O-N 3.12Å; C88-C92 PolarHBondContact O-N 2.95Å; C88-C92 PolarHBondContact O-SG 2.99Å; C88-F134 WeakPolarHBondContact SG-CD2 3.31Å; C88-F134 WeakPolarHBondContact SG-CE2 3.44Å; C88-I313 HydrophobicContact CB-CD1 3.51Å; C88-I313 HydrophobicContact CB-CG1 3.88Å; C88-I313 HydrophobicContact CB-CG2 4.41Å; C88-I313 VanDerWaalsContact SG-CD1 3.59Å
89G87.9Confident86.4Confident13 Ų1323.6 Ų23.613%0.13412%0.121CC..Hα-helixtrans-59.5-40.5178.400000112.2I85 I86 A87 C92 F93I85-G89 PolarHBondContact O-N 2.9Å; I86-G89 PolarHBondContact O-N 3.19Å; I86-G89 VanDerWaalsContact O-N 3.17Å; A87-G89 PolarHBondContact O-N 3.4Å; G89-C92 PolarHBondContact O-N 3.32Å; G89-F93 WeakPolarHBondContact O-CB 3.25Å; G89-F93 PolarHBondContact O-N 3.13Å
90V90Very high86Confident47 Ų4724.8 Ų24.829%0.28513%0.127SC..Hα-helixtrans-65.4-39.2174.7174.80000111.6I86 A87 C88 F93 R94 P126 C130I86-V90 WeakPolarHBondContact O-CG2 3.07Å; I86-V90 PolarHBondContact O-N 3.15Å; A87-V90 PolarHBondContact O-N 3.31Å; C88-V90 VanDerWaalsContact C-N 3.29Å; C88-V90 PolarHBondContact O-N 3.06Å; V90-F93 PolarHBondContact O-N 3.36Å; V90-R94 WeakPolarHBondContact O-CB 3.36Å; V90-R94 PolarHBondContact O-N 3.42Å; V90-P126 HydrophobicContact CG1-CB 3.82Å; V90-C130 HydrophobicContact CB-CB 4.49Å; V90-C130 VanDerWaalsContact CB-SG 3.52Å; V90-C130 WeakPolarHBondContact CG1-SG 3.38Å
91V85.7Confident85.2Confident6 Ų625.2 Ų25.24%0.03613%0.131CC..Hα-helixtrans-62.6-46.4174.8174.50000110.9A87 C88 F93 R94 Q95 C130 F131 L309A87-V91 WeakPolarHBondContact O-CG2 3.42Å; A87-V91 PolarHBondContact O-N 3.24Å; A87-V91 VanDerWaalsContact O-N 3.08Å; C88-V91 WeakPolarHBondContact O-CB 3.46Å; C88-V91 PolarHBondContact O-N 3.17Å; C88-V91 VanDerWaalsContact O-N 3.12Å; V91-F93 PolarHBondContact O-N 3.41Å; V91-R94 PolarHBondContact O-N 3.05Å; V91-Q95 WeakPolarHBondContact O-CB 3.27Å; V91-Q95 PolarHBondContact O-N 3.25Å; V91-C130 HydrophobicContact CG2-CB 3.69Å; V91-F131 HydrophobicContact CG1-CE1 4.44Å; V91-F131 HydrophobicContact CG1-CE2 4.48Å; V91-F131 HydrophobicContact CG1-CZ 4.01Å; V91-L309 HydrophobicContact CG1-CD2 3.98Å
92C86.7Confident84.2Confident0 Ų025.6 Ų25.60%013%0.134CC..Hα-helixtrans-62.9-42.2176.5-65.40000111.9I54 C88 G89 R94 Q95 M96 C310 I313I54-C92 HydrophobicContact CG1-CB 3.91Å; C88-C92 PolarHBondContact O-N 2.95Å; C88-C92 PolarHBondContact O-SG 2.99Å; G89-C92 PolarHBondContact O-N 3.32Å; C92-R94 PolarHBondContact O-N 3.3Å; C92-Q95 WeakPolarHBondContact O-CB 3.26Å; C92-Q95 PolarHBondContact O-N 2.93Å; C92-M96 PolarHBondContact O-N 3.12Å; C92-C310 VanDerWaalsContact SG-SG 3.66Å; C92-I313 VanDerWaalsContact SG-CD1 3.53Å
93F87.5Confident83.3Confident107 Ų10725.9 Ų25.947%0.46914%0.138SC..Hα-helixtrans-62.2-43.5176.2-176.5-104.2000112.1I54 G89 V90 V91 Q95 M96 I97I54-F93 HydrophobicContact CD1-CB 4.48Å; I54-F93 HydrophobicContact CD1-CD2 4.28Å; G89-F93 WeakPolarHBondContact O-CB 3.25Å; G89-F93 PolarHBondContact O-N 3.13Å; V90-F93 PolarHBondContact O-N 3.36Å; V91-F93 PolarHBondContact O-N 3.41Å; F93-Q95 VanDerWaalsContact C-N 3.32Å; F93-Q95 PolarHBondContact O-N 3.29Å; F93-M96 HydrophobicContact CD2-CE 3.69Å; F93-M96 HydrophobicContact CE2-CE 3.56Å; F93-M96 WeakPolarHBondContact O-CB 3.45Å; F93-M96 PolarHBondContact O-N 3.13Å; F93-I97 HydrophobicContact CD1-CD1 3.77Å; F93-I97 HydrophobicContact CE1-CD1 3.34Å; F93-I97 HydrophobicContact CE1-CG1 4.25Å; F93-I97 HydrophobicContact CZ-CD1 3.89Å; F93-I97 HydrophobicContact CZ-CG1 4.44Å; F93-I97 PolarHBondContact O-N 3.46Å
94R86Confident82.2Confident13 Ų1326.7 Ų26.75%0.04914%0.143CC..Hα-helixtrans-61.8-40.4173.1177.6-87.4-176.3-164.6-16.1111.4V90 V91 C92 M96 I97 Q98 M123V90-R94 WeakPolarHBondContact O-CB 3.36Å; V90-R94 PolarHBondContact O-N 3.42Å; V91-R94 PolarHBondContact O-N 3.05Å; C92-R94 PolarHBondContact O-N 3.3Å; R94-M96 VanDerWaalsContact C-N 3.3Å; R94-M96 PolarHBondContact O-N 3.36Å; R94-I97 PolarHBondContact O-N 3.45Å; R94-Q98 PolarHBondContact O-N 2.96Å; R94-M123 WeakPolarHBondContact CG-O 3.44Å
95Q81.4Confident80.9Confident1 Ų127.2 Ų27.21%0.00515%0.145CC..Hα-helixtrans-62.8-38.6177-167.465.512.200111.5T46 A50 V91 C92 F93 Q98 G99 L306T46-Q95 HydrophobicContact CG2-CG 3.64Å; A50-Q95 HydrophobicContact CB-CB 4.14Å; A50-Q95 HydrophobicContact CB-CG 4.32Å; V91-Q95 WeakPolarHBondContact O-CB 3.27Å; V91-Q95 PolarHBondContact O-N 3.25Å; C92-Q95 WeakPolarHBondContact O-CB 3.26Å; C92-Q95 PolarHBondContact O-N 2.93Å; F93-Q95 VanDerWaalsContact C-N 3.32Å; F93-Q95 PolarHBondContact O-N 3.29Å; Q95-Q98 PolarHBondContact O-N 2.96Å; Q95-G99 PolarHBondContact O-N 3.41Å; Q95-L306 VanDerWaalsContact OE1-CD2 3.3Å
96M84.7Confident79.7Confident42 Ų4230.5 Ų30.521%0.20716%0.162CC..Hα-helixtrans-61.3-48.7172.7-172.2-176.772.100111.2A50 I54 C92 F93 R94 Q98 G99 I100A50-M96 HydrophobicContact CB-CB 3.81Å; I54-M96 HydrophobicContact CD1-CB 4.28Å; I54-M96 HydrophobicContact CD1-CE 4.24Å; I54-M96 HydrophobicContact CD1-SD 3.71Å; C92-M96 PolarHBondContact O-N 3.12Å; F93-M96 HydrophobicContact CD2-CE 3.69Å; F93-M96 HydrophobicContact CE2-CE 3.56Å; F93-M96 WeakPolarHBondContact O-CB 3.45Å; F93-M96 PolarHBondContact O-N 3.13Å; R94-M96 VanDerWaalsContact C-N 3.3Å; R94-M96 PolarHBondContact O-N 3.36Å; M96-Q98 VanDerWaalsContact C-N 3.33Å; M96-Q98 PolarHBondContact O-N 3.47Å; M96-G99 PolarHBondContact O-N 3.44Å; M96-G99 VanDerWaalsContact O-N 3.17Å; M96-I100 HydrophobicContact CG-CD1 4.17Å; M96-I100 WeakPolarHBondContact O-CG1 3.48Å; M96-I100 PolarHBondContact O-N 3.25Å
97I82.9Confident78.4Confident64 Ų6431.1 Ų31.133%0.32817%0.169SC..Hα-helixtrans-59.3-44.6176.6-67.4169.8000110.8F93 R94 G99 I100 A101 M123F93-I97 HydrophobicContact CD1-CD1 3.77Å; F93-I97 HydrophobicContact CE1-CD1 3.34Å; F93-I97 HydrophobicContact CE1-CG1 4.25Å; F93-I97 HydrophobicContact CZ-CD1 3.89Å; F93-I97 HydrophobicContact CZ-CG1 4.44Å; F93-I97 PolarHBondContact O-N 3.46Å; R94-I97 PolarHBondContact O-N 3.45Å; I97-G99 VanDerWaalsContact C-N 3.32Å; I97-G99 PolarHBondContact O-N 3.11Å; I97-I100 PolarHBondContact O-N 3.03Å; I97-A101 WeakPolarHBondContact O-CB 3.45Å; I97-A101 PolarHBondContact O-N 3.1Å; I97-M123 HydrophobicContact CG2-SD 4.38Å
98Q76.3Confident77Confident11 Ų1134.8 Ų34.85%0.05119%0.185CC..Hα-helixtrans-60.7-43.1176.8-177.8-176.4-26.400111R94 Q95 M96 A101 S102 Y194 C195R94-Q98 PolarHBondContact O-N 2.96Å; Q95-Q98 PolarHBondContact O-N 2.96Å; M96-Q98 VanDerWaalsContact C-N 3.33Å; M96-Q98 PolarHBondContact O-N 3.47Å; Q98-A101 PolarHBondContact O-N 3.2Å; Q98-S102 VanDerWaalsContact O-CB 3.24Å; Q98-S102 WeakPolarHBondContact O-CB 3.44Å; Q98-S102 PolarHBondContact O-N 3.17Å; Q98-S102 PolarHBondContact O-OG 2.93Å; Q98-Y194 PolarHBondContact NE2-OH 3.43Å; Q98-C195 PolarHBondContact NE2-O 3.03Å
99G74Confident75.2Confident1 Ų142.5 Ų42.51%0.0123%0.226CC..Hα-helixtrans-56.9-50.4174.500000111.4Q95 M96 I97 A101 S102 S103Q95-G99 PolarHBondContact O-N 3.41Å; M96-G99 PolarHBondContact O-N 3.44Å; M96-G99 VanDerWaalsContact O-N 3.17Å; I97-G99 VanDerWaalsContact C-N 3.32Å; I97-G99 PolarHBondContact O-N 3.11Å; G99-A101 PolarHBondContact O-N 3.01Å; G99-S102 PolarHBondContact O-N 3.24Å; G99-S103 WeakPolarHBondContact O-CB 3.3Å; G99-S103 PolarHBondContact O-N 3.4Å; G99-S103 PolarHBondContact O-OG 3.27Å
100I79Confident73.5Confident64 Ų6446.7 Ų46.733%0.32825%0.248SC..Hα-helixtrans-59.7-50.4178.9-64.1165.4000111M47 M96 I97 S102 S103 M104M47-I100 VanDerWaalsContact CE-CA 3.43Å; M47-I100 HydrophobicContact CE-CB 3.99Å; M47-I100 HydrophobicContact CE-CG1 3.38Å; M96-I100 HydrophobicContact CG-CD1 4.17Å; M96-I100 WeakPolarHBondContact O-CG1 3.48Å; M96-I100 PolarHBondContact O-N 3.25Å; I97-I100 PolarHBondContact O-N 3.03Å; I100-S102 VanDerWaalsContact C-N 3.33Å; I100-S102 PolarHBondContact O-N 2.93Å; I100-S103 PolarHBondContact O-N 3.47Å; I100-M104 HydrophobicContact CG2-CE 3.65Å; I100-M104 HydrophobicContact CG2-SD 4.09Å; I100-M104 WeakPolarHBondContact O-CG 3.39Å; I100-M104 PolarHBondContact O-N 3.43Å
101A72.4Confident71.7Confident11 Ų1149.5 Ų49.59%0.09126%0.257CS..Hα-helixtrans-62.4-40.9-178.800000111.9I97 Q98 G99 M104 I105 I115I97-A101 WeakPolarHBondContact O-CB 3.45Å; I97-A101 PolarHBondContact O-N 3.1Å; Q98-A101 PolarHBondContact O-N 3.2Å; G99-A101 PolarHBondContact O-N 3.01Å; A101-M104 PolarHBondContact O-N 3.41Å; A101-I105 VanDerWaalsContact O-CG1 3.3Å; A101-I105 WeakPolarHBondContact O-CG1 3.31Å; A101-I105 PolarHBondContact O-N 2.7Å; A101-I115 HydrophobicContact CB-CD1 3.91Å
102S68Low70.2Confident10 Ų1056.5 Ų56.57%0.0729%0.294CS..Hα-helixtrans-69.3-39.3178-540000111.4Q98 G99 I100 M104 I105 I106Q98-S102 VanDerWaalsContact O-CB 3.24Å; Q98-S102 WeakPolarHBondContact O-CB 3.44Å; Q98-S102 PolarHBondContact O-N 3.17Å; Q98-S102 PolarHBondContact O-OG 2.93Å; G99-S102 PolarHBondContact O-N 3.24Å; I100-S102 VanDerWaalsContact C-N 3.33Å; I100-S102 PolarHBondContact O-N 2.93Å; S102-M104 VanDerWaalsContact C-N 3.35Å; S102-M104 PolarHBondContact O-N 3.09Å; S102-I105 PolarHBondContact O-N 3.36Å; S102-I106 WeakPolarHBondContact O-CG1 3.44Å; S102-I106 PolarHBondContact O-N 2.87Å
103S68.6Low68.8Low34 Ų3460 Ų6024%0.23831%0.312CS..Hα-helixtrans-61.4-42.9173-60.80000111.6G99 I100 I105 I106 V107G99-S103 WeakPolarHBondContact O-CB 3.3Å; G99-S103 PolarHBondContact O-N 3.4Å; G99-S103 PolarHBondContact O-OG 3.27Å; I100-S103 PolarHBondContact O-N 3.47Å; S103-I105 VanDerWaalsContact C-N 3.32Å; S103-I105 PolarHBondContact O-N 2.81Å; S103-I106 PolarHBondContact O-N 3.43Å; S103-V107 WeakPolarHBondContact O-CG2 3.49Å; S103-V107 PolarHBondContact O-N 3.08Å; S103-V107 VanDerWaalsContact O-N 3.11Å
104M69.6Low67.7Low66 Ų6661.4 Ų61.433%0.32532%0.32SS..Hα-helixtrans-62.9-37175.6-71.9174.8175.700112.3I100 A101 S102 V107 F111 L113I100-M104 HydrophobicContact CG2-CE 3.65Å; I100-M104 HydrophobicContact CG2-SD 4.09Å; I100-M104 WeakPolarHBondContact O-CG 3.39Å; I100-M104 PolarHBondContact O-N 3.43Å; A101-M104 PolarHBondContact O-N 3.41Å; S102-M104 VanDerWaalsContact C-N 3.35Å; S102-M104 PolarHBondContact O-N 3.09Å; M104-V107 CarbonylContact O-C 3.34Å; M104-V107 PolarHBondContact O-N 3.24Å; M104-F111 HydrophobicContact CG-CD2 4.34Å; M104-L113 HydrophobicContact CB-CD2 4.36Å
105I63.5Low66.7Low12 Ų1261.4 Ų61.46%0.06232%0.321CS..Hα-helixtrans-69.6-30.7175.6-67162000111.9A101 S102 S103 K108 L113 I115 Q193A101-I105 VanDerWaalsContact O-CG1 3.3Å; A101-I105 WeakPolarHBondContact O-CG1 3.31Å; A101-I105 PolarHBondContact O-N 2.7Å; S102-I105 PolarHBondContact O-N 3.36Å; S103-I105 VanDerWaalsContact C-N 3.32Å; S103-I105 PolarHBondContact O-N 2.81Å; I105-K108 WeakPolarHBondContact O-CE 3.36Å; I105-K108 WeakPolarHBondContact O-CG 3.38Å; I105-L113 HydrophobicContact CG1-CD2 4.44Å; I105-I115 HydrophobicContact CD1-CD1 3.58Å; I105-I115 HydrophobicContact CD1-CG1 3.98Å; I105-I115 HydrophobicContact CG1-CD1 4.45Å; I105-Q193 WeakPolarHBondContact CG2-O 3.44Å
106I62Low66.1Low75 Ų7564.1 Ų64.139%0.38534%0.338SS..Hα-helixtrans-72.9-36.2176.1-68.2177000110.4V39 L43 S102 S103 K108V39-I106 HydrophobicContact CB-CD1 4.33Å; V39-I106 HydrophobicContact CG1-CD1 3.34Å; L43-I106 HydrophobicContact CD1-CD1 3.3Å; L43-I106 HydrophobicContact CD1-CG1 4.4Å; S102-I106 WeakPolarHBondContact O-CG1 3.44Å; S102-I106 PolarHBondContact O-N 2.87Å; S103-I106 PolarHBondContact O-N 3.43Å; I106-K108 PolarHBondContact O-N 3.5Å
107V64.3Low65.2Low71 Ų7162.6 Ų62.643%0.4333%0.33SS..THydrogen-bonded Turntrans-83.752.2172.6-163.90000110S103 M104 D109 V110 F111S103-V107 WeakPolarHBondContact O-CG2 3.49Å; S103-V107 PolarHBondContact O-N 3.08Å; S103-V107 VanDerWaalsContact O-N 3.11Å; M104-V107 CarbonylContact O-C 3.34Å; M104-V107 PolarHBondContact O-N 3.24Å; V107-D109 PolarHBondContact O-N 3.03Å; V107-D109 VanDerWaalsContact O-N 3.1Å; V107-V110 HydrophobicContact CG1-CB 3.67Å; V107-V110 HydrophobicContact CG1-CG2 3.45Å; V107-V110 VanDerWaalsContact CG1-CG2 3.45Å; V107-V110 PolarHBondContact O-N 3.29Å; V107-F111 PolarHBondContact O-N 2.89Å
108K59.9Low64.5Low77 Ų7766.1 Ų66.134%0.33534%0.343SS..THydrogen-bonded Turntrans-52.7-34.6-179.8-65.1-169.1178.6159.60111.9I105 I106 V110I105-K108 WeakPolarHBondContact O-CE 3.36Å; I105-K108 WeakPolarHBondContact O-CG 3.38Å; I106-K108 PolarHBondContact O-N 3.5Å; K108-V110 PolarHBondContact O-N 3.39Å; K108-V110 VanDerWaalsContact O-N 3.17Å
109D49.4Very low64.4Low168 Ų16867.5 Ų67.590%0.89836%0.356SS*.THydrogen-bonded Turntrans-67.8-13.7-176.6-61.5-25.6000113.7V107V107-D109 PolarHBondContact O-N 3.03Å; V107-D109 VanDerWaalsContact O-N 3.1Å
110V51Low64.4Low100 Ų10067.5 Ų67.561%0.60636%0.356SS*.THydrogen-bonded Turntrans-112.6-33.5-179.6-176.30000112V107 K108V107-V110 HydrophobicContact CG1-CB 3.67Å; V107-V110 HydrophobicContact CG1-CG2 3.45Å; V107-V110 VanDerWaalsContact CG1-CG2 3.45Å; V107-V110 PolarHBondContact O-N 3.29Å; K108-V110 PolarHBondContact O-N 3.39Å; K108-V110 VanDerWaalsContact O-N 3.17Å
111F53Low64Low106 Ų10665.4 Ų65.447%0.46535%0.346SS..  trans-127.8108.6-178.7-59.4-79.3000109.8M104 V107 L113M104-F111 HydrophobicContact CG-CD2 4.34Å; V107-F111 PolarHBondContact O-N 2.89Å; F111-L113 PolarHBondContact O-N 2.72Å
112N54.1Low64.4Low154 Ų15468.6 Ų68.682%0.82436%0.364SS*.  trans-6858.1170-77.1-31.9000111.3
113L58Low64.8Low73 Ų7370.8 Ų70.838%0.38237%0.374SS..  trans-93.6107.9-177.1-159.293000109.8M104 I105 F111 I115M104-L113 HydrophobicContact CB-CD2 4.36Å; I105-L113 HydrophobicContact CG1-CD2 4.44Å; F111-L113 PolarHBondContact O-N 2.72Å; L113-I115 HydrophobicContact CD2-CD1 4.01Å; L113-I115 HydrophobicContact CD2-CG1 3.95Å
114H63.2Low65.2Low137 Ų13769.7 Ų69.763%0.63437%0.365SS*.  trans-104.6112.5172.1-67.9-56.3000109.9V191H114-V191 HydrophobicContact CB-CG1 3.65Å; H114-V191 HydrophobicContact CB-CG2 4.14Å; H114-V191 WeakPolarHBondContact ND1-CG1 3.28Å
115I65.6Low65.8Low12 Ų1267.1 Ų67.16%0.06235%0.354CS..EExtended strand (participates in β ladder)trans-89.3113.2177.5-58-172.3000108.4A101 I105 L113 A119 C120 M123 L192A101-I115 HydrophobicContact CB-CD1 3.91Å; I105-I115 HydrophobicContact CD1-CD1 3.58Å; I105-I115 HydrophobicContact CD1-CG1 3.98Å; I105-I115 HydrophobicContact CG1-CD1 4.45Å; L113-I115 HydrophobicContact CD2-CD1 4.01Å; L113-I115 HydrophobicContact CD2-CG1 3.95Å; I115-A119 HydrophobicContact CG2-CB 4.08Å; I115-C120 HydrophobicContact CG2-CB 4.01Å; I115-M123 HydrophobicContact CD1-CE 3.84Å; I115-M123 HydrophobicContact CG2-CE 3.65Å; I115-L192 WeakPolarHBondContact O-CB 3.49Å; I115-L192 PolarHBondContact O-N 3.49Å
116T68.7Low66.9Low59 Ų5968.9 Ų68.936%0.36237%0.367SS..EExtended strand (participates in β ladder)trans-71.5155.9174.162.80000110.8K118 A119 C120T116-K118 PolarHBondContact O-N 3.12Å; T116-A119 PolarHBondContact O-N 3.32Å; T116-A119 WeakPolarHBondContact OG1-CB 3.37Å; T116-A119 PolarHBondContact OG1-N 3.28Å; T116-C120 PolarHBondContact O-N 2.93Å
117K65Low67.9Low9 Ų965.3 Ų65.34%0.03935%0.349CS..Hα-helixtrans-49.7-42.3172.2-170.5177.9-174.4-179.30112.7C120 V121 Q188 L190 L192K117-C120 WeakPolarHBondContact O-CB 3.45Å; K117-C120 PolarHBondContact O-N 3.05Å; K117-V121 WeakPolarHBondContact O-CG2 3.37Å; K117-V121 PolarHBondContact O-N 3.41Å; K117-Q188 HydrophobicContact CD-CB 4.16Å; K117-L190 PolarHBondContact N-O 2.81Å; K117-L192 HydrophobicContact CB-CD1 4.05Å; K117-L192 HydrophobicContact CB-CG 4.49Å; K117-L192 HydrophobicContact CG-CD1 4.27Å
118K69.7Low68.8Low138 Ų13862.1 Ų62.160%0.633%0.329SS*.Hα-helixtrans-63.5-46.9177.2-171.7177.8-179.3-178.90112.1T116 C120 V121 V122T116-K118 PolarHBondContact O-N 3.12Å; K118-C120 PolarHBondContact O-N 2.03Å; K118-V121 PolarHBondContact O-N 3.43Å; K118-V122 VanDerWaalsContact O-CG2 3.31Å; K118-V122 WeakPolarHBondContact O-CG2 3.41Å; K118-V122 PolarHBondContact O-N 2.92Å
119A74Confident70.2Confident40 Ų4060 Ų6033%0.33132%0.321SS..Hα-helixtrans-60.1-39.917600000111.1I115 T116 V122 M123I115-A119 HydrophobicContact CG2-CB 4.08Å; T116-A119 PolarHBondContact O-N 3.32Å; T116-A119 WeakPolarHBondContact OG1-CB 3.37Å; T116-A119 PolarHBondContact OG1-N 3.28Å; A119-V122 PolarHBondContact O-N 3.37Å; A119-M123 WeakPolarHBondContact O-CG 3.41Å; A119-M123 PolarHBondContact O-N 2.76Å
120C73.2Confident72.2Confident1 Ų152.1 Ų52.11%0.00728%0.279CS..Hα-helixtrans-62.4-47.7176.6-177.60000112.7I115 T116 K117 K118 V122 M123 Q124 L192 C195 F200I115-C120 HydrophobicContact CG2-CB 4.01Å; T116-C120 PolarHBondContact O-N 2.93Å; K117-C120 WeakPolarHBondContact O-CB 3.45Å; K117-C120 PolarHBondContact O-N 3.05Å; K118-C120 PolarHBondContact O-N 2.03Å; C120-V122 VanDerWaalsContact C-N 3.32Å; C120-V122 PolarHBondContact O-N 2.88Å; C120-M123 PolarHBondContact O-N 2.87Å; C120-Q124 WeakPolarHBondContact O-CB 3.18Å; C120-Q124 WeakPolarHBondContact O-CG 3.27Å; C120-Q124 PolarHBondContact O-N 3.36Å; C120-Q124 PolarHBondContact SG-NE2 3.25Å; C120-L192 HydrophobicContact CB-CD1 3.75Å; C120-C195 WeakPolarHBondContact CA-SG 3.13Å; C120-C195 HydrophobicContact CB-CB 3.98Å; C120-C195 WeakPolarHBondContact CB-SG 3.33Å; C120-C195 WeakPolarHBondContact SG-CA 3.45Å; C120-C195 WeakPolarHBondContact SG-CB 3.46Å; C120-C195 CovalentContact SG-SG 2.03Å; C120-C195 PolarHBondContact SG-SG 2.89Å; C120-F200 VanDerWaalsContact SG-CE2 3.59Å
121V71.8Confident73.9Confident21 Ų2147.7 Ų47.713%0.12725%0.252CS..Hα-helixtrans-60.5-41.5175.9175.70000111.3K117 K118 Q124 A125 F183K117-V121 WeakPolarHBondContact O-CG2 3.37Å; K117-V121 PolarHBondContact O-N 3.41Å; K118-V121 PolarHBondContact O-N 3.43Å; V121-Q124 WeakPolarHBondContact O-CB 3.48Å; V121-Q124 PolarHBondContact O-N 3.35Å; V121-Q124 VanDerWaalsContact O-N 3.13Å; V121-A125 PolarHBondContact O-N 3.47Å; V121-F183 HydrophobicContact CB-CE1 4.45Å; V121-F183 HydrophobicContact CG1-CD1 3.61Å; V121-F183 HydrophobicContact CG1-CE1 3.66Å; V121-F183 HydrophobicContact CG1-CG 4.25Å; V121-F183 HydrophobicContact CG1-CZ 4.35Å
122V79.2Confident75.6Confident77 Ų7743.4 Ų43.447%0.46723%0.234SC..Hα-helixtrans-61.9-44.8176.1173.80000111.6K118 A119 C120 Q124 A125 P126 F183K118-V122 VanDerWaalsContact O-CG2 3.31Å; K118-V122 WeakPolarHBondContact O-CG2 3.41Å; K118-V122 PolarHBondContact O-N 2.92Å; A119-V122 PolarHBondContact O-N 3.37Å; C120-V122 VanDerWaalsContact C-N 3.32Å; C120-V122 PolarHBondContact O-N 2.88Å; V122-Q124 PolarHBondContact O-N 3.36Å; V122-A125 PolarHBondContact O-N 2.89Å; V122-P126 VanDerWaalsContact O-CD 3.31Å; V122-P126 WeakPolarHBondContact O-CD 3.13Å; V122-F183 HydrophobicContact CB-CE1 4.45Å; V122-F183 HydrophobicContact CG2-CE1 3.68Å; V122-F183 HydrophobicContact CG2-CZ 4.21Å
123M77.7Confident77.5Confident56 Ų5636.1 Ų36.128%0.27620%0.195SC..Hα-helixtrans-64.5-24.9176.1-71.8-168.5-59.600112.9R94 I97 I115 A119 C120 C195R94-M123 WeakPolarHBondContact CG-O 3.44Å; I97-M123 HydrophobicContact CG2-SD 4.38Å; I115-M123 HydrophobicContact CD1-CE 3.84Å; I115-M123 HydrophobicContact CG2-CE 3.65Å; A119-M123 WeakPolarHBondContact O-CG 3.41Å; A119-M123 PolarHBondContact O-N 2.76Å; C120-M123 PolarHBondContact O-N 2.87Å; M123-C195 HydrophobicContact CE-CB 4.18Å
124Q77.2Confident79Confident11 Ų1133 Ų335%0.05118%0.178CC..Hα-helixtrans-88.9-30.8-177.9-74.5173.7-1.500113.5C120 V121 V122 P126 S127 V128 C195 S196 V197C120-Q124 WeakPolarHBondContact O-CB 3.18Å; C120-Q124 WeakPolarHBondContact O-CG 3.27Å; C120-Q124 PolarHBondContact O-N 3.36Å; C120-Q124 PolarHBondContact SG-NE2 3.25Å; V121-Q124 WeakPolarHBondContact O-CB 3.48Å; V121-Q124 PolarHBondContact O-N 3.35Å; V121-Q124 VanDerWaalsContact O-N 3.13Å; V122-Q124 PolarHBondContact O-N 3.36Å; Q124-P126 VanDerWaalsContact C-CD 3.42Å; Q124-P126 VanDerWaalsContact C-N 3.32Å; Q124-S127 WeakPolarHBondContact O-CB 3.39Å; Q124-S127 PolarHBondContact O-N 3.18Å; Q124-S127 PolarHBondContact O-OG 2.94Å; Q124-V128 PolarHBondContact O-N 3.4Å; Q124-C195 PolarHBondContact NE2-SG 2.63Å; Q124-S196 PolarHBondContact NE2-O 3.3Å; Q124-S196 VanDerWaalsContact NE2-O 3.11Å; Q124-V197 HydrophobicContact CB-CB 4.49Å; Q124-V197 HydrophobicContact CB-CG1 4.45Å; Q124-V197 HydrophobicContact CB-CG2 3.82Å; Q124-V197 HydrophobicContact CG-CB 4.32Å; Q124-V197 HydrophobicContact CG-CG2 3.61Å; Q124-V197 VanDerWaalsContact OE1-CA 3.28Å
125A81.6Confident80.3Confident12 Ų1226.9 Ų26.910%0.09915%0.151CC..Hα-helixtrans-49.3-44.1-177.400000113.8V121 V122 S127 V128 I129 A179 F183V121-A125 PolarHBondContact O-N 3.47Å; V122-A125 PolarHBondContact O-N 2.89Å; A125-S127 VanDerWaalsContact C-N 3.26Å; A125-S127 PolarHBondContact O-N 3.13Å; A125-V128 PolarHBondContact O-N 3.38Å; A125-I129 VanDerWaalsContact O-CG1 3.3Å; A125-I129 WeakPolarHBondContact O-CG1 3.3Å; A125-I129 PolarHBondContact O-N 3.5Å; A125-A179 HydrophobicContact CB-CB 4.29Å; A125-F183 HydrophobicContact CB-CE2 3.61Å; A125-F183 HydrophobicContact CB-CZ 3.57Å
126P86.5Confident81.6Confident50 Ų5028.5 Ų28.533%0.32516%0.159SC..Hα-helixtrans-57.1-38.2176.8-25.834.8000113.4V90 V122 Q124 C130V90-P126 HydrophobicContact CG1-CB 3.82Å; V122-P126 VanDerWaalsContact O-CD 3.31Å; V122-P126 WeakPolarHBondContact O-CD 3.13Å; Q124-P126 VanDerWaalsContact C-CD 3.42Å; Q124-P126 VanDerWaalsContact C-N 3.32Å; P126-C130 VanDerWaalsContact O-CB 3.3Å; P126-C130 WeakPolarHBondContact O-CB 3.4Å; P126-C130 PolarHBondContact O-N 2.92Å; P126-C130 PolarHBondContact O-SG 3.28Å
127S83.8Confident82.7Confident0 Ų025.7 Ų25.70%014%0.142CC..Hα-helixtrans-68.9-42.7178.969.20000111.8Q124 A125 I129 C130 F131 V197Q124-S127 WeakPolarHBondContact O-CB 3.39Å; Q124-S127 PolarHBondContact O-N 3.18Å; Q124-S127 PolarHBondContact O-OG 2.94Å; A125-S127 VanDerWaalsContact C-N 3.26Å; A125-S127 PolarHBondContact O-N 3.13Å; S127-I129 PolarHBondContact O-N 3.02Å; S127-C130 PolarHBondContact O-N 3.23Å; S127-F131 WeakPolarHBondContact O-CB 3.44Å; S127-F131 WeakPolarHBondContact O-CD2 3Å; S127-F131 WeakPolarHBondContact O-CG 3.24Å; S127-F131 PolarHBondContact O-N 3.33Å; S127-V197 WeakPolarHBondContact OG-CG2 3.3Å
128V83.2Confident83.9Confident4 Ų425.5 Ų25.52%0.02414%0.142CC..Hα-helixtrans-60.8-44.7177.7177.70000111.2Q124 A125 C130 L132 A179 F182 V197 Y213Q124-V128 PolarHBondContact O-N 3.4Å; A125-V128 PolarHBondContact O-N 3.38Å; V128-C130 VanDerWaalsContact C-N 3.34Å; V128-C130 PolarHBondContact O-N 3.35Å; V128-L132 PolarHBondContact O-N 3.39Å; V128-A179 HydrophobicContact CB-CB 4.43Å; V128-A179 HydrophobicContact CG1-CB 4.35Å; V128-F182 HydrophobicContact CG1-CD2 3.71Å; V128-F182 HydrophobicContact CG1-CE2 3.63Å; V128-F182 HydrophobicContact CG2-CD2 4.41Å; V128-V197 HydrophobicContact CG2-CG1 3.51Å; V128-Y213 PolarHBondContact O-OH 2.97Å
