A0A5K4F3E1_SCHMA Loading...

Elongation of very long chain fatty acids protein

AlphaFold DB , UniProt , Accession A0A5K4F3E1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 269 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
1M42.2Very low80.9Confident234 Ų23490.4 Ų90.4100%1.15352%0.515SS*.  0123.50-59.8177.5-156.400106.2N3M1-N3 PolarHBondContact O-N 3.29Å
2A60.6Low82.1Confident97 Ų9782.8 Ų82.880%0.80247%0.472SS*.  trans-62.8133.4173.500000107.9I4A2-I4 PolarHBondContact O-N 3.2Å; A2-I4 VanDerWaalsContact O-N 3.14Å
3N67.5Low83Confident152 Ų15283.5 Ų83.581%0.81347%0.469SS*.  trans-57.9122.6175.7-74.4-30.6000108.2M1 F5M1-N3 PolarHBondContact O-N 3.29Å; N3-F5 WeakPolarHBondContact CB-O 3.33Å; N3-F5 PolarHBondContact O-N 3.46Å
4I79.5Confident83.8Confident131 Ų13188.4 Ų88.467%0.67249%0.493SS*.SBendtrans-60.1-36-179.6-67.8171.9000110.2A2 V224A2-I4 PolarHBondContact O-N 3.2Å; A2-I4 VanDerWaalsContact O-N 3.14Å; I4-V224 HydrophobicContact CG2-CB 4.49Å; I4-V224 HydrophobicContact CG2-CG2 3.94Å
5F84.3Confident84.7Confident83 Ų8386.3 Ų86.336%0.36448%0.475SS..SBendtrans-94.9144.8175.7-65.1-70.8000111.2N3 Y148 Y152 F225N3-F5 WeakPolarHBondContact CB-O 3.33Å; N3-F5 PolarHBondContact O-N 3.46Å; F5-Y148 HydrophobicContact CE1-CD1 4.2Å; F5-Y148 HydrophobicContact CZ-CD1 4.24Å; F5-Y148 HydrophobicContact CZ-CE1 4.32Å; F5-Y152 HydrophobicContact CB-CD1 4.15Å; F5-Y152 HydrophobicContact CB-CE1 3.84Å; F5-Y152 HydrophobicContact CG-CE1 4.48Å; F5-F225 AromaticContact CD1-CE2 3.97Å; F5-F225 HydrophobicContact CD1-CE2 3.97Å; F5-F225 AromaticContact CD1-CZ 3.71Å; F5-F225 HydrophobicContact CD1-CZ 3.71Å; F5-F225 HydrophobicContact CE1-CE2 4.48Å; F5-F225 AromaticContact CE1-CZ 3.99Å; F5-F225 HydrophobicContact CE1-CZ 3.99Å
6P87.5Confident85.5Confident27 Ų2785.9 Ų85.918%0.17548%0.478CS..PPolyproline II helixtrans-64.1170.4166.834.5-38.1000110.2Y152 V153 P222 F225P6-Y152 HydrophobicContact CG-CD1 4.08Å; P6-Y152 HydrophobicContact CG-CG 4.42Å; P6-Y152 WeakPolarHBondContact O-CD1 3.46Å; P6-Y152 VanDerWaalsContact O-CE1 3.23Å; P6-Y152 WeakPolarHBondContact O-CE1 3.44Å; P6-V153 HydrophobicContact CG-CG1 4.49Å; P6-P222 HydrophobicContact CB-CG 4.17Å; P6-P222 HydrophobicContact CG-CB 4.34Å; P6-P222 HydrophobicContact CG-CG 3.89Å; P6-F225 HydrophobicContact CG-CE2 4.15Å
7P89.6Confident86.1Confident114 Ų11484.2 Ų84.274%0.7447%0.467SS*.PPolyproline II helixtrans-55148.4168.6-23.334.3000111.7
8T92.9Very high86.7Confident60 Ų6079.6 Ų79.637%0.36844%0.441SS..PPolyproline II helixtrans-67.3146.5174.655.30000110.8P10 K151 Y152T8-P10 WeakPolarHBondContact O-CD 3.5Å; T8-K151 HydrophobicContact CG2-CD 4.24Å; T8-K151 HydrophobicContact CG2-CG 4.01Å; T8-Y152 HydrophobicContact CG2-CD1 4.15Å; T8-Y152 HydrophobicContact CG2-CE1 3.48Å; T8-Y152 VanDerWaalsContact CG2-CE1 3.48Å
9D94.4Very high87Confident2 Ų284.4 Ų84.41%0.01146%0.458CS..  trans-80.1115.8-179-169-27.4000111.5R11 V12 Y92 K151 P154D9-R11 PolarHBondContact O-N 3.14Å; D9-R11 VanDerWaalsContact O-N 3.17Å; D9-R11 WeakPolarHBondContact OD1-CB 3.39Å; D9-R11 WeakPolarHBondContact OD1-CG 3.4Å; D9-R11 PolarHBondContact OD1-N 2.8Å; D9-R11 IonicContact OD1-NE 3.85Å; D9-R11 PolarHBondContact OD1-NE 3.46Å; D9-R11 IonicContact OD2-CZ 2.7Å; D9-R11 IonicContact OD2-NE 2.83Å; D9-R11 PolarHBondContact OD2-NE 3.15Å; D9-R11 IonicContact OD2-NH2 2.79Å; D9-R11 PolarHBondContact OD2-NH2 3.04Å; D9-V12 HydrophobicContact CB-CG2 4.32Å; D9-V12 WeakPolarHBondContact O-CG2 3.45Å; D9-V12 PolarHBondContact O-N 3.15Å; D9-Y92 HydrophobicContact CB-CD1 4.43Å; D9-Y92 HydrophobicContact CB-CE1 4.41Å; D9-Y92 WeakPolarHBondContact OD2-CD1 3.33Å; D9-K151 PolarHBondContact N-O 3.08Å; D9-P154 HydrophobicContact CB-CG 4.11Å; D9-P154 WeakPolarHBondContact OD2-CG 3.32Å
10P95.2Very high87.4Confident80 Ų8083.3 Ų83.352%0.51945%0.451SS..THydrogen-bonded Turntrans-68.3-13-17929.3-36.3000113.3T8 V12T8-P10 WeakPolarHBondContact O-CD 3.5Å; P10-V12 VanDerWaalsContact C-N 3.31Å
11R96.1Very high87.8Confident14 Ų1480.9 Ų80.95%0.05344%0.44CS..THydrogen-bonded Turntrans-70.5-29.1178.9-60.6176.7-60.1169.22.6112.5D9 W15 D91 Y92 S93 R94 M99D9-R11 PolarHBondContact O-N 3.14Å; D9-R11 VanDerWaalsContact O-N 3.17Å; D9-R11 WeakPolarHBondContact OD1-CB 3.39Å; D9-R11 WeakPolarHBondContact OD1-CG 3.4Å; D9-R11 PolarHBondContact OD1-N 2.8Å; D9-R11 IonicContact OD1-NE 3.85Å; D9-R11 PolarHBondContact OD1-NE 3.46Å; D9-R11 IonicContact OD2-CZ 2.7Å; D9-R11 IonicContact OD2-NE 2.83Å; D9-R11 PolarHBondContact OD2-NE 3.15Å; D9-R11 IonicContact OD2-NH2 2.79Å; D9-R11 PolarHBondContact OD2-NH2 3.04Å; R11-W15 PolarHBondContact O-NE1 3.31Å; R11-D91 VanDerWaalsContact CZ-O 3.24Å; R11-D91 PolarHBondContact NH1-O 3.48Å; R11-D91 PolarHBondContact NH2-O 2.95Å; R11-Y92 WeakPolarHBondContact CD-O 3.33Å; R11-S93 WeakPolarHBondContact CD-O 3.29Å; R11-S93 PolarHBondContact NH1-O 3.2Å; R11-R94 HydrophobicContact CG-CG 4.24Å; R11-M99 HydrophobicContact CB-CE 4.27Å; R11-M99 HydrophobicContact CB-SD 4.07Å; R11-M99 HydrophobicContact CG-SD 4.01Å
12V95.9Very high90.4Very high0 Ų073.6 Ų73.60%041%0.409CS..THydrogen-bonded Turntrans-104.1-6-175.7-51.90000113.1D9 P10 N14 W15 M18 V150 P154D9-V12 HydrophobicContact CB-CG2 4.32Å; D9-V12 WeakPolarHBondContact O-CG2 3.45Å; D9-V12 PolarHBondContact O-N 3.15Å; P10-V12 VanDerWaalsContact C-N 3.31Å; V12-N14 VanDerWaalsContact C-N 3.29Å; V12-N14 PolarHBondContact O-N 3.18Å; V12-W15 HydrophobicContact CB-CD2 4.08Å; V12-W15 HydrophobicContact CB-CE3 3.81Å; V12-W15 HydrophobicContact CB-CZ3 4.24Å; V12-W15 HydrophobicContact CG1-CD2 4.23Å; V12-W15 HydrophobicContact CG1-CE3 3.68Å; V12-W15 HydrophobicContact CG1-CH2 4.02Å; V12-W15 HydrophobicContact CG1-CZ3 3.57Å; V12-W15 VanDerWaalsContact O-CB 3.3Å; V12-W15 WeakPolarHBondContact O-CB 3.49Å; V12-W15 PolarHBondContact O-N 2.67Å; V12-M18 HydrophobicContact CB-CG 4.35Å; V12-M18 HydrophobicContact CG2-CG 4.5Å; V12-M18 WeakPolarHBondContact O-CB 3.35Å; V12-V150 HydrophobicContact CB-CG1 4.46Å; V12-V150 HydrophobicContact CG1-CG1 4.27Å; V12-V150 HydrophobicContact CG2-CG1 4.5Å; V12-P154 HydrophobicContact CG1-CB 4.39Å; V12-P154 HydrophobicContact CG1-CG 4.25Å
13E92.9Very high92.1Very high91 Ų9171.3 Ų71.343%0.42539%0.386SS..THydrogen-bonded Turntrans-57.4-39.3-169.4-174.5169.9-16200114W15E13-W15 VanDerWaalsContact C-N 3.33Å
14N94.1Very high93.6Very high152 Ų15264.2 Ų64.281%0.81335%0.348SS*.THydrogen-bonded Turntrans-89.22.8-179.9-63.4-43.9000113.2V12V12-N14 VanDerWaalsContact C-N 3.29Å; V12-N14 PolarHBondContact O-N 3.18Å
15W97.6Very high94.5Very high57 Ų5762.2 Ų62.222%0.21634%0.335CS..SBendtrans-77.4149.9178.2-64.4-1.5000110.6R11 V12 E13 L17 M18 M99 A102 W106R11-W15 PolarHBondContact O-NE1 3.31Å; V12-W15 HydrophobicContact CB-CD2 4.08Å; V12-W15 HydrophobicContact CB-CE3 3.81Å; V12-W15 HydrophobicContact CB-CZ3 4.24Å; V12-W15 HydrophobicContact CG1-CD2 4.23Å; V12-W15 HydrophobicContact CG1-CE3 3.68Å; V12-W15 HydrophobicContact CG1-CH2 4.02Å; V12-W15 HydrophobicContact CG1-CZ3 3.57Å; V12-W15 VanDerWaalsContact O-CB 3.3Å; V12-W15 WeakPolarHBondContact O-CB 3.49Å; V12-W15 PolarHBondContact O-N 2.67Å; E13-W15 VanDerWaalsContact C-N 3.33Å; W15-L17 PolarHBondContact O-N 3.36Å; W15-M18 HydrophobicContact CB-CB 4.33Å; W15-M18 HydrophobicContact CB-CG 3.92Å; W15-M18 WeakPolarHBondContact O-CB 3.22Å; W15-M18 PolarHBondContact O-N 3.22Å; W15-M99 HydrophobicContact CZ2-CE 3.91Å; W15-A102 HydrophobicContact CH2-CB 4Å; W15-A102 HydrophobicContact CZ3-CB 4.42Å; W15-A102 WeakPolarHBondContact CZ3-O 3.49Å; W15-W106 HydrophobicContact CD2-CG 4.44Å; W15-W106 HydrophobicContact CE3-CB 3.51Å; W15-W106 AromaticContact CE3-CD1 3.65Å; W15-W106 HydrophobicContact CE3-CD2 4.09Å; W15-W106 AromaticContact CE3-CG 3.45Å; W15-W106 HydrophobicContact CE3-CG 3.45Å; W15-W106 VanDerWaalsContact CE3-CG 3.45Å; W15-W106 HydrophobicContact CZ3-CB 3.49Å; W15-W106 VanDerWaalsContact CZ3-CB 3.49Å; W15-W106 AromaticContact CZ3-CG 3.97Å; W15-W106 HydrophobicContact CZ3-CG 3.97Å
16P97.2Very high95.2Very high80 Ų8061.7 Ų61.752%0.51934%0.338SS..THydrogen-bonded Turntrans-53.8137.8179.5-21.827.9000111.7M18 W106 F110P16-M18 PolarHBondContact O-N 3.3Å; P16-W106 HydrophobicContact CB-CZ2 3.87Å; P16-W106 HydrophobicContact CG-CH2 4.3Å; P16-W106 HydrophobicContact CG-CZ2 3.73Å; P16-W106 PolarHBondContact O-NE1 3.17Å; P16-F110 HydrophobicContact CB-CE2 4.49Å; P16-F110 HydrophobicContact CB-CZ 4.06Å
17L96.2Very high95.7Very high58 Ų5862.9 Ų62.930%0.30435%0.345SS..THydrogen-bonded Turntrans63.35.1-176.1-56.5177.4000116.5W15 P23 F109 F110 I113 W147W15-L17 PolarHBondContact O-N 3.36Å; L17-P23 HydrophobicContact CD2-CB 3.79Å; L17-P23 HydrophobicContact CD2-CG 4.45Å; L17-F109 HydrophobicContact CB-CE1 4.07Å; L17-F109 HydrophobicContact CB-CZ 4.33Å; L17-F109 HydrophobicContact CD1-CE1 4.24Å; L17-F109 HydrophobicContact CD1-CZ 4.36Å; L17-F110 HydrophobicContact CB-CE2 4.46Å; L17-F110 HydrophobicContact CB-CZ 4.35Å; L17-F110 HydrophobicContact CD1-CE1 3.92Å; L17-F110 HydrophobicContact CD1-CE2 4.14Å; L17-F110 HydrophobicContact CD1-CZ 3.52Å; L17-F110 HydrophobicContact CG-CE2 4.46Å; L17-F110 HydrophobicContact CG-CZ 3.88Å; L17-I113 HydrophobicContact CD1-CD1 3.42Å; L17-I113 VanDerWaalsContact CD1-CD1 3.42Å; L17-W147 PolarHBondContact O-NE1 3.41Å
