A0A5K4F955_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession A0A5K4F955, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 369 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
1M57.1Low77.7Confident195 Ų195107 Ų10796%0.96150%0.501SS*.  0-58.30-75.2-176.4170.700115.4K3 T4 S5M1-K3 VanDerWaalsContact C-N 3.34Å; M1-K3 PolarHBondContact O-N 2.93Å; M1-T4 PolarHBondContact O-N 3.08Å; M1-T4 PolarHBondContact O-OG1 3.49Å; M1-T4 VanDerWaalsContact O-OG1 3.05Å; M1-S5 PolarHBondContact O-N 3.3Å
2K66Low78.6Confident191 Ų191101.3 Ų101.383%0.8348%0.476SS*.Hα-helixtrans-57.6-33.8-172-74.2-175.5179.3178.90116.4S5 F6K2-S5 PolarHBondContact O-OG 2.84Å; K2-F6 PolarHBondContact O-N 3.43Å
3K72.7Confident79.5Confident185 Ų185101.9 Ų101.980%0.80448%0.484SS*.Hα-helixtrans-73-36.7-176.8-166.7175.3-179.5-177.90112.7M1 W7M1-K3 VanDerWaalsContact C-N 3.34Å; M1-K3 PolarHBondContact O-N 2.93Å; K3-W7 PolarHBondContact O-N 3.23Å
4T66.1Low80.3Confident65 Ų65105.6 Ų105.640%0.39949%0.491SS..Hα-helixtrans-77.8-36.7-179.2520000112.3M1 F6 W7 F8 T306M1-T4 PolarHBondContact O-N 3.08Å; M1-T4 PolarHBondContact O-OG1 3.49Å; M1-T4 VanDerWaalsContact O-OG1 3.05Å; T4-F6 VanDerWaalsContact C-N 3.29Å; T4-F6 PolarHBondContact O-N 3.41Å; T4-W7 PolarHBondContact O-N 3.4Å; T4-F8 WeakPolarHBondContact O-CB 3.3Å; T4-F8 PolarHBondContact O-N 3.19Å; T4-T306 HydrophobicContact CG2-CG2 3.52Å; T4-T306 WeakPolarHBondContact OG1-CG2 3.47Å
5S78Confident81Confident43 Ų43100 Ų10030%0.30147%0.465SS..Hα-helixtrans-62.1-38.1172620000112M1 K2 N9M1-S5 PolarHBondContact O-N 3.3Å; K2-S5 PolarHBondContact O-OG 2.84Å; S5-N9 WeakPolarHBondContact O-CB 3.42Å; S5-N9 PolarHBondContact O-N 2.79Å; S5-N9 VanDerWaalsContact O-N 3.12Å; S5-N9 PolarHBondContact O-ND2 3.07Å
6F82.3Confident81.6Confident153 Ų15396.7 Ų96.767%0.67145%0.454SS*.Hα-helixtrans-65.7-47.5176.7-177.8-97.6000112.1K2 T4 F8 N9 D10K2-F6 PolarHBondContact O-N 3.43Å; T4-F6 VanDerWaalsContact C-N 3.29Å; T4-F6 PolarHBondContact O-N 3.41Å; F6-F8 PolarHBondContact O-N 3.01Å; F6-N9 PolarHBondContact O-N 2.61Å; F6-D10 PolarHBondContact O-N 3.32Å
7W83.4Confident82.3Confident152 Ų15299.1 Ų99.158%0.57646%0.463SS*.Hα-helixtrans-61.8-42.5178177.583000112.6K3 T4 D10 W11K3-W7 PolarHBondContact O-N 3.23Å; T4-W7 PolarHBondContact O-N 3.4Å; W7-D10 PolarHBondContact O-N 3.06Å; W7-W11 WeakPolarHBondContact O-CB 3.3Å; W7-W11 PolarHBondContact O-N 2.91Å
8F84.9Confident82.9Confident7 Ų797.8 Ų97.83%0.03146%0.459CS..Hα-helixtrans-63.4-42.5178.4-179.3-97.5000112.3T4 F6 W11 L12 I295 L296 Y299T4-F8 WeakPolarHBondContact O-CB 3.3Å; T4-F8 PolarHBondContact O-N 3.19Å; F6-F8 PolarHBondContact O-N 3.01Å; F8-W11 PolarHBondContact O-N 3.04Å; F8-L12 WeakPolarHBondContact O-CB 3.09Å; F8-L12 PolarHBondContact O-N 3.2Å; F8-I295 HydrophobicContact CD2-CG2 4.48Å; F8-I295 HydrophobicContact CE2-CG2 3.78Å; F8-L296 HydrophobicContact CZ-CD1 4.06Å; F8-Y299 HydrophobicContact CB-CE2 4.37Å; F8-Y299 HydrophobicContact CD1-CD1 4.42Å; F8-Y299 HydrophobicContact CD1-CD2 4.18Å; F8-Y299 HydrophobicContact CD1-CE1 4.25Å; F8-Y299 HydrophobicContact CD1-CE2 4Å; F8-Y299 HydrophobicContact CD1-CG 4.38Å; F8-Y299 AromaticContact CD2-CD2 3.76Å; F8-Y299 HydrophobicContact CD2-CD2 3.76Å; F8-Y299 HydrophobicContact CD2-CE2 4.21Å; F8-Y299 HydrophobicContact CD2-CG 4.16Å; F8-Y299 AromaticContact CE1-CD1 3.81Å; F8-Y299 HydrophobicContact CE1-CD1 3.81Å; F8-Y299 HydrophobicContact CE1-CD2 4.2Å; F8-Y299 AromaticContact CE1-CE1 3.96Å; F8-Y299 HydrophobicContact CE1-CE1 3.96Å; F8-Y299 HydrophobicContact CE1-CE2 4.33Å; F8-Y299 AromaticContact CE1-CG 3.94Å; F8-Y299 HydrophobicContact CE1-CG 3.94Å; F8-Y299 HydrophobicContact CE2-CD1 4.35Å; F8-Y299 AromaticContact CE2-CD2 3.76Å; F8-Y299 HydrophobicContact CE2-CD2 3.76Å; F8-Y299 AromaticContact CE2-CG 3.67Å; F8-Y299 HydrophobicContact CE2-CG 3.67Å; F8-Y299 AromaticContact CG-CD2 3.96Å; F8-Y299 HydrophobicContact CG-CD2 3.96Å; F8-Y299 AromaticContact CG-CE2 3.94Å; F8-Y299 HydrophobicContact CG-CE2 3.94Å; F8-Y299 HydrophobicContact CG-CG 4.48Å; F8-Y299 AromaticContact CZ-CD1 3.78Å; F8-Y299 HydrophobicContact CZ-CD1 3.78Å; F8-Y299 AromaticContact CZ-CD2 4Å; F8-Y299 HydrophobicContact CZ-CD2 4Å; F8-Y299 HydrophobicContact CZ-CE1 4.38Å; F8-Y299 AromaticContact CZ-CG 3.55Å; F8-Y299 HydrophobicContact CZ-CG 3.55Å
9N86.5Confident83.4Confident85 Ų8593.2 Ų93.246%0.45544%0.438SS..Hα-helixtrans-65.1-45.8177.6-70.1-15.5000111.8S5 F6 W11 L12 D13S5-N9 WeakPolarHBondContact O-CB 3.42Å; S5-N9 PolarHBondContact O-N 2.79Å; S5-N9 VanDerWaalsContact O-N 3.12Å; S5-N9 PolarHBondContact O-ND2 3.07Å; F6-N9 PolarHBondContact O-N 2.61Å; N9-W11 VanDerWaalsContact C-N 3.3Å; N9-W11 PolarHBondContact O-N 2.86Å; N9-L12 PolarHBondContact O-N 2.89Å; N9-D13 PolarHBondContact O-N 3.44Å
10D88.9Confident83.8Confident64 Ų6492 Ų9234%0.34243%0.434SS..Hα-helixtrans-59.6-42175.8-177.267.5000111.5F6 W7 D13 R14F6-D10 PolarHBondContact O-N 3.32Å; W7-D10 PolarHBondContact O-N 3.06Å; D10-D13 PolarHBondContact O-N 2.88Å; D10-R14 WeakPolarHBondContact O-CG 3.34Å; D10-R14 PolarHBondContact O-N 3.09Å; D10-R14 IonicContact OD1-NE 2.66Å; D10-R14 IonicContact OD1-NH2 3.69Å; D10-R14 IonicContact OD2-CZ 2.67Å; D10-R14 IonicContact OD2-NE 3.19Å; D10-R14 PolarHBondContact OD2-NE 2.89Å; D10-R14 IonicContact OD2-NH2 3.2Å; D10-R14 PolarHBondContact OD2-NH2 2.92Å; D10-R14 VanDerWaalsContact OD2-NH2 3.16Å
11W89.1Confident84.2Confident37 Ų3789.7 Ų89.714%0.1443%0.426CS..Hα-helixtrans-62.2-45.6175.5178.787.5000112W7 F8 N9 D13 R14 Q15 Q291 I295W7-W11 WeakPolarHBondContact O-CB 3.3Å; W7-W11 PolarHBondContact O-N 2.91Å; F8-W11 PolarHBondContact O-N 3.04Å; N9-W11 VanDerWaalsContact C-N 3.3Å; N9-W11 PolarHBondContact O-N 2.86Å; W11-D13 VanDerWaalsContact C-N 3.33Å; W11-D13 PolarHBondContact O-N 3.12Å; W11-R14 PolarHBondContact O-N 2.74Å; W11-Q15 HydrophobicContact CD2-CG 3.96Å; W11-Q15 HydrophobicContact CE3-CG 4.26Å; W11-Q15 HydrophobicContact CH2-CG 3.93Å; W11-Q15 HydrophobicContact CZ2-CG 3.58Å; W11-Q15 HydrophobicContact CZ3-CG 4.25Å; W11-Q15 WeakPolarHBondContact O-CG 3.39Å; W11-Q15 PolarHBondContact O-N 2Å; W11-Q291 HydrophobicContact CZ2-CG 4.39Å; W11-I295 HydrophobicContact CE3-CG2 4.23Å; W11-I295 HydrophobicContact CH2-CB 3.71Å; W11-I295 HydrophobicContact CH2-CD1 3.36Å; W11-I295 HydrophobicContact CH2-CG1 4.1Å; W11-I295 HydrophobicContact CH2-CG2 3.71Å; W11-I295 HydrophobicContact CZ2-CD1 3.27Å; W11-I295 HydrophobicContact CZ2-CG1 4.45Å; W11-I295 HydrophobicContact CZ2-CG2 4.48Å; W11-I295 HydrophobicContact CZ3-CB 4.03Å; W11-I295 HydrophobicContact CZ3-CD1 4.28Å; W11-I295 HydrophobicContact CZ3-CG2 3.56Å
12L88.3Confident86Confident39 Ų3981 Ų8120%0.20438%0.384CS..Hα-helixtrans-63.3-39.3-179.9-168.670.3000112.1F8 N9 Q15 T16 K292F8-L12 WeakPolarHBondContact O-CB 3.09Å; F8-L12 PolarHBondContact O-N 3.2Å; N9-L12 PolarHBondContact O-N 2.89Å; L12-Q15 PolarHBondContact O-N 3.19Å; L12-T16 WeakPolarHBondContact O-CB 3.26Å; L12-T16 PolarHBondContact O-N 2.75Å; L12-T16 PolarHBondContact O-OG1 3.43Å; L12-K292 HydrophobicContact CD1-CD 4.33Å; L12-K292 HydrophobicContact CD1-CG 4.13Å
13D90.4Very high87.2Confident109 Ų10973.9 Ų73.958%0.58335%0.353SS*.Hα-helixtrans-65.5-45.7177-74.7-18.5000111N9 D10 W11 Q15 T16 F17N9-D13 PolarHBondContact O-N 3.44Å; D10-D13 PolarHBondContact O-N 2.88Å; W11-D13 VanDerWaalsContact C-N 3.33Å; W11-D13 PolarHBondContact O-N 3.12Å; D13-Q15 PolarHBondContact O-N 2.93Å; D13-T16 PolarHBondContact O-N 2.65Å; D13-F17 WeakPolarHBondContact O-CB 2.73Å; D13-F17 PolarHBondContact O-N 3.35Å
14R91.2Very high88.1Confident154 Ų15474 Ų7458%0.58135%0.348SS*.Hα-helixtrans-59.9-44.5175-71.4175.5-168-110.40112.3D10 W11 T16 F17 L18D10-R14 WeakPolarHBondContact O-CG 3.34Å; D10-R14 PolarHBondContact O-N 3.09Å; D10-R14 IonicContact OD1-NE 2.66Å; D10-R14 IonicContact OD1-NH2 3.69Å; D10-R14 IonicContact OD2-CZ 2.67Å; D10-R14 IonicContact OD2-NE 3.19Å; D10-R14 PolarHBondContact OD2-NE 2.89Å; D10-R14 IonicContact OD2-NH2 3.2Å; D10-R14 PolarHBondContact OD2-NH2 2.92Å; D10-R14 VanDerWaalsContact OD2-NH2 3.16Å; W11-R14 PolarHBondContact O-N 2.74Å; R14-T16 VanDerWaalsContact C-N 3.34Å; R14-T16 PolarHBondContact O-N 3.11Å; R14-F17 PolarHBondContact O-N 3.01Å; R14-L18 WeakPolarHBondContact O-CG 3.46Å; R14-L18 PolarHBondContact O-N 3.48Å
15Q90.1Very high89.5Confident21 Ų2174.9 Ų74.910%0.09835%0.349CS..Hα-helixtrans-62.5-43.6177.2-70-57.4-41.100111.5W11 L12 D13 L18 I19W11-Q15 HydrophobicContact CD2-CG 3.96Å; W11-Q15 HydrophobicContact CE3-CG 4.26Å; W11-Q15 HydrophobicContact CH2-CG 3.93Å; W11-Q15 HydrophobicContact CZ2-CG 3.58Å; W11-Q15 HydrophobicContact CZ3-CG 4.25Å; W11-Q15 WeakPolarHBondContact O-CG 3.39Å; W11-Q15 PolarHBondContact O-N 2Å; L12-Q15 PolarHBondContact O-N 3.19Å; D13-Q15 PolarHBondContact O-N 2.93Å; Q15-L18 PolarHBondContact O-N 2.74Å; Q15-I19 WeakPolarHBondContact O-CD1 2.99Å; Q15-I19 VanDerWaalsContact O-CG1 3.28Å; Q15-I19 WeakPolarHBondContact O-CG1 3.36Å; Q15-I19 PolarHBondContact O-N 2.93Å
16T90.5Very high90.3Very high47 Ų4772.8 Ų72.829%0.28834%0.335SS..Hα-helixtrans-64.2-42.3178.6-56.60000111.2L12 D13 R14 I19 L20 K292L12-T16 WeakPolarHBondContact O-CB 3.26Å; L12-T16 PolarHBondContact O-N 2.75Å; L12-T16 PolarHBondContact O-OG1 3.43Å; D13-T16 PolarHBondContact O-N 2.65Å; R14-T16 VanDerWaalsContact C-N 3.34Å; R14-T16 PolarHBondContact O-N 3.11Å; T16-I19 PolarHBondContact O-N 3.03Å; T16-L20 HydrophobicContact CG2-CD1 4.14Å; T16-L20 VanDerWaalsContact O-CG 3.31Å; T16-L20 WeakPolarHBondContact O-CG 3.45Å; T16-L20 PolarHBondContact O-N 2.75Å; T16-K292 PolarHBondContact OG1-NZ 3.18Å
17F93.4Very high90.8Very high138 Ų13866.7 Ų66.761%0.60531%0.312SS*.Hα-helixtrans-58.7-50.2173.6178-100.2000111.7D13 R14 I19 L20 T21D13-F17 WeakPolarHBondContact O-CB 2.73Å; D13-F17 PolarHBondContact O-N 3.35Å; R14-F17 PolarHBondContact O-N 3.01Å; F17-I19 PolarHBondContact O-N 3.03Å; F17-L20 PolarHBondContact O-N 3.05Å; F17-T21 HydrophobicContact CD1-CG2 4.19Å; F17-T21 HydrophobicContact CD2-CG2 4.38Å; F17-T21 HydrophobicContact CE1-CG2 3.78Å; F17-T21 HydrophobicContact CE2-CG2 3.99Å; F17-T21 HydrophobicContact CG-CG2 4.47Å; F17-T21 HydrophobicContact CZ-CG2 3.67Å; F17-T21 WeakPolarHBondContact O-CG2 3.41Å; F17-T21 PolarHBondContact O-N 3.23Å; F17-T21 PolarHBondContact O-OG1 3.39Å
18L93.2Very high91.3Very high75 Ų7563.7 Ų63.739%0.39331%0.311SS..Hα-helixtrans-58.6-45.9178.3-72.3172.5000112.2R14 Q15 L20 T21 L22 L288R14-L18 WeakPolarHBondContact O-CG 3.46Å; R14-L18 PolarHBondContact O-N 3.48Å; Q15-L18 PolarHBondContact O-N 2.74Å; L18-L20 PolarHBondContact O-N 3.03Å; L18-T21 WeakPolarHBondContact CA-OG1 3.39Å; L18-T21 PolarHBondContact O-N 2.84Å; L18-T21 PolarHBondContact O-OG1 2.85Å; L18-L22 WeakPolarHBondContact O-CG 3.09Å; L18-L22 PolarHBondContact O-N 2.96Å; L18-L288 HydrophobicContact CB-CD1 4.17Å
19I91.7Very high91.8Very high10 Ų1065.1 Ų65.15%0.05132%0.319CS..Hα-helixtrans-60-45.7178.2-69.3161.4000111.1Q15 T16 F17 L22 E23 K285 L288 L289 K292Q15-I19 WeakPolarHBondContact O-CD1 2.99Å; Q15-I19 VanDerWaalsContact O-CG1 3.28Å; Q15-I19 WeakPolarHBondContact O-CG1 3.36Å; Q15-I19 PolarHBondContact O-N 2.93Å; T16-I19 PolarHBondContact O-N 3.03Å; F17-I19 PolarHBondContact O-N 3.03Å; I19-L22 PolarHBondContact O-N 3.21Å; I19-E23 WeakPolarHBondContact O-CG 3.06Å; I19-E23 PolarHBondContact O-N 3.16Å; I19-K285 HydrophobicContact CG2-CG 4.44Å; I19-L288 HydrophobicContact CD1-CB 4.42Å; I19-L288 HydrophobicContact CG1-CB 4.06Å; I19-L289 HydrophobicContact CD1-CD2 3.8Å; I19-L289 HydrophobicContact CD1-CG 4.12Å; I19-L289 HydrophobicContact CG1-CG 4.5Å; I19-L289 HydrophobicContact CG2-CD2 4.25Å; I19-L289 HydrophobicContact CG2-CG 4.45Å; I19-K292 HydrophobicContact CD1-CD 3.96Å
20L91.4Very high92.2Very high69 Ų6961.1 Ų61.136%0.36130%0.297SS..Hα-helixtrans-63.5-42.9177.7-71.1170.3000111.5T16 F17 L18 L22 E23 W24T16-L20 HydrophobicContact CG2-CD1 4.14Å; T16-L20 VanDerWaalsContact O-CG 3.31Å; T16-L20 WeakPolarHBondContact O-CG 3.45Å; T16-L20 PolarHBondContact O-N 2.75Å; F17-L20 PolarHBondContact O-N 3.05Å; L18-L20 PolarHBondContact O-N 3.03Å; L20-L22 VanDerWaalsContact C-N 3.3Å; L20-L22 PolarHBondContact O-N 3.04Å; L20-E23 WeakPolarHBondContact O-CB 3.22Å; L20-E23 PolarHBondContact O-N 3.23Å; L20-W24 PolarHBondContact O-N 3.12Å
21T93.9Very high92.5Very high44 Ų4463.9 Ų63.927%0.2731%0.306SS..Hα-helixtrans-61.7-38.517759.40000112.2F17 L18 W24 M25F17-T21 HydrophobicContact CD1-CG2 4.19Å; F17-T21 HydrophobicContact CD2-CG2 4.38Å; F17-T21 HydrophobicContact CE1-CG2 3.78Å; F17-T21 HydrophobicContact CE2-CG2 3.99Å; F17-T21 HydrophobicContact CG-CG2 4.47Å; F17-T21 HydrophobicContact CZ-CG2 3.67Å; F17-T21 WeakPolarHBondContact O-CG2 3.41Å; F17-T21 PolarHBondContact O-N 3.23Å; F17-T21 PolarHBondContact O-OG1 3.39Å; L18-T21 WeakPolarHBondContact CA-OG1 3.39Å; L18-T21 PolarHBondContact O-N 2.84Å; L18-T21 PolarHBondContact O-OG1 2.85Å; T21-W24 PolarHBondContact O-N 3.45Å; T21-M25 WeakPolarHBondContact O-CG 3.25Å; T21-M25 PolarHBondContact O-N 2.91Å
22L93.5Very high92.7Very high14 Ų1467.5 Ų67.57%0.07332%0.321CS..Hα-helixtrans-64.8-41.4174.9-70.4163.3000111.8L18 I19 L20 W24 M25 I26 L281 V284 K285 L288L18-L22 WeakPolarHBondContact O-CG 3.09Å; L18-L22 PolarHBondContact O-N 2.96Å; I19-L22 PolarHBondContact O-N 3.21Å; L20-L22 VanDerWaalsContact C-N 3.3Å; L20-L22 PolarHBondContact O-N 3.04Å; L22-W24 PolarHBondContact O-N 3.5Å; L22-M25 HydrophobicContact CD2-CE 3.56Å; L22-M25 HydrophobicContact CG-CE 4.15Å; L22-M25 PolarHBondContact O-N 3.23Å; L22-I26 VanDerWaalsContact O-CG1 3.24Å; L22-I26 WeakPolarHBondContact O-CG1 3.47Å; L22-I26 PolarHBondContact O-N 3.17Å; L22-L281 HydrophobicContact CD2-CD2 3.77Å; L22-V284 HydrophobicContact CD1-CG1 3.89Å; L22-V284 HydrophobicContact CD2-CG1 4.37Å; L22-K285 HydrophobicContact CB-CB 4.35Å; L22-K285 HydrophobicContact CD1-CB 4.2Å; L22-L288 HydrophobicContact CD1-CD1 3.62Å
23E91.2Very high93Very high41 Ų4166.1 Ų66.119%0.19231%0.314CS..Hα-helixtrans-60.1-44.5174.9-73.1-176.8159.700112.3I19 L20 I26 A27 K285I19-E23 WeakPolarHBondContact O-CG 3.06Å; I19-E23 PolarHBondContact O-N 3.16Å; L20-E23 WeakPolarHBondContact O-CB 3.22Å; L20-E23 PolarHBondContact O-N 3.23Å; E23-I26 PolarHBondContact O-N 3.43Å; E23-A27 WeakPolarHBondContact O-CB 3.47Å; E23-A27 PolarHBondContact O-N 3.27Å; E23-K285 HydrophobicContact CG-CD 4.03Å; E23-K285 VanDerWaalsContact CG-CE 3.5Å; E23-K285 VanDerWaalsContact CG-NZ 3.32Å; E23-K285 WeakPolarHBondContact OE1-CE 3.48Å; E23-K285 IonicContact OE1-NZ 3.2Å; E23-K285 PolarHBondContact OE1-NZ 3.38Å
24W93Very high93.3Very high186 Ų18662.3 Ų62.371%0.70529%0.293SS*.Hα-helixtrans-61.7-45.2176-82.6104.4000112L20 T21 L22 I26 A27 T28L20-W24 PolarHBondContact O-N 3.12Å; T21-W24 PolarHBondContact O-N 3.45Å; L22-W24 PolarHBondContact O-N 3.5Å; W24-I26 PolarHBondContact O-N 3.25Å; W24-A27 PolarHBondContact O-N 2.58Å; W24-T28 PolarHBondContact O-N 3.25Å; W24-T28 PolarHBondContact O-OG1 2.97Å
25M95.6Very high93.4Very high84 Ų8459.2 Ų59.241%0.41429%0.287SS..Hα-helixtrans-61.3-44.1177-71.7-172.6-66.900112.2T21 L22 A27 T28 I29 L281T21-M25 WeakPolarHBondContact O-CG 3.25Å; T21-M25 PolarHBondContact O-N 2.91Å; L22-M25 HydrophobicContact CD2-CE 3.56Å; L22-M25 HydrophobicContact CG-CE 4.15Å; L22-M25 PolarHBondContact O-N 3.23Å; M25-A27 VanDerWaalsContact C-N 3.34Å; M25-A27 PolarHBondContact O-N 3.31Å; M25-T28 PolarHBondContact O-N 2.84Å; M25-I29 WeakPolarHBondContact O-CG1 3.44Å; M25-I29 PolarHBondContact O-N 3.48Å; M25-L281 HydrophobicContact CB-CD1 3.94Å; M25-L281 HydrophobicContact CE-CD2 3.98Å
26I93.3Very high93.5Very high0 Ų059.2 Ų59.20%029%0.287CS..Hα-helixtrans-60.6-45.4175.7-65.5165.4000110L22 E23 W24 T28 I29 T30 I108 L112 T278 L281 K285L22-I26 VanDerWaalsContact O-CG1 3.24Å; L22-I26 WeakPolarHBondContact O-CG1 3.47Å; L22-I26 PolarHBondContact O-N 3.17Å; E23-I26 PolarHBondContact O-N 3.43Å; W24-I26 PolarHBondContact O-N 3.25Å; I26-T28 PolarHBondContact O-N 2.02Å; I26-I29 PolarHBondContact O-N 3.02Å; I26-T30 WeakPolarHBondContact O-CB 3.48Å; I26-T30 PolarHBondContact O-N 3.12Å; I26-T30 PolarHBondContact O-OG1 3.25Å; I26-I108 HydrophobicContact CG2-CG2 4.25Å; I26-L112 HydrophobicContact CB-CD1 4.43Å; I26-L112 HydrophobicContact CG2-CD1 3.89Å; I26-T278 HydrophobicContact CG2-CG2 4.29Å; I26-L281 HydrophobicContact CD1-CB 4.08Å; I26-L281 HydrophobicContact CG1-CB 3.7Å; I26-L281 HydrophobicContact CG1-CD1 4.12Å; I26-K285 HydrophobicContact CD1-CD 4.38Å
27A93.6Very high93.6Very high24 Ų2457 Ų5720%0.19827%0.274CS..Hα-helixtrans-61.9-43.7178.900000112.2E23 W24 M25 T30 F31 L112E23-A27 WeakPolarHBondContact O-CB 3.47Å; E23-A27 PolarHBondContact O-N 3.27Å; W24-A27 PolarHBondContact O-N 2.58Å; M25-A27 VanDerWaalsContact C-N 3.34Å; M25-A27 PolarHBondContact O-N 3.31Å; A27-T30 PolarHBondContact O-N 3.06Å; A27-F31 WeakPolarHBondContact O-CB 3.42Å; A27-F31 PolarHBondContact O-N 3.31Å; A27-L112 HydrophobicContact CB-CD1 4.11Å
28T94.6Very high93.6Very high90 Ų9053.7 Ų53.755%0.55227%0.265SS*.Hα-helixtrans-62.7-45.7177.8-57.10000111.9W24 M25 I26 T30 F31 Y32W24-T28 PolarHBondContact O-N 3.25Å; W24-T28 PolarHBondContact O-OG1 2.97Å; M25-T28 PolarHBondContact O-N 2.84Å; I26-T28 PolarHBondContact O-N 2.02Å; T28-T30 VanDerWaalsContact C-N 3.34Å; T28-F31 PolarHBondContact O-N 3.27Å; T28-Y32 PolarHBondContact O-N 2.93Å
29I94.9Very high93.6Very high36 Ų3657.1 Ų57.119%0.18527%0.273CS..Hα-helixtrans-64.1-42.5177.2-66.7165000110.4M25 I26 F31 Y32 I33 I277 T278 L281M25-I29 WeakPolarHBondContact O-CG1 3.44Å; M25-I29 PolarHBondContact O-N 3.48Å; I26-I29 PolarHBondContact O-N 3.02Å; I29-F31 VanDerWaalsContact C-N 3.33Å; I29-F31 PolarHBondContact O-N 3.17Å; I29-Y32 WeakPolarHBondContact O-CB 3.46Å; I29-Y32 PolarHBondContact O-N 3.28Å; I29-I33 HydrophobicContact CG2-CD1 4.05Å; I29-I33 HydrophobicContact CG2-CG1 4.44Å; I29-I33 WeakPolarHBondContact O-CG1 2.92Å; I29-I33 PolarHBondContact O-N 3.49Å; I29-I277 HydrophobicContact CD1-CG2 3.52Å; I29-T278 WeakPolarHBondContact CG2-OG1 3.28Å; I29-L281 HydrophobicContact CD1-CD1 3.59Å
30T93.6Very high93.6Very high1 Ų156.7 Ų56.71%0.00627%0.27CS..Hα-helixtrans-61.5-42.3177.9-55.60000111.2I26 A27 T28 I33 I34 A105 I108 L109I26-T30 WeakPolarHBondContact O-CB 3.48Å; I26-T30 PolarHBondContact O-N 3.12Å; I26-T30 PolarHBondContact O-OG1 3.25Å; A27-T30 PolarHBondContact O-N 3.06Å; T28-T30 VanDerWaalsContact C-N 3.34Å; T30-I33 PolarHBondContact O-N 3.41Å; T30-I34 HydrophobicContact CG2-CD1 4.38Å; T30-I34 WeakPolarHBondContact O-CG1 3.19Å; T30-I34 PolarHBondContact O-N 3.31Å; T30-A105 HydrophobicContact CG2-CB 3.91Å; T30-A105 WeakPolarHBondContact CG2-O 3.37Å; T30-I108 HydrophobicContact CG2-CB 4.14Å; T30-I108 HydrophobicContact CG2-CG2 4.03Å; T30-L109 HydrophobicContact CG2-CB 4.48Å
31F95.1Very high93.7Very high122 Ų12254.3 Ų54.354%0.53526%0.258SS..Hα-helixtrans-64.4-40.3176-171.3-105.7000112.1A27 T28 I29 I34 I35A27-F31 WeakPolarHBondContact O-CB 3.42Å; A27-F31 PolarHBondContact O-N 3.31Å; T28-F31 PolarHBondContact O-N 3.27Å; I29-F31 VanDerWaalsContact C-N 3.33Å; I29-F31 PolarHBondContact O-N 3.17Å; F31-I34 PolarHBondContact O-N 3.07Å; F31-I35 HydrophobicContact CD1-CD1 3.7Å; F31-I35 HydrophobicContact CE1-CD1 3.33Å; F31-I35 HydrophobicContact CE1-CG1 4.25Å; F31-I35 HydrophobicContact CZ-CD1 3.93Å; F31-I35 HydrophobicContact CZ-CG1 4.49Å; F31-I35 WeakPolarHBondContact O-CG1 3.02Å; F31-I35 PolarHBondContact O-N 3.19Å
32Y94.6Very high93.5Very high114 Ų11457.5 Ų57.545%0.44727%0.272SS..Hα-helixtrans-60.9-44.8172.9175.1-96.7000112.2T28 I29 I34 I35 M36T28-Y32 PolarHBondContact O-N 2.93Å; I29-Y32 WeakPolarHBondContact O-CB 3.46Å; I29-Y32 PolarHBondContact O-N 3.28Å; Y32-I34 VanDerWaalsContact C-N 3.3Å; Y32-I34 PolarHBondContact O-N 3.32Å; Y32-I35 PolarHBondContact O-N 2.86Å; Y32-M36 HydrophobicContact CD1-CG 4.23Å; Y32-M36 HydrophobicContact CD2-CG 4.31Å; Y32-M36 HydrophobicContact CE1-CG 3.72Å; Y32-M36 HydrophobicContact CE2-CG 3.81Å; Y32-M36 HydrophobicContact CE2-SD 4.28Å; Y32-M36 VanDerWaalsContact CZ-CG 3.49Å; Y32-M36 WeakPolarHBondContact O-CG 3.18Å; Y32-M36 PolarHBondContact O-N 3.18Å
33I94.4Very high93.3Very high9 Ų957.9 Ų57.95%0.04628%0.28CS..Hα-helixtrans-57.9-43.7175-68.2167.8000110.6I29 T30 I35 M36 A37 I101 A105 Y271I29-I33 HydrophobicContact CG2-CD1 4.05Å; I29-I33 HydrophobicContact CG2-CG1 4.44Å; I29-I33 WeakPolarHBondContact O-CG1 2.92Å; I29-I33 PolarHBondContact O-N 3.49Å; T30-I33 PolarHBondContact O-N 3.41Å; I33-I35 PolarHBondContact O-N 2.81Å; I33-M36 PolarHBondContact O-N 3.35Å; I33-A37 WeakPolarHBondContact O-CB 3.34Å; I33-A37 PolarHBondContact O-N 2.71Å; I33-I101 HydrophobicContact CG2-CG2 3.51Å; I33-A105 HydrophobicContact CG2-CB 4.13Å; I33-Y271 HydrophobicContact CG2-CE1 4.41Å
34I95.5Very high93.3Very high29 Ų2956 Ų5615%0.14927%0.271CS..Hα-helixtrans-60.6-46.6178.5-71166.1000111.1T30 F31 Y32 T38 L102 A105 I106 L109T30-I34 HydrophobicContact CG2-CD1 4.38Å; T30-I34 WeakPolarHBondContact O-CG1 3.19Å; T30-I34 PolarHBondContact O-N 3.31Å; F31-I34 PolarHBondContact O-N 3.07Å; Y32-I34 VanDerWaalsContact C-N 3.3Å; Y32-I34 PolarHBondContact O-N 3.32Å; I34-T38 WeakPolarHBondContact O-CB 3.44Å; I34-T38 PolarHBondContact O-N 3.5Å; I34-T38 PolarHBondContact O-OG1 3.49Å; I34-L102 HydrophobicContact CB-CD1 4.35Å; I34-L102 HydrophobicContact CG1-CD1 4.28Å; I34-L102 HydrophobicContact CG2-CD1 4Å; I34-A105 HydrophobicContact CD1-CB 4.22Å; I34-A105 HydrophobicContact CG1-CB 3.65Å; I34-I106 HydrophobicContact CD1-CG1 4.45Å; I34-L109 HydrophobicContact CD1-CD2 4.44Å
35I94.3Very high93.2Very high90 Ų9050.5 Ų50.546%0.46225%0.254SS..Hα-helixtrans-62.4-48.5179-69.8171.2000110.5F31 Y32 I33 T38 R39F31-I35 HydrophobicContact CD1-CD1 3.7Å; F31-I35 HydrophobicContact CE1-CD1 3.33Å; F31-I35 HydrophobicContact CE1-CG1 4.25Å; F31-I35 HydrophobicContact CZ-CD1 3.93Å; F31-I35 HydrophobicContact CZ-CG1 4.49Å; F31-I35 WeakPolarHBondContact O-CG1 3.02Å; F31-I35 PolarHBondContact O-N 3.19Å; Y32-I35 PolarHBondContact O-N 2.86Å; I33-I35 PolarHBondContact O-N 2.81Å; I35-T38 PolarHBondContact O-N 2.89Å; I35-R39 PolarHBondContact O-N 2.94Å
36M92.5Very high92.8Very high20 Ų2047.7 Ų47.710%0.09925%0.245CC..Hα-helixtrans-64.3-46.8-179.3-74-58.6-6000111.9Y32 I33 T38 R39 D40 I262Y32-M36 HydrophobicContact CD1-CG 4.23Å; Y32-M36 HydrophobicContact CD2-CG 4.31Å; Y32-M36 HydrophobicContact CE1-CG 3.72Å; Y32-M36 HydrophobicContact CE2-CG 3.81Å; Y32-M36 HydrophobicContact CE2-SD 4.28Å; Y32-M36 VanDerWaalsContact CZ-CG 3.49Å; Y32-M36 WeakPolarHBondContact O-CG 3.18Å; Y32-M36 PolarHBondContact O-N 3.18Å; I33-M36 PolarHBondContact O-N 3.35Å; M36-T38 VanDerWaalsContact C-N 3.29Å; M36-T38 PolarHBondContact O-N 3.4Å; M36-R39 WeakPolarHBondContact O-CB 2.98Å; M36-R39 PolarHBondContact O-N 3.32Å; M36-R39 VanDerWaalsContact O-N 3.15Å; M36-D40 WeakPolarHBondContact O-CB 3.46Å; M36-D40 PolarHBondContact O-N 3.05Å; M36-I262 HydrophobicContact CE-CD1 3.85Å
37A93.1Very high92.5Very high1 Ų148.3 Ų48.31%0.00825%0.248CC..Hα-helixtrans-62-39.2177.600000111.6I33 R39 D40 I41 I101 L102 Y271I33-A37 WeakPolarHBondContact O-CB 3.34Å; I33-A37 PolarHBondContact O-N 2.71Å; A37-R39 VanDerWaalsContact C-N 3.35Å; A37-D40 PolarHBondContact O-N 2.99Å; A37-I41 VanDerWaalsContact O-CB 3.29Å; A37-I41 WeakPolarHBondContact O-CB 3.26Å; A37-I41 PolarHBondContact O-N 3.41Å; A37-I101 HydrophobicContact CB-CG2 4.37Å; A37-L102 HydrophobicContact CB-CD1 4.44Å; A37-Y271 WeakPolarHBondContact CA-OH 3.49Å; A37-Y271 HydrophobicContact CB-CE1 4.35Å; A37-Y271 PolarHBondContact N-OH 3.16Å
38T92.9Very high92.3Very high68 Ų6850.1 Ų50.142%0.41725%0.254SS..Hα-helixtrans-67.9-35177-58.60000111.9I34 I35 M36 I41 I42I34-T38 WeakPolarHBondContact O-CB 3.44Å; I34-T38 PolarHBondContact O-N 3.5Å; I34-T38 PolarHBondContact O-OG1 3.49Å; I35-T38 PolarHBondContact O-N 2.89Å; M36-T38 VanDerWaalsContact C-N 3.29Å; M36-T38 PolarHBondContact O-N 3.4Å; T38-I41 WeakPolarHBondContact O-CG2 3.43Å; T38-I42 WeakPolarHBondContact O-CG1 3.48Å
39R92.5Very high92Very high147 Ų14752.8 Ų52.856%0.55526%0.258SS*.Hα-helixtrans-68.8-45.7172.7-179.7-177.1173.9-166.9-5.1111.2I35 M36 A37 I41 I42 S261I35-R39 PolarHBondContact O-N 2.94Å; M36-R39 WeakPolarHBondContact O-CB 2.98Å; M36-R39 PolarHBondContact O-N 3.32Å; M36-R39 VanDerWaalsContact O-N 3.15Å; A37-R39 VanDerWaalsContact C-N 3.35Å; R39-I41 VanDerWaalsContact C-N 3.35Å; R39-I41 PolarHBondContact O-N 2.81Å; R39-I42 PolarHBondContact O-N 3.36Å; R39-S261 PolarHBondContact NE-OG 3.3Å
40D92Very high91.7Very high1 Ų155.3 Ų55.31%0.00527%0.269CS..Hα-helixtrans-74.8-22.8-175.1-71.5-29.1000113.1M36 A37 I42 P44 L98 T260 S261 Y271M36-D40 WeakPolarHBondContact O-CB 3.46Å; M36-D40 PolarHBondContact O-N 3.05Å; A37-D40 PolarHBondContact O-N 2.99Å; D40-I42 VanDerWaalsContact C-N 3.28Å; D40-I42 PolarHBondContact O-N 3.39Å; D40-P44 WeakPolarHBondContact O-CD 3.07Å; D40-L98 HydrophobicContact CB-CD1 3.77Å; D40-L98 HydrophobicContact CB-CD2 4.38Å; D40-T260 HydrophobicContact CB-CG2 4.31Å; D40-S261 WeakPolarHBondContact OD1-CB 3.03Å; D40-S261 PolarHBondContact OD1-N 3.46Å; D40-S261 PolarHBondContact OD1-OG 3.21Å; D40-Y271 PolarHBondContact OD2-OH 3.02Å
41I92.9Very high91.4Very high20 Ų2058 Ų5810%0.10329%0.288CS..THydrogen-bonded Turntrans-75.5-15.6177.8-154.5172.6000113A37 T38 R39 G43 P44 I45 F95 L98A37-I41 VanDerWaalsContact O-CB 3.29Å; A37-I41 WeakPolarHBondContact O-CB 3.26Å; A37-I41 PolarHBondContact O-N 3.41Å; T38-I41 WeakPolarHBondContact O-CG2 3.43Å; R39-I41 VanDerWaalsContact C-N 3.35Å; R39-I41 PolarHBondContact O-N 2.81Å; I41-G43 PolarHBondContact O-N 3.24Å; I41-P44 WeakPolarHBondContact O-CD 3.38Å; I41-I45 HydrophobicContact CD1-CD1 4.4Å; I41-I45 HydrophobicContact CG1-CD1 3.97Å; I41-I45 HydrophobicContact CG1-CG1 4.25Å; I41-I45 HydrophobicContact CG2-CD1 4.08Å; I41-I45 WeakPolarHBondContact O-CB 3.31Å; I41-I45 WeakPolarHBondContact O-CD1 3.4Å; I41-I45 WeakPolarHBondContact O-CG1 3.47Å; I41-I45 PolarHBondContact O-N 2.89Å; I41-I45 VanDerWaalsContact O-N 3.12Å; I41-F95 HydrophobicContact CD1-CD2 4.19Å; I41-F95 HydrophobicContact CD1-CE2 4.03Å; I41-F95 HydrophobicContact CG1-CD2 3.91Å; I41-F95 HydrophobicContact CG1-CE2 4.13Å; I41-L98 HydrophobicContact CB-CB 4.46Å; I41-L98 HydrophobicContact CB-CD1 4.23Å; I41-L98 HydrophobicContact CD1-CB 4.44Å; I41-L98 HydrophobicContact CG1-CB 4.32Å