129I89.5Confident84.9Confident32 Ų3220 Ų2016%0.16412%0.119CC..Hα-helixtrans-57.6-51.6175.2-62.2168.5000109.3A125 S127 L132 V133 W172 G175 I176 A179A125-I129 VanDerWaalsContact O-CG1 3.3Å; A125-I129 WeakPolarHBondContact O-CG1 3.3Å; A125-I129 PolarHBondContact O-N 3.5Å; S127-I129 PolarHBondContact O-N 3.02Å; I129-L132 PolarHBondContact O-N 3.4Å; I129-V133 HydrophobicContact CG2-CG2 4.32Å; I129-V133 WeakPolarHBondContact O-CG2 3.24Å; I129-V133 PolarHBondContact O-N 3.46Å; I129-W172 HydrophobicContact CG2-CE3 3.96Å; I129-W172 HydrophobicContact CG2-CZ3 3.95Å; I129-G175 WeakPolarHBondContact CG1-O 3.37Å; I129-I176 HydrophobicContact CD1-CG1 4.24Å; I129-I176 HydrophobicContact CG2-CG1 4.44Å; I129-A179 HydrophobicContact CD1-CB 4.09Å; I129-A179 HydrophobicContact CG1-CB 3.54Å
130C90.7Very high85.7Confident3 Ų318.7 Ų18.72%0.0211%0.109CC..Hα-helixtrans-72-31.8-172.1-68.80000113.3A87 V90 V91 P126 S127 V128 L132 V133 F134A87-C130 HydrophobicContact CB-CB 3.91Å; A87-C130 WeakPolarHBondContact O-CB 3.37Å; V90-C130 HydrophobicContact CB-CB 4.49Å; V90-C130 VanDerWaalsContact CB-SG 3.52Å; V90-C130 WeakPolarHBondContact CG1-SG 3.38Å; V91-C130 HydrophobicContact CG2-CB 3.69Å; P126-C130 VanDerWaalsContact O-CB 3.3Å; P126-C130 WeakPolarHBondContact O-CB 3.4Å; P126-C130 PolarHBondContact O-N 2.92Å; P126-C130 PolarHBondContact O-SG 3.28Å; S127-C130 PolarHBondContact O-N 3.23Å; V128-C130 VanDerWaalsContact C-N 3.34Å; V128-C130 PolarHBondContact O-N 3.35Å; C130-L132 VanDerWaalsContact C-N 3.33Å; C130-L132 PolarHBondContact O-N 2.88Å; C130-V133 PolarHBondContact O-N 3Å; C130-F134 WeakPolarHBondContact O-CB 3.46Å; C130-F134 PolarHBondContact O-N 2.86Å
131F86.9Confident86.5Confident6 Ų618.7 Ų18.73%0.02611%0.109CC..Hα-helixtrans-60-43.9173-83.3-59.6000111.8V91 S127 S135 Y213 F274 L306 L309V91-F131 HydrophobicContact CG1-CE1 4.44Å; V91-F131 HydrophobicContact CG1-CE2 4.48Å; V91-F131 HydrophobicContact CG1-CZ 4.01Å; S127-F131 WeakPolarHBondContact O-CB 3.44Å; S127-F131 WeakPolarHBondContact O-CD2 3Å; S127-F131 WeakPolarHBondContact O-CG 3.24Å; S127-F131 PolarHBondContact O-N 3.33Å; F131-S135 WeakPolarHBondContact O-CB 3.5Å; F131-S135 PolarHBondContact O-N 3.15Å; F131-S135 PolarHBondContact O-OG 3.46Å; F131-Y213 HydrophobicContact CB-CE1 4.08Å; F131-F274 AromaticContact CD1-CE1 3.73Å; F131-F274 HydrophobicContact CD1-CE1 3.73Å; F131-F274 AromaticContact CD1-CZ 3.81Å; F131-F274 HydrophobicContact CD1-CZ 3.81Å; F131-F274 HydrophobicContact CE1-CE1 4.3Å; F131-F274 HydrophobicContact CE1-CZ 4.2Å; F131-L306 HydrophobicContact CZ-CD1 4.23Å; F131-L309 HydrophobicContact CD1-CD2 4.49Å; F131-L309 HydrophobicContact CE1-CD2 3.38Å; F131-L309 HydrophobicContact CZ-CD2 3.8Å
132L89.1Confident87.3Confident17 Ų1717.7 Ų17.79%0.08910%0.103CC..Hα-helixtrans-68.1-49.1177.3-170.660.9000111.6V128 I129 C130 F134 S135 L136 N178 Y213 I216V128-L132 PolarHBondContact O-N 3.39Å; I129-L132 PolarHBondContact O-N 3.4Å; C130-L132 VanDerWaalsContact C-N 3.33Å; C130-L132 PolarHBondContact O-N 2.88Å; L132-F134 VanDerWaalsContact C-N 3.32Å; L132-F134 PolarHBondContact O-N 3.2Å; L132-S135 PolarHBondContact O-N 3Å; L132-L136 HydrophobicContact CD1-CD1 4.11Å; L132-L136 HydrophobicContact CD1-CG 4.16Å; L132-L136 HydrophobicContact CG-CD1 3.9Å; L132-L136 HydrophobicContact CG-CG 4.35Å; L132-L136 WeakPolarHBondContact O-CB 3.24Å; L132-L136 VanDerWaalsContact O-CG 3.31Å; L132-L136 WeakPolarHBondContact O-CG 3.38Å; L132-L136 PolarHBondContact O-N 3.38Å; L132-N178 HydrophobicContact CD2-CB 3.96Å; L132-Y213 HydrophobicContact CB-CE1 4.24Å; L132-Y213 HydrophobicContact CD1-CE1 4.08Å; L132-Y213 PolarHBondContact N-OH 2.9Å; L132-I216 HydrophobicContact CD1-CD1 4.13Å
133V92.2Very high87.7Confident0 Ų015.6 Ų15.60%09%0.094CC..Hα-helixtrans-56.8-47.9177.81730000110.8A87 I129 C130 L136 C137 A171 W172A87-V133 HydrophobicContact CB-CB 4.26Å; A87-V133 HydrophobicContact CB-CG1 4.06Å; I129-V133 HydrophobicContact CG2-CG2 4.32Å; I129-V133 WeakPolarHBondContact O-CG2 3.24Å; I129-V133 PolarHBondContact O-N 3.46Å; C130-V133 PolarHBondContact O-N 3Å; V133-L136 PolarHBondContact O-N 3.31Å; V133-C137 VanDerWaalsContact O-CB 3.3Å; V133-C137 WeakPolarHBondContact O-CB 3.01Å; V133-C137 PolarHBondContact O-N 2.98Å; V133-C137 PolarHBondContact O-SG 2.71Å; V133-A171 WeakPolarHBondContact CG2-O 3.02Å; V133-W172 HydrophobicContact CG1-CD2 4.16Å; V133-W172 HydrophobicContact CG1-CZ2 3.9Å; V133-W172 HydrophobicContact CG2-CD2 3.81Å; V133-W172 HydrophobicContact CG2-CE3 3.89Å; V133-W172 HydrophobicContact CG2-CG 4.13Å; V133-W172 HydrophobicContact CG2-CZ3 4.35Å
134F91Very high88.2Confident7 Ų714.9 Ų14.93%0.0319%0.09CC..Hα-helixtrans-58.1-51.8178.4177.6-97.1000111.7S84 A87 C88 C130 L132 L136 C137 I138 N270 F274S84-F134 WeakPolarHBondContact O-CD2 3.22Å; A87-F134 HydrophobicContact CB-CB 4.08Å; C88-F134 WeakPolarHBondContact SG-CD2 3.31Å; C88-F134 WeakPolarHBondContact SG-CE2 3.44Å; C130-F134 WeakPolarHBondContact O-CB 3.46Å; C130-F134 PolarHBondContact O-N 2.86Å; L132-F134 VanDerWaalsContact C-N 3.32Å; L132-F134 PolarHBondContact O-N 3.2Å; F134-L136 VanDerWaalsContact C-N 3.34Å; F134-L136 PolarHBondContact O-N 2.9Å; F134-C137 PolarHBondContact O-N 3.45Å; F134-I138 HydrophobicContact CD1-CG1 4.36Å; F134-I138 HydrophobicContact CD2-CG1 4.23Å; F134-I138 HydrophobicContact CE1-CG1 3.94Å; F134-I138 HydrophobicContact CE2-CD1 4.11Å; F134-I138 HydrophobicContact CE2-CG1 3.79Å; F134-I138 HydrophobicContact CZ-CD1 4.18Å; F134-I138 HydrophobicContact CZ-CG1 3.66Å; F134-I138 WeakPolarHBondContact O-CG1 3.48Å; F134-I138 PolarHBondContact O-N 3.31Å; F134-N270 HydrophobicContact CE1-CB 4.34Å; F134-N270 HydrophobicContact CZ-CB 4.37Å; F134-F274 HydrophobicContact CD1-CE1 4.48Å; F134-F274 AromaticContact CD1-CE2 3.65Å; F134-F274 HydrophobicContact CD1-CE2 3.65Å; F134-F274 AromaticContact CD1-CZ 3.46Å; F134-F274 HydrophobicContact CD1-CZ 3.46Å; F134-F274 VanDerWaalsContact CD1-CZ 3.46Å; F134-F274 HydrophobicContact CE1-CD2 4.43Å; F134-F274 AromaticContact CE1-CE2 3.44Å; F134-F274 HydrophobicContact CE1-CE2 3.44Å; F134-F274 VanDerWaalsContact CE1-CE2 3.44Å; F134-F274 AromaticContact CE1-CZ 3.79Å; F134-F274 HydrophobicContact CE1-CZ 3.79Å
135S90Very high88.5Confident10 Ų1014.4 Ų14.47%0.079%0.087CC..Hα-helixtrans-61.2-44-177.3-55.80000111.5F131 L132 T139 F274F131-S135 WeakPolarHBondContact O-CB 3.5Å; F131-S135 PolarHBondContact O-N 3.15Å; F131-S135 PolarHBondContact O-OG 3.46Å; L132-S135 PolarHBondContact O-N 3Å; S135-T139 WeakPolarHBondContact O-CB 3.36Å; S135-T139 PolarHBondContact O-N 2.89Å; S135-T139 PolarHBondContact O-OG1 3.33Å; S135-F274 WeakPolarHBondContact OG-CE1 3.33Å
136L92.7Very high88.7Confident45 Ų4515.3 Ų15.324%0.2369%0.09CC..Hα-helixtrans-66.2-43.2177-69.8178.1000112.2L132 V133 F134 T139 A140 F167 A171 I216L132-L136 HydrophobicContact CD1-CD1 4.11Å; L132-L136 HydrophobicContact CD1-CG 4.16Å; L132-L136 HydrophobicContact CG-CD1 3.9Å; L132-L136 HydrophobicContact CG-CG 4.35Å; L132-L136 WeakPolarHBondContact O-CB 3.24Å; L132-L136 VanDerWaalsContact O-CG 3.31Å; L132-L136 WeakPolarHBondContact O-CG 3.38Å; L132-L136 PolarHBondContact O-N 3.38Å; V133-L136 PolarHBondContact O-N 3.31Å; F134-L136 VanDerWaalsContact C-N 3.34Å; F134-L136 PolarHBondContact O-N 2.9Å; L136-T139 PolarHBondContact O-N 3.04Å; L136-A140 VanDerWaalsContact O-CB 3.31Å; L136-A140 WeakPolarHBondContact O-CB 3.34Å; L136-A140 PolarHBondContact O-N 3.05Å; L136-F167 HydrophobicContact CB-CE1 4.36Å; L136-F167 HydrophobicContact CB-CZ 4.02Å; L136-A171 HydrophobicContact CB-CB 4.22Å; L136-A171 HydrophobicContact CD1-CB 3.93Å; L136-I216 HydrophobicContact CD2-CD1 4.36Å
137C92Very high88.6Confident1 Ų116.7 Ų16.71%0.00710%0.095CC..Hα-helixtrans-64.1-41.8178.3-75.50000112.4V133 F134 A140 L141V133-C137 VanDerWaalsContact O-CB 3.3Å; V133-C137 WeakPolarHBondContact O-CB 3.01Å; V133-C137 PolarHBondContact O-N 2.98Å; V133-C137 PolarHBondContact O-SG 2.71Å; F134-C137 PolarHBondContact O-N 3.45Å; C137-A140 PolarHBondContact O-N 3.25Å; C137-L141 WeakPolarHBondContact O-CB 3.1Å; C137-L141 PolarHBondContact O-N 2.99Å
138I89.2Confident88.3Confident5 Ų517.3 Ų17.33%0.02610%0.1CC..Hα-helixtrans-68.2-38.3177-65.8-62.9000111.4F134 L141 G142 T220 V267F134-I138 HydrophobicContact CD1-CG1 4.36Å; F134-I138 HydrophobicContact CD2-CG1 4.23Å; F134-I138 HydrophobicContact CE1-CG1 3.94Å; F134-I138 HydrophobicContact CE2-CD1 4.11Å; F134-I138 HydrophobicContact CE2-CG1 3.79Å; F134-I138 HydrophobicContact CZ-CD1 4.18Å; F134-I138 HydrophobicContact CZ-CG1 3.66Å; F134-I138 WeakPolarHBondContact O-CG1 3.48Å; F134-I138 PolarHBondContact O-N 3.31Å; I138-L141 HydrophobicContact CD1-CD2 4.4Å; I138-L141 WeakPolarHBondContact O-CB 3.46Å; I138-L141 PolarHBondContact O-N 3.24Å; I138-G142 PolarHBondContact O-N 2.72Å; I138-G142 VanDerWaalsContact O-N 3.14Å; I138-T220 HydrophobicContact CG2-CG2 3.89Å; I138-V267 HydrophobicContact CG2-CB 4.46Å; I138-V267 HydrophobicContact CG2-CG1 3.85Å; I138-V267 HydrophobicContact CG2-CG2 3.98Å
139T91Very high88Confident21 Ų2117.2 Ų17.213%0.12910%0.099CC..Hα-helixtrans-62.1-49173.7-52.50000110.8S135 L136 L141 G142 A143 I216 I219 T220 I223S135-T139 WeakPolarHBondContact O-CB 3.36Å; S135-T139 PolarHBondContact O-N 2.89Å; S135-T139 PolarHBondContact O-OG1 3.33Å; L136-T139 PolarHBondContact O-N 3.04Å; T139-L141 VanDerWaalsContact C-N 3.28Å; T139-L141 PolarHBondContact O-N 3.4Å; T139-G142 WeakPolarHBondContact O-CA 3.31Å; T139-G142 PolarHBondContact O-N 2.89Å; T139-G142 VanDerWaalsContact O-N 3.08Å; T139-A143 PolarHBondContact O-N 2.95Å; T139-I216 VanDerWaalsContact OG1-CG2 3.24Å; T139-I216 WeakPolarHBondContact OG1-CG2 3.32Å; T139-I219 HydrophobicContact CG2-CG2 4.08Å; T139-T220 PolarHBondContact OG1-OG1 3.08Å; T139-I223 HydrophobicContact CG2-CD1 3.91Å
140A91.9Very high87.6Confident14 Ų1420 Ų2012%0.11611%0.114CC..Hα-helixtrans-64.1-33.3177.900000112.4L80 L136 C137 G142 A143 E144 F167L80-A140 HydrophobicContact CD1-CB 4.14Å; L80-A140 HydrophobicContact CD2-CB 3.89Å; L136-A140 VanDerWaalsContact O-CB 3.31Å; L136-A140 WeakPolarHBondContact O-CB 3.34Å; L136-A140 PolarHBondContact O-N 3.05Å; C137-A140 PolarHBondContact O-N 3.25Å; A140-G142 VanDerWaalsContact C-N 3.29Å; A140-G142 PolarHBondContact O-N 3.29Å; A140-A143 PolarHBondContact O-N 3.27Å; A140-E144 WeakPolarHBondContact O-CB 3.49Å; A140-E144 WeakPolarHBondContact O-CG 3.34Å; A140-E144 PolarHBondContact O-N 2.9Å; A140-F167 HydrophobicContact CB-CD1 3.93Å; A140-F167 HydrophobicContact CB-CE1 3.34Å; A140-F167 HydrophobicContact CB-CE2 4.45Å; A140-F167 HydrophobicContact CB-CZ 3.65Å
141L89.7Confident86.6Confident0 Ų027.4 Ų27.40%015%0.146CC..Hα-helixtrans-58.6-45.8172.1-172.669.7000110.3V77 L80 L81 C137 I138 T139 E144 R145 Y224 L263V77-L141 HydrophobicContact CB-CD1 4.19Å; V77-L141 HydrophobicContact CG1-CD1 3.5Å; L80-L141 HydrophobicContact CB-CD1 4.16Å; L80-L141 HydrophobicContact CD1-CB 4.5Å; L80-L141 HydrophobicContact CD1-CD1 4.48Å; L81-L141 HydrophobicContact CD1-CD1 4.4Å; L81-L141 HydrophobicContact CD1-CD2 3.51Å; C137-L141 WeakPolarHBondContact O-CB 3.1Å; C137-L141 PolarHBondContact O-N 2.99Å; I138-L141 HydrophobicContact CD1-CD2 4.4Å; I138-L141 WeakPolarHBondContact O-CB 3.46Å; I138-L141 PolarHBondContact O-N 3.24Å; T139-L141 VanDerWaalsContact C-N 3.28Å; T139-L141 PolarHBondContact O-N 3.4Å; L141-E144 PolarHBondContact O-N 2.88Å; L141-R145 WeakPolarHBondContact O-CG 3.19Å; L141-R145 PolarHBondContact O-N 2.81Å; L141-Y224 WeakPolarHBondContact CD2-OH 3.39Å; L141-Y224 WeakPolarHBondContact CG-OH 3.44Å; L141-L263 HydrophobicContact CD2-CD1 4.07Å; L141-L263 HydrophobicContact CD2-CD2 4.27Å; L141-L263 HydrophobicContact CG-CD1 4.44Å
142G87.4Confident85.3Confident0 Ų031.8 Ų31.80%017%0.169CC..Hα-helixtrans-60.3-45.7173.400000112.3I138 T139 A140 E144 R145 L146 I223 Y224I138-G142 PolarHBondContact O-N 2.72Å; I138-G142 VanDerWaalsContact O-N 3.14Å; T139-G142 WeakPolarHBondContact O-CA 3.31Å; T139-G142 PolarHBondContact O-N 2.89Å; T139-G142 VanDerWaalsContact O-N 3.08Å; A140-G142 VanDerWaalsContact C-N 3.29Å; A140-G142 PolarHBondContact O-N 3.29Å; G142-E144 PolarHBondContact O-N 2.83Å; G142-R145 PolarHBondContact O-N 3.27Å; G142-L146 WeakPolarHBondContact O-CB 3.44Å; G142-L146 PolarHBondContact O-N 2.84Å; G142-I223 WeakPolarHBondContact O-CG2 3.47Å; G142-Y224 PolarHBondContact N-OH 3.46Å
143A88.7Confident83.6Confident34 Ų3435.1 Ų35.128%0.28119%0.193SC..Hα-helixtrans-62.3-41.6178.600000112.1T139 A140 R145 L146 L147T139-A143 PolarHBondContact O-N 2.95Å; A140-A143 PolarHBondContact O-N 3.27Å; A143-R145 VanDerWaalsContact C-N 3.35Å; A143-R145 PolarHBondContact O-N 3.47Å; A143-L146 WeakPolarHBondContact O-CB 3.37Å; A143-L146 PolarHBondContact O-N 3.29Å; A143-L147 WeakPolarHBondContact O-CB 3.49Å; A143-L147 VanDerWaalsContact O-CG 3.3Å; A143-L147 WeakPolarHBondContact O-CG 3.43Å; A143-L147 PolarHBondContact O-N 3.42Å
144E87.2Confident81.8Confident40 Ų4036.8 Ų36.819%0.18720%0.2CC..Hα-helixtrans-64.1-38174.6-77.1-69.9129.300112.1N76 L80 A140 L141 G142 A148 V164N76-E144 WeakPolarHBondContact CB-OE2 3.46Å; N76-E144 PolarHBondContact ND2-OE2 3.37Å; L80-E144 HydrophobicContact CD1-CB 4.43Å; L80-E144 HydrophobicContact CD1-CG 3.71Å; A140-E144 WeakPolarHBondContact O-CB 3.49Å; A140-E144 WeakPolarHBondContact O-CG 3.34Å; A140-E144 PolarHBondContact O-N 2.9Å; L141-E144 PolarHBondContact O-N 2.88Å; G142-E144 PolarHBondContact O-N 2.83Å; E144-A148 WeakPolarHBondContact O-CB 3.4Å; E144-A148 PolarHBondContact O-N 3.47Å; E144-A148 VanDerWaalsContact O-N 3.11Å; E144-V164 HydrophobicContact CG-CG2 4.37Å; E144-V164 WeakPolarHBondContact OE1-CG2 3.32Å
145R84.9Confident80Confident1 Ų142.8 Ų42.80%0.00423%0.232CC..Hα-helixtrans-66.9-40.7173-64.5-52.580.7-163.7-11.2111L141 G142 A143 T149 Y154 T227 N256L141-R145 WeakPolarHBondContact O-CG 3.19Å; L141-R145 PolarHBondContact O-N 2.81Å; G142-R145 PolarHBondContact O-N 3.27Å; A143-R145 VanDerWaalsContact C-N 3.35Å; A143-R145 PolarHBondContact O-N 3.47Å; R145-T149 WeakPolarHBondContact O-CB 3.43Å; R145-T149 PolarHBondContact O-N 3Å; R145-T149 PolarHBondContact O-OG1 2.85Å; R145-Y154 PolarHBondContact NH1-OH 3.45Å; R145-Y154 PolarHBondContact NH2-OH 3.46Å; R145-T227 HydrophobicContact CB-CG2 3.85Å; R145-N256 PolarHBondContact NH1-OD1 2.91Å
146L85.8Confident78.2Confident31 Ų3146.8 Ų46.816%0.16225%0.253CS..Hα-helixtrans-63.4-49.9177.1-176.659.3000111.2G142 A143 A148 T149 L150 I223 L226 T227 L230G142-L146 WeakPolarHBondContact O-CB 3.44Å; G142-L146 PolarHBondContact O-N 2.84Å; A143-L146 WeakPolarHBondContact O-CB 3.37Å; A143-L146 PolarHBondContact O-N 3.29Å; L146-A148 VanDerWaalsContact C-N 3.32Å; L146-A148 PolarHBondContact O-N 3.03Å; L146-T149 CarbonylContact O-C 3.29Å; L146-T149 VanDerWaalsContact O-C 3.29Å; L146-T149 WeakPolarHBondContact O-CA 3.48Å; L146-T149 WeakPolarHBondContact O-CB 3.47Å; L146-T149 PolarHBondContact O-N 3.47Å; L146-L150 HydrophobicContact CD1-CD1 4.47Å; L146-L150 HydrophobicContact CG-CD1 4.19Å; L146-L150 WeakPolarHBondContact O-CG 3.4Å; L146-L150 PolarHBondContact O-N 3.36Å; L146-I223 HydrophobicContact CB-CG2 4.36Å; L146-I223 HydrophobicContact CD2-CG2 4.33Å; L146-L226 HydrophobicContact CD1-CB 4.39Å; L146-T227 WeakPolarHBondContact CB-OG1 3.4Å; L146-L230 HydrophobicContact CD1-CD1 3.55Å
147L84Confident76.4Confident80 Ų8050.1 Ų50.142%0.41927%0.271SS..Hα-helixtrans-58.2-43.9178.6-76.4170.9000112A143 T149 L150 K151A143-L147 WeakPolarHBondContact O-CB 3.49Å; A143-L147 VanDerWaalsContact O-CG 3.3Å; A143-L147 WeakPolarHBondContact O-CG 3.43Å; A143-L147 PolarHBondContact O-N 3.42Å; L147-T149 VanDerWaalsContact C-N 3.29Å; L147-T149 PolarHBondContact O-N 2.94Å; L147-L150 PolarHBondContact O-N 3.38Å; L147-K151 PolarHBondContact O-N 3.26Å
148A77.4Confident74.6Confident13 Ų1358.9 Ų58.911%0.10731%0.312CS..Hα-helixtrans-64.8-35.317400000113.2E144 L146 L150 Y154E144-A148 WeakPolarHBondContact O-CB 3.4Å; E144-A148 PolarHBondContact O-N 3.47Å; E144-A148 VanDerWaalsContact O-N 3.11Å; L146-A148 VanDerWaalsContact C-N 3.32Å; L146-A148 PolarHBondContact O-N 3.03Å; A148-L150 PolarHBondContact O-N 2.88Å; A148-Y154 HydrophobicContact CB-CD1 4.31Å; A148-Y154 HydrophobicContact CB-CE1 3.43Å; A148-Y154 VanDerWaalsContact CB-CE1 3.43Å; A148-Y154 HydrophobicContact CB-CE2 3.7Å; A148-Y154 WeakPolarHBondContact CB-OH 3.31Å
149T77.3Confident73.1Confident1 Ų168.9 Ų68.91%0.00635%0.349CS..Hα-helixtrans-74.4-5.1172.6-48.70000112.1R145 L146 L147 L230 N231 R234 N256R145-T149 WeakPolarHBondContact O-CB 3.43Å; R145-T149 PolarHBondContact O-N 3Å; R145-T149 PolarHBondContact O-OG1 2.85Å; L146-T149 CarbonylContact O-C 3.29Å; L146-T149 VanDerWaalsContact O-C 3.29Å; L146-T149 WeakPolarHBondContact O-CA 3.48Å; L146-T149 WeakPolarHBondContact O-CB 3.47Å; L146-T149 PolarHBondContact O-N 3.47Å; L147-T149 VanDerWaalsContact C-N 3.29Å; L147-T149 PolarHBondContact O-N 2.94Å; T149-L230 HydrophobicContact CG2-CB 3.76Å; T149-N231 HydrophobicContact CG2-CB 4.5Å; T149-N231 VanDerWaalsContact CG2-OD1 3.26Å; T149-N231 WeakPolarHBondContact CG2-OD1 3.4Å; T149-N231 PolarHBondContact OG1-ND2 3.42Å; T149-R234 PolarHBondContact O-NE 2.98Å; T149-R234 PolarHBondContact O-NH1 3.25Å; T149-R234 PolarHBondContact O-NH2 3.15Å; T149-N256 PolarHBondContact OG1-ND2 3.35Å; T149-N256 VanDerWaalsContact OG1-ND2 3.14Å
150L80.2Confident71.9Confident92 Ų9268.5 Ų68.548%0.48235%0.347SS..Hα-helixtrans-103.1-50.3174.2-71.5171.4000110.7L146 L147 A148 N152 L230 R234L146-L150 HydrophobicContact CD1-CD1 4.47Å; L146-L150 HydrophobicContact CG-CD1 4.19Å; L146-L150 WeakPolarHBondContact O-CG 3.4Å; L146-L150 PolarHBondContact O-N 3.36Å; L147-L150 PolarHBondContact O-N 3.38Å; A148-L150 PolarHBondContact O-N 2.88Å; L150-N152 VanDerWaalsContact C-N 3.27Å; L150-N152 PolarHBondContact O-N 2.93Å; L150-N152 VanDerWaalsContact O-N 3.16Å; L150-L230 HydrophobicContact CD2-CD1 3.93Å; L150-R234 PolarHBondContact O-NH2 2.9Å
151K70.9Confident71.2Confident158 Ų15870.8 Ų70.869%0.68736%0.362SS*.Hα-helixtrans-70.5-9.3-170.9-72.7-173.2173.1-173.70116.1L147 C153L147-K151 PolarHBondContact O-N 3.26Å; K151-C153 PolarHBondContact O-N 3.5Å
152N58.9Low70.9Confident97 Ų9776.2 Ų76.252%0.51940%0.396SS..SBendtrans59.8-14-177-78.5-23.8000116.8L150 R234L150-N152 VanDerWaalsContact C-N 3.27Å; L150-N152 PolarHBondContact O-N 2.93Å; L150-N152 VanDerWaalsContact O-N 3.16Å; N152-R234 PolarHBondContact OD1-NH1 3.28Å; N152-R234 PolarHBondContact OD1-NH2 3.46Å
153C53.1Low70.8Confident88 Ų8878.5 Ų78.560%0.59542%0.419SS*.  trans-123.9134.5174.7-69.80000109.6K151K151-C153 PolarHBondContact O-N 3.5Å
154Y55.5Low70.7Confident35 Ų3577.2 Ų77.214%0.13741%0.408CS..  trans-85.4127.5154.9-83.7-79.2000107.7H74 R145 A148 D156 N256H74-Y154 HydrophobicContact CB-CE1 4.47Å; H74-Y154 AromaticContact CD2-CD1 3.78Å; H74-Y154 AromaticContact CD2-CE1 3.47Å; H74-Y154 VanDerWaalsContact CD2-CE1 3.47Å; H74-Y154 WeakPolarHBondContact CD2-CE1 3.49Å; H74-Y154 AromaticContact CD2-CE2 3.99Å; H74-Y154 AromaticContact CD2-CZ 3.55Å; H74-Y154 VanDerWaalsContact CE1-CB 3.49Å; H74-Y154 WeakPolarHBondContact CE1-CB 3.19Å; H74-Y154 AromaticContact CE1-CD1 3.3Å; H74-Y154 WeakPolarHBondContact CE1-CD1 3.27Å; H74-Y154 AromaticContact CE1-CD2 3.58Å; H74-Y154 AromaticContact CE1-CE1 3.83Å; H74-Y154 AromaticContact CE1-CG 3.15Å; H74-Y154 AromaticContact CG-CD1 3.73Å; H74-Y154 AromaticContact CG-CE1 3.69Å; H74-Y154 AromaticContact ND1-CD1 3.42Å; H74-Y154 WeakPolarHBondContact ND1-CD1 3.48Å; H74-Y154 AromaticContact ND1-CE1 3.89Å; H74-Y154 AromaticContact ND1-CG 3.75Å; H74-Y154 AromaticContact NE2-CD1 3.54Å; H74-Y154 AromaticContact NE2-CD2 3.41Å; H74-Y154 WeakPolarHBondContact NE2-CD2 3.34Å; H74-Y154 AromaticContact NE2-CE1 3.58Å; H74-Y154 AromaticContact NE2-CE2 3.42Å; H74-Y154 WeakPolarHBondContact NE2-CE2 3.19Å; H74-Y154 AromaticContact NE2-CG 3.44Å; H74-Y154 AromaticContact NE2-CZ 3.48Å; R145-Y154 PolarHBondContact NH1-OH 3.45Å; R145-Y154 PolarHBondContact NH2-OH 3.46Å; A148-Y154 HydrophobicContact CB-CD1 4.31Å; A148-Y154 HydrophobicContact CB-CE1 3.43Å; A148-Y154 VanDerWaalsContact CB-CE1 3.43Å; A148-Y154 HydrophobicContact CB-CE2 3.7Å; A148-Y154 WeakPolarHBondContact CB-OH 3.31Å; Y154-D156 PolarHBondContact O-N 3.17Å; Y154-N256 HydrophobicContact CE2-CB 4.24Å; Y154-N256 PolarHBondContact OH-OD1 3.33Å; Y154-N256 VanDerWaalsContact OH-OD1 3.12Å
155D51.5Low70.8Confident132 Ų13280 Ų8071%0.70642%0.419SS*.  trans-62.1108.1154.6-76.2-28.7000106.1N157D155-N157 PolarHBondContact O-N 2.93Å
156D53.1Low71.1Confident94 Ų9482.4 Ų82.450%0.50344%0.439SS..  trans-69.325.9178.7-81.8-27.7000112.3Y154 E158 Q252Y154-D156 PolarHBondContact O-N 3.17Å; D156-E158 PolarHBondContact O-N 3.43Å; D156-Q252 PolarHBondContact OD2-NE2 2.94Å
157N54.8Low71.4Confident115 Ų11584.6 Ų84.662%0.61545%0.448SS*.  trans-63113.2174.3-71.6-26.5000108.6D155 R159D155-N157 PolarHBondContact O-N 2.93Å; N157-R159 PolarHBondContact O-N 2.87Å
158E55.1Low71.8Confident186 Ų18681 Ų8187%0.86943%0.429SS*.SBendtrans-56.7-19.7171.4-67.1-169.6153.500112.1A75 D156A75-E158 VanDerWaalsContact CB-O 3.31Å; A75-E158 WeakPolarHBondContact CB-O 3.48Å; D156-E158 PolarHBondContact O-N 3.43Å
159R57.6Low72.6Confident214 Ų21484.6 Ų84.681%0.80845%0.45SS*.SBendtrans-86.8132.2174.7-65.8-178.1179174.80.5110.4N157 S161N157-R159 PolarHBondContact O-N 2.87Å; R159-S161 PolarHBondContact O-N 2.89Å
160S65.1Low73.3Confident13 Ų1389.3 Ų89.39%0.09148%0.478CS..PPolyproline II helixtrans-59.6137.6171.161.20000110.4N76 M79 T162 K165N76-S160 WeakPolarHBondContact OD1-CA 3.43Å; M79-S160 WeakPolarHBondContact CE-OG 3.35Å; S160-T162 PolarHBondContact O-N 3.45Å; S160-K165 WeakPolarHBondContact OG-CE 3.5Å