18M96.8Very high96.1Very high0 Ų057.8 Ų57.80%031%0.311CS..  trans-96.6-6.4-177.4-66.4-62.9102.600115.1V12 W15 P16 F109 W147 V150 K151V12-M18 HydrophobicContact CB-CG 4.35Å; V12-M18 HydrophobicContact CG2-CG 4.5Å; V12-M18 WeakPolarHBondContact O-CB 3.35Å; W15-M18 HydrophobicContact CB-CB 4.33Å; W15-M18 HydrophobicContact CB-CG 3.92Å; W15-M18 WeakPolarHBondContact O-CB 3.22Å; W15-M18 PolarHBondContact O-N 3.22Å; P16-M18 PolarHBondContact O-N 3.3Å; M18-F109 HydrophobicContact CE-CD1 3.51Å; M18-F109 HydrophobicContact CE-CE1 3.2Å; M18-F109 HydrophobicContact CE-CG 4.31Å; M18-F109 HydrophobicContact CE-CZ 3.77Å; M18-W147 VanDerWaalsContact CE-CD1 3.48Å; M18-W147 HydrophobicContact CE-CG 4.38Å; M18-V150 HydrophobicContact SD-CB 3.95Å; M18-V150 HydrophobicContact SD-CG1 3.51Å; M18-V150 VanDerWaalsContact SD-CG1 3.51Å; M18-K151 WeakPolarHBondContact O-CE 3.07Å; M18-K151 PolarHBondContact O-NZ 3.38Å
19K93.2Very high96.4Very high172 Ų17260 Ų6075%0.74832%0.321SS*.SBendtrans-62.4-54.4-179.5-173.7178.8-179.3179.80111.6
20D93.5Very high96.6Very high61 Ų6165.4 Ų65.433%0.32635%0.349SS..  trans-147.3157.8179.673.190.4000110.1T22 P23D20-T22 VanDerWaalsContact C-N 3.3Å; D20-T22 PolarHBondContact O-N 3.11Å; D20-T22 WeakPolarHBondContact OD1-CB 3.34Å; D20-T22 PolarHBondContact OD1-N 3.15Å; D20-T22 PolarHBondContact OD1-OG1 3.38Å; D20-P23 WeakPolarHBondContact O-CD 3.32Å; D20-P23 WeakPolarHBondContact OD1-CD 3.02Å
21P95.7Very high96.8Very high33 Ų3362.1 Ų62.121%0.21433%0.326CS..SBendtrans-81-9-172.531.4-33.9000113.6V24 F25 W147P21-V24 WeakPolarHBondContact O-CB 3.37Å; P21-V24 PolarHBondContact O-N 3.34Å; P21-F25 HydrophobicContact CB-CD2 3.91Å; P21-F25 HydrophobicContact CB-CE2 3.83Å; P21-F25 HydrophobicContact CG-CD2 4.48Å; P21-F25 HydrophobicContact CG-CE2 4.32Å; P21-F25 WeakPolarHBondContact O-CD2 3.29Å; P21-F25 PolarHBondContact O-N 3.47Å; P21-F25 VanDerWaalsContact O-N 3.12Å; P21-W147 HydrophobicContact CB-CD2 3.78Å; P21-W147 HydrophobicContact CB-CE3 3.71Å; P21-W147 HydrophobicContact CB-CH2 3.75Å; P21-W147 HydrophobicContact CB-CZ2 3.81Å; P21-W147 HydrophobicContact CB-CZ3 3.7Å; P21-W147 HydrophobicContact CG-CH2 3.93Å; P21-W147 HydrophobicContact CG-CZ2 4.29Å; P21-W147 HydrophobicContact CG-CZ3 4.07Å; P21-W147 VanDerWaalsContact N-CZ2 3.26Å
22T97.5Very high96.9Very high82 Ų8263.9 Ų63.950%0.50334%0.336SS..Hα-helixtrans-55.5-45.5-171.5-43.30000112.6D20 V24 F25 V26D20-T22 VanDerWaalsContact C-N 3.3Å; D20-T22 PolarHBondContact O-N 3.11Å; D20-T22 WeakPolarHBondContact OD1-CB 3.34Å; D20-T22 PolarHBondContact OD1-N 3.15Å; D20-T22 PolarHBondContact OD1-OG1 3.38Å; T22-V24 PolarHBondContact O-N 3.35Å; T22-F25 PolarHBondContact O-N 2.88Å; T22-V26 HydrophobicContact CG2-CG2 4.25Å; T22-V26 WeakPolarHBondContact O-CG2 3.43Å; T22-V26 PolarHBondContact O-N 3.45Å
23P97.4Very high97Very high48 Ų4866.9 Ų66.931%0.31235%0.354SS..Hα-helixtrans-59.3-33.9177.5-25.836.5000113.5L17 D20 T27L17-P23 HydrophobicContact CD2-CB 3.79Å; L17-P23 HydrophobicContact CD2-CG 4.45Å; D20-P23 WeakPolarHBondContact O-CD 3.32Å; D20-P23 WeakPolarHBondContact OD1-CD 3.02Å; P23-T27 WeakPolarHBondContact O-CB 3.41Å; P23-T27 PolarHBondContact O-N 2.92Å; P23-T27 PolarHBondContact O-OG1 2.68Å
24V98.1Very high97.3Very high4 Ų464.8 Ų64.82%0.02434%0.344CS..Hα-helixtrans-70.9-45.5177.9-177.90000110.5P21 T22 V26 T27 V28 F109 P143 I144 W147P21-V24 WeakPolarHBondContact O-CB 3.37Å; P21-V24 PolarHBondContact O-N 3.34Å; T22-V24 PolarHBondContact O-N 3.35Å; V24-V26 PolarHBondContact O-N 2.89Å; V24-T27 PolarHBondContact O-N 2.69Å; V24-V28 WeakPolarHBondContact O-CG2 3.33Å; V24-V28 PolarHBondContact O-N 3.45Å; V24-F109 HydrophobicContact CG1-CE2 4.36Å; V24-F109 HydrophobicContact CG2-CE2 3.99Å; V24-F109 HydrophobicContact CG2-CZ 3.62Å; V24-P143 HydrophobicContact CG1-CB 4.03Å; V24-I144 HydrophobicContact CG1-CG1 4.26Å; V24-W147 HydrophobicContact CG2-CB 4.35Å; V24-W147 VanDerWaalsContact CG2-CD1 3.45Å; V24-W147 HydrophobicContact CG2-CG 4.05Å
25F98.4Very high97.5Very high89 Ų8957.7 Ų57.739%0.3931%0.306SS..Hα-helixtrans-61.8-42.3175.6-80.4-77.2000112.2P21 T22 T27 V28 L29 I144 Y148P21-F25 HydrophobicContact CB-CD2 3.91Å; P21-F25 HydrophobicContact CB-CE2 3.83Å; P21-F25 HydrophobicContact CG-CD2 4.48Å; P21-F25 HydrophobicContact CG-CE2 4.32Å; P21-F25 WeakPolarHBondContact O-CD2 3.29Å; P21-F25 PolarHBondContact O-N 3.47Å; P21-F25 VanDerWaalsContact O-N 3.12Å; T22-F25 PolarHBondContact O-N 2.88Å; F25-T27 VanDerWaalsContact C-N 3.34Å; F25-V28 PolarHBondContact O-N 2.92Å; F25-L29 VanDerWaalsContact O-CB 3.31Å; F25-L29 WeakPolarHBondContact O-CB 3.38Å; F25-L29 PolarHBondContact O-N 3.3Å; F25-I144 HydrophobicContact CD1-CD1 3.98Å; F25-I144 HydrophobicContact CD1-CG1 4.39Å; F25-I144 HydrophobicContact CE1-CD1 3.78Å; F25-I144 HydrophobicContact CE1-CG1 4.2Å; F25-I144 HydrophobicContact CE1-CG2 3.98Å; F25-I144 HydrophobicContact CE2-CG2 4.38Å; F25-I144 HydrophobicContact CZ-CG2 3.68Å; F25-Y148 HydrophobicContact CE2-CE2 4.37Å; F25-Y148 HydrophobicContact CZ-CE2 4.37Å
26V98.6Very high97.5Very high72 Ų7260.6 Ų60.644%0.43633%0.325SS..Hα-helixtrans-62.2-43.5174.6171.80000110.7T22 V24 V28 L29 L30T22-V26 HydrophobicContact CG2-CG2 4.25Å; T22-V26 WeakPolarHBondContact O-CG2 3.43Å; T22-V26 PolarHBondContact O-N 3.45Å; V24-V26 PolarHBondContact O-N 2.89Å; V26-V28 PolarHBondContact O-N 3.27Å; V26-L29 PolarHBondContact O-N 3.23Å; V26-L30 HydrophobicContact CG1-CD1 4.02Å; V26-L30 HydrophobicContact CG1-CG 4.37Å; V26-L30 WeakPolarHBondContact O-CB 3.2Å; V26-L30 VanDerWaalsContact O-CG 3.31Å; V26-L30 WeakPolarHBondContact O-CG 3.44Å; V26-L30 PolarHBondContact O-N 2.78Å
27T98.5Very high97.4Very high51 Ų5164.1 Ų64.131%0.31333%0.328SS..Hα-helixtrans-61.1-46.5177.5-60.60000111.5P23 V24 F25 L29 L30 Y31 I113 L116P23-T27 WeakPolarHBondContact O-CB 3.41Å; P23-T27 PolarHBondContact O-N 2.92Å; P23-T27 PolarHBondContact O-OG1 2.68Å; V24-T27 PolarHBondContact O-N 2.69Å; F25-T27 VanDerWaalsContact C-N 3.34Å; T27-L29 VanDerWaalsContact C-N 3.35Å; T27-L30 PolarHBondContact O-N 3.39Å; T27-Y31 WeakPolarHBondContact O-CB 3.26Å; T27-Y31 PolarHBondContact O-N 2.75Å; T27-I113 HydrophobicContact CG2-CG2 4.39Å; T27-L116 HydrophobicContact CG2-CD1 3.89Å
28V98.7Very high97.5Very high7 Ų764.6 Ų64.64%0.04233%0.331CS..Hα-helixtrans-65.7-38.1177173.70000111.4V24 F25 V26 Y31 L32 A140 P143 I144V24-V28 WeakPolarHBondContact O-CG2 3.33Å; V24-V28 PolarHBondContact O-N 3.45Å; F25-V28 PolarHBondContact O-N 2.92Å; V26-V28 PolarHBondContact O-N 3.27Å; V28-Y31 WeakPolarHBondContact O-CB 3.45Å; V28-Y31 PolarHBondContact O-N 3.48Å; V28-L32 HydrophobicContact CG1-CD1 4.13Å; V28-L32 HydrophobicContact CG1-CG 4.36Å; V28-L32 VanDerWaalsContact O-CG 3.32Å; V28-L32 WeakPolarHBondContact O-CG 3.18Å; V28-L32 PolarHBondContact O-N 2.86Å; V28-A140 HydrophobicContact CG1-CB 3.98Å; V28-P143 HydrophobicContact CG2-CB 4.34Å; V28-P143 HydrophobicContact CG2-CG 4.44Å; V28-I144 HydrophobicContact CB-CD1 4.35Å; V28-I144 HydrophobicContact CG1-CD1 4.16Å; V28-I144 HydrophobicContact CG2-CD1 4.23Å; V28-I144 HydrophobicContact CG2-CG1 4.08Å
29L98.6Very high97.5Very high108 Ų10864.6 Ų64.657%0.56533%0.331SS*.Hα-helixtrans-63.2-46.5176-179.262.6000111.5F25 V26 T27 Y31 L32 V33F25-L29 VanDerWaalsContact O-CB 3.31Å; F25-L29 WeakPolarHBondContact O-CB 3.38Å; F25-L29 PolarHBondContact O-N 3.3Å; V26-L29 PolarHBondContact O-N 3.23Å; T27-L29 VanDerWaalsContact C-N 3.35Å; L29-Y31 VanDerWaalsContact C-N 3.33Å; L29-Y31 PolarHBondContact O-N 2.95Å; L29-L32 PolarHBondContact O-N 2.98Å; L29-V33 HydrophobicContact CD1-CG2 4.49Å; L29-V33 VanDerWaalsContact O-CG2 3.32Å; L29-V33 WeakPolarHBondContact O-CG2 3.31Å; L29-V33 PolarHBondContact O-N 3.17Å
30L98.7Very high97.6Very high114 Ų11458.3 Ų58.360%0.59731%0.308SS*.Hα-helixtrans-62-41.5175.6-70.4173.9000111.6V26 T27 V33 F34V26-L30 HydrophobicContact CG1-CD1 4.02Å; V26-L30 HydrophobicContact CG1-CG 4.37Å; V26-L30 WeakPolarHBondContact O-CB 3.2Å; V26-L30 VanDerWaalsContact O-CG 3.31Å; V26-L30 WeakPolarHBondContact O-CG 3.44Å; V26-L30 PolarHBondContact O-N 2.78Å; T27-L30 PolarHBondContact O-N 3.39Å; L30-V33 PolarHBondContact O-N 3.25Å; L30-F34 WeakPolarHBondContact O-CB 3.41Å; L30-F34 PolarHBondContact O-N 3.47Å
31Y98.7Very high97.7Very high12 Ų1261.4 Ų61.45%0.04732%0.318CS..Hα-helixtrans-57.1-49.2172.3163.8-95.7000111.5T27 V28 L29 F34 V35 L116 T119 V136 H139 A140T27-Y31 WeakPolarHBondContact O-CB 3.26Å; T27-Y31 PolarHBondContact O-N 2.75Å; V28-Y31 WeakPolarHBondContact O-CB 3.45Å; V28-Y31 PolarHBondContact O-N 3.48Å; L29-Y31 VanDerWaalsContact C-N 3.33Å; L29-Y31 PolarHBondContact O-N 2.95Å; Y31-F34 PolarHBondContact O-N 3Å; Y31-V35 HydrophobicContact CD2-CG2 3.83Å; Y31-V35 HydrophobicContact CE1-CG2 4.41Å; Y31-V35 HydrophobicContact CE2-CG2 3.52Å; Y31-V35 HydrophobicContact CG-CG2 4.42Å; Y31-V35 WeakPolarHBondContact O-CB 3.27Å; Y31-V35 WeakPolarHBondContact O-CG2 3.13Å; Y31-V35 PolarHBondContact O-N 3.05Å; Y31-L116 HydrophobicContact CD1-CD2 4.14Å; Y31-L116 HydrophobicContact CD2-CB 3.86Å; Y31-L116 HydrophobicContact CD2-CD2 3.89Å; Y31-L116 HydrophobicContact CD2-CG 4.34Å; Y31-L116 HydrophobicContact CE1-CD2 4.25Å; Y31-L116 HydrophobicContact CE2-CB 4.16Å; Y31-L116 HydrophobicContact CE2-CD2 3.96Å; Y31-L116 WeakPolarHBondContact CE2-O 3.3Å; Y31-L116 HydrophobicContact CG-CD1 4.5Å; Y31-L116 HydrophobicContact CG-CD2 3.98Å; Y31-T119 HydrophobicContact CE2-CG2 4.47Å; Y31-T119 PolarHBondContact OH-OG1 3.5Å; Y31-V136 HydrophobicContact CE1-CG1 4.21Å; Y31-H139 WeakPolarHBondContact OH-CB 3.48Å; Y31-A140 HydrophobicContact CE1-CB 4.36Å