42I91Very high90.9Very high111 Ų11153.2 Ų53.257%0.56927%0.268SS*.Hα-helixtrans-62.6-44.5178.8-64.5169.5000110.6T38 R39 D40 I45 A46T38-I42 WeakPolarHBondContact O-CG1 3.48Å; R39-I42 PolarHBondContact O-N 3.36Å; D40-I42 VanDerWaalsContact C-N 3.28Å; D40-I42 PolarHBondContact O-N 3.39Å; I42-I45 PolarHBondContact O-N 3.26Å; I42-A46 PolarHBondContact O-N 3.06Å
43G88Confident90.5Very high22 Ų2253.2 Ų53.223%0.22727%0.272CS..Hα-helixtrans-62.1-51.1-178.500000113.3I41 I45 A46 L47 T259I41-G43 PolarHBondContact O-N 3.24Å; G43-I45 VanDerWaalsContact C-N 3.31Å; G43-I45 PolarHBondContact O-N 3.46Å; G43-A46 PolarHBondContact O-N 2.76Å; G43-L47 WeakPolarHBondContact O-CG 3.27Å; G43-L47 PolarHBondContact O-N 2.6Å; G43-T259 CarbonylContact C-O 3.56Å; G43-T259 WeakPolarHBondContact CA-O 3.48Å
44P91.1Very high90.1Very high0 Ų057 Ų570%029%0.292CS..Hα-helixtrans-64.5-34.5176.5-22.836.4000112.6D40 I41 L47 L48 I94 F95 L98 T259D40-P44 WeakPolarHBondContact O-CD 3.07Å; I41-P44 WeakPolarHBondContact O-CD 3.38Å; P44-L47 PolarHBondContact O-N 2.77Å; P44-L48 VanDerWaalsContact O-CB 3.26Å; P44-L48 WeakPolarHBondContact O-CB 3.35Å; P44-L48 WeakPolarHBondContact O-CD1 2.92Å; P44-L48 WeakPolarHBondContact O-CG 3.43Å; P44-L48 PolarHBondContact O-N 3.24Å; P44-I94 HydrophobicContact CG-CB 4.32Å; P44-I94 HydrophobicContact CG-CG2 3.72Å; P44-F95 HydrophobicContact CB-CB 3.8Å; P44-F95 HydrophobicContact CB-CD2 4.45Å; P44-L98 HydrophobicContact CG-CD1 4.49Å; P44-T259 WeakPolarHBondContact CD-O 3.28Å
45I91Very high89.5Confident71 Ų7157.3 Ų57.336%0.36429%0.294SS..Hα-helixtrans-62.5-49.2174.8-73.9170.6000110.6I41 I42 G43 L47 L48 F49 F95I41-I45 HydrophobicContact CD1-CD1 4.4Å; I41-I45 HydrophobicContact CG1-CD1 3.97Å; I41-I45 HydrophobicContact CG1-CG1 4.25Å; I41-I45 HydrophobicContact CG2-CD1 4.08Å; I41-I45 WeakPolarHBondContact O-CB 3.31Å; I41-I45 WeakPolarHBondContact O-CD1 3.4Å; I41-I45 WeakPolarHBondContact O-CG1 3.47Å; I41-I45 PolarHBondContact O-N 2.89Å; I41-I45 VanDerWaalsContact O-N 3.12Å; I42-I45 PolarHBondContact O-N 3.26Å; G43-I45 VanDerWaalsContact C-N 3.31Å; G43-I45 PolarHBondContact O-N 3.46Å; I45-L47 VanDerWaalsContact C-N 3.31Å; I45-L47 PolarHBondContact O-N 3.44Å; I45-L48 PolarHBondContact O-N 2.95Å; I45-F49 HydrophobicContact CB-CD2 4.39Å; I45-F49 HydrophobicContact CG2-CD2 4.07Å; I45-F49 WeakPolarHBondContact O-CB 3.39Å; I45-F49 WeakPolarHBondContact O-CD2 3.35Å; I45-F49 PolarHBondContact O-N 3.02Å; I45-F95 HydrophobicContact CD1-CE2 4.18Å; I45-F95 HydrophobicContact CG1-CD2 3.92Å; I45-F95 HydrophobicContact CG1-CE2 3.62Å
46A88.4Confident89.1Confident26 Ų2653 Ų5322%0.21527%0.272CS..Hα-helixtrans-56.5-48.6176.700000110.4I42 G43 L48 E50I42-A46 PolarHBondContact O-N 3.06Å; G43-A46 PolarHBondContact O-N 2.76Å; A46-L48 VanDerWaalsContact C-N 3.31Å; A46-L48 PolarHBondContact O-N 3.4Å; A46-E50 WeakPolarHBondContact O-CB 3.26Å; A46-E50 PolarHBondContact O-N 3.41Å
47L87.4Confident88.8Confident12 Ų1257.6 Ų57.66%0.06329%0.293CS..Hα-helixtrans-66.8-26.2-178.9-68.1171.8000114.7G43 P44 I45 L55 F83 P91 F257 T259G43-L47 WeakPolarHBondContact O-CG 3.27Å; G43-L47 PolarHBondContact O-N 2.6Å; P44-L47 PolarHBondContact O-N 2.77Å; I45-L47 VanDerWaalsContact C-N 3.31Å; I45-L47 PolarHBondContact O-N 3.44Å; L47-L55 HydrophobicContact CD2-CD1 3.71Å; L47-L55 HydrophobicContact CD2-CD2 3.78Å; L47-L55 HydrophobicContact CD2-CG 4.37Å; L47-F83 HydrophobicContact CB-CZ 4.06Å; L47-F83 HydrophobicContact CD2-CE2 3.87Å; L47-F83 HydrophobicContact CD2-CZ 3.78Å; L47-F83 VanDerWaalsContact O-CE1 3.25Å; L47-F83 WeakPolarHBondContact O-CE1 3.5Å; L47-F83 VanDerWaalsContact O-CZ 3.27Å; L47-F83 WeakPolarHBondContact O-CZ 3.45Å; L47-P91 HydrophobicContact CB-CB 4.22Å; L47-P91 HydrophobicContact CB-CG 4.43Å; L47-P91 HydrophobicContact CD1-CB 4.44Å; L47-P91 HydrophobicContact CD1-CG 4.24Å; L47-F257 HydrophobicContact CD1-CB 4.42Å; L47-F257 HydrophobicContact CD2-CB 3.78Å; L47-F257 HydrophobicContact CD2-CD1 4.06Å; L47-F257 HydrophobicContact CD2-CG 3.95Å; L47-T259 HydrophobicContact CD1-CG2 3.48Å; L47-T259 VanDerWaalsContact CD1-CG2 3.48Å
48L88.9Confident88.3Confident63 Ų6359.7 Ų59.733%0.3332%0.315SS..Hα-helixtrans-94.6-32.5-177.5-70172.1000113.5P44 I45 A46 P91 T92 F95P44-L48 VanDerWaalsContact O-CB 3.26Å; P44-L48 WeakPolarHBondContact O-CB 3.35Å; P44-L48 WeakPolarHBondContact O-CD1 2.92Å; P44-L48 WeakPolarHBondContact O-CG 3.43Å; P44-L48 PolarHBondContact O-N 3.24Å; I45-L48 PolarHBondContact O-N 2.95Å; A46-L48 VanDerWaalsContact C-N 3.31Å; A46-L48 PolarHBondContact O-N 3.4Å; L48-P91 HydrophobicContact CD2-CB 4.18Å; L48-P91 HydrophobicContact CG-CB 4.2Å; L48-T92 WeakPolarHBondContact CD2-OG1 3.44Å; L48-F95 HydrophobicContact CD1-CB 3.65Å; L48-F95 HydrophobicContact CD1-CD1 4.11Å; L48-F95 HydrophobicContact CD1-CD2 4.42Å; L48-F95 HydrophobicContact CD1-CG 3.8Å
49F88.2Confident88Confident145 Ų14556.8 Ų56.864%0.63630%0.297SS*.Hα-helixtrans-119.8-18.1-168.2-59.2-72.4000114.2I45 F95I45-F49 HydrophobicContact CB-CD2 4.39Å; I45-F49 HydrophobicContact CG2-CD2 4.07Å; I45-F49 WeakPolarHBondContact O-CB 3.39Å; I45-F49 WeakPolarHBondContact O-CD2 3.35Å; I45-F49 PolarHBondContact O-N 3.02Å; F49-F95 HydrophobicContact CE2-CE2 4.31Å; F49-F95 HydrophobicContact CE2-CZ 4.17Å
50E88Confident87.7Confident90 Ų9051 Ų5142%0.42128%0.276SS..SBendtrans-74.6151.8176.8-164.4162.7-164.500111.3A46 N54A46-E50 WeakPolarHBondContact O-CB 3.26Å; A46-E50 PolarHBondContact O-N 3.41Å; E50-N54 HydrophobicContact CG-CB 3.76Å; E50-N54 WeakPolarHBondContact OE1-CB 3.12Å
51S88Confident87.5Confident56 Ų5656.6 Ų56.639%0.39230%0.301SS..  trans-65.6143.1173.466.20000109.8E53 N54 L55S51-E53 PolarHBondContact O-N 2.74Å; S51-N54 PolarHBondContact O-N 3.03Å; S51-N54 VanDerWaalsContact O-N 3.14Å; S51-N54 WeakPolarHBondContact OG-CB 3.23Å; S51-N54 PolarHBondContact OG-N 3.43Å; S51-N54 PolarHBondContact OG-ND2 3.2Å; S51-L55 PolarHBondContact O-N 3.32Å
52L84.8Confident87Confident22 Ų2258 Ų5812%0.11531%0.31CS..Hα-helixtrans-56.5-41.4176-70.2168000110.5N54 L55 F56 F74 P79 R80 F83L52-N54 VanDerWaalsContact C-N 3.32Å; L52-N54 PolarHBondContact O-N 3.09Å; L52-L55 WeakPolarHBondContact O-CB 3.02Å; L52-L55 PolarHBondContact O-N 2.66Å; L52-L55 VanDerWaalsContact O-N 3.14Å; L52-F56 HydrophobicContact CB-CD2 4.31Å; L52-F56 HydrophobicContact CD2-CD2 4.49Å; L52-F56 HydrophobicContact CD2-CE2 3.97Å; L52-F56 WeakPolarHBondContact O-CB 3.22Å; L52-F56 WeakPolarHBondContact O-CD2 3.07Å; L52-F56 PolarHBondContact O-N 3.28Å; L52-F74 HydrophobicContact CB-CB 4.16Å; L52-F74 HydrophobicContact CB-CD1 3.95Å; L52-F74 HydrophobicContact CB-CG 4.44Å; L52-P79 HydrophobicContact CD1-CB 4.17Å; L52-P79 HydrophobicContact CD1-CG 4.49Å; L52-R80 HydrophobicContact CD1-CB 4.37Å; L52-R80 HydrophobicContact CD1-CG 3.62Å; L52-F83 HydrophobicContact CD2-CB 3.71Å; L52-F83 HydrophobicContact CD2-CD1 3.94Å; L52-F83 HydrophobicContact CD2-CD2 3.93Å; L52-F83 HydrophobicContact CD2-CG 3.56Å
53E85.6Confident86.7Confident115 Ų11552.7 Ų52.754%0.53728%0.283SS..Hα-helixtrans-55.1-45177.2-173.1-179.8176.200113S51 F56 H57 F74S51-E53 PolarHBondContact O-N 2.74Å; E53-F56 CarbonylContact O-C 3.56Å; E53-F56 PolarHBondContact O-N 2.79Å; E53-H57 PolarHBondContact O-N 2.81Å; E53-F74 HydrophobicContact CB-CB 4.28Å; E53-F74 HydrophobicContact CB-CD2 3.95Å; E53-F74 HydrophobicContact CB-CG 4.16Å; E53-F74 HydrophobicContact CG-CD2 4.1Å; E53-F74 HydrophobicContact CG-CE2 4.43Å
54N86.1Confident86.6Confident88 Ų8853.7 Ų53.747%0.47128%0.283SS..Hα-helixtrans-68.3-41.4177.6-73.1-2.6000111.5E50 S51 L52 F56 H57E50-N54 HydrophobicContact CG-CB 3.76Å; E50-N54 WeakPolarHBondContact OE1-CB 3.12Å; S51-N54 PolarHBondContact O-N 3.03Å; S51-N54 VanDerWaalsContact O-N 3.14Å; S51-N54 WeakPolarHBondContact OG-CB 3.23Å; S51-N54 PolarHBondContact OG-N 3.43Å; S51-N54 PolarHBondContact OG-ND2 3.2Å; L52-N54 VanDerWaalsContact C-N 3.32Å; L52-N54 PolarHBondContact O-N 3.09Å; N54-F56 VanDerWaalsContact C-N 3.26Å; N54-F56 PolarHBondContact O-N 2.72Å; N54-H57 WeakPolarHBondContact O-CB 3.43Å; N54-H57 PolarHBondContact O-N 2.75Å; N54-H57 VanDerWaalsContact O-N 3.08Å
55L83.1Confident86.1Confident36 Ų3659.5 Ų59.519%0.18831%0.31CS..Hα-helixtrans-61.1-38.3177.5-171.474.5000111.8L47 S51 L52 F83 F257L47-L55 HydrophobicContact CD2-CD1 3.71Å; L47-L55 HydrophobicContact CD2-CD2 3.78Å; L47-L55 HydrophobicContact CD2-CG 4.37Å; S51-L55 PolarHBondContact O-N 3.32Å; L52-L55 WeakPolarHBondContact O-CB 3.02Å; L52-L55 PolarHBondContact O-N 2.66Å; L52-L55 VanDerWaalsContact O-N 3.14Å; L55-F83 HydrophobicContact CD2-CD2 3.89Å; L55-F83 HydrophobicContact CD2-CE2 3.25Å; L55-F83 HydrophobicContact CD2-CZ 3.83Å; L55-F257 HydrophobicContact CD1-CD1 4.21Å; L55-F257 HydrophobicContact CD1-CE1 4.2Å; L55-F257 HydrophobicContact CD2-CD1 4.11Å; L55-F257 HydrophobicContact CD2-CE1 3.8Å; L55-F257 HydrophobicContact CD2-CZ 4.03Å; L55-F257 HydrophobicContact CG-CD1 4.11Å; L55-F257 HydrophobicContact CG-CE1 3.66Å; L55-F257 HydrophobicContact CG-CZ 4.26Å
56F85Confident85.4Confident0 Ų058.5 Ų58.50%030%0.304CS..THydrogen-bonded Turntrans-89.24.1177.6-73.7-83.8000113L52 E53 N54 G58 I59 I60 F74 F83 F172 F257L52-F56 HydrophobicContact CB-CD2 4.31Å; L52-F56 HydrophobicContact CD2-CD2 4.49Å; L52-F56 HydrophobicContact CD2-CE2 3.97Å; L52-F56 WeakPolarHBondContact O-CB 3.22Å; L52-F56 WeakPolarHBondContact O-CD2 3.07Å; L52-F56 PolarHBondContact O-N 3.28Å; E53-F56 CarbonylContact O-C 3.56Å; E53-F56 PolarHBondContact O-N 2.79Å; N54-F56 VanDerWaalsContact C-N 3.26Å; N54-F56 PolarHBondContact O-N 2.72Å; F56-G58 VanDerWaalsContact C-N 3.33Å; F56-G58 PolarHBondContact O-N 3.43Å; F56-I59 HydrophobicContact CD1-CB 4.23Å; F56-I59 HydrophobicContact CD1-CD1 3.35Å; F56-I59 HydrophobicContact CD1-CG1 4.34Å; F56-I59 HydrophobicContact CD1-CG2 4.33Å; F56-I59 HydrophobicContact CE1-CD1 3.7Å; F56-I59 HydrophobicContact CG-CD1 4.39Å; F56-I59 CarbonylContact O-C 3.5Å; F56-I59 WeakPolarHBondContact O-CA 3.32Å; F56-I59 WeakPolarHBondContact O-CB 3.34Å; F56-I59 PolarHBondContact O-N 3.45Å; F56-I60 HydrophobicContact CB-CD1 4.42Å; F56-I60 WeakPolarHBondContact O-CG1 3.16Å; F56-I60 PolarHBondContact O-N 2.03Å; F56-F74 HydrophobicContact CB-CE1 3.8Å; F56-F74 HydrophobicContact CB-CZ 4.01Å; F56-F74 HydrophobicContact CD2-CD1 4.38Å; F56-F74 AromaticContact CD2-CE1 3.94Å; F56-F74 HydrophobicContact CD2-CE1 3.94Å; F56-F74 AromaticContact CG-CE1 3.94Å; F56-F74 HydrophobicContact CG-CE1 3.94Å; F56-F83 HydrophobicContact CE2-CD2 4.25Å; F56-F83 HydrophobicContact CZ-CD2 4.37Å; F56-F172 AromaticContact CD1-CE2 3.68Å; F56-F172 HydrophobicContact CD1-CE2 3.68Å; F56-F172 HydrophobicContact CD1-CZ 4.09Å; F56-F172 AromaticContact CD2-CE2 3.88Å; F56-F172 HydrophobicContact CD2-CE2 3.88Å; F56-F172 HydrophobicContact CD2-CZ 4.26Å; F56-F172 AromaticContact CE1-CE2 3.52Å; F56-F172 HydrophobicContact CE1-CE2 3.52Å; F56-F172 AromaticContact CE1-CZ 3.42Å; F56-F172 HydrophobicContact CE1-CZ 3.42Å; F56-F172 VanDerWaalsContact CE1-CZ 3.42Å; F56-F172 AromaticContact CE2-CE2 3.78Å; F56-F172 HydrophobicContact CE2-CE2 3.78Å; F56-F172 AromaticContact CE2-CZ 3.67Å; F56-F172 HydrophobicContact CE2-CZ 3.67Å; F56-F172 AromaticContact CG-CE2 3.91Å; F56-F172 HydrophobicContact CG-CE2 3.91Å; F56-F172 HydrophobicContact CZ-CE1 4.41Å; F56-F172 AromaticContact CZ-CE2 3.63Å; F56-F172 HydrophobicContact CZ-CE2 3.63Å; F56-F172 AromaticContact CZ-CZ 3.24Å; F56-F172 HydrophobicContact CZ-CZ 3.24Å; F56-F257 HydrophobicContact CD1-CZ 4.02Å; F56-F257 AromaticContact CE1-CE2 3.82Å; F56-F257 HydrophobicContact CE1-CE2 3.82Å; F56-F257 AromaticContact CE1-CZ 3.35Å; F56-F257 HydrophobicContact CE1-CZ 3.35Å; F56-F257 HydrophobicContact CE2-CE2 4.37Å; F56-F257 AromaticContact CE2-CZ 3.96Å; F56-F257 HydrophobicContact CE2-CZ 3.96Å; F56-F257 HydrophobicContact CZ-CE1 4.45Å; F56-F257 AromaticContact CZ-CE2 3.47Å; F56-F257 HydrophobicContact CZ-CE2 3.47Å; F56-F257 VanDerWaalsContact CZ-CE2 3.47Å; F56-F257 AromaticContact CZ-CZ 3.25Å; F56-F257 HydrophobicContact CZ-CZ 3.25Å
57H86.3Confident84.8Confident115 Ų11557.9 Ų57.953%0.53230%0.296SS..Hα-helixtrans-58.7-42.5-174.7-174.476.5000112.8E53 N54 I59 I60 K61E53-H57 PolarHBondContact O-N 2.81Å; N54-H57 WeakPolarHBondContact O-CB 3.43Å; N54-H57 PolarHBondContact O-N 2.75Å; N54-H57 VanDerWaalsContact O-N 3.08Å; H57-I59 VanDerWaalsContact C-N 3.29Å; H57-I59 PolarHBondContact O-N 2.99Å; H57-I60 PolarHBondContact O-N 3.48Å; H57-K61 WeakPolarHBondContact O-CB 3.11Å; H57-K61 PolarHBondContact O-N 3.44Å
58G83.5Confident84.1Confident46 Ų4662.8 Ų62.847%0.47432%0.321SS..Hα-helixtrans-64.1-34.9175.200000113F56 T62F56-G58 VanDerWaalsContact C-N 3.33Å; F56-G58 PolarHBondContact O-N 3.43Å; G58-T62 WeakPolarHBondContact O-CB 3.48Å; G58-T62 PolarHBondContact O-N 3.15Å; G58-T62 VanDerWaalsContact O-N 3.09Å; G58-T62 PolarHBondContact O-OG1 3.38Å
59I86Confident83.6Confident7 Ų767.7 Ų67.74%0.03634%0.34CS..Hα-helixtrans-68.8-50.2177-70.8168000110.2F56 H57 K61 T62 V63 L175 Y179 I256 F257F56-I59 HydrophobicContact CD1-CB 4.23Å; F56-I59 HydrophobicContact CD1-CD1 3.35Å; F56-I59 HydrophobicContact CD1-CG1 4.34Å; F56-I59 HydrophobicContact CD1-CG2 4.33Å; F56-I59 HydrophobicContact CE1-CD1 3.7Å; F56-I59 HydrophobicContact CG-CD1 4.39Å; F56-I59 CarbonylContact O-C 3.5Å; F56-I59 WeakPolarHBondContact O-CA 3.32Å; F56-I59 WeakPolarHBondContact O-CB 3.34Å; F56-I59 PolarHBondContact O-N 3.45Å; H57-I59 VanDerWaalsContact C-N 3.29Å; H57-I59 PolarHBondContact O-N 2.99Å; I59-K61 VanDerWaalsContact C-N 3.31Å; I59-K61 PolarHBondContact O-N 3.2Å; I59-T62 PolarHBondContact O-N 3.24Å; I59-V63 WeakPolarHBondContact O-CG2 3.4Å; I59-V63 PolarHBondContact O-N 3.25Å; I59-L175 HydrophobicContact CG2-CD1 4.18Å; I59-L175 HydrophobicContact CG2-CD2 4.43Å; I59-L175 HydrophobicContact CG2-CG 4.06Å; I59-Y179 HydrophobicContact CB-CD2 4.09Å; I59-Y179 HydrophobicContact CB-CE2 4.35Å; I59-Y179 HydrophobicContact CB-CG 4.23Å; I59-Y179 HydrophobicContact CD1-CD1 4.12Å; I59-Y179 HydrophobicContact CD1-CE1 4.05Å; I59-Y179 HydrophobicContact CG1-CD1 3.87Å; I59-Y179 HydrophobicContact CG1-CD2 3.86Å; I59-Y179 HydrophobicContact CG1-CE1 3.77Å; I59-Y179 HydrophobicContact CG1-CE2 3.75Å; I59-Y179 HydrophobicContact CG1-CG 3.91Å; I59-Y179 HydrophobicContact CG2-CD1 4.23Å; I59-Y179 HydrophobicContact CG2-CD2 3.86Å; I59-Y179 HydrophobicContact CG2-CG 3.64Å; I59-I256 HydrophobicContact CD1-CG2 3.88Å; I59-F257 HydrophobicContact CD1-CE1 4.46Å; I59-F257 HydrophobicContact CD1-CZ 4.09Å
60I86.8Confident83.4Confident24 Ų2461.6 Ų61.612%0.12332%0.315CS..Hα-helixtrans-54.5-50.1176.5-67.2165.4000109.8F56 H57 T62 V63 D64 F74 L175F56-I60 HydrophobicContact CB-CD1 4.42Å; F56-I60 WeakPolarHBondContact O-CG1 3.16Å; F56-I60 PolarHBondContact O-N 2.03Å; H57-I60 PolarHBondContact O-N 3.48Å; I60-T62 PolarHBondContact O-N 3.02Å; I60-V63 PolarHBondContact O-N 3.36Å; I60-D64 VanDerWaalsContact O-CB 3.3Å; I60-D64 WeakPolarHBondContact O-CB 3.45Å; I60-D64 VanDerWaalsContact O-CG 3.29Å; I60-D64 PolarHBondContact O-N 2.97Å; I60-F74 HydrophobicContact CD1-CE2 3.52Å; I60-F74 HydrophobicContact CD1-CZ 3.59Å; I60-F74 HydrophobicContact CG1-CE2 4.32Å; I60-F74 HydrophobicContact CG1-CZ 4.02Å; I60-L175 HydrophobicContact CG1-CD1 4.46Å; I60-L175 HydrophobicContact CG1-CD2 3.91Å
61K87.2Confident83.2Confident120 Ų12063.4 Ų63.452%0.52233%0.328SS..Hα-helixtrans-58.8-46.1179.5-176.3-178.7173.8-1730112.2H57 I59 V63 D64 E65H57-K61 WeakPolarHBondContact O-CB 3.11Å; H57-K61 PolarHBondContact O-N 3.44Å; I59-K61 VanDerWaalsContact C-N 3.31Å; I59-K61 PolarHBondContact O-N 3.2Å; K61-V63 VanDerWaalsContact C-N 3.32Å; K61-V63 PolarHBondContact O-N 2.86Å; K61-D64 PolarHBondContact O-N 3.35Å; K61-E65 WeakPolarHBondContact CE-OE1 2.99Å; K61-E65 VanDerWaalsContact O-CG 3.31Å; K61-E65 WeakPolarHBondContact O-CG 3.27Å; K61-E65 PolarHBondContact O-N 2.9Å
62T83.5Confident83.1Confident48 Ų4861.7 Ų61.729%0.29432%0.315SS..Hα-helixtrans-63.2-39.7-180-55.30000111.5G58 I59 I60 Q66 Y179G58-T62 WeakPolarHBondContact O-CB 3.48Å; G58-T62 PolarHBondContact O-N 3.15Å; G58-T62 VanDerWaalsContact O-N 3.09Å; G58-T62 PolarHBondContact O-OG1 3.38Å; I59-T62 PolarHBondContact O-N 3.24Å; I60-T62 PolarHBondContact O-N 3.02Å; T62-Q66 WeakPolarHBondContact O-CG 3.1Å; T62-Y179 HydrophobicContact CG2-CD2 4.29Å; T62-Y179 HydrophobicContact CG2-CE2 4.31Å
63V84.4Confident83.1Confident0 Ų065.5 Ų65.50%034%0.336CS..Hα-helixtrans-73.6-43.2177.8174.40000110.8I59 I60 K61 E65 Q66 Y67 T169 L175 N178I59-V63 WeakPolarHBondContact O-CG2 3.4Å; I59-V63 PolarHBondContact O-N 3.25Å; I60-V63 PolarHBondContact O-N 3.36Å; K61-V63 VanDerWaalsContact C-N 3.32Å; K61-V63 PolarHBondContact O-N 2.86Å; V63-E65 PolarHBondContact O-N 2.96Å; V63-Q66 CarbonylContact O-C 3.01Å; V63-Q66 PolarHBondContact O-N 2.94Å; V63-Y67 HydrophobicContact CB-CD2 4.34Å; V63-Y67 HydrophobicContact CG1-CD2 3.61Å; V63-Y67 HydrophobicContact CG1-CE2 4.31Å; V63-Y67 HydrophobicContact CG1-CG 4.29Å; V63-Y67 VanDerWaalsContact O-CD2 3.26Å; V63-Y67 WeakPolarHBondContact O-CD2 3.41Å; V63-Y67 PolarHBondContact O-N 3.15Å; V63-T169 HydrophobicContact CG1-CG2 4.36Å; V63-L175 HydrophobicContact CB-CD1 3.87Å; V63-L175 HydrophobicContact CG1-CD1 3.95Å; V63-L175 HydrophobicContact CG2-CD1 3.89Å; V63-N178 HydrophobicContact CG1-CB 4.4Å; V63-N178 HydrophobicContact CG2-CB 4.5Å
64D85.5Confident83Confident43 Ų4361 Ų6123%0.2331%0.314CS..Hα-helixtrans-63.1-26.5178.2-76.12.2000112.7I60 K61 Q66 S70I60-D64 VanDerWaalsContact O-CB 3.3Å; I60-D64 WeakPolarHBondContact O-CB 3.45Å; I60-D64 VanDerWaalsContact O-CG 3.29Å; I60-D64 PolarHBondContact O-N 2.97Å; K61-D64 PolarHBondContact O-N 3.35Å; D64-Q66 VanDerWaalsContact C-N 3.34Å; D64-S70 VanDerWaalsContact OD1-CB 3.26Å; D64-S70 WeakPolarHBondContact OD1-CB 3.28Å; D64-S70 PolarHBondContact OD1-N 3Å; D64-S70 PolarHBondContact OD1-OG 3.4Å
65E80.2Confident82.9Confident122 Ų12261.8 Ų61.857%0.5732%0.322SS*.Hα-helixtrans-72-27172.7-76.8173.7-171.700112.8K61 V63 N227K61-E65 WeakPolarHBondContact CE-OE1 2.99Å; K61-E65 VanDerWaalsContact O-CG 3.31Å; K61-E65 WeakPolarHBondContact O-CG 3.27Å; K61-E65 PolarHBondContact O-N 2.9Å; V63-E65 PolarHBondContact O-N 2.96Å; E65-N227 PolarHBondContact O-ND2 3.04Å; E65-N227 PolarHBondContact O-OD1 3.41Å; E65-N227 VanDerWaalsContact O-OD1 3.09Å
66Q77.5Confident82.9Confident51 Ų5161.3 Ų61.324%0.23833%0.326CS..Hα-helixtrans-108.9-11.7-173.1-66.7178-600114.7T62 V63 D64 N227T62-Q66 WeakPolarHBondContact O-CG 3.1Å; V63-Q66 CarbonylContact O-C 3.01Å; V63-Q66 PolarHBondContact O-N 2.94Å; D64-Q66 VanDerWaalsContact C-N 3.34Å; Q66-N227 WeakPolarHBondContact CA-OD1 3.03Å; Q66-N227 PolarHBondContact O-OD1 3.26Å
67Y75.3Confident82.8Confident13 Ų1367.8 Ų67.85%0.05136%0.361CS..SBendtrans-140.3-177.9-174.8-57.9-88.5000111.4V63 K69 N178 Q182 I219 S220 L225 N227V63-Y67 HydrophobicContact CB-CD2 4.34Å; V63-Y67 HydrophobicContact CG1-CD2 3.61Å; V63-Y67 HydrophobicContact CG1-CE2 4.31Å; V63-Y67 HydrophobicContact CG1-CG 4.29Å; V63-Y67 VanDerWaalsContact O-CD2 3.26Å; V63-Y67 WeakPolarHBondContact O-CD2 3.41Å; V63-Y67 PolarHBondContact O-N 3.15Å; Y67-K69 PolarHBondContact O-N 3.31Å; Y67-N178 HydrophobicContact CE2-CB 4.18Å; Y67-Q182 WeakPolarHBondContact OH-CG 3.3Å; Y67-I219 HydrophobicContact CE1-CB 4.42Å; Y67-I219 HydrophobicContact CE1-CG2 4.28Å; Y67-S220 WeakPolarHBondContact OH-CA 3.43Å; Y67-S220 WeakPolarHBondContact OH-CB 3.26Å; Y67-L225 HydrophobicContact CE1-CD1 4.03Å; Y67-L225 HydrophobicContact CE2-CD1 4.38Å; Y67-L225 WeakPolarHBondContact OH-CD1 3.32Å; Y67-N227 PolarHBondContact N-OD1 3.32Å
68I72.8Confident82.7Confident115 Ų11566.2 Ų66.259%0.5935%0.354SS*.SBendtrans-61.5136.6166.3-61.8168.9000108.2S70 E168I68-S70 PolarHBondContact O-N 3.33Å; I68-S70 VanDerWaalsContact O-N 3.16Å; I68-E168 HydrophobicContact CD1-CG 4.33Å
69K77.8Confident82.6Confident166 Ų16664.2 Ų64.272%0.72233%0.333SS*.  trans-45.3121.9178.5-173.1176.7-178.11790111Y67Y67-K69 PolarHBondContact O-N 3.31Å
70S83.1Confident82.5Confident16 Ų1669.9 Ų69.911%0.11235%0.354CS..  trans-68145.6-179.7590000111.5D64 I68 T169D64-S70 VanDerWaalsContact OD1-CB 3.26Å; D64-S70 WeakPolarHBondContact OD1-CB 3.28Å; D64-S70 PolarHBondContact OD1-N 3Å; D64-S70 PolarHBondContact OD1-OG 3.4Å; I68-S70 PolarHBondContact O-N 3.33Å; I68-S70 VanDerWaalsContact O-N 3.16Å; S70-T169 WeakPolarHBondContact CA-O 3.4Å
71N84.5Confident82.4Confident129 Ų12974.5 Ų74.569%0.6937%0.373SS*.  trans-134.781174.6-176.728.2000108T169N71-T169 PolarHBondContact N-O 2.97Å
72V85.7Confident82Confident19 Ų1968.9 Ų68.912%0.11535%0.349CS..  trans-111127.1-173.9177.50000109.1F74 T169 F172 L175V72-F74 HydrophobicContact CB-CE2 3.9Å; V72-F74 HydrophobicContact CB-CZ 4.13Å; V72-F74 HydrophobicContact CG1-CD2 4.32Å; V72-F74 HydrophobicContact CG1-CE1 4.2Å; V72-F74 HydrophobicContact CG1-CE2 3.94Å; V72-F74 HydrophobicContact CG1-CZ 3.88Å; V72-F74 WeakPolarHBondContact O-CD2 3.22Å; V72-T169 HydrophobicContact CG2-CG2 4Å; V72-F172 HydrophobicContact CG1-CB 3.85Å; V72-F172 HydrophobicContact CG1-CD2 4.28Å; V72-L175 HydrophobicContact CG2-CB 4.08Å; V72-L175 HydrophobicContact CG2-CD2 4.13Å
73D85.2Confident82Confident103 Ų10367.8 Ų67.855%0.55134%0.34SS*.  trans-83.3112.5171.3-179.39.6000110.4T75D73-T75 WeakPolarHBondContact OD1-CB 3.39Å; D73-T75 PolarHBondContact OD1-N 2.96Å; D73-T75 PolarHBondContact OD1-OG1 3.45Å; D73-T75 PolarHBondContact OD2-OG1 2.83Å
74F84.7Confident81.9Confident19 Ų1976.3 Ų76.38%0.08337%0.372CS..  trans-88.2-4.3178-69.3-83.4000113.8L52 E53 F56 I60 V72 P79 F172 L175L52-F74 HydrophobicContact CB-CB 4.16Å; L52-F74 HydrophobicContact CB-CD1 3.95Å; L52-F74 HydrophobicContact CB-CG 4.44Å; E53-F74 HydrophobicContact CB-CB 4.28Å; E53-F74 HydrophobicContact CB-CD2 3.95Å; E53-F74 HydrophobicContact CB-CG 4.16Å; E53-F74 HydrophobicContact CG-CD2 4.1Å; E53-F74 HydrophobicContact CG-CE2 4.43Å; F56-F74 HydrophobicContact CB-CE1 3.8Å; F56-F74 HydrophobicContact CB-CZ 4.01Å; F56-F74 HydrophobicContact CD2-CD1 4.38Å; F56-F74 AromaticContact CD2-CE1 3.94Å; F56-F74 HydrophobicContact CD2-CE1 3.94Å; F56-F74 AromaticContact CG-CE1 3.94Å; F56-F74 HydrophobicContact CG-CE1 3.94Å; I60-F74 HydrophobicContact CD1-CE2 3.52Å; I60-F74 HydrophobicContact CD1-CZ 3.59Å; I60-F74 HydrophobicContact CG1-CE2 4.32Å; I60-F74 HydrophobicContact CG1-CZ 4.02Å; V72-F74 HydrophobicContact CB-CE2 3.9Å; V72-F74 HydrophobicContact CB-CZ 4.13Å; V72-F74 HydrophobicContact CG1-CD2 4.32Å; V72-F74 HydrophobicContact CG1-CE1 4.2Å; V72-F74 HydrophobicContact CG1-CE2 3.94Å; V72-F74 HydrophobicContact CG1-CZ 3.88Å; V72-F74 WeakPolarHBondContact O-CD2 3.22Å; F74-P79 HydrophobicContact CD1-CB 4.48Å; F74-F172 HydrophobicContact CD1-CD2 4.13Å; F74-F172 HydrophobicContact CD1-CE2 4.38Å; F74-F172 AromaticContact CE1-CD2 3.53Å; F74-F172 HydrophobicContact CE1-CD2 3.53Å; F74-F172 AromaticContact CE1-CE2 3.7Å; F74-F172 HydrophobicContact CE1-CE2 3.7Å; F74-F172 HydrophobicContact CZ-CD2 4.34Å; F74-L175 HydrophobicContact CE1-CD2 4.22Å; F74-L175 HydrophobicContact CZ-CD2 3.62Å
75T82.8Confident81.6Confident105 Ų10576 Ų7664%0.64437%0.37SS*.SBendtrans-83.2-23.2-176.267.80000113.1D73D73-T75 WeakPolarHBondContact OD1-CB 3.39Å; D73-T75 PolarHBondContact OD1-N 2.96Å; D73-T75 PolarHBondContact OD1-OG1 3.45Å; D73-T75 PolarHBondContact OD2-OG1 2.83Å
76G83.3Confident81.5Confident27 Ų2771.5 Ų71.528%0.27835%0.35SS..SBendtrans-66.2168.8-179.300000115.2P79G76-P79 VanDerWaalsContact O-CD 3.32Å; G76-P79 WeakPolarHBondContact O-CD 3.37Å; G76-P79 VanDerWaalsContact O-CG 3.32Å; G76-P79 WeakPolarHBondContact O-CG 3.38Å
77D83Confident81.6Confident136 Ų13670 Ų7073%0.72734%0.342SS*.Hα-helixtrans-72.5-29.1-179.3-70-38.9000113.1R80 F81D77-R80 PolarHBondContact O-N 3.44Å; D77-F81 WeakPolarHBondContact O-CB 3.4Å; D77-F81 PolarHBondContact O-N 3.27Å
78E83.3Confident81.7Confident82 Ų8270.9 Ų70.938%0.38336%0.355SS..Hα-helixtrans-60.4-53.7-179.5-173.8-177.5165.600113.7R80 F81 L82 Q163 P173E78-R80 VanDerWaalsContact C-N 3.3Å; E78-R80 PolarHBondContact O-N 2.96Å; E78-F81 PolarHBondContact O-N 3.29Å; E78-L82 PolarHBondContact O-N 3.18Å; E78-Q163 PolarHBondContact OE1-OE1 3.24Å; E78-P173 VanDerWaalsContact OE1-CD 3.23Å; E78-P173 WeakPolarHBondContact OE1-CD 3.28Å; E78-P173 WeakPolarHBondContact OE1-CG 3.26Å
79P82.1Confident82.1Confident4 Ų470.2 Ų70.23%0.02636%0.358CS..Hα-helixtrans-64.2-34.5177.326.3-36.6000112.3L52 F74 G76 L82 F83 F172L52-P79 HydrophobicContact CD1-CB 4.17Å; L52-P79 HydrophobicContact CD1-CG 4.49Å; F74-P79 HydrophobicContact CD1-CB 4.48Å; G76-P79 VanDerWaalsContact O-CD 3.32Å; G76-P79 WeakPolarHBondContact O-CD 3.37Å; G76-P79 VanDerWaalsContact O-CG 3.32Å; G76-P79 WeakPolarHBondContact O-CG 3.38Å; P79-L82 PolarHBondContact O-N 3.27Å; P79-F83 WeakPolarHBondContact O-CB 3.35Å; P79-F83 PolarHBondContact O-N 3.49Å; P79-F172 HydrophobicContact CB-CB 4.04Å; P79-F172 HydrophobicContact CB-CD1 3.76Å; P79-F172 HydrophobicContact CB-CD2 4.17Å; P79-F172 HydrophobicContact CB-CE1 4.31Å; P79-F172 HydrophobicContact CB-CG 3.71Å
80R84.1Confident82.4Confident126 Ų12663.9 Ų63.948%0.47533%0.332SS..Hα-helixtrans-65.1-42.9174.6-68.1174.8-178.4-98.21.8111.7L52 D77 E78 R84L52-R80 HydrophobicContact CD1-CB 4.37Å; L52-R80 HydrophobicContact CD1-CG 3.62Å; D77-R80 PolarHBondContact O-N 3.44Å; E78-R80 VanDerWaalsContact C-N 3.3Å; E78-R80 PolarHBondContact O-N 2.96Å; R80-R84 WeakPolarHBondContact O-CB 3.02Å; R80-R84 WeakPolarHBondContact O-CG 3.02Å; R80-R84 PolarHBondContact O-N 3.46Å
81F84Confident82.6Confident120 Ų12063.3 Ų63.353%0.52633%0.328SS..Hα-helixtrans-62.6-49.8175.6171.9-98.4000110.7D77 E78 F83 R84 L85D77-F81 WeakPolarHBondContact O-CB 3.4Å; D77-F81 PolarHBondContact O-N 3.27Å; E78-F81 PolarHBondContact O-N 3.29Å; F81-F83 VanDerWaalsContact C-N 3.34Å; F81-F83 PolarHBondContact O-N 3.3Å; F81-R84 PolarHBondContact O-N 3.05Å; F81-L85 HydrophobicContact CE1-CD2 4.32Å; F81-L85 WeakPolarHBondContact O-CB 3.37Å; F81-L85 PolarHBondContact O-N 2.8Å