161S77.8Confident73.9Confident62 Ų6285 Ų8543%0.43446%0.456SS..PPolyproline II helixtrans-52.7137.7174.5175.40000111N76 R159 G163 V164 K165N76-S161 PolarHBondContact OD1-N 2.88Å; R159-S161 PolarHBondContact O-N 2.89Å; S161-G163 PolarHBondContact O-N 3.28Å; S161-G163 PolarHBondContact OG-N 3.48Å; S161-V164 PolarHBondContact O-N 3.29Å; S161-V164 VanDerWaalsContact O-N 3.07Å; S161-K165 PolarHBondContact O-N 2.85Å
162T83.5Confident75Confident115 Ų11580.6 Ų80.671%0.70644%0.435SS*.Hα-helixtrans-53.9-34174.1-50.80000111.3S160 K165 A166S160-T162 PolarHBondContact O-N 3.45Å; T162-K165 PolarHBondContact O-N 3.45Å; T162-A166 WeakPolarHBondContact O-CB 3.45Å; T162-A166 PolarHBondContact O-N 3Å
163G84.6Confident76.7Confident47 Ų4780.1 Ų80.149%0.48544%0.436SS..Hα-helixtrans-63.5-41.217700000113.4S161 A166 F167S161-G163 PolarHBondContact O-N 3.28Å; S161-G163 PolarHBondContact OG-N 3.48Å; G163-A166 PolarHBondContact O-N 3.3Å; G163-F167 WeakPolarHBondContact O-CB 3.22Å; G163-F167 PolarHBondContact O-N 3.41Å
164V87Confident78.5Confident7 Ų777.2 Ų77.24%0.04242%0.42CS..Hα-helixtrans-70.8-39.11791760000111.2N76 M79 L80 E144 S161 F167 V168N76-V164 HydrophobicContact CB-CB 4.47Å; N76-V164 HydrophobicContact CB-CG1 4.34Å; N76-V164 HydrophobicContact CB-CG2 3.95Å; M79-V164 HydrophobicContact SD-CG1 4.27Å; L80-V164 HydrophobicContact CD1-CG1 4.21Å; L80-V164 HydrophobicContact CD2-CG1 4.07Å; L80-V164 HydrophobicContact CG-CG1 3.84Å; E144-V164 HydrophobicContact CG-CG2 4.37Å; E144-V164 WeakPolarHBondContact OE1-CG2 3.32Å; S161-V164 PolarHBondContact O-N 3.29Å; S161-V164 VanDerWaalsContact O-N 3.07Å; V164-F167 PolarHBondContact O-N 3.48Å; V164-V168 WeakPolarHBondContact O-CG2 3.44Å; V164-V168 PolarHBondContact O-N 3.5Å
165K88.8Confident80Confident99 Ų9975.5 Ų75.543%0.4341%0.414SS..Hα-helixtrans-58.9-50.1172.6-78.1169.8160.9164.20111.4M79 S160 S161 T162 F167 V168 T169M79-K165 HydrophobicContact CE-CD 4.49Å; M79-K165 HydrophobicContact CE-CG 3.73Å; M79-K165 HydrophobicContact SD-CB 4.48Å; M79-K165 HydrophobicContact SD-CG 3.65Å; S160-K165 WeakPolarHBondContact OG-CE 3.5Å; S161-K165 PolarHBondContact O-N 2.85Å; T162-K165 PolarHBondContact O-N 3.45Å; K165-F167 VanDerWaalsContact C-N 3.33Å; K165-F167 PolarHBondContact O-N 3.31Å; K165-V168 PolarHBondContact O-N 2.88Å; K165-T169 PolarHBondContact O-N 2.87Å; K165-T169 PolarHBondContact O-OG1 3.37Å
166A90.4Very high81.9Confident51 Ų5173.2 Ų73.242%0.42140%0.401SS..Hα-helixtrans-59.9-43.9177.600000111.5T162 G163 V168 T169 V170T162-A166 WeakPolarHBondContact O-CB 3.45Å; T162-A166 PolarHBondContact O-N 3Å; G163-A166 PolarHBondContact O-N 3.3Å; A166-V168 PolarHBondContact O-N 3.46Å; A166-T169 PolarHBondContact O-N 2.9Å; A166-V170 VanDerWaalsContact O-CG2 3.3Å; A166-V170 WeakPolarHBondContact O-CG2 3.44Å; A166-V170 PolarHBondContact O-N 2.7Å
167F93.3Very high83.5Confident77 Ų7775.3 Ų75.334%0.33841%0.405SS..Hα-helixtrans-58.7-47176.9177.7-91.1000112.4L80 L136 A140 G163 V164 K165 T169 V170 A171L80-F167 HydrophobicContact CD2-CD1 4.18Å; L80-F167 HydrophobicContact CD2-CE1 4.41Å; L136-F167 HydrophobicContact CB-CE1 4.36Å; L136-F167 HydrophobicContact CB-CZ 4.02Å; A140-F167 HydrophobicContact CB-CD1 3.93Å; A140-F167 HydrophobicContact CB-CE1 3.34Å; A140-F167 HydrophobicContact CB-CE2 4.45Å; A140-F167 HydrophobicContact CB-CZ 3.65Å; G163-F167 WeakPolarHBondContact O-CB 3.22Å; G163-F167 PolarHBondContact O-N 3.41Å; V164-F167 PolarHBondContact O-N 3.48Å; K165-F167 VanDerWaalsContact C-N 3.33Å; K165-F167 PolarHBondContact O-N 3.31Å; F167-T169 VanDerWaalsContact C-N 3.33Å; F167-T169 PolarHBondContact O-N 2.87Å; F167-V170 PolarHBondContact O-N 3.33Å; F167-A171 HydrophobicContact CE1-CB 4.48Å; F167-A171 WeakPolarHBondContact O-CB 3.5Å; F167-A171 PolarHBondContact O-N 3.05Å
168V92.4Very high84.8Confident5 Ų570.7 Ų70.73%0.0338%0.381CS..Hα-helixtrans-60.4-45.2177.9167.30000110.7M79 L80 H83 V164 K165 A166 V170 A171 W172M79-V168 HydrophobicContact CG-CG2 4.37Å; L80-V168 HydrophobicContact CD2-CG2 3.93Å; H83-V168 HydrophobicContact CB-CG1 4.3Å; H83-V168 VanDerWaalsContact CD2-CG1 3.44Å; H83-V168 WeakPolarHBondContact CD2-CG1 3.5Å; H83-V168 WeakPolarHBondContact NE2-CG1 3.32Å; V164-V168 WeakPolarHBondContact O-CG2 3.44Å; V164-V168 PolarHBondContact O-N 3.5Å; K165-V168 PolarHBondContact O-N 2.88Å; A166-V168 PolarHBondContact O-N 3.46Å; V168-V170 VanDerWaalsContact C-N 3.35Å; V168-V170 PolarHBondContact O-N 3.17Å; V168-A171 WeakPolarHBondContact O-CB 3.37Å; V168-A171 PolarHBondContact O-N 3.28Å; V168-W172 VanDerWaalsContact O-CD1 3.25Å; V168-W172 PolarHBondContact O-N 3.26Å
169T92.9Very high86.1Confident88 Ų8862 Ų6254%0.5434%0.341SS..Hα-helixtrans-59.4-46.5176.3-58.60000111.2K165 A166 F167 A171 W172 V173K165-T169 PolarHBondContact O-N 2.87Å; K165-T169 PolarHBondContact O-OG1 3.37Å; A166-T169 PolarHBondContact O-N 2.9Å; F167-T169 VanDerWaalsContact C-N 3.33Å; F167-T169 PolarHBondContact O-N 2.87Å; T169-A171 VanDerWaalsContact C-N 3.31Å; T169-A171 PolarHBondContact O-N 3.47Å; T169-W172 PolarHBondContact O-N 3.33Å; T169-V173 HydrophobicContact CG2-CG2 4.47Å; T169-V173 VanDerWaalsContact O-CG2 3.31Å; T169-V173 WeakPolarHBondContact O-CG2 3.47Å; T169-V173 PolarHBondContact O-N 2.81Å
170V93.2Very high87.3Confident100 Ų10056.3 Ų56.361%0.60633%0.326SS*.Hα-helixtrans-62.2-38.5176.71720000111.4A166 F167 V168 V173 G174A166-V170 VanDerWaalsContact O-CG2 3.3Å; A166-V170 WeakPolarHBondContact O-CG2 3.44Å; A166-V170 PolarHBondContact O-N 2.7Å; F167-V170 PolarHBondContact O-N 3.33Å; V168-V170 VanDerWaalsContact C-N 3.35Å; V168-V170 PolarHBondContact O-N 3.17Å; V170-V173 PolarHBondContact O-N 3.03Å; V170-G174 PolarHBondContact O-N 2.71Å
171A93.4Very high87.8Confident3 Ų358.1 Ų58.13%0.02533%0.334CS..Hα-helixtrans-63.4-42.617700000111.9V133 L136 F167 V168 T169 G175V133-A171 WeakPolarHBondContact CG2-O 3.02Å; L136-A171 HydrophobicContact CB-CB 4.22Å; L136-A171 HydrophobicContact CD1-CB 3.93Å; F167-A171 HydrophobicContact CE1-CB 4.48Å; F167-A171 WeakPolarHBondContact O-CB 3.5Å; F167-A171 PolarHBondContact O-N 3.05Å; V168-A171 WeakPolarHBondContact O-CB 3.37Å; V168-A171 PolarHBondContact O-N 3.28Å; T169-A171 VanDerWaalsContact C-N 3.31Å; T169-A171 PolarHBondContact O-N 3.47Å; A171-G175 PolarHBondContact O-N 2.82Å
172W94.3Very high87.2Confident64 Ų6456.1 Ų56.124%0.24232%0.318CS..Hα-helixtrans-65.2-46.1174.4-81.7100.2000112.3H83 I86 I129 V133 V168 T169 G174 G175 I176H83-W172 AromaticContact CE1-NE1 3.94Å; H83-W172 AromaticContact CG-NE1 3.96Å; H83-W172 AromaticContact ND1-NE1 3.15Å; H83-W172 PolarHBondContact ND1-NE1 3.43Å; H83-W172 VanDerWaalsContact ND1-NE1 3.15Å; I86-W172 HydrophobicContact CG2-CH2 4.31Å; I86-W172 HydrophobicContact CG2-CZ2 4.19Å; I129-W172 HydrophobicContact CG2-CE3 3.96Å; I129-W172 HydrophobicContact CG2-CZ3 3.95Å; V133-W172 HydrophobicContact CG1-CD2 4.16Å; V133-W172 HydrophobicContact CG1-CZ2 3.9Å; V133-W172 HydrophobicContact CG2-CD2 3.81Å; V133-W172 HydrophobicContact CG2-CE3 3.89Å; V133-W172 HydrophobicContact CG2-CG 4.13Å; V133-W172 HydrophobicContact CG2-CZ3 4.35Å; V168-W172 VanDerWaalsContact O-CD1 3.25Å; V168-W172 PolarHBondContact O-N 3.26Å; T169-W172 PolarHBondContact O-N 3.33Å; W172-G174 VanDerWaalsContact C-N 3.34Å; W172-G174 PolarHBondContact O-N 3.47Å; W172-G175 PolarHBondContact O-N 3.45Å; W172-I176 WeakPolarHBondContact O-CG1 3.43Å; W172-I176 PolarHBondContact O-N 3.23Å
173V93.6Very high86.6Confident88 Ų8854.7 Ų54.753%0.53330%0.302SS..Hα-helixtrans-61.2-43.9176.8172.70000110.9T169 V170 G175 I176 F177T169-V173 HydrophobicContact CG2-CG2 4.47Å; T169-V173 VanDerWaalsContact O-CG2 3.31Å; T169-V173 WeakPolarHBondContact O-CG2 3.47Å; T169-V173 PolarHBondContact O-N 2.81Å; V170-V173 PolarHBondContact O-N 3.03Å; V173-G175 VanDerWaalsContact C-N 3.33Å; V173-G175 PolarHBondContact O-N 3.19Å; V173-I176 PolarHBondContact O-N 3.12Å; V173-F177 WeakPolarHBondContact O-CB 3.48Å; V173-F177 PolarHBondContact O-N 3.04Å
174G89.8Confident85.7Confident26 Ų2659.3 Ų59.327%0.26832%0.315SS..Hα-helixtrans-62.4-38.7174.900000112.5V170 W172 F177 N178V170-G174 PolarHBondContact O-N 2.71Å; W172-G174 VanDerWaalsContact C-N 3.34Å; W172-G174 PolarHBondContact O-N 3.47Å; G174-F177 PolarHBondContact O-N 2.93Å; G174-N178 WeakPolarHBondContact O-CB 3.34Å; G174-N178 PolarHBondContact O-N 3.46Å
175G88.5Confident84.5Confident0 Ų060.5 Ų60.50%032%0.321CS..Hα-helixtrans-60-47.3172.400000112.4I129 A171 W172 V173 N178 A179I129-G175 WeakPolarHBondContact CG1-O 3.37Å; A171-G175 PolarHBondContact O-N 2.82Å; W172-G175 PolarHBondContact O-N 3.45Å; V173-G175 VanDerWaalsContact C-N 3.33Å; V173-G175 PolarHBondContact O-N 3.19Å; G175-N178 WeakPolarHBondContact O-CB 3.37Å; G175-N178 PolarHBondContact O-N 3.05Å; G175-A179 PolarHBondContact O-N 2.77Å
176I90Very high83Confident84 Ų8459.7 Ų59.743%0.43133%0.325SS..Hα-helixtrans-61.1-47.9176.3-66.3164.6000110.3I129 W172 V173 N178 A179 L180I129-I176 HydrophobicContact CD1-CG1 4.24Å; I129-I176 HydrophobicContact CG2-CG1 4.44Å; W172-I176 WeakPolarHBondContact O-CG1 3.43Å; W172-I176 PolarHBondContact O-N 3.23Å; V173-I176 PolarHBondContact O-N 3.12Å; I176-N178 VanDerWaalsContact C-N 3.31Å; I176-N178 PolarHBondContact O-N 3.06Å; I176-A179 PolarHBondContact O-N 3.4Å; I176-A179 VanDerWaalsContact O-N 3.15Å; I176-L180 HydrophobicContact CG2-CD1 4.26Å; I176-L180 HydrophobicContact CG2-CG 4.45Å; I176-L180 WeakPolarHBondContact O-CG 3.48Å; I176-L180 PolarHBondContact O-N 2.95Å
177F87.8Confident81.1Confident137 Ų13763.8 Ų63.860%0.60134%0.34SS*.Hα-helixtrans-59.5-42.4177.8-173.4-100.5000111.9V173 G174 A179 L180 I181V173-F177 WeakPolarHBondContact O-CB 3.48Å; V173-F177 PolarHBondContact O-N 3.04Å; G174-F177 PolarHBondContact O-N 2.93Å; F177-A179 VanDerWaalsContact C-N 3.35Å; F177-A179 PolarHBondContact O-N 3.26Å; F177-L180 WeakPolarHBondContact O-CB 3.28Å; F177-L180 PolarHBondContact O-N 3.47Å; F177-I181 HydrophobicContact CD1-CD1 4.09Å; F177-I181 HydrophobicContact CE1-CD1 3.83Å; F177-I181 HydrophobicContact CE1-CG1 4.37Å; F177-I181 WeakPolarHBondContact O-CG1 3.4Å; F177-I181 PolarHBondContact O-N 2.95Å; F177-I181 VanDerWaalsContact O-N 3.17Å
178N82.9Confident79.2Confident18 Ų1863 Ų6310%0.09634%0.338CS..Hα-helixtrans-59.6-45.1175.2-16836.5000111.3L132 G174 G175 I176 L180 I181 F182L132-N178 HydrophobicContact CD2-CB 3.96Å; G174-N178 WeakPolarHBondContact O-CB 3.34Å; G174-N178 PolarHBondContact O-N 3.46Å; G175-N178 WeakPolarHBondContact O-CB 3.37Å; G175-N178 PolarHBondContact O-N 3.05Å; I176-N178 VanDerWaalsContact C-N 3.31Å; I176-N178 PolarHBondContact O-N 3.06Å; N178-L180 VanDerWaalsContact C-N 3.35Å; N178-L180 PolarHBondContact O-N 3.19Å; N178-I181 WeakPolarHBondContact O-CB 3.36Å; N178-I181 PolarHBondContact O-N 3.4Å; N178-F182 VanDerWaalsContact O-CD2 3.26Å; N178-F182 WeakPolarHBondContact O-CD2 3.48Å
179A81.7Confident77.2Confident3 Ų371.7 Ų71.73%0.02538%0.378CS..Hα-helixtrans-65.6-34.1176.100000113.4A125 V128 I129 G175 I176 F177 I181 F182 F183A125-A179 HydrophobicContact CB-CB 4.29Å; V128-A179 HydrophobicContact CB-CB 4.43Å; V128-A179 HydrophobicContact CG1-CB 4.35Å; I129-A179 HydrophobicContact CD1-CB 4.09Å; I129-A179 HydrophobicContact CG1-CB 3.54Å; G175-A179 PolarHBondContact O-N 2.77Å; I176-A179 PolarHBondContact O-N 3.4Å; I176-A179 VanDerWaalsContact O-N 3.15Å; F177-A179 VanDerWaalsContact C-N 3.35Å; F177-A179 PolarHBondContact O-N 3.26Å; A179-I181 VanDerWaalsContact C-N 3.29Å; A179-I181 PolarHBondContact O-N 2.91Å; A179-F182 WeakPolarHBondContact O-CB 3.44Å; A179-F182 PolarHBondContact O-N 3.42Å; A179-F182 VanDerWaalsContact O-N 3.13Å; A179-F183 WeakPolarHBondContact O-CD2 3.43Å; A179-F183 PolarHBondContact O-N 3.08Å
180L82.2Confident75.5Confident95 Ų9571.3 Ų71.350%0.49737%0.372SS..Hα-helixtrans-61-36.1173.3-71174.8000112.5I176 F177 N178 F182 F183 L184I176-L180 HydrophobicContact CG2-CD1 4.26Å; I176-L180 HydrophobicContact CG2-CG 4.45Å; I176-L180 WeakPolarHBondContact O-CG 3.48Å; I176-L180 PolarHBondContact O-N 2.95Å; F177-L180 WeakPolarHBondContact O-CB 3.28Å; F177-L180 PolarHBondContact O-N 3.47Å; N178-L180 VanDerWaalsContact C-N 3.35Å; N178-L180 PolarHBondContact O-N 3.19Å; L180-F182 VanDerWaalsContact C-N 3.28Å; L180-F182 PolarHBondContact O-N 3.35Å; L180-F183 HydrophobicContact CD2-CD2 4.29Å; L180-F183 WeakPolarHBondContact O-CB 3.32Å; L180-F183 PolarHBondContact O-N 2.89Å; L180-L184 PolarHBondContact O-N 3.47Å
181I75.9Confident73.6Confident51 Ų5169.6 Ų69.626%0.26236%0.362SS..Hα-helixtrans-60.9-39.8174.5-62.5167.7000110.6F177 N178 A179 F183 L184F177-I181 HydrophobicContact CD1-CD1 4.09Å; F177-I181 HydrophobicContact CE1-CD1 3.83Å; F177-I181 HydrophobicContact CE1-CG1 4.37Å; F177-I181 WeakPolarHBondContact O-CG1 3.4Å; F177-I181 PolarHBondContact O-N 2.95Å; F177-I181 VanDerWaalsContact O-N 3.17Å; N178-I181 WeakPolarHBondContact O-CB 3.36Å; N178-I181 PolarHBondContact O-N 3.4Å; A179-I181 VanDerWaalsContact C-N 3.29Å; A179-I181 PolarHBondContact O-N 2.91Å; I181-F183 VanDerWaalsContact C-N 3.26Å; I181-F183 PolarHBondContact O-N 3.29Å; I181-L184 WeakPolarHBondContact O-CB 3.34Å; I181-L184 PolarHBondContact O-N 3.45Å; I181-L184 VanDerWaalsContact O-N 3.15Å
182F66.2Low71.8Confident21 Ų2169.8 Ų69.89%0.09236%0.362CS..Hα-helixtrans-66.7-24.7175.1-74.4-87.4000113.3V128 N178 A179 L180 L184 L185 F198 T209V128-F182 HydrophobicContact CG1-CD2 3.71Å; V128-F182 HydrophobicContact CG1-CE2 3.63Å; V128-F182 HydrophobicContact CG2-CD2 4.41Å; N178-F182 VanDerWaalsContact O-CD2 3.26Å; N178-F182 WeakPolarHBondContact O-CD2 3.48Å; A179-F182 WeakPolarHBondContact O-CB 3.44Å; A179-F182 PolarHBondContact O-N 3.42Å; A179-F182 VanDerWaalsContact O-N 3.13Å; L180-F182 VanDerWaalsContact C-N 3.28Å; L180-F182 PolarHBondContact O-N 3.35Å; F182-L184 VanDerWaalsContact C-N 3.3Å; F182-L185 VanDerWaalsContact O-CD1 3.25Å; F182-L185 WeakPolarHBondContact O-CD1 3.33Å; F182-L185 VanDerWaalsContact O-CG 3.26Å; F182-L185 WeakPolarHBondContact O-CG 3.32Å; F182-F198 HydrophobicContact CZ-CE1 4.5Å; F182-T209 HydrophobicContact CE2-CG2 4.45Å; F182-T209 HydrophobicContact CZ-CG2 4.16Å
183F69Low69.8Low85 Ų8569.4 Ų69.437%0.37336%0.363SS..Hα-helixtrans-74.9-17.7173.7-76.4-70000113.7V121 V122 A125 A179 L180 I181 L185V121-F183 HydrophobicContact CB-CE1 4.45Å; V121-F183 HydrophobicContact CG1-CD1 3.61Å; V121-F183 HydrophobicContact CG1-CE1 3.66Å; V121-F183 HydrophobicContact CG1-CG 4.25Å; V121-F183 HydrophobicContact CG1-CZ 4.35Å; V122-F183 HydrophobicContact CB-CE1 4.45Å; V122-F183 HydrophobicContact CG2-CE1 3.68Å; V122-F183 HydrophobicContact CG2-CZ 4.21Å; A125-F183 HydrophobicContact CB-CE2 3.61Å; A125-F183 HydrophobicContact CB-CZ 3.57Å; A179-F183 WeakPolarHBondContact O-CD2 3.43Å; A179-F183 PolarHBondContact O-N 3.08Å; L180-F183 HydrophobicContact CD2-CD2 4.29Å; L180-F183 WeakPolarHBondContact O-CB 3.32Å; L180-F183 PolarHBondContact O-N 2.89Å; I181-F183 VanDerWaalsContact C-N 3.26Å; I181-F183 PolarHBondContact O-N 3.29Å; F183-L185 PolarHBondContact O-N 3.23Å
184L67.6Low67.9Low144 Ų14467.5 Ų67.575%0.75435%0.347SS*.THydrogen-bonded Turntrans-76.42.7176.9-62.5174.4000113.1L180 I181 F182L180-L184 PolarHBondContact O-N 3.47Å; I181-L184 WeakPolarHBondContact O-CB 3.34Å; I181-L184 PolarHBondContact O-N 3.45Å; I181-L184 VanDerWaalsContact O-N 3.15Å; F182-L184 VanDerWaalsContact C-N 3.3Å
185L61.1Low66.6Low32 Ų3266.5 Ų66.517%0.16834%0.335CS..SBendtrans-63140.3173.6-71.6170.2000110.6F182 F183 N187 N201F182-L185 VanDerWaalsContact O-CD1 3.25Å; F182-L185 WeakPolarHBondContact O-CD1 3.33Å; F182-L185 VanDerWaalsContact O-CG 3.26Å; F182-L185 WeakPolarHBondContact O-CG 3.32Å; F183-L185 PolarHBondContact O-N 3.23Å; L185-N187 PolarHBondContact O-N 2.96Å; L185-N201 HydrophobicContact CD1-CB 4.47Å; L185-N201 HydrophobicContact CD2-CB 4.24Å; L185-N201 WeakPolarHBondContact CD2-ND2 3.45Å
186P56.4Low65.3Low81 Ų8166.5 Ų66.553%0.52634%0.335SS..  trans-57.2128-176.619.7-30000111.3Q188P186-Q188 PolarHBondContact O-N 3.31Å
187N52Low63.6Low138 Ų13863 Ų6374%0.73832%0.318SS*.  trans-58105.2172.1-82.5-27.4000108.7L185L185-N187 PolarHBondContact O-N 2.96Å
188Q52Low62.1Low61 Ų6156.7 Ų56.729%0.28529%0.29SS..  trans-114.4122.4165.1-70.7174.2-28.700106.4K117 P186 L190K117-Q188 HydrophobicContact CD-CB 4.16Å; P186-Q188 PolarHBondContact O-N 3.31Å; Q188-L190 HydrophobicContact CB-CD1 3.96Å; Q188-L190 HydrophobicContact CB-CG 4.33Å; Q188-L190 PolarHBondContact O-N 3.45Å
189E51.9Low60.7Low187 Ų18756.3 Ų56.387%0.87429%0.289SS*.  trans-73.322-179.9-63.2-173.8157.400113.1
190L55.3Low59.2Low79 Ų7956.9 Ų56.941%0.41429%0.291SS..PPolyproline II helixtrans-74.5132.8-176.8-67.2159.7000109.9F18 K117 Q188F18-L190 HydrophobicContact CD1-CD1 4.34Å; F18-L190 HydrophobicContact CE1-CB 4.27Å; F18-L190 HydrophobicContact CE1-CD1 3.51Å; F18-L190 HydrophobicContact CE1-CG 4.37Å; F18-L190 HydrophobicContact CZ-CB 3.81Å; F18-L190 HydrophobicContact CZ-CD1 3.72Å; F18-L190 HydrophobicContact CZ-CG 4.35Å; K117-L190 PolarHBondContact N-O 2.81Å; Q188-L190 HydrophobicContact CB-CD1 3.96Å; Q188-L190 HydrophobicContact CB-CG 4.33Å; Q188-L190 PolarHBondContact O-N 3.45Å
191V55Low57.8Low65 Ų6553.1 Ų53.139%0.39427%0.271SS..EExtended strand (participates in β ladder)trans-74.2123.3172.9175.10000108.6H114H114-V191 HydrophobicContact CB-CG1 3.65Å; H114-V191 HydrophobicContact CB-CG2 4.14Å; H114-V191 WeakPolarHBondContact ND1-CG1 3.28Å
192L55.8Low56.8Low7 Ų750.9 Ų50.94%0.03726%0.259CS..EExtended strand (participates in β ladder)trans-96.8133178.2-71.1173.7000110.3F18 I115 K117 C120 Y194 F200F18-L192 HydrophobicContact CE2-CD2 3.64Å; F18-L192 HydrophobicContact CZ-CD2 3.92Å; I115-L192 WeakPolarHBondContact O-CB 3.49Å; I115-L192 PolarHBondContact O-N 3.49Å; K117-L192 HydrophobicContact CB-CD1 4.05Å; K117-L192 HydrophobicContact CB-CG 4.49Å; K117-L192 HydrophobicContact CG-CD1 4.27Å; C120-L192 HydrophobicContact CB-CD1 3.75Å; L192-Y194 WeakPolarHBondContact CB-O 3.35Å; L192-F200 HydrophobicContact CD1-CD1 4.37Å; L192-F200 HydrophobicContact CD1-CD2 4.38Å; L192-F200 HydrophobicContact CD1-CE1 4.26Å; L192-F200 HydrophobicContact CD1-CE2 4.2Å; L192-F200 HydrophobicContact CD1-CG 4.49Å; L192-F200 HydrophobicContact CD1-CZ 4.24Å; L192-F200 HydrophobicContact CD2-CD1 3.88Å; L192-F200 HydrophobicContact CD2-CE1 3.68Å; L192-F200 HydrophobicContact CD2-CZ 4.35Å
193Q51.5Low56.5Low55 Ų5550.4 Ų50.426%0.25726%0.259SS..SBendtrans-87.6-13.8172.9-67-170.38.600113T25 N29 I105T25-Q193 HydrophobicContact CG2-CB 3.47Å; T25-Q193 VanDerWaalsContact CG2-CB 3.47Å; T25-Q193 PolarHBondContact O-OE1 3.44Å; N29-Q193 PolarHBondContact ND2-OE1 3.35Å; I105-Q193 WeakPolarHBondContact CG2-O 3.44Å
194Y53.2Low56.4Low48 Ų4849 Ų4919%0.18826%0.258CS..  trans-135.5152.6174.1-165.9-115.5000109.5Q98 L192 L199 F200 L303Q98-Y194 PolarHBondContact NE2-OH 3.43Å; L192-Y194 WeakPolarHBondContact CB-O 3.35Å; Y194-L199 HydrophobicContact CE1-CD1 4.41Å; Y194-F200 WeakPolarHBondContact O-CZ 3.3Å; Y194-L303 HydrophobicContact CE1-CD2 4.49Å; Y194-L303 WeakPolarHBondContact OH-CD2 3.36Å
195C62.2Low56.3Low5 Ų546.2 Ų46.23%0.03424%0.241CC..  trans-132.183.3179.1-176.40000113.2Q98 C120 M123 Q124Q98-C195 PolarHBondContact NE2-O 3.03Å; C120-C195 WeakPolarHBondContact CA-SG 3.13Å; C120-C195 HydrophobicContact CB-CB 3.98Å; C120-C195 WeakPolarHBondContact CB-SG 3.33Å; C120-C195 WeakPolarHBondContact SG-CA 3.45Å; C120-C195 WeakPolarHBondContact SG-CB 3.46Å; C120-C195 CovalentContact SG-SG 2.03Å; C120-C195 PolarHBondContact SG-SG 2.89Å; M123-C195 HydrophobicContact CE-CB 4.18Å; Q124-C195 PolarHBondContact NE2-SG 2.63Å
196S62Low56.7Low0 Ų045.1 Ų45.10%024%0.236CC..  trans-115136.6172.1175.70000114.7Q124 F198 F200 Y302Q124-S196 PolarHBondContact NE2-O 3.3Å; Q124-S196 VanDerWaalsContact NE2-O 3.11Å; S196-F198 PolarHBondContact O-N 2.88Å; S196-F198 VanDerWaalsContact O-N 3.14Å; S196-F200 WeakPolarHBondContact O-CD2 3.4Å; S196-F200 WeakPolarHBondContact O-CE2 3.32Å; S196-Y302 WeakPolarHBondContact OG-CE1 3.26Å; S196-Y302 PolarHBondContact OG-OH 2.84Å
197V54.8Low57.5Low12 Ų1244.4 Ų44.47%0.07322%0.223CC..THydrogen-bonded Turntrans-55.9-36.2-168.3-173.10000113.5Q124 S127 V128Q124-V197 HydrophobicContact CB-CB 4.49Å; Q124-V197 HydrophobicContact CB-CG1 4.45Å; Q124-V197 HydrophobicContact CB-CG2 3.82Å; Q124-V197 HydrophobicContact CG-CB 4.32Å; Q124-V197 HydrophobicContact CG-CG2 3.61Å; Q124-V197 VanDerWaalsContact OE1-CA 3.28Å; S127-V197 WeakPolarHBondContact OG-CG2 3.3Å; V128-V197 HydrophobicContact CG2-CG1 3.51Å
198F56.1Low58.7Low3 Ų342.8 Ų42.81%0.01322%0.217CC..THydrogen-bonded Turntrans-116.6-1.7-163.8-57.7-60.7000113.4F182 S196 L206 F277 F278 L281 Y302F182-F198 HydrophobicContact CZ-CE1 4.5Å; S196-F198 PolarHBondContact O-N 2.88Å; S196-F198 VanDerWaalsContact O-N 3.14Å; F198-L206 HydrophobicContact CB-CD1 4.01Å; F198-L206 HydrophobicContact CB-CD2 4.5Å; F198-L206 HydrophobicContact CD1-CD1 3.28Å; F198-L206 HydrophobicContact CE1-CD1 4.07Å; F198-L206 HydrophobicContact CG-CD1 4.04Å; F198-L206 VanDerWaalsContact O-CD2 3.29Å; F198-L206 WeakPolarHBondContact O-CD2 3.31Å; F198-F277 HydrophobicContact CD2-CE1 4.04Å; F198-F277 AromaticContact CD2-CZ 3.94Å; F198-F277 HydrophobicContact CD2-CZ 3.94Å; F198-F277 AromaticContact CE2-CE1 3.73Å; F198-F277 HydrophobicContact CE2-CE1 3.73Å; F198-F277 AromaticContact CE2-CZ 3.94Å; F198-F277 HydrophobicContact CE2-CZ 3.94Å; F198-F278 HydrophobicContact CE1-CE1 4.28Å; F198-F278 AromaticContact CE2-CE1 3.93Å; F198-F278 HydrophobicContact CE2-CE1 3.93Å; F198-F278 HydrophobicContact CE2-CZ 4.39Å; F198-F278 AromaticContact CZ-CE1 3.69Å; F198-F278 HydrophobicContact CZ-CE1 3.69Å; F198-F278 HydrophobicContact CZ-CZ 4.2Å; F198-L281 HydrophobicContact CB-CD1 3.4Å; F198-L281 VanDerWaalsContact CB-CD1 3.4Å; F198-L281 HydrophobicContact CB-CD2 3.23Å; F198-L281 HydrophobicContact CB-CG 3.87Å; F198-L281 HydrophobicContact CD1-CD2 3.94Å; F198-L281 HydrophobicContact CD2-CD2 3.66Å; F198-L281 HydrophobicContact CE2-CD2 4.47Å; F198-L281 HydrophobicContact CG-CD1 4.44Å; F198-L281 HydrophobicContact CG-CD2 3.34Å; F198-L281 HydrophobicContact CG-CG 4.47Å; F198-Y302 HydrophobicContact CD2-CE2 4.26Å