32L98.7Very high97.7Very high51 Ų5163.7 Ų63.727%0.26733%0.328SS..Hα-helixtrans-64.3-43.5179.6-72173.2000112.1V28 L29 F34 V35 L36 V136 A140V28-L32 HydrophobicContact CG1-CD1 4.13Å; V28-L32 HydrophobicContact CG1-CG 4.36Å; V28-L32 VanDerWaalsContact O-CG 3.32Å; V28-L32 WeakPolarHBondContact O-CG 3.18Å; V28-L32 PolarHBondContact O-N 2.86Å; L29-L32 PolarHBondContact O-N 2.98Å; L32-F34 VanDerWaalsContact C-N 3.29Å; L32-F34 PolarHBondContact O-N 3.25Å; L32-V35 PolarHBondContact O-N 3.16Å; L32-L36 HydrophobicContact CB-CD1 4.46Å; L32-L36 HydrophobicContact CD2-CD1 4.18Å; L32-L36 VanDerWaalsContact O-CB 3.26Å; L32-L36 WeakPolarHBondContact O-CB 2.89Å; L32-L36 WeakPolarHBondContact O-CG 3.46Å; L32-L36 PolarHBondContact O-N 3.28Å; L32-V136 HydrophobicContact CD2-CG1 3.88Å; L32-A140 HydrophobicContact CD2-CB 4.11Å
33V98.6Very high97.5Very high62 Ų6259.8 Ų59.838%0.37630%0.304SS..Hα-helixtrans-59.3-42.9174.9169.90000110.7L29 L30 W37 L38L29-V33 HydrophobicContact CD1-CG2 4.49Å; L29-V33 VanDerWaalsContact O-CG2 3.32Å; L29-V33 WeakPolarHBondContact O-CG2 3.31Å; L29-V33 PolarHBondContact O-N 3.17Å; L30-V33 PolarHBondContact O-N 3.25Å; V33-W37 HydrophobicContact CG1-CE3 4.15Å; V33-W37 PolarHBondContact O-N 3.02Å; V33-L38 PolarHBondContact O-N 3.33Å
34F98.6Very high97.2Very high47 Ų4766.3 Ų66.321%0.20633%0.327CS..Iπ-helixtrans-65.5-51.8176.6-175.9-92.2000112L30 Y31 L32 L38 G39 P40 V120 I123 L124L30-F34 WeakPolarHBondContact O-CB 3.41Å; L30-F34 PolarHBondContact O-N 3.47Å; Y31-F34 PolarHBondContact O-N 3Å; L32-F34 VanDerWaalsContact C-N 3.29Å; L32-F34 PolarHBondContact O-N 3.25Å; F34-L38 HydrophobicContact CD2-CD2 4.35Å; F34-L38 PolarHBondContact O-N 2.8Å; F34-G39 WeakPolarHBondContact O-CA 3.23Å; F34-G39 PolarHBondContact O-N 3.16Å; F34-P40 WeakPolarHBondContact O-CD 3.38Å; F34-V120 HydrophobicContact CD1-CG1 4.47Å; F34-V120 HydrophobicContact CD1-CG2 3.96Å; F34-V120 HydrophobicContact CE1-CB 4.13Å; F34-V120 HydrophobicContact CE1-CG1 3.75Å; F34-V120 HydrophobicContact CE1-CG2 4.02Å; F34-V120 HydrophobicContact CZ-CG1 4.09Å; F34-I123 HydrophobicContact CD1-CD1 4.37Å; F34-I123 HydrophobicContact CE1-CB 4.45Å; F34-I123 HydrophobicContact CE1-CD1 4.2Å; F34-I123 HydrophobicContact CE1-CG2 4.32Å; F34-L124 HydrophobicContact CZ-CD2 4.41Å
35V98.1Very high96.8Very high4 Ų475.3 Ų75.32%0.02437%0.366CS..Iπ-helixtrans-70.2-40.5-171.5166.20000112.5Y31 L32 P40 T119 I123 V131 V136Y31-V35 HydrophobicContact CD2-CG2 3.83Å; Y31-V35 HydrophobicContact CE1-CG2 4.41Å; Y31-V35 HydrophobicContact CE2-CG2 3.52Å; Y31-V35 HydrophobicContact CG-CG2 4.42Å; Y31-V35 WeakPolarHBondContact O-CB 3.27Å; Y31-V35 WeakPolarHBondContact O-CG2 3.13Å; Y31-V35 PolarHBondContact O-N 3.05Å; L32-V35 PolarHBondContact O-N 3.16Å; V35-P40 WeakPolarHBondContact O-CD 3.38Å; V35-P40 WeakPolarHBondContact O-CG 3.32Å; V35-T119 HydrophobicContact CB-CG2 4.37Å; V35-T119 HydrophobicContact CG1-CG2 3.69Å; V35-T119 HydrophobicContact CG2-CG2 3.67Å; V35-I123 HydrophobicContact CB-CD1 4.04Å; V35-I123 HydrophobicContact CG1-CD1 4.1Å; V35-I123 HydrophobicContact CG2-CD1 3.89Å; V35-V131 HydrophobicContact CG1-CG1 3.87Å; V35-V136 HydrophobicContact CG1-CG1 4.22Å; V35-V136 HydrophobicContact CG1-CG2 3.72Å
36L97.1Very high96.3Very high118 Ų11874.3 Ų74.362%0.61836%0.362SS*.Iπ-helixtrans-88.6-25-173.7-59.9178.1000113.3L32 V136L32-L36 HydrophobicContact CB-CD1 4.46Å; L32-L36 HydrophobicContact CD2-CD1 4.18Å; L32-L36 VanDerWaalsContact O-CB 3.26Å; L32-L36 WeakPolarHBondContact O-CB 2.89Å; L32-L36 WeakPolarHBondContact O-CG 3.46Å; L32-L36 PolarHBondContact O-N 3.28Å; L36-V136 HydrophobicContact CD2-CG1 4.35Å
37W96.6Very high95.5Very high153 Ų15379.2 Ų79.258%0.5838%0.381SS*.Iπ-helixtrans-131.7-63.8-171.9179.969000113.8V33 K41V33-W37 HydrophobicContact CG1-CE3 4.15Å; V33-W37 PolarHBondContact O-N 3.02Å; W37-K41 WeakPolarHBondContact O-CB 3.35Å; W37-K41 PolarHBondContact O-N 3Å; W37-K41 VanDerWaalsContact O-N 3.15Å
38L97.5Very high95Very high68 Ų6880.8 Ų80.836%0.35639%0.391SS..Iπ-helixtrans-69.7-48.8-167.4179.162.6000112.5V33 F34 K41 I42V33-L38 PolarHBondContact O-N 3.33Å; F34-L38 HydrophobicContact CD2-CD2 4.35Å; F34-L38 PolarHBondContact O-N 2.8Å; L38-K41 PolarHBondContact O-N 3.19Å; L38-I42 HydrophobicContact CD1-CD1 3.77Å; L38-I42 HydrophobicContact CD1-CG1 4.14Å; L38-I42 HydrophobicContact CG-CD1 3.75Å; L38-I42 HydrophobicContact CG-CG1 4.49Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.36Å; L38-I42 PolarHBondContact O-N 3.22Å
39G96.6Very high94.6Very high1 Ų184 Ų841%0.0141%0.412CS..Hα-helixtrans-59-54.4179.700000112.8F34 K41 I42 M43F34-G39 WeakPolarHBondContact O-CA 3.23Å; F34-G39 PolarHBondContact O-N 3.16Å; G39-K41 VanDerWaalsContact C-N 3.3Å; G39-K41 PolarHBondContact O-N 3.36Å; G39-I42 PolarHBondContact O-N 2.99Å; G39-M43 WeakPolarHBondContact O-CB 3.46Å; G39-M43 VanDerWaalsContact O-CG 3.32Å; G39-M43 WeakPolarHBondContact O-CG 3.47Å; G39-M43 PolarHBondContact O-N 2.94Å
40P95.7Very high94.3Very high39 Ų3983 Ų8325%0.25340%0.403SS..Hα-helixtrans-57.1-39.7174.6-26.835.3000113.3F34 V35 M43 K44 F128F34-P40 WeakPolarHBondContact O-CD 3.38Å; V35-P40 WeakPolarHBondContact O-CD 3.38Å; V35-P40 WeakPolarHBondContact O-CG 3.32Å; P40-M43 PolarHBondContact O-N 3.47Å; P40-K44 WeakPolarHBondContact O-CB 3.35Å; P40-K44 PolarHBondContact O-N 2.97Å; P40-F128 HydrophobicContact CB-CE1 4.27Å; P40-F128 HydrophobicContact CG-CE1 4.38Å
41K95.5Very high93.8Very high127 Ų12784 Ų8455%0.55241%0.409SS*.Hα-helixtrans-64.2-45.5177.6-174.2178-179.4-179.40112.1W37 L38 G39 K44 K45W37-K41 WeakPolarHBondContact O-CB 3.35Å; W37-K41 PolarHBondContact O-N 3Å; W37-K41 VanDerWaalsContact O-N 3.15Å; L38-K41 PolarHBondContact O-N 3.19Å; G39-K41 VanDerWaalsContact C-N 3.3Å; G39-K41 PolarHBondContact O-N 3.36Å; K41-K44 PolarHBondContact O-N 2.9Å; K41-K45 PolarHBondContact O-N 3.25Å
42I94.5Very high93.6Very high80 Ų8085.1 Ų85.141%0.4142%0.415SS..Hα-helixtrans-61.6-48.4175.9-69.7168000110.2L38 G39 K44 K45 H46L38-I42 HydrophobicContact CD1-CD1 3.77Å; L38-I42 HydrophobicContact CD1-CG1 4.14Å; L38-I42 HydrophobicContact CG-CD1 3.75Å; L38-I42 HydrophobicContact CG-CG1 4.49Å; L38-I42 VanDerWaalsContact O-CG1 3.29Å; L38-I42 WeakPolarHBondContact O-CG1 3.36Å; L38-I42 PolarHBondContact O-N 3.22Å; G39-I42 PolarHBondContact O-N 2.99Å; I42-K44 VanDerWaalsContact C-N 3.3Å; I42-K44 PolarHBondContact O-N 3.42Å; I42-K45 WeakPolarHBondContact O-CB 3.47Å; I42-K45 PolarHBondContact O-N 3.23Å; I42-K45 VanDerWaalsContact O-N 3.11Å; I42-H46 PolarHBondContact O-N 2.97Å
43M93.7Very high93.2Very high1 Ų188 Ų881%0.00542%0.423CS..Hα-helixtrans-73.9-18.4-176.1-65.4-53.2-57.900113.7G39 P40 F50 I123 L124 K126 F128G39-M43 WeakPolarHBondContact O-CB 3.46Å; G39-M43 VanDerWaalsContact O-CG 3.32Å; G39-M43 WeakPolarHBondContact O-CG 3.47Å; G39-M43 PolarHBondContact O-N 2.94Å; P40-M43 PolarHBondContact O-N 3.47Å; M43-F50 HydrophobicContact CE-CD2 3.92Å; M43-F50 HydrophobicContact CE-CE2 4.05Å; M43-F50 HydrophobicContact SD-CD2 3.93Å; M43-F50 HydrophobicContact SD-CE2 3.61Å; M43-I123 HydrophobicContact CG-CG2 3.83Å; M43-I123 WeakPolarHBondContact CG-O 3.42Å; M43-L124 WeakPolarHBondContact CE-O 3Å; M43-L124 HydrophobicContact SD-CD2 4.12Å; M43-K126 HydrophobicContact CE-CD 4.38Å; M43-K126 HydrophobicContact CE-CG 3.66Å; M43-K126 WeakPolarHBondContact O-CE 3.39Å; M43-K126 PolarHBondContact O-NZ 3.46Å; M43-F128 HydrophobicContact CB-CZ 3.86Å
44K90.8Very high92.9Very high185 Ų18589.4 Ų89.480%0.80443%0.433SS*.Hα-helixtrans-70.5-39.5167.1-172.3177.6-178.9179.90111.3P40 K41 I42P40-K44 WeakPolarHBondContact O-CB 3.35Å; P40-K44 PolarHBondContact O-N 2.97Å; K41-K44 PolarHBondContact O-N 2.9Å; I42-K44 VanDerWaalsContact C-N 3.3Å; I42-K44 PolarHBondContact O-N 3.42Å
45K91.3Very high92.7Very high192 Ų19291.6 Ų91.684%0.83545%0.446SS*.Hα-helixtrans-72.4-39.3176.7-174.3179.3177.8-177.70111.9K41 I42 Q47K41-K45 PolarHBondContact O-N 3.25Å; I42-K45 WeakPolarHBondContact O-CB 3.47Å; I42-K45 PolarHBondContact O-N 3.23Å; I42-K45 VanDerWaalsContact O-N 3.11Å; K45-Q47 PolarHBondContact O-N 3.45Å
46H88Confident92.5Very high68 Ų6891.8 Ų91.832%0.31545%0.447SS..SBendtrans-79.3115.4177.1-169-83.8000110.3I42 T48 F50 K126I42-H46 PolarHBondContact O-N 2.97Å; H46-T48 PolarHBondContact CE1-O 2.81Å; H46-T48 VanDerWaalsContact CE1-O 3.23Å; H46-T48 PolarHBondContact CE1-OG1 2.86Å; H46-T48 VanDerWaalsContact CE1-OG1 3.3Å; H46-T48 PolarHBondContact ND1-O 3.38Å; H46-T48 PolarHBondContact O-N 2.9Å; H46-F50 AromaticContact CD2-CZ 3.97Å; H46-F50 AromaticContact NE2-CE1 3.84Å; H46-F50 AromaticContact NE2-CZ 3.81Å; H46-K126 WeakPolarHBondContact O-CE 3.22Å; H46-K126 PolarHBondContact O-NZ 2.91Å
47Q81.3Confident92.4Very high175 Ų17588.7 Ų88.782%0.81843%0.431SS*.  trans-69.5-36.4-168-70.3179.5-19.600113.8K45 K126K45-Q47 PolarHBondContact O-N 3.45Å; Q47-K126 VanDerWaalsContact C-NZ 3.31Å; Q47-K126 PolarHBondContact O-NZ 3.27Å
48T87.9Confident92.4Very high85 Ų8585.7 Ų85.752%0.52143%0.429SS..SBendtrans-102.6153.3-17553.20000112.5H46H46-T48 PolarHBondContact CE1-O 2.81Å; H46-T48 VanDerWaalsContact CE1-O 3.23Å; H46-T48 PolarHBondContact CE1-OG1 2.86Å; H46-T48 VanDerWaalsContact CE1-OG1 3.3Å; H46-T48 PolarHBondContact ND1-O 3.38Å; H46-T48 PolarHBondContact O-N 2.9Å
49P90Very high92.4Very high75 Ų7583.9 Ų83.949%0.48742%0.418SS..PPolyproline II helixtrans-72144.2168.730.3-33.7000110.3N51 R125 K126P49-N51 PolarHBondContact O-N 3.23Å; P49-R125 VanDerWaalsContact CB-O 3.31Å; P49-R125 WeakPolarHBondContact CB-O 3.49Å; P49-K126 HydrophobicContact CB-CB 4.31Å; P49-K126 HydrophobicContact CB-CG 4.19Å