82L79.9Confident82.8Confident3 Ų360.3 Ų60.32%0.01631%0.314CS..Hα-helixtrans-65.5-37.7-178.6-175.551.6000112.1E78 P79 L85 L86 L157 V160 F172 L176E78-L82 PolarHBondContact O-N 3.18Å; P79-L82 PolarHBondContact O-N 3.27Å; L82-L85 HydrophobicContact CD1-CD2 3.92Å; L82-L85 WeakPolarHBondContact O-CB 3.16Å; L82-L85 PolarHBondContact O-N 3.18Å; L82-L86 HydrophobicContact CD1-CG 4.26Å; L82-L86 HydrophobicContact CG-CD1 4.27Å; L82-L86 HydrophobicContact CG-CG 4.49Å; L82-L86 WeakPolarHBondContact O-CB 3.26Å; L82-L86 VanDerWaalsContact O-CG 3.3Å; L82-L86 WeakPolarHBondContact O-CG 3.27Å; L82-L86 PolarHBondContact O-N 3.27Å; L82-L157 HydrophobicContact CD1-CD2 4.32Å; L82-V160 HydrophobicContact CD1-CB 4.27Å; L82-V160 HydrophobicContact CD1-CG1 3.92Å; L82-V160 HydrophobicContact CD1-CG2 3.49Å; L82-V160 VanDerWaalsContact CD1-CG2 3.49Å; L82-V160 HydrophobicContact CD2-CG1 3.44Å; L82-V160 VanDerWaalsContact CD2-CG1 3.44Å; L82-V160 HydrophobicContact CD2-CG2 4.42Å; L82-V160 HydrophobicContact CG-CG1 4.36Å; L82-F172 HydrophobicContact CB-CD1 3.99Å; L82-F172 HydrophobicContact CB-CE1 3.74Å; L82-F172 HydrophobicContact CD2-CD1 3.53Å; L82-F172 HydrophobicContact CD2-CE1 3.47Å; L82-F172 VanDerWaalsContact CD2-CE1 3.47Å; L82-F172 HydrophobicContact CG-CD1 4.1Å; L82-F172 HydrophobicContact CG-CE1 3.66Å; L82-L176 HydrophobicContact CD1-CD2 4.41Å; L82-L176 HydrophobicContact CD2-CD2 3.64Å; L82-L176 HydrophobicContact CG-CD2 4.13Å
83F83.5Confident82.9Confident25 Ų2563.1 Ų63.111%0.1133%0.331CS..Hα-helixtrans-60.3-47.3172.1176.5-105.5000112.1L47 L52 L55 F56 P79 F81 L85 L86 R87 F257L47-F83 HydrophobicContact CB-CZ 4.06Å; L47-F83 HydrophobicContact CD2-CE2 3.87Å; L47-F83 HydrophobicContact CD2-CZ 3.78Å; L47-F83 VanDerWaalsContact O-CE1 3.25Å; L47-F83 WeakPolarHBondContact O-CE1 3.5Å; L47-F83 VanDerWaalsContact O-CZ 3.27Å; L47-F83 WeakPolarHBondContact O-CZ 3.45Å; L52-F83 HydrophobicContact CD2-CB 3.71Å; L52-F83 HydrophobicContact CD2-CD1 3.94Å; L52-F83 HydrophobicContact CD2-CD2 3.93Å; L52-F83 HydrophobicContact CD2-CG 3.56Å; L55-F83 HydrophobicContact CD2-CD2 3.89Å; L55-F83 HydrophobicContact CD2-CE2 3.25Å; L55-F83 HydrophobicContact CD2-CZ 3.83Å; F56-F83 HydrophobicContact CE2-CD2 4.25Å; F56-F83 HydrophobicContact CZ-CD2 4.37Å; P79-F83 WeakPolarHBondContact O-CB 3.35Å; P79-F83 PolarHBondContact O-N 3.49Å; F81-F83 VanDerWaalsContact C-N 3.34Å; F81-F83 PolarHBondContact O-N 3.3Å; F83-L85 VanDerWaalsContact C-N 3.28Å; F83-L85 PolarHBondContact O-N 3.21Å; F83-L86 PolarHBondContact O-N 3.38Å; F83-R87 PolarHBondContact O-N 2.83Å; F83-R87 VanDerWaalsContact O-N 3.12Å; F83-F257 HydrophobicContact CD2-CD2 4.47Å; F83-F257 HydrophobicContact CD2-CE2 4.28Å; F83-F257 HydrophobicContact CE2-CD2 4.17Å; F83-F257 HydrophobicContact CE2-CE2 4.31Å
84R82.4Confident83.2Confident179 Ų17958.2 Ų58.268%0.67531%0.305SS*.Hα-helixtrans-63.6-34175.5-74.1176.4-177169.62.3112.4R80 F81 G88R80-R84 WeakPolarHBondContact O-CB 3.02Å; R80-R84 WeakPolarHBondContact O-CG 3.02Å; R80-R84 PolarHBondContact O-N 3.46Å; F81-R84 PolarHBondContact O-N 3.05Å; R84-G88 WeakPolarHBondContact O-CA 3.4Å; R84-G88 PolarHBondContact O-N 2.8Å
85L79.7Confident83.6Confident37 Ų3759.5 Ų59.519%0.19431%0.311CS..Hα-helixtrans-68.6-46.8175.9175.265.8000111.3F81 L82 F83 R87 E156 V160F81-L85 HydrophobicContact CE1-CD2 4.32Å; F81-L85 WeakPolarHBondContact O-CB 3.37Å; F81-L85 PolarHBondContact O-N 2.8Å; L82-L85 HydrophobicContact CD1-CD2 3.92Å; L82-L85 WeakPolarHBondContact O-CB 3.16Å; L82-L85 PolarHBondContact O-N 3.18Å; F83-L85 VanDerWaalsContact C-N 3.28Å; F83-L85 PolarHBondContact O-N 3.21Å; L85-R87 VanDerWaalsContact C-N 3.26Å; L85-R87 PolarHBondContact O-N 3.44Å; L85-E156 HydrophobicContact CD1-CB 3.44Å; L85-E156 VanDerWaalsContact CD1-CB 3.44Å; L85-E156 HydrophobicContact CD1-CG 3.72Å; L85-E156 HydrophobicContact CD2-CB 3.59Å; L85-E156 HydrophobicContact CG-CB 4.04Å; L85-V160 HydrophobicContact CD2-CG2 4.13Å
86L77.5Confident84Confident26 Ų2659.1 Ų59.114%0.13631%0.305CS..Hα-helixtrans-59.3-38.1180-79.3169.8000112.6L82 F83 F153 L157 L176L82-L86 HydrophobicContact CD1-CG 4.26Å; L82-L86 HydrophobicContact CG-CD1 4.27Å; L82-L86 HydrophobicContact CG-CG 4.49Å; L82-L86 WeakPolarHBondContact O-CB 3.26Å; L82-L86 VanDerWaalsContact O-CG 3.3Å; L82-L86 WeakPolarHBondContact O-CG 3.27Å; L82-L86 PolarHBondContact O-N 3.27Å; F83-L86 PolarHBondContact O-N 3.38Å; L86-F153 HydrophobicContact CD2-CE2 4.09Å; L86-F153 HydrophobicContact CD2-CZ 4.12Å; L86-L157 HydrophobicContact CD2-CD2 3.87Å; L86-L176 HydrophobicContact CD1-CD1 4.07Å; L86-L176 HydrophobicContact CD1-CD2 3.89Å; L86-L176 HydrophobicContact CD2-CD2 4.43Å
87R78.3Confident84.5Confident19 Ų1958.9 Ų58.97%0.07230%0.296CS..Hα-helixtrans-108.4-21-170.5-163.165.2-157.5154.614114.1F83 L85 P91 F257 T259 E264F83-R87 PolarHBondContact O-N 2.83Å; F83-R87 VanDerWaalsContact O-N 3.12Å; L85-R87 VanDerWaalsContact C-N 3.26Å; L85-R87 PolarHBondContact O-N 3.44Å; R87-P91 HydrophobicContact CB-CG 4.31Å; R87-P91 HydrophobicContact CG-CG 3.22Å; R87-F257 VanDerWaalsContact CZ-O 3.29Å; R87-F257 PolarHBondContact NH1-O 3.46Å; R87-T259 VanDerWaalsContact CZ-CG2 3.46Å; R87-T259 VanDerWaalsContact NE-CG2 3.28Å; R87-T259 VanDerWaalsContact NH2-CB 3.31Å; R87-T259 PolarHBondContact NH2-OG1 2.96Å; R87-E264 IonicContact CZ-OE1 2.83Å; R87-E264 IonicContact CZ-OE2 3.43Å; R87-E264 IonicContact NH1-OE1 3.66Å; R87-E264 PolarHBondContact NH1-OE1 3.33Å; R87-E264 IonicContact NH1-OE2 3.16Å; R87-E264 PolarHBondContact NH1-OE2 3.47Å; R87-E264 IonicContact NH2-OE1 3.8Å; R87-E264 PolarHBondContact NH2-OE1 3.34Å; R87-E264 IonicContact NH2-OE2 3.09Å; R87-E264 PolarHBondContact NH2-OE2 2.96Å
88G78.1Confident84.9Confident32 Ų3252.4 Ų52.433%0.3326%0.262SS..THydrogen-bonded Turntrans63.4-163.2-176.500000113.3R84 L90 P91R84-G88 WeakPolarHBondContact O-CA 3.4Å; R84-G88 PolarHBondContact O-N 2.8Å; G88-L90 PolarHBondContact O-N 2.89Å; G88-P91 WeakPolarHBondContact O-CD 3.34Å
89P81.8Confident85.5Confident102 Ų10251.2 Ų51.266%0.66226%0.26SS*.THydrogen-bonded Turntrans-74.51.6178.132.2-36.1000113.5T92 V93P89-T92 PolarHBondContact O-N 3.27Å; P89-V93 WeakPolarHBondContact O-CG2 3.4Å; P89-V93 PolarHBondContact O-N 2.87Å; P89-V93 VanDerWaalsContact O-N 3.1Å
90L83.3Confident86Confident32 Ų3255.1 Ų55.117%0.16828%0.28CS..Hα-helixtrans-61.1-45.7-168.8-174.258.8000114.1G88 T92 V93 I94 W141G88-L90 PolarHBondContact O-N 2.89Å; L90-T92 VanDerWaalsContact C-N 3.28Å; L90-T92 PolarHBondContact O-N 3.31Å; L90-V93 PolarHBondContact O-N 3.38Å; L90-I94 HydrophobicContact CD1-CD1 3.7Å; L90-I94 HydrophobicContact CD1-CG1 3.94Å; L90-I94 HydrophobicContact CD2-CD1 4.43Å; L90-I94 HydrophobicContact CG-CD1 3.72Å; L90-I94 HydrophobicContact CG-CG1 4.32Å; L90-I94 WeakPolarHBondContact O-CG1 3.48Å; L90-I94 PolarHBondContact O-N 3.18Å; L90-W141 HydrophobicContact CD1-CZ2 3.83Å; L90-W141 HydrophobicContact CD2-CH2 4.1Å; L90-W141 HydrophobicContact CD2-CZ2 4.09Å
91P87.6Confident86.5Confident4 Ų449.2 Ų49.23%0.02626%0.258CS..Hα-helixtrans-60.2-40178.9-21.533.8000111.7L47 L48 R87 G88 I94 F95 T259L47-P91 HydrophobicContact CB-CB 4.22Å; L47-P91 HydrophobicContact CB-CG 4.43Å; L47-P91 HydrophobicContact CD1-CB 4.44Å; L47-P91 HydrophobicContact CD1-CG 4.24Å; L48-P91 HydrophobicContact CD2-CB 4.18Å; L48-P91 HydrophobicContact CG-CB 4.2Å; R87-P91 HydrophobicContact CB-CG 4.31Å; R87-P91 HydrophobicContact CG-CG 3.22Å; G88-P91 WeakPolarHBondContact O-CD 3.34Å; P91-I94 PolarHBondContact O-N 3.47Å; P91-F95 WeakPolarHBondContact O-CB 3.44Å; P91-F95 PolarHBondContact O-N 3.46Å; P91-T259 HydrophobicContact CB-CG2 3.9Å; P91-T259 HydrophobicContact CG-CG2 3.81Å
92T88.8Confident87Confident66 Ų6645.3 Ų45.341%0.40524%0.242SC..Hα-helixtrans-64.3-46177.6-49.20000111.6L48 P89 L90 F95 L96L48-T92 WeakPolarHBondContact CD2-OG1 3.44Å; P89-T92 PolarHBondContact O-N 3.27Å; L90-T92 VanDerWaalsContact C-N 3.28Å; L90-T92 PolarHBondContact O-N 3.31Å; T92-F95 PolarHBondContact O-N 3.08Å; T92-L96 HydrophobicContact CG2-CD1 4.31Å; T92-L96 WeakPolarHBondContact O-CG 3.32Å; T92-L96 PolarHBondContact O-N 3.36Å
93V88.3Confident87.6Confident78 Ų7850.4 Ų50.447%0.47327%0.269SS..Hα-helixtrans-62.4-46.4178.7173.90000110.6P89 L90 L96 H97P89-V93 WeakPolarHBondContact O-CG2 3.4Å; P89-V93 PolarHBondContact O-N 2.87Å; P89-V93 VanDerWaalsContact O-N 3.1Å; L90-V93 PolarHBondContact O-N 3.38Å; V93-L96 PolarHBondContact O-N 3.42Å; V93-H97 VanDerWaalsContact O-CB 3.26Å; V93-H97 WeakPolarHBondContact O-CB 3.34Å; V93-H97 PolarHBondContact O-N 3.27Å
94I90Very high88Confident0 Ų049.6 Ų49.60%027%0.265CS..Hα-helixtrans-64.9-43.4178.6-66.7175.7000110.8P44 L90 P91 L96 H97 L98 T259 T260 Y267P44-I94 HydrophobicContact CG-CB 4.32Å; P44-I94 HydrophobicContact CG-CG2 3.72Å; L90-I94 HydrophobicContact CD1-CD1 3.7Å; L90-I94 HydrophobicContact CD1-CG1 3.94Å; L90-I94 HydrophobicContact CD2-CD1 4.43Å; L90-I94 HydrophobicContact CG-CD1 3.72Å; L90-I94 HydrophobicContact CG-CG1 4.32Å; L90-I94 WeakPolarHBondContact O-CG1 3.48Å; L90-I94 PolarHBondContact O-N 3.18Å; P91-I94 PolarHBondContact O-N 3.47Å; I94-L96 PolarHBondContact O-N 3.15Å; I94-H97 WeakPolarHBondContact O-CB 3.37Å; I94-H97 PolarHBondContact O-N 3.22Å; I94-L98 HydrophobicContact CG2-CD1 3.72Å; I94-L98 HydrophobicContact CG2-CG 4.11Å; I94-L98 WeakPolarHBondContact O-CB 3.15Å; I94-L98 WeakPolarHBondContact O-CG 3.37Å; I94-L98 PolarHBondContact O-N 3.31Å; I94-T259 HydrophobicContact CD1-CG2 4.26Å; I94-T259 WeakPolarHBondContact CD1-OG1 3.13Å; I94-T260 HydrophobicContact CD1-CG2 4.44Å; I94-T260 HydrophobicContact CG2-CG2 3.82Å; I94-Y267 HydrophobicContact CD1-CE1 4.01Å; I94-Y267 HydrophobicContact CG1-CE1 4.09Å; I94-Y267 HydrophobicContact CG2-CE2 4.5Å
95F93.4Very high88.5Confident46 Ų4641.2 Ų41.220%0.20223%0.234CC..Hα-helixtrans-57.9-49177.5174.9-104.4000111.8I41 P44 I45 L48 F49 P91 T92 T99I41-F95 HydrophobicContact CD1-CD2 4.19Å; I41-F95 HydrophobicContact CD1-CE2 4.03Å; I41-F95 HydrophobicContact CG1-CD2 3.91Å; I41-F95 HydrophobicContact CG1-CE2 4.13Å; P44-F95 HydrophobicContact CB-CB 3.8Å; P44-F95 HydrophobicContact CB-CD2 4.45Å; I45-F95 HydrophobicContact CD1-CE2 4.18Å; I45-F95 HydrophobicContact CG1-CD2 3.92Å; I45-F95 HydrophobicContact CG1-CE2 3.62Å; L48-F95 HydrophobicContact CD1-CB 3.65Å; L48-F95 HydrophobicContact CD1-CD1 4.11Å; L48-F95 HydrophobicContact CD1-CD2 4.42Å; L48-F95 HydrophobicContact CD1-CG 3.8Å; F49-F95 HydrophobicContact CE2-CE2 4.31Å; F49-F95 HydrophobicContact CE2-CZ 4.17Å; P91-F95 WeakPolarHBondContact O-CB 3.44Å; P91-F95 PolarHBondContact O-N 3.46Å; T92-F95 PolarHBondContact O-N 3.08Å; F95-T99 WeakPolarHBondContact O-CB 3.23Å; F95-T99 PolarHBondContact O-N 2.97Å; F95-T99 PolarHBondContact O-OG1 3.29Å
96L92.5Very high89.1Confident98 Ų9842.4 Ų42.451%0.51324%0.24SC..Hα-helixtrans-62.6-44.2177.1-70.3174.2000111.3T92 V93 I94 T99 I100T92-L96 HydrophobicContact CG2-CD1 4.31Å; T92-L96 WeakPolarHBondContact O-CG 3.32Å; T92-L96 PolarHBondContact O-N 3.36Å; V93-L96 PolarHBondContact O-N 3.42Å; I94-L96 PolarHBondContact O-N 3.15Å; L96-T99 PolarHBondContact O-N 2.84Å; L96-I100 VanDerWaalsContact O-CG1 3.28Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.14Å
97H92.2Very high89.8Confident22 Ų2242.5 Ų42.510%0.10224%0.243CC..Hα-helixtrans-58.2-52.5178.1-180-117.8000112.5V93 I94 T99 I100 I101 D134 Y267V93-H97 VanDerWaalsContact O-CB 3.26Å; V93-H97 WeakPolarHBondContact O-CB 3.34Å; V93-H97 PolarHBondContact O-N 3.27Å; I94-H97 WeakPolarHBondContact O-CB 3.37Å; I94-H97 PolarHBondContact O-N 3.22Å; H97-T99 VanDerWaalsContact C-N 3.31Å; H97-T99 PolarHBondContact O-N 3.31Å; H97-I100 PolarHBondContact O-N 3.14Å; H97-I101 WeakPolarHBondContact CE1-CD1 3.2Å; H97-I101 WeakPolarHBondContact NE2-CD1 3.46Å; H97-I101 WeakPolarHBondContact O-CG1 3.37Å; H97-I101 PolarHBondContact O-N 3.44Å; H97-D134 IonicContact CE1-OD1 2.68Å; H97-D134 PolarHBondContact CE1-OD1 3.43Å; H97-D134 IonicContact NE2-OD1 3.96Å; H97-D134 PolarHBondContact NE2-OD1 2.82Å; H97-Y267 AromaticContact ND1-CE2 3.7Å
98L93.1Very high90.4Very high0 Ų041.8 Ų41.80%024%0.24CC..Hα-helixtrans-64.9-35.2179.3-68176.6000112.1D40 I41 P44 I94 I100 I101 L102 Y271D40-L98 HydrophobicContact CB-CD1 3.77Å; D40-L98 HydrophobicContact CB-CD2 4.38Å; I41-L98 HydrophobicContact CB-CB 4.46Å; I41-L98 HydrophobicContact CB-CD1 4.23Å; I41-L98 HydrophobicContact CD1-CB 4.44Å; I41-L98 HydrophobicContact CG1-CB 4.32Å; P44-L98 HydrophobicContact CG-CD1 4.49Å; I94-L98 HydrophobicContact CG2-CD1 3.72Å; I94-L98 HydrophobicContact CG2-CG 4.11Å; I94-L98 WeakPolarHBondContact O-CB 3.15Å; I94-L98 WeakPolarHBondContact O-CG 3.37Å; I94-L98 PolarHBondContact O-N 3.31Å; L98-I100 VanDerWaalsContact C-N 3.35Å; L98-I101 PolarHBondContact O-N 3.27Å; L98-L102 VanDerWaalsContact O-CB 3.3Å; L98-L102 WeakPolarHBondContact O-CB 3.38Å; L98-L102 PolarHBondContact O-N 3.28Å; L98-Y271 HydrophobicContact CD2-CE1 4.47Å; L98-Y271 HydrophobicContact CD2-CE2 3.83Å
99T94.5Very high90.9Very high56 Ų5642.9 Ų42.934%0.34424%0.238SC..Hα-helixtrans-62.3-42.9175.2-59.50000111.3F95 L96 H97 L102 L103F95-T99 WeakPolarHBondContact O-CB 3.23Å; F95-T99 PolarHBondContact O-N 2.97Å; F95-T99 PolarHBondContact O-OG1 3.29Å; L96-T99 PolarHBondContact O-N 2.84Å; H97-T99 VanDerWaalsContact C-N 3.31Å; H97-T99 PolarHBondContact O-N 3.31Å; T99-L102 PolarHBondContact O-N 3.29Å; T99-L103 WeakPolarHBondContact O-CB 3.29Å; T99-L103 PolarHBondContact O-N 3.35Å
100I93.4Very high91.3Very high87 Ų8743 Ų4345%0.44623%0.228SC..Hα-helixtrans-67.6-43177.9-62.5163.7000110.7L96 H97 L98 L102 L103 N104 L130L96-I100 VanDerWaalsContact O-CG1 3.28Å; L96-I100 WeakPolarHBondContact O-CG1 3.41Å; L96-I100 PolarHBondContact O-N 3.14Å; H97-I100 PolarHBondContact O-N 3.14Å; L98-I100 VanDerWaalsContact C-N 3.35Å; I100-L102 PolarHBondContact O-N 2.85Å; I100-L103 PolarHBondContact O-N 3.35Å; I100-N104 WeakPolarHBondContact O-CB 3.16Å; I100-N104 PolarHBondContact O-N 2.64Å; I100-L130 HydrophobicContact CB-CD2 4.39Å; I100-L130 HydrophobicContact CG2-CD1 4.34Å; I100-L130 HydrophobicContact CG2-CD2 3.78Å; I100-L130 HydrophobicContact CG2-CG 4.33Å
101I93.9Very high91.5Very high2 Ų241.4 Ų41.41%0.0122%0.22CC..Hα-helixtrans-58-48.6174.8-72.3173000110.6I33 A37 H97 L98 L103 N104 A105 L130 Y271I33-I101 HydrophobicContact CG2-CG2 3.51Å; A37-I101 HydrophobicContact CB-CG2 4.37Å; H97-I101 WeakPolarHBondContact CE1-CD1 3.2Å; H97-I101 WeakPolarHBondContact NE2-CD1 3.46Å; H97-I101 WeakPolarHBondContact O-CG1 3.37Å; H97-I101 PolarHBondContact O-N 3.44Å; L98-I101 PolarHBondContact O-N 3.27Å; I101-L103 PolarHBondContact O-N 3.3Å; I101-N104 PolarHBondContact O-N 3.13Å; I101-A105 WeakPolarHBondContact O-CB 3.49Å; I101-A105 PolarHBondContact O-N 2.85Å; I101-L130 HydrophobicContact CG1-CD1 4.14Å; I101-L130 HydrophobicContact CG1-CD2 4.14Å; I101-Y271 HydrophobicContact CD1-CD1 3.8Å; I101-Y271 HydrophobicContact CD1-CD2 4.36Å; I101-Y271 HydrophobicContact CD1-CE1 4.34Å; I101-Y271 HydrophobicContact CD1-CG 3.82Å; I101-Y271 HydrophobicContact CG2-CD1 4.11Å; I101-Y271 HydrophobicContact CG2-CE1 4.18Å
102L94.4Very high91.5Very high38 Ų3842.4 Ų42.420%0.19923%0.225CC..Hα-helixtrans-62-46-178.5-174.765.3000111.2I34 A37 L98 T99 I100 N104 A105 I106I34-L102 HydrophobicContact CB-CD1 4.35Å; I34-L102 HydrophobicContact CG1-CD1 4.28Å; I34-L102 HydrophobicContact CG2-CD1 4Å; A37-L102 HydrophobicContact CB-CD1 4.44Å; L98-L102 VanDerWaalsContact O-CB 3.3Å; L98-L102 WeakPolarHBondContact O-CB 3.38Å; L98-L102 PolarHBondContact O-N 3.28Å; T99-L102 PolarHBondContact O-N 3.29Å; I100-L102 PolarHBondContact O-N 2.85Å; L102-N104 VanDerWaalsContact C-N 3.35Å; L102-N104 PolarHBondContact O-N 3.07Å; L102-A105 PolarHBondContact O-N 2.94Å; L102-I106 HydrophobicContact CD1-CD1 4.39Å; L102-I106 HydrophobicContact CG-CD1 4.04Å; L102-I106 VanDerWaalsContact O-CG1 3.26Å; L102-I106 WeakPolarHBondContact O-CG1 3.4Å; L102-I106 PolarHBondContact O-N 3.4Å
103L92.6Very high91.4Very high110 Ų11045 Ų4558%0.57624%0.236SC*.Hα-helixtrans-61.2-44176.7-178.362.7000111.4T99 I100 I101 I106 C107T99-L103 WeakPolarHBondContact O-CB 3.29Å; T99-L103 PolarHBondContact O-N 3.35Å; I100-L103 PolarHBondContact O-N 3.35Å; I101-L103 PolarHBondContact O-N 3.3Å; L103-I106 PolarHBondContact O-N 2.67Å; L103-C107 WeakPolarHBondContact O-CB 3.16Å; L103-C107 PolarHBondContact O-N 3.34Å; L103-C107 PolarHBondContact O-SG 3.32Å
104N92.1Very high91.3Very high7 Ų748.6 Ų48.64%0.03725%0.245CC..Hα-helixtrans-64-43.4177.6-177.2-104.5000112I100 I101 L102 I106 C107 I108 N123 V126 L130I100-N104 WeakPolarHBondContact O-CB 3.16Å; I100-N104 PolarHBondContact O-N 2.64Å; I101-N104 PolarHBondContact O-N 3.13Å; L102-N104 VanDerWaalsContact C-N 3.35Å; L102-N104 PolarHBondContact O-N 3.07Å; N104-I106 PolarHBondContact O-N 2.72Å; N104-C107 WeakPolarHBondContact O-CB 3.45Å; N104-C107 PolarHBondContact O-N 2.83Å; N104-I108 WeakPolarHBondContact O-CG1 3.17Å; N104-I108 PolarHBondContact O-N 2.95Å; N104-I108 WeakPolarHBondContact OD1-CD1 3.37Å; N104-N123 PolarHBondContact ND2-O 3.12Å; N104-N123 PolarHBondContact ND2-OD1 3.43Å; N104-V126 HydrophobicContact CB-CG1 4.39Å; N104-V126 WeakPolarHBondContact ND2-CG1 3.35Å; N104-L130 HydrophobicContact CB-CD1 4.07Å
105A92.9Very high91Very high3 Ų357.4 Ų57.43%0.02528%0.279CS..Hα-helixtrans-63.5-41.4178.100000112.1T30 I33 I34 I101 L102 C107 I108 L109T30-A105 HydrophobicContact CG2-CB 3.91Å; T30-A105 WeakPolarHBondContact CG2-O 3.37Å; I33-A105 HydrophobicContact CG2-CB 4.13Å; I34-A105 HydrophobicContact CD1-CB 4.22Å; I34-A105 HydrophobicContact CG1-CB 3.65Å; I101-A105 WeakPolarHBondContact O-CB 3.49Å; I101-A105 PolarHBondContact O-N 2.85Å; L102-A105 PolarHBondContact O-N 2.94Å; A105-C107 VanDerWaalsContact C-N 3.34Å; A105-C107 PolarHBondContact O-N 3.26Å; A105-I108 PolarHBondContact O-N 3.39Å; A105-L109 PolarHBondContact O-N 3.23Å
106I92.2Very high90.5Very high63 Ų6357 Ų5732%0.32328%0.284SS..Hα-helixtrans-60.3-45.8173.3-70.1166.4000110.4I34 L102 L103 N104 I108 L109 F110I34-I106 HydrophobicContact CD1-CG1 4.45Å; L102-I106 HydrophobicContact CD1-CD1 4.39Å; L102-I106 HydrophobicContact CG-CD1 4.04Å; L102-I106 VanDerWaalsContact O-CG1 3.26Å; L102-I106 WeakPolarHBondContact O-CG1 3.4Å; L102-I106 PolarHBondContact O-N 3.4Å; L103-I106 PolarHBondContact O-N 2.67Å; N104-I106 PolarHBondContact O-N 2.72Å; I106-I108 PolarHBondContact O-N 3.48Å; I106-L109 PolarHBondContact O-N 2.84Å; I106-F110 HydrophobicContact CG2-CD2 3.61Å; I106-F110 HydrophobicContact CG2-CE2 3.54Å; I106-F110 VanDerWaalsContact O-CD2 3.26Å; I106-F110 WeakPolarHBondContact O-CD2 3.44Å; I106-F110 PolarHBondContact O-N 3.18Å
107C91.6Very high89.8Confident27 Ų2758.1 Ų58.118%0.18229%0.287CS..Hα-helixtrans-62-41.8176.6-70.90000112.5L103 N104 A105 L109 F110 G111 F119 N123L103-C107 WeakPolarHBondContact O-CB 3.16Å; L103-C107 PolarHBondContact O-N 3.34Å; L103-C107 PolarHBondContact O-SG 3.32Å; N104-C107 WeakPolarHBondContact O-CB 3.45Å; N104-C107 PolarHBondContact O-N 2.83Å; A105-C107 VanDerWaalsContact C-N 3.34Å; A105-C107 PolarHBondContact O-N 3.26Å; C107-L109 VanDerWaalsContact C-N 3.32Å; C107-L109 PolarHBondContact O-N 3.37Å; C107-F110 PolarHBondContact O-N 3.43Å; C107-G111 PolarHBondContact O-N 2.86Å; C107-F119 HydrophobicContact CB-CE1 3.72Å; C107-F119 HydrophobicContact CB-CZ 3.69Å; C107-F119 WeakPolarHBondContact O-CE1 3.32Å; C107-N123 WeakPolarHBondContact CB-OD1 3.32Å
108I90.9Very high89.3Confident4 Ų466 Ų662%0.02132%0.316CS..Hα-helixtrans-59-45.5174.7-70.9168.9000110.4I26 T30 N104 A105 I106 F110 G111 L112 M120 N123 L127I26-I108 HydrophobicContact CG2-CG2 4.25Å; T30-I108 HydrophobicContact CG2-CB 4.14Å; T30-I108 HydrophobicContact CG2-CG2 4.03Å; N104-I108 WeakPolarHBondContact O-CG1 3.17Å; N104-I108 PolarHBondContact O-N 2.95Å; N104-I108 WeakPolarHBondContact OD1-CD1 3.37Å; A105-I108 PolarHBondContact O-N 3.39Å; I106-I108 PolarHBondContact O-N 3.48Å; I108-F110 PolarHBondContact O-N 2.9Å; I108-G111 PolarHBondContact O-N 3.19Å; I108-L112 HydrophobicContact CG2-CD1 4.18Å; I108-L112 WeakPolarHBondContact O-CG 3.43Å; I108-L112 PolarHBondContact O-N 3.03Å; I108-M120 HydrophobicContact CG2-CE 4.19Å; I108-N123 HydrophobicContact CG1-CB 4.16Å; I108-L127 HydrophobicContact CD1-CD2 4.35Å
109L89.7Confident88.8Confident55 Ų5569.8 Ų69.829%0.28833%0.333SS..Hα-helixtrans-62.1-45.1179.1-17362.7000111.7T30 I34 A105 I106 C107 G111 L112 L113T30-L109 HydrophobicContact CG2-CB 4.48Å; I34-L109 HydrophobicContact CD1-CD2 4.44Å; A105-L109 PolarHBondContact O-N 3.23Å; I106-L109 PolarHBondContact O-N 2.84Å; C107-L109 VanDerWaalsContact C-N 3.32Å; C107-L109 PolarHBondContact O-N 3.37Å; L109-G111 VanDerWaalsContact C-N 3.34Å; L109-G111 PolarHBondContact O-N 3.03Å; L109-L112 PolarHBondContact O-N 3.03Å; L109-L113 HydrophobicContact CG-CD1 4.22Å; L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.3Å; L109-L113 PolarHBondContact O-N 3.22Å
110F89.6Confident88.2Confident104 Ų10467.4 Ų67.446%0.45632%0.318SS..Hα-helixtrans-62.5-39.5174.4-83.7-65000112.7I106 C107 I108 L112 L113 F114I106-F110 HydrophobicContact CG2-CD2 3.61Å; I106-F110 HydrophobicContact CG2-CE2 3.54Å; I106-F110 VanDerWaalsContact O-CD2 3.26Å; I106-F110 WeakPolarHBondContact O-CD2 3.44Å; I106-F110 PolarHBondContact O-N 3.18Å; C107-F110 PolarHBondContact O-N 3.43Å; I108-F110 PolarHBondContact O-N 2.9Å; F110-L112 VanDerWaalsContact C-N 3.32Å; F110-L112 PolarHBondContact O-N 2.87Å; F110-L113 PolarHBondContact O-N 3.24Å; F110-F114 HydrophobicContact CB-CD2 4.44Å; F110-F114 HydrophobicContact CD1-CD2 4.07Å; F110-F114 AromaticContact CD1-CE2 3.51Å; F110-F114 HydrophobicContact CD1-CE2 3.51Å; F110-F114 HydrophobicContact CD1-CZ 4.49Å; F110-F114 HydrophobicContact CE1-CE2 4.1Å; F110-F114 VanDerWaalsContact O-CD2 3.31Å; F110-F114 WeakPolarHBondContact O-CD2 3.28Å; F110-F114 PolarHBondContact O-N 3.39Å
111G87.4Confident87.8Confident0 Ų068.3 Ų68.30%032%0.319CS..Hα-helixtrans-63.4-37.3176.500000113C107 I108 L109 R115 A116 M120C107-G111 PolarHBondContact O-N 2.86Å; I108-G111 PolarHBondContact O-N 3.19Å; L109-G111 VanDerWaalsContact C-N 3.34Å; L109-G111 PolarHBondContact O-N 3.03Å; G111-R115 WeakPolarHBondContact O-CA 3.41Å; G111-R115 PolarHBondContact O-N 3.39Å; G111-R115 VanDerWaalsContact O-N 3.13Å; G111-A116 PolarHBondContact O-N 2.99Å; G111-M120 VanDerWaalsContact C-SD 3.59Å
112L87.9Confident87.5Confident24 Ų2470.5 Ų70.513%0.12633%0.334CS..Hα-helixtrans-69.5-44.9173.6-69172.5000111.9I26 A27 I108 L109 F110 R115 M120I26-L112 HydrophobicContact CB-CD1 4.43Å; I26-L112 HydrophobicContact CG2-CD1 3.89Å; A27-L112 HydrophobicContact CB-CD1 4.11Å; I108-L112 HydrophobicContact CG2-CD1 4.18Å; I108-L112 WeakPolarHBondContact O-CG 3.43Å; I108-L112 PolarHBondContact O-N 3.03Å; L109-L112 PolarHBondContact O-N 3.03Å; F110-L112 VanDerWaalsContact C-N 3.32Å; F110-L112 PolarHBondContact O-N 2.87Å; L112-R115 PolarHBondContact O-N 3Å; L112-M120 HydrophobicContact CD2-CE 3.71Å; L112-M120 HydrophobicContact CD2-SD 4.36Å; L112-M120 HydrophobicContact CG-CE 3.92Å; L112-M120 HydrophobicContact CG-SD 4.19Å
113L86.9Confident87.2Confident120 Ų12069.3 Ų69.363%0.62833%0.328SS*.Hα-helixtrans-63.3-45.2-179.3-73.3171.9000112.4L109 F110 R115L109-L113 HydrophobicContact CG-CD1 4.22Å; L109-L113 VanDerWaalsContact O-CG 3.3Å; L109-L113 WeakPolarHBondContact O-CG 3.3Å; L109-L113 PolarHBondContact O-N 3.22Å; F110-L113 PolarHBondContact O-N 3.24Å; L113-R115 VanDerWaalsContact C-N 3.32Å
114F87.2Confident86.9Confident154 Ų15464.7 Ų64.768%0.67530%0.303SS*.THydrogen-bonded Turntrans-88.22-179.6-66-61.3000113.8F110 A116F110-F114 HydrophobicContact CB-CD2 4.44Å; F110-F114 HydrophobicContact CD1-CD2 4.07Å; F110-F114 AromaticContact CD1-CE2 3.51Å; F110-F114 HydrophobicContact CD1-CE2 3.51Å; F110-F114 HydrophobicContact CD1-CZ 4.49Å; F110-F114 HydrophobicContact CE1-CE2 4.1Å; F110-F114 VanDerWaalsContact O-CD2 3.31Å; F110-F114 WeakPolarHBondContact O-CD2 3.28Å; F110-F114 PolarHBondContact O-N 3.39Å; F114-A116 PolarHBondContact O-N 3.16Å; F114-A116 VanDerWaalsContact O-N 3.12Å
115R81.8Confident86.8Confident185 Ų18571.6 Ų71.670%0.69833%0.334SS*.THydrogen-bonded Turntrans48.736.6-175-63.6-177170.9175.5-2113G111 L112 L113 E117G111-R115 WeakPolarHBondContact O-CA 3.41Å; G111-R115 PolarHBondContact O-N 3.39Å; G111-R115 VanDerWaalsContact O-N 3.13Å; L112-R115 PolarHBondContact O-N 3Å; L113-R115 VanDerWaalsContact C-N 3.32Å; R115-E117 PolarHBondContact O-N 3.24Å; R115-E117 VanDerWaalsContact O-N 3.11Å
116A83.5Confident86.8Confident37 Ų3774.7 Ų74.731%0.30635%0.352SS..  trans-83.986.9-176.600000110.2G111 F114 Y118 F119 M120G111-A116 PolarHBondContact O-N 2.99Å; F114-A116 PolarHBondContact O-N 3.16Å; F114-A116 VanDerWaalsContact O-N 3.12Å; A116-Y118 VanDerWaalsContact C-N 3.3Å; A116-Y118 PolarHBondContact O-N 3.34Å; A116-F119 HydrophobicContact CB-CB 3.78Å; A116-F119 WeakPolarHBondContact O-CB 3.39Å; A116-F119 PolarHBondContact O-N 3.3Å; A116-M120 PolarHBondContact O-N 3.39Å
117E78.6Confident86.8Confident123 Ų12371.8 Ų71.858%0.57534%0.337SS*.Hα-helixtrans-57.4-39.6-174.9-65.5-169.9174.600113.7R115 F119 M120 K121R115-E117 PolarHBondContact O-N 3.24Å; R115-E117 VanDerWaalsContact O-N 3.11Å; E117-F119 VanDerWaalsContact C-N 3.32Å; E117-F119 PolarHBondContact O-N 2.67Å; E117-M120 PolarHBondContact O-N 3.2Å; E117-K121 WeakPolarHBondContact O-CG 3.5Å; E117-K121 PolarHBondContact O-N 2.66Å
118Y81.6Confident86.8Confident186 Ų18674.2 Ų74.273%0.72935%0.347SS*.Hα-helixtrans-62.4-42.5176.8-178.3-96.9000111.4A116 M120 K121 C122A116-Y118 VanDerWaalsContact C-N 3.3Å; A116-Y118 PolarHBondContact O-N 3.34Å; Y118-M120 VanDerWaalsContact C-N 3.35Å; Y118-M120 PolarHBondContact O-N 3.19Å; Y118-K121 PolarHBondContact O-N 2.94Å; Y118-C122 PolarHBondContact O-N 2.71Å
119F82.2Confident86.9Confident81 Ų8175.9 Ų75.936%0.35537%0.365SS..Hα-helixtrans-65-41178.6-167.3-115.8000111.3C107 A116 E117 K121 C122 N123C107-F119 HydrophobicContact CB-CE1 3.72Å; C107-F119 HydrophobicContact CB-CZ 3.69Å; C107-F119 WeakPolarHBondContact O-CE1 3.32Å; A116-F119 HydrophobicContact CB-CB 3.78Å; A116-F119 WeakPolarHBondContact O-CB 3.39Å; A116-F119 PolarHBondContact O-N 3.3Å; E117-F119 VanDerWaalsContact C-N 3.32Å; E117-F119 PolarHBondContact O-N 2.67Å; F119-K121 PolarHBondContact O-N 2.95Å; F119-C122 PolarHBondContact O-N 2.78Å; F119-N123 VanDerWaalsContact CD1-ND2 3.32Å; F119-N123 WeakPolarHBondContact CD1-ND2 3.41Å; F119-N123 VanDerWaalsContact CE1-ND2 3.28Å; F119-N123 WeakPolarHBondContact CE1-ND2 3.21Å; F119-N123 WeakPolarHBondContact CZ-ND2 3.33Å; F119-N123 PolarHBondContact O-N 3.33Å; F119-N123 PolarHBondContact O-ND2 3.41Å