199L53.2Low59.9Low11 Ų1140.4 Ų40.46%0.05821%0.207CC..THydrogen-bonded Turntrans-92.3-9.4175.9-71167.6000112.2F17 I21 Y194 V299 Y302F17-L199 WeakPolarHBondContact CD1-O 3.31Å; F17-L199 WeakPolarHBondContact CE1-O 3.23Å; F17-L199 HydrophobicContact CZ-CD2 4.26Å; I21-L199 HydrophobicContact CD1-CB 4.11Å; I21-L199 WeakPolarHBondContact CD1-O 3.31Å; Y194-L199 HydrophobicContact CE1-CD1 4.41Å; L199-V299 HydrophobicContact CD1-CG1 4.3Å; L199-Y302 HydrophobicContact CD1-CD1 4.38Å; L199-Y302 HydrophobicContact CD1-CE1 4.22Å
200F49.6Very low61.4Low15 Ų1531.6 Ų31.67%0.06617%0.166CC..SBendtrans-96.9-1.1-176.8-61.9-57.4000116I21 C120 L192 Y194 S196I21-F200 HydrophobicContact CG2-CE1 4.31Å; C120-F200 VanDerWaalsContact SG-CE2 3.59Å; L192-F200 HydrophobicContact CD1-CD1 4.37Å; L192-F200 HydrophobicContact CD1-CD2 4.38Å; L192-F200 HydrophobicContact CD1-CE1 4.26Å; L192-F200 HydrophobicContact CD1-CE2 4.2Å; L192-F200 HydrophobicContact CD1-CG 4.49Å; L192-F200 HydrophobicContact CD1-CZ 4.24Å; L192-F200 HydrophobicContact CD2-CD1 3.88Å; L192-F200 HydrophobicContact CD2-CE1 3.68Å; L192-F200 HydrophobicContact CD2-CZ 4.35Å; Y194-F200 WeakPolarHBondContact O-CZ 3.3Å; S196-F200 WeakPolarHBondContact O-CD2 3.4Å; S196-F200 WeakPolarHBondContact O-CE2 3.32Å
201N52.8Low62.7Low16 Ų1629.6 Ų29.69%0.08617%0.165CC..  trans-157.5103177.9-141.8-78.8000112.8D14 L185 S203 L206D14-N201 VanDerWaalsContact CG-ND2 3.3Å; D14-N201 VanDerWaalsContact OD1-CA 3.24Å; D14-N201 WeakPolarHBondContact OD1-CA 3.43Å; D14-N201 PolarHBondContact OD1-ND2 3.23Å; D14-N201 PolarHBondContact OD1-OD1 3.41Å; D14-N201 VanDerWaalsContact OD2-CG 3.32Å; D14-N201 PolarHBondContact OD2-ND2 3.01Å; D14-N201 PolarHBondContact OD2-OD1 2.85Å; L185-N201 HydrophobicContact CD1-CB 4.47Å; L185-N201 HydrophobicContact CD2-CB 4.24Å; L185-N201 WeakPolarHBondContact CD2-ND2 3.45Å; N201-S203 PolarHBondContact O-N 3.29Å; N201-S203 WeakPolarHBondContact OD1-CB 3.37Å; N201-S203 PolarHBondContact OD1-N 3.37Å; N201-S203 PolarHBondContact OD1-OG 2.85Å; N201-L206 WeakPolarHBondContact O-CB 3.39Å; N201-L206 WeakPolarHBondContact O-CD2 3.43Å
202I54.6Low64.2Low3 Ų330.5 Ų30.52%0.01517%0.167CC..  trans-78.764162.9-58.7166.1000107.1D14 F17 Y207 F288 V289D14-I202 PolarHBondContact OD1-N 2.9Å; F17-I202 HydrophobicContact CB-CD1 4.35Å; F17-I202 HydrophobicContact CD1-CD1 3.67Å; F17-I202 HydrophobicContact CD1-CG1 3.71Å; F17-I202 HydrophobicContact CD2-CD1 3.71Å; F17-I202 HydrophobicContact CE1-CD1 3.62Å; F17-I202 HydrophobicContact CE1-CG1 3.55Å; F17-I202 HydrophobicContact CE2-CD1 3.63Å; F17-I202 HydrophobicContact CE2-CG1 4.46Å; F17-I202 HydrophobicContact CG-CD1 3.68Å; F17-I202 HydrophobicContact CG-CG1 4.22Å; F17-I202 HydrophobicContact CZ-CD1 3.6Å; F17-I202 HydrophobicContact CZ-CG1 3.95Å; I202-Y207 HydrophobicContact CG2-CD2 4.25Å; I202-Y207 HydrophobicContact CG2-CE2 3.29Å; I202-F288 HydrophobicContact CD1-CB 3.71Å; I202-F288 HydrophobicContact CD1-CD1 3.49Å; I202-F288 VanDerWaalsContact CD1-CD1 3.49Å; I202-F288 HydrophobicContact CD1-CG 3.84Å; I202-V289 HydrophobicContact CG2-CG2 3.81Å
203S61.3Low65.7Low12 Ų1230.2 Ų30.28%0.08417%0.166CC..  trans-78.2152.4167.648.80000108.6N201 Q205 L206 Y207N201-S203 PolarHBondContact O-N 3.29Å; N201-S203 WeakPolarHBondContact OD1-CB 3.37Å; N201-S203 PolarHBondContact OD1-N 3.37Å; N201-S203 PolarHBondContact OD1-OG 2.85Å; S203-Q205 PolarHBondContact O-N 3.03Å; S203-Q205 VanDerWaalsContact O-N 3.07Å; S203-Q205 WeakPolarHBondContact OG-CB 3.47Å; S203-L206 WeakPolarHBondContact O-CB 3.31Å; S203-L206 PolarHBondContact O-N 3.03Å; S203-L206 PolarHBondContact OG-N 3.44Å; S203-L206 VanDerWaalsContact OG-N 3.16Å; S203-Y207 PolarHBondContact O-N 3.02Å
204P65.3Low67.5Low56 Ų5628.7 Ų28.736%0.36416%0.161SC..Hα-helixtrans-54.5-25.6164.120.7-28.1000111.5L10 Y207 V208L10-P204 HydrophobicContact CD1-CB 4Å; L10-P204 HydrophobicContact CD1-CG 3.72Å; P204-Y207 PolarHBondContact O-N 3.22Å; P204-V208 VanDerWaalsContact O-CG2 3.25Å; P204-V208 WeakPolarHBondContact O-CG2 3.43Å; P204-V208 PolarHBondContact O-N 2.89Å
205Q66.2Low69.3Low85 Ų8528.4 Ų28.440%0.39717%0.168SC..Hα-helixtrans-63.2-43.3172.8-61.7177.9-11.600112.1S203 Y207 V208 T209S203-Q205 PolarHBondContact O-N 3.03Å; S203-Q205 VanDerWaalsContact O-N 3.07Å; S203-Q205 WeakPolarHBondContact OG-CB 3.47Å; Q205-Y207 VanDerWaalsContact C-N 3.33Å; Q205-Y207 PolarHBondContact O-N 3.25Å; Q205-V208 PolarHBondContact O-N 2.96Å; Q205-T209 WeakPolarHBondContact O-CB 3.45Å; Q205-T209 PolarHBondContact O-N 2.96Å; Q205-T209 PolarHBondContact O-OG1 3.21Å
206L69.4Low70.7Confident9 Ų929 Ų295%0.04717%0.171CC..Hα-helixtrans-58-45.7175.3-179.663.1000111.6F198 N201 S203 T209 C210 L281F198-L206 HydrophobicContact CB-CD1 4.01Å; F198-L206 HydrophobicContact CB-CD2 4.5Å; F198-L206 HydrophobicContact CD1-CD1 3.28Å; F198-L206 HydrophobicContact CE1-CD1 4.07Å; F198-L206 HydrophobicContact CG-CD1 4.04Å; F198-L206 VanDerWaalsContact O-CD2 3.29Å; F198-L206 WeakPolarHBondContact O-CD2 3.31Å; N201-L206 WeakPolarHBondContact O-CB 3.39Å; N201-L206 WeakPolarHBondContact O-CD2 3.43Å; S203-L206 WeakPolarHBondContact O-CB 3.31Å; S203-L206 PolarHBondContact O-N 3.03Å; S203-L206 PolarHBondContact OG-N 3.44Å; S203-L206 VanDerWaalsContact OG-N 3.16Å; L206-T209 PolarHBondContact O-N 3.25Å; L206-C210 WeakPolarHBondContact O-CB 3.41Å; L206-C210 PolarHBondContact O-N 3.43Å; L206-C210 PolarHBondContact O-SG 2.86Å; L206-L281 HydrophobicContact CD1-CD2 4.29Å
207Y73Confident72Confident66 Ų6629.2 Ų29.226%0.25917%0.173SC..Hα-helixtrans-61.7-43.8176.5-75.4-73.5000112.4I202 S203 P204 Q205 T209 C210 G211 T282 G285 A286I202-Y207 HydrophobicContact CG2-CD2 4.25Å; I202-Y207 HydrophobicContact CG2-CE2 3.29Å; S203-Y207 PolarHBondContact O-N 3.02Å; P204-Y207 PolarHBondContact O-N 3.22Å; Q205-Y207 VanDerWaalsContact C-N 3.33Å; Q205-Y207 PolarHBondContact O-N 3.25Å; Y207-T209 VanDerWaalsContact C-N 3.34Å; Y207-C210 PolarHBondContact O-N 2.93Å; Y207-G211 PolarHBondContact O-N 3.47Å; Y207-T282 HydrophobicContact CD1-CG2 4Å; Y207-T282 HydrophobicContact CE1-CG2 4.14Å; Y207-G285 PolarHBondContact OH-O 2.64Å; Y207-A286 WeakPolarHBondContact OH-CA 3.5Å; Y207-A286 PolarHBondContact OH-N 3.08Å
208V76.9Confident73.8Confident103 Ų10333 Ų3362%0.62419%0.192SC*.Hα-helixtrans-62.6-43.6176.51710000110.5P204 Q205 G211 L212P204-V208 VanDerWaalsContact O-CG2 3.25Å; P204-V208 WeakPolarHBondContact O-CG2 3.43Å; P204-V208 PolarHBondContact O-N 2.89Å; Q205-V208 PolarHBondContact O-N 2.96Å; V208-G211 PolarHBondContact O-N 3.31Å; V208-L212 VanDerWaalsContact O-CB 3.27Å; V208-L212 WeakPolarHBondContact O-CB 3.38Å; V208-L212 PolarHBondContact O-N 3.27Å
209T78.8Confident75.6Confident12 Ų1237.1 Ų37.17%0.07421%0.213CC..Hα-helixtrans-66-45.5178.1-61.60000111.9F182 Q205 L206 Y207 L212 Y213F182-T209 HydrophobicContact CE2-CG2 4.45Å; F182-T209 HydrophobicContact CZ-CG2 4.16Å; Q205-T209 WeakPolarHBondContact O-CB 3.45Å; Q205-T209 PolarHBondContact O-N 2.96Å; Q205-T209 PolarHBondContact O-OG1 3.21Å; L206-T209 PolarHBondContact O-N 3.25Å; Y207-T209 VanDerWaalsContact C-N 3.34Å; T209-L212 WeakPolarHBondContact O-CB 3.27Å; T209-L212 PolarHBondContact O-N 3.41Å; T209-Y213 HydrophobicContact CG2-CD2 3.72Å; T209-Y213 HydrophobicContact CG2-CE2 3.3Å; T209-Y213 WeakPolarHBondContact O-CD2 3.43Å; T209-Y213 PolarHBondContact O-N 2.85Å
210C81.6Confident77.4Confident1 Ų136.8 Ų36.81%0.00721%0.211CC..Hα-helixtrans-63.7-44.4176.1-64.80000111.3L206 Y207 L212 Y213 C214 F278 L281 T282L206-C210 WeakPolarHBondContact O-CB 3.41Å; L206-C210 PolarHBondContact O-N 3.43Å; L206-C210 PolarHBondContact O-SG 2.86Å; Y207-C210 PolarHBondContact O-N 2.93Å; C210-L212 VanDerWaalsContact C-N 3.32Å; C210-L212 PolarHBondContact O-N 2.89Å; C210-Y213 PolarHBondContact O-N 2.96Å; C210-C214 WeakPolarHBondContact O-CB 3.26Å; C210-C214 PolarHBondContact O-N 3.4Å; C210-C214 PolarHBondContact O-SG 3.12Å; C210-C214 VanDerWaalsContact O-SG 3.4Å; C210-F278 HydrophobicContact CB-CB 4.34Å; C210-F278 HydrophobicContact CB-CD1 4.19Å; C210-L281 WeakPolarHBondContact SG-CD2 3.28Å; C210-T282 WeakPolarHBondContact CB-OG1 3.11Å
211G83.8Confident79.4Confident38 Ų3838.4 Ų38.439%0.39222%0.222SC..Hα-helixtrans-59.6-41.7174.900000112.2Y207 V208 C214 A215Y207-G211 PolarHBondContact O-N 3.47Å; V208-G211 PolarHBondContact O-N 3.31Å; G211-C214 PolarHBondContact O-N 3.37Å; G211-A215 VanDerWaalsContact O-CB 3.31Å; G211-A215 WeakPolarHBondContact O-CB 3.36Å; G211-A215 PolarHBondContact O-N 3.08Å
212L86.4Confident81.3Confident84 Ų8440.9 Ų40.944%0.4424%0.238SC..Hα-helixtrans-61.1-47173.7179.667.6000111.4V208 T209 C210 A215 I216V208-L212 VanDerWaalsContact O-CB 3.27Å; V208-L212 WeakPolarHBondContact O-CB 3.38Å; V208-L212 PolarHBondContact O-N 3.27Å; T209-L212 WeakPolarHBondContact O-CB 3.27Å; T209-L212 PolarHBondContact O-N 3.41Å; C210-L212 VanDerWaalsContact C-N 3.32Å; C210-L212 PolarHBondContact O-N 2.89Å; L212-A215 PolarHBondContact O-N 2.87Å; L212-I216 HydrophobicContact CD1-CD1 4.24Å; L212-I216 HydrophobicContact CD1-CG1 4.48Å; L212-I216 HydrophobicContact CG-CD1 3.96Å; L212-I216 VanDerWaalsContact O-CG1 3.25Å; L212-I216 WeakPolarHBondContact O-CG1 3.29Å; L212-I216 PolarHBondContact O-N 3.42Å
213Y88Confident83.1Confident1 Ų142 Ų420%0.00424%0.244CC..Hα-helixtrans-63.7-42.3177.8-75.1-59.2000112.7V128 F131 L132 T209 C210 I216 A217 F278V128-Y213 PolarHBondContact O-OH 2.97Å; F131-Y213 HydrophobicContact CB-CE1 4.08Å; L132-Y213 HydrophobicContact CB-CE1 4.24Å; L132-Y213 HydrophobicContact CD1-CE1 4.08Å; L132-Y213 PolarHBondContact N-OH 2.9Å; T209-Y213 HydrophobicContact CG2-CD2 3.72Å; T209-Y213 HydrophobicContact CG2-CE2 3.3Å; T209-Y213 WeakPolarHBondContact O-CD2 3.43Å; T209-Y213 PolarHBondContact O-N 2.85Å; C210-Y213 PolarHBondContact O-N 2.96Å; Y213-I216 PolarHBondContact O-N 2.88Å; Y213-A217 WeakPolarHBondContact O-CB 3.42Å; Y213-A217 PolarHBondContact O-N 3.47Å; Y213-F278 HydrophobicContact CD1-CE2 4.2Å; Y213-F278 HydrophobicContact CD1-CZ 4.3Å; Y213-F278 AromaticContact CD2-CD1 3.9Å; Y213-F278 HydrophobicContact CD2-CD1 3.9Å; Y213-F278 HydrophobicContact CD2-CD2 4.3Å; Y213-F278 AromaticContact CD2-CE1 3.36Å; Y213-F278 HydrophobicContact CD2-CE1 3.36Å; Y213-F278 AromaticContact CD2-CE2 3.82Å; Y213-F278 HydrophobicContact CD2-CE2 3.82Å; Y213-F278 HydrophobicContact CD2-CG 4.34Å; Y213-F278 AromaticContact CD2-CZ 3.31Å; Y213-F278 HydrophobicContact CD2-CZ 3.31Å; Y213-F278 AromaticContact CE2-CE1 3.87Å; Y213-F278 HydrophobicContact CE2-CE1 3.87Å; Y213-F278 HydrophobicContact CE2-CE2 4.49Å; Y213-F278 AromaticContact CE2-CZ 3.7Å; Y213-F278 HydrophobicContact CE2-CZ 3.7Å; Y213-F278 HydrophobicContact CG-CD1 4.4Å; Y213-F278 HydrophobicContact CG-CD2 4.03Å; Y213-F278 HydrophobicContact CG-CE1 4.05Å; Y213-F278 AromaticContact CG-CE2 3.65Å; Y213-F278 HydrophobicContact CG-CE2 3.65Å; Y213-F278 HydrophobicContact CG-CG 4.39Å; Y213-F278 AromaticContact CG-CZ 3.66Å; Y213-F278 HydrophobicContact CG-CZ 3.66Å
214C88.2Confident84.4Confident22 Ų2241.5 Ų41.515%0.14924%0.24CC..Hα-helixtrans-61.1-43.6173.3-72.40000111.5C210 G211 A217 I218 L275C210-C214 WeakPolarHBondContact O-CB 3.26Å; C210-C214 PolarHBondContact O-N 3.4Å; C210-C214 PolarHBondContact O-SG 3.12Å; C210-C214 VanDerWaalsContact O-SG 3.4Å; G211-C214 PolarHBondContact O-N 3.37Å; C214-A217 PolarHBondContact O-N 3.39Å; C214-I218 WeakPolarHBondContact O-CG1 3.13Å; C214-I218 PolarHBondContact O-N 2.94Å; C214-L275 HydrophobicContact CB-CD2 4.08Å
215A91.1Very high85.5Confident42 Ų4245.8 Ų45.835%0.34725%0.249SC..Hα-helixtrans-61.9-45176.400000111.6G211 L212 A217 I218 I219G211-A215 VanDerWaalsContact O-CB 3.31Å; G211-A215 WeakPolarHBondContact O-CB 3.36Å; G211-A215 PolarHBondContact O-N 3.08Å; L212-A215 PolarHBondContact O-N 2.87Å; A215-A217 VanDerWaalsContact C-N 3.32Å; A215-A217 PolarHBondContact O-N 3.4Å; A215-I218 PolarHBondContact O-N 3.03Å; A215-I219 WeakPolarHBondContact O-CB 3.19Å; A215-I219 WeakPolarHBondContact O-CD1 3.33Å; A215-I219 VanDerWaalsContact O-CG1 3.22Å; A215-I219 WeakPolarHBondContact O-CG1 3.49Å; A215-I219 PolarHBondContact O-N 3.46Å
216I92.1Very high86.7Confident17 Ų1744.9 Ų44.99%0.08725%0.246CC..Hα-helixtrans-60.5-42.6175.6-66.5165.1000110.7L132 L136 T139 L212 Y213 I219 T220L132-I216 HydrophobicContact CD1-CD1 4.13Å; L136-I216 HydrophobicContact CD2-CD1 4.36Å; T139-I216 VanDerWaalsContact OG1-CG2 3.24Å; T139-I216 WeakPolarHBondContact OG1-CG2 3.32Å; L212-I216 HydrophobicContact CD1-CD1 4.24Å; L212-I216 HydrophobicContact CD1-CG1 4.48Å; L212-I216 HydrophobicContact CG-CD1 3.96Å; L212-I216 VanDerWaalsContact O-CG1 3.25Å; L212-I216 WeakPolarHBondContact O-CG1 3.29Å; L212-I216 PolarHBondContact O-N 3.42Å; Y213-I216 PolarHBondContact O-N 2.88Å; I216-I219 PolarHBondContact O-N 2.95Å; I216-T220 WeakPolarHBondContact O-CB 3.25Å; I216-T220 PolarHBondContact O-N 3.17Å; I216-T220 PolarHBondContact O-OG1 2.85Å
217A89.3Confident87.5Confident6 Ų644.4 Ų44.45%0.0524%0.244CC..Hα-helixtrans-62.6-43.5177.300000112Y213 C214 A215 T220 V221 F274 L275Y213-A217 WeakPolarHBondContact O-CB 3.42Å; Y213-A217 PolarHBondContact O-N 3.47Å; C214-A217 PolarHBondContact O-N 3.39Å; A215-A217 VanDerWaalsContact C-N 3.32Å; A215-A217 PolarHBondContact O-N 3.4Å; A217-T220 WeakPolarHBondContact O-CB 3.39Å; A217-T220 PolarHBondContact O-N 3.39Å; A217-V221 WeakPolarHBondContact O-CG2 3.38Å; A217-V221 PolarHBondContact O-N 3.5Å; A217-F274 HydrophobicContact CB-CB 4.31Å; A217-L275 HydrophobicContact CB-CD2 4.1Å; A217-L275 HydrophobicContact CB-CG 3.9Å
218I91.9Very high88.1Confident92 Ų9245.5 Ų45.547%0.47225%0.249SC..Hα-helixtrans-63.2-48.9175.7-67164.8000110.7C214 A215 T220 V221 V222 L275C214-I218 WeakPolarHBondContact O-CG1 3.13Å; C214-I218 PolarHBondContact O-N 2.94Å; A215-I218 PolarHBondContact O-N 3.03Å; I218-T220 VanDerWaalsContact C-N 3.25Å; I218-T220 PolarHBondContact O-N 2.7Å; I218-V221 PolarHBondContact O-N 2.83Å; I218-V221 VanDerWaalsContact O-N 3.12Å; I218-V222 HydrophobicContact CG2-CG2 4.36Å; I218-V222 WeakPolarHBondContact O-CG2 3.35Å; I218-V222 PolarHBondContact O-N 3.19Å; I218-L275 HydrophobicContact CD1-CD2 4.47Å; I218-L275 HydrophobicContact CG1-CD2 4.07Å
219I93.7Very high88.6Confident88 Ų8846.6 Ų46.645%0.45125%0.245SC..Hα-helixtrans-56.8-43.4177.8-70.2165.2000110.2T139 A215 I216 V221 V222 I223T139-I219 HydrophobicContact CG2-CG2 4.08Å; A215-I219 WeakPolarHBondContact O-CB 3.19Å; A215-I219 WeakPolarHBondContact O-CD1 3.33Å; A215-I219 VanDerWaalsContact O-CG1 3.22Å; A215-I219 WeakPolarHBondContact O-CG1 3.49Å; A215-I219 PolarHBondContact O-N 3.46Å; I216-I219 PolarHBondContact O-N 2.95Å; I219-V221 PolarHBondContact O-N 3.45Å; I219-V222 PolarHBondContact O-N 3.14Å; I219-I223 HydrophobicContact CG2-CD1 3.66Å; I219-I223 HydrophobicContact CG2-CG1 4.29Å; I219-I223 WeakPolarHBondContact O-CB 3.46Å; I219-I223 VanDerWaalsContact O-CG1 3.28Å; I219-I223 WeakPolarHBondContact O-CG1 3.44Å; I219-I223 PolarHBondContact O-N 3.36Å
220T91.1Very high89Confident4 Ų449 Ų493%0.02526%0.257CS..Hα-helixtrans-57.3-50.7176-59.50000111.1I138 T139 I216 A217 I218 V222 I223 Y224 V267I138-T220 HydrophobicContact CG2-CG2 3.89Å; T139-T220 PolarHBondContact OG1-OG1 3.08Å; I216-T220 WeakPolarHBondContact O-CB 3.25Å; I216-T220 PolarHBondContact O-N 3.17Å; I216-T220 PolarHBondContact O-OG1 2.85Å; A217-T220 WeakPolarHBondContact O-CB 3.39Å; A217-T220 PolarHBondContact O-N 3.39Å; I218-T220 VanDerWaalsContact C-N 3.25Å; I218-T220 PolarHBondContact O-N 2.7Å; T220-V222 VanDerWaalsContact C-N 3.33Å; T220-V222 PolarHBondContact O-N 3.38Å; T220-I223 PolarHBondContact O-N 3.2Å; T220-Y224 HydrophobicContact CG2-CD2 3.99Å; T220-Y224 HydrophobicContact CG2-CE2 4.15Å; T220-Y224 WeakPolarHBondContact O-CD2 3.43Å; T220-Y224 PolarHBondContact O-N 2.85Å; T220-V267 HydrophobicContact CG2-CG1 3.46Å; T220-V267 VanDerWaalsContact CG2-CG1 3.46Å
221V91.4Very high89Confident49 Ų4949.1 Ų49.130%0.29726%0.257SS..Hα-helixtrans-59.4-44.7179.1173.40000111A217 I218 I219 Y224 W225 L268 S271A217-V221 WeakPolarHBondContact O-CG2 3.38Å; A217-V221 PolarHBondContact O-N 3.5Å; I218-V221 PolarHBondContact O-N 2.83Å; I218-V221 VanDerWaalsContact O-N 3.12Å; I219-V221 PolarHBondContact O-N 3.45Å; V221-Y224 PolarHBondContact O-N 3.37Å; V221-W225 VanDerWaalsContact O-CB 3.28Å; V221-W225 WeakPolarHBondContact O-CB 3.35Å; V221-W225 PolarHBondContact O-N 3.42Å; V221-L268 HydrophobicContact CG1-CD2 4.25Å; V221-L268 HydrophobicContact CG2-CD2 4.33Å; V221-S271 VanDerWaalsContact CG2-CB 3.46Å
222V93.1Very high88.9Confident68 Ų6849.7 Ų49.741%0.41226%0.255SS..Hα-helixtrans-62.1-46.4178.7173.60000111.3I218 I219 T220 Y224 W225 L226I218-V222 HydrophobicContact CG2-CG2 4.36Å; I218-V222 WeakPolarHBondContact O-CG2 3.35Å; I218-V222 PolarHBondContact O-N 3.19Å; I219-V222 PolarHBondContact O-N 3.14Å; T220-V222 VanDerWaalsContact C-N 3.33Å; T220-V222 PolarHBondContact O-N 3.38Å; V222-Y224 PolarHBondContact O-N 2.96Å; V222-W225 PolarHBondContact O-N 3.27Å; V222-L226 HydrophobicContact CG1-CD1 4.07Å; V222-L226 HydrophobicContact CG1-CG 4.41Å; V222-L226 WeakPolarHBondContact O-CB 3.35Å; V222-L226 WeakPolarHBondContact O-CG 3.42Å; V222-L226 PolarHBondContact O-N 3.3Å
223I91.8Very high88.6Confident27 Ų2749.2 Ų49.214%0.13826%0.259CS..Hα-helixtrans-60.3-45.8178.2-70.9170.2000110.9T139 G142 L146 I219 T220 L226 T227T139-I223 HydrophobicContact CG2-CD1 3.91Å; G142-I223 WeakPolarHBondContact O-CG2 3.47Å; L146-I223 HydrophobicContact CB-CG2 4.36Å; L146-I223 HydrophobicContact CD2-CG2 4.33Å; I219-I223 HydrophobicContact CG2-CD1 3.66Å; I219-I223 HydrophobicContact CG2-CG1 4.29Å; I219-I223 WeakPolarHBondContact O-CB 3.46Å; I219-I223 VanDerWaalsContact O-CG1 3.28Å; I219-I223 WeakPolarHBondContact O-CG1 3.44Å; I219-I223 PolarHBondContact O-N 3.36Å; T220-I223 PolarHBondContact O-N 3.2Å; I223-L226 PolarHBondContact O-N 3.39Å; I223-T227 WeakPolarHBondContact O-CB 3.47Å; I223-T227 PolarHBondContact O-N 2.99Å; I223-T227 PolarHBondContact O-OG1 2.87Å
224Y88.6Confident88Confident1 Ų151.2 Ų51.20%0.00427%0.267CS..Hα-helixtrans-68-36.8178.9-89.7-93.6000112.4L141 G142 T220 V221 V222 T227 Y228 L263 L264 V267L141-Y224 WeakPolarHBondContact CD2-OH 3.39Å; L141-Y224 WeakPolarHBondContact CG-OH 3.44Å; G142-Y224 PolarHBondContact N-OH 3.46Å; T220-Y224 HydrophobicContact CG2-CD2 3.99Å; T220-Y224 HydrophobicContact CG2-CE2 4.15Å; T220-Y224 WeakPolarHBondContact O-CD2 3.43Å; T220-Y224 PolarHBondContact O-N 2.85Å; V221-Y224 PolarHBondContact O-N 3.37Å; V222-Y224 PolarHBondContact O-N 2.96Å; Y224-T227 PolarHBondContact O-N 3.02Å; Y224-Y228 WeakPolarHBondContact O-CB 3.3Å; Y224-Y228 PolarHBondContact O-N 2.88Å; Y224-L263 HydrophobicContact CE1-CB 4.43Å; Y224-L264 HydrophobicContact CD1-CD1 4.09Å; Y224-L264 HydrophobicContact CG-CD1 4.48Å; Y224-V267 HydrophobicContact CD1-CB 4.48Å; Y224-V267 HydrophobicContact CD1-CG1 4.47Å; Y224-V267 HydrophobicContact CD2-CB 4.49Å; Y224-V267 HydrophobicContact CD2-CG1 3.69Å; Y224-V267 HydrophobicContact CE1-CB 4.31Å; Y224-V267 HydrophobicContact CE1-CG1 4.48Å; Y224-V267 HydrophobicContact CE1-CG2 3.89Å; Y224-V267 HydrophobicContact CE2-CB 4.31Å; Y224-V267 HydrophobicContact CE2-CG1 3.68Å; Y224-V267 HydrophobicContact CE2-CG2 4.03Å; Y224-V267 HydrophobicContact CG-CG1 4.09Å
225W89.1Confident87.3Confident146 Ų14652.6 Ų52.655%0.55327%0.274SS*.Hα-helixtrans-63.7-46.2174.1177.475.4000111.9V221 V222 T227 Y228 K229V221-W225 VanDerWaalsContact O-CB 3.28Å; V221-W225 WeakPolarHBondContact O-CB 3.35Å; V221-W225 PolarHBondContact O-N 3.42Å; V222-W225 PolarHBondContact O-N 3.27Å; W225-T227 VanDerWaalsContact C-N 3.35Å; W225-T227 PolarHBondContact O-N 3.39Å; W225-Y228 PolarHBondContact O-N 2.95Å; W225-K229 HydrophobicContact CH2-CD 4.45Å; W225-K229 HydrophobicContact CZ2-CD 4.38Å; W225-K229 WeakPolarHBondContact O-CB 3.32Å; W225-K229 PolarHBondContact O-N 3.43Å
226L90.9Very high86.5Confident66 Ų6655.1 Ų55.135%0.34628%0.281SS..Hα-helixtrans-60-45.7173.9-71.9173.9000111.4L146 V222 I223 Y228 K229 L230L146-L226 HydrophobicContact CD1-CB 4.39Å; V222-L226 HydrophobicContact CG1-CD1 4.07Å; V222-L226 HydrophobicContact CG1-CG 4.41Å; V222-L226 WeakPolarHBondContact O-CB 3.35Å; V222-L226 WeakPolarHBondContact O-CG 3.42Å; V222-L226 PolarHBondContact O-N 3.3Å; I223-L226 PolarHBondContact O-N 3.39Å; L226-Y228 VanDerWaalsContact C-N 3.32Å; L226-Y228 PolarHBondContact O-N 3.29Å; L226-K229 PolarHBondContact O-N 2.9Å; L226-L230 WeakPolarHBondContact O-CB 3.46Å; L226-L230 WeakPolarHBondContact O-CG 3.41Å; L226-L230 PolarHBondContact O-N 2.81Å
227T87.3Confident85.5Confident0 Ų056.7 Ų56.70%029%0.294CS..Hα-helixtrans-59.5-43.7177.4-56.80000111.1R145 L146 I223 Y224 W225 N231 T260R145-T227 HydrophobicContact CB-CG2 3.85Å; L146-T227 WeakPolarHBondContact CB-OG1 3.4Å; I223-T227 WeakPolarHBondContact O-CB 3.47Å; I223-T227 PolarHBondContact O-N 2.99Å; I223-T227 PolarHBondContact O-OG1 2.87Å; Y224-T227 PolarHBondContact O-N 3.02Å; W225-T227 VanDerWaalsContact C-N 3.35Å; W225-T227 PolarHBondContact O-N 3.39Å; T227-N231 VanDerWaalsContact O-CB 3.25Å; T227-N231 WeakPolarHBondContact O-CB 3.44Å; T227-N231 PolarHBondContact O-N 2.8Å; T227-N231 PolarHBondContact O-ND2 2.82Å; T227-T260 HydrophobicContact CG2-CG2 3.89Å
228Y85.8Confident84.4Confident89 Ų8957.9 Ų57.935%0.34930%0.298SS..Hα-helixtrans-64.5-45176.7176.7-98.6000112.2Y224 W225 L226 N231 S232 L264Y224-Y228 WeakPolarHBondContact O-CB 3.3Å; Y224-Y228 PolarHBondContact O-N 2.88Å; W225-Y228 PolarHBondContact O-N 2.95Å; L226-Y228 VanDerWaalsContact C-N 3.32Å; L226-Y228 PolarHBondContact O-N 3.29Å; Y228-N231 PolarHBondContact O-N 3.15Å; Y228-S232 WeakPolarHBondContact O-CB 3.46Å; Y228-S232 PolarHBondContact O-N 3.36Å; Y228-S232 PolarHBondContact O-OG 3.47Å; Y228-L264 HydrophobicContact CD2-CD2 4.08Å
229K87.5Confident83.2Confident126 Ų12657.3 Ų57.355%0.54830%0.302SS..Hα-helixtrans-62.8-46.8178.9-172.5178.1-179.4179.60111.6W225 L226 S232 S233W225-K229 HydrophobicContact CH2-CD 4.45Å; W225-K229 HydrophobicContact CZ2-CD 4.38Å; W225-K229 WeakPolarHBondContact O-CB 3.32Å; W225-K229 PolarHBondContact O-N 3.43Å; L226-K229 PolarHBondContact O-N 2.9Å; K229-S232 PolarHBondContact O-N 3.45Å; K229-S233 PolarHBondContact O-N 3.21Å