50F91.3Very high92.4Very high85 Ų8584 Ų8437%0.37342%0.418SS..PPolyproline II helixtrans-66.9133.8172.7-70.3-75000110.4M43 H46 L52 L124M43-F50 HydrophobicContact CE-CD2 3.92Å; M43-F50 HydrophobicContact CE-CE2 4.05Å; M43-F50 HydrophobicContact SD-CD2 3.93Å; M43-F50 HydrophobicContact SD-CE2 3.61Å; H46-F50 AromaticContact CD2-CZ 3.97Å; H46-F50 AromaticContact NE2-CE1 3.84Å; H46-F50 AromaticContact NE2-CZ 3.81Å; F50-L52 VanDerWaalsContact C-N 3.33Å; F50-L52 HydrophobicContact CB-CD1 4.28Å; F50-L52 HydrophobicContact CB-CD2 3.97Å; F50-L52 HydrophobicContact CB-CG 3.82Å; F50-L52 PolarHBondContact O-N 3.26Å; F50-L124 HydrophobicContact CD2-CB 4.12Å; F50-L124 HydrophobicContact CD2-CD2 4.11Å; F50-L124 WeakPolarHBondContact CD2-O 3.23Å; F50-L124 HydrophobicContact CE2-CD2 4.15Å; F50-L124 PolarHBondContact N-O 2.95Å
51N90.2Very high92.5Very high137 Ų13786.6 Ų86.673%0.73343%0.429SS*.  trans-79.185.4172.7-175.14.5000110.2P49 R53P49-N51 PolarHBondContact O-N 3.23Å; N51-R53 WeakPolarHBondContact OD1-CB 3.38Å; N51-R53 PolarHBondContact OD1-N 2.98Å
52L92.9Very high92.7Very high34 Ų3483.5 Ų83.518%0.17842%0.423CS..  trans-95.718.6-179.8-57.4-179.7000112.8F50 L55 M56 L121 L124 R125F50-L52 VanDerWaalsContact C-N 3.33Å; F50-L52 HydrophobicContact CB-CD1 4.28Å; F50-L52 HydrophobicContact CB-CD2 3.97Å; F50-L52 HydrophobicContact CB-CG 3.82Å; F50-L52 PolarHBondContact O-N 3.26Å; L52-L55 HydrophobicContact CB-CB 4.47Å; L52-L55 HydrophobicContact CD2-CD2 4.29Å; L52-L55 WeakPolarHBondContact O-CB 3.45Å; L52-L55 PolarHBondContact O-N 3.41Å; L52-M56 HydrophobicContact CB-CG 4.33Å; L52-M56 VanDerWaalsContact O-CG 3.27Å; L52-M56 WeakPolarHBondContact O-CG 3.39Å; L52-M56 PolarHBondContact O-N 3.43Å; L52-L121 HydrophobicContact CD1-CD2 3.86Å; L52-L124 HydrophobicContact CD1-CB 3.73Å; L52-L124 HydrophobicContact CD1-CD1 4.07Å; L52-R125 HydrophobicContact CB-CG 4.38Å; L52-R125 HydrophobicContact CD1-CG 4.21Å; L52-R125 HydrophobicContact CG-CG 4.46Å
53R90.7Very high92.8Very high113 Ų11379.9 Ų79.943%0.42641%0.405SS..Hα-helixtrans-56.5-48.7-171.8176.2171.3172.8-159.2-6.9113.9N51 L55 M56 I57 S180 A181N51-R53 WeakPolarHBondContact OD1-CB 3.38Å; N51-R53 PolarHBondContact OD1-N 2.98Å; R53-L55 VanDerWaalsContact C-N 3.32Å; R53-L55 PolarHBondContact O-N 3.02Å; R53-M56 PolarHBondContact O-N 3.34Å; R53-I57 HydrophobicContact CG-CD1 3.92Å; R53-I57 WeakPolarHBondContact O-CG1 3.43Å; R53-I57 PolarHBondContact O-N 2.98Å; R53-S180 WeakPolarHBondContact CG-O 3.44Å; R53-S180 PolarHBondContact NE-O 3.35Å; R53-A181 PolarHBondContact NH2-O 3.01Å
54P91.9Very high93.1Very high91 Ų9181.3 Ų81.359%0.59141%0.413SS*.Hα-helixtrans-60.2-43.5177.4-22.634.1000112M56 I57 V58P54-M56 PolarHBondContact O-N 3.3Å; P54-I57 PolarHBondContact O-N 2.94Å; P54-V58 WeakPolarHBondContact O-CG2 3.16Å; P54-V58 PolarHBondContact O-N 3.48Å; P54-V58 VanDerWaalsContact O-N 3.07Å
55L95.5Very high93.5Very high93 Ų9378 Ų7849%0.48740%0.404SS..Hα-helixtrans-59.6-46.9176.5177.664000111.5L52 R53 I57 V58 Y59 L121L52-L55 HydrophobicContact CB-CB 4.47Å; L52-L55 HydrophobicContact CD2-CD2 4.29Å; L52-L55 WeakPolarHBondContact O-CB 3.45Å; L52-L55 PolarHBondContact O-N 3.41Å; R53-L55 VanDerWaalsContact C-N 3.32Å; R53-L55 PolarHBondContact O-N 3.02Å; L55-I57 VanDerWaalsContact C-N 3.32Å; L55-I57 PolarHBondContact O-N 3.39Å; L55-V58 PolarHBondContact O-N 3.13Å; L55-Y59 WeakPolarHBondContact O-CB 3.31Å; L55-Y59 PolarHBondContact O-N 3.21Å; L55-L121 HydrophobicContact CD2-CD2 3.87Å; L55-L121 HydrophobicContact CG-CD2 4.5Å
56M94.2Very high93.8Very high7 Ų770.6 Ų70.63%0.03437%0.373CS..Hα-helixtrans-61-40.1178.1-68.8-68.8-4400112L52 R53 P54 N60 L121L52-M56 HydrophobicContact CB-CG 4.33Å; L52-M56 VanDerWaalsContact O-CG 3.27Å; L52-M56 WeakPolarHBondContact O-CG 3.39Å; L52-M56 PolarHBondContact O-N 3.43Å; R53-M56 PolarHBondContact O-N 3.34Å; P54-M56 PolarHBondContact O-N 3.3Å; M56-N60 WeakPolarHBondContact O-CB 3.5Å; M56-N60 PolarHBondContact O-N 3.13Å; M56-N60 PolarHBondContact O-ND2 2.86Å; M56-L121 HydrophobicContact CE-CD1 4.45Å; M56-L121 HydrophobicContact SD-CB 3.7Å; M56-L121 HydrophobicContact SD-CD1 3.76Å; M56-L121 HydrophobicContact SD-CD2 4.16Å; M56-L121 HydrophobicContact SD-CG 4.08Å
57I93.9Very high94.3Very high53 Ų5367.5 Ų67.527%0.27236%0.359SS..Hα-helixtrans-64.3-50.7179.4-69.2166.5000109.5R53 P54 L55 N60 I61R53-I57 HydrophobicContact CG-CD1 3.92Å; R53-I57 WeakPolarHBondContact O-CG1 3.43Å; R53-I57 PolarHBondContact O-N 2.98Å; P54-I57 PolarHBondContact O-N 2.94Å; L55-I57 VanDerWaalsContact C-N 3.32Å; L55-I57 PolarHBondContact O-N 3.39Å; I57-N60 PolarHBondContact O-N 3.02Å; I57-I61 HydrophobicContact CG2-CD1 3.72Å; I57-I61 WeakPolarHBondContact O-CB 3.31Å; I57-I61 VanDerWaalsContact O-CG1 3.26Å; I57-I61 WeakPolarHBondContact O-CG1 3.4Å; I57-I61 PolarHBondContact O-N 3.2Å
58V96.4Very high95.2Very high91 Ų9161.7 Ų61.755%0.55234%0.338SS*.Hα-helixtrans-59.5-50.4177.91750000110.4P54 L55 N60 I61 S62P54-V58 WeakPolarHBondContact O-CG2 3.16Å; P54-V58 PolarHBondContact O-N 3.48Å; P54-V58 VanDerWaalsContact O-N 3.07Å; L55-V58 PolarHBondContact O-N 3.13Å; V58-N60 PolarHBondContact O-N 3.39Å; V58-I61 PolarHBondContact O-N 3.07Å; V58-S62 WeakPolarHBondContact O-CB 3.43Å; V58-S62 PolarHBondContact O-N 2.64Å; V58-S62 PolarHBondContact O-OG 3.1Å
59Y97.9Very high95.7Very high30 Ų3062.1 Ų62.112%0.11833%0.33CS..Hα-helixtrans-56.8-49.6-179.5176-95.6000112.8L55 S62 L63 I114 F117 D118 L121L55-Y59 WeakPolarHBondContact O-CB 3.31Å; L55-Y59 PolarHBondContact O-N 3.21Å; Y59-S62 WeakPolarHBondContact O-CB 3.48Å; Y59-S62 PolarHBondContact O-N 3.05Å; Y59-L63 HydrophobicContact CD1-CD1 4.09Å; Y59-L63 HydrophobicContact CE1-CD1 3.4Å; Y59-L63 VanDerWaalsContact CE1-CD1 3.4Å; Y59-L63 HydrophobicContact CE1-CG 4.44Å; Y59-L63 HydrophobicContact CE2-CD1 4Å; Y59-L63 PolarHBondContact O-N 3.22Å; Y59-L63 WeakPolarHBondContact OH-CD1 3.44Å; Y59-I114 HydrophobicContact CE2-CG2 4.17Å; Y59-I114 PolarHBondContact OH-O 3.37Å; Y59-F117 HydrophobicContact CE2-CB 4.05Å; Y59-D118 WeakPolarHBondContact CE1-OD1 3.19Å; Y59-D118 PolarHBondContact OH-N 2.83Å; Y59-D118 PolarHBondContact OH-OD1 3.32Å; Y59-L121 HydrophobicContact CD1-CD1 3.76Å; Y59-L121 HydrophobicContact CD2-CD1 4.26Å; Y59-L121 HydrophobicContact CE1-CD1 3.81Å; Y59-L121 HydrophobicContact CE2-CD1 4.3Å; Y59-L121 HydrophobicContact CG-CD1 3.98Å
60N97.8Very high96.1Very high2 Ų258.6 Ų58.61%0.01131%0.307CS..Hα-helixtrans-66.6-40.7179.2-75.6-64.6000111.9M56 I57 V58 S62 L63 V64 Y173 Y176M56-N60 WeakPolarHBondContact O-CB 3.5Å; M56-N60 PolarHBondContact O-N 3.13Å; M56-N60 PolarHBondContact O-ND2 2.86Å; I57-N60 PolarHBondContact O-N 3.02Å; V58-N60 PolarHBondContact O-N 3.39Å; N60-S62 VanDerWaalsContact C-N 3.32Å; N60-S62 PolarHBondContact O-N 2.91Å; N60-L63 PolarHBondContact O-N 3.34Å; N60-V64 WeakPolarHBondContact O-CG2 3.22Å; N60-V64 PolarHBondContact O-N 3.44Å; N60-Y173 WeakPolarHBondContact OD1-CD1 3.48Å; N60-Y176 WeakPolarHBondContact OD1-CB 3.32Å
61I97.3Very high96.5Very high95 Ų9556.1 Ų56.149%0.48730%0.299SS..Hα-helixtrans-60.8-44.9175.4-70.6169.1000110I57 V58 L63 V64 L65I57-I61 HydrophobicContact CG2-CD1 3.72Å; I57-I61 WeakPolarHBondContact O-CB 3.31Å; I57-I61 VanDerWaalsContact O-CG1 3.26Å; I57-I61 WeakPolarHBondContact O-CG1 3.4Å; I57-I61 PolarHBondContact O-N 3.2Å; V58-I61 PolarHBondContact O-N 3.07Å; I61-L63 VanDerWaalsContact C-N 3.3Å; I61-L63 PolarHBondContact O-N 3.5Å; I61-V64 PolarHBondContact O-N 3.47Å; I61-L65 HydrophobicContact CG2-CD1 4.15Å; I61-L65 HydrophobicContact CG2-CG 4.47Å; I61-L65 WeakPolarHBondContact O-CG 3.32Å; I61-L65 PolarHBondContact O-N 3.2Å
62S98.4Very high96.9Very high62 Ų6255.8 Ų55.843%0.43429%0.288SS..Hα-helixtrans-57.9-41.6175.4-63.10000112V58 Y59 N60 L65 L66V58-S62 WeakPolarHBondContact O-CB 3.43Å; V58-S62 PolarHBondContact O-N 2.64Å; V58-S62 PolarHBondContact O-OG 3.1Å; Y59-S62 WeakPolarHBondContact O-CB 3.48Å; Y59-S62 PolarHBondContact O-N 3.05Å; N60-S62 VanDerWaalsContact C-N 3.32Å; N60-S62 PolarHBondContact O-N 2.91Å; S62-L65 PolarHBondContact O-N 3.38Å; S62-L66 VanDerWaalsContact O-CB 3.32Å; S62-L66 WeakPolarHBondContact O-CB 3.48Å; S62-L66 PolarHBondContact O-N 2.9Å
63L98.6Very high97.2Very high4 Ų455.1 Ų55.12%0.02129%0.285CS..Hα-helixtrans-74.1-29.6178-70.8-178000114Y59 N60 I61 L66 S67 I114 Y173Y59-L63 HydrophobicContact CD1-CD1 4.09Å; Y59-L63 HydrophobicContact CE1-CD1 3.4Å; Y59-L63 VanDerWaalsContact CE1-CD1 3.4Å; Y59-L63 HydrophobicContact CE1-CG 4.44Å; Y59-L63 HydrophobicContact CE2-CD1 4Å; Y59-L63 PolarHBondContact O-N 3.22Å; Y59-L63 WeakPolarHBondContact OH-CD1 3.44Å; N60-L63 PolarHBondContact O-N 3.34Å; I61-L63 VanDerWaalsContact C-N 3.3Å; I61-L63 PolarHBondContact O-N 3.5Å; L63-L66 HydrophobicContact CD2-CD2 3.97Å; L63-S67 WeakPolarHBondContact O-CB 3.31Å; L63-S67 PolarHBondContact O-N 2.96Å; L63-S67 PolarHBondContact O-OG 2.94Å; L63-I114 HydrophobicContact CD2-CG2 3.94Å; L63-Y173 HydrophobicContact CB-CD1 3.86Å; L63-Y173 HydrophobicContact CB-CD2 3.53Å; L63-Y173 HydrophobicContact CB-CE1 4.19Å; L63-Y173 HydrophobicContact CB-CE2 3.86Å; L63-Y173 HydrophobicContact CB-CG 3.55Å; L63-Y173 HydrophobicContact CD1-CD1 3.76Å; L63-Y173 HydrophobicContact CD1-CD2 4.32Å; L63-Y173 HydrophobicContact CD1-CE1 3.32Å; L63-Y173 HydrophobicContact CD1-CE2 3.92Å; L63-Y173 HydrophobicContact CD1-CG 4.26Å; L63-Y173 VanDerWaalsContact CD1-CZ 3.43Å; L63-Y173 HydrophobicContact CG-CD1 4.48Å; L63-Y173 HydrophobicContact CG-CE1 4.39Å; L63-Y173 HydrophobicContact CG-CE2 4.4Å