120M81.5Confident87Confident6 Ų673.8 Ų73.83%0.0335%0.354CS..Hα-helixtrans-62-41.4175.4-69.4-63.5-6700112.3I108 G111 L112 A116 E117 Y118 N123 M124 Y282I108-M120 HydrophobicContact CG2-CE 4.19Å; G111-M120 VanDerWaalsContact C-SD 3.59Å; L112-M120 HydrophobicContact CD2-CE 3.71Å; L112-M120 HydrophobicContact CD2-SD 4.36Å; L112-M120 HydrophobicContact CG-CE 3.92Å; L112-M120 HydrophobicContact CG-SD 4.19Å; A116-M120 PolarHBondContact O-N 3.39Å; E117-M120 PolarHBondContact O-N 3.2Å; Y118-M120 VanDerWaalsContact C-N 3.35Å; Y118-M120 PolarHBondContact O-N 3.19Å; M120-N123 PolarHBondContact O-N 3.04Å; M120-M124 VanDerWaalsContact O-CG 3.28Å; M120-M124 WeakPolarHBondContact O-CG 3.38Å; M120-M124 PolarHBondContact O-N 3.43Å; M120-Y282 HydrophobicContact CB-CE2 3.96Å; M120-Y282 HydrophobicContact CE-CD2 4.19Å; M120-Y282 HydrophobicContact CE-CE2 4Å
121K85.7Confident87.2Confident105 Ų10570.6 Ų70.646%0.45734%0.342SS..Hα-helixtrans-62.2-45.1175.6-70.9172.1-175.3172.40112E117 Y118 F119 M124 F125 Y282E117-K121 WeakPolarHBondContact O-CG 3.5Å; E117-K121 PolarHBondContact O-N 2.66Å; Y118-K121 PolarHBondContact O-N 2.94Å; F119-K121 PolarHBondContact O-N 2.95Å; K121-M124 WeakPolarHBondContact O-CB 3.34Å; K121-M124 PolarHBondContact O-N 2.65Å; K121-F125 VanDerWaalsContact O-CD2 3.22Å; K121-F125 WeakPolarHBondContact O-CD2 3.35Å; K121-F125 PolarHBondContact O-N 3.4Å; K121-Y282 WeakPolarHBondContact CG-OH 3.41Å
122C87Confident87.4Confident49 Ų4975.9 Ų75.933%0.33137%0.369SS..Hα-helixtrans-61.2-44.9175.8-69.80000112.1Y118 F119 M124 F125 V126Y118-C122 PolarHBondContact O-N 2.71Å; F119-C122 PolarHBondContact O-N 2.78Å; C122-M124 PolarHBondContact O-N 3.28Å; C122-F125 PolarHBondContact O-N 2.99Å; C122-F125 VanDerWaalsContact O-N 3.16Å; C122-V126 PolarHBondContact O-N 3.49Å
123N87.9Confident87.5Confident12 Ų1276.8 Ų76.86%0.06438%0.38CS..Hα-helixtrans-62.9-28.5178-80.9-73.7000112.9N104 C107 I108 F119 M120 V126 L127N104-N123 PolarHBondContact ND2-O 3.12Å; N104-N123 PolarHBondContact ND2-OD1 3.43Å; C107-N123 WeakPolarHBondContact CB-OD1 3.32Å; I108-N123 HydrophobicContact CG1-CB 4.16Å; F119-N123 VanDerWaalsContact CD1-ND2 3.32Å; F119-N123 WeakPolarHBondContact CD1-ND2 3.41Å; F119-N123 VanDerWaalsContact CE1-ND2 3.28Å; F119-N123 WeakPolarHBondContact CE1-ND2 3.21Å; F119-N123 WeakPolarHBondContact CZ-ND2 3.33Å; F119-N123 PolarHBondContact O-N 3.33Å; F119-N123 PolarHBondContact O-ND2 3.41Å; M120-N123 PolarHBondContact O-N 3.04Å; N123-V126 PolarHBondContact O-N 2.83Å; N123-L127 WeakPolarHBondContact O-CB 3.01Å; N123-L127 PolarHBondContact O-N 3.35Å
124M87.8Confident87.7Confident13 Ų1371 Ų716%0.06435%0.35CS..Hα-helixtrans-68-35.7175.2-75.1-76.615000113M120 K121 C122 V126 L127 I128 T278 Y282M120-M124 VanDerWaalsContact O-CG 3.28Å; M120-M124 WeakPolarHBondContact O-CG 3.38Å; M120-M124 PolarHBondContact O-N 3.43Å; K121-M124 WeakPolarHBondContact O-CB 3.34Å; K121-M124 PolarHBondContact O-N 2.65Å; C122-M124 PolarHBondContact O-N 3.28Å; M124-V126 VanDerWaalsContact C-N 3.3Å; M124-V126 PolarHBondContact O-N 3.06Å; M124-L127 HydrophobicContact CE-CD2 3.96Å; M124-L127 PolarHBondContact O-N 3.3Å; M124-L127 HydrophobicContact SD-CD2 4.01Å; M124-I128 VanDerWaalsContact O-CG1 3.29Å; M124-I128 WeakPolarHBondContact O-CG1 3.48Å; M124-I128 PolarHBondContact O-N 2.93Å; M124-T278 HydrophobicContact CE-CG2 4.48Å; M124-Y282 HydrophobicContact CB-CE1 4.41Å; M124-Y282 VanDerWaalsContact CE-CB 3.44Å; M124-Y282 HydrophobicContact CE-CD1 3.92Å; M124-Y282 HydrophobicContact CE-CD2 3.47Å; M124-Y282 VanDerWaalsContact CE-CD2 3.47Å; M124-Y282 HydrophobicContact CE-CE2 4.15Å; M124-Y282 HydrophobicContact CE-CG 3.3Å; M124-Y282 HydrophobicContact CG-CD1 3.58Å; M124-Y282 HydrophobicContact CG-CD2 4.26Å; M124-Y282 HydrophobicContact CG-CE1 3.5Å; M124-Y282 HydrophobicContact CG-CE2 4.18Å; M124-Y282 HydrophobicContact CG-CG 3.95Å; M124-Y282 HydrophobicContact SD-CD1 3.49Å; M124-Y282 WeakPolarHBondContact SD-CD1 3.44Å; M124-Y282 HydrophobicContact SD-CD2 4.19Å; M124-Y282 HydrophobicContact SD-CE1 4.09Å; M124-Y282 HydrophobicContact SD-CG 3.53Å; M124-Y282 VanDerWaalsContact SD-CG 3.53Å
125F90Very high87.8Confident153 Ų15366.2 Ų66.267%0.67133%0.333SS*.Hα-helixtrans-63.8-39.3172.9-68.6-70.2000111.6K121 C122 I128 G129K121-F125 VanDerWaalsContact O-CD2 3.22Å; K121-F125 WeakPolarHBondContact O-CD2 3.35Å; K121-F125 PolarHBondContact O-N 3.4Å; C122-F125 PolarHBondContact O-N 2.99Å; C122-F125 VanDerWaalsContact O-N 3.16Å; F125-I128 PolarHBondContact O-N 3.27Å; F125-G129 PolarHBondContact O-N 3.42Å
126V91.2Very high88.2Confident68 Ų6859.9 Ų59.941%0.41232%0.321SS..Hα-helixtrans-64.1-43.4174.4-1790000110.6N104 C122 N123 M124 I128 G129 L130N104-V126 HydrophobicContact CB-CG1 4.39Å; N104-V126 WeakPolarHBondContact ND2-CG1 3.35Å; C122-V126 PolarHBondContact O-N 3.49Å; N123-V126 PolarHBondContact O-N 2.83Å; M124-V126 VanDerWaalsContact C-N 3.3Å; M124-V126 PolarHBondContact O-N 3.06Å; V126-I128 PolarHBondContact O-N 3.24Å; V126-G129 WeakPolarHBondContact O-CA 3.43Å; V126-G129 PolarHBondContact O-N 3.42Å; V126-G129 VanDerWaalsContact O-N 3.14Å; V126-L130 PolarHBondContact O-N 2.98Å
127L92.1Very high88.2Confident2 Ų260.3 Ų60.31%0.0132%0.319CS..Hα-helixtrans-63.8-38.6178.4-169.962.8000112.5I108 N123 M124 L130 L131 H275 T278 I279I108-L127 HydrophobicContact CD1-CD2 4.35Å; N123-L127 WeakPolarHBondContact O-CB 3.01Å; N123-L127 PolarHBondContact O-N 3.35Å; M124-L127 HydrophobicContact CE-CD2 3.96Å; M124-L127 PolarHBondContact O-N 3.3Å; M124-L127 HydrophobicContact SD-CD2 4.01Å; L127-L130 PolarHBondContact O-N 2.91Å; L127-L131 WeakPolarHBondContact O-CB 3.17Å; L127-L131 PolarHBondContact O-N 2.99Å; L127-H275 HydrophobicContact CD1-CB 4.19Å; L127-H275 WeakPolarHBondContact CD1-CD2 3.31Å; L127-T278 HydrophobicContact CD2-CG2 3.77Å; L127-I279 HydrophobicContact CD2-CD1 4.32Å; L127-I279 HydrophobicContact CD2-CG1 3.57Å; L127-I279 HydrophobicContact CG-CD1 4.06Å; L127-I279 HydrophobicContact CG-CG1 3.86Å
128I93.2Very high88.6Confident77 Ų7756.1 Ų56.140%0.39530%0.299SS..Hα-helixtrans-65-41.3172.2-69165000110.5M124 F125 V126 L131 I132 I279M124-I128 VanDerWaalsContact O-CG1 3.29Å; M124-I128 WeakPolarHBondContact O-CG1 3.48Å; M124-I128 PolarHBondContact O-N 2.93Å; F125-I128 PolarHBondContact O-N 3.27Å; V126-I128 PolarHBondContact O-N 3.24Å; I128-L131 WeakPolarHBondContact O-CB 3.16Å; I128-L131 PolarHBondContact O-N 2.95Å; I128-I132 HydrophobicContact CG2-CD1 4.13Å; I128-I132 WeakPolarHBondContact O-CG1 3.48Å; I128-I132 PolarHBondContact O-N 2.95Å; I128-I279 HydrophobicContact CG1-CD1 4.12Å
129G92.5Very high88.7Confident39 Ų3951 Ų5140%0.40228%0.284SS..Hα-helixtrans-60.1-44.417400000112.6F125 V126 I132 A133F125-G129 PolarHBondContact O-N 3.42Å; V126-G129 WeakPolarHBondContact O-CA 3.43Å; V126-G129 PolarHBondContact O-N 3.42Å; V126-G129 VanDerWaalsContact O-N 3.14Å; G129-I132 PolarHBondContact O-N 2.85Å; G129-A133 PolarHBondContact O-N 2.99Å
130L92.6Very high88.7Confident11 Ų1151.1 Ų51.16%0.05829%0.291CS..Hα-helixtrans-60.7-44.1173.2-77.9172.8000111.6I100 I101 N104 V126 L127 I132 A133 D134I100-L130 HydrophobicContact CB-CD2 4.39Å; I100-L130 HydrophobicContact CG2-CD1 4.34Å; I100-L130 HydrophobicContact CG2-CD2 3.78Å; I100-L130 HydrophobicContact CG2-CG 4.33Å; I101-L130 HydrophobicContact CG1-CD1 4.14Å; I101-L130 HydrophobicContact CG1-CD2 4.14Å; N104-L130 HydrophobicContact CB-CD1 4.07Å; V126-L130 PolarHBondContact O-N 2.98Å; L127-L130 PolarHBondContact O-N 2.91Å; L130-I132 VanDerWaalsContact C-N 3.3Å; L130-I132 PolarHBondContact O-N 3Å; L130-A133 CarbonylContact O-C 3.6Å; L130-A133 WeakPolarHBondContact O-CB 3.35Å; L130-A133 PolarHBondContact O-N 3.07Å; L130-A133 VanDerWaalsContact O-N 3.13Å; L130-D134 WeakPolarHBondContact O-CB 3.09Å; L130-D134 PolarHBondContact O-N 3.32Å
131L93Very high88.4Confident38 Ų3854.8 Ų54.820%0.19931%0.305CS..Hα-helixtrans-58.7-42.5176.9-175.475000112.1L127 I128 T135 L272 H275 I276 I279L127-L131 WeakPolarHBondContact O-CB 3.17Å; L127-L131 PolarHBondContact O-N 2.99Å; I128-L131 WeakPolarHBondContact O-CB 3.16Å; I128-L131 PolarHBondContact O-N 2.95Å; L131-T135 WeakPolarHBondContact O-CB 3.32Å; L131-T135 PolarHBondContact O-N 3.04Å; L131-T135 PolarHBondContact O-OG1 3.17Å; L131-L272 HydrophobicContact CD1-CD1 3.6Å; L131-L272 HydrophobicContact CD1-CG 4.43Å; L131-L272 HydrophobicContact CG-CD1 4.4Å; L131-H275 HydrophobicContact CD1-CB 3.82Å; L131-I276 HydrophobicContact CD1-CD1 4.36Å; L131-I276 HydrophobicContact CD1-CG1 3.56Å; L131-I276 HydrophobicContact CD2-CG1 4.46Å; L131-I279 HydrophobicContact CB-CD1 4.26Å; L131-I279 HydrophobicContact CD2-CD1 3.86Å
132I92.4Very high88Confident111 Ų11154.6 Ų54.657%0.56931%0.308SS*.Hα-helixtrans-65-43.6176.5-66.5165.8000110.3I128 G129 L130 T135 A136I128-I132 HydrophobicContact CG2-CD1 4.13Å; I128-I132 WeakPolarHBondContact O-CG1 3.48Å; I128-I132 PolarHBondContact O-N 2.95Å; G129-I132 PolarHBondContact O-N 2.85Å; L130-I132 VanDerWaalsContact C-N 3.3Å; L130-I132 PolarHBondContact O-N 3Å; I132-T135 PolarHBondContact O-N 2.91Å; I132-A136 WeakPolarHBondContact O-CB 3.27Å; I132-A136 PolarHBondContact O-N 3.1Å
133A89.7Confident87.4Confident42 Ų4261.1 Ų61.135%0.34733%0.327SS..Hα-helixtrans-62.3-47.6177.200000111.8G129 L130 T135 A136 V137G129-A133 PolarHBondContact O-N 2.99Å; L130-A133 CarbonylContact O-C 3.6Å; L130-A133 WeakPolarHBondContact O-CB 3.35Å; L130-A133 PolarHBondContact O-N 3.07Å; L130-A133 VanDerWaalsContact O-N 3.13Å; A133-T135 VanDerWaalsContact C-N 3.31Å; A133-T135 PolarHBondContact O-N 3.22Å; A133-A136 PolarHBondContact O-N 3.29Å; A133-V137 WeakPolarHBondContact O-CG2 3.32Å; A133-V137 PolarHBondContact O-N 3.37Å
134D89.9Confident86.6Confident0 Ų065.8 Ų65.80%035%0.347CS..Hα-helixtrans-56.8-45.9174.7-80-37.8000111.2H97 L130 A136 V137 F138 L272 H275H97-D134 IonicContact CE1-OD1 2.68Å; H97-D134 PolarHBondContact CE1-OD1 3.43Å; H97-D134 IonicContact NE2-OD1 3.96Å; H97-D134 PolarHBondContact NE2-OD1 2.82Å; L130-D134 WeakPolarHBondContact O-CB 3.09Å; L130-D134 PolarHBondContact O-N 3.32Å; D134-A136 PolarHBondContact O-N 2.83Å; D134-V137 PolarHBondContact O-N 3.05Å; D134-F138 WeakPolarHBondContact O-CB 3.5Å; D134-F138 PolarHBondContact O-N 3.15Å; D134-L272 HydrophobicContact CB-CB 4.25Å; D134-L272 HydrophobicContact CB-CD1 3.81Å; D134-H275 IonicContact OD2-CE1 2.65Å; D134-H275 PolarHBondContact OD2-CE1 3.47Å; D134-H275 IonicContact OD2-CG 2.65Å; D134-H275 IonicContact OD2-ND1 3.39Å; D134-H275 PolarHBondContact OD2-ND1 2.95Å
135T90.3Very high85.5Confident52 Ų5268.9 Ų68.932%0.31936%0.363SS..Hα-helixtrans-61.7-46.1178.8-56.90000110.7L131 I132 A133 F138 L139 L272L131-T135 WeakPolarHBondContact O-CB 3.32Å; L131-T135 PolarHBondContact O-N 3.04Å; L131-T135 PolarHBondContact O-OG1 3.17Å; I132-T135 PolarHBondContact O-N 2.91Å; A133-T135 VanDerWaalsContact C-N 3.31Å; A133-T135 PolarHBondContact O-N 3.22Å; T135-F138 PolarHBondContact O-N 3.32Å; T135-L139 HydrophobicContact CG2-CD1 3.78Å; T135-L139 HydrophobicContact CG2-CG 4.24Å; T135-L139 VanDerWaalsContact O-CB 3.3Å; T135-L139 WeakPolarHBondContact O-CB 2.98Å; T135-L139 WeakPolarHBondContact O-CG 3.41Å; T135-L139 PolarHBondContact O-N 2.85Å; T135-L272 VanDerWaalsContact OG1-CD1 3.28Å; T135-L272 WeakPolarHBondContact OG1-CD1 3.33Å
136A88.7Confident84.2Confident53 Ų5363.2 Ų63.244%0.43834%0.342SS..Hα-helixtrans-63.5-44.217900000112.1I132 A133 D134 T140I132-A136 WeakPolarHBondContact O-CB 3.27Å; I132-A136 PolarHBondContact O-N 3.1Å; A133-A136 PolarHBondContact O-N 3.29Å; D134-A136 PolarHBondContact O-N 2.83Å; A136-T140 WeakPolarHBondContact O-CB 3.47Å; A136-T140 PolarHBondContact O-N 2.95Å; A136-T140 PolarHBondContact O-OG1 3.5Å
137V85Confident82.9Confident45 Ų4567.1 Ų67.127%0.27335%0.353SS..Hα-helixtrans-65.4-48.1177.6174.60000110.3A133 D134 L139 T140 W141 T268A133-V137 WeakPolarHBondContact O-CG2 3.32Å; A133-V137 PolarHBondContact O-N 3.37Å; D134-V137 PolarHBondContact O-N 3.05Å; V137-L139 PolarHBondContact O-N 3.45Å; V137-T140 WeakPolarHBondContact O-CB 3.25Å; V137-T140 PolarHBondContact O-N 3.37Å; V137-T140 VanDerWaalsContact O-N 3.15Å; V137-W141 PolarHBondContact O-N 2.88Å; V137-T268 HydrophobicContact CB-CG2 4.27Å; V137-T268 HydrophobicContact CG1-CG2 3.67Å
138F85.3Confident81.6Confident36 Ų3672.9 Ų72.916%0.15838%0.383CS..Hα-helixtrans-59.7-46.7178.7-179.9-109.6000112.4D134 T135 T140 W141 I142 L269 L272D134-F138 WeakPolarHBondContact O-CB 3.5Å; D134-F138 PolarHBondContact O-N 3.15Å; T135-F138 PolarHBondContact O-N 3.32Å; F138-T140 VanDerWaalsContact C-N 3.31Å; F138-T140 PolarHBondContact O-N 3.47Å; F138-W141 PolarHBondContact O-N 3.37Å; F138-I142 HydrophobicContact CD1-CD1 4.08Å; F138-I142 HydrophobicContact CD2-CD1 4.44Å; F138-I142 HydrophobicContact CE1-CD1 3.39Å; F138-I142 HydrophobicContact CE1-CG1 4.43Å; F138-I142 HydrophobicContact CE2-CD1 3.79Å; F138-I142 HydrophobicContact CE2-CG1 4.29Å; F138-I142 HydrophobicContact CZ-CD1 3.24Å; F138-I142 HydrophobicContact CZ-CG1 4.2Å; F138-I142 PolarHBondContact O-N 3.12Å; F138-L269 HydrophobicContact CD2-CB 4.21Å; F138-L269 HydrophobicContact CE1-CD1 4.43Å; F138-L269 HydrophobicContact CE2-CB 3.8Å; F138-L269 HydrophobicContact CE2-CD1 3.97Å; F138-L269 HydrophobicContact CE2-CD2 4.4Å; F138-L269 HydrophobicContact CE2-CG 4.27Å; F138-L269 HydrophobicContact CZ-CB 4.49Å; F138-L269 HydrophobicContact CZ-CD1 3.79Å; F138-L269 HydrophobicContact CZ-CG 4.5Å; F138-L272 HydrophobicContact CD1-CD2 4.22Å
139L85.7Confident80.4Confident79 Ų7971.3 Ų71.341%0.41438%0.379SS..Hα-helixtrans-61.3-41.5174.7-69.9171.9000111.1T135 V137 W141 I142 Y143T135-L139 HydrophobicContact CG2-CD1 3.78Å; T135-L139 HydrophobicContact CG2-CG 4.24Å; T135-L139 VanDerWaalsContact O-CB 3.3Å; T135-L139 WeakPolarHBondContact O-CB 2.98Å; T135-L139 WeakPolarHBondContact O-CG 3.41Å; T135-L139 PolarHBondContact O-N 2.85Å; V137-L139 PolarHBondContact O-N 3.45Å; L139-W141 VanDerWaalsContact C-N 3.32Å; L139-W141 PolarHBondContact O-N 3.48Å; L139-I142 PolarHBondContact O-N 2.81Å; L139-Y143 HydrophobicContact CB-CD2 4.34Å; L139-Y143 HydrophobicContact CD2-CD2 4.24Å; L139-Y143 HydrophobicContact CD2-CE2 3.76Å; L139-Y143 WeakPolarHBondContact O-CB 3.46Å; L139-Y143 VanDerWaalsContact O-CD2 3.28Å; L139-Y143 WeakPolarHBondContact O-CD2 2.91Å; L139-Y143 PolarHBondContact O-N 3.25Å
140T80.5Confident79.2Confident83 Ų8370.4 Ų70.451%0.50937%0.365SS..Hα-helixtrans-59.6-44.1175.8-57.80000110.9A136 V137 F138 K144A136-T140 WeakPolarHBondContact O-CB 3.47Å; A136-T140 PolarHBondContact O-N 2.95Å; A136-T140 PolarHBondContact O-OG1 3.5Å; V137-T140 WeakPolarHBondContact O-CB 3.25Å; V137-T140 PolarHBondContact O-N 3.37Å; V137-T140 VanDerWaalsContact O-N 3.15Å; F138-T140 VanDerWaalsContact C-N 3.31Å; F138-T140 PolarHBondContact O-N 3.47Å; T140-K144 WeakPolarHBondContact O-CA 3.32Å; T140-K144 WeakPolarHBondContact O-CB 3.22Å; T140-K144 PolarHBondContact O-N 2.91Å
141W76.5Confident78.3Confident83 Ų8371.2 Ų71.231%0.31438%0.376SS..Hα-helixtrans-69.2-32.3179.2-79107.1000114.2L90 V137 F138 L139 R265L90-W141 HydrophobicContact CD1-CZ2 3.83Å; L90-W141 HydrophobicContact CD2-CH2 4.1Å; L90-W141 HydrophobicContact CD2-CZ2 4.09Å; V137-W141 PolarHBondContact O-N 2.88Å; F138-W141 PolarHBondContact O-N 3.37Å; L139-W141 VanDerWaalsContact C-N 3.32Å; L139-W141 PolarHBondContact O-N 3.48Å; W141-R265 HydrophobicContact CE3-CG 4.44Å
142I76.9Confident77.5Confident100 Ų10076.2 Ų76.251%0.51340%0.4SS..Hα-helixtrans-73.9-45.7175.9-73.2-172.6000111.7F138 L139F138-I142 HydrophobicContact CD1-CD1 4.08Å; F138-I142 HydrophobicContact CD2-CD1 4.44Å; F138-I142 HydrophobicContact CE1-CD1 3.39Å; F138-I142 HydrophobicContact CE1-CG1 4.43Å; F138-I142 HydrophobicContact CE2-CD1 3.79Å; F138-I142 HydrophobicContact CE2-CG1 4.29Å; F138-I142 HydrophobicContact CZ-CD1 3.24Å; F138-I142 HydrophobicContact CZ-CG1 4.2Å; F138-I142 PolarHBondContact O-N 3.12Å; L139-I142 PolarHBondContact O-N 2.81Å
143Y74.7Confident76.9Confident186 Ų18672.6 Ų72.673%0.72938%0.381SS*.Hα-helixtrans-89.5-19-172.7-73.7-72.7000113.9L139 D145L139-Y143 HydrophobicContact CB-CD2 4.34Å; L139-Y143 HydrophobicContact CD2-CD2 4.24Å; L139-Y143 HydrophobicContact CD2-CE2 3.76Å; L139-Y143 WeakPolarHBondContact O-CB 3.46Å; L139-Y143 VanDerWaalsContact O-CD2 3.28Å; L139-Y143 WeakPolarHBondContact O-CD2 2.91Å; L139-Y143 PolarHBondContact O-N 3.25Å; Y143-D145 PolarHBondContact O-N 3.42Å
144K69.6Low76.5Confident111 Ų11171 Ų7148%0.48337%0.366SS..SBendtrans-69.6104.2173.9-173.7176.5-175.5-176.70108.3T140 P146T140-K144 WeakPolarHBondContact O-CA 3.32Å; T140-K144 WeakPolarHBondContact O-CB 3.22Å; T140-K144 PolarHBondContact O-N 2.91Å; K144-P146 WeakPolarHBondContact O-CD 3.44Å; K144-P146 VanDerWaalsContact O-N 3.13Å
145D64.8Low76.1Confident77 Ų7775.1 Ų75.141%0.41239%0.388SS..  trans-54.1119.3172.8-172.1-24.3000108.2Y143 K147 I148Y143-D145 PolarHBondContact O-N 3.42Å; D145-K147 PolarHBondContact O-N 2.95Å; D145-K147 WeakPolarHBondContact OD1-CB 3.43Å; D145-K147 WeakPolarHBondContact OD1-CG 3.44Å; D145-K147 PolarHBondContact OD1-N 3.48Å; D145-I148 HydrophobicContact CB-CD1 4.43Å; D145-I148 HydrophobicContact CB-CG1 4.47Å; D145-I148 PolarHBondContact O-N 3.32Å; D145-I148 VanDerWaalsContact O-N 3.16Å
146P63.4Low75.8Confident34 Ų3475.3 Ų75.322%0.22139%0.385CS..Hα-helixtrans-53.1-32.2-177.918.4-30.8000111.5K144 I148 S149 V150 Y253K144-P146 WeakPolarHBondContact O-CD 3.44Å; K144-P146 VanDerWaalsContact O-N 3.13Å; P146-I148 VanDerWaalsContact C-N 3.3Å; P146-I148 PolarHBondContact O-N 3.2Å; P146-S149 PolarHBondContact O-N 2.92Å; P146-S149 PolarHBondContact O-OG 3.43Å; P146-V150 WeakPolarHBondContact O-CG2 3.35Å; P146-V150 PolarHBondContact O-N 3.15Å; P146-Y253 HydrophobicContact CB-CE1 4.22Å; P146-Y253 HydrophobicContact CG-CE1 4.41Å
147K64.5Low75.6Confident151 Ų15172.9 Ų72.966%0.65737%0.365SS*.Hα-helixtrans-58.6-34.7-177.4-65.2179-179.1-178.50114.3D145 V150 G151D145-K147 PolarHBondContact O-N 2.95Å; D145-K147 WeakPolarHBondContact OD1-CB 3.43Å; D145-K147 WeakPolarHBondContact OD1-CG 3.44Å; D145-K147 PolarHBondContact OD1-N 3.48Å; K147-V150 WeakPolarHBondContact O-CB 3.5Å; K147-V150 PolarHBondContact O-N 2.87Å; K147-G151 PolarHBondContact O-N 3.44Å
148I65.3Low75.7Confident123 Ų12374.3 Ų74.363%0.63137%0.369SS*.Hα-helixtrans-70.4-40.6-178-60.7174.7000110.5D145 P146 V150D145-I148 HydrophobicContact CB-CD1 4.43Å; D145-I148 HydrophobicContact CB-CG1 4.47Å; D145-I148 PolarHBondContact O-N 3.32Å; D145-I148 VanDerWaalsContact O-N 3.16Å; P146-I148 VanDerWaalsContact C-N 3.3Å; P146-I148 PolarHBondContact O-N 3.2Å; I148-V150 VanDerWaalsContact C-N 3.35Å
149S66.6Low75.7Confident44 Ų4478.1 Ų78.131%0.30839%0.385SS..Hα-helixtrans-72.1-29.5173.935.10000113P146 F153P146-S149 PolarHBondContact O-N 2.92Å; P146-S149 PolarHBondContact O-OG 3.43Å; S149-F153 WeakPolarHBondContact O-CB 3.01Å; S149-F153 PolarHBondContact O-N 3.43Å
150V68.5Low75.8Confident20 Ų2074.6 Ų74.612%0.12137%0.367CS..Hα-helixtrans-60.1-52.9178.1176.30000109.9P146 K147 I148 M152 F153 L154 T252P146-V150 WeakPolarHBondContact O-CG2 3.35Å; P146-V150 PolarHBondContact O-N 3.15Å; K147-V150 WeakPolarHBondContact O-CB 3.5Å; K147-V150 PolarHBondContact O-N 2.87Å; I148-V150 VanDerWaalsContact C-N 3.35Å; V150-M152 PolarHBondContact O-N 2.72Å; V150-F153 WeakPolarHBondContact O-CB 3.32Å; V150-F153 PolarHBondContact O-N 3.34Å; V150-F153 VanDerWaalsContact O-N 3.07Å; V150-L154 HydrophobicContact CG1-CD1 3.43Å; V150-L154 VanDerWaalsContact CG1-CD1 3.43Å; V150-L154 HydrophobicContact CG1-CD2 4.37Å; V150-L154 HydrophobicContact CG1-CG 3.66Å; V150-L154 VanDerWaalsContact O-CG 3.28Å; V150-L154 WeakPolarHBondContact O-CG 3.49Å; V150-L154 PolarHBondContact O-N 2.84Å; V150-T252 HydrophobicContact CB-CG2 4.2Å; V150-T252 HydrophobicContact CG2-CG2 3.18Å
151G73.8Confident76.2Confident28 Ų2870.7 Ų70.729%0.28934%0.343SS..Hα-helixtrans-54.7-49.6-172.900000113.8K147 F153 L154 D155K147-G151 PolarHBondContact O-N 3.44Å; G151-F153 VanDerWaalsContact C-N 3.33Å; G151-F153 PolarHBondContact O-N 3.35Å; G151-L154 PolarHBondContact O-N 3.38Å; G151-D155 VanDerWaalsContact O-CG 3.31Å; G151-D155 PolarHBondContact O-N 3.26Å
152M75.3Confident76.9Confident142 Ų14270.6 Ų70.670%0.735%0.348SS*.Hα-helixtrans-63.3-38.7179.2-127.7-176.3-6500112.5V150 E156V150-M152 PolarHBondContact O-N 2.72Å; M152-E156 WeakPolarHBondContact O-CG 3.16Å; M152-E156 PolarHBondContact O-N 2.99Å
153F79Confident77.4Confident36 Ų3670.2 Ų70.216%0.15834%0.344CS..Hα-helixtrans-67.4-42.7177.1171.9-113.1000111.9L86 S149 V150 G151 E156 L157 L251L86-F153 HydrophobicContact CD2-CE2 4.09Å; L86-F153 HydrophobicContact CD2-CZ 4.12Å; S149-F153 WeakPolarHBondContact O-CB 3.01Å; S149-F153 PolarHBondContact O-N 3.43Å; V150-F153 WeakPolarHBondContact O-CB 3.32Å; V150-F153 PolarHBondContact O-N 3.34Å; V150-F153 VanDerWaalsContact O-N 3.07Å; G151-F153 VanDerWaalsContact C-N 3.33Å; G151-F153 PolarHBondContact O-N 3.35Å; F153-E156 PolarHBondContact O-N 2.94Å; F153-L157 HydrophobicContact CD1-CD1 4.13Å; F153-L157 HydrophobicContact CD2-CD1 4.46Å; F153-L157 HydrophobicContact CD2-CG 4.39Å; F153-L157 HydrophobicContact CE1-CD1 3.44Å; F153-L157 VanDerWaalsContact CE1-CD1 3.44Å; F153-L157 HydrophobicContact CE1-CG 4.34Å; F153-L157 HydrophobicContact CE2-CD1 3.81Å; F153-L157 HydrophobicContact CE2-CD2 4.46Å; F153-L157 HydrophobicContact CE2-CG 3.95Å; F153-L157 HydrophobicContact CZ-CD1 3.28Å; F153-L157 HydrophobicContact CZ-CG 3.96Å; F153-L157 PolarHBondContact O-N 3.28Å; F153-L251 HydrophobicContact CE1-CB 4.03Å; F153-L251 HydrophobicContact CZ-CB 4.37Å
154L81.7Confident78.2Confident8 Ų861.5 Ų61.54%0.04231%0.31CS..Hα-helixtrans-66.2-42.2178.2-64.1-169.9000112.2V150 G151 E156 L157 Q158 M189 Y190V150-L154 HydrophobicContact CG1-CD1 3.43Å; V150-L154 VanDerWaalsContact CG1-CD1 3.43Å; V150-L154 HydrophobicContact CG1-CD2 4.37Å; V150-L154 HydrophobicContact CG1-CG 3.66Å; V150-L154 VanDerWaalsContact O-CG 3.28Å; V150-L154 WeakPolarHBondContact O-CG 3.49Å; V150-L154 PolarHBondContact O-N 2.84Å; G151-L154 PolarHBondContact O-N 3.38Å; L154-E156 VanDerWaalsContact C-N 3.28Å; L154-E156 PolarHBondContact O-N 2.79Å; L154-L157 PolarHBondContact O-N 3.08Å; L154-Q158 WeakPolarHBondContact O-CB 3.42Å; L154-Q158 PolarHBondContact O-N 3Å; L154-M189 HydrophobicContact CD2-CE 3.56Å; L154-Y190 HydrophobicContact CD1-CD1 4.38Å; L154-Y190 HydrophobicContact CD1-CE1 3.47Å; L154-Y190 VanDerWaalsContact CD1-CE1 3.47Å
155D82.8Confident79.2Confident87 Ų8757.9 Ų57.947%0.46530%0.299SS..Hα-helixtrans-59.9-40.5177.7-74.3-11000111.5G151 K159G151-D155 VanDerWaalsContact O-CG 3.31Å; G151-D155 PolarHBondContact O-N 3.26Å; D155-K159 PolarHBondContact O-N 3.4Å
156E83Confident80.2Confident56 Ų5654.2 Ų54.226%0.26228%0.279SS..Hα-helixtrans-72.9-40.1176.7-68.4-62.7147.900112.4L85 M152 F153 L154 Q158 K159 V160L85-E156 HydrophobicContact CD1-CB 3.44Å; L85-E156 VanDerWaalsContact CD1-CB 3.44Å; L85-E156 HydrophobicContact CD1-CG 3.72Å; L85-E156 HydrophobicContact CD2-CB 3.59Å; L85-E156 HydrophobicContact CG-CB 4.04Å; M152-E156 WeakPolarHBondContact O-CG 3.16Å; M152-E156 PolarHBondContact O-N 2.99Å; F153-E156 PolarHBondContact O-N 2.94Å; L154-E156 VanDerWaalsContact C-N 3.28Å; L154-E156 PolarHBondContact O-N 2.79Å; E156-Q158 VanDerWaalsContact C-N 3.26Å; E156-Q158 PolarHBondContact O-N 3.49Å; E156-K159 VanDerWaalsContact CD-NZ 3.34Å; E156-K159 WeakPolarHBondContact O-CB 3.19Å; E156-K159 PolarHBondContact O-N 2.87Å; E156-K159 VanDerWaalsContact O-N 3.15Å; E156-K159 IonicContact OE1-NZ 2.93Å; E156-K159 PolarHBondContact OE1-NZ 3.41Å; E156-K159 IonicContact OE2-NZ 2.74Å; E156-K159 PolarHBondContact OE2-NZ 3.26Å; E156-V160 WeakPolarHBondContact O-CG2 3.47Å; E156-V160 PolarHBondContact O-N 3.47Å
157L83.6Confident81Confident2 Ų253.4 Ų53.41%0.0128%0.275CS..Hα-helixtrans-63.4-32.3172.8-80.4-172.8000112.7L82 L86 F153 L154 K159 V160 Q161 M189 L251L82-L157 HydrophobicContact CD1-CD2 4.32Å; L86-L157 HydrophobicContact CD2-CD2 3.87Å; F153-L157 HydrophobicContact CD1-CD1 4.13Å; F153-L157 HydrophobicContact CD2-CD1 4.46Å; F153-L157 HydrophobicContact CD2-CG 4.39Å; F153-L157 HydrophobicContact CE1-CD1 3.44Å; F153-L157 VanDerWaalsContact CE1-CD1 3.44Å; F153-L157 HydrophobicContact CE1-CG 4.34Å; F153-L157 HydrophobicContact CE2-CD1 3.81Å; F153-L157 HydrophobicContact CE2-CD2 4.46Å; F153-L157 HydrophobicContact CE2-CG 3.95Å; F153-L157 HydrophobicContact CZ-CD1 3.28Å; F153-L157 HydrophobicContact CZ-CG 3.96Å; F153-L157 PolarHBondContact O-N 3.28Å; L154-L157 PolarHBondContact O-N 3.08Å; L157-K159 VanDerWaalsContact C-N 3.3Å; L157-K159 PolarHBondContact O-N 2.81Å; L157-V160 WeakPolarHBondContact O-CB 3.4Å; L157-V160 PolarHBondContact O-N 3.4Å; L157-Q161 PolarHBondContact O-N 3Å; L157-M189 HydrophobicContact CB-CE 3.58Å; L157-M189 HydrophobicContact CB-SD 3.94Å; L157-M189 HydrophobicContact CD1-CE 3.55Å; L157-M189 HydrophobicContact CD1-SD 4.36Å; L157-M189 HydrophobicContact CG-CE 4.25Å; L157-L251 HydrophobicContact CD1-CD1 3.87Å
158Q87.3Confident81.7Confident74 Ų7449.6 Ų49.635%0.34626%0.259SS..Hα-helixtrans-66.4-34175.1-167.1174.511.800111.6L154 E156 V160 Q161 I162L154-Q158 WeakPolarHBondContact O-CB 3.42Å; L154-Q158 PolarHBondContact O-N 3Å; E156-Q158 VanDerWaalsContact C-N 3.26Å; E156-Q158 PolarHBondContact O-N 3.49Å; Q158-V160 VanDerWaalsContact C-N 3.29Å; Q158-V160 PolarHBondContact O-N 3.46Å; Q158-Q161 WeakPolarHBondContact O-CB 3.38Å; Q158-Q161 PolarHBondContact O-N 2.94Å; Q158-I162 PolarHBondContact O-N 2.68Å
159K86.6Confident82.6Confident116 Ų11643.8 Ų43.850%0.50423%0.23SC..Hα-helixtrans-63.9-37.3172.1-65.6171.5-171.1169.90111.8D155 E156 L157 I162D155-K159 PolarHBondContact O-N 3.4Å; E156-K159 VanDerWaalsContact CD-NZ 3.34Å; E156-K159 WeakPolarHBondContact O-CB 3.19Å; E156-K159 PolarHBondContact O-N 2.87Å; E156-K159 VanDerWaalsContact O-N 3.15Å; E156-K159 IonicContact OE1-NZ 2.93Å; E156-K159 PolarHBondContact OE1-NZ 3.41Å; E156-K159 IonicContact OE2-NZ 2.74Å; E156-K159 PolarHBondContact OE2-NZ 3.26Å; L157-K159 VanDerWaalsContact C-N 3.3Å; L157-K159 PolarHBondContact O-N 2.81Å; K159-I162 PolarHBondContact O-N 2.93Å