230L86.1Confident82.1Confident61 Ų6158.9 Ų58.932%0.31931%0.31SS..Hα-helixtrans-63.8-43.5177-70.7172.3000111.8L146 T149 L150 L226 S232 S233 R234L146-L230 HydrophobicContact CD1-CD1 3.55Å; T149-L230 HydrophobicContact CG2-CB 3.76Å; L150-L230 HydrophobicContact CD2-CD1 3.93Å; L226-L230 WeakPolarHBondContact O-CB 3.46Å; L226-L230 WeakPolarHBondContact O-CG 3.41Å; L226-L230 PolarHBondContact O-N 2.81Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 3.46Å; L230-S233 PolarHBondContact O-N 3.03Å; L230-R234 WeakPolarHBondContact O-CB 3.31Å; L230-R234 WeakPolarHBondContact O-CG 3.39Å; L230-R234 PolarHBondContact O-N 3.32Å
231N82.1Confident80.8Confident4 Ų463 Ų632%0.02133%0.332CS..Hα-helixtrans-61.5-41.5175.3-85-45.8000112.1T149 T227 Y228 R234 V235 V257T149-N231 HydrophobicContact CG2-CB 4.5Å; T149-N231 VanDerWaalsContact CG2-OD1 3.26Å; T149-N231 WeakPolarHBondContact CG2-OD1 3.4Å; T149-N231 PolarHBondContact OG1-ND2 3.42Å; T227-N231 VanDerWaalsContact O-CB 3.25Å; T227-N231 WeakPolarHBondContact O-CB 3.44Å; T227-N231 PolarHBondContact O-N 2.8Å; T227-N231 PolarHBondContact O-ND2 2.82Å; Y228-N231 PolarHBondContact O-N 3.15Å; N231-R234 PolarHBondContact O-N 3.46Å; N231-V235 VanDerWaalsContact O-CG2 3.29Å; N231-V235 WeakPolarHBondContact O-CG2 3.48Å; N231-V235 PolarHBondContact O-N 2.99Å; N231-V257 HydrophobicContact CB-CG2 4.06Å
232S80.9Confident79.3Confident50 Ų5069.2 Ų69.235%0.3535%0.35SS..Hα-helixtrans-63.5-44.6176.6-58.80000111.6Y228 K229 L230 R234 V235 L236Y228-S232 WeakPolarHBondContact O-CB 3.46Å; Y228-S232 PolarHBondContact O-N 3.36Å; Y228-S232 PolarHBondContact O-OG 3.47Å; K229-S232 PolarHBondContact O-N 3.45Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 3.46Å; S232-R234 VanDerWaalsContact C-N 3.31Å; S232-R234 PolarHBondContact O-N 3.07Å; S232-V235 PolarHBondContact O-N 3.27Å; S232-L236 PolarHBondContact O-N 3.43Å
233S81.9Confident77.7Confident75 Ų7571 Ų7152%0.52437%0.372SS..Hα-helixtrans-62.2-37.7175.5-171.80000112.4K229 L230 L236 S237K229-S233 PolarHBondContact O-N 3.21Å; L230-S233 PolarHBondContact O-N 3.03Å; S233-L236 WeakPolarHBondContact O-CB 3.39Å; S233-L236 PolarHBondContact O-N 2.99Å; S233-S237 PolarHBondContact O-N 3.48Å
234R75.4Confident76.4Confident43 Ų4374.4 Ų74.416%0.16239%0.394CS..Hα-helixtrans-70.1-46.5176.5-76.2-177.1173.6-157.2-6.6111.7T149 L150 N152 L230 N231 S232 L236 S237 F238 L253T149-R234 PolarHBondContact O-NE 2.98Å; T149-R234 PolarHBondContact O-NH1 3.25Å; T149-R234 PolarHBondContact O-NH2 3.15Å; L150-R234 PolarHBondContact O-NH2 2.9Å; N152-R234 PolarHBondContact OD1-NH1 3.28Å; N152-R234 PolarHBondContact OD1-NH2 3.46Å; L230-R234 WeakPolarHBondContact O-CB 3.31Å; L230-R234 WeakPolarHBondContact O-CG 3.39Å; L230-R234 PolarHBondContact O-N 3.32Å; N231-R234 PolarHBondContact O-N 3.46Å; S232-R234 VanDerWaalsContact C-N 3.31Å; S232-R234 PolarHBondContact O-N 3.07Å; R234-L236 PolarHBondContact O-N 3.34Å; R234-L236 VanDerWaalsContact O-N 3.16Å; R234-S237 WeakPolarHBondContact CA-OG 3.49Å; R234-S237 PolarHBondContact O-N 3.47Å; R234-S237 PolarHBondContact O-OG 3Å; R234-F238 HydrophobicContact CB-CD2 4.36Å; R234-F238 WeakPolarHBondContact O-CB 3.42Å; R234-F238 VanDerWaalsContact O-CD2 3.23Å; R234-F238 WeakPolarHBondContact O-CD2 3.3Å; R234-F238 PolarHBondContact O-N 2.99Å; R234-L253 HydrophobicContact CB-CD1 4.29Å
235V72.9Confident75.2Confident50 Ų5076.7 Ų76.730%0.30341%0.405SS..Hα-helixtrans-54.8-38.4175.4171.20000110.5N231 S232 S239 V257N231-V235 VanDerWaalsContact O-CG2 3.29Å; N231-V235 WeakPolarHBondContact O-CG2 3.48Å; N231-V235 PolarHBondContact O-N 2.99Å; S232-V235 PolarHBondContact O-N 3.27Å; V235-S239 WeakPolarHBondContact O-CB 3.3Å; V235-S239 PolarHBondContact O-N 3.4Å; V235-S239 VanDerWaalsContact O-N 3.09Å; V235-V257 HydrophobicContact CG2-CG1 4.33Å; V235-V257 HydrophobicContact CG2-CG2 3.92Å
236L73Confident74.4Confident95 Ų9572.1 Ų72.150%0.49740%0.395SS..Hα-helixtrans-64.1-50.1172.4-173.765.9000112.4S232 S233 R234 F238 S239 I240S232-L236 PolarHBondContact O-N 3.43Å; S233-L236 WeakPolarHBondContact O-CB 3.39Å; S233-L236 PolarHBondContact O-N 2.99Å; R234-L236 PolarHBondContact O-N 3.34Å; R234-L236 VanDerWaalsContact O-N 3.16Å; L236-F238 VanDerWaalsContact C-N 3.33Å; L236-F238 PolarHBondContact O-N 3.25Å; L236-S239 WeakPolarHBondContact O-CB 3.3Å; L236-S239 PolarHBondContact O-N 3.35Å; L236-S239 VanDerWaalsContact O-N 3.08Å; L236-S239 PolarHBondContact O-OG 3.29Å; L236-I240 HydrophobicContact CG-CD1 4.32Å; L236-I240 WeakPolarHBondContact O-CG1 3.47Å; L236-I240 PolarHBondContact O-N 3.04Å
237S71.2Confident73.4Confident51 Ų5174.7 Ų74.736%0.35741%0.409SS..Hα-helixtrans-61.1-40.3179.871.60000112.8S233 R234 S239 I240 N241S233-S237 PolarHBondContact O-N 3.48Å; R234-S237 WeakPolarHBondContact CA-OG 3.49Å; R234-S237 PolarHBondContact O-N 3.47Å; R234-S237 PolarHBondContact O-OG 3Å; S237-S239 VanDerWaalsContact C-N 3.29Å; S237-S239 PolarHBondContact O-N 3.02Å; S237-I240 PolarHBondContact O-N 2.92Å; S237-N241 PolarHBondContact O-N 3.16Å
238F67.7Low72.5Confident31 Ų3180.5 Ų80.514%0.13644%0.436CS..Hα-helixtrans-67-29.3175.7-86.4-92000112.6R234 L236 I240 H245 R250 L253R234-F238 HydrophobicContact CB-CD2 4.36Å; R234-F238 WeakPolarHBondContact O-CB 3.42Å; R234-F238 VanDerWaalsContact O-CD2 3.23Å; R234-F238 WeakPolarHBondContact O-CD2 3.3Å; R234-F238 PolarHBondContact O-N 2.99Å; L236-F238 VanDerWaalsContact C-N 3.33Å; L236-F238 PolarHBondContact O-N 3.25Å; F238-I240 VanDerWaalsContact C-N 3.35Å; F238-H245 HydrophobicContact CD1-CB 3.93Å; F238-H245 AromaticContact CD1-CD2 3.36Å; F238-H245 WeakPolarHBondContact CD1-CD2 3.31Å; F238-H245 AromaticContact CD1-CG 3.51Å; F238-H245 AromaticContact CD1-NE2 3.84Å; F238-H245 HydrophobicContact CE1-CB 3.59Å; F238-H245 AromaticContact CE1-CD2 3.41Å; F238-H245 VanDerWaalsContact CE1-CD2 3.41Å; F238-H245 WeakPolarHBondContact CE1-CD2 3.44Å; F238-H245 AromaticContact CE1-CE1 3.59Å; F238-H245 AromaticContact CE1-CG 3.11Å; F238-H245 AromaticContact CE1-ND1 3.25Å; F238-H245 VanDerWaalsContact CE1-ND1 3.25Å; F238-H245 WeakPolarHBondContact CE1-ND1 3.48Å; F238-H245 AromaticContact CE1-NE2 3.7Å; F238-H245 AromaticContact CZ-CE1 3.57Å; F238-H245 AromaticContact CZ-CG 3.89Å; F238-H245 AromaticContact CZ-ND1 3.55Å; F238-H245 AromaticContact CZ-NE2 3.92Å; F238-R250 HydrophobicContact CD1-CG 4.31Å; F238-R250 HydrophobicContact CE1-CG 4.37Å; F238-L253 HydrophobicContact CB-CD2 4.35Å; F238-L253 HydrophobicContact CD1-CD2 4.14Å; F238-L253 HydrophobicContact CD2-CD2 3.29Å; F238-L253 HydrophobicContact CE1-CD2 4.21Å; F238-L253 HydrophobicContact CE2-CD1 4.25Å; F238-L253 HydrophobicContact CE2-CD2 3.43Å; F238-L253 VanDerWaalsContact CE2-CD2 3.43Å; F238-L253 HydrophobicContact CE2-CG 4.36Å; F238-L253 HydrophobicContact CG-CD2 3.68Å; F238-L253 HydrophobicContact CZ-CD2 3.89Å
239S65.9Low71.7Confident79 Ų7979.6 Ų79.655%0.55244%0.435SS*.Hα-helixtrans-71-32.1175.977.50000112.6V235 L236 S237V235-S239 WeakPolarHBondContact O-CB 3.3Å; V235-S239 PolarHBondContact O-N 3.4Å; V235-S239 VanDerWaalsContact O-N 3.09Å; L236-S239 WeakPolarHBondContact O-CB 3.3Å; L236-S239 PolarHBondContact O-N 3.35Å; L236-S239 VanDerWaalsContact O-N 3.08Å; L236-S239 PolarHBondContact O-OG 3.29Å; S237-S239 VanDerWaalsContact C-N 3.29Å; S237-S239 PolarHBondContact O-N 3.02Å
240I69.8Low70.7Confident122 Ų12277.1 Ų77.163%0.62642%0.422SS*.Hα-helixtrans-80.4-49.3179.6-62167.6000110L236 S237 F238 R242L236-I240 HydrophobicContact CG-CD1 4.32Å; L236-I240 WeakPolarHBondContact O-CG1 3.47Å; L236-I240 PolarHBondContact O-N 3.04Å; S237-I240 PolarHBondContact O-N 2.92Å; F238-I240 VanDerWaalsContact C-N 3.35Å; I240-R242 PolarHBondContact O-N 3.4Å
241N64.3Low70Confident90 Ų9079.7 Ų79.748%0.48143%0.431SS..  trans-10356.7-174.3-71.4-16.8000112.1S237 A243 T244S237-N241 PolarHBondContact O-N 3.16Å; N241-A243 PolarHBondContact O-N 3.4Å; N241-T244 PolarHBondContact O-N 3.45Å; N241-T244 PolarHBondContact O-OG1 3.05Å; N241-T244 VanDerWaalsContact O-OG1 3.07Å
242R60.5Low69.4Low180 Ų18081.2 Ų81.268%0.67944%0.438SS*.G310 helixtrans-57.9-39.4-177.6-157.1172.6-173.8-175.81111I240 T244 R250I240-R242 PolarHBondContact O-N 3.4Å; R242-T244 VanDerWaalsContact C-N 3.3Å; R242-T244 PolarHBondContact O-N 3.38Å; R242-R250 PolarHBondContact O-NH2 3.42Å
243A58Low69.1Low105 Ų10580 Ų8087%0.86843%0.427SS*.G310 helixtrans-65-21.8-172.800000115.8N241N241-A243 PolarHBondContact O-N 3.4Å
244T65.4Low68.7Low99 Ų9980.3 Ų80.361%0.60742%0.417SS*.G310 helixtrans-90.3-11.4-170.154.90000114.8N241 R242N241-T244 PolarHBondContact O-N 3.45Å; N241-T244 PolarHBondContact O-OG1 3.05Å; N241-T244 VanDerWaalsContact O-OG1 3.07Å; R242-T244 VanDerWaalsContact C-N 3.3Å; R242-T244 PolarHBondContact O-N 3.38Å
245H62.6Low68.6Low48 Ų4879.4 Ų79.422%0.22242%0.415CS..SBendtrans-108.2134.3-170.2-71.5-70.3000113.2F238 E249 R250F238-H245 HydrophobicContact CD1-CB 3.93Å; F238-H245 AromaticContact CD1-CD2 3.36Å; F238-H245 WeakPolarHBondContact CD1-CD2 3.31Å; F238-H245 AromaticContact CD1-CG 3.51Å; F238-H245 AromaticContact CD1-NE2 3.84Å; F238-H245 HydrophobicContact CE1-CB 3.59Å; F238-H245 AromaticContact CE1-CD2 3.41Å; F238-H245 VanDerWaalsContact CE1-CD2 3.41Å; F238-H245 WeakPolarHBondContact CE1-CD2 3.44Å; F238-H245 AromaticContact CE1-CE1 3.59Å; F238-H245 AromaticContact CE1-CG 3.11Å; F238-H245 AromaticContact CE1-ND1 3.25Å; F238-H245 VanDerWaalsContact CE1-ND1 3.25Å; F238-H245 WeakPolarHBondContact CE1-ND1 3.48Å; F238-H245 AromaticContact CE1-NE2 3.7Å; F238-H245 AromaticContact CZ-CE1 3.57Å; F238-H245 AromaticContact CZ-CG 3.89Å; F238-H245 AromaticContact CZ-ND1 3.55Å; F238-H245 AromaticContact CZ-NE2 3.92Å; H245-E249 IonicContact CE1-OE2 3.99Å; H245-E249 IonicContact CG-OE2 3.75Å; H245-E249 IonicContact ND1-OE2 2.92Å; H245-E249 PolarHBondContact ND1-OE2 2.93Å; H245-R250 HydrophobicContact CB-CG 4.25Å; H245-R250 PolarHBondContact O-NE 2.84Å; H245-R250 PolarHBondContact O-NH2 3.4Å
246S73Confident68.7Low51 Ų5177.3 Ų77.336%0.35740%0.402SS..  trans-61.9152.1174.271.10000111.4Q248 E249 R250S246-Q248 PolarHBondContact O-N 2.89Å; S246-E249 PolarHBondContact O-N 2.93Å; S246-E249 WeakPolarHBondContact OG-CB 3.43Å; S246-E249 VanDerWaalsContact OG-CG 3.25Å; S246-E249 WeakPolarHBondContact OG-CG 3.49Å; S246-E249 PolarHBondContact OG-N 3.27Å; S246-E249 PolarHBondContact OG-OE1 3.26Å; S246-R250 WeakPolarHBondContact O-CG 3.41Å; S246-R250 PolarHBondContact O-N 2.93Å
247L69.3Low68.9Low120 Ų12073.8 Ų73.863%0.62839%0.385SS*.Hα-helixtrans-59.9-37.8177.2-78.2168.4000111.6R250 F251L247-R250 PolarHBondContact O-N 2.95Å; L247-F251 WeakPolarHBondContact O-CD2 3.46Å; L247-F251 PolarHBondContact O-N 3.41Å
248Q70.2Confident69.2Low121 Ų12172.2 Ų72.257%0.56537%0.374SS*.Hα-helixtrans-61.7-48178.7-177.6173.7-10.100112S246 R250 F251 Q252S246-Q248 PolarHBondContact O-N 2.89Å; Q248-R250 VanDerWaalsContact C-N 3.27Å; Q248-R250 PolarHBondContact O-N 3.15Å; Q248-F251 PolarHBondContact O-N 2.8Å; Q248-F251 VanDerWaalsContact O-N 3.13Å; Q248-Q252 PolarHBondContact O-N 2.95Å
249E67.5Low69.7Low71 Ų7171.2 Ų71.233%0.33237%0.37SS..Hα-helixtrans-56.9-42.1175.3-79.2159.6-129.700111.7H245 S246 F251 Q252 L253H245-E249 IonicContact CE1-OE2 3.99Å; H245-E249 IonicContact CG-OE2 3.75Å; H245-E249 IonicContact ND1-OE2 2.92Å; H245-E249 PolarHBondContact ND1-OE2 2.93Å; S246-E249 PolarHBondContact O-N 2.93Å; S246-E249 WeakPolarHBondContact OG-CB 3.43Å; S246-E249 VanDerWaalsContact OG-CG 3.25Å; S246-E249 WeakPolarHBondContact OG-CG 3.49Å; S246-E249 PolarHBondContact OG-N 3.27Å; S246-E249 PolarHBondContact OG-OE1 3.26Å; E249-F251 PolarHBondContact O-N 3.3Å; E249-Q252 PolarHBondContact O-N 3.43Å; E249-L253 VanDerWaalsContact O-CB 3.3Å; E249-L253 WeakPolarHBondContact O-CB 3.31Å; E249-L253 PolarHBondContact O-N 2.95Å
250R67.5Low70.4Confident74 Ų7467.5 Ų67.528%0.27934%0.344SS..Hα-helixtrans-64.8-40.1178.3-65.4-176.8-165.3163.39.6111.9F238 R242 H245 S246 L247 Q248 R254F238-R250 HydrophobicContact CD1-CG 4.31Å; F238-R250 HydrophobicContact CE1-CG 4.37Å; R242-R250 PolarHBondContact O-NH2 3.42Å; H245-R250 HydrophobicContact CB-CG 4.25Å; H245-R250 PolarHBondContact O-NE 2.84Å; H245-R250 PolarHBondContact O-NH2 3.4Å; S246-R250 WeakPolarHBondContact O-CG 3.41Å; S246-R250 PolarHBondContact O-N 2.93Å; L247-R250 PolarHBondContact O-N 2.95Å; Q248-R250 VanDerWaalsContact C-N 3.27Å; Q248-R250 PolarHBondContact O-N 3.15Å; R250-R254 VanDerWaalsContact O-CB 3.3Å; R250-R254 WeakPolarHBondContact O-CB 3.22Å; R250-R254 PolarHBondContact O-N 3.45Å
251F70.2Confident70.9Confident115 Ų11564.7 Ų64.750%0.50433%0.329SS..Hα-helixtrans-66.8-44.1176-80.5-64.5000111.9L247 Q248 E249 R254 N255 V364L247-F251 WeakPolarHBondContact O-CD2 3.46Å; L247-F251 PolarHBondContact O-N 3.41Å; Q248-F251 PolarHBondContact O-N 2.8Å; Q248-F251 VanDerWaalsContact O-N 3.13Å; E249-F251 PolarHBondContact O-N 3.3Å; F251-R254 PolarHBondContact O-N 3.48Å; F251-N255 WeakPolarHBondContact O-CB 3.41Å; F251-N255 PolarHBondContact O-N 2.92Å; F251-V364 HydrophobicContact CE1-CG2 4.39Å
252Q71Confident71.6Confident36 Ų3660.6 Ų60.617%0.16831%0.308CS..Hα-helixtrans-63.2-45.2177.1-74.2-178.5-15.200111.4D156 Q248 E249 N255 N256D156-Q252 PolarHBondContact OD2-NE2 2.94Å; Q248-Q252 PolarHBondContact O-N 2.95Å; E249-Q252 PolarHBondContact O-N 3.43Å; Q252-N255 PolarHBondContact O-N 2.96Å; Q252-N256 WeakPolarHBondContact O-CB 3.44Å; Q252-N256 PolarHBondContact O-N 3.3Å
253L73.1Confident72.6Confident23 Ų2352.3 Ų52.312%0.1228%0.277CS..Hα-helixtrans-60.9-48.6175.8-174.377.8000111.3R234 F238 E249 N255 N256 V257R234-L253 HydrophobicContact CB-CD1 4.29Å; F238-L253 HydrophobicContact CB-CD2 4.35Å; F238-L253 HydrophobicContact CD1-CD2 4.14Å; F238-L253 HydrophobicContact CD2-CD2 3.29Å; F238-L253 HydrophobicContact CE1-CD2 4.21Å; F238-L253 HydrophobicContact CE2-CD1 4.25Å; F238-L253 HydrophobicContact CE2-CD2 3.43Å; F238-L253 VanDerWaalsContact CE2-CD2 3.43Å; F238-L253 HydrophobicContact CE2-CG 4.36Å; F238-L253 HydrophobicContact CG-CD2 3.68Å; F238-L253 HydrophobicContact CZ-CD2 3.89Å; E249-L253 VanDerWaalsContact O-CB 3.3Å; E249-L253 WeakPolarHBondContact O-CB 3.31Å; E249-L253 PolarHBondContact O-N 2.95Å; L253-N255 VanDerWaalsContact C-N 3.27Å; L253-N255 PolarHBondContact O-N 2.71Å; L253-N256 PolarHBondContact O-N 3.37Å; L253-V257 HydrophobicContact CD1-CG2 4.5Å; L253-V257 HydrophobicContact CG-CG2 4.3Å; L253-V257 WeakPolarHBondContact O-CB 3.49Å; L253-V257 VanDerWaalsContact O-CG2 3.26Å; L253-V257 WeakPolarHBondContact O-CG2 3.29Å; L253-V257 PolarHBondContact O-N 3.46Å
254R73.4Confident73.8Confident83 Ų8348.9 Ų48.931%0.31324%0.244SC..Hα-helixtrans-59.3-40.9178-177.4-179.8-107.7-172.6-4.7111.1R250 F251 S258 Q374R250-R254 VanDerWaalsContact O-CB 3.3Å; R250-R254 WeakPolarHBondContact O-CB 3.22Å; R250-R254 PolarHBondContact O-N 3.45Å; F251-R254 PolarHBondContact O-N 3.48Å; R254-S258 VanDerWaalsContact O-CB 3.24Å; R254-S258 WeakPolarHBondContact O-CB 3.42Å; R254-S258 PolarHBondContact O-N 2.65Å; R254-Q374 VanDerWaalsContact NH2-OE1 3.08Å
255N74.2Confident74.6Confident23 Ų2345.9 Ų45.912%0.12323%0.226CC..Hα-helixtrans-64.2-46.9176.7-162.351.9000111.5L72 F251 Q252 L253 V257 S258 I259 K326L72-N255 PolarHBondContact O-ND2 3.01Å; F251-N255 WeakPolarHBondContact O-CB 3.41Å; F251-N255 PolarHBondContact O-N 2.92Å; Q252-N255 PolarHBondContact O-N 2.96Å; L253-N255 VanDerWaalsContact C-N 3.27Å; L253-N255 PolarHBondContact O-N 2.71Å; N255-V257 PolarHBondContact O-N 3.38Å; N255-S258 PolarHBondContact O-N 2.88Å; N255-I259 WeakPolarHBondContact O-CB 3.45Å; N255-I259 VanDerWaalsContact O-CG1 3.23Å; N255-I259 WeakPolarHBondContact O-CG1 3.3Å; N255-I259 PolarHBondContact O-N 3.14Å; N255-K326 PolarHBondContact OD1-NZ 2.87Å
256N75.5Confident75.6Confident6 Ų644 Ų443%0.03222%0.219CC..Hα-helixtrans-63.4-43.1179.6-170.731.3000112.1R145 T149 Y154 Q252 L253 T260R145-N256 PolarHBondContact NH1-OD1 2.91Å; T149-N256 PolarHBondContact OG1-ND2 3.35Å; T149-N256 VanDerWaalsContact OG1-ND2 3.14Å; Y154-N256 HydrophobicContact CE2-CB 4.24Å; Y154-N256 PolarHBondContact OH-OD1 3.33Å; Y154-N256 VanDerWaalsContact OH-OD1 3.12Å; Q252-N256 WeakPolarHBondContact O-CB 3.44Å; Q252-N256 PolarHBondContact O-N 3.3Å; L253-N256 PolarHBondContact O-N 3.37Å; N256-T260 VanDerWaalsContact O-CB 3.27Å; N256-T260 WeakPolarHBondContact O-CB 3.41Å; N256-T260 PolarHBondContact O-N 2.64Å; N256-T260 PolarHBondContact O-OG1 2.96Å
257V77.2Confident76.1Confident22 Ų2241.8 Ų41.813%0.13320%0.203CC..Hα-helixtrans-64.2-47.2176.7173.50000110.9N231 V235 L253 N255 I259 T260 I261N231-V257 HydrophobicContact CB-CG2 4.06Å; V235-V257 HydrophobicContact CG2-CG1 4.33Å; V235-V257 HydrophobicContact CG2-CG2 3.92Å; L253-V257 HydrophobicContact CD1-CG2 4.5Å; L253-V257 HydrophobicContact CG-CG2 4.3Å; L253-V257 WeakPolarHBondContact O-CB 3.49Å; L253-V257 VanDerWaalsContact O-CG2 3.26Å; L253-V257 WeakPolarHBondContact O-CG2 3.29Å; L253-V257 PolarHBondContact O-N 3.46Å; N255-V257 PolarHBondContact O-N 3.38Å; V257-I259 PolarHBondContact O-N 2.71Å; V257-T260 PolarHBondContact O-N 3.4Å; V257-I261 HydrophobicContact CG1-CD1 3.58Å; V257-I261 HydrophobicContact CG1-CG1 4.33Å; V257-I261 WeakPolarHBondContact O-CB 3.21Å; V257-I261 VanDerWaalsContact O-CG1 3.3Å; V257-I261 WeakPolarHBondContact O-CG1 3.41Å; V257-I261 PolarHBondContact O-N 3.22Å
258S77.7Confident76.9Confident17 Ų1739 Ų3912%0.11919%0.188CC..Hα-helixtrans-60.1-47.6179-179.80000111.4R254 N255 T260 I261 A262 E370R254-S258 VanDerWaalsContact O-CB 3.24Å; R254-S258 WeakPolarHBondContact O-CB 3.42Å; R254-S258 PolarHBondContact O-N 2.65Å; N255-S258 PolarHBondContact O-N 2.88Å; S258-T260 PolarHBondContact O-N 3.19Å; S258-I261 PolarHBondContact O-N 3.48Å; S258-A262 WeakPolarHBondContact O-CB 3.14Å; S258-A262 PolarHBondContact O-N 3.02Å; S258-E370 PolarHBondContact OG-OE1 3.13Å
259I77.5Confident77.7Confident10 Ų1035.5 Ų35.55%0.05118%0.177CC..Hα-helixtrans-62.5-44176.6-67.3169.2000111.2L73 N255 V257 A262 L263L73-I259 HydrophobicContact CD2-CD1 4.13Å; L73-I259 HydrophobicContact CD2-CG2 4.06Å; L73-I259 HydrophobicContact CG-CD1 4.48Å; N255-I259 WeakPolarHBondContact O-CB 3.45Å; N255-I259 VanDerWaalsContact O-CG1 3.23Å; N255-I259 WeakPolarHBondContact O-CG1 3.3Å; N255-I259 PolarHBondContact O-N 3.14Å; V257-I259 PolarHBondContact O-N 2.71Å; I259-A262 PolarHBondContact O-N 3.42Å; I259-L263 HydrophobicContact CG2-CD1 3.78Å; I259-L263 HydrophobicContact CG2-CG 4.4Å; I259-L263 WeakPolarHBondContact O-CB 3.41Å; I259-L263 WeakPolarHBondContact O-CG 3.46Å; I259-L263 PolarHBondContact O-N 2.87Å
260T80.5Confident78.6Confident2 Ų232.3 Ų32.31%0.01216%0.163CC..Hα-helixtrans-62.7-45.1179.1-58.80000111.4T227 N256 V257 S258 A262 L263 L264T227-T260 HydrophobicContact CG2-CG2 3.89Å; N256-T260 VanDerWaalsContact O-CB 3.27Å; N256-T260 WeakPolarHBondContact O-CB 3.41Å; N256-T260 PolarHBondContact O-N 2.64Å; N256-T260 PolarHBondContact O-OG1 2.96Å; V257-T260 PolarHBondContact O-N 3.4Å; S258-T260 PolarHBondContact O-N 3.19Å; T260-A262 VanDerWaalsContact C-N 3.28Å; T260-A262 PolarHBondContact O-N 2.88Å; T260-L263 PolarHBondContact O-N 3.46Å; T260-L264 WeakPolarHBondContact O-CB 3.47Å; T260-L264 PolarHBondContact O-N 2.99Å
261I81Confident79.4Confident63 Ų6329.1 Ų29.132%0.32315%0.151SC..Hα-helixtrans-67-31.4177.8-69171.7000111.6V257 S258 P265 R323V257-I261 HydrophobicContact CG1-CD1 3.58Å; V257-I261 HydrophobicContact CG1-CG1 4.33Å; V257-I261 WeakPolarHBondContact O-CB 3.21Å; V257-I261 VanDerWaalsContact O-CG1 3.3Å; V257-I261 WeakPolarHBondContact O-CG1 3.41Å; V257-I261 PolarHBondContact O-N 3.22Å; S258-I261 PolarHBondContact O-N 3.48Å; I261-P265 VanDerWaalsContact O-CD 3.29Å; I261-P265 WeakPolarHBondContact O-CD 3.49Å; I261-R323 PolarHBondContact O-NH1 2.7Å
262A78Confident80.3Confident4 Ų428.2 Ų28.23%0.03315%0.151CC..Hα-helixtrans-70-39.1174.500000112.2S258 I259 T260 P265 L320 R323S258-A262 WeakPolarHBondContact O-CB 3.14Å; S258-A262 PolarHBondContact O-N 3.02Å; I259-A262 PolarHBondContact O-N 3.42Å; T260-A262 VanDerWaalsContact C-N 3.28Å; T260-A262 PolarHBondContact O-N 2.88Å; A262-P265 WeakPolarHBondContact O-CD 3.39Å; A262-L320 HydrophobicContact CB-CD2 4.3Å; A262-R323 HydrophobicContact CB-CB 3.78Å
263L81.7Confident81.1Confident6 Ų626.6 Ų26.63%0.03114%0.144CC..Hα-helixtrans-77.8-33.8-179.7-72.7169.3000113.6L81 L141 Y224 I259 T260 C266 V267 L320L81-L263 HydrophobicContact CD1-CD2 4Å; L141-L263 HydrophobicContact CD2-CD1 4.07Å; L141-L263 HydrophobicContact CD2-CD2 4.27Å; L141-L263 HydrophobicContact CG-CD1 4.44Å; Y224-L263 HydrophobicContact CE1-CB 4.43Å; I259-L263 HydrophobicContact CG2-CD1 3.78Å; I259-L263 HydrophobicContact CG2-CG 4.4Å; I259-L263 WeakPolarHBondContact O-CB 3.41Å; I259-L263 WeakPolarHBondContact O-CG 3.46Å; I259-L263 PolarHBondContact O-N 2.87Å; T260-L263 PolarHBondContact O-N 3.46Å; L263-C266 WeakPolarHBondContact O-CB 3.35Å; L263-C266 PolarHBondContact O-N 2.89Å; L263-V267 PolarHBondContact O-N 2.66Å; L263-L320 HydrophobicContact CD2-CD2 3.99Å
264L83.8Confident81.7Confident32 Ų3226 Ų2617%0.16814%0.14CC..Hα-helixtrans-47.3-51.6-175.2-172.167.4000114.6Y224 Y228 T260 C266 V267 L268Y224-L264 HydrophobicContact CD1-CD1 4.09Å; Y224-L264 HydrophobicContact CG-CD1 4.48Å; Y228-L264 HydrophobicContact CD2-CD2 4.08Å; T260-L264 WeakPolarHBondContact O-CB 3.47Å; T260-L264 PolarHBondContact O-N 2.99Å; L264-C266 VanDerWaalsContact C-N 3.31Å; L264-C266 PolarHBondContact O-N 3.44Å; L264-V267 PolarHBondContact O-N 3.35Å; L264-L268 HydrophobicContact CD1-CD1 4.06Å; L264-L268 HydrophobicContact CD1-CG 4.13Å; L264-L268 HydrophobicContact CD2-CD1 4.49Å; L264-L268 HydrophobicContact CG-CD1 3.86Å; L264-L268 HydrophobicContact CG-CG 4.3Å; L264-L268 WeakPolarHBondContact O-CB 3.35Å; L264-L268 WeakPolarHBondContact O-CG 3.5Å; L264-L268 PolarHBondContact O-N 2.99Å
265P82.4Confident82.4Confident36 Ų3624.8 Ų24.823%0.23414%0.139CC..Hα-helixtrans-61.8-37.9179.125.1-36.5000112.9I261 A262 S269 V319I261-P265 VanDerWaalsContact O-CD 3.29Å; I261-P265 WeakPolarHBondContact O-CD 3.49Å; A262-P265 WeakPolarHBondContact O-CD 3.39Å; P265-S269 VanDerWaalsContact O-CB 3.27Å; P265-S269 WeakPolarHBondContact O-CB 3.27Å; P265-S269 PolarHBondContact O-N 3.43Å; P265-V319 HydrophobicContact CB-CG1 4.36Å; P265-V319 HydrophobicContact CG-CG1 3.65Å