64V98.7Very high97.5Very high30 Ų3049.8 Ų49.818%0.18226%0.264CS..Hα-helixtrans-63.3-46.1168.51720000110.4N60 I61 S68 Y173 T174N60-V64 WeakPolarHBondContact O-CG2 3.22Å; N60-V64 PolarHBondContact O-N 3.44Å; I61-V64 PolarHBondContact O-N 3.47Å; V64-S68 VanDerWaalsContact O-CB 3.22Å; V64-S68 WeakPolarHBondContact O-CB 3.44Å; V64-S68 PolarHBondContact O-N 3.08Å; V64-S68 PolarHBondContact O-OG 3.1Å; V64-Y173 VanDerWaalsContact CG2-C 3.42Å; V64-T174 WeakPolarHBondContact CG2-OG1 2.97Å
65L98.7Very high97.9Very high115 Ų11545.9 Ų45.960%0.60224%0.24SC*.Hα-helixtrans-64.9-46.2178.6-67.7175.2000111.1I61 S62 S68 W69I61-L65 HydrophobicContact CG2-CD1 4.15Å; I61-L65 HydrophobicContact CG2-CG 4.47Å; I61-L65 WeakPolarHBondContact O-CG 3.32Å; I61-L65 PolarHBondContact O-N 3.2Å; S62-L65 PolarHBondContact O-N 3.38Å; L65-S68 PolarHBondContact O-N 3.48Å; L65-W69 VanDerWaalsContact O-CB 3.27Å; L65-W69 WeakPolarHBondContact O-CB 3.31Å; L65-W69 PolarHBondContact O-N 2.9Å
66L98.7Very high98Very high37 Ų3743.1 Ų43.119%0.19423%0.227CC..Hα-helixtrans-60.7-47.7177.2179.563.2000111.5S62 L63 W69 L70 I114S62-L66 VanDerWaalsContact O-CB 3.32Å; S62-L66 WeakPolarHBondContact O-CB 3.48Å; S62-L66 PolarHBondContact O-N 2.9Å; L63-L66 HydrophobicContact CD2-CD2 3.97Å; L66-W69 HydrophobicContact CD1-CE3 3.98Å; L66-W69 HydrophobicContact CD1-CZ3 4.21Å; L66-W69 PolarHBondContact O-N 3.35Å; L66-L70 HydrophobicContact CD1-CD1 4.34Å; L66-L70 HydrophobicContact CG-CD1 4.19Å; L66-L70 WeakPolarHBondContact O-CG 3.42Å; L66-L70 PolarHBondContact O-N 2.86Å; L66-I114 HydrophobicContact CD2-CD1 4.32Å
67S98.8Very high98.1Very high3 Ų342.9 Ų42.92%0.02123%0.226CC..Hα-helixtrans-64.7-45.3179.8-580000111.1L63 W69 L70 V71L63-S67 WeakPolarHBondContact O-CB 3.31Å; L63-S67 PolarHBondContact O-N 2.96Å; L63-S67 PolarHBondContact O-OG 2.94Å; S67-W69 VanDerWaalsContact C-N 3.34Å; S67-W69 PolarHBondContact O-N 3.4Å; S67-L70 PolarHBondContact O-N 3.5Å; S67-V71 WeakPolarHBondContact O-CG2 3.24Å; S67-V71 PolarHBondContact O-N 3.33Å
68S98.8Very high98.3Very high54 Ų5440.4 Ų40.438%0.37821%0.214SC..Hα-helixtrans-62.1-40.6177-59.80000112.3V64 L65 V71 Y72V64-S68 VanDerWaalsContact O-CB 3.22Å; V64-S68 WeakPolarHBondContact O-CB 3.44Å; V64-S68 PolarHBondContact O-N 3.08Å; V64-S68 PolarHBondContact O-OG 3.1Å; L65-S68 PolarHBondContact O-N 3.48Å; S68-V71 WeakPolarHBondContact O-CB 3.42Å; S68-V71 PolarHBondContact O-N 3.19Å; S68-Y72 PolarHBondContact O-N 3.43Å; S68-Y72 VanDerWaalsContact O-N 3.07Å
69W98.8Very high98.3Very high93 Ų9337.1 Ų37.135%0.35219%0.191SC..Hα-helixtrans-64.6-42.8174.2173.867000111.6L65 L66 S67 V71 Y72 E73 F107L65-W69 VanDerWaalsContact O-CB 3.27Å; L65-W69 WeakPolarHBondContact O-CB 3.31Å; L65-W69 PolarHBondContact O-N 2.9Å; L66-W69 HydrophobicContact CD1-CE3 3.98Å; L66-W69 HydrophobicContact CD1-CZ3 4.21Å; L66-W69 PolarHBondContact O-N 3.35Å; S67-W69 VanDerWaalsContact C-N 3.34Å; S67-W69 PolarHBondContact O-N 3.4Å; W69-V71 VanDerWaalsContact C-N 3.32Å; W69-V71 PolarHBondContact O-N 2.89Å; W69-Y72 WeakPolarHBondContact O-CB 3.49Å; W69-Y72 PolarHBondContact O-N 3.23Å; W69-Y72 VanDerWaalsContact O-N 3.16Å; W69-E73 HydrophobicContact CD2-CG 4Å; W69-E73 VanDerWaalsContact CE2-CG 3.45Å; W69-E73 HydrophobicContact CG-CG 4.35Å; W69-E73 HydrophobicContact CH2-CG 4.46Å; W69-E73 HydrophobicContact CZ2-CG 3.73Å; W69-E73 PolarHBondContact NE1-OE1 2.86Å; W69-E73 WeakPolarHBondContact O-CB 3.27Å; W69-E73 WeakPolarHBondContact O-CG 3.45Å; W69-E73 PolarHBondContact O-N 3.27Å; W69-F107 HydrophobicContact CH2-CB 4.17Å; W69-F107 AromaticContact CH2-CD1 3.98Å; W69-F107 HydrophobicContact CH2-CD1 3.98Å; W69-F107 AromaticContact CH2-CD2 3.56Å; W69-F107 HydrophobicContact CH2-CD2 3.56Å; W69-F107 HydrophobicContact CH2-CE1 4.21Å; W69-F107 AromaticContact CH2-CE2 3.83Å; W69-F107 HydrophobicContact CH2-CE2 3.83Å; W69-F107 AromaticContact CH2-CG 3.64Å; W69-F107 HydrophobicContact CH2-CG 3.64Å; W69-F107 HydrophobicContact CH2-CZ 4.14Å; W69-F107 HydrophobicContact CZ3-CB 3.85Å; W69-F107 AromaticContact CZ3-CD1 3.9Å; W69-F107 HydrophobicContact CZ3-CD1 3.9Å; W69-F107 HydrophobicContact CZ3-CD2 4.11Å; W69-F107 HydrophobicContact CZ3-CE1 4.45Å; W69-F107 AromaticContact CZ3-CG 3.7Å; W69-F107 HydrophobicContact CZ3-CG 3.7Å
70L98.8Very high98.2Very high1 Ų142.2 Ų42.21%0.00522%0.22CC..Hα-helixtrans-63.2-36.1174.3-72.2168000112.5L66 S67 E73 F74 T104 F107 F108 C166L66-L70 HydrophobicContact CD1-CD1 4.34Å; L66-L70 HydrophobicContact CG-CD1 4.19Å; L66-L70 WeakPolarHBondContact O-CG 3.42Å; L66-L70 PolarHBondContact O-N 2.86Å; S67-L70 PolarHBondContact O-N 3.5Å; L70-E73 PolarHBondContact O-N 3.39Å; L70-F74 HydrophobicContact CB-CD2 4.42Å; L70-F74 HydrophobicContact CB-CE2 4.47Å; L70-F74 WeakPolarHBondContact O-CB 3.23Å; L70-F74 WeakPolarHBondContact O-CD2 3.5Å; L70-F74 PolarHBondContact O-N 3.43Å; L70-T104 HydrophobicContact CD2-CG2 3.98Å; L70-F107 HydrophobicContact CD2-CB 3.85Å; L70-F108 HydrophobicContact CD1-CB 4.42Å; L70-F108 HydrophobicContact CD1-CD2 4.2Å; L70-F108 HydrophobicContact CD2-CB 4.37Å; L70-C166 HydrophobicContact CB-CB 4.24Å; L70-C166 WeakPolarHBondContact CB-SG 3.32Å
71V98.9Very high98Very high34 Ų3446.4 Ų46.421%0.20625%0.246CC..Hα-helixtrans-57.4-51.2171.3172.70000109.9S67 S68 W69 E73 F74 A75 F163 C166 I167S67-V71 WeakPolarHBondContact O-CG2 3.24Å; S67-V71 PolarHBondContact O-N 3.33Å; S68-V71 WeakPolarHBondContact O-CB 3.42Å; S68-V71 PolarHBondContact O-N 3.19Å; W69-V71 VanDerWaalsContact C-N 3.32Å; W69-V71 PolarHBondContact O-N 2.89Å; V71-E73 PolarHBondContact O-N 3.18Å; V71-F74 PolarHBondContact O-N 2.83Å; V71-A75 WeakPolarHBondContact O-CB 3.48Å; V71-A75 PolarHBondContact O-N 3.27Å; V71-F163 HydrophobicContact CB-CE2 4.49Å; V71-F163 HydrophobicContact CG1-CD2 4.5Å; V71-F163 HydrophobicContact CG1-CE2 3.76Å; V71-F163 WeakPolarHBondContact O-CE2 3.43Å; V71-C166 VanDerWaalsContact CG2-C 3.49Å; V71-C166 HydrophobicContact CG2-CB 3.49Å; V71-C166 VanDerWaalsContact CG2-CB 3.49Å; V71-I167 HydrophobicContact CB-CG1 4.44Å; V71-I167 HydrophobicContact CG1-CG1 3.89Å; V71-I167 HydrophobicContact CG2-CB 4.3Å; V71-I167 HydrophobicContact CG2-CG1 3.61Å
72Y98.8Very high97.7Very high129 Ų12945 Ų4551%0.50625%0.254SS..Hα-helixtrans-58.2-48.8177.4169.1-99.6000111.4S68 W69 A75 V76S68-Y72 PolarHBondContact O-N 3.43Å; S68-Y72 VanDerWaalsContact O-N 3.07Å; W69-Y72 WeakPolarHBondContact O-CB 3.49Å; W69-Y72 PolarHBondContact O-N 3.23Å; W69-Y72 VanDerWaalsContact O-N 3.16Å; Y72-A75 WeakPolarHBondContact O-CB 3.45Å; Y72-A75 PolarHBondContact O-N 3.48Å; Y72-V76 HydrophobicContact CD2-CG1 3.99Å; Y72-V76 HydrophobicContact CE1-CG2 4.17Å; Y72-V76 HydrophobicContact CE2-CG1 3.58Å; Y72-V76 VanDerWaalsContact O-CG2 3.31Å; Y72-V76 WeakPolarHBondContact O-CG2 3.31Å; Y72-V76 PolarHBondContact O-N 3.33Å
73E98.8Very high97.6Very high21 Ų2143.9 Ų43.910%0.09824%0.241CC..Hα-helixtrans-62.5-45.6-178.6-74-60140.400112.5W69 L70 V71 A75 S77 R100 T104W69-E73 HydrophobicContact CD2-CG 4Å; W69-E73 VanDerWaalsContact CE2-CG 3.45Å; W69-E73 HydrophobicContact CG-CG 4.35Å; W69-E73 HydrophobicContact CH2-CG 4.46Å; W69-E73 HydrophobicContact CZ2-CG 3.73Å; W69-E73 PolarHBondContact NE1-OE1 2.86Å; W69-E73 WeakPolarHBondContact O-CB 3.27Å; W69-E73 WeakPolarHBondContact O-CG 3.45Å; W69-E73 PolarHBondContact O-N 3.27Å; L70-E73 PolarHBondContact O-N 3.39Å; V71-E73 PolarHBondContact O-N 3.18Å; E73-A75 VanDerWaalsContact C-N 3.34Å; E73-A75 PolarHBondContact O-N 2.96Å; E73-S77 WeakPolarHBondContact O-CB 3.34Å; E73-S77 PolarHBondContact O-N 2.8Å; E73-S77 PolarHBondContact O-OG 3.29Å; E73-R100 VanDerWaalsContact CD-NH2 3.33Å; E73-R100 IonicContact OE1-CZ 2.93Å; E73-R100 IonicContact OE1-NE 2.92Å; E73-R100 IonicContact OE1-NH2 3.97Å; E73-R100 PolarHBondContact OE1-NH2 2.86Å; E73-R100 IonicContact OE2-CZ 3.47Å; E73-R100 IonicContact OE2-NE 2.68Å; E73-R100 PolarHBondContact OE2-NE 2.93Å; E73-R100 IonicContact OE2-NH2 2.78Å; E73-R100 PolarHBondContact OE2-NH2 3.34Å; E73-R100 VanDerWaalsContact OE2-NH2 3.15Å; E73-T104 HydrophobicContact CB-CG2 3.58Å
74F98.7Very high97.4Very high0 Ų046.8 Ų46.80%026%0.261CS..Hα-helixtrans-63.6-40175.5-83.1-58000112.2L70 V71 G78 W79 M101 T104 F108 T159 A162 F163L70-F74 HydrophobicContact CB-CD2 4.42Å; L70-F74 HydrophobicContact CB-CE2 4.47Å; L70-F74 WeakPolarHBondContact O-CB 3.23Å; L70-F74 WeakPolarHBondContact O-CD2 3.5Å; L70-F74 PolarHBondContact O-N 3.43Å; V71-F74 PolarHBondContact O-N 2.83Å; F74-G78 PolarHBondContact O-N 3.12Å; F74-W79 PolarHBondContact O-N 3.07Å; F74-M101 HydrophobicContact CD1-CE 4.34Å; F74-M101 HydrophobicContact CD1-SD 3.72Å; F74-M101 HydrophobicContact CE1-SD 3.94Å; F74-T104 HydrophobicContact CB-CG2 4.47Å; F74-T104 HydrophobicContact CD1-CG2 3.63Å; F74-T104 HydrophobicContact CD2-CG2 3.77Å; F74-T104 HydrophobicContact CE1-CG2 3.63Å; F74-T104 HydrophobicContact CE2-CG2 3.77Å; F74-T104 HydrophobicContact CG-CG2 3.68Å; F74-T104 HydrophobicContact CZ-CG2 3.69Å; F74-F108 HydrophobicContact CE2-CB 4.11Å; F74-F108 AromaticContact CE2-CD2 3.79Å; F74-F108 HydrophobicContact CE2-CD2 3.79Å; F74-F108 HydrophobicContact CE2-CG 4.18Å; F74-F108 HydrophobicContact CZ-CB 3.94Å; F74-F108 HydrophobicContact CZ-CD2 4.24Å; F74-F108 HydrophobicContact CZ-CG 4.19Å; F74-T159 HydrophobicContact CE1-CG2 4.31Å; F74-A162 HydrophobicContact CE1-CB 4.21Å; F74-A162 HydrophobicContact CE2-CB 3.85Å; F74-A162 HydrophobicContact CZ-CB 3.59Å; F74-F163 HydrophobicContact CB-CB 3.92Å; F74-F163 HydrophobicContact CB-CD2 3.54Å; F74-F163 HydrophobicContact CB-CE2 4.37Å; F74-F163 HydrophobicContact CB-CG 4.02Å; F74-F163 HydrophobicContact CD2-CB 4.39Å; F74-F163 HydrophobicContact CG-CB 4.13Å; F74-F163 HydrophobicContact CG-CD2 4.45Å