160V86.9Confident83.5Confident6 Ų646.2 Ų46.24%0.03624%0.239CC..Hα-helixtrans-69.7-37.7176.51780000110.9L82 L85 E156 L157 Q158 I162 Q163 P173 F177L82-V160 HydrophobicContact CD1-CB 4.27Å; L82-V160 HydrophobicContact CD1-CG1 3.92Å; L82-V160 HydrophobicContact CD1-CG2 3.49Å; L82-V160 VanDerWaalsContact CD1-CG2 3.49Å; L82-V160 HydrophobicContact CD2-CG1 3.44Å; L82-V160 VanDerWaalsContact CD2-CG1 3.44Å; L82-V160 HydrophobicContact CD2-CG2 4.42Å; L82-V160 HydrophobicContact CG-CG1 4.36Å; L85-V160 HydrophobicContact CD2-CG2 4.13Å; E156-V160 WeakPolarHBondContact O-CG2 3.47Å; E156-V160 PolarHBondContact O-N 3.47Å; L157-V160 WeakPolarHBondContact O-CB 3.4Å; L157-V160 PolarHBondContact O-N 3.4Å; Q158-V160 VanDerWaalsContact C-N 3.29Å; Q158-V160 PolarHBondContact O-N 3.46Å; V160-I162 PolarHBondContact O-N 2.71Å; V160-Q163 WeakPolarHBondContact O-CB 3.14Å; V160-Q163 PolarHBondContact O-N 2.97Å; V160-P173 HydrophobicContact CG1-CB 3.8Å; V160-P173 HydrophobicContact CG1-CG 4.04Å; V160-F177 HydrophobicContact CG1-CE2 4.08Å
161Q90Very high84.4Confident0 Ų047.2 Ų47.20%024%0.244CC..Hα-helixtrans-56.9-32.8177-168.2-175.313.900112.5L157 Q158 Q163 Y164 F177 E194 W195 I200L157-Q161 PolarHBondContact O-N 3Å; Q158-Q161 WeakPolarHBondContact O-CB 3.38Å; Q158-Q161 PolarHBondContact O-N 2.94Å; Q161-Q163 PolarHBondContact O-N 3.06Å; Q161-Y164 WeakPolarHBondContact O-CB 3.47Å; Q161-Y164 PolarHBondContact O-N 3.27Å; Q161-Y164 VanDerWaalsContact O-N 3.15Å; Q161-F177 VanDerWaalsContact CA-CE2 3.46Å; Q161-F177 HydrophobicContact CB-CE1 4.4Å; Q161-F177 HydrophobicContact CB-CE2 3.91Å; Q161-F177 HydrophobicContact CB-CZ 3.63Å; Q161-F177 HydrophobicContact CG-CE1 4.23Å; Q161-F177 HydrophobicContact CG-CE2 4.34Å; Q161-F177 HydrophobicContact CG-CZ 3.94Å; Q161-E194 PolarHBondContact NE2-OE2 3.29Å; Q161-E194 PolarHBondContact OE1-OE2 2.91Å; Q161-W195 HydrophobicContact CG-CH2 3.63Å; Q161-W195 HydrophobicContact CG-CZ2 3.95Å; Q161-W195 HydrophobicContact CG-CZ3 4.2Å; Q161-I200 HydrophobicContact CG-CD1 4.21Å
162I89.9Confident85.1Confident81 Ų8146.1 Ų46.142%0.41523%0.231SC..THydrogen-bonded Turntrans-64.7-23178-61.3166.2000111.8Q158 K159 V160 Y164Q158-I162 PolarHBondContact O-N 2.68Å; K159-I162 PolarHBondContact O-N 2.93Å; V160-I162 PolarHBondContact O-N 2.71Å; I162-Y164 VanDerWaalsContact C-N 3.32Å
163Q88.9Confident85.8Confident93 Ų9339.3 Ų39.344%0.43520%0.198SC..THydrogen-bonded Turntrans-87.92179-60.4173.8-24.900113.3E78 V160 Q161 S165 N171 P173E78-Q163 PolarHBondContact OE1-OE1 3.24Å; V160-Q163 WeakPolarHBondContact O-CB 3.14Å; V160-Q163 PolarHBondContact O-N 2.97Å; Q161-Q163 PolarHBondContact O-N 3.06Å; Q163-S165 PolarHBondContact O-N 3.47Å; Q163-N171 PolarHBondContact O-ND2 2.93Å; Q163-P173 HydrophobicContact CB-CB 4.1Å; Q163-P173 HydrophobicContact CB-CG 3.94Å
164Y91.1Very high86.3Confident2 Ų237.6 Ų37.61%0.00819%0.19CC..  trans-63.5126.8177.8-178.1-101.7000111.6Q161 I162 G166 T174 F177 N178 W195 W202 P218Q161-Y164 WeakPolarHBondContact O-CB 3.47Å; Q161-Y164 PolarHBondContact O-N 3.27Å; Q161-Y164 VanDerWaalsContact O-N 3.15Å; I162-Y164 VanDerWaalsContact C-N 3.32Å; Y164-G166 VanDerWaalsContact OH-C 3.29Å; Y164-G166 PolarHBondContact OH-O 3.49Å; Y164-T174 HydrophobicContact CD2-CG2 4.1Å; Y164-T174 HydrophobicContact CE2-CG2 3.76Å; Y164-F177 HydrophobicContact CD2-CB 3.83Å; Y164-F177 HydrophobicContact CD2-CG 4.46Å; Y164-F177 HydrophobicContact CE2-CB 3.97Å; Y164-N178 WeakPolarHBondContact CE2-OD1 3.18Å; Y164-N178 PolarHBondContact OH-OD1 3.35Å; Y164-W195 HydrophobicContact CD1-CE3 4.28Å; Y164-W195 AromaticContact CD1-CH2 3.61Å; Y164-W195 HydrophobicContact CD1-CH2 3.61Å; Y164-W195 AromaticContact CD1-CZ3 3.32Å; Y164-W195 HydrophobicContact CD1-CZ3 3.32Å; Y164-W195 HydrophobicContact CD2-CH2 4.12Å; Y164-W195 HydrophobicContact CE1-CH2 4.17Å; Y164-W195 AromaticContact CE1-CZ3 3.99Å; Y164-W195 HydrophobicContact CE1-CZ3 3.99Å; Y164-W195 AromaticContact CG-CH2 3.58Å; Y164-W195 HydrophobicContact CG-CH2 3.58Å; Y164-W195 AromaticContact CG-CZ3 3.71Å; Y164-W195 HydrophobicContact CG-CZ3 3.71Å; Y164-W202 HydrophobicContact CD1-CB 3.84Å; Y164-W202 HydrophobicContact CD1-CD2 4.23Å; Y164-W202 HydrophobicContact CD1-CE3 4.4Å; Y164-W202 HydrophobicContact CD1-CG 4.01Å; Y164-W202 HydrophobicContact CE1-CB 4.49Å; Y164-W202 HydrophobicContact CE1-CD2 4.15Å; Y164-W202 AromaticContact CE1-CE3 3.95Å; Y164-W202 HydrophobicContact CE1-CE3 3.95Å; Y164-W202 HydrophobicContact CE1-CG 4.41Å; Y164-W202 WeakPolarHBondContact O-CB 3.28Å; Y164-P218 HydrophobicContact CE1-CB 4.04Å; Y164-P218 HydrophobicContact CE1-CG 3.76Å
165S89.1Confident86.8Confident36 Ų3637.2 Ų37.225%0.25219%0.188SC..  trans-98.3-16.4-176.659.50000114.3Q163 E168 T174 K203Q163-S165 PolarHBondContact O-N 3.47Å; S165-E168 PolarHBondContact OG-O 3.41Å; S165-E168 VanDerWaalsContact OG-O 3.06Å; S165-T174 PolarHBondContact N-OG1 3.02Å; S165-T174 PolarHBondContact OG-OG1 2.77Å; S165-K203 WeakPolarHBondContact O-CB 3.42Å; S165-K203 PolarHBondContact O-N 3.38Å; S165-K203 VanDerWaalsContact O-N 3.12Å
166G86.7Confident87.1Confident0 Ų033.3 Ų33.30%017%0.167CC..  trans118.5-146.2179.200000114.4Y164 E168 T174 N178Y164-G166 VanDerWaalsContact OH-C 3.29Å; Y164-G166 PolarHBondContact OH-O 3.49Å; G166-E168 VanDerWaalsContact C-N 3.29Å; G166-E168 PolarHBondContact O-N 3.41Å; G166-T174 WeakPolarHBondContact O-CG2 3.1Å; G166-N178 PolarHBondContact O-ND2 3.42Å
167A79.8Confident87.5Confident16 Ų1630.9 Ų30.913%0.13216%0.156CC..SBendtrans-70.9-23.3179.800000113.5T169 V206 I219A167-T169 PolarHBondContact O-N 3.33Å; A167-V206 HydrophobicContact CB-CG1 4.18Å; A167-I219 HydrophobicContact CB-CD1 3.95Å
168E80.6Confident87.9Confident71 Ų7130.8 Ų30.833%0.33216%0.155SC..SBendtrans-83.3106.1175.8-72.8169.1-165.400109.8I68 S165 G166 N170 K203I68-E168 HydrophobicContact CD1-CG 4.33Å; S165-E168 PolarHBondContact OG-O 3.41Å; S165-E168 VanDerWaalsContact OG-O 3.06Å; G166-E168 VanDerWaalsContact C-N 3.29Å; G166-E168 PolarHBondContact O-N 3.41Å; E168-N170 VanDerWaalsContact C-N 3.34Å; E168-N170 PolarHBondContact O-N 3.45Å; E168-K203 IonicContact OE1-NZ 3.76Å; E168-K203 PolarHBondContact OE1-NZ 3.48Å; E168-K203 IonicContact OE2-NZ 2.84Å; E168-K203 PolarHBondContact OE2-NZ 3.36Å
169T84Confident88Confident1 Ų128.6 Ų28.61%0.00614%0.144CC..  trans-82.475.4-176.3-54.40000111.3V63 S70 N71 V72 A167 L175 N178V63-T169 HydrophobicContact CG1-CG2 4.36Å; S70-T169 WeakPolarHBondContact CA-O 3.4Å; N71-T169 PolarHBondContact N-O 2.97Å; V72-T169 HydrophobicContact CG2-CG2 4Å; A167-T169 PolarHBondContact O-N 3.33Å; T169-L175 HydrophobicContact CG2-CB 3.42Å; T169-L175 VanDerWaalsContact CG2-CB 3.42Å; T169-L175 HydrophobicContact CG2-CD1 3.66Å; T169-L175 HydrophobicContact CG2-CG 4.12Å; T169-N178 PolarHBondContact OG1-ND2 3.01Å
170N84.6Confident88.3Confident96 Ų9623.2 Ų23.251%0.51312%0.121SC..  trans-102.9-10.8-177.2-61.2-18.2000113.7E168E168-N170 VanDerWaalsContact C-N 3.34Å; E168-N170 PolarHBondContact O-N 3.45Å
171N88Confident88.6Confident41 Ų4122.9 Ų22.922%0.21912%0.119CC..SBendtrans-135.3161.5176.8706.9000110.5Q163 T174 L175Q163-N171 PolarHBondContact O-ND2 2.93Å; N171-T174 PolarHBondContact O-N 2.92Å; N171-T174 WeakPolarHBondContact OD1-CB 3.43Å; N171-T174 PolarHBondContact OD1-N 3.35Å; N171-T174 PolarHBondContact OD1-OG1 2.92Å; N171-L175 PolarHBondContact O-N 2.71Å; N171-L175 VanDerWaalsContact O-N 3.15Å
172F87.5Confident88.6Confident4 Ų423.8 Ų23.82%0.01812%0.123CC..Hα-helixtrans-65.3-40.4-175.2-177.2-109.1000113.7F56 V72 F74 P79 L82 T174 L175 L176F56-F172 AromaticContact CD1-CE2 3.68Å; F56-F172 HydrophobicContact CD1-CE2 3.68Å; F56-F172 HydrophobicContact CD1-CZ 4.09Å; F56-F172 AromaticContact CD2-CE2 3.88Å; F56-F172 HydrophobicContact CD2-CE2 3.88Å; F56-F172 HydrophobicContact CD2-CZ 4.26Å; F56-F172 AromaticContact CE1-CE2 3.52Å; F56-F172 HydrophobicContact CE1-CE2 3.52Å; F56-F172 AromaticContact CE1-CZ 3.42Å; F56-F172 HydrophobicContact CE1-CZ 3.42Å; F56-F172 VanDerWaalsContact CE1-CZ 3.42Å; F56-F172 AromaticContact CE2-CE2 3.78Å; F56-F172 HydrophobicContact CE2-CE2 3.78Å; F56-F172 AromaticContact CE2-CZ 3.67Å; F56-F172 HydrophobicContact CE2-CZ 3.67Å; F56-F172 AromaticContact CG-CE2 3.91Å; F56-F172 HydrophobicContact CG-CE2 3.91Å; F56-F172 HydrophobicContact CZ-CE1 4.41Å; F56-F172 AromaticContact CZ-CE2 3.63Å; F56-F172 HydrophobicContact CZ-CE2 3.63Å; F56-F172 AromaticContact CZ-CZ 3.24Å; F56-F172 HydrophobicContact CZ-CZ 3.24Å; V72-F172 HydrophobicContact CG1-CB 3.85Å; V72-F172 HydrophobicContact CG1-CD2 4.28Å; F74-F172 HydrophobicContact CD1-CD2 4.13Å; F74-F172 HydrophobicContact CD1-CE2 4.38Å; F74-F172 AromaticContact CE1-CD2 3.53Å; F74-F172 HydrophobicContact CE1-CD2 3.53Å; F74-F172 AromaticContact CE1-CE2 3.7Å; F74-F172 HydrophobicContact CE1-CE2 3.7Å; F74-F172 HydrophobicContact CZ-CD2 4.34Å; P79-F172 HydrophobicContact CB-CB 4.04Å; P79-F172 HydrophobicContact CB-CD1 3.76Å; P79-F172 HydrophobicContact CB-CD2 4.17Å; P79-F172 HydrophobicContact CB-CE1 4.31Å; P79-F172 HydrophobicContact CB-CG 3.71Å; L82-F172 HydrophobicContact CB-CD1 3.99Å; L82-F172 HydrophobicContact CB-CE1 3.74Å; L82-F172 HydrophobicContact CD2-CD1 3.53Å; L82-F172 HydrophobicContact CD2-CE1 3.47Å; L82-F172 VanDerWaalsContact CD2-CE1 3.47Å; L82-F172 HydrophobicContact CG-CD1 4.1Å; L82-F172 HydrophobicContact CG-CE1 3.66Å; F172-T174 VanDerWaalsContact C-N 3.3Å; F172-T174 PolarHBondContact O-N 3.41Å; F172-L175 HydrophobicContact CD2-CD2 4.29Å; F172-L175 WeakPolarHBondContact O-CB 3.4Å; F172-L175 PolarHBondContact O-N 2.98Å; F172-L176 WeakPolarHBondContact O-CB 3.38Å; F172-L176 PolarHBondContact O-N 3.21Å
173P89.9Confident88.7Confident0 Ų024.6 Ų24.60%013%0.125CC..Hα-helixtrans-55.1-42.6172.7-29.436.9000113.5E78 V160 Q163 L176 F177E78-P173 VanDerWaalsContact OE1-CD 3.23Å; E78-P173 WeakPolarHBondContact OE1-CD 3.28Å; E78-P173 WeakPolarHBondContact OE1-CG 3.26Å; V160-P173 HydrophobicContact CG1-CB 3.8Å; V160-P173 HydrophobicContact CG1-CG 4.04Å; Q163-P173 HydrophobicContact CB-CB 4.1Å; Q163-P173 HydrophobicContact CB-CG 3.94Å; P173-L176 PolarHBondContact O-N 3.33Å; P173-F177 WeakPolarHBondContact O-CD2 3.34Å; P173-F177 PolarHBondContact O-N 3.12Å
174T91.3Very high88.9Confident0 Ų022 Ų220%011%0.113CC..Hα-helixtrans-67.6-42179.6-600000112.2Y164 S165 G166 N171 F172 L176 N178Y164-T174 HydrophobicContact CD2-CG2 4.1Å; Y164-T174 HydrophobicContact CE2-CG2 3.76Å; S165-T174 PolarHBondContact N-OG1 3.02Å; S165-T174 PolarHBondContact OG-OG1 2.77Å; G166-T174 WeakPolarHBondContact O-CG2 3.1Å; N171-T174 PolarHBondContact O-N 2.92Å; N171-T174 WeakPolarHBondContact OD1-CB 3.43Å; N171-T174 PolarHBondContact OD1-N 3.35Å; N171-T174 PolarHBondContact OD1-OG1 2.92Å; F172-T174 VanDerWaalsContact C-N 3.3Å; F172-T174 PolarHBondContact O-N 3.41Å; T174-L176 VanDerWaalsContact C-N 3.31Å; T174-L176 PolarHBondContact O-N 3.4Å; T174-N178 WeakPolarHBondContact CG2-ND2 3.48Å; T174-N178 VanDerWaalsContact O-CB 3.27Å; T174-N178 WeakPolarHBondContact O-CB 3.23Å; T174-N178 VanDerWaalsContact O-CG 3.23Å; T174-N178 PolarHBondContact O-N 2.8Å; T174-N178 PolarHBondContact O-ND2 2.98Å
175L90.5Very high89Confident0 Ų027.5 Ų27.50%014%0.138CC..Hα-helixtrans-57.1-48.5173.9178.166.2000110.6I59 I60 V63 V72 F74 T169 N171 F172 N178 Y179I59-L175 HydrophobicContact CG2-CD1 4.18Å; I59-L175 HydrophobicContact CG2-CD2 4.43Å; I59-L175 HydrophobicContact CG2-CG 4.06Å; I60-L175 HydrophobicContact CG1-CD1 4.46Å; I60-L175 HydrophobicContact CG1-CD2 3.91Å; V63-L175 HydrophobicContact CB-CD1 3.87Å; V63-L175 HydrophobicContact CG1-CD1 3.95Å; V63-L175 HydrophobicContact CG2-CD1 3.89Å; V72-L175 HydrophobicContact CG2-CB 4.08Å; V72-L175 HydrophobicContact CG2-CD2 4.13Å; F74-L175 HydrophobicContact CE1-CD2 4.22Å; F74-L175 HydrophobicContact CZ-CD2 3.62Å; T169-L175 HydrophobicContact CG2-CB 3.42Å; T169-L175 VanDerWaalsContact CG2-CB 3.42Å; T169-L175 HydrophobicContact CG2-CD1 3.66Å; T169-L175 HydrophobicContact CG2-CG 4.12Å; N171-L175 PolarHBondContact O-N 2.71Å; N171-L175 VanDerWaalsContact O-N 3.15Å; F172-L175 HydrophobicContact CD2-CD2 4.29Å; F172-L175 WeakPolarHBondContact O-CB 3.4Å; F172-L175 PolarHBondContact O-N 2.98Å; L175-N178 PolarHBondContact O-N 2.98Å; L175-Y179 WeakPolarHBondContact O-CB 3.47Å; L175-Y179 PolarHBondContact O-N 2.89Å
176L89.1Confident89.3Confident5 Ų525.8 Ų25.83%0.02613%0.126CC..Hα-helixtrans-60.6-53-178.8-179.167.5000111.7L82 L86 F172 P173 T174 N178 Y179 V180 I256L82-L176 HydrophobicContact CD1-CD2 4.41Å; L82-L176 HydrophobicContact CD2-CD2 3.64Å; L82-L176 HydrophobicContact CG-CD2 4.13Å; L86-L176 HydrophobicContact CD1-CD1 4.07Å; L86-L176 HydrophobicContact CD1-CD2 3.89Å; L86-L176 HydrophobicContact CD2-CD2 4.43Å; F172-L176 WeakPolarHBondContact O-CB 3.38Å; F172-L176 PolarHBondContact O-N 3.21Å; P173-L176 PolarHBondContact O-N 3.33Å; T174-L176 VanDerWaalsContact C-N 3.31Å; T174-L176 PolarHBondContact O-N 3.4Å; L176-N178 PolarHBondContact O-N 3.09Å; L176-Y179 PolarHBondContact O-N 3.29Å; L176-V180 HydrophobicContact CD1-CG2 4.11Å; L176-V180 HydrophobicContact CG-CG2 4.34Å; L176-V180 WeakPolarHBondContact O-CB 3.42Å; L176-V180 VanDerWaalsContact O-CG2 3.27Å; L176-V180 WeakPolarHBondContact O-CG2 3.33Å; L176-V180 PolarHBondContact O-N 3.34Å; L176-I256 HydrophobicContact CD1-CD1 3.51Å
177F91.5Very high89.7Confident4 Ų425.8 Ų25.82%0.01813%0.126CC..Hα-helixtrans-66.1-38.8-178.9-85.3-76000112.4V160 Q161 Y164 P173 Y179 V180 H181 M189 W195V160-F177 HydrophobicContact CG1-CE2 4.08Å; Q161-F177 VanDerWaalsContact CA-CE2 3.46Å; Q161-F177 HydrophobicContact CB-CE1 4.4Å; Q161-F177 HydrophobicContact CB-CE2 3.91Å; Q161-F177 HydrophobicContact CB-CZ 3.63Å; Q161-F177 HydrophobicContact CG-CE1 4.23Å; Q161-F177 HydrophobicContact CG-CE2 4.34Å; Q161-F177 HydrophobicContact CG-CZ 3.94Å; Y164-F177 HydrophobicContact CD2-CB 3.83Å; Y164-F177 HydrophobicContact CD2-CG 4.46Å; Y164-F177 HydrophobicContact CE2-CB 3.97Å; P173-F177 WeakPolarHBondContact O-CD2 3.34Å; P173-F177 PolarHBondContact O-N 3.12Å; F177-Y179 VanDerWaalsContact C-N 3.29Å; F177-Y179 PolarHBondContact O-N 2.9Å; F177-V180 PolarHBondContact O-N 3.2Å; F177-H181 AromaticContact CD1-NE2 3.76Å; F177-H181 WeakPolarHBondContact O-CB 3.17Å; F177-H181 PolarHBondContact O-N 2.69Å; F177-H181 PolarHBondContact O-ND1 3.39Å; F177-M189 HydrophobicContact CE1-SD 3.72Å; F177-M189 HydrophobicContact CZ-SD 3.88Å; F177-W195 HydrophobicContact CD1-CZ2 4.44Å
178N91.7Very high90.3Very high0 Ų025 Ų250%012%0.12CC..Hα-helixtrans-61.5-39.8176.6-74.6-17.6000111.9V63 Y67 Y164 G166 T169 T174 L175 L176 S220V63-N178 HydrophobicContact CG1-CB 4.4Å; V63-N178 HydrophobicContact CG2-CB 4.5Å; Y67-N178 HydrophobicContact CE2-CB 4.18Å; Y164-N178 WeakPolarHBondContact CE2-OD1 3.18Å; Y164-N178 PolarHBondContact OH-OD1 3.35Å; G166-N178 PolarHBondContact O-ND2 3.42Å; T169-N178 PolarHBondContact OG1-ND2 3.01Å; T174-N178 WeakPolarHBondContact CG2-ND2 3.48Å; T174-N178 VanDerWaalsContact O-CB 3.27Å; T174-N178 WeakPolarHBondContact O-CB 3.23Å; T174-N178 VanDerWaalsContact O-CG 3.23Å; T174-N178 PolarHBondContact O-N 2.8Å; T174-N178 PolarHBondContact O-ND2 2.98Å; L175-N178 PolarHBondContact O-N 2.98Å; L176-N178 PolarHBondContact O-N 3.09Å; N178-S220 VanDerWaalsContact OD1-CB 3.32Å; N178-S220 WeakPolarHBondContact OD1-CB 3.42Å; N178-S220 PolarHBondContact OD1-OG 3.31Å
179Y90.5Very high90.8Very high28 Ų2821.7 Ų21.711%0.1110%0.104CC..Hα-helixtrans-67.8-52.7173.6175.6-100.6000112.5I59 T62 L175 L176 F177 H181 Q182 H183 I256I59-Y179 HydrophobicContact CB-CD2 4.09Å; I59-Y179 HydrophobicContact CB-CE2 4.35Å; I59-Y179 HydrophobicContact CB-CG 4.23Å; I59-Y179 HydrophobicContact CD1-CD1 4.12Å; I59-Y179 HydrophobicContact CD1-CE1 4.05Å; I59-Y179 HydrophobicContact CG1-CD1 3.87Å; I59-Y179 HydrophobicContact CG1-CD2 3.86Å; I59-Y179 HydrophobicContact CG1-CE1 3.77Å; I59-Y179 HydrophobicContact CG1-CE2 3.75Å; I59-Y179 HydrophobicContact CG1-CG 3.91Å; I59-Y179 HydrophobicContact CG2-CD1 4.23Å; I59-Y179 HydrophobicContact CG2-CD2 3.86Å; I59-Y179 HydrophobicContact CG2-CG 3.64Å; T62-Y179 HydrophobicContact CG2-CD2 4.29Å; T62-Y179 HydrophobicContact CG2-CE2 4.31Å; L175-Y179 WeakPolarHBondContact O-CB 3.47Å; L175-Y179 PolarHBondContact O-N 2.89Å; L176-Y179 PolarHBondContact O-N 3.29Å; F177-Y179 VanDerWaalsContact C-N 3.29Å; F177-Y179 PolarHBondContact O-N 2.9Å; Y179-H181 VanDerWaalsContact C-N 3.34Å; Y179-H181 PolarHBondContact O-N 3.2Å; Y179-Q182 PolarHBondContact O-N 3.22Å; Y179-H183 HydrophobicContact CD1-CB 4.37Å; Y179-H183 HydrophobicContact CD2-CB 4.43Å; Y179-H183 HydrophobicContact CE1-CB 3.99Å; Y179-H183 HydrophobicContact CE2-CB 4.07Å; Y179-H183 AromaticContact CZ-CG 3.62Å; Y179-H183 AromaticContact CZ-ND1 3.72Å; Y179-H183 VanDerWaalsContact O-CB 3.26Å; Y179-H183 WeakPolarHBondContact O-CB 3.46Å; Y179-H183 PolarHBondContact O-N 3.05Å; Y179-H183 PolarHBondContact OH-CE1 2.9Å; Y179-H183 PolarHBondContact OH-ND1 3.34Å; Y179-I256 HydrophobicContact CE1-CG2 4.11Å
180V91.9Very high91.1Very high3 Ų327.3 Ų27.32%0.01813%0.126CC..Hα-helixtrans-58.1-46.3-175.3164.40000111.3L176 F177 Q182 F184 C247 L251 I256L176-V180 HydrophobicContact CD1-CG2 4.11Å; L176-V180 HydrophobicContact CG-CG2 4.34Å; L176-V180 WeakPolarHBondContact O-CB 3.42Å; L176-V180 VanDerWaalsContact O-CG2 3.27Å; L176-V180 WeakPolarHBondContact O-CG2 3.33Å; L176-V180 PolarHBondContact O-N 3.34Å; F177-V180 PolarHBondContact O-N 3.2Å; V180-Q182 VanDerWaalsContact C-N 3.29Å; V180-Q182 PolarHBondContact O-N 3.41Å; V180-F184 HydrophobicContact CG1-CD2 4.16Å; V180-F184 WeakPolarHBondContact O-CB 3.48Å; V180-F184 PolarHBondContact O-N 3Å; V180-C247 HydrophobicContact CG1-CB 3.8Å; V180-L251 HydrophobicContact CG1-CD1 3.94Å; V180-L251 HydrophobicContact CG1-CD2 4.08Å; V180-L251 HydrophobicContact CG1-CG 4.17Å; V180-L251 HydrophobicContact CG2-CD1 4.45Å; V180-L251 HydrophobicContact CG2-CD2 4.09Å; V180-I256 HydrophobicContact CG2-CD1 3.57Å; V180-I256 HydrophobicContact CG2-CG1 4.4Å
181H93.6Very high91.4Very high0 Ų025.5 Ų25.50%012%0.116CC..Hα-helixtrans-59.5-41.9-179.3-64.4155.9000112.1F177 Y179 H185 C186 G188 W195 S220 F243 C247F177-H181 AromaticContact CD1-NE2 3.76Å; F177-H181 WeakPolarHBondContact O-CB 3.17Å; F177-H181 PolarHBondContact O-N 2.69Å; F177-H181 PolarHBondContact O-ND1 3.39Å; Y179-H181 VanDerWaalsContact C-N 3.34Å; Y179-H181 PolarHBondContact O-N 3.2Å; H181-H185 VanDerWaalsContact O-CA 3.23Å; H181-H185 WeakPolarHBondContact O-CA 3.26Å; H181-H185 PolarHBondContact O-N 3.48Å; H181-C186 WeakPolarHBondContact CA-O 3.29Å; H181-C186 WeakPolarHBondContact CB-O 3.33Å; H181-C186 PolarHBondContact CD2-O 2.87Å; H181-C186 VanDerWaalsContact CD2-O 3.31Å; H181-C186 PolarHBondContact O-N 2.97Å; H181-G188 PolarHBondContact NE2-N 3.27Å; H181-W195 AromaticContact CE1-CE2 3.97Å; H181-W195 AromaticContact CE1-CZ2 3.52Å; H181-W195 AromaticContact CE1-NE1 3.96Å; H181-W195 AromaticContact NE2-CZ2 3.84Å; H181-W195 AromaticContact NE2-NE1 4Å; H181-S220 WeakPolarHBondContact CB-O 3.35Å; H181-S220 PolarHBondContact ND1-OG 3.01Å; H181-F243 WeakPolarHBondContact O-CE2 3.45Å; H181-C247 PolarHBondContact CD2-SG 3.43Å
182Q91.1Very high91.6Very high18 Ų1826.8 Ų26.88%0.08412%0.119CC..Hα-helixtrans-78.2-44.4-178.1-74.1-66.2-57.900112.7Y67 Y179 V180 H185 S220 C222 L225Y67-Q182 WeakPolarHBondContact OH-CG 3.3Å; Y179-Q182 PolarHBondContact O-N 3.22Å; V180-Q182 VanDerWaalsContact C-N 3.29Å; V180-Q182 PolarHBondContact O-N 3.41Å; Q182-H185 PolarHBondContact O-CE1 3.47Å; Q182-H185 VanDerWaalsContact O-CE1 3.28Å; Q182-H185 PolarHBondContact O-ND1 2.99Å; Q182-H185 VanDerWaalsContact O-ND1 3.12Å; Q182-S220 PolarHBondContact NE2-O 3.44Å; Q182-C222 PolarHBondContact NE2-O 2.99Å; Q182-L225 HydrophobicContact CG-CD1 3.86Å; Q182-L225 VanDerWaalsContact NE2-CD1 3.29Å
183H91.3Very high91.9Very high99 Ų9929.7 Ų29.746%0.45814%0.137SC..Hα-helixtrans-67.5-38.7-176.9-171.579.4000112.2Y179Y179-H183 HydrophobicContact CD1-CB 4.37Å; Y179-H183 HydrophobicContact CD2-CB 4.43Å; Y179-H183 HydrophobicContact CE1-CB 3.99Å; Y179-H183 HydrophobicContact CE2-CB 4.07Å; Y179-H183 AromaticContact CZ-CG 3.62Å; Y179-H183 AromaticContact CZ-ND1 3.72Å; Y179-H183 VanDerWaalsContact O-CB 3.26Å; Y179-H183 WeakPolarHBondContact O-CB 3.46Å; Y179-H183 PolarHBondContact O-N 3.05Å; Y179-H183 PolarHBondContact OH-CE1 2.9Å; Y179-H183 PolarHBondContact OH-ND1 3.34Å
184F92.4Very high92Very high39 Ų3930.9 Ų30.917%0.17114%0.142CC..THydrogen-bonded Turntrans-103.94.9-178.2-65-70000114V180 C186 I250 L251 N254 I256V180-F184 HydrophobicContact CG1-CD2 4.16Å; V180-F184 WeakPolarHBondContact O-CB 3.48Å; V180-F184 PolarHBondContact O-N 3Å; F184-C186 VanDerWaalsContact C-N 3.3Å; F184-C186 PolarHBondContact O-N 3.35Å; F184-I250 HydrophobicContact CB-CD1 4.41Å; F184-I250 HydrophobicContact CB-CG2 4.01Å; F184-I250 HydrophobicContact CD1-CG2 3.69Å; F184-I250 HydrophobicContact CE1-CG2 4.39Å; F184-I250 HydrophobicContact CG-CG2 3.97Å; F184-L251 HydrophobicContact CD2-CD2 4.08Å; F184-L251 HydrophobicContact CE2-CD2 3.73Å; F184-L251 HydrophobicContact CZ-CD2 4.43Å; F184-N254 HydrophobicContact CE1-CB 3.95Å; F184-N254 HydrophobicContact CZ-CB 4.49Å; F184-I256 HydrophobicContact CE2-CG1 4.13Å
185H93.5Very high92.1Very high116 Ų11630.9 Ų30.954%0.53714%0.142SC..THydrogen-bonded Turntrans50.648.3-179.3-58-44.2000113.2H181 Q182 F243H181-H185 VanDerWaalsContact O-CA 3.23Å; H181-H185 WeakPolarHBondContact O-CA 3.26Å; H181-H185 PolarHBondContact O-N 3.48Å; Q182-H185 PolarHBondContact O-CE1 3.47Å; Q182-H185 VanDerWaalsContact O-CE1 3.28Å; Q182-H185 PolarHBondContact O-ND1 2.99Å; Q182-H185 VanDerWaalsContact O-ND1 3.12Å; H185-F243 HydrophobicContact CB-CD1 3.84Å; H185-F243 HydrophobicContact CB-CE1 3.64Å; H185-F243 HydrophobicContact CB-CE2 4.48Å; H185-F243 HydrophobicContact CB-CG 4.38Å; H185-F243 HydrophobicContact CB-CZ 4Å; H185-F243 AromaticContact CG-CE1 3.95Å; H185-F243 AromaticContact ND1-CE1 3.74Å; H185-F243 AromaticContact ND1-CZ 3.42Å; H185-F243 WeakPolarHBondContact ND1-CZ 3.49Å; H185-F243 WeakPolarHBondContact O-CB 3.34Å; H185-F243 WeakPolarHBondContact O-CD1 3.21Å; H185-F243 WeakPolarHBondContact O-CG 3.48Å
186C95.2Very high92.1Very high0 Ų034.7 Ų34.70%016%0.162CC..  trans-130.2163.6-175.866.30000111.1H181 F184 Q245 C247 I250H181-C186 WeakPolarHBondContact CA-O 3.29Å; H181-C186 WeakPolarHBondContact CB-O 3.33Å; H181-C186 PolarHBondContact CD2-O 2.87Å; H181-C186 VanDerWaalsContact CD2-O 3.31Å; H181-C186 PolarHBondContact O-N 2.97Å; F184-C186 VanDerWaalsContact C-N 3.3Å; F184-C186 PolarHBondContact O-N 3.35Å; C186-Q245 CarbonylContact C-O 3.6Å; C186-Q245 VanDerWaalsContact CA-O 3.26Å; C186-Q245 WeakPolarHBondContact CA-O 3.48Å; C186-Q245 WeakPolarHBondContact CB-O 3.41Å; C186-C247 HydrophobicContact CB-CB 3.97Å; C186-C247 WeakPolarHBondContact CB-SG 3.24Å; C186-C247 WeakPolarHBondContact SG-CA 3.48Å; C186-C247 WeakPolarHBondContact SG-CB 3.47Å; C186-C247 CovalentContact SG-SG 2.03Å; C186-C247 PolarHBondContact SG-SG 3.03Å; C186-I250 HydrophobicContact CB-CD1 3.69Å
187C94.9Very high92.1Very high0 Ų038.2 Ų38.20%018%0.181CC..  trans-145.3128.5177.6-176.30000111.9N191 Y192 C221 F243 Q245C187-N191 CarbonylContact O-C 3.39Å; C187-N191 WeakPolarHBondContact O-CA 3.25Å; C187-Y192 PolarHBondContact O-N 3Å; C187-Y192 VanDerWaalsContact O-N 3.17Å; C187-Y192 VanDerWaalsContact SG-CA 3.54Å; C187-Y192 WeakPolarHBondContact SG-CB 3.48Å; C187-C221 HydrophobicContact CB-CB 3.52Å; C187-C221 WeakPolarHBondContact CB-SG 3.15Å; C187-C221 WeakPolarHBondContact SG-CB 3.34Å; C187-C221 CovalentContact SG-SG 2.02Å; C187-C221 PolarHBondContact SG-SG 3.45Å; C187-F243 HydrophobicContact CB-CB 4.12Å; C187-F243 VanDerWaalsContact CB-O 3.27Å; C187-F243 WeakPolarHBondContact CB-O 3.29Å; C187-Q245 PolarHBondContact N-O 3.41Å
188G92.6Very high91.8Very high0 Ų042.6 Ų42.60%021%0.212CC..SBendtrans68.4176.5-175.100000111.9H181 E194 C247H181-G188 PolarHBondContact NE2-N 3.27Å; G188-E194 WeakPolarHBondContact CA-OE2 3.3Å; G188-C247 WeakPolarHBondContact O-CB 3.48Å; G188-C247 PolarHBondContact O-N 2.9Å; G188-C247 PolarHBondContact O-SG 2.85Å
189M90.8Very high91.4Very high2 Ų246.9 Ų46.91%0.0124%0.239CC..SBendtrans-74.7-50.4-178.7-66.8-50.5-52.500111.3L154 L157 F177 E194 G246 C247 G248L154-M189 HydrophobicContact CD2-CE 3.56Å; L157-M189 HydrophobicContact CB-CE 3.58Å; L157-M189 HydrophobicContact CB-SD 3.94Å; L157-M189 HydrophobicContact CD1-CE 3.55Å; L157-M189 HydrophobicContact CD1-SD 4.36Å; L157-M189 HydrophobicContact CG-CE 4.25Å; F177-M189 HydrophobicContact CE1-SD 3.72Å; F177-M189 HydrophobicContact CZ-SD 3.88Å; M189-E194 PolarHBondContact N-OE2 3.33Å; M189-G246 CarbonylContact O-C 3.58Å; M189-G246 WeakPolarHBondContact O-CA 3.33Å; M189-C247 PolarHBondContact O-N 3.2Å; M189-G248 WeakPolarHBondContact O-CA 3.29Å; M189-G248 PolarHBondContact O-N 3.21Å
190Y91.1Very high91.3Very high118 Ų11846 Ų4646%0.46324%0.236SC..SBendtrans-105.2-38.3176.6-56.9-76.5000111.8L154 E194 G246L154-Y190 HydrophobicContact CD1-CD1 4.38Å; L154-Y190 HydrophobicContact CD1-CE1 3.47Å; L154-Y190 VanDerWaalsContact CD1-CE1 3.47Å; Y190-E194 WeakPolarHBondContact CA-OE1 3.31Å; Y190-E194 WeakPolarHBondContact CB-OE1 3.44Å; Y190-E194 WeakPolarHBondContact CD2-OE1 3.33Å; Y190-E194 PolarHBondContact N-OE1 3.33Å; Y190-G246 VanDerWaalsContact O-CA 3.28Å; Y190-G246 WeakPolarHBondContact O-CA 3.33Å; Y190-G246 PolarHBondContact O-N 2.7Å
191N91.5Very high91.1Very high58 Ų5853.7 Ų53.731%0.3127%0.271SS..  trans-162.9169.4175.763.647.7000112.7C187 T193 E194C187-N191 CarbonylContact O-C 3.39Å; C187-N191 WeakPolarHBondContact O-CA 3.25Å; N191-T193 PolarHBondContact O-N 3.36Å; N191-T193 WeakPolarHBondContact OD1-CA 3.23Å; N191-T193 WeakPolarHBondContact OD1-CB 3.33Å; N191-T193 PolarHBondContact OD1-N 3.32Å; N191-T193 PolarHBondContact OD1-OG1 3.44Å; N191-E194 PolarHBondContact N-OE1 2.72Å; N191-E194 WeakPolarHBondContact O-CG 3.39Å; N191-E194 PolarHBondContact O-N 3.42Å; N191-E194 PolarHBondContact OD1-N 2.93Å