266C83.3Confident83.1Confident10 Ų1027.7 Ų27.77%0.06815%0.154CC..Hα-helixtrans-66.1-42.1179.2-56.60000110.8L263 L264 N270 Q316L263-C266 WeakPolarHBondContact O-CB 3.35Å; L263-C266 PolarHBondContact O-N 2.89Å; L264-C266 VanDerWaalsContact C-N 3.31Å; L264-C266 PolarHBondContact O-N 3.44Å; C266-N270 WeakPolarHBondContact O-CB 3.26Å; C266-N270 PolarHBondContact O-N 2.94Å; C266-N270 PolarHBondContact O-ND2 3.27Å; C266-Q316 HydrophobicContact CB-CG 4.21Å
267V84Confident83.5Confident3 Ų327.7 Ų27.72%0.01815%0.154CC..Hα-helixtrans-70.5-44.9179.9176.50000111.3I138 T220 Y224 L263 L264 S269 N270 S271I138-V267 HydrophobicContact CG2-CB 4.46Å; I138-V267 HydrophobicContact CG2-CG1 3.85Å; I138-V267 HydrophobicContact CG2-CG2 3.98Å; T220-V267 HydrophobicContact CG2-CG1 3.46Å; T220-V267 VanDerWaalsContact CG2-CG1 3.46Å; Y224-V267 HydrophobicContact CD1-CB 4.48Å; Y224-V267 HydrophobicContact CD1-CG1 4.47Å; Y224-V267 HydrophobicContact CD2-CB 4.49Å; Y224-V267 HydrophobicContact CD2-CG1 3.69Å; Y224-V267 HydrophobicContact CE1-CB 4.31Å; Y224-V267 HydrophobicContact CE1-CG1 4.48Å; Y224-V267 HydrophobicContact CE1-CG2 3.89Å; Y224-V267 HydrophobicContact CE2-CB 4.31Å; Y224-V267 HydrophobicContact CE2-CG1 3.68Å; Y224-V267 HydrophobicContact CE2-CG2 4.03Å; Y224-V267 HydrophobicContact CG-CG1 4.09Å; L263-V267 PolarHBondContact O-N 2.66Å; L264-V267 PolarHBondContact O-N 3.35Å; V267-S269 VanDerWaalsContact C-N 3.35Å; V267-S269 PolarHBondContact O-N 3.04Å; V267-N270 PolarHBondContact O-N 3.16Å; V267-S271 WeakPolarHBondContact O-CB 3.27Å; V267-S271 PolarHBondContact O-N 3.02Å; V267-S271 PolarHBondContact O-OG 3.19Å
268L85.2Confident83.9Confident61 Ų6126.7 Ų26.732%0.31915%0.148SC..Hα-helixtrans-61.2-44.1176.4-69.7176.4000111.4V221 L264 N270 S271 I272V221-L268 HydrophobicContact CG1-CD2 4.25Å; V221-L268 HydrophobicContact CG2-CD2 4.33Å; L264-L268 HydrophobicContact CD1-CD1 4.06Å; L264-L268 HydrophobicContact CD1-CG 4.13Å; L264-L268 HydrophobicContact CD2-CD1 4.49Å; L264-L268 HydrophobicContact CG-CD1 3.86Å; L264-L268 HydrophobicContact CG-CG 4.3Å; L264-L268 WeakPolarHBondContact O-CB 3.35Å; L264-L268 WeakPolarHBondContact O-CG 3.5Å; L264-L268 PolarHBondContact O-N 2.99Å; L268-N270 VanDerWaalsContact C-N 3.35Å; L268-N270 PolarHBondContact O-N 2.89Å; L268-S271 PolarHBondContact O-N 2.93Å; L268-I272 WeakPolarHBondContact O-CB 3.33Å; L268-I272 WeakPolarHBondContact O-CD1 3.49Å; L268-I272 WeakPolarHBondContact O-CG1 3.46Å; L268-I272 PolarHBondContact O-N 3.38Å
269S86.5Confident84.2Confident48 Ų4826.8 Ų26.834%0.33615%0.151SC..Hα-helixtrans-59.4-47.2176.6-158.70000111.2P265 V267 I272 T273 N312P265-S269 VanDerWaalsContact O-CB 3.27Å; P265-S269 WeakPolarHBondContact O-CB 3.27Å; P265-S269 PolarHBondContact O-N 3.43Å; V267-S269 VanDerWaalsContact C-N 3.35Å; V267-S269 PolarHBondContact O-N 3.04Å; S269-I272 PolarHBondContact O-N 3.11Å; S269-T273 WeakPolarHBondContact O-CB 3.29Å; S269-T273 PolarHBondContact O-N 3.22Å; S269-T273 PolarHBondContact O-OG1 3.46Å; S269-N312 PolarHBondContact O-ND2 2.94Å; S269-N312 PolarHBondContact OG-OD1 3Å
270N86.2Confident84.4Confident5 Ų527.1 Ų27.13%0.02715%0.154CC..Hα-helixtrans-61.7-52176.1-75.8-39000111.6F134 C266 V267 L268 I272 T273 F274 N312F134-N270 HydrophobicContact CE1-CB 4.34Å; F134-N270 HydrophobicContact CZ-CB 4.37Å; C266-N270 WeakPolarHBondContact O-CB 3.26Å; C266-N270 PolarHBondContact O-N 2.94Å; C266-N270 PolarHBondContact O-ND2 3.27Å; V267-N270 PolarHBondContact O-N 3.16Å; L268-N270 VanDerWaalsContact C-N 3.35Å; L268-N270 PolarHBondContact O-N 2.89Å; N270-I272 VanDerWaalsContact C-N 3.28Å; N270-I272 PolarHBondContact O-N 2.86Å; N270-T273 PolarHBondContact O-N 3.21Å; N270-T273 VanDerWaalsContact O-N 3.09Å; N270-F274 VanDerWaalsContact O-CD2 3.22Å; N270-F274 WeakPolarHBondContact O-CD2 3.39Å; N270-F274 PolarHBondContact O-N 3.43Å; N270-N312 VanDerWaalsContact OD1-CB 3.29Å; N270-N312 WeakPolarHBondContact OD1-CB 3.35Å; N270-N312 PolarHBondContact OD1-ND2 2.68Å
271S86.2Confident84.3Confident6 Ų627.3 Ų27.34%0.04216%0.155CC..Hα-helixtrans-57.3-40.1179.5-65.60000112.6V221 V267 L268 F274 L275V221-S271 VanDerWaalsContact CG2-CB 3.46Å; V267-S271 WeakPolarHBondContact O-CB 3.27Å; V267-S271 PolarHBondContact O-N 3.02Å; V267-S271 PolarHBondContact O-OG 3.19Å; L268-S271 PolarHBondContact O-N 2.93Å; S271-F274 PolarHBondContact O-N 3.36Å; S271-L275 WeakPolarHBondContact O-CB 3.46Å; S271-L275 VanDerWaalsContact O-CG 3.27Å; S271-L275 WeakPolarHBondContact O-CG 3.35Å; S271-L275 PolarHBondContact O-N 3.07Å
272I88.2Confident84.1Confident96 Ų9626.4 Ų26.449%0.49215%0.153SC..Hα-helixtrans-64.4-48.2174.9-68.5164.8000110.4L268 S269 N270 F274 L275 L276L268-I272 WeakPolarHBondContact O-CB 3.33Å; L268-I272 WeakPolarHBondContact O-CD1 3.49Å; L268-I272 WeakPolarHBondContact O-CG1 3.46Å; L268-I272 PolarHBondContact O-N 3.38Å; S269-I272 PolarHBondContact O-N 3.11Å; N270-I272 VanDerWaalsContact C-N 3.28Å; N270-I272 PolarHBondContact O-N 2.86Å; I272-F274 VanDerWaalsContact C-N 3.32Å; I272-F274 PolarHBondContact O-N 2.99Å; I272-L275 PolarHBondContact O-N 3.17Å; I272-L276 HydrophobicContact CG2-CD1 3.89Å; I272-L276 HydrophobicContact CG2-CG 4.31Å; I272-L276 WeakPolarHBondContact O-CB 3.33Å; I272-L276 VanDerWaalsContact O-CG 3.31Å; I272-L276 WeakPolarHBondContact O-CG 3.5Å; I272-L276 PolarHBondContact O-N 3.44Å
273T87.9Confident84.2Confident3 Ų330.2 Ų30.22%0.01817%0.171CC..Hα-helixtrans-60.4-40.9177.3-59.70000112S269 N270 L276 F277 L308 L309 N312S269-T273 WeakPolarHBondContact O-CB 3.29Å; S269-T273 PolarHBondContact O-N 3.22Å; S269-T273 PolarHBondContact O-OG1 3.46Å; N270-T273 PolarHBondContact O-N 3.21Å; N270-T273 VanDerWaalsContact O-N 3.09Å; T273-L276 PolarHBondContact O-N 2.95Å; T273-F277 WeakPolarHBondContact O-CB 3.27Å; T273-F277 PolarHBondContact O-N 3.47Å; T273-L308 HydrophobicContact CG2-CB 4.13Å; T273-L308 HydrophobicContact CG2-CD2 4.1Å; T273-L308 HydrophobicContact CG2-CG 4.05Å; T273-L309 HydrophobicContact CG2-CB 4.15Å; T273-L309 HydrophobicContact CG2-CD1 4.49Å; T273-N312 WeakPolarHBondContact CB-ND2 3.42Å; T273-N312 PolarHBondContact OG1-ND2 3.08Å
274F85.9Confident83.7Confident10 Ų1030.4 Ų30.44%0.04417%0.174CC..Hα-helixtrans-64.8-43.2175.8-89.3-100.1000111.9F131 F134 S135 A217 N270 S271 I272 F277 F278 L309F131-F274 AromaticContact CD1-CE1 3.73Å; F131-F274 HydrophobicContact CD1-CE1 3.73Å; F131-F274 AromaticContact CD1-CZ 3.81Å; F131-F274 HydrophobicContact CD1-CZ 3.81Å; F131-F274 HydrophobicContact CE1-CE1 4.3Å; F131-F274 HydrophobicContact CE1-CZ 4.2Å; F134-F274 HydrophobicContact CD1-CE1 4.48Å; F134-F274 AromaticContact CD1-CE2 3.65Å; F134-F274 HydrophobicContact CD1-CE2 3.65Å; F134-F274 AromaticContact CD1-CZ 3.46Å; F134-F274 HydrophobicContact CD1-CZ 3.46Å; F134-F274 VanDerWaalsContact CD1-CZ 3.46Å; F134-F274 HydrophobicContact CE1-CD2 4.43Å; F134-F274 AromaticContact CE1-CE2 3.44Å; F134-F274 HydrophobicContact CE1-CE2 3.44Å; F134-F274 VanDerWaalsContact CE1-CE2 3.44Å; F134-F274 AromaticContact CE1-CZ 3.79Å; F134-F274 HydrophobicContact CE1-CZ 3.79Å; S135-F274 WeakPolarHBondContact OG-CE1 3.33Å; A217-F274 HydrophobicContact CB-CB 4.31Å; N270-F274 VanDerWaalsContact O-CD2 3.22Å; N270-F274 WeakPolarHBondContact O-CD2 3.39Å; N270-F274 PolarHBondContact O-N 3.43Å; S271-F274 PolarHBondContact O-N 3.36Å; I272-F274 VanDerWaalsContact C-N 3.32Å; I272-F274 PolarHBondContact O-N 2.99Å; F274-F277 PolarHBondContact O-N 2.89Å; F274-F278 AromaticContact CD1-CD2 3.89Å; F274-F278 HydrophobicContact CD1-CD2 3.89Å; F274-F278 AromaticContact CD1-CE2 3.49Å; F274-F278 HydrophobicContact CD1-CE2 3.49Å; F274-F278 VanDerWaalsContact CD1-CE2 3.49Å; F274-F278 AromaticContact CE1-CE2 3.85Å; F274-F278 HydrophobicContact CE1-CE2 3.85Å; F274-F278 WeakPolarHBondContact O-CB 3.47Å; F274-F278 WeakPolarHBondContact O-CD2 3.37Å; F274-F278 PolarHBondContact O-N 2.87Å; F274-L309 HydrophobicContact CD2-CD1 4.09Å; F274-L309 HydrophobicContact CE2-CD1 3.43Å; F274-L309 VanDerWaalsContact CE2-CD1 3.43Å; F274-L309 HydrophobicContact CZ-CD1 4.05Å
275L87.7Confident83Confident58 Ų5829.1 Ų29.130%0.30417%0.168SC..Hα-helixtrans-63.9-42.6176-76.5169.8000112.1C214 A217 I218 S271 I272 G279C214-L275 HydrophobicContact CB-CD2 4.08Å; A217-L275 HydrophobicContact CB-CD2 4.1Å; A217-L275 HydrophobicContact CB-CG 3.9Å; I218-L275 HydrophobicContact CD1-CD2 4.47Å; I218-L275 HydrophobicContact CG1-CD2 4.07Å; S271-L275 WeakPolarHBondContact O-CB 3.46Å; S271-L275 VanDerWaalsContact O-CG 3.27Å; S271-L275 WeakPolarHBondContact O-CG 3.35Å; S271-L275 PolarHBondContact O-N 3.07Å; I272-L275 PolarHBondContact O-N 3.17Å; L275-G279 WeakPolarHBondContact O-CA 3.42Å; L275-G279 PolarHBondContact O-N 3.3Å
276L89.6Confident82.6Confident83 Ų8329.8 Ų29.844%0.43518%0.177SC..Hα-helixtrans-65.6-47.8175.5-68.6174.4000110.6I272 T273 T280 L305I272-L276 HydrophobicContact CG2-CD1 3.89Å; I272-L276 HydrophobicContact CG2-CG 4.31Å; I272-L276 WeakPolarHBondContact O-CB 3.33Å; I272-L276 VanDerWaalsContact O-CG 3.31Å; I272-L276 WeakPolarHBondContact O-CG 3.5Å; I272-L276 PolarHBondContact O-N 3.44Å; T273-L276 PolarHBondContact O-N 2.95Å; L276-T280 VanDerWaalsContact O-CB 3.31Å; L276-T280 WeakPolarHBondContact O-CB 3.41Å; L276-T280 WeakPolarHBondContact O-CG2 3.26Å; L276-T280 PolarHBondContact O-N 2.87Å; L276-T280 PolarHBondContact O-OG1 2.82Å; L276-L305 HydrophobicContact CB-CD1 4.01Å; L276-L305 HydrophobicContact CB-CD2 3.62Å; L276-L305 HydrophobicContact CB-CG 4.46Å; L276-L305 HydrophobicContact CD1-CD2 4.04Å; L276-L305 HydrophobicContact CG-CD2 4.47Å; L276-L305 WeakPolarHBondContact O-CD1 3.48Å
277F84.1Confident82Confident7 Ų733.9 Ų33.93%0.03119%0.194CC..Hα-helixtrans-62.5-56.1-178.3179-102.2000112.6F198 T273 F274 T280 L281 Y302 L305 L306F198-F277 HydrophobicContact CD2-CE1 4.04Å; F198-F277 AromaticContact CD2-CZ 3.94Å; F198-F277 HydrophobicContact CD2-CZ 3.94Å; F198-F277 AromaticContact CE2-CE1 3.73Å; F198-F277 HydrophobicContact CE2-CE1 3.73Å; F198-F277 AromaticContact CE2-CZ 3.94Å; F198-F277 HydrophobicContact CE2-CZ 3.94Å; T273-F277 WeakPolarHBondContact O-CB 3.27Å; T273-F277 PolarHBondContact O-N 3.47Å; F274-F277 PolarHBondContact O-N 2.89Å; F277-T280 PolarHBondContact O-OG1 3.32Å; F277-L281 WeakPolarHBondContact O-CB 3.44Å; F277-L281 PolarHBondContact O-N 2.93Å; F277-L281 VanDerWaalsContact O-N 3.13Å; F277-Y302 HydrophobicContact CD2-CD2 4.01Å; F277-Y302 AromaticContact CD2-CE2 3.99Å; F277-Y302 HydrophobicContact CD2-CE2 3.99Å; F277-Y302 HydrophobicContact CE1-CE2 4.24Å; F277-Y302 AromaticContact CE2-CD2 3.55Å; F277-Y302 HydrophobicContact CE2-CD2 3.55Å; F277-Y302 AromaticContact CE2-CE2 3.11Å; F277-Y302 HydrophobicContact CE2-CE2 3.11Å; F277-Y302 HydrophobicContact CE2-CG 4.46Å; F277-Y302 AromaticContact CE2-CZ 3.71Å; F277-Y302 HydrophobicContact CZ-CD2 4.13Å; F277-Y302 AromaticContact CZ-CE2 3.28Å; F277-Y302 HydrophobicContact CZ-CE2 3.28Å; F277-Y302 AromaticContact CZ-CZ 3.79Å; F277-L305 HydrophobicContact CB-CB 4.28Å; F277-L305 HydrophobicContact CD2-CB 4.05Å; F277-L306 HydrophobicContact CD2-CB 4.45Å; F277-L306 HydrophobicContact CE2-CB 3.94Å; F277-L306 HydrophobicContact CE2-CD1 3.89Å; F277-L306 HydrophobicContact CE2-CG 4.4Å; F277-L306 HydrophobicContact CZ-CD1 4.02Å
278F84.8Confident81.2Confident0 Ų034 Ų340%019%0.194CC..Hα-helixtrans-73.1-28.6178.9-71.7-69.2000112.8F198 C210 Y213 F274 L281 T282F198-F278 HydrophobicContact CE1-CE1 4.28Å; F198-F278 AromaticContact CE2-CE1 3.93Å; F198-F278 HydrophobicContact CE2-CE1 3.93Å; F198-F278 HydrophobicContact CE2-CZ 4.39Å; F198-F278 AromaticContact CZ-CE1 3.69Å; F198-F278 HydrophobicContact CZ-CE1 3.69Å; F198-F278 HydrophobicContact CZ-CZ 4.2Å; C210-F278 HydrophobicContact CB-CB 4.34Å; C210-F278 HydrophobicContact CB-CD1 4.19Å; Y213-F278 HydrophobicContact CD1-CE2 4.2Å; Y213-F278 HydrophobicContact CD1-CZ 4.3Å; Y213-F278 AromaticContact CD2-CD1 3.9Å; Y213-F278 HydrophobicContact CD2-CD1 3.9Å; Y213-F278 HydrophobicContact CD2-CD2 4.3Å; Y213-F278 AromaticContact CD2-CE1 3.36Å; Y213-F278 HydrophobicContact CD2-CE1 3.36Å; Y213-F278 AromaticContact CD2-CE2 3.82Å; Y213-F278 HydrophobicContact CD2-CE2 3.82Å; Y213-F278 HydrophobicContact CD2-CG 4.34Å; Y213-F278 AromaticContact CD2-CZ 3.31Å; Y213-F278 HydrophobicContact CD2-CZ 3.31Å; Y213-F278 AromaticContact CE2-CE1 3.87Å; Y213-F278 HydrophobicContact CE2-CE1 3.87Å; Y213-F278 HydrophobicContact CE2-CE2 4.49Å; Y213-F278 AromaticContact CE2-CZ 3.7Å; Y213-F278 HydrophobicContact CE2-CZ 3.7Å; Y213-F278 HydrophobicContact CG-CD1 4.4Å; Y213-F278 HydrophobicContact CG-CD2 4.03Å; Y213-F278 HydrophobicContact CG-CE1 4.05Å; Y213-F278 AromaticContact CG-CE2 3.65Å; Y213-F278 HydrophobicContact CG-CE2 3.65Å; Y213-F278 HydrophobicContact CG-CG 4.39Å; Y213-F278 AromaticContact CG-CZ 3.66Å; Y213-F278 HydrophobicContact CG-CZ 3.66Å; F274-F278 AromaticContact CD1-CD2 3.89Å; F274-F278 HydrophobicContact CD1-CD2 3.89Å; F274-F278 AromaticContact CD1-CE2 3.49Å; F274-F278 HydrophobicContact CD1-CE2 3.49Å; F274-F278 VanDerWaalsContact CD1-CE2 3.49Å; F274-F278 AromaticContact CE1-CE2 3.85Å; F274-F278 HydrophobicContact CE1-CE2 3.85Å; F274-F278 WeakPolarHBondContact O-CB 3.47Å; F274-F278 WeakPolarHBondContact O-CD2 3.37Å; F274-F278 PolarHBondContact O-N 2.87Å; F278-L281 HydrophobicContact CD1-CD2 4.15Å; F278-T282 WeakPolarHBondContact O-CB 3.32Å; F278-T282 PolarHBondContact O-N 2.86Å; F278-T282 PolarHBondContact O-OG1 3.03Å
279G83.2Confident80.3Confident19 Ų1934.5 Ų34.520%0.19620%0.2CC..Hα-helixtrans-65.8-51.8173.700000112.3L275 L281 T282 I283L275-G279 WeakPolarHBondContact O-CA 3.42Å; L275-G279 PolarHBondContact O-N 3.3Å; G279-L281 VanDerWaalsContact C-N 3.28Å; G279-L281 PolarHBondContact O-N 3.09Å; G279-T282 WeakPolarHBondContact O-CB 3.47Å; G279-T282 PolarHBondContact O-N 3.49Å; G279-I283 WeakPolarHBondContact O-CB 3.35Å; G279-I283 VanDerWaalsContact O-CG1 3.23Å; G279-I283 WeakPolarHBondContact O-CG1 3.45Å; G279-I283 PolarHBondContact O-N 3.43Å
280T82Confident79.5Confident18 Ų1841.8 Ų41.811%0.1122%0.22CC..Hα-helixtrans-59.1-40.3175.150.80000111.8L276 F277 I283 A284 L298 L305L276-T280 VanDerWaalsContact O-CB 3.31Å; L276-T280 WeakPolarHBondContact O-CB 3.41Å; L276-T280 WeakPolarHBondContact O-CG2 3.26Å; L276-T280 PolarHBondContact O-N 2.87Å; L276-T280 PolarHBondContact O-OG1 2.82Å; F277-T280 PolarHBondContact O-OG1 3.32Å; T280-I283 PolarHBondContact O-N 2.87Å; T280-A284 VanDerWaalsContact O-CB 3.27Å; T280-A284 WeakPolarHBondContact O-CB 3.4Å; T280-A284 PolarHBondContact O-N 3.33Å; T280-L298 HydrophobicContact CG2-CD1 4.39Å; T280-L305 HydrophobicContact CG2-CD1 3.51Å; T280-L305 WeakPolarHBondContact OG1-CD1 3.32Å
281L78.2Confident78.5Confident6 Ų646.7 Ų46.73%0.03124%0.242CC..Hα-helixtrans-63.9-41.5175.8179.963.2000112.9F198 L206 C210 F277 F278 G279 A284 G285 Y302F198-L281 HydrophobicContact CB-CD1 3.4Å; F198-L281 VanDerWaalsContact CB-CD1 3.4Å; F198-L281 HydrophobicContact CB-CD2 3.23Å; F198-L281 HydrophobicContact CB-CG 3.87Å; F198-L281 HydrophobicContact CD1-CD2 3.94Å; F198-L281 HydrophobicContact CD2-CD2 3.66Å; F198-L281 HydrophobicContact CE2-CD2 4.47Å; F198-L281 HydrophobicContact CG-CD1 4.44Å; F198-L281 HydrophobicContact CG-CD2 3.34Å; F198-L281 HydrophobicContact CG-CG 4.47Å; L206-L281 HydrophobicContact CD1-CD2 4.29Å; C210-L281 WeakPolarHBondContact SG-CD2 3.28Å; F277-L281 WeakPolarHBondContact O-CB 3.44Å; F277-L281 PolarHBondContact O-N 2.93Å; F277-L281 VanDerWaalsContact O-N 3.13Å; F278-L281 HydrophobicContact CD1-CD2 4.15Å; G279-L281 VanDerWaalsContact C-N 3.28Å; G279-L281 PolarHBondContact O-N 3.09Å; L281-A284 PolarHBondContact O-N 3.41Å; L281-G285 PolarHBondContact O-N 3.24Å; L281-Y302 HydrophobicContact CB-CD2 4.36Å; L281-Y302 HydrophobicContact CD1-CD2 4.29Å; L281-Y302 HydrophobicContact CD1-CE2 4.13Å; L281-Y302 HydrophobicContact CD2-CE2 4.46Å
282T77.9Confident77.4Confident44 Ų4452.5 Ų52.527%0.2727%0.269SS..Hα-helixtrans-64-42.8175-57.90000111Y207 C210 F278 G279 G285 A286Y207-T282 HydrophobicContact CD1-CG2 4Å; Y207-T282 HydrophobicContact CE1-CG2 4.14Å; C210-T282 WeakPolarHBondContact CB-OG1 3.11Å; F278-T282 WeakPolarHBondContact O-CB 3.32Å; F278-T282 PolarHBondContact O-N 2.86Å; F278-T282 PolarHBondContact O-OG1 3.03Å; G279-T282 WeakPolarHBondContact O-CB 3.47Å; G279-T282 PolarHBondContact O-N 3.49Å; T282-G285 PolarHBondContact O-N 3.08Å; T282-A286 WeakPolarHBondContact O-CB 3.46Å; T282-A286 PolarHBondContact O-N 3.3Å
283I79.5Confident75.9Confident83 Ų8355.1 Ų55.143%0.42628%0.279SS..Hα-helixtrans-65.2-43.5177.2-69.4166.7000110.3G279 T280 G285 A286 F287 L298G279-I283 WeakPolarHBondContact O-CB 3.35Å; G279-I283 VanDerWaalsContact O-CG1 3.23Å; G279-I283 WeakPolarHBondContact O-CG1 3.45Å; G279-I283 PolarHBondContact O-N 3.43Å; T280-I283 PolarHBondContact O-N 2.87Å; I283-G285 PolarHBondContact O-N 3.38Å; I283-A286 PolarHBondContact O-N 2.89Å; I283-A286 VanDerWaalsContact O-N 3.11Å; I283-F287 HydrophobicContact CG2-CD2 3.43Å; I283-F287 VanDerWaalsContact CG2-CD2 3.43Å; I283-F287 HydrophobicContact CG2-CE2 3.4Å; I283-F287 VanDerWaalsContact O-CD2 3.28Å; I283-F287 WeakPolarHBondContact O-CD2 3.47Å; I283-F287 PolarHBondContact O-N 3.09Å; I283-L298 HydrophobicContact CG2-CD2 4.27Å
284A71.9Confident74.6Confident11 Ų1156.6 Ų56.69%0.09129%0.287CS..Hα-helixtrans-61.3-45.2177.200000111.7T280 L281 A286 F288 L298T280-A284 VanDerWaalsContact O-CB 3.27Å; T280-A284 WeakPolarHBondContact O-CB 3.4Å; T280-A284 PolarHBondContact O-N 3.33Å; L281-A284 PolarHBondContact O-N 3.41Å; A284-A286 VanDerWaalsContact C-N 3.3Å; A284-A286 PolarHBondContact O-N 3.3Å; A284-F288 VanDerWaalsContact O-CB 3.3Å; A284-F288 WeakPolarHBondContact O-CB 3.3Å; A284-F288 PolarHBondContact O-N 3.48Å; A284-L298 HydrophobicContact CB-CD2 3.43Å; A284-L298 VanDerWaalsContact CB-CD2 3.43Å; A284-L298 HydrophobicContact CB-CG 3.82Å
285G69.1Low73.6Confident4 Ų460.3 Ų60.34%0.04131%0.307CS..Hα-helixtrans-58.9-43.2172.600000111.9Y207 L281 T282 I283 F288 V289Y207-G285 PolarHBondContact OH-O 2.64Å; L281-G285 PolarHBondContact O-N 3.24Å; T282-G285 PolarHBondContact O-N 3.08Å; I283-G285 PolarHBondContact O-N 3.38Å; G285-F288 PolarHBondContact O-N 3.28Å; G285-V289 VanDerWaalsContact O-CG2 3.28Å; G285-V289 WeakPolarHBondContact O-CG2 3.33Å; G285-V289 PolarHBondContact O-N 3.49Å
286A73Confident72.4Confident50 Ų5061.6 Ų61.641%0.41331%0.314SS..Hα-helixtrans-69.9-42.4-176.500000112.6Y207 T282 I283 A284 F288 V289 R290Y207-A286 WeakPolarHBondContact OH-CA 3.5Å; Y207-A286 PolarHBondContact OH-N 3.08Å; T282-A286 WeakPolarHBondContact O-CB 3.46Å; T282-A286 PolarHBondContact O-N 3.3Å; I283-A286 PolarHBondContact O-N 2.89Å; I283-A286 VanDerWaalsContact O-N 3.11Å; A284-A286 VanDerWaalsContact C-N 3.3Å; A284-A286 PolarHBondContact O-N 3.3Å; A286-F288 VanDerWaalsContact C-N 3.33Å; A286-V289 PolarHBondContact O-N 2.85Å; A286-R290 PolarHBondContact O-N 2.84Å
287F71.9Confident71.4Confident97 Ų9767.3 Ų67.343%0.42533%0.33SS..Hα-helixtrans-62.2-43.5173.3-86.5-70.9000111.1I283 V289 R290 E291 L298I283-F287 HydrophobicContact CG2-CD2 3.43Å; I283-F287 VanDerWaalsContact CG2-CD2 3.43Å; I283-F287 HydrophobicContact CG2-CE2 3.4Å; I283-F287 VanDerWaalsContact O-CD2 3.28Å; I283-F287 WeakPolarHBondContact O-CD2 3.47Å; I283-F287 PolarHBondContact O-N 3.09Å; F287-V289 VanDerWaalsContact C-N 3.34Å; F287-V289 PolarHBondContact O-N 3.45Å; F287-R290 PolarHBondContact O-N 3.37Å; F287-E291 PolarHBondContact O-N 2.83Å; F287-L298 HydrophobicContact CD2-CD2 4.48Å
288F65.5Low70.8Confident4 Ų468.5 Ų68.52%0.01834%0.336CS..Hα-helixtrans-61-43.1178.4-172.2-88.9000112.4F17 A20 I202 A284 G285 A286 R290 E292 L294F17-F288 HydrophobicContact CB-CD1 3.7Å; F17-F288 HydrophobicContact CB-CE1 3.24Å; F17-F288 HydrophobicContact CB-CZ 3.76Å; F17-F288 HydrophobicContact CD2-CB 4.12Å; F17-F288 AromaticContact CD2-CD1 3.15Å; F17-F288 HydrophobicContact CD2-CD1 3.15Å; F17-F288 AromaticContact CD2-CD2 3.3Å; F17-F288 HydrophobicContact CD2-CD2 3.3Å; F17-F288 AromaticContact CD2-CE1 3.35Å; F17-F288 HydrophobicContact CD2-CE1 3.35Å; F17-F288 AromaticContact CD2-CE2 3.47Å; F17-F288 HydrophobicContact CD2-CE2 3.47Å; F17-F288 VanDerWaalsContact CD2-CE2 3.47Å; F17-F288 AromaticContact CD2-CG 3.15Å; F17-F288 HydrophobicContact CD2-CG 3.15Å; F17-F288 AromaticContact CD2-CZ 3.52Å; F17-F288 HydrophobicContact CD2-CZ 3.52Å; F17-F288 HydrophobicContact CE2-CB 3.89Å; F17-F288 AromaticContact CE2-CD1 3.81Å; F17-F288 HydrophobicContact CE2-CD1 3.81Å; F17-F288 AromaticContact CE2-CD2 3.54Å; F17-F288 HydrophobicContact CE2-CD2 3.54Å; F17-F288 HydrophobicContact CE2-CE1 4.38Å; F17-F288 HydrophobicContact CE2-CE2 4.13Å; F17-F288 AromaticContact CE2-CG 3.37Å; F17-F288 HydrophobicContact CE2-CG 3.37Å; F17-F288 AromaticContact CG-CD1 3.71Å; F17-F288 HydrophobicContact CG-CD1 3.71Å; F17-F288 AromaticContact CG-CE1 3.71Å; F17-F288 HydrophobicContact CG-CE1 3.71Å; F17-F288 HydrophobicContact CG-CE2 4.49Å; F17-F288 HydrophobicContact CG-CG 4.15Å; F17-F288 HydrophobicContact CG-CZ 4.14Å; A20-F288 HydrophobicContact CB-CE2 3.65Å; A20-F288 HydrophobicContact CB-CZ 3.86Å; I202-F288 HydrophobicContact CD1-CB 3.71Å; I202-F288 HydrophobicContact CD1-CD1 3.49Å; I202-F288 VanDerWaalsContact CD1-CD1 3.49Å; I202-F288 HydrophobicContact CD1-CG 3.84Å; A284-F288 VanDerWaalsContact O-CB 3.3Å; A284-F288 WeakPolarHBondContact O-CB 3.3Å; A284-F288 PolarHBondContact O-N 3.48Å; G285-F288 PolarHBondContact O-N 3.28Å; A286-F288 VanDerWaalsContact C-N 3.33Å; F288-R290 PolarHBondContact O-N 3.35Å; F288-E292 VanDerWaalsContact CE2-O 3.3Å; F288-E292 WeakPolarHBondContact CE2-O 3.29Å; F288-E292 WeakPolarHBondContact O-CA 3.24Å; F288-E292 PolarHBondContact O-N 2.94Å; F288-L294 HydrophobicContact CD2-CB 4.26Å
289V66.4Low69.8Low73 Ų7368.9 Ų68.944%0.44234%0.338SS..Hα-helixtrans-63.3-24.5176.1170.70000112.4I202 G285 A286 F287I202-V289 HydrophobicContact CG2-CG2 3.81Å; G285-V289 VanDerWaalsContact O-CG2 3.28Å; G285-V289 WeakPolarHBondContact O-CG2 3.33Å; G285-V289 PolarHBondContact O-N 3.49Å; A286-V289 PolarHBondContact O-N 2.85Å; F287-V289 VanDerWaalsContact C-N 3.34Å; F287-V289 PolarHBondContact O-N 3.45Å