75A98.6Very high97.2Very high9 Ų950.2 Ų50.27%0.07428%0.278CS..Iπ-helixtrans-61.4-54.7178.300000111.3V71 Y72 E73 S77 G78 W79 L80 F163V71-A75 WeakPolarHBondContact O-CB 3.48Å; V71-A75 PolarHBondContact O-N 3.27Å; Y72-A75 WeakPolarHBondContact O-CB 3.45Å; Y72-A75 PolarHBondContact O-N 3.48Å; E73-A75 VanDerWaalsContact C-N 3.34Å; E73-A75 PolarHBondContact O-N 2.96Å; A75-S77 PolarHBondContact O-N 2.79Å; A75-G78 PolarHBondContact O-N 3.36Å; A75-W79 PolarHBondContact O-N 2.93Å; A75-L80 HydrophobicContact CB-CB 4.37Å; A75-L80 HydrophobicContact CB-CD1 3.73Å; A75-L80 HydrophobicContact CB-CG 3.81Å; A75-L80 PolarHBondContact O-N 3.35Å; A75-F163 HydrophobicContact CB-CE2 4.01Å; A75-F163 HydrophobicContact CB-CZ 4.22Å
76V98.1Very high97Very high36 Ų3645 Ų4522%0.21825%0.253CS..Iπ-helixtrans-77.1-22.9-176.3-56.10000113.3Y72 G78 T81 I97 R100Y72-V76 HydrophobicContact CD2-CG1 3.99Å; Y72-V76 HydrophobicContact CE1-CG2 4.17Å; Y72-V76 HydrophobicContact CE2-CG1 3.58Å; Y72-V76 VanDerWaalsContact O-CG2 3.31Å; Y72-V76 WeakPolarHBondContact O-CG2 3.31Å; Y72-V76 PolarHBondContact O-N 3.33Å; V76-G78 VanDerWaalsContact C-N 3.29Å; V76-T81 WeakPolarHBondContact O-CG2 3.48Å; V76-T81 PolarHBondContact O-OG1 3.45Å; V76-I97 WeakPolarHBondContact O-CD1 3.46Å; V76-R100 VanDerWaalsContact CG2-NH2 3.33Å
77S97.5Very high96.8Very high1 Ų145.2 Ų45.21%0.00726%0.257CS..Iπ-helixtrans-76.8-14.6176.9-59.40000113.8E73 A75 I97 R100E73-S77 WeakPolarHBondContact O-CB 3.34Å; E73-S77 PolarHBondContact O-N 2.8Å; E73-S77 PolarHBondContact O-OG 3.29Å; A75-S77 PolarHBondContact O-N 2.79Å; S77-I97 WeakPolarHBondContact O-CG1 3.25Å; S77-R100 WeakPolarHBondContact OG-CD 3.14Å; S77-R100 VanDerWaalsContact OG-CG 3.24Å; S77-R100 WeakPolarHBondContact OG-CG 3.31Å
78G96.3Very high96.6Very high2 Ų247 Ų472%0.02126%0.264CS..Iπ-helixtrans-176.7-51.9176.600000114.1F74 A75 V76 L80 T81 G82 Y83F74-G78 PolarHBondContact O-N 3.12Å; A75-G78 PolarHBondContact O-N 3.36Å; V76-G78 VanDerWaalsContact C-N 3.29Å; G78-L80 PolarHBondContact O-N 3.45Å; G78-L80 VanDerWaalsContact O-N 3.08Å; G78-T81 WeakPolarHBondContact CA-OG1 3.36Å; G78-T81 PolarHBondContact N-OG1 3.03Å; G78-T81 PolarHBondContact O-N 3.29Å; G78-G82 PolarHBondContact O-N 2.93Å; G78-Y83 WeakPolarHBondContact O-CB 3.41Å; G78-Y83 PolarHBondContact O-N 3.08Å
79W97.4Very high96.4Very high21 Ų2146.2 Ų46.28%0.0826%0.259CS..Iπ-helixtrans-65.4-20.2-164.1-69.5111.1000115.6F74 A75 Y83 L85 T159 F160 F163F74-W79 PolarHBondContact O-N 3.07Å; A75-W79 PolarHBondContact O-N 2.93Å; W79-Y83 HydrophobicContact CD2-CD2 4.14Å; W79-Y83 AromaticContact CE2-CD2 3.81Å; W79-Y83 HydrophobicContact CE3-CD2 4.45Å; W79-Y83 HydrophobicContact CH2-CD2 4.16Å; W79-Y83 AromaticContact CZ2-CD2 3.81Å; W79-Y83 HydrophobicContact CZ2-CD2 3.81Å; W79-Y83 HydrophobicContact CZ3-CD2 4.47Å; W79-L85 HydrophobicContact CE3-CD2 4.35Å; W79-L85 HydrophobicContact CZ3-CD2 4.05Å; W79-T159 VanDerWaalsContact CZ2-OG1 3.31Å; W79-T159 WeakPolarHBondContact CZ2-OG1 3.45Å; W79-T159 PolarHBondContact NE1-OG1 2.85Å; W79-F160 AromaticContact CD2-CD2 3.86Å; W79-F160 HydrophobicContact CD2-CD2 3.86Å; W79-F160 AromaticContact CE3-CD2 3.71Å; W79-F160 HydrophobicContact CE3-CD2 3.71Å; W79-F160 HydrophobicContact CE3-CE2 4.32Å; W79-F160 HydrophobicContact CH2-CB 3.55Å; W79-F160 AromaticContact CH2-CD2 3.94Å; W79-F160 HydrophobicContact CH2-CD2 3.94Å; W79-F160 HydrophobicContact CH2-CG 4.03Å; W79-F160 VanDerWaalsContact CZ2-CA 3.42Å; W79-F160 HydrophobicContact CZ2-CB 3.38Å; W79-F160 HydrophobicContact CZ2-CD2 4.08Å; W79-F160 HydrophobicContact CZ2-CG 4.17Å; W79-F160 VanDerWaalsContact CZ2-N 3.25Å; W79-F160 HydrophobicContact CZ3-CB 4.25Å; W79-F160 AromaticContact CZ3-CD2 3.74Å; W79-F160 HydrophobicContact CZ3-CD2 3.74Å; W79-F160 HydrophobicContact CZ3-CG 4.24Å; W79-F163 HydrophobicContact CB-CD1 4.04Å; W79-F163 HydrophobicContact CB-CE1 4.09Å; W79-F163 HydrophobicContact CG-CD1 4.03Å; W79-F163 HydrophobicContact CG-CG 4.38Å
80L95.6Very high96.3Very high138 Ų13842.4 Ų42.472%0.72325%0.246SC*.THydrogen-bonded Turntrans-116.14.5171.7-61.2-171.9000113.6A75 G78A75-L80 HydrophobicContact CB-CB 4.37Å; A75-L80 HydrophobicContact CB-CD1 3.73Å; A75-L80 HydrophobicContact CB-CG 3.81Å; A75-L80 PolarHBondContact O-N 3.35Å; G78-L80 PolarHBondContact O-N 3.45Å; G78-L80 VanDerWaalsContact O-N 3.08Å
81T93.1Very high96.2Very high90 Ų9045.3 Ų45.355%0.55226%0.261SS*.THydrogen-bonded Turntrans-125.8-18.2-173.152.90000114.8V76 G78V76-T81 WeakPolarHBondContact O-CG2 3.48Å; V76-T81 PolarHBondContact O-OG1 3.45Å; G78-T81 WeakPolarHBondContact CA-OG1 3.36Å; G78-T81 PolarHBondContact N-OG1 3.03Å; G78-T81 PolarHBondContact O-N 3.29Å
82G91.1Very high96Very high64 Ų6448.3 Ų48.366%0.6627%0.27SS*.THydrogen-bonded Turntrans176-7.9176.900000117.4G78G78-G82 PolarHBondContact O-N 2.93Å
83Y96.4Very high95.9Very high40 Ų4044.1 Ų44.116%0.15726%0.259CS..  trans-71.6138.8174.3-81.618000110.9G78 W79 Q88 M101 G156G78-Y83 WeakPolarHBondContact O-CB 3.41Å; G78-Y83 PolarHBondContact O-N 3.08Å; W79-Y83 HydrophobicContact CD2-CD2 4.14Å; W79-Y83 AromaticContact CE2-CD2 3.81Å; W79-Y83 HydrophobicContact CE3-CD2 4.45Å; W79-Y83 HydrophobicContact CH2-CD2 4.16Å; W79-Y83 AromaticContact CZ2-CD2 3.81Å; W79-Y83 HydrophobicContact CZ2-CD2 3.81Å; W79-Y83 HydrophobicContact CZ3-CD2 4.47Å; Y83-Q88 HydrophobicContact CD1-CG 4.01Å; Y83-Q88 HydrophobicContact CD2-CG 3.71Å; Y83-Q88 HydrophobicContact CE1-CG 4.27Å; Y83-Q88 HydrophobicContact CE2-CG 3.96Å; Y83-Q88 HydrophobicContact CG-CG 3.71Å; Y83-M101 HydrophobicContact CD2-CE 4.2Å; Y83-M101 HydrophobicContact CE2-CE 3.64Å; Y83-G156 PolarHBondContact OH-N 3.17Å
84S94.1Very high95.8Very high64 Ų6452.3 Ų52.345%0.44829%0.289SS..  trans-89.7147.9172.5-178.80000111.3G86S84-G86 PolarHBondContact O-N 3.41Å; S84-G86 PolarHBondContact OG-N 3.34Å; S84-G86 VanDerWaalsContact OG-N 3.1Å
85L94.4Very high95.7Very high102 Ų10260.4 Ų60.453%0.53432%0.32SS..SBendtrans-74.2-7.4168.4-67.6177.4000113.1W79 F160 H209W79-L85 HydrophobicContact CE3-CD2 4.35Å; W79-L85 HydrophobicContact CZ3-CD2 4.05Å; L85-F160 HydrophobicContact CD2-CD2 4.05Å; L85-F160 HydrophobicContact CD2-CE1 4.31Å; L85-F160 HydrophobicContact CD2-CE2 3.49Å; L85-F160 VanDerWaalsContact CD2-CE2 3.49Å; L85-F160 HydrophobicContact CD2-CZ 3.64Å; L85-H209 PolarHBondContact O-CD2 2.82Å
86G94.5Very high95.7Very high7 Ų765.4 Ų65.47%0.07235%0.352CS..SBendtrans-84.5-140.3170.900000112S84 Q88 T213S84-G86 PolarHBondContact O-N 3.41Å; S84-G86 PolarHBondContact OG-N 3.34Å; S84-G86 VanDerWaalsContact OG-N 3.1Å; G86-Q88 PolarHBondContact O-N 3.45Å; G86-T213 WeakPolarHBondContact O-CG2 3.39Å
87C94.4Very high95.6Very high41 Ų4167.3 Ų67.328%0.27736%0.36SS..  trans-67.5120.2173178.10000110.4I216 C219C87-I216 HydrophobicContact CB-CD1 4.15Å; C87-I216 HydrophobicContact CB-CG2 4.03Å; C87-C219 VanDerWaalsContact CA-SG 3.56Å; C87-C219 HydrophobicContact CB-CB 3.62Å; C87-C219 WeakPolarHBondContact CB-SG 3.39Å; C87-C219 WeakPolarHBondContact SG-CA 3.31Å; C87-C219 WeakPolarHBondContact SG-CB 3.49Å; C87-C219 CovalentContact SG-SG 2.03Å; C87-C219 PolarHBondContact SG-SG 3.17Å
88Q96.1Very high95.6Very high39 Ų3967.4 Ų67.418%0.18236%0.361CS..  trans-126.7101.6171.3-173.664.451.200109.6Y83 G86 G156 L157Y83-Q88 HydrophobicContact CD1-CG 4.01Å; Y83-Q88 HydrophobicContact CD2-CG 3.71Å; Y83-Q88 HydrophobicContact CE1-CG 4.27Å; Y83-Q88 HydrophobicContact CE2-CG 3.96Å; Y83-Q88 HydrophobicContact CG-CG 3.71Å; G86-Q88 PolarHBondContact O-N 3.45Å; Q88-G156 CarbonylContact O-C 3.51Å; Q88-G156 VanDerWaalsContact O-CA 3.25Å; Q88-G156 WeakPolarHBondContact O-CA 3.27Å; Q88-L157 HydrophobicContact CB-CB 4.15Å; Q88-L157 PolarHBondContact O-N 2.82Å
89S94.8Very high95.6Very high38 Ų3869.9 Ų69.927%0.26637%0.372SS..  trans-68.6160.1174.9-52.60000111.4N220S89-N220 WeakPolarHBondContact CB-O 3.41Å; S89-N220 PolarHBondContact OG-O 3.21Å
90V96.4Very high95.7Very high14 Ų1472.9 Ų72.99%0.08538%0.384CS..  trans-76.8125.4173.7-174.20000108.9Y92 V153 Y221V90-Y92 HydrophobicContact CB-CD2 4.26Å; V90-Y92 HydrophobicContact CB-CE1 4.24Å; V90-Y92 HydrophobicContact CB-CE2 3.66Å; V90-Y92 HydrophobicContact CG1-CD1 4.05Å; V90-Y92 HydrophobicContact CG1-CD2 4.27Å; V90-Y92 HydrophobicContact CG1-CE1 3.67Å; V90-Y92 HydrophobicContact CG1-CE2 3.93Å; V90-Y92 HydrophobicContact CG1-CG 4.33Å; V90-Y92 WeakPolarHBondContact O-CD2 3.31Å; V90-Y92 PolarHBondContact O-N 2.94Å; V90-V153 HydrophobicContact CG2-CB 3.93Å; V90-V153 HydrophobicContact CG2-CG1 4.16Å; V90-Y221 HydrophobicContact CG2-CD2 3.93Å; V90-Y221 HydrophobicContact CG2-CE2 3.79Å
91D95.6Very high95.8Very high61 Ų6166.4 Ų66.433%0.32635%0.35SS..  trans-82.6107.9168.1-177.7-6.2000108.6R11 S93 A98R11-D91 VanDerWaalsContact CZ-O 3.24Å; R11-D91 PolarHBondContact NH1-O 3.48Å; R11-D91 PolarHBondContact NH2-O 2.95Å; D91-S93 VanDerWaalsContact C-N 3.32Å; D91-S93 VanDerWaalsContact CG-OG 3.27Å; D91-S93 WeakPolarHBondContact OD1-CA 3.45Å; D91-S93 WeakPolarHBondContact OD1-CB 3.36Å; D91-S93 PolarHBondContact OD1-N 3.05Å; D91-S93 PolarHBondContact OD1-OG 3.23Å; D91-S93 PolarHBondContact OD2-OG 3.11Å; D91-A98 HydrophobicContact CB-CB 4.01Å