192Y92.7Very high91Very high69 Ų6954.7 Ų54.727%0.27128%0.275SS..G310 helixtrans-65.5-22.1179.177.7-92000114.4C187 E194 W195 I217 L236 P242 I244C187-Y192 PolarHBondContact O-N 3Å; C187-Y192 VanDerWaalsContact O-N 3.17Å; C187-Y192 VanDerWaalsContact SG-CA 3.54Å; C187-Y192 WeakPolarHBondContact SG-CB 3.48Å; Y192-E194 PolarHBondContact O-N 2.89Å; Y192-W195 PolarHBondContact O-N 2.88Å; Y192-I217 HydrophobicContact CD2-CG2 4.24Å; Y192-L236 HydrophobicContact CD2-CD2 4.11Å; Y192-L236 HydrophobicContact CE2-CD2 3.76Å; Y192-P242 HydrophobicContact CD1-CG 4.1Å; Y192-P242 HydrophobicContact CD2-CG 3.96Å; Y192-P242 HydrophobicContact CE1-CG 4.4Å; Y192-P242 HydrophobicContact CE2-CG 4.28Å; Y192-P242 HydrophobicContact CG-CG 3.86Å; Y192-I244 HydrophobicContact CE1-CG2 4.47Å
193T92.4Very high90.9Very high64 Ų6458.4 Ų58.439%0.39329%0.291SS..G310 helixtrans-70.1-17.6-175.871.10000112.4N191 W195 L196N191-T193 PolarHBondContact O-N 3.36Å; N191-T193 WeakPolarHBondContact OD1-CA 3.23Å; N191-T193 WeakPolarHBondContact OD1-CB 3.33Å; N191-T193 PolarHBondContact OD1-N 3.32Å; N191-T193 PolarHBondContact OD1-OG1 3.44Å; T193-W195 PolarHBondContact O-N 2.98Å; T193-L196 VanDerWaalsContact O-CB 3.25Å; T193-L196 WeakPolarHBondContact O-CB 3.34Å; T193-L196 PolarHBondContact O-N 3.13Å
194E92Very high90.8Very high25 Ų2556.5 Ų56.512%0.11728%0.28CS..G310 helixtrans-54.2-37.6171.3-70.2171.4-170.900112.7Q161 G188 M189 Y190 N191 Y192 L196 N197 I200Q161-E194 PolarHBondContact NE2-OE2 3.29Å; Q161-E194 PolarHBondContact OE1-OE2 2.91Å; G188-E194 WeakPolarHBondContact CA-OE2 3.3Å; M189-E194 PolarHBondContact N-OE2 3.33Å; Y190-E194 WeakPolarHBondContact CA-OE1 3.31Å; Y190-E194 WeakPolarHBondContact CB-OE1 3.44Å; Y190-E194 WeakPolarHBondContact CD2-OE1 3.33Å; Y190-E194 PolarHBondContact N-OE1 3.33Å; N191-E194 PolarHBondContact N-OE1 2.72Å; N191-E194 WeakPolarHBondContact O-CG 3.39Å; N191-E194 PolarHBondContact O-N 3.42Å; N191-E194 PolarHBondContact OD1-N 2.93Å; Y192-E194 PolarHBondContact O-N 2.89Å; E194-L196 PolarHBondContact O-N 2.85Å; E194-L196 VanDerWaalsContact O-N 3.11Å; E194-N197 WeakPolarHBondContact O-CB 3.49Å; E194-N197 PolarHBondContact O-N 3Å; E194-I200 HydrophobicContact CB-CD1 4.42Å
195W93Very high90.7Very high0 Ų059 Ų590%029%0.293CS..G310 helixtrans-67.4-11.9178.9-63.8108.7000113.6Q161 Y164 F177 H181 Y192 T193 I200 W202 R204 I217 P218Q161-W195 HydrophobicContact CG-CH2 3.63Å; Q161-W195 HydrophobicContact CG-CZ2 3.95Å; Q161-W195 HydrophobicContact CG-CZ3 4.2Å; Y164-W195 HydrophobicContact CD1-CE3 4.28Å; Y164-W195 AromaticContact CD1-CH2 3.61Å; Y164-W195 HydrophobicContact CD1-CH2 3.61Å; Y164-W195 AromaticContact CD1-CZ3 3.32Å; Y164-W195 HydrophobicContact CD1-CZ3 3.32Å; Y164-W195 HydrophobicContact CD2-CH2 4.12Å; Y164-W195 HydrophobicContact CE1-CH2 4.17Å; Y164-W195 AromaticContact CE1-CZ3 3.99Å; Y164-W195 HydrophobicContact CE1-CZ3 3.99Å; Y164-W195 AromaticContact CG-CH2 3.58Å; Y164-W195 HydrophobicContact CG-CH2 3.58Å; Y164-W195 AromaticContact CG-CZ3 3.71Å; Y164-W195 HydrophobicContact CG-CZ3 3.71Å; F177-W195 HydrophobicContact CD1-CZ2 4.44Å; H181-W195 AromaticContact CE1-CE2 3.97Å; H181-W195 AromaticContact CE1-CZ2 3.52Å; H181-W195 AromaticContact CE1-NE1 3.96Å; H181-W195 AromaticContact NE2-CZ2 3.84Å; H181-W195 AromaticContact NE2-NE1 4Å; Y192-W195 PolarHBondContact O-N 2.88Å; T193-W195 PolarHBondContact O-N 2.98Å; W195-I200 HydrophobicContact CE3-CG2 3.86Å; W195-I200 HydrophobicContact CZ3-CG2 3.66Å; W195-W202 AromaticContact CE3-CD1 3.98Å; W195-W202 AromaticContact CE3-NE1 3.77Å; W195-R204 VanDerWaalsContact O-CZ 3.31Å; W195-R204 PolarHBondContact O-NH1 3.4Å; W195-R204 PolarHBondContact O-NH2 2.88Å; W195-I217 HydrophobicContact CB-CB 4.46Å; W195-I217 HydrophobicContact CB-CG2 4.21Å; W195-P218 VanDerWaalsContact CD2-CD 3.44Å; W195-P218 HydrophobicContact CD2-CG 3.35Å; W195-P218 VanDerWaalsContact CE2-CG 3.47Å; W195-P218 HydrophobicContact CE3-CG 3.65Å; W195-P218 HydrophobicContact CG-CG 3.77Å; W195-P218 HydrophobicContact CH2-CG 4.14Å; W195-P218 HydrophobicContact CZ2-CG 3.89Å; W195-P218 HydrophobicContact CZ3-CG 4.04Å
196L91.3Very high90.3Very high81 Ų8154.1 Ų54.142%0.42427%0.272SS..G310 helixtrans-85.6-13.5172.9-52.4177.9000112.2T193 E194 K216 I217 L236T193-L196 VanDerWaalsContact O-CB 3.25Å; T193-L196 WeakPolarHBondContact O-CB 3.34Å; T193-L196 PolarHBondContact O-N 3.13Å; E194-L196 PolarHBondContact O-N 2.85Å; E194-L196 VanDerWaalsContact O-N 3.11Å; L196-K216 HydrophobicContact CD2-CB 3.96Å; L196-K216 WeakPolarHBondContact CD2-O 3.44Å; L196-I217 HydrophobicContact CD2-CG2 4.26Å; L196-L236 HydrophobicContact CD1-CD1 4.19Å; L196-L236 HydrophobicContact CD2-CD1 3.91Å
197N89Confident89.8Confident78 Ų7858.4 Ų58.442%0.41730%0.298SS..SBendtrans-67.8132.4176.5-170.1-16.6000110.5E194 T199 I200E194-N197 WeakPolarHBondContact O-CB 3.49Å; E194-N197 PolarHBondContact O-N 3Å; N197-T199 PolarHBondContact O-N 3.34Å; N197-T199 PolarHBondContact OD1-N 2.69Å; N197-T199 PolarHBondContact OD1-OG1 3.49Å; N197-I200 PolarHBondContact O-N 3.38Å
198S84.6Confident89.1Confident97 Ų9760.3 Ų60.368%0.67831%0.305SS*.THydrogen-bonded Turntrans-65.3-19.2177.551.20000114.1I200S198-I200 VanDerWaalsContact C-N 3.28Å; S198-I200 PolarHBondContact O-N 3.47Å
199T84.9Confident88.4Confident90 Ų9063.9 Ų63.955%0.55234%0.342SS*.THydrogen-bonded Turntrans-68.4-27.8177.6-510000112.3N197 Q201N197-T199 PolarHBondContact O-N 3.34Å; N197-T199 PolarHBondContact OD1-N 2.69Å; N197-T199 PolarHBondContact OD1-OG1 3.49Å; T199-Q201 PolarHBondContact O-N 2.96Å
200I87.7Confident88Confident9 Ų971.5 Ų71.55%0.04638%0.383CS..SBendtrans-92.698.5177.1-56.7170000107.9Q161 E194 W195 N197 S198Q161-I200 HydrophobicContact CG-CD1 4.21Å; E194-I200 HydrophobicContact CB-CD1 4.42Å; W195-I200 HydrophobicContact CE3-CG2 3.86Å; W195-I200 HydrophobicContact CZ3-CG2 3.66Å; N197-I200 PolarHBondContact O-N 3.38Å; S198-I200 VanDerWaalsContact C-N 3.28Å; S198-I200 PolarHBondContact O-N 3.47Å
201Q87.1Confident87.8Confident164 Ų16470.4 Ų70.477%0.76638%0.384SS*.  trans-93.9110-179.4-64.1-171.9-3.900110.2T199T199-Q201 PolarHBondContact O-N 2.96Å
202W91Very high87.6Confident21 Ų2171.2 Ų71.28%0.0839%0.391CS..  trans-139.9163.5-179.864.7-82.3000110.5Y164 W195 R204 I215 I217 P218Y164-W202 HydrophobicContact CD1-CB 3.84Å; Y164-W202 HydrophobicContact CD1-CD2 4.23Å; Y164-W202 HydrophobicContact CD1-CE3 4.4Å; Y164-W202 HydrophobicContact CD1-CG 4.01Å; Y164-W202 HydrophobicContact CE1-CB 4.49Å; Y164-W202 HydrophobicContact CE1-CD2 4.15Å; Y164-W202 AromaticContact CE1-CE3 3.95Å; Y164-W202 HydrophobicContact CE1-CE3 3.95Å; Y164-W202 HydrophobicContact CE1-CG 4.41Å; Y164-W202 WeakPolarHBondContact O-CB 3.28Å; W195-W202 AromaticContact CE3-CD1 3.98Å; W195-W202 AromaticContact CE3-NE1 3.77Å; W202-R204 HydrophobicContact CD2-CG 4.09Å; W202-R204 HydrophobicContact CE3-CG 4.34Å; W202-R204 HydrophobicContact CH2-CG 4.06Å; W202-R204 HydrophobicContact CZ2-CG 3.81Å; W202-R204 HydrophobicContact CZ3-CG 4.33Å; W202-R204 PolarHBondContact O-N 3.22Å; W202-I215 HydrophobicContact CH2-CD1 3.64Å; W202-I215 HydrophobicContact CH2-CG1 3.78Å; W202-I215 HydrophobicContact CZ3-CD1 3.65Å; W202-I215 HydrophobicContact CZ3-CG1 4.07Å; W202-I217 WeakPolarHBondContact CH2-O 3.45Å; W202-P218 HydrophobicContact CZ2-CG 4.39Å
203K89.8Confident87.3Confident97 Ų9771 Ų7142%0.42239%0.39SS..  trans-73.499.6-176.9-170.8-176.6-176.7179.30110.9S165 E168S165-K203 WeakPolarHBondContact O-CB 3.42Å; S165-K203 PolarHBondContact O-N 3.38Å; S165-K203 VanDerWaalsContact O-N 3.12Å; E168-K203 IonicContact OE1-NZ 3.76Å; E168-K203 PolarHBondContact OE1-NZ 3.48Å; E168-K203 IonicContact OE2-NZ 2.84Å; E168-K203 PolarHBondContact OE2-NZ 3.36Å
204R90Very high87.3Confident58 Ų5871.3 Ų71.322%0.21939%0.39CS..  trans-82.7-8.1178-65.4178.6-168.4-99.30.5114.5W195 W202 I215 K216W195-R204 VanDerWaalsContact O-CZ 3.31Å; W195-R204 PolarHBondContact O-NH1 3.4Å; W195-R204 PolarHBondContact O-NH2 2.88Å; W202-R204 HydrophobicContact CD2-CG 4.09Å; W202-R204 HydrophobicContact CE3-CG 4.34Å; W202-R204 HydrophobicContact CH2-CG 4.06Å; W202-R204 HydrophobicContact CZ2-CG 3.81Å; W202-R204 HydrophobicContact CZ3-CG 4.33Å; W202-R204 PolarHBondContact O-N 3.22Å; R204-I215 WeakPolarHBondContact CB-O 3.28Å; R204-I215 WeakPolarHBondContact O-CG1 3.31Å; R204-I215 PolarHBondContact O-N 3.01Å; R204-K216 PolarHBondContact NH1-O 3.49Å
205M89.4Confident87.2Confident93 Ų9370.1 Ų70.146%0.45838%0.384SS..EExtended strand (participates in β ladder)trans-98.4117.8178.4-60.2-59.4-77.600109.8T212 Y213 D214M205-T212 HydrophobicContact CB-CG2 4.02Å; M205-T212 HydrophobicContact CE-CG2 3.74Å; M205-Y213 WeakPolarHBondContact CA-O 3.26Å; M205-D214 HydrophobicContact SD-CB 3.73Å
206V86.2Confident87.2Confident13 Ų1374.2 Ų74.28%0.07940%0.402CS..EExtended strand (participates in β ladder)trans-125.7141-179.5-65.40000110.5A167 Y208 T212 Y213 I215 I219 L230A167-V206 HydrophobicContact CB-CG1 4.18Å; V206-Y208 HydrophobicContact CB-CE2 4.35Å; V206-Y208 HydrophobicContact CG2-CD2 4.38Å; V206-Y208 HydrophobicContact CG2-CE2 4.22Å; V206-T212 CarbonylContact O-C 3.51Å; V206-T212 WeakPolarHBondContact O-CA 3.36Å; V206-Y213 PolarHBondContact N-O 3.24Å; V206-Y213 PolarHBondContact O-N 3.42Å; V206-I215 HydrophobicContact CG1-CD1 3.75Å; V206-I215 HydrophobicContact CG1-CG1 4.34Å; V206-I215 HydrophobicContact CG2-CD1 4.06Å; V206-I215 HydrophobicContact CG2-CG1 4.18Å; V206-I215 HydrophobicContact CG2-CG2 3.87Å; V206-I219 HydrophobicContact CB-CD1 4.42Å; V206-I219 HydrophobicContact CG1-CD1 4.11Å; V206-I219 HydrophobicContact CG2-CD1 4.24Å; V206-L230 HydrophobicContact CG2-CD1 3.77Å
207T84.2Confident87.3Confident89 Ų8970.3 Ų70.355%0.54638%0.381SS..EExtended strand (participates in β ladder)trans-111.7120.6-176-58.70000110.5I211 T212T207-I211 CarbonylContact C-O 3.55Å; T207-I211 WeakPolarHBondContact CA-O 3.38Å; T207-T212 PolarHBondContact OG1-OG1 2.92Å
208Y80.2Confident87.5Confident40 Ų4066.6 Ų66.616%0.15736%0.362CS..EExtended strand (participates in β ladder)trans-124.9128.9172.5-76.8-96.7000109V206 N210 I211 I219 L230V206-Y208 HydrophobicContact CB-CE2 4.35Å; V206-Y208 HydrophobicContact CG2-CD2 4.38Å; V206-Y208 HydrophobicContact CG2-CE2 4.22Å; Y208-N210 VanDerWaalsContact C-N 3.3Å; Y208-N210 PolarHBondContact O-N 3.01Å; Y208-I211 PolarHBondContact N-O 3.49Å; Y208-I211 PolarHBondContact O-N 2.92Å; Y208-I219 HydrophobicContact CE2-CD1 3.95Å; Y208-L230 HydrophobicContact CD2-CB 3.91Å; Y208-L230 HydrophobicContact CD2-CD1 4.18Å; Y208-L230 HydrophobicContact CE2-CB 4.11Å; Y208-L230 HydrophobicContact CE2-CD1 3.81Å; Y208-L230 HydrophobicContact CG-CB 4.3Å
209G77.4Confident87.8Confident75 Ų7562.2 Ų62.277%0.77333%0.33SS*.THydrogen-bonded Turntrans55.238.9175.800000114.7I211G209-I211 PolarHBondContact O-N 3.42Å
210N82.1Confident88.2Confident163 Ų16357.9 Ų57.987%0.87230%0.304SS*.THydrogen-bonded Turntrans66.59.4-173.8-57.2-30.5000116.1Y208Y208-N210 VanDerWaalsContact C-N 3.3Å; Y208-N210 PolarHBondContact O-N 3.01Å
211I86.6Confident88.5Confident94 Ų9457.5 Ų57.548%0.48230%0.302SS..EExtended strand (participates in β ladder)trans-107126.6173-57.9172.2000108.3T207 Y208 G209 Y213T207-I211 CarbonylContact C-O 3.55Å; T207-I211 WeakPolarHBondContact CA-O 3.38Å; Y208-I211 PolarHBondContact N-O 3.49Å; Y208-I211 PolarHBondContact O-N 2.92Å; G209-I211 PolarHBondContact O-N 3.42Å; I211-Y213 HydrophobicContact CB-CD2 4.49Å; I211-Y213 HydrophobicContact CB-CE2 3.68Å; I211-Y213 HydrophobicContact CG2-CD1 4.4Å; I211-Y213 HydrophobicContact CG2-CD2 4.18Å; I211-Y213 HydrophobicContact CG2-CE1 3.87Å; I211-Y213 HydrophobicContact CG2-CE2 3.61Å; I211-Y213 VanDerWaalsContact CG2-CZ 3.44Å; I211-Y213 VanDerWaalsContact O-CD2 3.3Å; I211-Y213 WeakPolarHBondContact O-CD2 3.3Å; I211-Y213 VanDerWaalsContact O-CE2 3.3Å; I211-Y213 WeakPolarHBondContact O-CE2 3.41Å
212T87.5Confident88.7Confident75 Ų7549.7 Ų49.746%0.4627%0.265SS..EExtended strand (participates in β ladder)trans-92.4129.2173.2-49.30000110M205 V206 T207M205-T212 HydrophobicContact CB-CG2 4.02Å; M205-T212 HydrophobicContact CE-CG2 3.74Å; V206-T212 CarbonylContact O-C 3.51Å; V206-T212 WeakPolarHBondContact O-CA 3.36Å; T207-T212 PolarHBondContact OG1-OG1 2.92Å
213Y87.9Confident88.7Confident65 Ų6551.1 Ų51.126%0.25528%0.277SS..EExtended strand (participates in β ladder)trans-113.2139.8-179.1-59.8-92000110.5M205 V206 I211 L230M205-Y213 WeakPolarHBondContact CA-O 3.26Å; V206-Y213 PolarHBondContact N-O 3.24Å; V206-Y213 PolarHBondContact O-N 3.42Å; I211-Y213 HydrophobicContact CB-CD2 4.49Å; I211-Y213 HydrophobicContact CB-CE2 3.68Å; I211-Y213 HydrophobicContact CG2-CD1 4.4Å; I211-Y213 HydrophobicContact CG2-CD2 4.18Å; I211-Y213 HydrophobicContact CG2-CE1 3.87Å; I211-Y213 HydrophobicContact CG2-CE2 3.61Å; I211-Y213 VanDerWaalsContact CG2-CZ 3.44Å; I211-Y213 VanDerWaalsContact O-CD2 3.3Å; I211-Y213 WeakPolarHBondContact O-CD2 3.3Å; I211-Y213 VanDerWaalsContact O-CE2 3.3Å; I211-Y213 WeakPolarHBondContact O-CE2 3.41Å; Y213-L230 HydrophobicContact CD1-CD2 3.76Å; Y213-L230 HydrophobicContact CD2-CD2 4Å; Y213-L230 HydrophobicContact CE1-CD2 4.41Å; Y213-L230 HydrophobicContact CG-CD2 3.52Å
214D90.4Very high88.3Confident71 Ų7153.7 Ų53.738%0.3830%0.296SS..EExtended strand (participates in β ladder)trans-88.8112.4166.7177.728.7000109.4M205 K216M205-D214 HydrophobicContact SD-CB 3.73Å; D214-K216 IonicContact OD2-NZ 3.93Å; D214-K216 PolarHBondContact OD2-NZ 3.2Å
215I91.5Very high88Confident0 Ų052.1 Ų52.10%029%0.291CS..  trans-101.8143.8179.354.4167.2000111.4W202 R204 V206 I219 L230 A234 R235W202-I215 HydrophobicContact CH2-CD1 3.64Å; W202-I215 HydrophobicContact CH2-CG1 3.78Å; W202-I215 HydrophobicContact CZ3-CD1 3.65Å; W202-I215 HydrophobicContact CZ3-CG1 4.07Å; R204-I215 WeakPolarHBondContact CB-O 3.28Å; R204-I215 WeakPolarHBondContact O-CG1 3.31Å; R204-I215 PolarHBondContact O-N 3.01Å; V206-I215 HydrophobicContact CG1-CD1 3.75Å; V206-I215 HydrophobicContact CG1-CG1 4.34Å; V206-I215 HydrophobicContact CG2-CD1 4.06Å; V206-I215 HydrophobicContact CG2-CG1 4.18Å; V206-I215 HydrophobicContact CG2-CG2 3.87Å; I215-I219 HydrophobicContact CD1-CD1 4.18Å; I215-I219 HydrophobicContact CD1-CG1 3.64Å; I215-L230 HydrophobicContact CG2-CD1 3.77Å; I215-L230 HydrophobicContact CG2-CD2 4.07Å; I215-L230 HydrophobicContact CG2-CG 4.49Å; I215-A234 HydrophobicContact CB-CB 4.2Å; I215-A234 HydrophobicContact CG2-CB 3.81Å; I215-R235 HydrophobicContact CG2-CG 4.42Å
216K91.7Very high87.4Confident85 Ų8550.7 Ų50.737%0.3729%0.288SS..SBendtrans-92.7-27.9-175.7-61.7-51.2-174.7-161.90112.7L196 R204 D214 A234 L236L196-K216 HydrophobicContact CD2-CB 3.96Å; L196-K216 WeakPolarHBondContact CD2-O 3.44Å; R204-K216 PolarHBondContact NH1-O 3.49Å; D214-K216 IonicContact OD2-NZ 3.93Å; D214-K216 PolarHBondContact OD2-NZ 3.2Å; K216-A234 PolarHBondContact N-O 3.27Å; K216-L236 HydrophobicContact CB-CD1 3.8Å; K216-L236 HydrophobicContact CB-CG 4.08Å; K216-L236 HydrophobicContact CG-CD1 4.44Å
217I93.8Very high86.8Confident0 Ų054 Ų540%031%0.305CS..SBendtrans-132.7159.6179.261.5171.8000110Y192 W195 L196 W202 I219 C221 A234 L236 P242Y192-I217 HydrophobicContact CD2-CG2 4.24Å; W195-I217 HydrophobicContact CB-CB 4.46Å; W195-I217 HydrophobicContact CB-CG2 4.21Å; L196-I217 HydrophobicContact CD2-CG2 4.26Å; W202-I217 WeakPolarHBondContact CH2-O 3.45Å; I217-I219 PolarHBondContact O-N 3Å; I217-C221 HydrophobicContact CD1-CB 4.17Å; I217-A234 PolarHBondContact N-O 3.14Å; I217-L236 HydrophobicContact CD1-CD2 3.96Å; I217-L236 HydrophobicContact CG1-CD2 4.45Å; I217-L236 HydrophobicContact CG2-CD1 4.4Å; I217-L236 HydrophobicContact CG2-CD2 4.08Å; I217-L236 HydrophobicContact CG2-CG 4.32Å; I217-P242 HydrophobicContact CD1-CB 3.39Å; I217-P242 HydrophobicContact CD1-CG 3.78Å
218P93.3Very high86.4Confident0 Ų055.9 Ų55.90%031%0.312CS..  trans-52.9139.3173.5-29.437000112.1Y164 W195 W202 S220 C221Y164-P218 HydrophobicContact CE1-CB 4.04Å; Y164-P218 HydrophobicContact CE1-CG 3.76Å; W195-P218 VanDerWaalsContact CD2-CD 3.44Å; W195-P218 HydrophobicContact CD2-CG 3.35Å; W195-P218 VanDerWaalsContact CE2-CG 3.47Å; W195-P218 HydrophobicContact CE3-CG 3.65Å; W195-P218 HydrophobicContact CG-CG 3.77Å; W195-P218 HydrophobicContact CH2-CG 4.14Å; W195-P218 HydrophobicContact CZ2-CG 3.89Å; W195-P218 HydrophobicContact CZ3-CG 4.04Å; W202-P218 HydrophobicContact CZ2-CG 4.39Å; P218-S220 WeakPolarHBondContact CB-OG 3.31Å; P218-S220 PolarHBondContact O-N 3.48Å; P218-C221 WeakPolarHBondContact O-CB 3.25Å; P218-C221 PolarHBondContact O-N 2.86Å
219I91.7Very high86.5Confident4 Ų461 Ų612%0.02133%0.331CS..G310 helixtrans-56.8-35.2171.9-58.5-176.2000109.3Y67 A167 V206 Y208 I215 I217 C221 C222 L225 L230 P231 A234Y67-I219 HydrophobicContact CE1-CB 4.42Å; Y67-I219 HydrophobicContact CE1-CG2 4.28Å; A167-I219 HydrophobicContact CB-CD1 3.95Å; V206-I219 HydrophobicContact CB-CD1 4.42Å; V206-I219 HydrophobicContact CG1-CD1 4.11Å; V206-I219 HydrophobicContact CG2-CD1 4.24Å; Y208-I219 HydrophobicContact CE2-CD1 3.95Å; I215-I219 HydrophobicContact CD1-CD1 4.18Å; I215-I219 HydrophobicContact CD1-CG1 3.64Å; I217-I219 PolarHBondContact O-N 3Å; I219-C221 PolarHBondContact O-N 3.23Å; I219-C222 VanDerWaalsContact O-CB 3.22Å; I219-C222 WeakPolarHBondContact O-CB 3.39Å; I219-C222 PolarHBondContact O-N 2.97Å; I219-L225 HydrophobicContact CG2-CD1 4.23Å; I219-L225 HydrophobicContact CG2-CD2 3.54Å; I219-L225 WeakPolarHBondContact O-CD2 3.35Å; I219-L230 HydrophobicContact CD1-CD1 3.89Å; I219-L230 HydrophobicContact CG1-CD1 4.27Å; I219-P231 HydrophobicContact CG2-CG 3.71Å; I219-A234 HydrophobicContact CG1-CB 4.46Å
220S91.8Very high86.9Confident0 Ų058 Ų580%030%0.298CS..G310 helixtrans-61-16176.853.90000116.1Y67 N178 H181 Q182 P218 C222Y67-S220 WeakPolarHBondContact OH-CA 3.43Å; Y67-S220 WeakPolarHBondContact OH-CB 3.26Å; N178-S220 VanDerWaalsContact OD1-CB 3.32Å; N178-S220 WeakPolarHBondContact OD1-CB 3.42Å; N178-S220 PolarHBondContact OD1-OG 3.31Å; H181-S220 WeakPolarHBondContact CB-O 3.35Å; H181-S220 PolarHBondContact ND1-OG 3.01Å; Q182-S220 PolarHBondContact NE2-O 3.44Å; P218-S220 WeakPolarHBondContact CB-OG 3.31Å; P218-S220 PolarHBondContact O-N 3.48Å; S220-C222 VanDerWaalsContact C-N 3.26Å; S220-C222 PolarHBondContact O-N 3.14Å
221C94.6Very high87.1Confident0 Ų051 Ų510%026%0.261CS..G310 helixtrans-82.4-0.6174.3-69.30000114.5C187 I217 P218 I219 P242 F243C187-C221 HydrophobicContact CB-CB 3.52Å; C187-C221 WeakPolarHBondContact CB-SG 3.15Å; C187-C221 WeakPolarHBondContact SG-CB 3.34Å; C187-C221 CovalentContact SG-SG 2.02Å; C187-C221 PolarHBondContact SG-SG 3.45Å; I217-C221 HydrophobicContact CD1-CB 4.17Å; P218-C221 WeakPolarHBondContact O-CB 3.25Å; P218-C221 PolarHBondContact O-N 2.86Å; I219-C221 PolarHBondContact O-N 3.23Å; C221-P242 HydrophobicContact CB-CB 4.43Å; C221-P242 WeakPolarHBondContact O-CA 3.36Å; C221-P242 WeakPolarHBondContact O-CB 3.4Å; C221-F243 WeakPolarHBondContact O-CD2 3.48Å; C221-F243 PolarHBondContact O-N 3.25Å
222C92.7Very high87.1Confident0 Ų048.9 Ų48.90%025%0.251CS..SBendtrans-100.3140.1-174.4-83.90000112.7Q182 I219 S220 L225 P231 C233 A234Q182-C222 PolarHBondContact NE2-O 2.99Å; I219-C222 VanDerWaalsContact O-CB 3.22Å; I219-C222 WeakPolarHBondContact O-CB 3.39Å; I219-C222 PolarHBondContact O-N 2.97Å; S220-C222 VanDerWaalsContact C-N 3.26Å; S220-C222 PolarHBondContact O-N 3.14Å; C222-L225 HydrophobicContact CB-CD2 3.79Å; C222-P231 HydrophobicContact CB-CB 3.83Å; C222-P231 HydrophobicContact CB-CG 3.76Å; C222-C233 WeakPolarHBondContact CA-SG 3.45Å; C222-C233 HydrophobicContact CB-CB 4.26Å; C222-C233 WeakPolarHBondContact CB-SG 3.49Å; C222-C233 WeakPolarHBondContact SG-CB 3.14Å; C222-C233 CovalentContact SG-SG 2Å; C222-C233 PolarHBondContact SG-SG 3.48Å; C222-A234 PolarHBondContact SG-N 2.89Å
223P89.5Confident87.3Confident51 Ų5145.5 Ų45.533%0.33123%0.23SC..SBendtrans-69.1158.2168.629.8-34.3000111.7F243P223-F243 HydrophobicContact CB-CE1 4.12Å; P223-F243 HydrophobicContact CB-CZ 4.19Å
224N82.3Confident87.5Confident152 Ų15242.4 Ų42.481%0.81322%0.218SC*.SBendtrans56.252.3172.1-56.5-33.6000114.4
225L83.6Confident87.4Confident24 Ų2446.2 Ų46.213%0.12623%0.227CC..  trans-69.5139.5177.1-65.2-173.9000113Y67 Q182 I219 C222 P231Y67-L225 HydrophobicContact CE1-CD1 4.03Å; Y67-L225 HydrophobicContact CE2-CD1 4.38Å; Y67-L225 WeakPolarHBondContact OH-CD1 3.32Å; Q182-L225 HydrophobicContact CG-CD1 3.86Å; Q182-L225 VanDerWaalsContact NE2-CD1 3.29Å; I219-L225 HydrophobicContact CG2-CD1 4.23Å; I219-L225 HydrophobicContact CG2-CD2 3.54Å; I219-L225 WeakPolarHBondContact O-CD2 3.35Å; C222-L225 HydrophobicContact CB-CD2 3.79Å; L225-P231 HydrophobicContact CD2-CB 4.01Å; L225-P231 HydrophobicContact CD2-CG 3.59Å
226T76.2Confident87.2Confident63 Ų6349 Ų4939%0.38724%0.242SC..  trans-136.2151171.269.70000109.9D228T226-D228 WeakPolarHBondContact CB-OD1 3.35Å; T226-D228 PolarHBondContact O-N 3.19Å; T226-D228 PolarHBondContact OG1-OD1 3.26Å
227N73.2Confident86.6Confident82 Ų8248.3 Ų48.344%0.43924%0.242SC..SBendtrans-75.3-14.4-174-611.3000113E65 Q66 Y67E65-N227 PolarHBondContact O-ND2 3.04Å; E65-N227 PolarHBondContact O-OD1 3.41Å; E65-N227 VanDerWaalsContact O-OD1 3.09Å; Q66-N227 WeakPolarHBondContact CA-OD1 3.03Å; Q66-N227 PolarHBondContact O-OD1 3.26Å; Y67-N227 PolarHBondContact N-OD1 3.32Å
228D77.1Confident85.8Confident130 Ų13053.4 Ų53.470%0.69528%0.278SS*.SBendtrans-101-18.2-171.365.4-33000113.7T226T226-D228 WeakPolarHBondContact CB-OD1 3.35Å; T226-D228 PolarHBondContact O-N 3.19Å; T226-D228 PolarHBondContact OG1-OD1 3.26Å
229R82.1Confident85.3Confident146 Ų14659.2 Ų59.255%0.55131%0.309SS*.SBendtrans-133.8138.7-175.2-180176.9170.2175.1-4.1112.1D232R229-D232 IonicContact CZ-OD2 2.69Å; R229-D232 IonicContact NH2-OD1 2.98Å; R229-D232 IonicContact NH2-OD2 3.98Å; R229-D232 PolarHBondContact NH2-OD2 3.47Å
230L85.7Confident85Confident14 Ų1465.3 Ų65.37%0.07333%0.332CS..  trans-68.7125.6167.8-176.973.9000110.4V206 Y208 Y213 I215 I219 A234 R235V206-L230 HydrophobicContact CG2-CD1 3.77Å; Y208-L230 HydrophobicContact CD2-CB 3.91Å; Y208-L230 HydrophobicContact CD2-CD1 4.18Å; Y208-L230 HydrophobicContact CE2-CB 4.11Å; Y208-L230 HydrophobicContact CE2-CD1 3.81Å; Y208-L230 HydrophobicContact CG-CB 4.3Å; Y213-L230 HydrophobicContact CD1-CD2 3.76Å; Y213-L230 HydrophobicContact CD2-CD2 4Å; Y213-L230 HydrophobicContact CE1-CD2 4.41Å; Y213-L230 HydrophobicContact CG-CD2 3.52Å; I215-L230 HydrophobicContact CG2-CD1 3.77Å; I215-L230 HydrophobicContact CG2-CD2 4.07Å; I215-L230 HydrophobicContact CG2-CG 4.49Å; I219-L230 HydrophobicContact CD1-CD1 3.89Å; I219-L230 HydrophobicContact CG1-CD1 4.27Å; L230-A234 HydrophobicContact CD1-CB 4.29Å; L230-R235 HydrophobicContact CD2-CG 4.28Å
231P86.9Confident85Confident14 Ų1469.2 Ų69.29%0.09136%0.358CS..  trans-71.2136.6175.832.4-38.9000111.2I219 C222 L225 C233 A234I219-P231 HydrophobicContact CG2-CG 3.71Å; C222-P231 HydrophobicContact CB-CB 3.83Å; C222-P231 HydrophobicContact CB-CG 3.76Å; L225-P231 HydrophobicContact CD2-CB 4.01Å; L225-P231 HydrophobicContact CD2-CG 3.59Å; P231-C233 PolarHBondContact O-N 3.2Å; P231-A234 HydrophobicContact CG-CB 4.14Å; P231-A234 WeakPolarHBondContact O-CB 3.41Å; P231-A234 PolarHBondContact O-N 3.03Å
232D86.7Confident84.9Confident51 Ų5169.9 Ų69.927%0.27336%0.362SS..G310 helixtrans-63.9-27.2-172.6-67.3-47.6000113.2R229 A234 R235 N237 Y240R229-D232 IonicContact CZ-OD2 2.69Å; R229-D232 IonicContact NH2-OD1 2.98Å; R229-D232 IonicContact NH2-OD2 3.98Å; R229-D232 PolarHBondContact NH2-OD2 3.47Å; D232-A234 VanDerWaalsContact C-N 3.3Å; D232-A234 PolarHBondContact O-N 2.93Å; D232-R235 PolarHBondContact O-N 3.5Å; D232-N237 WeakPolarHBondContact O-CB 3.36Å; D232-Y240 HydrophobicContact CB-CD2 3.74Å; D232-Y240 HydrophobicContact CB-CE2 4.35Å; D232-Y240 HydrophobicContact CB-CG 4.17Å
233C91.4Very high85Confident4 Ų471.3 Ų71.33%0.02737%0.368CS..G310 helixtrans-65.9-25175.246.10000113.9C222 P231 R235 L236 Y240C222-C233 WeakPolarHBondContact CA-SG 3.45Å; C222-C233 HydrophobicContact CB-CB 4.26Å; C222-C233 WeakPolarHBondContact CB-SG 3.49Å; C222-C233 WeakPolarHBondContact SG-CB 3.14Å; C222-C233 CovalentContact SG-SG 2Å; C222-C233 PolarHBondContact SG-SG 3.48Å; P231-C233 PolarHBondContact O-N 3.2Å; C233-R235 PolarHBondContact O-N 2.89Å; C233-R235 VanDerWaalsContact O-N 3.12Å; C233-L236 WeakPolarHBondContact O-CA 3.26Å; C233-L236 PolarHBondContact O-N 2.98Å; C233-Y240 VanDerWaalsContact CA-O 3.26Å; C233-Y240 WeakPolarHBondContact CA-O 3.35Å; C233-Y240 WeakPolarHBondContact CB-O 3.35Å
234A91Very high85.2Confident0 Ų074.9 Ų74.90%038%0.383CS..G310 helixtrans-65.6-20.3-178.600000112.2I215 K216 I217 I219 C222 L230 P231 D232I215-A234 HydrophobicContact CB-CB 4.2Å; I215-A234 HydrophobicContact CG2-CB 3.81Å; K216-A234 PolarHBondContact N-O 3.27Å; I217-A234 PolarHBondContact N-O 3.14Å; I219-A234 HydrophobicContact CG1-CB 4.46Å; C222-A234 PolarHBondContact SG-N 2.89Å; L230-A234 HydrophobicContact CD1-CB 4.29Å; P231-A234 HydrophobicContact CG-CB 4.14Å; P231-A234 WeakPolarHBondContact O-CB 3.41Å; P231-A234 PolarHBondContact O-N 3.03Å; D232-A234 VanDerWaalsContact C-N 3.3Å; D232-A234 PolarHBondContact O-N 2.93Å
235R89.5Confident85.7Confident150 Ų15072.6 Ų72.657%0.56637%0.367SS*.G310 helixtrans-94.86.6174.1-63.2177.962.8-159.1-2.4113.2I215 L230 D232 C233I215-R235 HydrophobicContact CG2-CG 4.42Å; L230-R235 HydrophobicContact CD2-CG 4.28Å; D232-R235 PolarHBondContact O-N 3.5Å; C233-R235 PolarHBondContact O-N 2.89Å; C233-R235 VanDerWaalsContact O-N 3.12Å
236L86.4Confident86.1Confident60 Ų6071.9 Ų71.931%0.31437%0.366SS..THydrogen-bonded Turntrans56.143.5-174.1-65.5174.2000113.4Y192 L196 K216 I217 C233 S238 P242Y192-L236 HydrophobicContact CD2-CD2 4.11Å; Y192-L236 HydrophobicContact CE2-CD2 3.76Å; L196-L236 HydrophobicContact CD1-CD1 4.19Å; L196-L236 HydrophobicContact CD2-CD1 3.91Å; K216-L236 HydrophobicContact CB-CD1 3.8Å; K216-L236 HydrophobicContact CB-CG 4.08Å; K216-L236 HydrophobicContact CG-CD1 4.44Å; I217-L236 HydrophobicContact CD1-CD2 3.96Å; I217-L236 HydrophobicContact CG1-CD2 4.45Å; I217-L236 HydrophobicContact CG2-CD1 4.4Å; I217-L236 HydrophobicContact CG2-CD2 4.08Å; I217-L236 HydrophobicContact CG2-CG 4.32Å; C233-L236 WeakPolarHBondContact O-CA 3.26Å; C233-L236 PolarHBondContact O-N 2.98Å; L236-S238 PolarHBondContact O-N 3.47Å; L236-P242 HydrophobicContact CD2-CG 4.21Å
237N79.9Confident86.8Confident70 Ų7068.9 Ų68.937%0.37435%0.348SS..  trans-70.1127.1170.5-171.3-20.1000110.2D232 N239 Y240D232-N237 WeakPolarHBondContact O-CB 3.36Å; N237-N239 PolarHBondContact O-N 3.44Å; N237-N239 VanDerWaalsContact O-N 3.08Å; N237-N239 PolarHBondContact OD1-N 2.91Å; N237-Y240 CarbonylContact O-C 3.47Å; N237-Y240 PolarHBondContact O-N 3.37Å; N237-Y240 VanDerWaalsContact O-N 3.07Å; N237-Y240 VanDerWaalsContact O-O 3.1Å