290R69.6Low69Low201 Ų20171.8 Ų71.876%0.75835%0.349SS*.Hα-helixtrans-92.4-42.3-176.6-172.7-179.2-178.4-176.5-1.5113.5A286 F287 F288A286-R290 PolarHBondContact O-N 2.84Å; F287-R290 PolarHBondContact O-N 3.37Å; F288-R290 PolarHBondContact O-N 3.35Å
291E66.5Low68.7Low107 Ų10773.3 Ų73.350%0.536%0.36SS..Hα-helixtrans-114.4-4.1-167.7-67.7177.7-168.700113.2F287 Q293F287-E291 PolarHBondContact O-N 2.83Å; E291-Q293 PolarHBondContact O-N 3.4Å
292E61.5Low68.5Low128 Ų12873.3 Ų73.360%0.59836%0.36SS*.SBendtrans55.26.6-175.9-67.3172.6-162.400114.5F288F288-E292 VanDerWaalsContact CE2-O 3.3Å; F288-E292 WeakPolarHBondContact CE2-O 3.29Å; F288-E292 WeakPolarHBondContact O-CA 3.24Å; F288-E292 PolarHBondContact O-N 2.94Å
293Q57.2Low68.1Low152 Ų15271.9 Ų71.971%0.7135%0.35SS*.  trans-111.7133.9178.1-67.1-172.6-5.300110.2E291E291-Q293 PolarHBondContact O-N 3.4Å
294L60.9Low68Low34 Ų3472.6 Ų72.618%0.17836%0.355CS..  trans-89.6111.8174.8-17576.8000108.7F17 I21 Y24 F288 L296 V299F17-L294 HydrophobicContact CE2-CD1 3.66Å; F17-L294 HydrophobicContact CZ-CD1 4.18Å; I21-L294 HydrophobicContact CG1-CD2 4.05Å; Y24-L294 HydrophobicContact CD1-CD2 4.16Å; Y24-L294 HydrophobicContact CG-CD2 4.4Å; F288-L294 HydrophobicContact CD2-CB 4.26Å; L294-L296 PolarHBondContact O-N 3.44Å; L294-L296 VanDerWaalsContact O-N 3.16Å; L294-V299 HydrophobicContact CD1-CG2 3.8Å; L294-V299 HydrophobicContact CD2-CG2 3.59Å; L294-V299 HydrophobicContact CG-CG2 3.59Å
295D65.6Low68.5Low88 Ų8872.9 Ų72.947%0.47135%0.354SS..  trans-68.5112.7174.9-174.4-8.5000110.5R297 L298 V299D295-R297 PolarHBondContact O-N 3.4Å; D295-R297 WeakPolarHBondContact OD1-CB 3.22Å; D295-R297 PolarHBondContact OD1-N 2.91Å; D295-L298 HydrophobicContact CB-CB 4.11Å; D295-L298 WeakPolarHBondContact O-CB 3.37Å; D295-L298 PolarHBondContact O-N 2.88Å; D295-V299 PolarHBondContact O-N 2.9Å
296L61.2Low68.7Low84 Ų8472.9 Ų72.944%0.4435%0.353SS..Hα-helixtrans-49.3-40.6176.7-163.898000112.6Y24 L294 L298 V299 N300Y24-L296 HydrophobicContact CD2-CD1 4.12Å; Y24-L296 HydrophobicContact CE2-CD1 3.06Å; Y24-L296 HydrophobicContact CE2-CG 4.39Å; Y24-L296 VanDerWaalsContact CZ-CD1 3.48Å; Y24-L296 WeakPolarHBondContact OH-CD1 3.21Å; L294-L296 PolarHBondContact O-N 3.44Å; L294-L296 VanDerWaalsContact O-N 3.16Å; L296-L298 VanDerWaalsContact C-N 3.25Å; L296-L298 PolarHBondContact O-N 3.5Å; L296-V299 PolarHBondContact O-N 2.96Å; L296-N300 PolarHBondContact O-N 3Å; L296-N300 PolarHBondContact O-ND2 2.94Å
297R69.4Low68.9Low204 Ų20470.5 Ų70.577%0.7733%0.334SS*.Hα-helixtrans-65.9-35.9-176.9-63.4177.8175.6179.30.4110.6D295 C301D295-R297 PolarHBondContact O-N 3.4Å; D295-R297 WeakPolarHBondContact OD1-CB 3.22Å; D295-R297 PolarHBondContact OD1-N 2.91Å; R297-C301 VanDerWaalsContact O-CB 3.24Å; R297-C301 WeakPolarHBondContact O-CB 3.31Å; R297-C301 PolarHBondContact O-N 2.85Å
298L70.5Confident69.4Low31 Ų3168.7 Ų68.716%0.16233%0.328CS..Hα-helixtrans-75-36.3-179.1-166.458.3000111.8T280 I283 A284 F287 D295 L296 C301 Y302T280-L298 HydrophobicContact CG2-CD1 4.39Å; I283-L298 HydrophobicContact CG2-CD2 4.27Å; A284-L298 HydrophobicContact CB-CD2 3.43Å; A284-L298 VanDerWaalsContact CB-CD2 3.43Å; A284-L298 HydrophobicContact CB-CG 3.82Å; F287-L298 HydrophobicContact CD2-CD2 4.48Å; D295-L298 HydrophobicContact CB-CB 4.11Å; D295-L298 WeakPolarHBondContact O-CB 3.37Å; D295-L298 PolarHBondContact O-N 2.88Å; L296-L298 VanDerWaalsContact C-N 3.25Å; L296-L298 PolarHBondContact O-N 3.5Å; L298-C301 PolarHBondContact O-N 3.34Å; L298-Y302 WeakPolarHBondContact O-CB 3.44Å; L298-Y302 PolarHBondContact O-N 3.2Å
299V64.3Low69.9Low8 Ų869 Ų695%0.04833%0.33CS..Hα-helixtrans-62.9-48.1171.1179.40000110.7L199 L294 D295 L296 C301 Y302 L303L199-V299 HydrophobicContact CD1-CG1 4.3Å; L294-V299 HydrophobicContact CD1-CG2 3.8Å; L294-V299 HydrophobicContact CD2-CG2 3.59Å; L294-V299 HydrophobicContact CG-CG2 3.59Å; D295-V299 PolarHBondContact O-N 2.9Å; L296-V299 PolarHBondContact O-N 2.96Å; V299-C301 VanDerWaalsContact C-N 3.29Å; V299-C301 PolarHBondContact O-N 2.88Å; V299-Y302 WeakPolarHBondContact O-CB 3.46Å; V299-Y302 PolarHBondContact O-N 3.25Å; V299-L303 HydrophobicContact CG1-CD1 4.35Å; V299-L303 WeakPolarHBondContact O-CB 3.23Å; V299-L303 VanDerWaalsContact O-CG 3.31Å; V299-L303 WeakPolarHBondContact O-CG 3.42Å; V299-L303 PolarHBondContact O-N 3.38Å
300N67.3Low70.4Confident81 Ų8165.7 Ų65.743%0.43331%0.31SS..Hα-helixtrans-62.8-36.8176.6-71.9-21.1000112L296 L303 L304L296-N300 PolarHBondContact O-N 3Å; L296-N300 PolarHBondContact O-ND2 2.94Å; N300-L303 PolarHBondContact O-N 2.91Å; N300-L304 WeakPolarHBondContact O-CB 3.23Å; N300-L304 PolarHBondContact O-N 3.41Å
301C75.9Confident70.9Confident50 Ų5058.3 Ų58.334%0.33829%0.285SS..Hα-helixtrans-64-45.8174.2-171.80000111.8R297 L298 V299 L303 L304 L305R297-C301 VanDerWaalsContact O-CB 3.24Å; R297-C301 WeakPolarHBondContact O-CB 3.31Å; R297-C301 PolarHBondContact O-N 2.85Å; L298-C301 PolarHBondContact O-N 3.34Å; V299-C301 VanDerWaalsContact C-N 3.29Å; V299-C301 PolarHBondContact O-N 2.88Å; C301-L303 VanDerWaalsContact C-N 3.29Å; C301-L303 PolarHBondContact O-N 2.88Å; C301-L304 PolarHBondContact O-N 3.18Å; C301-L305 VanDerWaalsContact O-CG 3.28Å; C301-L305 WeakPolarHBondContact O-CG 3.3Å; C301-L305 PolarHBondContact O-N 3.41Å
302Y74.4Confident71.5Confident6 Ų653.8 Ų53.82%0.02426%0.264CS..Hα-helixtrans-56.6-44.3174.2161.4-93.3000111.7S196 F198 L199 F277 L281 L298 V299 L305 L306S196-Y302 WeakPolarHBondContact OG-CE1 3.26Å; S196-Y302 PolarHBondContact OG-OH 2.84Å; F198-Y302 HydrophobicContact CD2-CE2 4.26Å; L199-Y302 HydrophobicContact CD1-CD1 4.38Å; L199-Y302 HydrophobicContact CD1-CE1 4.22Å; F277-Y302 HydrophobicContact CD2-CD2 4.01Å; F277-Y302 AromaticContact CD2-CE2 3.99Å; F277-Y302 HydrophobicContact CD2-CE2 3.99Å; F277-Y302 HydrophobicContact CE1-CE2 4.24Å; F277-Y302 AromaticContact CE2-CD2 3.55Å; F277-Y302 HydrophobicContact CE2-CD2 3.55Å; F277-Y302 AromaticContact CE2-CE2 3.11Å; F277-Y302 HydrophobicContact CE2-CE2 3.11Å; F277-Y302 HydrophobicContact CE2-CG 4.46Å; F277-Y302 AromaticContact CE2-CZ 3.71Å; F277-Y302 HydrophobicContact CZ-CD2 4.13Å; F277-Y302 AromaticContact CZ-CE2 3.28Å; F277-Y302 HydrophobicContact CZ-CE2 3.28Å; F277-Y302 AromaticContact CZ-CZ 3.79Å; L281-Y302 HydrophobicContact CB-CD2 4.36Å; L281-Y302 HydrophobicContact CD1-CD2 4.29Å; L281-Y302 HydrophobicContact CD1-CE2 4.13Å; L281-Y302 HydrophobicContact CD2-CE2 4.46Å; L298-Y302 WeakPolarHBondContact O-CB 3.44Å; L298-Y302 PolarHBondContact O-N 3.2Å; V299-Y302 WeakPolarHBondContact O-CB 3.46Å; V299-Y302 PolarHBondContact O-N 3.25Å; Y302-L305 PolarHBondContact O-N 3.42Å; Y302-L306 PolarHBondContact O-N 2.88Å; Y302-L306 VanDerWaalsContact O-N 3.08Å
303L68.4Low72.1Confident13 Ų1347.8 Ų47.87%0.06824%0.236CC..Hα-helixtrans-64.4-39.1178.2-74.7-177.1000112.9Y42 Y194 V299 N300 C301 L306 N307Y42-L303 HydrophobicContact CD1-CD1 4.47Å; Y42-L303 HydrophobicContact CE1-CB 4.29Å; Y42-L303 HydrophobicContact CE1-CD1 3.98Å; Y42-L303 HydrophobicContact CE1-CD2 4.21Å; Y42-L303 HydrophobicContact CE1-CG 4.38Å; Y42-L303 HydrophobicContact CE2-CB 3.65Å; Y42-L303 WeakPolarHBondContact OH-CB 3.46Å; Y42-L303 WeakPolarHBondContact OH-CD2 3.14Å; Y42-L303 PolarHBondContact OH-O 3.12Å; Y42-L303 VanDerWaalsContact OH-O 3.13Å; Y194-L303 HydrophobicContact CE1-CD2 4.49Å; Y194-L303 WeakPolarHBondContact OH-CD2 3.36Å; V299-L303 HydrophobicContact CG1-CD1 4.35Å; V299-L303 WeakPolarHBondContact O-CB 3.23Å; V299-L303 VanDerWaalsContact O-CG 3.31Å; V299-L303 WeakPolarHBondContact O-CG 3.42Å; V299-L303 PolarHBondContact O-N 3.38Å; N300-L303 PolarHBondContact O-N 2.91Å; C301-L303 VanDerWaalsContact C-N 3.29Å; C301-L303 PolarHBondContact O-N 2.88Å; L303-L306 PolarHBondContact O-N 3.35Å; L303-N307 PolarHBondContact O-N 2.75Å
304L77Confident73Confident99 Ų9943 Ų4352%0.51822%0.215SC..Hα-helixtrans-66.5-40.2173.8-176.169.1000111.9N300 C301 L306 N307 L308N300-L304 WeakPolarHBondContact O-CB 3.23Å; N300-L304 PolarHBondContact O-N 3.41Å; C301-L304 PolarHBondContact O-N 3.18Å; L304-L306 VanDerWaalsContact C-N 3.28Å; L304-L306 PolarHBondContact O-N 2.97Å; L304-N307 WeakPolarHBondContact O-CB 3.09Å; L304-N307 PolarHBondContact O-N 3.5Å; L304-N307 VanDerWaalsContact O-N 3.12Å; L304-L308 PolarHBondContact O-N 3.02Å
305L82.2Confident73.8Confident16 Ų1645 Ų458%0.08423%0.225CC..Hα-helixtrans-66.3-31.4178.6-72169.1000112.5L276 F277 T280 C301 Y302 N307 L308 L309L276-L305 HydrophobicContact CB-CD1 4.01Å; L276-L305 HydrophobicContact CB-CD2 3.62Å; L276-L305 HydrophobicContact CB-CG 4.46Å; L276-L305 HydrophobicContact CD1-CD2 4.04Å; L276-L305 HydrophobicContact CG-CD2 4.47Å; L276-L305 WeakPolarHBondContact O-CD1 3.48Å; F277-L305 HydrophobicContact CB-CB 4.28Å; F277-L305 HydrophobicContact CD2-CB 4.05Å; T280-L305 HydrophobicContact CG2-CD1 3.51Å; T280-L305 WeakPolarHBondContact OG1-CD1 3.32Å; C301-L305 VanDerWaalsContact O-CG 3.28Å; C301-L305 WeakPolarHBondContact O-CG 3.3Å; C301-L305 PolarHBondContact O-N 3.41Å; Y302-L305 PolarHBondContact O-N 3.42Å; L305-N307 VanDerWaalsContact C-N 3.35Å; L305-L308 HydrophobicContact CD2-CD2 4.15Å; L305-L308 WeakPolarHBondContact O-CB 2.89Å; L305-L308 PolarHBondContact O-N 3.13Å; L305-L309 PolarHBondContact O-N 3.36Å
306L73.6Confident74.2Confident4 Ų441.1 Ų41.12%0.02120%0.204CC..Hα-helixtrans-65.4-38.9171.4-169.557.8000111.8Q95 F131 F277 Y302 L303 L304 L309Q95-L306 VanDerWaalsContact OE1-CD2 3.3Å; F131-L306 HydrophobicContact CZ-CD1 4.23Å; F277-L306 HydrophobicContact CD2-CB 4.45Å; F277-L306 HydrophobicContact CE2-CB 3.94Å; F277-L306 HydrophobicContact CE2-CD1 3.89Å; F277-L306 HydrophobicContact CE2-CG 4.4Å; F277-L306 HydrophobicContact CZ-CD1 4.02Å; Y302-L306 PolarHBondContact O-N 2.88Å; Y302-L306 VanDerWaalsContact O-N 3.08Å; L303-L306 PolarHBondContact O-N 3.35Å; L304-L306 VanDerWaalsContact C-N 3.28Å; L304-L306 PolarHBondContact O-N 2.97Å; L306-L309 WeakPolarHBondContact O-CB 3.43Å; L306-L309 PolarHBondContact O-N 2.8Å
307N77Confident74.5Confident1 Ų137.6 Ų37.61%0.00519%0.186CC..Hα-helixtrans-66.7-37.7173.5-72.4-13.3000111.6Y42 L303 L304 L305 L309 C310 I311Y42-N307 WeakPolarHBondContact CE2-ND2 3.42Å; L303-N307 PolarHBondContact O-N 2.75Å; L304-N307 WeakPolarHBondContact O-CB 3.09Å; L304-N307 PolarHBondContact O-N 3.5Å; L304-N307 VanDerWaalsContact O-N 3.12Å; L305-N307 VanDerWaalsContact C-N 3.35Å; N307-L309 PolarHBondContact O-N 3.24Å; N307-C310 WeakPolarHBondContact O-CB 3.47Å; N307-C310 PolarHBondContact O-N 2.8Å; N307-I311 WeakPolarHBondContact O-CG1 3.47Å; N307-I311 PolarHBondContact O-N 3.01Å
308L82.7Confident74.6Confident59 Ų5932 Ų3231%0.30917%0.17SC..Hα-helixtrans-58.6-33.9176.3-172.564.1000112.5T273 L304 L305 I311 N312T273-L308 HydrophobicContact CG2-CB 4.13Å; T273-L308 HydrophobicContact CG2-CD2 4.1Å; T273-L308 HydrophobicContact CG2-CG 4.05Å; L304-L308 PolarHBondContact O-N 3.02Å; L305-L308 HydrophobicContact CD2-CD2 4.15Å; L305-L308 WeakPolarHBondContact O-CB 2.89Å; L305-L308 PolarHBondContact O-N 3.13Å; L308-I311 HydrophobicContact CD1-CD1 4.2Å; L308-I311 WeakPolarHBondContact O-CB 3.42Å; L308-I311 PolarHBondContact O-N 3.31Å; L308-N312 PolarHBondContact O-N 2.94Å
309L77.3Confident74.8Confident11 Ų1132 Ų326%0.05817%0.172CC..Hα-helixtrans-62.2-42.8173.6-177.474.6000112V91 F131 T273 F274 L305 L306 N307 I311 N312 I313V91-L309 HydrophobicContact CG1-CD2 3.98Å; F131-L309 HydrophobicContact CD1-CD2 4.49Å; F131-L309 HydrophobicContact CE1-CD2 3.38Å; F131-L309 HydrophobicContact CZ-CD2 3.8Å; T273-L309 HydrophobicContact CG2-CB 4.15Å; T273-L309 HydrophobicContact CG2-CD1 4.49Å; F274-L309 HydrophobicContact CD2-CD1 4.09Å; F274-L309 HydrophobicContact CE2-CD1 3.43Å; F274-L309 VanDerWaalsContact CE2-CD1 3.43Å; F274-L309 HydrophobicContact CZ-CD1 4.05Å; L305-L309 PolarHBondContact O-N 3.36Å; L306-L309 WeakPolarHBondContact O-CB 3.43Å; L306-L309 PolarHBondContact O-N 2.8Å; N307-L309 PolarHBondContact O-N 3.24Å; L309-I311 VanDerWaalsContact C-N 3.34Å; L309-N312 PolarHBondContact O-N 3.19Å; L309-I313 PolarHBondContact O-N 3.23Å
310C74.9Confident75.2Confident2 Ų231.9 Ų31.91%0.01417%0.171CC..Hα-helixtrans-64.6-39.7175.9-71.80000111.5M49 C92 N307 N312 I313 I314M49-C310 HydrophobicContact CB-CB 4.18Å; C92-C310 VanDerWaalsContact SG-SG 3.66Å; N307-C310 WeakPolarHBondContact O-CB 3.47Å; N307-C310 PolarHBondContact O-N 2.8Å; C310-N312 VanDerWaalsContact C-N 3.34Å; C310-N312 PolarHBondContact O-N 2.81Å; C310-I313 PolarHBondContact O-N 3.11Å; C310-I314 WeakPolarHBondContact O-CG1 3.17Å; C310-I314 PolarHBondContact O-N 3.47Å
311I80.2Confident75.2Confident46 Ų4631 Ų3124%0.23617%0.166CC..Hα-helixtrans-58.6-45.2174.9-61.9172.5000111.2M49 N307 L308 L309 I313 I314 I315M49-I311 HydrophobicContact CE-CD1 3.32Å; M49-I311 HydrophobicContact CE-CG1 3.32Å; M49-I311 HydrophobicContact SD-CD1 4.25Å; M49-I311 HydrophobicContact SD-CG1 3.55Å; M49-I311 VanDerWaalsContact SD-CG1 3.55Å; N307-I311 WeakPolarHBondContact O-CG1 3.47Å; N307-I311 PolarHBondContact O-N 3.01Å; L308-I311 HydrophobicContact CD1-CD1 4.2Å; L308-I311 WeakPolarHBondContact O-CB 3.42Å; L308-I311 PolarHBondContact O-N 3.31Å; L309-I311 VanDerWaalsContact C-N 3.34Å; I311-I313 PolarHBondContact O-N 3.19Å; I311-I314 WeakPolarHBondContact O-CB 3.29Å; I311-I314 PolarHBondContact O-N 3.48Å; I311-I314 VanDerWaalsContact O-N 3.08Å; I311-I315 HydrophobicContact CG2-CD1 3.46Å; I311-I315 VanDerWaalsContact CG2-CD1 3.46Å; I311-I315 HydrophobicContact CG2-CG1 4.07Å; I311-I315 WeakPolarHBondContact O-CG1 3.17Å; I311-I315 PolarHBondContact O-N 3.12Å
312N80.8Confident75Confident12 Ų1235.4 Ų35.46%0.06418%0.179CC..Hα-helixtrans-57.1-37.8179.8-78.4-25.6000112.4S269 N270 T273 L308 L309 C310 I315 Q316S269-N312 PolarHBondContact O-ND2 2.94Å; S269-N312 PolarHBondContact OG-OD1 3Å; N270-N312 VanDerWaalsContact OD1-CB 3.29Å; N270-N312 WeakPolarHBondContact OD1-CB 3.35Å; N270-N312 PolarHBondContact OD1-ND2 2.68Å; T273-N312 WeakPolarHBondContact CB-ND2 3.42Å; T273-N312 PolarHBondContact OG1-ND2 3.08Å; L308-N312 PolarHBondContact O-N 2.94Å; L309-N312 PolarHBondContact O-N 3.19Å; C310-N312 VanDerWaalsContact C-N 3.34Å; C310-N312 PolarHBondContact O-N 2.81Å; N312-I315 PolarHBondContact O-N 3.47Å; N312-Q316 WeakPolarHBondContact O-CB 3.3Å; N312-Q316 PolarHBondContact O-N 2.84Å
313I73.3Confident74.7Confident3 Ų341 Ų412%0.01520%0.2CC..Hα-helixtrans-68.2-37.9178.8-63.4159.4000111.2C88 C92 L309 C310 I311 P317C88-I313 HydrophobicContact CB-CD1 3.51Å; C88-I313 HydrophobicContact CB-CG1 3.88Å; C88-I313 HydrophobicContact CB-CG2 4.41Å; C88-I313 VanDerWaalsContact SG-CD1 3.59Å; C92-I313 VanDerWaalsContact SG-CD1 3.53Å; L309-I313 PolarHBondContact O-N 3.23Å; C310-I313 PolarHBondContact O-N 3.11Å; I311-I313 PolarHBondContact O-N 3.19Å; I313-P317 WeakPolarHBondContact O-CD 3.32Å
314I75.3Confident74.5Confident50 Ų5041 Ų4126%0.25620%0.201SC..Hα-helixtrans-67-40.6176.2-61.2168.8000111G52 C310 I311 P317G52-I314 VanDerWaalsContact C-CG1 3.41Å; G52-I314 WeakPolarHBondContact O-CG1 3.08Å; C310-I314 WeakPolarHBondContact O-CG1 3.17Å; C310-I314 PolarHBondContact O-N 3.47Å; I311-I314 WeakPolarHBondContact O-CB 3.29Å; I311-I314 PolarHBondContact O-N 3.48Å; I311-I314 VanDerWaalsContact O-N 3.08Å; I314-P317 VanDerWaalsContact O-CD 3.22Å; I314-P317 WeakPolarHBondContact O-CD 3.21Å; I314-P317 VanDerWaalsContact O-CG 3.31Å; I314-P317 WeakPolarHBondContact O-CG 3.35Å
315I78Confident73.7Confident76 Ų7639.6 Ų39.639%0.3919%0.192SC..Hα-helixtrans-77-32.8-176.1-67.7178.6000111.7I311 N312 I318 V319I311-I315 HydrophobicContact CG2-CD1 3.46Å; I311-I315 VanDerWaalsContact CG2-CD1 3.46Å; I311-I315 HydrophobicContact CG2-CG1 4.07Å; I311-I315 WeakPolarHBondContact O-CG1 3.17Å; I311-I315 PolarHBondContact O-N 3.12Å; N312-I315 PolarHBondContact O-N 3.47Å; I315-I318 WeakPolarHBondContact O-CB 3.31Å; I315-I318 PolarHBondContact O-N 2.97Å; I315-V319 HydrophobicContact CG2-CG2 3.49Å; I315-V319 VanDerWaalsContact CG2-CG2 3.49Å; I315-V319 WeakPolarHBondContact O-CG2 3.36Å; I315-V319 PolarHBondContact O-N 3.38Å
316Q74.8Confident72.7Confident8 Ų842.3 Ų42.34%0.03720%0.203CC..Hα-helixtrans-48.3-50.4-178.7-176.2169.612.400115C266 N312 I318 V319 L320C266-Q316 HydrophobicContact CB-CG 4.21Å; N312-Q316 WeakPolarHBondContact O-CB 3.3Å; N312-Q316 PolarHBondContact O-N 2.84Å; Q316-I318 VanDerWaalsContact C-N 3.31Å; Q316-I318 PolarHBondContact O-N 3.2Å; Q316-V319 PolarHBondContact O-N 2.57Å; Q316-L320 HydrophobicContact CG-CD1 3.72Å; Q316-L320 HydrophobicContact CG-CG 4.38Å; Q316-L320 WeakPolarHBondContact O-CB 3.47Å; Q316-L320 WeakPolarHBondContact O-CG 3.42Å; Q316-L320 PolarHBondContact O-N 3.23Å
317P66.4Low72Confident9 Ų942.5 Ų42.56%0.05820%0.204CC..Hα-helixtrans-62.9-39.2178.319.6-27.3000111.7N60 I313 I314 L320 L321N60-P317 WeakPolarHBondContact ND2-CD 3.05Å; N60-P317 VanDerWaalsContact OD1-CB 3.31Å; N60-P317 WeakPolarHBondContact OD1-CB 3.49Å; I313-P317 WeakPolarHBondContact O-CD 3.32Å; I314-P317 VanDerWaalsContact O-CD 3.22Å; I314-P317 WeakPolarHBondContact O-CD 3.21Å; I314-P317 VanDerWaalsContact O-CG 3.31Å; I314-P317 WeakPolarHBondContact O-CG 3.35Å; P317-L320 PolarHBondContact O-N 3.07Å; P317-L321 WeakPolarHBondContact O-CB 3.3Å; P317-L321 WeakPolarHBondContact O-CG 3.5Å; P317-L321 PolarHBondContact O-N 2.92Å
318I71.7Confident71.1Confident86 Ų8649.1 Ų49.144%0.44123%0.229SC..Hα-helixtrans-63.7-45.7179.3-57.9172.7000109.9I315 Q316 K322I315-I318 WeakPolarHBondContact O-CB 3.31Å; I315-I318 PolarHBondContact O-N 2.97Å; Q316-I318 VanDerWaalsContact C-N 3.31Å; Q316-I318 PolarHBondContact O-N 3.2Å; I318-K322 HydrophobicContact CG2-CD 4.21Å; I318-K322 VanDerWaalsContact O-CB 3.3Å; I318-K322 WeakPolarHBondContact O-CB 3.37Å; I318-K322 VanDerWaalsContact O-CG 3.32Å; I318-K322 WeakPolarHBondContact O-CG 3.35Å; I318-K322 PolarHBondContact O-N 3.28Å
319V76.2Confident69.9Low31 Ų3152.6 Ų52.619%0.18825%0.247CC..Hα-helixtrans-64.2-42.5177.9174.30000110.9P265 I315 Q316 K322 R323P265-V319 HydrophobicContact CB-CG1 4.36Å; P265-V319 HydrophobicContact CG-CG1 3.65Å; I315-V319 HydrophobicContact CG2-CG2 3.49Å; I315-V319 VanDerWaalsContact CG2-CG2 3.49Å; I315-V319 WeakPolarHBondContact O-CG2 3.36Å; I315-V319 PolarHBondContact O-N 3.38Å; Q316-V319 PolarHBondContact O-N 2.57Å; V319-K322 PolarHBondContact O-N 3.43Å; V319-R323 WeakPolarHBondContact O-CB 3.36Å; V319-R323 WeakPolarHBondContact O-CG 3.38Å; V319-R323 PolarHBondContact O-N 2.97Å
320L70.8Confident69.1Low7 Ų753 Ų534%0.03725%0.249CC..Hα-helixtrans-67.6-41.7179.3-69.2172000112.3F64 A262 L263 Q316 P317 R323 C324 L327F64-L320 HydrophobicContact CE2-CD1 4.26Å; F64-L320 HydrophobicContact CZ-CD1 3.82Å; A262-L320 HydrophobicContact CB-CD2 4.3Å; L263-L320 HydrophobicContact CD2-CD2 3.99Å; Q316-L320 HydrophobicContact CG-CD1 3.72Å; Q316-L320 HydrophobicContact CG-CG 4.38Å; Q316-L320 WeakPolarHBondContact O-CB 3.47Å; Q316-L320 WeakPolarHBondContact O-CG 3.42Å; Q316-L320 PolarHBondContact O-N 3.23Å; P317-L320 PolarHBondContact O-N 3.07Å; L320-R323 PolarHBondContact O-N 2.78Å; L320-C324 WeakPolarHBondContact O-CB 3.45Å; L320-C324 PolarHBondContact O-N 3.41Å; L320-L327 HydrophobicContact CB-CD1 4.43Å
321L68.9Low68.2Low61 Ų6160.5 Ų60.532%0.31928%0.282SS..Hα-helixtrans-66-39.6174-71.5169.7000111.7L63 P317 L327 R328L63-L321 HydrophobicContact CD1-CD2 4.38Å; L63-L321 HydrophobicContact CD2-CD2 4.19Å; L63-L321 HydrophobicContact CD2-CG 4.49Å; P317-L321 WeakPolarHBondContact O-CB 3.3Å; P317-L321 WeakPolarHBondContact O-CG 3.5Å; P317-L321 PolarHBondContact O-N 2.92Å; L321-L327 HydrophobicContact CD2-CB 3.99Å; L321-R328 WeakPolarHBondContact O-CG 3.38Å; L321-R328 PolarHBondContact O-NE 3.28Å; L321-R328 VanDerWaalsContact O-NE 3.08Å
322K70.9Confident67.2Low143 Ų14361.5 Ų61.562%0.62229%0.287SS*.Hα-helixtrans-67-39.5175.8-78.7-175.4177.6-176.50111.9I318 V319 R328I318-K322 HydrophobicContact CG2-CD 4.21Å; I318-K322 VanDerWaalsContact O-CB 3.3Å; I318-K322 WeakPolarHBondContact O-CB 3.37Å; I318-K322 VanDerWaalsContact O-CG 3.32Å; I318-K322 WeakPolarHBondContact O-CG 3.35Å; I318-K322 PolarHBondContact O-N 3.28Å; V319-K322 PolarHBondContact O-N 3.43Å; K322-R328 PolarHBondContact O-NH2 3.23Å
323R67.6Low66.2Low124 Ų12465.2 Ų65.247%0.46831%0.307SS..Hα-helixtrans-90.9-28.1-174.3-67.9-167.1175.7-149.8-0.7114.2I261 A262 V319 L320I261-R323 PolarHBondContact O-NH1 2.7Å; A262-R323 HydrophobicContact CB-CB 3.78Å; V319-R323 WeakPolarHBondContact O-CB 3.36Å; V319-R323 WeakPolarHBondContact O-CG 3.38Å; V319-R323 PolarHBondContact O-N 2.97Å; L320-R323 PolarHBondContact O-N 2.78Å
324C63.8Low65.2Low13 Ų1369.3 Ų69.39%0.08832%0.322CS..  trans-98.997.1177.3-167.10000110.1L320 K326 L327 R328L320-C324 WeakPolarHBondContact O-CB 3.45Å; L320-C324 PolarHBondContact O-N 3.41Å; C324-K326 PolarHBondContact O-N 3.35Å; C324-K326 VanDerWaalsContact O-N 3.11Å; C324-L327 HydrophobicContact CB-CB 4.14Å; C324-L327 HydrophobicContact CB-CD1 3.7Å; C324-L327 HydrophobicContact CB-CG 3.84Å; C324-L327 PolarHBondContact O-N 2.96Å; C324-R328 PolarHBondContact O-N 3.07Å
325Q61.5Low64.3Low69 Ų6971.4 Ų71.432%0.32234%0.339SS..Hα-helixtrans-53.5-33.8176.3-66.9-175.8-10.800112L327 R328Q325-L327 VanDerWaalsContact C-N 3.3Å; Q325-L327 PolarHBondContact O-N 3.46Å; Q325-R328 WeakPolarHBondContact O-CB 3.42Å; Q325-R328 PolarHBondContact O-N 3.49Å
326K60.8Low63.3Low74 Ų7471 Ų7132%0.32234%0.343SS..Hα-helixtrans-66.4-28.7179.2-54.8-171.2-174.6176.50113.3L72 N255 C324L72-K326 HydrophobicContact CD1-CB 3.76Å; L72-K326 HydrophobicContact CD2-CB 3.87Å; L72-K326 HydrophobicContact CD2-CD 3.51Å; L72-K326 HydrophobicContact CD2-CG 4.28Å; L72-K326 HydrophobicContact CG-CB 4.44Å; N255-K326 PolarHBondContact OD1-NZ 2.87Å; C324-K326 PolarHBondContact O-N 3.35Å; C324-K326 VanDerWaalsContact O-N 3.11Å