92Y96Very high96.1Very high98 Ų9862.1 Ų62.138%0.38432%0.323SS..  trans-86.73178.1-64.9-78.7000113.7D9 R11 V90 Y152D9-Y92 HydrophobicContact CB-CD1 4.43Å; D9-Y92 HydrophobicContact CB-CE1 4.41Å; D9-Y92 WeakPolarHBondContact OD2-CD1 3.33Å; R11-Y92 WeakPolarHBondContact CD-O 3.33Å; V90-Y92 HydrophobicContact CB-CD2 4.26Å; V90-Y92 HydrophobicContact CB-CE1 4.24Å; V90-Y92 HydrophobicContact CB-CE2 3.66Å; V90-Y92 HydrophobicContact CG1-CD1 4.05Å; V90-Y92 HydrophobicContact CG1-CD2 4.27Å; V90-Y92 HydrophobicContact CG1-CE1 3.67Å; V90-Y92 HydrophobicContact CG1-CE2 3.93Å; V90-Y92 HydrophobicContact CG1-CG 4.33Å; V90-Y92 WeakPolarHBondContact O-CD2 3.31Å; V90-Y92 PolarHBondContact O-N 2.94Å; Y92-Y152 PolarHBondContact OH-O 3.31Å
93S96.6Very high96.4Very high40 Ų4060.8 Ų60.828%0.2830%0.304SS..SBendtrans-69.7163.3176.775.60000111.6R11 D91 R95R11-S93 WeakPolarHBondContact CD-O 3.29Å; R11-S93 PolarHBondContact NH1-O 3.2Å; D91-S93 VanDerWaalsContact C-N 3.32Å; D91-S93 VanDerWaalsContact CG-OG 3.27Å; D91-S93 WeakPolarHBondContact OD1-CA 3.45Å; D91-S93 WeakPolarHBondContact OD1-CB 3.36Å; D91-S93 PolarHBondContact OD1-N 3.05Å; D91-S93 PolarHBondContact OD1-OG 3.23Å; D91-S93 PolarHBondContact OD2-OG 3.11Å; S93-R95 PolarHBondContact O-N 2.94Å; S93-R95 WeakPolarHBondContact OG-CB 3.4Å; S93-R95 VanDerWaalsContact OG-CG 3.28Å; S93-R95 WeakPolarHBondContact OG-CG 3.13Å; S93-R95 PolarHBondContact OG-N 3.36Å
94R96.8Very high96.5Very high193 Ų19359 Ų5973%0.72830%0.297SS*.  trans-89.722.1171.9-66.8-174.8174.7-174.8-1.5112.7R11 M99R11-R94 HydrophobicContact CG-CG 4.24Å; R94-M99 HydrophobicContact CB-CG 4.4Å; R94-M99 HydrophobicContact CB-SD 4.34Å; R94-M99 HydrophobicContact CG-SD 4.16Å
95R96.6Very high96.8Very high170 Ų17056 Ų5664%0.64228%0.276SS*.  trans-61.6146.8174.8-68.3179.787.5121.53.4109.6S93 I97 A98 M99S93-R95 PolarHBondContact O-N 2.94Å; S93-R95 WeakPolarHBondContact OG-CB 3.4Å; S93-R95 VanDerWaalsContact OG-CG 3.28Å; S93-R95 WeakPolarHBondContact OG-CG 3.13Å; S93-R95 PolarHBondContact OG-N 3.36Å; R95-I97 VanDerWaalsContact C-N 3.27Å; R95-I97 PolarHBondContact O-N 3.43Å; R95-I97 VanDerWaalsContact O-N 3.15Å; R95-A98 HydrophobicContact CB-CB 4.49Å; R95-A98 PolarHBondContact O-N 2.96Å; R95-M99 PolarHBondContact O-N 3.44Å
96P97Very high97Very high115 Ų11552.8 Ų52.875%0.74726%0.257SS*.Hα-helixtrans-52.8-42.1-175.3-29.735.5000113.9R100P96-R100 VanDerWaalsContact O-CB 3.3Å; P96-R100 WeakPolarHBondContact O-CB 3.49Å; P96-R100 PolarHBondContact O-N 3.41Å
97I96.6Very high97.2Very high75 Ų7556 Ų5639%0.38527%0.269SS..Hα-helixtrans-67.4-38.8180-165.867.5000113V76 S77 R95 R100 M101V76-I97 WeakPolarHBondContact O-CD1 3.46Å; S77-I97 WeakPolarHBondContact O-CG1 3.25Å; R95-I97 VanDerWaalsContact C-N 3.27Å; R95-I97 PolarHBondContact O-N 3.43Å; R95-I97 VanDerWaalsContact O-N 3.15Å; I97-R100 WeakPolarHBondContact O-CB 3.46Å; I97-R100 PolarHBondContact O-N 3.27Å; I97-M101 PolarHBondContact O-N 3Å
98A97.1Very high97.4Very high4 Ų454 Ų543%0.03326%0.256CS..Hα-helixtrans-70.6-42178.500000111.3D91 R95 R100 M101 A102D91-A98 HydrophobicContact CB-CB 4.01Å; R95-A98 HydrophobicContact CB-CB 4.49Å; R95-A98 PolarHBondContact O-N 2.96Å; A98-R100 VanDerWaalsContact C-N 3.31Å; A98-R100 PolarHBondContact O-N 2.93Å; A98-M101 PolarHBondContact O-N 2.82Å; A98-A102 WeakPolarHBondContact O-CB 3.36Å; A98-A102 PolarHBondContact O-N 2.9Å
99M98.2Very high97.5Very high53 Ų5352.1 Ų52.126%0.26125%0.247SC..Hα-helixtrans-63.8-37.8172.9-69.9-58-56.100111.9R11 W15 R94 R95 A102 S103R11-M99 HydrophobicContact CB-CE 4.27Å; R11-M99 HydrophobicContact CB-SD 4.07Å; R11-M99 HydrophobicContact CG-SD 4.01Å; W15-M99 HydrophobicContact CZ2-CE 3.91Å; R94-M99 HydrophobicContact CB-CG 4.4Å; R94-M99 HydrophobicContact CB-SD 4.34Å; R94-M99 HydrophobicContact CG-SD 4.16Å; R95-M99 PolarHBondContact O-N 3.44Å; M99-A102 PolarHBondContact O-N 3.5Å; M99-S103 VanDerWaalsContact O-CB 3.32Å; M99-S103 WeakPolarHBondContact O-CB 3.45Å; M99-S103 PolarHBondContact O-N 3Å
100R98.1Very high97.7Very high85 Ų8552.8 Ų52.832%0.32125%0.245SC..Hα-helixtrans-61.7-50.1175.1-163.5-176.9-177.9161.93.2110.6E73 V76 S77 P96 I97 A98 A102 S103 T104E73-R100 VanDerWaalsContact CD-NH2 3.33Å; E73-R100 IonicContact OE1-CZ 2.93Å; E73-R100 IonicContact OE1-NE 2.92Å; E73-R100 IonicContact OE1-NH2 3.97Å; E73-R100 PolarHBondContact OE1-NH2 2.86Å; E73-R100 IonicContact OE2-CZ 3.47Å; E73-R100 IonicContact OE2-NE 2.68Å; E73-R100 PolarHBondContact OE2-NE 2.93Å; E73-R100 IonicContact OE2-NH2 2.78Å; E73-R100 PolarHBondContact OE2-NH2 3.34Å; E73-R100 VanDerWaalsContact OE2-NH2 3.15Å; V76-R100 VanDerWaalsContact CG2-NH2 3.33Å; S77-R100 WeakPolarHBondContact OG-CD 3.14Å; S77-R100 VanDerWaalsContact OG-CG 3.24Å; S77-R100 WeakPolarHBondContact OG-CG 3.31Å; P96-R100 VanDerWaalsContact O-CB 3.3Å; P96-R100 WeakPolarHBondContact O-CB 3.49Å; P96-R100 PolarHBondContact O-N 3.41Å; I97-R100 WeakPolarHBondContact O-CB 3.46Å; I97-R100 PolarHBondContact O-N 3.27Å; A98-R100 VanDerWaalsContact C-N 3.31Å; A98-R100 PolarHBondContact O-N 2.93Å; R100-A102 VanDerWaalsContact C-N 3.35Å; R100-A102 PolarHBondContact O-N 3.14Å; R100-S103 WeakPolarHBondContact O-CB 3.41Å; R100-S103 PolarHBondContact O-N 3.39Å; R100-T104 PolarHBondContact O-N 2.92Å; R100-T104 PolarHBondContact O-OG1 3.24Å
101M98.4Very high97.8Very high1 Ų152.2 Ų52.21%0.00524%0.242CC..Hα-helixtrans-58-45.3175.6-177.657.376.800112.4F74 Y83 I97 A98 S103 T104 C105 T159F74-M101 HydrophobicContact CD1-CE 4.34Å; F74-M101 HydrophobicContact CD1-SD 3.72Å; F74-M101 HydrophobicContact CE1-SD 3.94Å; Y83-M101 HydrophobicContact CD2-CE 4.2Å; Y83-M101 HydrophobicContact CE2-CE 3.64Å; I97-M101 PolarHBondContact O-N 3Å; A98-M101 PolarHBondContact O-N 2.82Å; M101-S103 VanDerWaalsContact C-N 3.33Å; M101-S103 PolarHBondContact O-N 3.04Å; M101-T104 WeakPolarHBondContact O-CB 3.34Å; M101-T104 PolarHBondContact O-N 2.83Å; M101-C105 PolarHBondContact O-N 2.67Å; M101-C105 PolarHBondContact O-SG 2.8Å; M101-T159 HydrophobicContact CG-CG2 4.44Å; M101-T159 HydrophobicContact SD-CG2 3.94Å
102A98.5Very high97.9Very high0 Ų049.5 Ų49.50%023%0.227CC..Hα-helixtrans-61.1-43.5178.200000111.7W15 A98 M99 R100 C105 W106 P154W15-A102 HydrophobicContact CH2-CB 4Å; W15-A102 HydrophobicContact CZ3-CB 4.42Å; W15-A102 WeakPolarHBondContact CZ3-O 3.49Å; A98-A102 WeakPolarHBondContact O-CB 3.36Å; A98-A102 PolarHBondContact O-N 2.9Å; M99-A102 PolarHBondContact O-N 3.5Å; R100-A102 VanDerWaalsContact C-N 3.35Å; R100-A102 PolarHBondContact O-N 3.14Å; A102-C105 WeakPolarHBondContact O-CB 3.33Å; A102-C105 PolarHBondContact O-N 3.35Å; A102-W106 PolarHBondContact O-N 3.09Å; A102-P154 WeakPolarHBondContact CA-O 3.34Å; A102-P154 HydrophobicContact CB-CB 3.92Å; A102-P154 HydrophobicContact CB-CG 4.27Å
103S98.5Very high98.1Very high37 Ų3746 Ų4626%0.25922%0.215SC..Hα-helixtrans-60.4-45.5175.3-175.30000111.1M99 R100 M101 C105 W106 F107M99-S103 VanDerWaalsContact O-CB 3.32Å; M99-S103 WeakPolarHBondContact O-CB 3.45Å; M99-S103 PolarHBondContact O-N 3Å; R100-S103 WeakPolarHBondContact O-CB 3.41Å; R100-S103 PolarHBondContact O-N 3.39Å; M101-S103 VanDerWaalsContact C-N 3.33Å; M101-S103 PolarHBondContact O-N 3.04Å; S103-C105 VanDerWaalsContact C-N 3.32Å; S103-C105 PolarHBondContact O-N 3.34Å; S103-W106 WeakPolarHBondContact O-CB 3.36Å; S103-W106 PolarHBondContact O-N 3.35Å; S103-F107 VanDerWaalsContact O-CD2 3.28Å; S103-F107 WeakPolarHBondContact O-CD2 3.28Å; S103-F107 PolarHBondContact O-N 3.04Å; S103-F107 WeakPolarHBondContact OG-CE2 3.01Å
104T98.8Very high98.1Very high2 Ų247.3 Ų47.31%0.01222%0.218CC..Hα-helixtrans-58.4-42.5175.5-51.90000112.1L70 E73 F74 R100 M101 W106 F107 F108L70-T104 HydrophobicContact CD2-CG2 3.98Å; E73-T104 HydrophobicContact CB-CG2 3.58Å; F74-T104 HydrophobicContact CB-CG2 4.47Å; F74-T104 HydrophobicContact CD1-CG2 3.63Å; F74-T104 HydrophobicContact CD2-CG2 3.77Å; F74-T104 HydrophobicContact CE1-CG2 3.63Å; F74-T104 HydrophobicContact CE2-CG2 3.77Å; F74-T104 HydrophobicContact CG-CG2 3.68Å; F74-T104 HydrophobicContact CZ-CG2 3.69Å; R100-T104 PolarHBondContact O-N 2.92Å; R100-T104 PolarHBondContact O-OG1 3.24Å; M101-T104 WeakPolarHBondContact O-CB 3.34Å; M101-T104 PolarHBondContact O-N 2.83Å; T104-W106 VanDerWaalsContact C-N 3.31Å; T104-W106 PolarHBondContact O-N 3.49Å; T104-F107 PolarHBondContact O-N 3.02Å; T104-F108 WeakPolarHBondContact O-CB 3.12Å; T104-F108 PolarHBondContact O-N 3.33Å
105C98.8Very high98.2Very high1 Ų138.3 Ų38.31%0.00718%0.184CC..Hα-helixtrans-61.6-41.1175-63.30000111.6M101 A102 S103 F108 F109 W146 V150 P154 T159M101-C105 PolarHBondContact O-N 2.67Å; M101-C105 PolarHBondContact O-SG 2.8Å; A102-C105 WeakPolarHBondContact O-CB 3.33Å; A102-C105 PolarHBondContact O-N 3.35Å; S103-C105 VanDerWaalsContact C-N 3.32Å; S103-C105 PolarHBondContact O-N 3.34Å; C105-F108 WeakPolarHBondContact O-CB 3.37Å; C105-F108 PolarHBondContact O-N 3.47Å; C105-F109 PolarHBondContact O-N 2.99Å; C105-W146 HydrophobicContact CB-CZ3 4.45Å; C105-V150 HydrophobicContact CB-CG2 3.99Å; C105-V150 VanDerWaalsContact O-CG2 3.3Å; C105-V150 WeakPolarHBondContact O-CG2 3.3Å; C105-P154 HydrophobicContact CB-CB 4.4Å; C105-T159 WeakPolarHBondContact SG-CG2 3.12Å