238S75.5Confident87.5Confident107 Ų10765 Ų6575%0.74833%0.327SS*.THydrogen-bonded Turntrans-57.9-26.5-174.157.50000114.6L236 Y240L236-S238 PolarHBondContact O-N 3.47Å; S238-Y240 VanDerWaalsContact C-N 3.31Å
239N84.3Confident87.7Confident122 Ų12264.4 Ų64.465%0.65232%0.32SS*.THydrogen-bonded Turntrans-78.3-16.5-177.9-65.4-12.3000113.3N237N237-N239 PolarHBondContact O-N 3.44Å; N237-N239 VanDerWaalsContact O-N 3.08Å; N237-N239 PolarHBondContact OD1-N 2.91Å
240Y85.9Confident87.9Confident132 Ų13258.4 Ų58.452%0.51830%0.299SS..SBendtrans-132.686.7-178-60.8-80.4000107.9D232 C233 N237 S238D232-Y240 HydrophobicContact CB-CD2 3.74Å; D232-Y240 HydrophobicContact CB-CE2 4.35Å; D232-Y240 HydrophobicContact CB-CG 4.17Å; C233-Y240 VanDerWaalsContact CA-O 3.26Å; C233-Y240 WeakPolarHBondContact CA-O 3.35Å; C233-Y240 WeakPolarHBondContact CB-O 3.35Å; N237-Y240 CarbonylContact O-C 3.47Å; N237-Y240 PolarHBondContact O-N 3.37Å; N237-Y240 VanDerWaalsContact O-N 3.07Å; N237-Y240 VanDerWaalsContact O-O 3.1Å; S238-Y240 VanDerWaalsContact C-N 3.31Å
241P90.4Very high87.8Confident82 Ų8258.3 Ų58.353%0.53230%0.298SS..  trans-70.8148.3-179.628.8-33.9000111.1
242P94Very high87.3Confident13 Ų1359.2 Ų59.28%0.08430%0.303CS..  trans-72.8175.5168.133.9-36.1000111.3Y192 I217 C221 L236 I244Y192-P242 HydrophobicContact CD1-CG 4.1Å; Y192-P242 HydrophobicContact CD2-CG 3.96Å; Y192-P242 HydrophobicContact CE1-CG 4.4Å; Y192-P242 HydrophobicContact CE2-CG 4.28Å; Y192-P242 HydrophobicContact CG-CG 3.86Å; I217-P242 HydrophobicContact CD1-CB 3.39Å; I217-P242 HydrophobicContact CD1-CG 3.78Å; C221-P242 HydrophobicContact CB-CB 4.43Å; C221-P242 WeakPolarHBondContact O-CA 3.36Å; C221-P242 WeakPolarHBondContact O-CB 3.4Å; L236-P242 HydrophobicContact CD2-CG 4.21Å; P242-I244 PolarHBondContact O-N 2.71Å
243F94.6Very high86.7Confident30 Ų3061.3 Ų61.313%0.13231%0.308CS..  trans-57.6122165.4-58.8-49.6000110.1H181 H185 C187 C221 P223H181-F243 WeakPolarHBondContact O-CE2 3.45Å; H185-F243 HydrophobicContact CB-CD1 3.84Å; H185-F243 HydrophobicContact CB-CE1 3.64Å; H185-F243 HydrophobicContact CB-CE2 4.48Å; H185-F243 HydrophobicContact CB-CG 4.38Å; H185-F243 HydrophobicContact CB-CZ 4Å; H185-F243 AromaticContact CG-CE1 3.95Å; H185-F243 AromaticContact ND1-CE1 3.74Å; H185-F243 AromaticContact ND1-CZ 3.42Å; H185-F243 WeakPolarHBondContact ND1-CZ 3.49Å; H185-F243 WeakPolarHBondContact O-CB 3.34Å; H185-F243 WeakPolarHBondContact O-CD1 3.21Å; H185-F243 WeakPolarHBondContact O-CG 3.48Å; C187-F243 HydrophobicContact CB-CB 4.12Å; C187-F243 VanDerWaalsContact CB-O 3.27Å; C187-F243 WeakPolarHBondContact CB-O 3.29Å; C221-F243 WeakPolarHBondContact O-CD2 3.48Å; C221-F243 PolarHBondContact O-N 3.25Å; P223-F243 HydrophobicContact CB-CE1 4.12Å; P223-F243 HydrophobicContact CB-CZ 4.19Å
244I92.2Very high86Confident126 Ų12665.2 Ų65.265%0.64633%0.329SS*.  trans-88-23.1-176.158.5173.1000112.9Y192 P242Y192-I244 HydrophobicContact CE1-CG2 4.47Å; P242-I244 PolarHBondContact O-N 2.71Å
245Q92.4Very high85.1Confident104 Ų10467 Ų6749%0.48634%0.341SS..SBendtrans-79.8137.7-176.9-171.4174.96.600111C186 C187 I250C186-Q245 CarbonylContact C-O 3.6Å; C186-Q245 VanDerWaalsContact CA-O 3.26Å; C186-Q245 WeakPolarHBondContact CA-O 3.48Å; C186-Q245 WeakPolarHBondContact CB-O 3.41Å; C187-Q245 PolarHBondContact N-O 3.41Å; Q245-I250 HydrophobicContact CG-CD1 3.98Å; Q245-I250 HydrophobicContact CG-CG1 4.42Å
246G92.1Very high84.4Confident10 Ų1061.4 Ų61.410%0.10332%0.322CS..  trans-73.8143.5172.100000112.7M189 Y190 G248M189-G246 CarbonylContact O-C 3.58Å; M189-G246 WeakPolarHBondContact O-CA 3.33Å; Y190-G246 VanDerWaalsContact O-CA 3.28Å; Y190-G246 WeakPolarHBondContact O-CA 3.33Å; Y190-G246 PolarHBondContact O-N 2.7Å; G246-G248 VanDerWaalsContact C-N 3.32Å
247C92.2Very high83.8Confident0 Ų059.6 Ų59.60%031%0.311CS..Hα-helixtrans-74.7-22.7179.5-60.30000113.5V180 H181 C186 G188 M189 E249 I250 L251V180-C247 HydrophobicContact CG1-CB 3.8Å; H181-C247 PolarHBondContact CD2-SG 3.43Å; C186-C247 HydrophobicContact CB-CB 3.97Å; C186-C247 WeakPolarHBondContact CB-SG 3.24Å; C186-C247 WeakPolarHBondContact SG-CA 3.48Å; C186-C247 WeakPolarHBondContact SG-CB 3.47Å; C186-C247 CovalentContact SG-SG 2.03Å; C186-C247 PolarHBondContact SG-SG 3.03Å; G188-C247 WeakPolarHBondContact O-CB 3.48Å; G188-C247 PolarHBondContact O-N 2.9Å; G188-C247 PolarHBondContact O-SG 2.85Å; M189-C247 PolarHBondContact O-N 3.2Å; C247-E249 PolarHBondContact O-N 2.98Å; C247-I250 PolarHBondContact O-N 3.5Å; C247-L251 HydrophobicContact CB-CD1 4.36Å; C247-L251 WeakPolarHBondContact O-CB 3.39Å; C247-L251 VanDerWaalsContact O-CG 3.29Å; C247-L251 WeakPolarHBondContact O-CG 3.32Å; C247-L251 PolarHBondContact O-N 3.28Å
248G87.4Confident83.5Confident0 Ų061.7 Ų61.70%032%0.322CS..Hα-helixtrans-59.5-50.2-172.500000113.3M189 G246 T252M189-G248 WeakPolarHBondContact O-CA 3.29Å; M189-G248 PolarHBondContact O-N 3.21Å; G246-G248 VanDerWaalsContact C-N 3.32Å; G248-T252 PolarHBondContact O-N 3.39Å; G248-T252 PolarHBondContact O-OG1 3.3Å
249E81.1Confident83.7Confident118 Ų11856.6 Ų56.655%0.55129%0.287SS*.Hα-helixtrans-65.4-42.1178.3-172171.8-165.400111.1C247 L251 T252 Y253C247-E249 PolarHBondContact O-N 2.98Å; E249-L251 PolarHBondContact O-N 3.26Å; E249-T252 WeakPolarHBondContact O-CB 3.38Å; E249-T252 PolarHBondContact O-N 3.01Å; E249-Y253 HydrophobicContact CG-CD2 3.9Å; E249-Y253 HydrophobicContact CG-CE2 3.51Å; E249-Y253 WeakPolarHBondContact O-CD2 3.48Å; E249-Y253 PolarHBondContact O-N 3.44Å
250I87.4Confident83.4Confident19 Ų1951.2 Ų51.210%0.09726%0.258CS..Hα-helixtrans-61.9-47.9-179.5-55.1176.6000111.2F184 C186 Q245 C247 T252 Y253 N254F184-I250 HydrophobicContact CB-CD1 4.41Å; F184-I250 HydrophobicContact CB-CG2 4.01Å; F184-I250 HydrophobicContact CD1-CG2 3.69Å; F184-I250 HydrophobicContact CE1-CG2 4.39Å; F184-I250 HydrophobicContact CG-CG2 3.97Å; C186-I250 HydrophobicContact CB-CD1 3.69Å; Q245-I250 HydrophobicContact CG-CD1 3.98Å; Q245-I250 HydrophobicContact CG-CG1 4.42Å; C247-I250 PolarHBondContact O-N 3.5Å; I250-T252 PolarHBondContact O-N 3.24Å; I250-Y253 PolarHBondContact O-N 3.31Å; I250-Y253 VanDerWaalsContact O-N 3.13Å; I250-N254 PolarHBondContact O-N 3.05Å; I250-N254 PolarHBondContact O-ND2 3.34Å
251L83.4Confident82.9Confident12 Ų1247.4 Ų47.46%0.06325%0.251CS..Hα-helixtrans-63.8-25.9179.2-73.3177.3000112.8F153 L157 V180 F184 C247 E249 N254 I256F153-L251 HydrophobicContact CE1-CB 4.03Å; F153-L251 HydrophobicContact CZ-CB 4.37Å; L157-L251 HydrophobicContact CD1-CD1 3.87Å; V180-L251 HydrophobicContact CG1-CD1 3.94Å; V180-L251 HydrophobicContact CG1-CD2 4.08Å; V180-L251 HydrophobicContact CG1-CG 4.17Å; V180-L251 HydrophobicContact CG2-CD1 4.45Å; V180-L251 HydrophobicContact CG2-CD2 4.09Å; F184-L251 HydrophobicContact CD2-CD2 4.08Å; F184-L251 HydrophobicContact CE2-CD2 3.73Å; F184-L251 HydrophobicContact CZ-CD2 4.43Å; C247-L251 HydrophobicContact CB-CD1 4.36Å; C247-L251 WeakPolarHBondContact O-CB 3.39Å; C247-L251 VanDerWaalsContact O-CG 3.29Å; C247-L251 WeakPolarHBondContact O-CG 3.32Å; C247-L251 PolarHBondContact O-N 3.28Å; E249-L251 PolarHBondContact O-N 3.26Å; L251-N254 CarbonylContact O-C 3.6Å; L251-I256 HydrophobicContact CD2-CD1 3.93Å; L251-I256 HydrophobicContact CD2-CG1 3.69Å
252T76.3Confident82.3Confident33 Ų3345.9 Ų45.920%0.20224%0.238CC..Hα-helixtrans-73-35176.3-51.50000111.8V150 G248 E249 I250V150-T252 HydrophobicContact CB-CG2 4.2Å; V150-T252 HydrophobicContact CG2-CG2 3.18Å; G248-T252 PolarHBondContact O-N 3.39Å; G248-T252 PolarHBondContact O-OG1 3.3Å; E249-T252 WeakPolarHBondContact O-CB 3.38Å; E249-T252 PolarHBondContact O-N 3.01Å; I250-T252 PolarHBondContact O-N 3.24Å
253Y74Confident81.6Confident96 Ų9648.3 Ų48.338%0.37626%0.255SS..Hα-helixtrans-91.3-24.9179-64.9-67.6000113.5P146 E249 I250P146-Y253 HydrophobicContact CB-CE1 4.22Å; P146-Y253 HydrophobicContact CG-CE1 4.41Å; E249-Y253 HydrophobicContact CG-CD2 3.9Å; E249-Y253 HydrophobicContact CG-CE2 3.51Å; E249-Y253 WeakPolarHBondContact O-CD2 3.48Å; E249-Y253 PolarHBondContact O-N 3.44Å; I250-Y253 PolarHBondContact O-N 3.31Å; I250-Y253 VanDerWaalsContact O-N 3.13Å
254N75.6Confident80.7Confident86 Ų8648 Ų4846%0.4625%0.254SS..SBendtrans-128.381.5-179.6-56.2-73.8000108.6F184 I250 L251F184-N254 HydrophobicContact CE1-CB 3.95Å; F184-N254 HydrophobicContact CZ-CB 4.49Å; I250-N254 PolarHBondContact O-N 3.05Å; I250-N254 PolarHBondContact O-ND2 3.34Å; L251-N254 CarbonylContact O-C 3.6Å
255P72.6Confident79.8Confident38 Ų3847 Ų4725%0.24724%0.242CC..  trans-60.1144.4175.927.1-33.6000109.6F257P255-F257 PolarHBondContact O-N 3.41Å
256I74.3Confident79.3Confident32 Ų3247.7 Ų47.716%0.16424%0.244CC..SBendtrans-61.2-28.3179.3-58.2170.4000111.2I59 L176 Y179 V180 F184 L251I59-I256 HydrophobicContact CD1-CG2 3.88Å; L176-I256 HydrophobicContact CD1-CD1 3.51Å; Y179-I256 HydrophobicContact CE1-CG2 4.11Å; V180-I256 HydrophobicContact CG2-CD1 3.57Å; V180-I256 HydrophobicContact CG2-CG1 4.4Å; F184-I256 HydrophobicContact CE2-CG1 4.13Å; L251-I256 HydrophobicContact CD2-CD1 3.93Å; L251-I256 HydrophobicContact CD2-CG1 3.69Å
257F73.9Confident79Confident21 Ų2147.4 Ų47.49%0.09224%0.24CC..SBendtrans-120.6109.9-177.8-60.5-65000109.8L47 L55 F56 I59 F83 R87 P255L47-F257 HydrophobicContact CD1-CB 4.42Å; L47-F257 HydrophobicContact CD2-CB 3.78Å; L47-F257 HydrophobicContact CD2-CD1 4.06Å; L47-F257 HydrophobicContact CD2-CG 3.95Å; L55-F257 HydrophobicContact CD1-CD1 4.21Å; L55-F257 HydrophobicContact CD1-CE1 4.2Å; L55-F257 HydrophobicContact CD2-CD1 4.11Å; L55-F257 HydrophobicContact CD2-CE1 3.8Å; L55-F257 HydrophobicContact CD2-CZ 4.03Å; L55-F257 HydrophobicContact CG-CD1 4.11Å; L55-F257 HydrophobicContact CG-CE1 3.66Å; L55-F257 HydrophobicContact CG-CZ 4.26Å; F56-F257 HydrophobicContact CD1-CZ 4.02Å; F56-F257 AromaticContact CE1-CE2 3.82Å; F56-F257 HydrophobicContact CE1-CE2 3.82Å; F56-F257 AromaticContact CE1-CZ 3.35Å; F56-F257 HydrophobicContact CE1-CZ 3.35Å; F56-F257 HydrophobicContact CE2-CE2 4.37Å; F56-F257 AromaticContact CE2-CZ 3.96Å; F56-F257 HydrophobicContact CE2-CZ 3.96Å; F56-F257 HydrophobicContact CZ-CE1 4.45Å; F56-F257 AromaticContact CZ-CE2 3.47Å; F56-F257 HydrophobicContact CZ-CE2 3.47Å; F56-F257 VanDerWaalsContact CZ-CE2 3.47Å; F56-F257 AromaticContact CZ-CZ 3.25Å; F56-F257 HydrophobicContact CZ-CZ 3.25Å; I59-F257 HydrophobicContact CD1-CE1 4.46Å; I59-F257 HydrophobicContact CD1-CZ 4.09Å; F83-F257 HydrophobicContact CD2-CD2 4.47Å; F83-F257 HydrophobicContact CD2-CE2 4.28Å; F83-F257 HydrophobicContact CE2-CD2 4.17Å; F83-F257 HydrophobicContact CE2-CE2 4.31Å; R87-F257 VanDerWaalsContact CZ-O 3.29Å; R87-F257 PolarHBondContact NH1-O 3.46Å; P255-F257 PolarHBondContact O-N 3.41Å
258D73.7Confident78.7Confident115 Ų11547.4 Ų47.462%0.61524%0.24SC*.  trans-74.1128.6168.5-69.1-33.7000109.5
259T80Confident78.9Confident0 Ų050.3 Ų50.30%026%0.255CS..SBendtrans-79-30.9171.639.70000113.3G43 P44 L47 R87 P91 I94 E264G43-T259 CarbonylContact C-O 3.56Å; G43-T259 WeakPolarHBondContact CA-O 3.48Å; P44-T259 WeakPolarHBondContact CD-O 3.28Å; L47-T259 HydrophobicContact CD1-CG2 3.48Å; L47-T259 VanDerWaalsContact CD1-CG2 3.48Å; R87-T259 VanDerWaalsContact CZ-CG2 3.46Å; R87-T259 VanDerWaalsContact NE-CG2 3.28Å; R87-T259 VanDerWaalsContact NH2-CB 3.31Å; R87-T259 PolarHBondContact NH2-OG1 2.96Å; P91-T259 HydrophobicContact CB-CG2 3.9Å; P91-T259 HydrophobicContact CG-CG2 3.81Å; I94-T259 HydrophobicContact CD1-CG2 4.26Å; I94-T259 WeakPolarHBondContact CD1-OG1 3.13Å; T259-E264 PolarHBondContact N-OE1 3.35Å; T259-E264 WeakPolarHBondContact OG1-CG 3.31Å; T259-E264 PolarHBondContact OG1-OE1 2.95Å
260T79Confident79.3Confident9 Ų946.6 Ų46.66%0.05524%0.24CC..SBendtrans-130159.1-170.347.30000109.6D40 I94 I262 Y267D40-T260 HydrophobicContact CB-CG2 4.31Å; I94-T260 HydrophobicContact CD1-CG2 4.44Å; I94-T260 HydrophobicContact CG2-CG2 3.82Å; T260-I262 PolarHBondContact O-N 3.48Å; T260-I262 PolarHBondContact OG1-O 2.79Å; T260-Y267 HydrophobicContact CG2-CG 4.41Å
261S75.2Confident79.5Confident52 Ų5245.9 Ų45.936%0.36424%0.236SC..SBendtrans-70-15.7179.170.60000113.6R39 D40R39-S261 PolarHBondContact NE-OG 3.3Å; D40-S261 WeakPolarHBondContact OD1-CB 3.03Å; D40-S261 PolarHBondContact OD1-N 3.46Å; D40-S261 PolarHBondContact OD1-OG 3.21Å
262I78Confident80Confident50 Ų5046.1 Ų46.126%0.25624%0.237SC..SBendtrans-109.5150.8174.9-58.4169.4000107.5M36 T260 E264 F266 V270M36-I262 HydrophobicContact CE-CD1 3.85Å; T260-I262 PolarHBondContact O-N 3.48Å; T260-I262 PolarHBondContact OG1-O 2.79Å; I262-E264 PolarHBondContact O-N 2.85Å; I262-F266 HydrophobicContact CG2-CB 4.16Å; I262-V270 HydrophobicContact CD1-CG2 4.05Å
263S78Confident80.8Confident63 Ų6347.8 Ų47.844%0.44125%0.247SC..  trans-47.7131.4169.5154.90000111.2R265 F266 Y267S263-R265 PolarHBondContact O-N 3.35Å; S263-R265 PolarHBondContact OG-N 3.49Å; S263-F266 PolarHBondContact O-N 3.02Å; S263-Y267 PolarHBondContact O-N 3.21Å
264E75.1Confident81.7Confident25 Ų2543.9 Ų43.912%0.11723%0.234CC..THydrogen-bonded Turntrans-59-23.2-177.3-70141.5-170.400113.3R87 T259 I262 F266 Y267R87-E264 IonicContact CZ-OE1 2.83Å; R87-E264 IonicContact CZ-OE2 3.43Å; R87-E264 IonicContact NH1-OE1 3.66Å; R87-E264 PolarHBondContact NH1-OE1 3.33Å; R87-E264 IonicContact NH1-OE2 3.16Å; R87-E264 PolarHBondContact NH1-OE2 3.47Å; R87-E264 IonicContact NH2-OE1 3.8Å; R87-E264 PolarHBondContact NH2-OE1 3.34Å; R87-E264 IonicContact NH2-OE2 3.09Å; R87-E264 PolarHBondContact NH2-OE2 2.96Å; T259-E264 PolarHBondContact N-OE1 3.35Å; T259-E264 WeakPolarHBondContact OG1-CG 3.31Å; T259-E264 PolarHBondContact OG1-OE1 2.95Å; I262-E264 PolarHBondContact O-N 2.85Å; E264-F266 VanDerWaalsContact C-N 3.26Å; E264-F266 PolarHBondContact O-N 3.16Å; E264-Y267 WeakPolarHBondContact O-CD1 3.3Å
265R75.3Confident82.6Confident105 Ų10539.9 Ų39.940%0.39621%0.212SC..THydrogen-bonded Turntrans-70.1-22.5173.4-63.3-173.7178.3-172.60.4113.8W141 S263W141-R265 HydrophobicContact CE3-CG 4.44Å; S263-R265 PolarHBondContact O-N 3.35Å; S263-R265 PolarHBondContact OG-N 3.49Å
266F81.2Confident83.6Confident118 Ų11841.8 Ų41.852%0.51822%0.22SC..THydrogen-bonded Turntrans-118.6-11.5-172.1-64.3-68.1000113.5I262 S263 E264 T268 L269I262-F266 HydrophobicContact CG2-CB 4.16Å; S263-F266 PolarHBondContact O-N 3.02Å; E264-F266 VanDerWaalsContact C-N 3.26Å; E264-F266 PolarHBondContact O-N 3.16Å; F266-T268 VanDerWaalsContact C-N 3.3Å; F266-T268 PolarHBondContact O-N 2.83Å; F266-L269 HydrophobicContact CD1-CD2 4.31Å; F266-L269 VanDerWaalsContact O-CB 3.32Å; F266-L269 WeakPolarHBondContact O-CB 3.35Å; F266-L269 PolarHBondContact O-N 3.35Å; F266-L269 VanDerWaalsContact O-N 3.07Å
267Y85.3Confident84.7Confident4 Ų443.9 Ų43.92%0.01623%0.23CC..Hα-helixtrans-59.7-41.6-177.494.1-90.1000111.6I94 H97 T260 S263 E264 L269 V270 Y271I94-Y267 HydrophobicContact CD1-CE1 4.01Å; I94-Y267 HydrophobicContact CG1-CE1 4.09Å; I94-Y267 HydrophobicContact CG2-CE2 4.5Å; H97-Y267 AromaticContact ND1-CE2 3.7Å; T260-Y267 HydrophobicContact CG2-CG 4.41Å; S263-Y267 PolarHBondContact O-N 3.21Å; E264-Y267 WeakPolarHBondContact O-CD1 3.3Å; Y267-L269 VanDerWaalsContact C-N 3.28Å; Y267-L269 PolarHBondContact O-N 3.37Å; Y267-V270 PolarHBondContact O-N 3.27Å; Y267-Y271 HydrophobicContact CD2-CD2 4.11Å; Y267-Y271 HydrophobicContact CD2-CE2 4.03Å; Y267-Y271 WeakPolarHBondContact O-CD2 3.42Å
268T86.9Confident85.6Confident0 Ų042.9 Ų42.90%023%0.226CC..Hα-helixtrans-65.9-28.3177.452.70000113.3V137 F266 V270 Y271 L272V137-T268 HydrophobicContact CB-CG2 4.27Å; V137-T268 HydrophobicContact CG1-CG2 3.67Å; F266-T268 VanDerWaalsContact C-N 3.3Å; F266-T268 PolarHBondContact O-N 2.83Å; T268-V270 VanDerWaalsContact C-N 3.31Å; T268-V270 PolarHBondContact O-N 2.96Å; T268-Y271 PolarHBondContact O-N 2.9Å; T268-L272 VanDerWaalsContact O-CB 3.23Å; T268-L272 WeakPolarHBondContact O-CB 3.32Å; T268-L272 PolarHBondContact O-N 2.94Å
269L89.7Confident86.5Confident60 Ų6038.8 Ų38.831%0.31420%0.204SC..Hα-helixtrans-63.3-40.1178.6179.560.8000111.4F138 F266 Y267 L272 V273F138-L269 HydrophobicContact CD2-CB 4.21Å; F138-L269 HydrophobicContact CE1-CD1 4.43Å; F138-L269 HydrophobicContact CE2-CB 3.8Å; F138-L269 HydrophobicContact CE2-CD1 3.97Å; F138-L269 HydrophobicContact CE2-CD2 4.4Å; F138-L269 HydrophobicContact CE2-CG 4.27Å; F138-L269 HydrophobicContact CZ-CB 4.49Å; F138-L269 HydrophobicContact CZ-CD1 3.79Å; F138-L269 HydrophobicContact CZ-CG 4.5Å; F266-L269 HydrophobicContact CD1-CD2 4.31Å; F266-L269 VanDerWaalsContact O-CB 3.32Å; F266-L269 WeakPolarHBondContact O-CB 3.35Å; F266-L269 PolarHBondContact O-N 3.35Å; F266-L269 VanDerWaalsContact O-N 3.07Å; Y267-L269 VanDerWaalsContact C-N 3.28Å; Y267-L269 PolarHBondContact O-N 3.37Å; L269-L272 HydrophobicContact CD1-CD2 4.4Å; L269-L272 PolarHBondContact O-N 3.45Å; L269-V273 HydrophobicContact CD1-CG2 4.13Å; L269-V273 WeakPolarHBondContact O-CG2 3.38Å; L269-V273 PolarHBondContact O-N 3.38Å
270V90.7Very high87.2Confident41 Ų4141.7 Ų41.725%0.24822%0.224CC..Hα-helixtrans-61.4-49179178.80000110I262 Y267 T268 V273 S274I262-V270 HydrophobicContact CD1-CG2 4.05Å; Y267-V270 PolarHBondContact O-N 3.27Å; T268-V270 VanDerWaalsContact C-N 3.31Å; T268-V270 PolarHBondContact O-N 2.96Å; V270-V273 PolarHBondContact O-N 2.85Å; V270-S274 WeakPolarHBondContact O-CB 3.36Å; V270-S274 PolarHBondContact O-N 2.95Å; V270-S274 PolarHBondContact O-OG 2.83Å; V270-S274 VanDerWaalsContact O-OG 3.08Å
271Y92Very high87.9Confident3 Ų342.7 Ų42.71%0.01223%0.229CC..Hα-helixtrans-67.2-40.6178.6-64.2-72.6000112.3I33 A37 D40 L98 I101 Y267 T268 V273 S274 H275I33-Y271 HydrophobicContact CG2-CE1 4.41Å; A37-Y271 WeakPolarHBondContact CA-OH 3.49Å; A37-Y271 HydrophobicContact CB-CE1 4.35Å; A37-Y271 PolarHBondContact N-OH 3.16Å; D40-Y271 PolarHBondContact OD2-OH 3.02Å; L98-Y271 HydrophobicContact CD2-CE1 4.47Å; L98-Y271 HydrophobicContact CD2-CE2 3.83Å; I101-Y271 HydrophobicContact CD1-CD1 3.8Å; I101-Y271 HydrophobicContact CD1-CD2 4.36Å; I101-Y271 HydrophobicContact CD1-CE1 4.34Å; I101-Y271 HydrophobicContact CD1-CG 3.82Å; I101-Y271 HydrophobicContact CG2-CD1 4.11Å; I101-Y271 HydrophobicContact CG2-CE1 4.18Å; Y267-Y271 HydrophobicContact CD2-CD2 4.11Å; Y267-Y271 HydrophobicContact CD2-CE2 4.03Å; Y267-Y271 WeakPolarHBondContact O-CD2 3.42Å; T268-Y271 PolarHBondContact O-N 2.9Å; Y271-V273 PolarHBondContact O-N 3.25Å; Y271-S274 PolarHBondContact O-N 3.39Å; Y271-H275 WeakPolarHBondContact O-CB 3.37Å; Y271-H275 PolarHBondContact O-N 3.5Å; Y271-H275 PolarHBondContact O-ND1 2.97Å
272L92.5Very high88.7Confident18 Ų1841.5 Ų41.59%0.09422%0.217CC..Hα-helixtrans-54.7-51.2174.6-176.875.3000111.3L131 D134 T135 F138 T268 L269 H275 I276L131-L272 HydrophobicContact CD1-CD1 3.6Å; L131-L272 HydrophobicContact CD1-CG 4.43Å; L131-L272 HydrophobicContact CG-CD1 4.4Å; D134-L272 HydrophobicContact CB-CB 4.25Å; D134-L272 HydrophobicContact CB-CD1 3.81Å; T135-L272 VanDerWaalsContact OG1-CD1 3.28Å; T135-L272 WeakPolarHBondContact OG1-CD1 3.33Å; F138-L272 HydrophobicContact CD1-CD2 4.22Å; T268-L272 VanDerWaalsContact O-CB 3.23Å; T268-L272 WeakPolarHBondContact O-CB 3.32Å; T268-L272 PolarHBondContact O-N 2.94Å; L269-L272 HydrophobicContact CD1-CD2 4.4Å; L269-L272 PolarHBondContact O-N 3.45Å; L272-H275 PolarHBondContact O-N 3.45Å; L272-I276 HydrophobicContact CG-CD1 4.22Å; L272-I276 VanDerWaalsContact O-CG1 3.31Å; L272-I276 WeakPolarHBondContact O-CG1 3.42Å; L272-I276 PolarHBondContact O-N 3.06Å
273V93.6Very high89.4Confident68 Ų6842.9 Ų42.941%0.41223%0.227SC..Hα-helixtrans-63.4-44.7178.61720000110.7L269 V270 Y271 H275 I276 I277L269-V273 HydrophobicContact CD1-CG2 4.13Å; L269-V273 WeakPolarHBondContact O-CG2 3.38Å; L269-V273 PolarHBondContact O-N 3.38Å; V270-V273 PolarHBondContact O-N 2.85Å; Y271-V273 PolarHBondContact O-N 3.25Å; V273-H275 VanDerWaalsContact C-N 3.32Å; V273-H275 PolarHBondContact O-N 3.45Å; V273-I276 PolarHBondContact O-N 3.34Å; V273-I277 HydrophobicContact CG1-CD1 3.76Å; V273-I277 HydrophobicContact CG1-CG1 4.44Å; V273-I277 VanDerWaalsContact O-CG1 3.29Å; V273-I277 WeakPolarHBondContact O-CG1 3.43Å; V273-I277 PolarHBondContact O-N 2.96Å
274S93.2Very high90.2Very high13 Ų1343.3 Ų43.39%0.09123%0.227CC..Hα-helixtrans-60.5-39.8176.9-65.40000112.8V270 Y271 T278V270-S274 WeakPolarHBondContact O-CB 3.36Å; V270-S274 PolarHBondContact O-N 2.95Å; V270-S274 PolarHBondContact O-OG 2.83Å; V270-S274 VanDerWaalsContact O-OG 3.08Å; Y271-S274 PolarHBondContact O-N 3.39Å; S274-T278 WeakPolarHBondContact O-CB 3.45Å; S274-T278 PolarHBondContact O-N 3.02Å; S274-T278 PolarHBondContact O-OG1 3.43Å
275H93.7Very high91Very high2 Ų243 Ų431%0.00923%0.226CC..Hα-helixtrans-67.6-44.6176.6-65.6153.1000111.7L127 L131 D134 Y271 L272 V273 I277 T278 I279L127-H275 HydrophobicContact CD1-CB 4.19Å; L127-H275 WeakPolarHBondContact CD1-CD2 3.31Å; L131-H275 HydrophobicContact CD1-CB 3.82Å; D134-H275 IonicContact OD2-CE1 2.65Å; D134-H275 PolarHBondContact OD2-CE1 3.47Å; D134-H275 IonicContact OD2-CG 2.65Å; D134-H275 IonicContact OD2-ND1 3.39Å; D134-H275 PolarHBondContact OD2-ND1 2.95Å; Y271-H275 WeakPolarHBondContact O-CB 3.37Å; Y271-H275 PolarHBondContact O-N 3.5Å; Y271-H275 PolarHBondContact O-ND1 2.97Å; L272-H275 PolarHBondContact O-N 3.45Å; V273-H275 VanDerWaalsContact C-N 3.32Å; V273-H275 PolarHBondContact O-N 3.45Å; H275-I277 VanDerWaalsContact C-N 3.35Å; H275-I277 PolarHBondContact O-N 3.07Å; H275-T278 PolarHBondContact O-N 3.29Å; H275-I279 WeakPolarHBondContact O-CB 3.22Å; H275-I279 VanDerWaalsContact O-CG1 3.25Å; H275-I279 WeakPolarHBondContact O-CG1 3.41Å; H275-I279 PolarHBondContact O-N 3.04Å
276I95Very high91.7Very high79 Ų7940.6 Ų40.641%0.40522%0.223SC..Hα-helixtrans-57.5-47.9175.8-69.5169.9000110.9L131 L272 V273 S280L131-I276 HydrophobicContact CD1-CD1 4.36Å; L131-I276 HydrophobicContact CD1-CG1 3.56Å; L131-I276 HydrophobicContact CD2-CG1 4.46Å; L272-I276 HydrophobicContact CG-CD1 4.22Å; L272-I276 VanDerWaalsContact O-CG1 3.31Å; L272-I276 WeakPolarHBondContact O-CG1 3.42Å; L272-I276 PolarHBondContact O-N 3.06Å; V273-I276 PolarHBondContact O-N 3.34Å; I276-S280 VanDerWaalsContact O-CB 3.31Å; I276-S280 WeakPolarHBondContact O-CB 3.37Å; I276-S280 PolarHBondContact O-N 2.65Å; I276-S280 PolarHBondContact O-OG 3.06Å
277I95.9Very high92.2Very high75 Ų7539 Ų3939%0.38522%0.223SC..Hα-helixtrans-63.7-47-179.8-64.2167.5000109.8I29 V273 H275 I279 S280 L281I29-I277 HydrophobicContact CD1-CG2 3.52Å; V273-I277 HydrophobicContact CG1-CD1 3.76Å; V273-I277 HydrophobicContact CG1-CG1 4.44Å; V273-I277 VanDerWaalsContact O-CG1 3.29Å; V273-I277 WeakPolarHBondContact O-CG1 3.43Å; V273-I277 PolarHBondContact O-N 2.96Å; H275-I277 VanDerWaalsContact C-N 3.35Å; H275-I277 PolarHBondContact O-N 3.07Å; I277-I279 PolarHBondContact O-N 3.47Å; I277-S280 PolarHBondContact O-N 2.98Å; I277-L281 HydrophobicContact CG2-CD1 3.94Å; I277-L281 HydrophobicContact CG2-CG 4.24Å; I277-L281 VanDerWaalsContact O-CG 3.31Å; I277-L281 WeakPolarHBondContact O-CG 3.47Å; I277-L281 PolarHBondContact O-N 3.35Å
278T93.5Very high92.5Very high1 Ų140.1 Ų40.11%0.00623%0.229CC..Hα-helixtrans-60.9-44.9-179-57.30000111.9I26 I29 M124 L127 S274 H275 Y282I26-T278 HydrophobicContact CG2-CG2 4.29Å; I29-T278 WeakPolarHBondContact CG2-OG1 3.28Å; M124-T278 HydrophobicContact CE-CG2 4.48Å; L127-T278 HydrophobicContact CD2-CG2 3.77Å; S274-T278 WeakPolarHBondContact O-CB 3.45Å; S274-T278 PolarHBondContact O-N 3.02Å; S274-T278 PolarHBondContact O-OG1 3.43Å; H275-T278 PolarHBondContact O-N 3.29Å; T278-Y282 WeakPolarHBondContact O-CB 3.28Å; T278-Y282 PolarHBondContact O-N 3.49Å
279I92.8Very high92.7Very high28 Ų2842.9 Ų42.914%0.14424%0.243CC..Hα-helixtrans-61.9-46.2175.5-68.7165.5000110.2L127 I128 L131 H275 I277 L281 Y282 V283L127-I279 HydrophobicContact CD2-CD1 4.32Å; L127-I279 HydrophobicContact CD2-CG1 3.57Å; L127-I279 HydrophobicContact CG-CD1 4.06Å; L127-I279 HydrophobicContact CG-CG1 3.86Å; I128-I279 HydrophobicContact CG1-CD1 4.12Å; L131-I279 HydrophobicContact CB-CD1 4.26Å; L131-I279 HydrophobicContact CD2-CD1 3.86Å; H275-I279 WeakPolarHBondContact O-CB 3.22Å; H275-I279 VanDerWaalsContact O-CG1 3.25Å; H275-I279 WeakPolarHBondContact O-CG1 3.41Å; H275-I279 PolarHBondContact O-N 3.04Å; I277-I279 PolarHBondContact O-N 3.47Å; I279-L281 PolarHBondContact O-N 3.13Å; I279-Y282 PolarHBondContact O-N 3.12Å; I279-V283 HydrophobicContact CG2-CG2 4.31Å; I279-V283 WeakPolarHBondContact O-CG2 3.33Å; I279-V283 PolarHBondContact O-N 3.37Å
280S94.6Very high92.7Very high61 Ų6146.2 Ų46.243%0.42726%0.255SS..Hα-helixtrans-60.2-47.6-179.2-59.40000111.8I276 I277 Y282 V283 V284I276-S280 VanDerWaalsContact O-CB 3.31Å; I276-S280 WeakPolarHBondContact O-CB 3.37Å; I276-S280 PolarHBondContact O-N 2.65Å; I276-S280 PolarHBondContact O-OG 3.06Å; I277-S280 PolarHBondContact O-N 2.98Å; S280-Y282 VanDerWaalsContact C-N 3.3Å; S280-Y282 PolarHBondContact O-N 3.26Å; S280-V283 PolarHBondContact O-N 3.01Å; S280-V284 WeakPolarHBondContact O-CG2 3.41Å; S280-V284 PolarHBondContact O-N 3.05Å
281L94.7Very high92.7Very high30 Ų3048 Ų4816%0.15726%0.261CS..Hα-helixtrans-61.5-39.6176.7-66.3175.6000111.8L22 M25 I26 I29 I277 I279 V284 K285L22-L281 HydrophobicContact CD2-CD2 3.77Å; M25-L281 HydrophobicContact CB-CD1 3.94Å; M25-L281 HydrophobicContact CE-CD2 3.98Å; I26-L281 HydrophobicContact CD1-CB 4.08Å; I26-L281 HydrophobicContact CG1-CB 3.7Å; I26-L281 HydrophobicContact CG1-CD1 4.12Å; I29-L281 HydrophobicContact CD1-CD1 3.59Å; I277-L281 HydrophobicContact CG2-CD1 3.94Å; I277-L281 HydrophobicContact CG2-CG 4.24Å; I277-L281 VanDerWaalsContact O-CG 3.31Å; I277-L281 WeakPolarHBondContact O-CG 3.47Å; I277-L281 PolarHBondContact O-N 3.35Å; I279-L281 PolarHBondContact O-N 3.13Å; L281-V284 PolarHBondContact O-N 3.48Å; L281-K285 WeakPolarHBondContact O-CB 3.09Å; L281-K285 PolarHBondContact O-N 3.36Å