327L58Low62.3Low7 Ų772.6 Ų72.64%0.03735%0.352CS..Hα-helixtrans-79.2-24.7176.2-66.4175.1000112.3L72 L320 L321 C324 Q325 L329 I330L72-L327 HydrophobicContact CD1-CD2 4.32Å; L320-L327 HydrophobicContact CB-CD1 4.43Å; L321-L327 HydrophobicContact CD2-CB 3.99Å; C324-L327 HydrophobicContact CB-CB 4.14Å; C324-L327 HydrophobicContact CB-CD1 3.7Å; C324-L327 HydrophobicContact CB-CG 3.84Å; C324-L327 PolarHBondContact O-N 2.96Å; Q325-L327 VanDerWaalsContact C-N 3.3Å; Q325-L327 PolarHBondContact O-N 3.46Å; L327-L329 PolarHBondContact O-N 3.33Å; L327-I330 HydrophobicContact CD2-CD1 3.61Å; L327-I330 WeakPolarHBondContact O-CB 3.15Å; L327-I330 WeakPolarHBondContact O-CG1 3.44Å; L327-I330 PolarHBondContact O-N 2.89Å; L327-I330 VanDerWaalsContact O-N 3.1Å
328R59.5Low61.7Low141 Ų14173.7 Ų73.753%0.53236%0.357SS..Hα-helixtrans-65.4-24.5178-61.1-171.4-165.4174.24.5113.6L321 K322 C324 Q325 I330L321-R328 WeakPolarHBondContact O-CG 3.38Å; L321-R328 PolarHBondContact O-NE 3.28Å; L321-R328 VanDerWaalsContact O-NE 3.08Å; K322-R328 PolarHBondContact O-NH2 3.23Å; C324-R328 PolarHBondContact O-N 3.07Å; Q325-R328 WeakPolarHBondContact O-CB 3.42Å; Q325-R328 PolarHBondContact O-N 3.49Å; R328-I330 PolarHBondContact O-N 2.92Å
329L56.8Low60.6Low131 Ų13174.7 Ų74.769%0.68636%0.363SS*.THydrogen-bonded Turntrans-77.8-4.5177.2-65170.8000112.9R68 L327 K331R68-L329 PolarHBondContact NH1-O 2.84Å; L327-L329 PolarHBondContact O-N 3.33Å; L329-K331 PolarHBondContact O-N 3.38Å
330I60Low59.5Low19 Ų1976.6 Ų76.610%0.09738%0.377CS..  trans-81.3104.6175.4-56.1178.8000107.4L63 R68 C69 L327 R328 L332L63-I330 HydrophobicContact CD1-CB 4.36Å; L63-I330 HydrophobicContact CD1-CD1 3.98Å; L63-I330 HydrophobicContact CD1-CG2 4.19Å; R68-I330 HydrophobicContact CB-CD1 4.03Å; R68-I330 HydrophobicContact CB-CG1 3.92Å; C69-I330 HydrophobicContact CB-CD1 4.33Å; L327-I330 HydrophobicContact CD2-CD1 3.61Å; L327-I330 WeakPolarHBondContact O-CB 3.15Å; L327-I330 WeakPolarHBondContact O-CG1 3.44Å; L327-I330 PolarHBondContact O-N 2.89Å; L327-I330 VanDerWaalsContact O-N 3.1Å; R328-I330 PolarHBondContact O-N 2.92Å; I330-L332 PolarHBondContact O-N 3.32Å; I330-L332 VanDerWaalsContact O-N 3.15Å
331K57.4Low58.2Low161 Ų16177.8 Ų77.870%0.739%0.386SS*.  trans-63.8113.5162.9-76.3-172176.6-176.50106.7L329 D333L329-K331 PolarHBondContact O-N 3.38Å; K331-D333 VanDerWaalsContact C-N 3.34Å; K331-D333 PolarHBondContact O-N 3.14Å; K331-D333 VanDerWaalsContact O-N 3.07Å
332L59.3Low57.1Low67 Ų6781.5 Ų81.535%0.35141%0.405SS..  trans-80.385.9-179.3-166.375.7000108T59 L63 I330 W334T59-L332 HydrophobicContact CG2-CD2 4.08Å; L63-L332 HydrophobicContact CD1-CD1 4.35Å; I330-L332 PolarHBondContact O-N 3.32Å; I330-L332 VanDerWaalsContact O-N 3.15Å; L332-W334 VanDerWaalsContact CD2-CD1 3.42Å; L332-W334 PolarHBondContact O-N 3.2Å
333D58.6Low55.7Low90 Ų9079.6 Ų79.648%0.48140%0.401SS..  trans-74.685.4172.5-62.2-29.8000107.7K331 S336 N337K331-D333 VanDerWaalsContact C-N 3.34Å; K331-D333 PolarHBondContact O-N 3.14Å; K331-D333 VanDerWaalsContact O-N 3.07Å; D333-S336 WeakPolarHBondContact CB-OG 3.25Å; D333-S336 PolarHBondContact O-OG 3.06Å; D333-N337 PolarHBondContact O-N 3.04Å; D333-N337 PolarHBondContact O-ND2 3.38Å
334W53.6Low54.1Low89 Ų8978.2 Ų78.234%0.33742%0.416SS..Hα-helixtrans-53-49.5-173.5-129.874000113.9F55 L332 L338F55-W334 AromaticContact CD2-CH2 3.7Å; F55-W334 HydrophobicContact CD2-CH2 3.7Å; F55-W334 AromaticContact CD2-CZ2 3.8Å; F55-W334 HydrophobicContact CD2-CZ2 3.8Å; F55-W334 HydrophobicContact CE1-CZ2 4.28Å; F55-W334 AromaticContact CE2-CH2 3.18Å; F55-W334 HydrophobicContact CE2-CH2 3.18Å; F55-W334 AromaticContact CE2-CZ2 3.14Å; F55-W334 HydrophobicContact CE2-CZ2 3.14Å; F55-W334 HydrophobicContact CE2-CZ3 4.19Å; F55-W334 AromaticContact CZ-CH2 3.95Å; F55-W334 HydrophobicContact CZ-CH2 3.95Å; F55-W334 AromaticContact CZ-CZ2 3.42Å; F55-W334 HydrophobicContact CZ-CZ2 3.42Å; F55-W334 VanDerWaalsContact CZ-CZ2 3.42Å; L332-W334 VanDerWaalsContact CD2-CD1 3.42Å; L332-W334 PolarHBondContact O-N 3.2Å; W334-L338 HydrophobicContact CD2-CD1 3.64Å; W334-L338 HydrophobicContact CE3-CD1 3.25Å; W334-L338 HydrophobicContact CG-CD1 4.44Å; W334-L338 HydrophobicContact CH2-CD1 3.69Å; W334-L338 HydrophobicContact CZ2-CD1 4.05Å; W334-L338 HydrophobicContact CZ3-CD1 3.29Å; W334-L338 WeakPolarHBondContact O-CB 3.41Å; W334-L338 PolarHBondContact O-N 3.17Å
335P55.8Low52.7Low93 Ų9385.7 Ų85.760%0.60445%0.447SS*.Hα-helixtrans-72.6-38.8-171.524.6-31.1000113.4L339P335-L339 PolarHBondContact O-N 3Å; P335-L339 VanDerWaalsContact O-N 3.12Å
336S56Low51.2Low68 Ų6888 Ų8848%0.47647%0.471SS..Hα-helixtrans-71.6-39.3-178.155.50000112.3D333 S340D333-S336 WeakPolarHBondContact CB-OG 3.25Å; D333-S336 PolarHBondContact O-OG 3.06Å; S336-S340 PolarHBondContact O-N 3.26Å; S336-S340 VanDerWaalsContact O-N 3.13Å; S336-S340 PolarHBondContact O-OG 3.43Å
337N55.2Low49.7Very low42 Ų4289.4 Ų89.423%0.22549%0.49CS..Hα-helixtrans-72.7-35.4179.6-70-53.5000112.5A62 D333 S340 C341A62-N337 HydrophobicContact CB-CB 4.27Å; D333-N337 PolarHBondContact O-N 3.04Å; D333-N337 PolarHBondContact O-ND2 3.38Å; N337-S340 PolarHBondContact O-OG 3.01Å; N337-C341 PolarHBondContact O-N 2.82Å; N337-C341 PolarHBondContact O-SG 3.08Å
338L53.5Low48.3Very low32 Ų3294 Ų9417%0.16852%0.522CS..Hα-helixtrans-69.5-44174.6-93.9155.8000112.3L58 W334 S340 C341 I342L58-L338 HydrophobicContact CD2-CD2 4.48Å; W334-L338 HydrophobicContact CD2-CD1 3.64Å; W334-L338 HydrophobicContact CE3-CD1 3.25Å; W334-L338 HydrophobicContact CG-CD1 4.44Å; W334-L338 HydrophobicContact CH2-CD1 3.69Å; W334-L338 HydrophobicContact CZ2-CD1 4.05Å; W334-L338 HydrophobicContact CZ3-CD1 3.29Å; W334-L338 WeakPolarHBondContact O-CB 3.41Å; W334-L338 PolarHBondContact O-N 3.17Å; L338-S340 VanDerWaalsContact C-N 3.29Å; L338-S340 PolarHBondContact O-N 3.23Å; L338-C341 WeakPolarHBondContact O-CB 3.41Å; L338-C341 PolarHBondContact O-N 2.78Å; L338-I342 PolarHBondContact O-N 3.19Å; L338-I342 VanDerWaalsContact O-N 3.17Å
339L48.4Very low46.8Very low107 Ų10794.1 Ų94.156%0.5653%0.533SS*.Hα-helixtrans-59.8-41.7175.5-107.499.5000111.4P335 C341 I342 L343P335-L339 PolarHBondContact O-N 3Å; P335-L339 VanDerWaalsContact O-N 3.12Å; L339-C341 PolarHBondContact O-N 3.03Å; L339-I342 PolarHBondContact O-N 3.11Å; L339-L343 HydrophobicContact CD2-CD1 3.98Å; L339-L343 HydrophobicContact CG-CD1 4.29Å; L339-L343 WeakPolarHBondContact O-CB 3.47Å; L339-L343 PolarHBondContact O-N 3.27Å
340S52.4Low45.6Very low71 Ų7196.2 Ų96.250%0.49754%0.54SS..Hα-helixtrans-65.8-24.7175.9730000113.9S336 N337 L338S336-S340 PolarHBondContact O-N 3.26Å; S336-S340 VanDerWaalsContact O-N 3.13Å; S336-S340 PolarHBondContact O-OG 3.43Å; N337-S340 PolarHBondContact O-OG 3.01Å; L338-S340 VanDerWaalsContact C-N 3.29Å; L338-S340 PolarHBondContact O-N 3.23Å
341C43.9Very low44.2Very low31 Ų31100.9 Ų100.921%0.20957%0.571CS.*Hα-helixtrans-76.2-31.1174.5-80.10000113.1R65 N337 L338 L339R65-C341 VanDerWaalsContact CD-SG 3.54Å; R65-C341 PolarHBondContact NH1-SG 3.26Å; N337-C341 PolarHBondContact O-N 2.82Å; N337-C341 PolarHBondContact O-SG 3.08Å; L338-C341 WeakPolarHBondContact O-CB 3.41Å; L338-C341 PolarHBondContact O-N 2.78Å; L339-C341 PolarHBondContact O-N 3.03Å
342I45.1Very low42.8Very low140 Ų14099.1 Ų99.172%0.71858%0.576SS**Hα-helixtrans-88-40.4-179.5-60.5169.8000110L338 L339 A344L338-I342 PolarHBondContact O-N 3.19Å; L338-I342 VanDerWaalsContact O-N 3.17Å; L339-I342 PolarHBondContact O-N 3.11Å; I342-A344 VanDerWaalsContact C-N 3.33Å; I342-A344 PolarHBondContact O-N 3.39Å
343L42.5Very low41.4Very low103 Ų103101 Ų10154%0.53960%0.595SS.*  trans-90.860.3172-75.3113.9000111.1L339 K345L339-L343 HydrophobicContact CD2-CD1 3.98Å; L339-L343 HydrophobicContact CG-CD1 4.29Å; L339-L343 WeakPolarHBondContact O-CB 3.47Å; L339-L343 PolarHBondContact O-N 3.27Å; L343-K345 PolarHBondContact O-N 3.2Å
344A35Very low39.9Very low95 Ų95102.4 Ų102.479%0.78561%0.612SS**  trans-72.961.4156.600000108.9I342I342-A344 VanDerWaalsContact C-N 3.33Å; I342-A344 PolarHBondContact O-N 3.39Å
345K33Very low38.8Very low170 Ų170106.1 Ų106.174%0.73964%0.637SS**  trans-98.7102-179.9-158.5169.4-172.7176.90108.3L343 S347L343-K345 PolarHBondContact O-N 3.2Å; K345-S347 PolarHBondContact O-N 3.1Å
346S29.4Very low37.5Very low118 Ų118111.5 Ų111.583%0.82565%0.652SS**  trans22.685.3137.2171.90000115.7
347S31.3Very low36.2Very low103 Ų103114.5 Ų114.572%0.7267%0.667SS**  trans-148.898.1146.172.40000109.3K345 N349K345-S347 PolarHBondContact O-N 3.1Å; S347-N349 PolarHBondContact O-N 3.28Å
348S28.7Very low34.8Very low103 Ų103117.3 Ų117.372%0.7269%0.69SS**  trans-48.3121.5142.852.60000107.4
349N28Very low33.6Very low143 Ų143122.9 Ų122.977%0.76572%0.718SS**  trans173.9117.9141.3-84.2-17.1000109.9S347S347-N349 PolarHBondContact O-N 3.28Å
350Q30.2Very low32.8Very low175 Ų175122.8 Ų122.882%0.81872%0.722SS**  trans53.2122153.3-71.5172.8-21.800119.2
351P30Very low31.7Very low117 Ų117127.4 Ų127.476%0.7674%0.736SS**  trans-68.1133.6166.729.9-29.6000108.9S353P351-S353 PolarHBondContact O-N 3.07Å
352P29.8Very low31.2Very low124 Ų124132.7 Ų132.781%0.80576%0.756SS**  trans-68.5110.3168.127.7-29000107.6
353S28.8Very low30.5Very low107 Ų107134.5 Ų134.575%0.74876%0.761SS**SBendtrans-55.7143.615846.70000108.6P351P351-S353 PolarHBondContact O-N 3.07Å
354S28Very low30.3Very low119 Ų119133 Ų13383%0.83276%0.755SS**  trans82.467.4179.881.80000117.4
355L30.8Very low30.4Very low167 Ų167132.6 Ų132.687%0.87474%0.74SS**  trans-120.8106.2147-147.182.1000108.1T357L355-T357 PolarHBondContact O-N 3.15Å
356K28Very low30.8Very low207 Ų207129.2 Ų129.290%0.974%0.735SS**  trans-42.1115175-82.9175.1173.6175.20109.4S358K356-S358 VanDerWaalsContact C-N 3.27Å; K356-S358 PolarHBondContact O-N 2.89Å
357T28Very low31.3Very low131 Ų131131.2 Ų131.280%0.80473%0.732SS**  trans-64.187168.5350000108.4L355 I359L355-T357 PolarHBondContact O-N 3.15Å; T357-I359 PolarHBondContact O-N 3.34Å
358S26.8Very low32Very low101 Ų101127.3 Ų127.371%0.70670%0.704SS**  trans-65.9106.3157.960.20000106.5K356 V360K356-S358 VanDerWaalsContact C-N 3.27Å; K356-S358 PolarHBondContact O-N 2.89Å; S358-V360 VanDerWaalsContact C-N 3.28Å; S358-V360 PolarHBondContact O-N 3.48Å
359I28.4Very low32.7Very low148 Ų148129.2 Ų129.276%0.75970%0.702SS**  trans-57.698.7166-63.9166.5000105.2T357 Q361T357-I359 PolarHBondContact O-N 3.34Å; I359-Q361 HydrophobicContact CG2-CG 4.24Å; I359-Q361 PolarHBondContact O-N 3.13Å
360V31.7Very low33.5Very low106 Ų106125 Ų12564%0.64268%0.677SS**  trans-71.389.8162.4179.80000105S358 F362S358-V360 VanDerWaalsContact C-N 3.28Å; S358-V360 PolarHBondContact O-N 3.48Å; V360-F362 PolarHBondContact O-N 3Å; V360-F362 VanDerWaalsContact O-N 3.07Å
361Q28.3Very low34.1Very low168 Ų168117.7 Ų117.779%0.78565%0.647SS**  trans-53.8113.9161.7-98.6175.8-38.400106.5I359 H363I359-Q361 HydrophobicContact CG2-CG 4.24Å; I359-Q361 PolarHBondContact O-N 3.13Å; Q361-H363 PolarHBondContact O-N 3.48Å
362F34.4Very low34.7Very low142 Ų142117.5 Ų117.562%0.62364%0.639SS**  trans-65.892.1166.5-71.7-85.1000107.1V360 V364V360-F362 PolarHBondContact O-N 3Å; V360-F362 VanDerWaalsContact O-N 3.07Å; F362-V364 VanDerWaalsContact C-N 3.33Å; F362-V364 PolarHBondContact O-N 2.98Å
363H30Very low35.4Very low178 Ų178116.6 Ų116.682%0.82463%0.626SS**  trans-65.1102.1166-146.1-56.6000106.1Q361 N365Q361-H363 PolarHBondContact O-N 3.48Å; H363-N365 PolarHBondContact O-N 3.44Å
364V38.1Very low36.3Very low70 Ų70116 Ų11642%0.42461%0.611SS.*  trans-62.8104170.4177.90000105.2F251 F362 P366F251-V364 HydrophobicContact CE1-CG2 4.39Å; F362-V364 VanDerWaalsContact C-N 3.33Å; F362-V364 PolarHBondContact O-N 2.98Å; V364-P366 WeakPolarHBondContact O-CD 3.36Å
365N36.5Very low37.1Very low88 Ų88114 Ų11447%0.47159%0.594SS.*  trans-71.7112.9169.7-171.5-9.8000107.1H363 E367 S368H363-N365 PolarHBondContact O-N 3.44Å; N365-E367 PolarHBondContact O-N 3.38Å; N365-E367 VanDerWaalsContact O-N 3.11Å; N365-E367 WeakPolarHBondContact OD1-CB 3.35Å; N365-E367 PolarHBondContact OD1-N 2.86Å; N365-E367 VanDerWaalsContact OD1-N 3.08Å; N365-S368 PolarHBondContact O-N 3.2Å
366P42.2Very low37.7Very low98 Ų98112.7 Ų112.764%0.63658%0.581SS**THydrogen-bonded Turntrans-64.2-9.4178.327.5-34.1000113.2V364 A371V364-P366 WeakPolarHBondContact O-CD 3.36Å; P366-A371 WeakPolarHBondContact O-CB 3.47Å
367E39.6Very low38.4Very low160 Ų160109.9 Ų109.975%0.74857%0.565SS**THydrogen-bonded Turntrans-93.25.3178.6-57.3-172.8160.400114.1N365N365-E367 PolarHBondContact O-N 3.38Å; N365-E367 VanDerWaalsContact O-N 3.11Å; N365-E367 WeakPolarHBondContact OD1-CB 3.35Å; N365-E367 PolarHBondContact OD1-N 2.86Å; N365-E367 VanDerWaalsContact OD1-N 3.08Å
368S46.3Very low39.2Very low21 Ų21106.1 Ų106.115%0.14754%0.544CS..SBendtrans-66.414217882.90000110.9N365 E370 A371 L372N365-S368 PolarHBondContact O-N 3.2Å; S368-E370 PolarHBondContact O-N 3.37Å; S368-A371 WeakPolarHBondContact O-CA 3.29Å; S368-A371 WeakPolarHBondContact O-CB 3.4Å; S368-A371 PolarHBondContact O-N 3.42Å; S368-L372 PolarHBondContact O-N 3.12Å
369Q43.5Very low39.9Very low144 Ų144105.8 Ų105.867%0.67354%0.535SS*.Hα-helixtrans-48.2-20.9175.6-91.4-175.6-33.800114.3M373Q369-M373 WeakPolarHBondContact O-CB 3.25Å; Q369-M373 PolarHBondContact O-N 3.38Å
370E44.5Very low40.7Very low53 Ų53105.1 Ų105.125%0.24853%0.526CS..Hα-helixtrans-73.9-37174.8-62.2-175.8159.100112.7S258 S368 Q374S258-E370 PolarHBondContact OG-OE1 3.13Å; S368-E370 PolarHBondContact O-N 3.37Å; E370-Q374 WeakPolarHBondContact O-CB 3.49Å; E370-Q374 WeakPolarHBondContact O-CG 3.31Å; E370-Q374 PolarHBondContact O-N 3.28Å
371A43.1Very low41.2Very low22 Ų22107.2 Ų107.218%0.18252%0.524CS..Hα-helixtrans-69.5-36.9169.600000111P366 S368 Q374 T375P366-A371 WeakPolarHBondContact O-CB 3.47Å; S368-A371 WeakPolarHBondContact O-CA 3.29Å; S368-A371 WeakPolarHBondContact O-CB 3.4Å; S368-A371 PolarHBondContact O-N 3.42Å; A371-Q374 PolarHBondContact O-N 3.35Å; A371-T375 PolarHBondContact O-N 2.76Å; A371-T375 PolarHBondContact O-OG1 3.19Å; A371-T375 VanDerWaalsContact O-OG1 3.12Å
372L41.5Very low41.8Very low114 Ų114106.8 Ų106.860%0.59752%0.515SS*.Hα-helixtrans-68.3-37.2176.2-148112000112.4S368 T375 F376S368-L372 PolarHBondContact O-N 3.12Å; L372-T375 VanDerWaalsContact CA-OG1 3.31Å; L372-T375 WeakPolarHBondContact CA-OG1 3.43Å; L372-T375 PolarHBondContact O-N 3.16Å; L372-T375 PolarHBondContact O-OG1 3.29Å; L372-F376 VanDerWaalsContact O-CB 3.28Å; L372-F376 WeakPolarHBondContact O-CB 3.21Å; L372-F376 PolarHBondContact O-N 3.33Å
373M45.4Very low42.2Very low105 Ų105106.7 Ų106.752%0.51752%0.518SS..Hα-helixtrans-67.2-44.1170.5-81.5-143-82.200110.7Q369 T375 F376 W377Q369-M373 WeakPolarHBondContact O-CB 3.25Å; Q369-M373 PolarHBondContact O-N 3.38Å; M373-T375 VanDerWaalsContact C-N 3.29Å; M373-T375 PolarHBondContact O-N 3.13Å; M373-F376 PolarHBondContact O-N 2.8Å; M373-F376 VanDerWaalsContact O-N 3.09Å; M373-W377 PolarHBondContact O-N 2.82Å
374Q47.3Very low43Very low94 Ų94102.6 Ų102.644%0.43950%0.502SS..Hα-helixtrans-60.9-35.2176.2-75-176.3-3300112.9R254 E370 A371 S378R254-Q374 VanDerWaalsContact NH2-OE1 3.08Å; E370-Q374 WeakPolarHBondContact O-CB 3.49Å; E370-Q374 WeakPolarHBondContact O-CG 3.31Å; E370-Q374 PolarHBondContact O-N 3.28Å; A371-Q374 PolarHBondContact O-N 3.35Å; Q374-S378 WeakPolarHBondContact O-CB 3.49Å; Q374-S378 PolarHBondContact O-N 2.84Å; Q374-S378 VanDerWaalsContact O-N 3.08Å
375T45.7Very low43.3Very low77 Ų77106.7 Ų106.747%0.47252%0.517SS..Hα-helixtrans-73.5-35.1171.450.60000112.7A371 L372 M373 S378 N379A371-T375 PolarHBondContact O-N 2.76Å; A371-T375 PolarHBondContact O-OG1 3.19Å; A371-T375 VanDerWaalsContact O-OG1 3.12Å; L372-T375 VanDerWaalsContact CA-OG1 3.31Å; L372-T375 WeakPolarHBondContact CA-OG1 3.43Å; L372-T375 PolarHBondContact O-N 3.16Å; L372-T375 PolarHBondContact O-OG1 3.29Å; M373-T375 VanDerWaalsContact C-N 3.29Å; M373-T375 PolarHBondContact O-N 3.13Å; T375-S378 PolarHBondContact O-N 3.46Å; T375-N379 VanDerWaalsContact O-CB 3.26Å; T375-N379 WeakPolarHBondContact O-CB 3.44Å; T375-N379 PolarHBondContact O-N 3.03Å
376F42.9Very low43.6Very low140 Ų140109.9 Ų109.961%0.61453%0.528SS*.Hα-helixtrans-65.8-44.2176.7-155.4-90.9000112.2L372 M373 K380L372-F376 VanDerWaalsContact O-CB 3.28Å; L372-F376 WeakPolarHBondContact O-CB 3.21Å; L372-F376 PolarHBondContact O-N 3.33Å; M373-F376 PolarHBondContact O-N 2.8Å; M373-F376 VanDerWaalsContact O-N 3.09Å; F376-K380 WeakPolarHBondContact O-CB 3.33Å; F376-K380 PolarHBondContact O-N 3.18Å
377W42.4Very low43.7Very low147 Ų147115.5 Ų115.556%0.55754%0.537SS*.Hα-helixtrans-70.7-35.9176.6-69.4101.4000112M373 Y381M373-W377 PolarHBondContact O-N 2.82Å; W377-Y381 PolarHBondContact O-N 2.95Å
378S43.9Very low43.9Very low52 Ų52114.8 Ų114.836%0.36454%0.539SS..Hα-helixtrans-65.6-42.9172.5173.90000112.7Q374 T375 R382Q374-S378 WeakPolarHBondContact O-CB 3.49Å; Q374-S378 PolarHBondContact O-N 2.84Å; Q374-S378 VanDerWaalsContact O-N 3.08Å; T375-S378 PolarHBondContact O-N 3.46Å; S378-R382 WeakPolarHBondContact O-CB 3.1Å; S378-R382 PolarHBondContact O-N 2.94Å
379N41.3Very low43.2Very low95 Ų95117.3 Ų117.351%0.50856%0.556SS.*Hα-helixtrans-73.2-36.4-179.6-87.6-11.8000113T375 R382 M383T375-N379 VanDerWaalsContact O-CB 3.26Å; T375-N379 WeakPolarHBondContact O-CB 3.44Å; T375-N379 PolarHBondContact O-N 3.03Å; N379-R382 PolarHBondContact O-N 2.84Å; N379-M383 WeakPolarHBondContact O-CB 3.46Å; N379-M383 VanDerWaalsContact O-CG 3.3Å; N379-M383 WeakPolarHBondContact O-CG 3.43Å; N379-M383 PolarHBondContact O-N 3.27Å
380K45.8Very low42.7Very low134 Ų134116.7 Ų116.758%0.58357%0.565SS**Hα-helixtrans-64.3-41.7177.1-162.1173.8-177.2-179.40111.3F376 M383 D384F376-K380 WeakPolarHBondContact O-CB 3.33Å; F376-K380 PolarHBondContact O-N 3.18Å; K380-M383 PolarHBondContact O-N 2.97Å; K380-D384 PolarHBondContact O-N 3.28Å
381Y42.8Very low42.5Very low150 Ų150118.3 Ų118.359%0.58858%0.582SS**Hα-helixtrans-73-34.4175.4-91.7-87.7000113.8W377 M383 D384 Q385W377-Y381 PolarHBondContact O-N 2.95Å; Y381-M383 VanDerWaalsContact C-N 3.32Å; Y381-M383 PolarHBondContact O-N 3.07Å; Y381-D384 PolarHBondContact O-N 2.91Å; Y381-Q385 WeakPolarHBondContact O-CB 3.16Å; Y381-Q385 PolarHBondContact O-N 2.88Å
382R40.7Very low42.1Very low158 Ų158128.6 Ų128.660%0.59662%0.616SS**Hα-helixtrans-65.2-34.4172.5-85.2-174.7-173174.31.2113S378 N379 Q385 H386S378-R382 WeakPolarHBondContact O-CB 3.1Å; S378-R382 PolarHBondContact O-N 2.94Å; N379-R382 PolarHBondContact O-N 2.84Å; R382-Q385 PolarHBondContact O-N 3.35Å; R382-H386 WeakPolarHBondContact O-CB 3.48Å; R382-H386 PolarHBondContact O-N 3.5Å
383M42.1Very low41.6Very low140 Ų140130.7 Ų130.769%0.6963%0.627SS**Hα-helixtrans-68.6-36.2175.8-75.3-71.9167.600111.9N379 K380 Y381 R387N379-M383 WeakPolarHBondContact O-CB 3.46Å; N379-M383 VanDerWaalsContact O-CG 3.3Å; N379-M383 WeakPolarHBondContact O-CG 3.43Å; N379-M383 PolarHBondContact O-N 3.27Å; K380-M383 PolarHBondContact O-N 2.97Å; Y381-M383 VanDerWaalsContact C-N 3.32Å; Y381-M383 PolarHBondContact O-N 3.07Å; M383-R387 PolarHBondContact O-N 3.02Å
384D46.6Very low41Very low92 Ų92133.3 Ų133.349%0.49264%0.642SS.*Hα-helixtrans-74.3-28.7175.2-70.5-27.3000112.6K380 Y381K380-D384 PolarHBondContact O-N 3.28Å; Y381-D384 PolarHBondContact O-N 2.91Å
385Q44.4Very low40.3Very low156 Ų156134.8 Ų134.873%0.72966%0.661SS**Hα-helixtrans-79.7-31.1176.3-136.6172.44.300113.1Y381 R382Y381-Q385 WeakPolarHBondContact O-CB 3.16Å; Y381-Q385 PolarHBondContact O-N 2.88Å; R382-Q385 PolarHBondContact O-N 3.35Å
386H43Very low39.7Very low155 Ų155136.9 Ų136.972%0.71868%0.678SS**Hα-helixtrans-77.5-17.6176.2-99.6-60000114.2R382 N388R382-H386 WeakPolarHBondContact O-CB 3.48Å; R382-H386 PolarHBondContact O-N 3.5Å; H386-N388 VanDerWaalsContact C-N 3.32Å
387R44.7Very low39.2Very low216 Ų216142 Ų14282%0.81569%0.693SS**THydrogen-bonded Turntrans-78.5-12.5178.6-116.1177.9177.3180-1.9114.5M383M383-R387 PolarHBondContact O-N 3.02Å
388N43.6Very low38.8Very low146 Ų146143.2 Ų143.278%0.78171%0.71SS**THydrogen-bonded Turntrans-114.218.9-174.4-79.2-10.6000114.9H386H386-N388 VanDerWaalsContact C-N 3.32Å
389S31.7Very low38.4Very low74 Ų74148.2 Ų148.252%0.51773%0.731SS.*  trans-144111.4175.7-168.80000113.4S391S389-S391 PolarHBondContact O-N 2.88Å
390P33.4Very low38.1Very low131 Ų131148.8 Ų148.885%0.85174%0.74SS**  trans-94.382171.935.6-26.5000109.5
391S40Very low37.7Very low87 Ų87148 Ų14861%0.60875%0.751SS**  trans-162.3110.8167.2520000113.5S389S389-S391 PolarHBondContact O-N 2.88Å
392R34.6Very low37.6Very low238 Ų238148.9 Ų148.990%0.89877%0.766SS**  trans52.7113.8135.9-66.3-178.2176.9-176.5-1.1119.3
393L31Very low37.7Very low158 Ų158145.3 Ų145.383%0.82777%0.77SS**  19.5142.3127-89103.3000119.3
394L32.5Very low37.4Very low160 Ų160150.1 Ų150.184%0.83878%0.781SS**  trans90.296.6163.7-64.2130.7000115.6
395C32.5Very low37.3Very low125 Ų125161.2 Ų161.285%0.84582%0.815SS**  -174.3153.4114.3-106.80000113.2
396C34.5Very low37Very low121 Ų121161.5 Ų161.582%0.81882%0.82SS**  trans85.772.9165.3-58.10000118.7
397R32.3Very low36.7Very low246 Ų246161.8 Ų161.893%0.92883%0.825SS**  trans7.1113.2133.7-70.2179.3175.3178.5-2.3117.1
398L34.5Very low36.2Very low174 Ų174158.8 Ų158.891%0.91183%0.826SS**PPolyproline II helixtrans-78.6123.9148.3-81.3143.3000108.8
399I35.5Very low35.8Very low157 Ų157159.5 Ų159.581%0.80583%0.828SS**PPolyproline II helixtrans-77.5129.8165.1-65.4170.6000107.2
400P35Very low36Very low107 Ų107164.9 Ų164.970%0.69585%0.848SS**PPolyproline II helixtrans-80.9140.3-177.531.7-31.5000111.5N402P400-N402 PolarHBondContact O-N 3.04Å
401S35.6Very low36.2Very low116 Ų116167.1 Ų167.181%0.81185%0.848SS**PPolyproline II helixtrans-69.8122.7166.660.30000109.7A403S401-A403 PolarHBondContact O-N 3.05Å
402N42Very low35.9Very low169 Ų169172.9 Ų172.990%0.90487%0.865SS**PPolyproline II helixtrans-64.8124.2167.6-89.2-16.8000110.2P400P400-N402 PolarHBondContact O-N 3.04Å
403A41.6Very low36.1Very low84 Ų84167.8 Ų167.869%0.69486%0.862SS**PPolyproline II helixtrans-92.6134.6166.800000109.7S401S401-A403 PolarHBondContact O-N 3.05Å
404R37Very low36.5Very low241 Ų241168.7 Ų168.791%0.90987%0.865SS**  trans58.8105.4150.2-61.2-179-169.5-176.32.8119
405R44.8Very low36.8Very low324 Ų324169.5 Ų169.5100%1.22387%0.868SS**  -145.1099.5-108.6-176.6-168.1178.44.3109.6

Retrieved 405 of 405 residues in 188.1 ms (Link to these results)

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