282Y91.7Very high92.6Very high27 Ų2750.2 Ų50.211%0.10627%0.271CS..Hα-helixtrans-67.1-41.2177.8-177-93.3000113M120 K121 M124 T278 I279 S280 K285 T286M120-Y282 HydrophobicContact CB-CE2 3.96Å; M120-Y282 HydrophobicContact CE-CD2 4.19Å; M120-Y282 HydrophobicContact CE-CE2 4Å; K121-Y282 WeakPolarHBondContact CG-OH 3.41Å; M124-Y282 HydrophobicContact CB-CE1 4.41Å; M124-Y282 VanDerWaalsContact CE-CB 3.44Å; M124-Y282 HydrophobicContact CE-CD1 3.92Å; M124-Y282 HydrophobicContact CE-CD2 3.47Å; M124-Y282 VanDerWaalsContact CE-CD2 3.47Å; M124-Y282 HydrophobicContact CE-CE2 4.15Å; M124-Y282 HydrophobicContact CE-CG 3.3Å; M124-Y282 HydrophobicContact CG-CD1 3.58Å; M124-Y282 HydrophobicContact CG-CD2 4.26Å; M124-Y282 HydrophobicContact CG-CE1 3.5Å; M124-Y282 HydrophobicContact CG-CE2 4.18Å; M124-Y282 HydrophobicContact CG-CG 3.95Å; M124-Y282 HydrophobicContact SD-CD1 3.49Å; M124-Y282 WeakPolarHBondContact SD-CD1 3.44Å; M124-Y282 HydrophobicContact SD-CD2 4.19Å; M124-Y282 HydrophobicContact SD-CE1 4.09Å; M124-Y282 HydrophobicContact SD-CG 3.53Å; M124-Y282 VanDerWaalsContact SD-CG 3.53Å; T278-Y282 WeakPolarHBondContact O-CB 3.28Å; T278-Y282 PolarHBondContact O-N 3.49Å; I279-Y282 PolarHBondContact O-N 3.12Å; S280-Y282 VanDerWaalsContact C-N 3.3Å; S280-Y282 PolarHBondContact O-N 3.26Å; Y282-K285 PolarHBondContact O-N 3.44Å; Y282-T286 WeakPolarHBondContact CE1-OG1 3.06Å; Y282-T286 WeakPolarHBondContact O-CB 3.41Å; Y282-T286 PolarHBondContact O-N 2.99Å; Y282-T286 PolarHBondContact O-OG1 3.3Å
283V92.6Very high92.5Very high79 Ų7952.6 Ų52.648%0.47929%0.289SS..Hα-helixtrans-61.6-47.7175.7170.70000110.1I279 S280 K285 T286 T287I279-V283 HydrophobicContact CG2-CG2 4.31Å; I279-V283 WeakPolarHBondContact O-CG2 3.33Å; I279-V283 PolarHBondContact O-N 3.37Å; S280-V283 PolarHBondContact O-N 3.01Å; V283-K285 PolarHBondContact O-N 3.33Å; V283-T286 PolarHBondContact O-N 3.41Å; V283-T287 PolarHBondContact O-N 3.08Å; V283-T287 PolarHBondContact O-OG1 3.29Å
284V94.8Very high92.4Very high73 Ų7354.1 Ų54.144%0.44229%0.291SS..Hα-helixtrans-58.8-47.9176.5175.40000110.8L22 S280 L281 T286 T287 L288L22-V284 HydrophobicContact CD1-CG1 3.89Å; L22-V284 HydrophobicContact CD2-CG1 4.37Å; S280-V284 WeakPolarHBondContact O-CG2 3.41Å; S280-V284 PolarHBondContact O-N 3.05Å; L281-V284 PolarHBondContact O-N 3.48Å; V284-T286 VanDerWaalsContact C-N 3.31Å; V284-T286 PolarHBondContact O-N 2.87Å; V284-T287 PolarHBondContact O-N 3.49Å; V284-L288 HydrophobicContact CG1-CD1 4.13Å; V284-L288 HydrophobicContact CG1-CG 4.41Å; V284-L288 WeakPolarHBondContact O-CG 3.45Å; V284-L288 PolarHBondContact O-N 3.17Å
285K91.1Very high92.2Very high18 Ų1855.4 Ų55.48%0.07830%0.297CS..Hα-helixtrans-55.1-46.6176.3-179.1-167.6173.7-176.60111.6I19 L22 E23 I26 L281 Y282 V283 L288 L289I19-K285 HydrophobicContact CG2-CG 4.44Å; L22-K285 HydrophobicContact CB-CB 4.35Å; L22-K285 HydrophobicContact CD1-CB 4.2Å; E23-K285 HydrophobicContact CG-CD 4.03Å; E23-K285 VanDerWaalsContact CG-CE 3.5Å; E23-K285 VanDerWaalsContact CG-NZ 3.32Å; E23-K285 WeakPolarHBondContact OE1-CE 3.48Å; E23-K285 IonicContact OE1-NZ 3.2Å; E23-K285 PolarHBondContact OE1-NZ 3.38Å; I26-K285 HydrophobicContact CD1-CD 4.38Å; L281-K285 WeakPolarHBondContact O-CB 3.09Å; L281-K285 PolarHBondContact O-N 3.36Å; Y282-K285 PolarHBondContact O-N 3.44Å; V283-K285 PolarHBondContact O-N 3.33Å; K285-L288 PolarHBondContact O-N 2.98Å; K285-L289 HydrophobicContact CG-CD1 4.12Å; K285-L289 WeakPolarHBondContact O-CB 3.49Å; K285-L289 WeakPolarHBondContact O-CG 3.31Å; K285-L289 PolarHBondContact O-N 3.4Å
286T89.8Confident91.9Very high55 Ų5559.3 Ų59.334%0.33732%0.317SS..Hα-helixtrans-66.4-40.3-177.6-56.70000111.5Y282 V283 V284 L289 K290Y282-T286 WeakPolarHBondContact CE1-OG1 3.06Å; Y282-T286 WeakPolarHBondContact O-CB 3.41Å; Y282-T286 PolarHBondContact O-N 2.99Å; Y282-T286 PolarHBondContact O-OG1 3.3Å; V283-T286 PolarHBondContact O-N 3.41Å; V284-T286 VanDerWaalsContact C-N 3.31Å; V284-T286 PolarHBondContact O-N 2.87Å; T286-L289 PolarHBondContact O-N 3.06Å; T286-K290 WeakPolarHBondContact O-CB 3.38Å; T286-K290 PolarHBondContact O-N 3.47Å
287T92Very high91.7Very high85 Ų8561.2 Ų61.252%0.52132%0.323SS..Hα-helixtrans-64.1-43.7175-61.10000111.9V283 V284 K290 Q291V283-T287 PolarHBondContact O-N 3.08Å; V283-T287 PolarHBondContact O-OG1 3.29Å; V284-T287 PolarHBondContact O-N 3.49Å; T287-K290 PolarHBondContact O-N 2.95Å; T287-Q291 WeakPolarHBondContact O-CB 3.26Å; T287-Q291 PolarHBondContact O-N 3.41Å
288L92.6Very high91.2Very high26 Ų2660.9 Ų60.914%0.13632%0.322CS..Hα-helixtrans-64.1-40.7176.6-67.5177.6000111.9L18 I19 L22 V284 K285 K290 Q291 K292L18-L288 HydrophobicContact CB-CD1 4.17Å; I19-L288 HydrophobicContact CD1-CB 4.42Å; I19-L288 HydrophobicContact CG1-CB 4.06Å; L22-L288 HydrophobicContact CD1-CD1 3.62Å; V284-L288 HydrophobicContact CG1-CD1 4.13Å; V284-L288 HydrophobicContact CG1-CG 4.41Å; V284-L288 WeakPolarHBondContact O-CG 3.45Å; V284-L288 PolarHBondContact O-N 3.17Å; K285-L288 PolarHBondContact O-N 2.98Å; L288-K290 VanDerWaalsContact C-N 3.35Å; L288-Q291 PolarHBondContact O-N 2.96Å; L288-K292 VanDerWaalsContact O-CB 3.31Å; L288-K292 WeakPolarHBondContact O-CB 3.49Å; L288-K292 PolarHBondContact O-N 2.93Å
289L89.7Confident90.8Very high59 Ų5965.6 Ų65.631%0.30934%0.34SS..Hα-helixtrans-61.8-42.9174.7-79.7169.1000111.9I19 K285 T286 K292 S293I19-L289 HydrophobicContact CD1-CD2 3.8Å; I19-L289 HydrophobicContact CD1-CG 4.12Å; I19-L289 HydrophobicContact CG1-CG 4.5Å; I19-L289 HydrophobicContact CG2-CD2 4.25Å; I19-L289 HydrophobicContact CG2-CG 4.45Å; K285-L289 HydrophobicContact CG-CD1 4.12Å; K285-L289 WeakPolarHBondContact O-CB 3.49Å; K285-L289 WeakPolarHBondContact O-CG 3.31Å; K285-L289 PolarHBondContact O-N 3.4Å; T286-L289 PolarHBondContact O-N 3.06Å; L289-K292 PolarHBondContact O-N 3.11Å; L289-S293 PolarHBondContact O-N 2.98Å
290K90.6Very high90.3Very high130 Ų13072.4 Ų72.457%0.56537%0.371SS*.Hα-helixtrans-61.1-50.5175.8-174-179.9176.4-1730111T286 T287 L288 K292 S293 E294T286-K290 WeakPolarHBondContact O-CB 3.38Å; T286-K290 PolarHBondContact O-N 3.47Å; T287-K290 PolarHBondContact O-N 2.95Å; L288-K290 VanDerWaalsContact C-N 3.35Å; K290-K292 VanDerWaalsContact C-N 3.31Å; K290-K292 PolarHBondContact O-N 3.42Å; K290-S293 PolarHBondContact O-N 3.19Å; K290-S293 VanDerWaalsContact O-N 3.09Å; K290-S293 PolarHBondContact O-OG 2.91Å; K290-E294 WeakPolarHBondContact CE-OE1 3.37Å; K290-E294 IonicContact NZ-OE1 3.97Å; K290-E294 WeakPolarHBondContact O-CG 3.39Å; K290-E294 PolarHBondContact O-N 3.48Å
291Q91.4Very high90Very high77 Ų7773.6 Ų73.636%0.3637%0.37SS..Hα-helixtrans-58.5-42.9177.4-177179.83.400111.9W11 T287 L288 S293 E294 I295W11-Q291 HydrophobicContact CZ2-CG 4.39Å; T287-Q291 WeakPolarHBondContact O-CB 3.26Å; T287-Q291 PolarHBondContact O-N 3.41Å; L288-Q291 PolarHBondContact O-N 2.96Å; Q291-S293 VanDerWaalsContact C-N 3.34Å; Q291-S293 PolarHBondContact O-N 2.84Å; Q291-E294 PolarHBondContact O-N 3.46Å; Q291-I295 HydrophobicContact CG-CD1 3.89Å; Q291-I295 PolarHBondContact O-N 2.75Å; Q291-I295 VanDerWaalsContact O-N 3.12Å
292K89.8Confident89.2Confident51 Ų5173.8 Ų73.822%0.22238%0.378CS..Hα-helixtrans-58.8-43.9174.6-176.4176.5173.4175.90111.8L12 T16 I19 L288 L289 K290 L296L12-K292 HydrophobicContact CD1-CD 4.33Å; L12-K292 HydrophobicContact CD1-CG 4.13Å; T16-K292 PolarHBondContact OG1-NZ 3.18Å; I19-K292 HydrophobicContact CD1-CD 3.96Å; L288-K292 VanDerWaalsContact O-CB 3.31Å; L288-K292 WeakPolarHBondContact O-CB 3.49Å; L288-K292 PolarHBondContact O-N 2.93Å; L289-K292 PolarHBondContact O-N 3.11Å; K290-K292 VanDerWaalsContact C-N 3.31Å; K290-K292 PolarHBondContact O-N 3.42Å; K292-L296 VanDerWaalsContact O-CB 3.26Å; K292-L296 WeakPolarHBondContact O-CB 3.44Å; K292-L296 PolarHBondContact O-N 2.94Å
293S90.4Very high88.4Confident68 Ų6879.2 Ų79.248%0.47640%0.403SS..Hα-helixtrans-67.1-4218073.20000113.1L289 K290 Q291 L296 F297L289-S293 PolarHBondContact O-N 2.98Å; K290-S293 PolarHBondContact O-N 3.19Å; K290-S293 VanDerWaalsContact O-N 3.09Å; K290-S293 PolarHBondContact O-OG 2.91Å; Q291-S293 VanDerWaalsContact C-N 3.34Å; Q291-S293 PolarHBondContact O-N 2.84Å; S293-L296 PolarHBondContact O-N 2.99Å; S293-F297 WeakPolarHBondContact O-CB 3.38Å; S293-F297 PolarHBondContact O-N 3.38Å
294E90.7Very high87.1Confident99 Ų9979.2 Ų79.246%0.46340%0.4SS..Hα-helixtrans-66.4-43.6-179.6-72174.817100111.4K290 Q291 F297 L298K290-E294 WeakPolarHBondContact CE-OE1 3.37Å; K290-E294 IonicContact NZ-OE1 3.97Å; K290-E294 WeakPolarHBondContact O-CG 3.39Å; K290-E294 PolarHBondContact O-N 3.48Å; Q291-E294 PolarHBondContact O-N 3.46Å; E294-F297 PolarHBondContact O-N 3.4Å; E294-L298 WeakPolarHBondContact O-CG 3.4Å; E294-L298 PolarHBondContact O-N 3.12Å
295I89.1Confident85.3Confident41 Ų4183.4 Ų83.421%0.2141%0.414CS..Hα-helixtrans-69.8-39179-72.3168.4000111.4F8 W11 Q291 F297 L298 Y299F8-I295 HydrophobicContact CD2-CG2 4.48Å; F8-I295 HydrophobicContact CE2-CG2 3.78Å; W11-I295 HydrophobicContact CE3-CG2 4.23Å; W11-I295 HydrophobicContact CH2-CB 3.71Å; W11-I295 HydrophobicContact CH2-CD1 3.36Å; W11-I295 HydrophobicContact CH2-CG1 4.1Å; W11-I295 HydrophobicContact CH2-CG2 3.71Å; W11-I295 HydrophobicContact CZ2-CD1 3.27Å; W11-I295 HydrophobicContact CZ2-CG1 4.45Å; W11-I295 HydrophobicContact CZ2-CG2 4.48Å; W11-I295 HydrophobicContact CZ3-CB 4.03Å; W11-I295 HydrophobicContact CZ3-CD1 4.28Å; W11-I295 HydrophobicContact CZ3-CG2 3.56Å; Q291-I295 HydrophobicContact CG-CD1 3.89Å; Q291-I295 PolarHBondContact O-N 2.75Å; Q291-I295 VanDerWaalsContact O-N 3.12Å; I295-F297 VanDerWaalsContact C-N 3.3Å; I295-F297 PolarHBondContact O-N 3.45Å; I295-L298 PolarHBondContact O-N 3.47Å; I295-Y299 WeakPolarHBondContact O-CB 3.38Å; I295-Y299 PolarHBondContact O-N 2.69Å
296L87.6Confident83.4Confident83 Ų8384.8 Ų84.844%0.43542%0.424SS..Hα-helixtrans-63.6-38.4175.8-17266.8000111.5F8 K292 S293 Y299 H300F8-L296 HydrophobicContact CZ-CD1 4.06Å; K292-L296 VanDerWaalsContact O-CB 3.26Å; K292-L296 WeakPolarHBondContact O-CB 3.44Å; K292-L296 PolarHBondContact O-N 2.94Å; S293-L296 PolarHBondContact O-N 2.99Å; L296-Y299 PolarHBondContact O-N 3.38Å; L296-H300 WeakPolarHBondContact O-CB 3.43Å; L296-H300 PolarHBondContact O-N 3.37Å
297F90.5Very high81.3Confident120 Ų12089.7 Ų89.753%0.52645%0.449SS..Hα-helixtrans-63.4-49.2174.4179.5-97.7000111.9S293 E294 I295 Y299 H300 E301S293-F297 WeakPolarHBondContact O-CB 3.38Å; S293-F297 PolarHBondContact O-N 3.38Å; E294-F297 PolarHBondContact O-N 3.4Å; I295-F297 VanDerWaalsContact C-N 3.3Å; I295-F297 PolarHBondContact O-N 3.45Å; F297-Y299 VanDerWaalsContact C-N 3.3Å; F297-Y299 PolarHBondContact O-N 3.12Å; F297-H300 PolarHBondContact O-N 3.31Å; F297-E301 HydrophobicContact CD1-CG 4.43Å; F297-E301 HydrophobicContact CE1-CG 4Å; F297-E301 WeakPolarHBondContact CE1-OE1 3.37Å; F297-E301 WeakPolarHBondContact CE1-OE2 3.37Å; F297-E301 HydrophobicContact CE2-CG 4.34Å; F297-E301 HydrophobicContact CZ-CG 3.96Å; F297-E301 WeakPolarHBondContact CZ-OE1 3.28Å; F297-E301 PolarHBondContact O-N 3.29Å
298L86.3Confident79.1Confident68 Ų6892.3 Ų92.336%0.35646%0.46SS..Hα-helixtrans-63.2-34.6178-69.2171.9000113.2E294 I295 G302 K303 L304E294-L298 WeakPolarHBondContact O-CG 3.4Å; E294-L298 PolarHBondContact O-N 3.12Å; I295-L298 PolarHBondContact O-N 3.47Å; L298-G302 PolarHBondContact O-N 3.09Å; L298-K303 HydrophobicContact CD2-CB 4.27Å; L298-K303 HydrophobicContact CD2-CD 4.07Å; L298-K303 PolarHBondContact O-N 3.42Å; L298-K303 VanDerWaalsContact O-N 3.07Å; L298-L304 HydrophobicContact CB-CD1 3.58Å; L298-L304 HydrophobicContact CD1-CD1 4.4Å; L298-L304 PolarHBondContact O-N 3.05Å
299Y83.3Confident76.6Confident99 Ų9999 Ų9939%0.38849%0.49SS..Hα-helixtrans-66.8-43.3173.9-177-97.1000111.6F8 I295 L296 F297 G302F8-Y299 HydrophobicContact CB-CE2 4.37Å; F8-Y299 HydrophobicContact CD1-CD1 4.42Å; F8-Y299 HydrophobicContact CD1-CD2 4.18Å; F8-Y299 HydrophobicContact CD1-CE1 4.25Å; F8-Y299 HydrophobicContact CD1-CE2 4Å; F8-Y299 HydrophobicContact CD1-CG 4.38Å; F8-Y299 AromaticContact CD2-CD2 3.76Å; F8-Y299 HydrophobicContact CD2-CD2 3.76Å; F8-Y299 HydrophobicContact CD2-CE2 4.21Å; F8-Y299 HydrophobicContact CD2-CG 4.16Å; F8-Y299 AromaticContact CE1-CD1 3.81Å; F8-Y299 HydrophobicContact CE1-CD1 3.81Å; F8-Y299 HydrophobicContact CE1-CD2 4.2Å; F8-Y299 AromaticContact CE1-CE1 3.96Å; F8-Y299 HydrophobicContact CE1-CE1 3.96Å; F8-Y299 HydrophobicContact CE1-CE2 4.33Å; F8-Y299 AromaticContact CE1-CG 3.94Å; F8-Y299 HydrophobicContact CE1-CG 3.94Å; F8-Y299 HydrophobicContact CE2-CD1 4.35Å; F8-Y299 AromaticContact CE2-CD2 3.76Å; F8-Y299 HydrophobicContact CE2-CD2 3.76Å; F8-Y299 AromaticContact CE2-CG 3.67Å; F8-Y299 HydrophobicContact CE2-CG 3.67Å; F8-Y299 AromaticContact CG-CD2 3.96Å; F8-Y299 HydrophobicContact CG-CD2 3.96Å; F8-Y299 AromaticContact CG-CE2 3.94Å; F8-Y299 HydrophobicContact CG-CE2 3.94Å; F8-Y299 HydrophobicContact CG-CG 4.48Å; F8-Y299 AromaticContact CZ-CD1 3.78Å; F8-Y299 HydrophobicContact CZ-CD1 3.78Å; F8-Y299 AromaticContact CZ-CD2 4Å; F8-Y299 HydrophobicContact CZ-CD2 4Å; F8-Y299 HydrophobicContact CZ-CE1 4.38Å; F8-Y299 AromaticContact CZ-CG 3.55Å; F8-Y299 HydrophobicContact CZ-CG 3.55Å; I295-Y299 WeakPolarHBondContact O-CB 3.38Å; I295-Y299 PolarHBondContact O-N 2.69Å; L296-Y299 PolarHBondContact O-N 3.38Å; F297-Y299 VanDerWaalsContact C-N 3.3Å; F297-Y299 PolarHBondContact O-N 3.12Å; Y299-G302 PolarHBondContact O-N 2.94Å; Y299-G302 VanDerWaalsContact O-N 3.15Å
300H83.7Confident74.2Confident171 Ų171104 Ų10479%0.79252%0.517SS*.Hα-helixtrans-70.2-32.4178.7-168.4-70000113L296 F297 G302L296-H300 WeakPolarHBondContact O-CB 3.43Å; L296-H300 PolarHBondContact O-N 3.37Å; F297-H300 PolarHBondContact O-N 3.31Å; H300-G302 PolarHBondContact O-N 3.06Å
301E87.2Confident71.6Confident87 Ų87106.7 Ų106.741%0.40753%0.532SS..THydrogen-bonded Turntrans-72.4-5.4172.2-73.7-163.9145.800113.4F297 K303F297-E301 HydrophobicContact CD1-CG 4.43Å; F297-E301 HydrophobicContact CE1-CG 4Å; F297-E301 WeakPolarHBondContact CE1-OE1 3.37Å; F297-E301 WeakPolarHBondContact CE1-OE2 3.37Å; F297-E301 HydrophobicContact CE2-CG 4.34Å; F297-E301 HydrophobicContact CZ-CG 3.96Å; F297-E301 WeakPolarHBondContact CZ-OE1 3.28Å; F297-E301 PolarHBondContact O-N 3.29Å; E301-K303 HydrophobicContact CB-CD 4.4Å; E301-K303 HydrophobicContact CB-CG 4.18Å; E301-K303 PolarHBondContact O-N 3.46Å; E301-K303 IonicContact OE1-NZ 3.12Å; E301-K303 VanDerWaalsContact OE2-CD 3.3Å; E301-K303 WeakPolarHBondContact OE2-CD 3.3Å; E301-K303 WeakPolarHBondContact OE2-CE 3.15Å; E301-K303 IonicContact OE2-NZ 2.95Å; E301-K303 PolarHBondContact OE2-NZ 3.17Å
302G78.5Confident68.8Low33 Ų33110.5 Ų110.534%0.3455%0.553SS.*THydrogen-bonded Turntrans69.710.7-175.300000113.8L298 Y299 H300 L304 Q305L298-G302 PolarHBondContact O-N 3.09Å; Y299-G302 PolarHBondContact O-N 2.94Å; Y299-G302 VanDerWaalsContact O-N 3.15Å; H300-G302 PolarHBondContact O-N 3.06Å; G302-L304 VanDerWaalsContact C-N 3.31Å; G302-Q305 VanDerWaalsContact O-CG 3.28Å; G302-Q305 WeakPolarHBondContact O-CG 3.03Å
303K75.8Confident66Low142 Ų142113.9 Ų113.962%0.61758%0.581SS**  trans-74.1-21.4177.9-73.6-179.1-179.3157.40113L298 E301 Q305L298-K303 HydrophobicContact CD2-CB 4.27Å; L298-K303 HydrophobicContact CD2-CD 4.07Å; L298-K303 PolarHBondContact O-N 3.42Å; L298-K303 VanDerWaalsContact O-N 3.07Å; E301-K303 HydrophobicContact CB-CD 4.4Å; E301-K303 HydrophobicContact CB-CG 4.18Å; E301-K303 PolarHBondContact O-N 3.46Å; E301-K303 IonicContact OE1-NZ 3.12Å; E301-K303 VanDerWaalsContact OE2-CD 3.3Å; E301-K303 WeakPolarHBondContact OE2-CD 3.3Å; E301-K303 WeakPolarHBondContact OE2-CE 3.15Å; E301-K303 IonicContact OE2-NZ 2.95Å; E301-K303 PolarHBondContact OE2-NZ 3.17Å; K303-Q305 PolarHBondContact O-N 3.32Å
304L63.6Low63.2Low79 Ų79117.2 Ų117.241%0.41460%0.599SS.*SBendtrans-76.858.9162.9-102.997.5000109.9L298 G302L298-L304 HydrophobicContact CB-CD1 3.58Å; L298-L304 HydrophobicContact CD1-CD1 4.4Å; L298-L304 PolarHBondContact O-N 3.05Å; G302-L304 VanDerWaalsContact C-N 3.31Å
305Q57.2Low60.4Low160 Ų160119.8 Ų119.875%0.74862%0.616SS**  trans-80.6142.7172.5-101.3171.64.800110.7G302 K303 N307G302-Q305 VanDerWaalsContact O-CG 3.28Å; G302-Q305 WeakPolarHBondContact O-CG 3.03Å; K303-Q305 PolarHBondContact O-N 3.32Å; Q305-N307 PolarHBondContact O-N 3.43Å
306T52Low57.6Low47 Ų47126.5 Ų126.529%0.28865%0.646SS.*  trans-73.8118.1-173.254.50000110.4T4 N308T4-T306 HydrophobicContact CG2-CG2 3.52Å; T4-T306 WeakPolarHBondContact OG1-CG2 3.47Å; T306-N308 PolarHBondContact O-N 2.92Å
307N45.7Very low55Low159 Ų159129 Ų12985%0.8566%0.658SS**THydrogen-bonded Turntrans-66.833172.7-71.2-0.9000114.1Q305Q305-N307 PolarHBondContact O-N 3.43Å
308N45.5Very low52.3Low140 Ų140131.4 Ų131.475%0.74967%0.669SS**THydrogen-bonded Turntrans-112.16.3-177.2-88.346.2000113.8T306T306-N308 PolarHBondContact O-N 2.92Å
309E40.9Very low49.5Very low166 Ų166134.6 Ų134.678%0.77669%0.691SS**SBendtrans-90.9-12.8176.1-78.8-176.317300114.4E311E309-E311 PolarHBondContact O-N 3.37Å
310D38.7Very low47.2Very low165 Ų165136.6 Ų136.688%0.88271%0.709SS**THydrogen-bonded Turntrans-87.81.1-175.9-70.6-20.8000115.7
311E35.5Very low44.7Very low186 Ų186133.7 Ų133.787%0.86971%0.708SS**THydrogen-bonded Turntrans-113.90.6-175.8-122179.7-170.300116.3E309E309-E311 PolarHBondContact O-N 3.37Å
312I32.3Very low42Very low156 Ų156136.6 Ų136.680%0.873%0.726SS**SBendtrans-140.663.9-178.8-42.1176.8000111.9
313C31.2Very low39.9Very low122 Ų122142.8 Ų142.882%0.82475%0.751SS**  trans-160.967.4153.7-138.80000112.3
314T32Very low37.6Very low139 Ų139142 Ų14285%0.85375%0.754SS**SBendtrans-148.440.4160.4-17.20000112.6
315D31.4Very low36.3Very low153 Ų153145.2 Ų145.282%0.81877%0.772SS**  trans-144.183.5165.6-89.2-36.5000108
316H30.6Very low35.1Very low182 Ų182145.5 Ų145.584%0.84378%0.778SS**  trans176129.1141-100.2-53.2000112.3
317I33.8Very low34.1Very low134 Ų134150.1 Ų150.169%0.68780%0.801SS**  trans104.6105.5145.5-63.2158.1000116.8
318K32.5Very low33.3Very low171 Ų171148.4 Ų148.474%0.74379%0.792SS**  trans85.391142-72.1169.8-170.81780118.5D320K318-D320 PolarHBondContact O-N 3.5Å
319T27.8Very low32.5Very low135 Ų135147.7 Ų147.783%0.82879%0.788SS**  -26.6111116.930.60000111.9
320D35.2Very low32Very low141 Ų141145.9 Ų145.975%0.75478%0.784SS**  trans-158.5113.7136.4-93.6-32.1000110.1K318K318-D320 PolarHBondContact O-N 3.5Å
321S32.5Very low31.7Very low110 Ų110144.6 Ų144.677%0.76978%0.777SS**  trans48.9100.7144.8-63.10000120.1
322N29.9Very low31.4Very low148 Ų148142.1 Ų142.179%0.79177%0.77SS**  59.790.2111.4-14925.2000116.8
323N33Very low31.4Very low163 Ų163142.8 Ų142.887%0.87278%0.775SS**  trans-150.1120.1133.4-143.60.6000112.1
324N29.1Very low31.3Very low126 Ų126142.6 Ų142.667%0.67477%0.766SS**  trans-60.6136.6169.6-79.1-38.7000110.8
325N36.1Very low31.2Very low147 Ų147142.7 Ų142.779%0.78676%0.761SS**  trans149.491137.1-79-17.6000110.5
326N32.3Very low31Very low165 Ų165143.3 Ų143.388%0.88276%0.764SS**  -175.6119.4108-97.3-19.2000110.1
327N29.7Very low31Very low145 Ų145142.1 Ų142.178%0.77576%0.762SS**  trans-72.9154.7172.3-101.6-18.9000111.1
328N30.5Very low30.7Very low123 Ų123142.9 Ų142.966%0.65877%0.767SS**  trans93.8109.4145-69.6-9.2000119.9
329N28.5Very low30.6Very low124 Ų124140.7 Ų140.766%0.66376%0.763SS**  80.7103.8119.9-69.4-5.2000117.6
330N29.1Very low30.6Very low128 Ų128141.6 Ų141.668%0.68476%0.763SS**  143.7133.783.3-102.4-7.4000112
331N32Very low30.3Very low138 Ų138142 Ų14274%0.73876%0.763SS**  trans72.585.2148.5-66-7.1000118.9N333N331-N333 PolarHBondContact O-N 3.36Å
332N29.5Very low30.2Very low134 Ų134143.3 Ų143.372%0.71776%0.761SS**  8109.1110.2-78.1-13.7000115.6
333N33.2Very low30Very low171 Ų171145.3 Ų145.391%0.91477%0.766SS**  trans-126.876.5136.3-102.3-12.9000107.1N331N331-N333 PolarHBondContact O-N 3.36Å
334N29.4Very low29.8Very low118 Ų118146.4 Ų146.463%0.63177%0.766SS**  trans-74.5127.9168.6-98.2-15.5000109
335N28.1Very low29.6Very low140 Ų140145.3 Ų145.375%0.74977%0.768SS**  trans46.183.6131.8-56.9-15.3000117.3
336N28.9Very low29.1Very low167 Ų167147.1 Ų147.189%0.89377%0.774SS**  trans-122.758155.7-94.1-9.3000109.8
337I29.6Very low28.9Very low156 Ų156145.3 Ų145.380%0.877%0.765SS**  trans-142.581.9167.7-51.2176.6000106.8
338I28.4Very low28.8Very low151 Ų151144.5 Ų144.577%0.77477%0.765SS**SBendtrans-173126.7154.6-92.2145.4000107.7
339N29.4Very low28.8Very low124 Ų124144.8 Ų144.866%0.66377%0.767SS**  trans74.677.7162.8-59.8-11.6000119.5
340N28.3Very low28.8Very low155 Ų155143.6 Ų143.683%0.82977%0.768SS**  trans-11674.8139.9-92.1-10.3000108.5N342N340-N342 VanDerWaalsContact C-N 3.32Å; N340-N342 PolarHBondContact O-N 3.02Å
341I29.8Very low28.8Very low149 Ų149144.6 Ų144.676%0.76478%0.778SS**  trans-91.282.7158.5-61.8171.7000104.4E343I341-E343 PolarHBondContact O-N 3.45Å
342N29.3Very low28.6Very low137 Ų137148.8 Ų148.873%0.73378%0.784SS**  trans-78.3114.9168.2-94.5-11.9000107.7N340 Q344N340-N342 VanDerWaalsContact C-N 3.32Å; N340-N342 PolarHBondContact O-N 3.02Å; N342-Q344 VanDerWaalsContact C-N 3.35Å; N342-Q344 PolarHBondContact O-N 3Å
343E25.7Very low28.5Very low190 Ų190145.6 Ų145.689%0.88878%0.782SS**  trans-51.795.3160.6-67.3173.6143.600109.2I341 S345I341-E343 PolarHBondContact O-N 3.45Å; E343-S345 PolarHBondContact O-N 3.39Å
344Q29.2Very low28.4Very low186 Ų186146 Ų14687%0.86978%0.776SS**  trans-89.3100.1162.2-103.7-180-19.700108.4N342 M346N342-Q344 VanDerWaalsContact C-N 3.35Å; N342-Q344 PolarHBondContact O-N 3Å; Q344-M346 PolarHBondContact O-N 3.35Å
345S25Very low28.4Very low104 Ų104144 Ų14473%0.72778%0.784SS**  trans-33.5125.9169.855.30000113.5E343 N347E343-S345 PolarHBondContact O-N 3.39Å; S345-N347 PolarHBondContact O-N 3Å; S345-N347 VanDerWaalsContact O-N 3.08Å
346M25.7Very low28.4Very low184 Ų184146.6 Ų146.691%0.90678%0.784SS**  trans-54108.1162.6-75.7175165.600109.7Q344 T348Q344-M346 PolarHBondContact O-N 3.35Å; M346-T348 PolarHBondContact O-N 3.47Å
347N28.1Very low28.5Very low128 Ų128146.2 Ų146.268%0.68478%0.783SS**  trans-80.2106.9164.8-150.539.9000107.5S345 D349S345-N347 PolarHBondContact O-N 3Å; S345-N347 VanDerWaalsContact O-N 3.08Å; N347-D349 VanDerWaalsContact C-N 3.31Å; N347-D349 PolarHBondContact ND2-OD2 2.76Å; N347-D349 PolarHBondContact O-N 3Å
348T27.4Very low28.5Very low127 Ų127145.9 Ų145.978%0.77978%0.781SS**  trans-74.879.7176.348.30000109.7M346 S350M346-T348 PolarHBondContact O-N 3.47Å; T348-S350 PolarHBondContact O-N 3.46Å; T348-S350 VanDerWaalsContact O-N 3.14Å
349D29.9Very low28.6Very low130 Ų130144.8 Ų144.870%0.69578%0.781SS**  trans-82.993.5170.9-77-36.4000110.2N347N347-D349 VanDerWaalsContact C-N 3.31Å; N347-D349 PolarHBondContact ND2-OD2 2.76Å; N347-D349 PolarHBondContact O-N 3Å
350S28.1Very low28.5Very low99 Ų99147.5 Ų147.569%0.69279%0.787SS**  trans26.3103.4149.667.50000117.5T348 R352T348-S350 PolarHBondContact O-N 3.46Å; T348-S350 VanDerWaalsContact O-N 3.14Å; S350-R352 PolarHBondContact O-N 2.98Å
351V29.8Very low28.7Very low148 Ų148145.9 Ų145.990%0.89778%0.784SS**  trans-60.9100.4156.2177.40000108G353V351-G353 PolarHBondContact O-N 3.07Å
352R27.8Very low28.6Very low227 Ų227147.4 Ų147.486%0.85779%0.788SS**  trans-75.1105.7171-167178.4-85.4-175.5-5107.4S350 F354S350-R352 PolarHBondContact O-N 2.98Å; R352-F354 PolarHBondContact O-N 3.36Å
353G28.1Very low28.6Very low66 Ų66149.9 Ų149.968%0.6879%0.792SS**  trans-58.2122.5-178.700000112.1V351 G355V351-G353 PolarHBondContact O-N 3.07Å; G353-G355 PolarHBondContact O-N 3.26Å
354F31.1Very low28.9Very low179 Ų179145.7 Ų145.779%0.78578%0.784SS**  trans-82.396.4160.6-79.8-84.6000107.4R352 Y356R352-F354 PolarHBondContact O-N 3.36Å; F354-Y356 HydrophobicContact CB-CD2 4.39Å; F354-Y356 HydrophobicContact CB-CE2 4.02Å; F354-Y356 PolarHBondContact O-N 3.45Å
355G28.2Very low29Very low77 Ų77143.2 Ų143.279%0.79478%0.777SS**  trans-66.1111.2166.700000109G353G353-G355 PolarHBondContact O-N 3.26Å
356Y29.5Very low29.3Very low194 Ų194143 Ų14376%0.76178%0.775SS**  trans-97.3112.6161.1-75.8-84.6000107.3F354 I358F354-Y356 HydrophobicContact CB-CD2 4.39Å; F354-Y356 HydrophobicContact CB-CE2 4.02Å; F354-Y356 PolarHBondContact O-N 3.45Å; Y356-I358 VanDerWaalsContact C-N 3.33Å; Y356-I358 PolarHBondContact O-N 3.3Å
357D30.5Very low29.3Very low160 Ų160142.4 Ų142.486%0.85677%0.77SS**  trans-64.994.1167.4-76.1-38.5000108.5V359D357-V359 VanDerWaalsContact C-N 3.29Å; D357-V359 PolarHBondContact O-N 3.15Å
358I30Very low29.6Very low148 Ų148145.5 Ų145.576%0.75978%0.778SS**  trans-74.592.7167.8-59.7175.3000106.4Y356 K360Y356-I358 VanDerWaalsContact C-N 3.33Å; Y356-I358 PolarHBondContact O-N 3.3Å; I358-K360 PolarHBondContact O-N 2.92Å
359V29.7Very low29.9Very low128 Ų128153.8 Ų153.878%0.77680%0.797SS**  trans-58.5105165.9177.70000107.3D357D357-V359 VanDerWaalsContact C-N 3.29Å; D357-V359 PolarHBondContact O-N 3.15Å
360K28.2Very low29.9Very low182 Ų182155 Ų15579%0.79180%0.802SS**PPolyproline II helixtrans-60.3127.2174.5-80.3177.8176.81740108.9I358 H362I358-K360 PolarHBondContact O-N 2.92Å; K360-H362 PolarHBondContact O-N 3.18Å
361P30.8Very low30Very low120 Ų120157.9 Ų157.978%0.77981%0.807SS**PPolyproline II helixtrans-64.2135172.725.4-30.9000109.5K363P361-K363 PolarHBondContact O-N 3.46Å
362H29.1Very low30Very low182 Ų182158.4 Ų158.484%0.84380%0.803SS**PPolyproline II helixtrans-55.8118.6176.7-127.7-78.4000109.3K360 S364K360-H362 PolarHBondContact O-N 3.18Å; H362-S364 PolarHBondContact O-N 2.68Å
363K29.2Very low30.2Very low188 Ų188154.4 Ų154.482%0.81780%0.799SS**  trans-61.5101.6159-109.7178.4171.7-175.30106.4P361P361-K363 PolarHBondContact O-N 3.46Å
364S31.4Very low30.3Very low103 Ų103159.9 Ų159.972%0.7281%0.807SS**  trans-103108.5158.656.30000106.7H362 S366H362-S364 PolarHBondContact O-N 2.68Å; S364-S366 PolarHBondContact O-N 3.48Å
365D30.8Very low30.2Very low134 Ų134158.7 Ų158.772%0.71781%0.808SS**  trans-56.6117.1174.1-56-58.6000109.7
366S32.1Very low30.4Very low99 Ų99164.5 Ų164.569%0.69281%0.809SS**  trans-12284.6160.463.80000108S364 F368S364-S366 PolarHBondContact O-N 3.48Å; S366-F368 PolarHBondContact O-N 3.28Å
367H26Very low30.5Very low171 Ų171162.2 Ų162.279%0.79281%0.813SS**  trans-53.1113152.1-78.1-85.5000108.1
368F34.5Very low30.5Very low193 Ų193162.4 Ų162.485%0.84681%0.809SS**  trans-128.2123.1156.5-95.1-85.3000108.1S366S366-F368 PolarHBondContact O-N 3.28Å
369Y33.7Very low30.5Very low301 Ų301163.7 Ų163.7100%1.1881%0.814SS**  trans-57.20171.3-90.6-98.3000112.4

Retrieved 369 of 369 residues in 537.2 ms (Link to these results)

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