106W98.7Very high98.3Very high35 Ų3530.6 Ų30.613%0.13316%0.156CC..Hα-helixtrans-67.5-42.8177.7178.586.8000112.6W15 P16 A102 S103 T104 F108 F109 F110 V150W15-W106 HydrophobicContact CD2-CG 4.44Å; W15-W106 HydrophobicContact CE3-CB 3.51Å; W15-W106 AromaticContact CE3-CD1 3.65Å; W15-W106 HydrophobicContact CE3-CD2 4.09Å; W15-W106 AromaticContact CE3-CG 3.45Å; W15-W106 HydrophobicContact CE3-CG 3.45Å; W15-W106 VanDerWaalsContact CE3-CG 3.45Å; W15-W106 HydrophobicContact CZ3-CB 3.49Å; W15-W106 VanDerWaalsContact CZ3-CB 3.49Å; W15-W106 AromaticContact CZ3-CG 3.97Å; W15-W106 HydrophobicContact CZ3-CG 3.97Å; P16-W106 HydrophobicContact CB-CZ2 3.87Å; P16-W106 HydrophobicContact CG-CH2 4.3Å; P16-W106 HydrophobicContact CG-CZ2 3.73Å; P16-W106 PolarHBondContact O-NE1 3.17Å; A102-W106 PolarHBondContact O-N 3.09Å; S103-W106 WeakPolarHBondContact O-CB 3.36Å; S103-W106 PolarHBondContact O-N 3.35Å; T104-W106 VanDerWaalsContact C-N 3.31Å; T104-W106 PolarHBondContact O-N 3.49Å; W106-F108 VanDerWaalsContact C-N 3.31Å; W106-F108 PolarHBondContact O-N 2.9Å; W106-F109 WeakPolarHBondContact O-CB 3.47Å; W106-F109 PolarHBondContact O-N 3.19Å; W106-F110 AromaticContact CD2-CD2 3.84Å; W106-F110 HydrophobicContact CD2-CD2 3.84Å; W106-F110 HydrophobicContact CD2-CE2 4.1Å; W106-F110 AromaticContact CE2-CD2 3.42Å; W106-F110 VanDerWaalsContact CE2-CD2 3.42Å; W106-F110 AromaticContact CE2-CE2 3.19Å; W106-F110 HydrophobicContact CE3-CD2 4.24Å; W106-F110 HydrophobicContact CG-CD2 4.43Å; W106-F110 AromaticContact CH2-CD2 3.88Å; W106-F110 HydrophobicContact CH2-CD2 3.88Å; W106-F110 AromaticContact CH2-CE2 3.78Å; W106-F110 HydrophobicContact CH2-CE2 3.78Å; W106-F110 HydrophobicContact CH2-CZ 4.26Å; W106-F110 AromaticContact CZ2-CD2 3.45Å; W106-F110 HydrophobicContact CZ2-CD2 3.45Å; W106-F110 VanDerWaalsContact CZ2-CD2 3.45Å; W106-F110 AromaticContact CZ2-CE2 3.01Å; W106-F110 HydrophobicContact CZ2-CE2 3.01Å; W106-F110 HydrophobicContact CZ2-CG 4.43Å; W106-F110 AromaticContact CZ2-CZ 3.66Å; W106-F110 HydrophobicContact CZ2-CZ 3.66Å; W106-F110 HydrophobicContact CZ3-CD2 4.25Å; W106-F110 AromaticContact NE1-CD2 3.79Å; W106-F110 AromaticContact NE1-CE2 3.39Å; W106-F110 PolarHBondContact O-N 3.06Å; W106-V150 HydrophobicContact CB-CG1 4.01Å
107F98.8Very high98.4Very high73 Ų7330.7 Ų30.732%0.3215%0.145SC..Hα-helixtrans-64.3-35.7172.7-82.4-74000112.4W69 L70 S103 T104 F110 S111W69-F107 HydrophobicContact CH2-CB 4.17Å; W69-F107 AromaticContact CH2-CD1 3.98Å; W69-F107 HydrophobicContact CH2-CD1 3.98Å; W69-F107 AromaticContact CH2-CD2 3.56Å; W69-F107 HydrophobicContact CH2-CD2 3.56Å; W69-F107 HydrophobicContact CH2-CE1 4.21Å; W69-F107 AromaticContact CH2-CE2 3.83Å; W69-F107 HydrophobicContact CH2-CE2 3.83Å; W69-F107 AromaticContact CH2-CG 3.64Å; W69-F107 HydrophobicContact CH2-CG 3.64Å; W69-F107 HydrophobicContact CH2-CZ 4.14Å; W69-F107 HydrophobicContact CZ3-CB 3.85Å; W69-F107 AromaticContact CZ3-CD1 3.9Å; W69-F107 HydrophobicContact CZ3-CD1 3.9Å; W69-F107 HydrophobicContact CZ3-CD2 4.11Å; W69-F107 HydrophobicContact CZ3-CE1 4.45Å; W69-F107 AromaticContact CZ3-CG 3.7Å; W69-F107 HydrophobicContact CZ3-CG 3.7Å; L70-F107 HydrophobicContact CD2-CB 3.85Å; S103-F107 VanDerWaalsContact O-CD2 3.28Å; S103-F107 WeakPolarHBondContact O-CD2 3.28Å; S103-F107 PolarHBondContact O-N 3.04Å; S103-F107 WeakPolarHBondContact OG-CE2 3.01Å; T104-F107 PolarHBondContact O-N 3.02Å; F107-F110 PolarHBondContact O-N 2.96Å; F107-S111 PolarHBondContact O-N 3.21Å
108F98.8Very high98.4Very high0 Ų027.3 Ų27.30%013%0.128CC..Hα-helixtrans-63.9-44.3172.4-176.7-85.3000111.6L70 F74 T104 C105 W106 F110 S111 K112 W146 A162 N165 C166L70-F108 HydrophobicContact CD1-CB 4.42Å; L70-F108 HydrophobicContact CD1-CD2 4.2Å; L70-F108 HydrophobicContact CD2-CB 4.37Å; F74-F108 HydrophobicContact CE2-CB 4.11Å; F74-F108 AromaticContact CE2-CD2 3.79Å; F74-F108 HydrophobicContact CE2-CD2 3.79Å; F74-F108 HydrophobicContact CE2-CG 4.18Å; F74-F108 HydrophobicContact CZ-CB 3.94Å; F74-F108 HydrophobicContact CZ-CD2 4.24Å; F74-F108 HydrophobicContact CZ-CG 4.19Å; T104-F108 WeakPolarHBondContact O-CB 3.12Å; T104-F108 PolarHBondContact O-N 3.33Å; C105-F108 WeakPolarHBondContact O-CB 3.37Å; C105-F108 PolarHBondContact O-N 3.47Å; W106-F108 VanDerWaalsContact C-N 3.31Å; W106-F108 PolarHBondContact O-N 2.9Å; F108-F110 VanDerWaalsContact C-N 3.33Å; F108-F110 PolarHBondContact O-N 3.12Å; F108-S111 WeakPolarHBondContact O-CB 3.44Å; F108-S111 PolarHBondContact O-N 3.12Å; F108-S111 VanDerWaalsContact O-N 3.14Å; F108-S111 PolarHBondContact O-OG 2.93Å; F108-K112 HydrophobicContact CD1-CG 4.37Å; F108-K112 HydrophobicContact CE1-CD 4.15Å; F108-K112 HydrophobicContact CE1-CG 4Å; F108-K112 HydrophobicContact CZ-CD 4.35Å; F108-K112 PolarHBondContact O-N 3.22Å; F108-W146 AromaticContact CD1-CD2 3.48Å; F108-W146 HydrophobicContact CD1-CD2 3.48Å; F108-W146 VanDerWaalsContact CD1-CD2 3.48Å; F108-W146 AromaticContact CD1-CE2 3.48Å; F108-W146 VanDerWaalsContact CD1-CE2 3.48Å; F108-W146 AromaticContact CD1-CE3 3.7Å; F108-W146 HydrophobicContact CD1-CE3 3.7Å; F108-W146 HydrophobicContact CD1-CG 4.05Å; F108-W146 AromaticContact CD1-CH2 3.92Å; F108-W146 HydrophobicContact CD1-CH2 3.92Å; F108-W146 AromaticContact CD1-CZ2 3.66Å; F108-W146 HydrophobicContact CD1-CZ2 3.66Å; F108-W146 AromaticContact CD1-CZ3 3.92Å; F108-W146 HydrophobicContact CD1-CZ3 3.92Å; F108-W146 AromaticContact CE1-CD1 3.81Å; F108-W146 AromaticContact CE1-CD2 3.56Å; F108-W146 HydrophobicContact CE1-CD2 3.56Å; F108-W146 AromaticContact CE1-CE2 3.1Å; F108-W146 HydrophobicContact CE1-CE3 4.22Å; F108-W146 AromaticContact CE1-CG 3.97Å; F108-W146 HydrophobicContact CE1-CG 3.97Å; F108-W146 HydrophobicContact CE1-CH2 4.1Å; F108-W146 AromaticContact CE1-CZ2 3.37Å; F108-W146 HydrophobicContact CE1-CZ2 3.37Å; F108-W146 HydrophobicContact CE1-CZ3 4.47Å; F108-W146 AromaticContact CE1-NE1 3.31Å; F108-W146 VanDerWaalsContact CE1-NE1 3.31Å; F108-W146 HydrophobicContact CZ-CZ2 4.06Å; F108-A162 HydrophobicContact CD1-CB 4.35Å; F108-A162 HydrophobicContact CD2-CB 4.15Å; F108-A162 HydrophobicContact CE1-CB 4.23Å; F108-A162 HydrophobicContact CE2-CB 3.95Å; F108-A162 HydrophobicContact CG-CB 4.3Å; F108-A162 HydrophobicContact CZ-CB 3.97Å; F108-N165 HydrophobicContact CE2-CB 4.27Å; F108-N165 HydrophobicContact CZ-CB 4.15Å; F108-N165 WeakPolarHBondContact CZ-OD1 3.12Å; F108-C166 WeakPolarHBondContact CD2-SG 3.08Å; F108-C166 WeakPolarHBondContact CE2-SG 3.23Å
109F98.7Very high98.4Very high0 Ų027.1 Ų27.10%013%0.126CC..Hα-helixtrans-57.2-46.3172.5156.8-105.4000111.7L17 M18 V24 C105 W106 S111 K112 I113 P143 W146 W147 V150L17-F109 HydrophobicContact CB-CE1 4.07Å; L17-F109 HydrophobicContact CB-CZ 4.33Å; L17-F109 HydrophobicContact CD1-CE1 4.24Å; L17-F109 HydrophobicContact CD1-CZ 4.36Å; M18-F109 HydrophobicContact CE-CD1 3.51Å; M18-F109 HydrophobicContact CE-CE1 3.2Å; M18-F109 HydrophobicContact CE-CG 4.31Å; M18-F109 HydrophobicContact CE-CZ 3.77Å; V24-F109 HydrophobicContact CG1-CE2 4.36Å; V24-F109 HydrophobicContact CG2-CE2 3.99Å; V24-F109 HydrophobicContact CG2-CZ 3.62Å; C105-F109 PolarHBondContact O-N 2.99Å; W106-F109 WeakPolarHBondContact O-CB 3.47Å; W106-F109 PolarHBondContact O-N 3.19Å; F109-S111 VanDerWaalsContact C-N 3.28Å; F109-S111 PolarHBondContact O-N 2.71Å; F109-K112 WeakPolarHBondContact O-CB 3.26Å; F109-K112 PolarHBondContact O-N 3.5Å; F109-I113 HydrophobicContact CE1-CD1 3.87Å; F109-I113 HydrophobicContact CE2-CD1 4Å; F109-I113 HydrophobicContact CE2-CG1 4.26Å; F109-I113 HydrophobicContact CZ-CD1 3.5Å; F109-I113 VanDerWaalsContact CZ-CD1 3.5Å; F109-I113 HydrophobicContact CZ-CG1 4.25Å; F109-I113 PolarHBondContact O-N 2.99Å; F109-P143 WeakPolarHBondContact CE2-O 3.48Å; F109-W146 HydrophobicContact CB-CB 4.14Å; F109-W146 HydrophobicContact CD2-CB 4.07Å; F109-W147 HydrophobicContact CD2-CB 4.29Å; F109-W147 HydrophobicContact CE2-CB 3.81Å; F109-W147 HydrophobicContact CE2-CG 4.43Å; F109-W147 HydrophobicContact CZ-CB 4.38Å; F109-W147 AromaticContact CZ-CD1 3.84Å; F109-V150 HydrophobicContact CB-CG2 3.8Å
110F98.3Very high98.4Very high51 Ų5126 Ų2622%0.22412%0.122CC..Hα-helixtrans-60.5-37.4175.4-99.8-90000112.4P16 L17 W106 F107 F108 K112 I113 I114P16-F110 HydrophobicContact CB-CE2 4.49Å; P16-F110 HydrophobicContact CB-CZ 4.06Å; L17-F110 HydrophobicContact CB-CE2 4.46Å; L17-F110 HydrophobicContact CB-CZ 4.35Å; L17-F110 HydrophobicContact CD1-CE1 3.92Å; L17-F110 HydrophobicContact CD1-CE2 4.14Å; L17-F110 HydrophobicContact CD1-CZ 3.52Å; L17-F110 HydrophobicContact CG-CE2 4.46Å; L17-F110 HydrophobicContact CG-CZ 3.88Å; W106-F110 AromaticContact CD2-CD2 3.84Å; W106-F110 HydrophobicContact CD2-CD2 3.84Å; W106-F110 HydrophobicContact CD2-CE2 4.1Å; W106-F110 AromaticContact CE2-CD2 3.42Å; W106-F110 VanDerWaalsContact CE2-CD2 3.42Å; W106-F110 AromaticContact CE2-CE2 3.19Å; W106-F110 HydrophobicContact CE3-CD2 4.24Å; W106-F110 HydrophobicContact CG-CD2 4.43Å; W106-F110 AromaticContact CH2-CD2 3.88Å; W106-F110 HydrophobicContact CH2-CD2 3.88Å; W106-F110 AromaticContact CH2-CE2 3.78Å; W106-F110 HydrophobicContact CH2-CE2 3.78Å; W106-F110 HydrophobicContact CH2-CZ 4.26Å; W106-F110 AromaticContact CZ2-CD2 3.45Å; W106-F110 HydrophobicContact CZ2-CD2 3.45Å; W106-F110 VanDerWaalsContact CZ2-CD2 3.45Å; W106-F110 AromaticContact CZ2-CE2 3.01Å; W106-F110 HydrophobicContact CZ2-CE2 3.01Å; W106-F110 HydrophobicContact CZ2-CG 4.43Å; W106-F110 AromaticContact CZ2-CZ 3.66Å; W106-F110 HydrophobicContact CZ2-CZ 3.66Å; W106-F110 HydrophobicContact CZ3-CD2 4.25Å; W106-F110 AromaticContact NE1-CD2 3.79Å; W106-F110 AromaticContact NE1-CE2 3.39Å; W106-F110 PolarHBondContact O-N 3.06Å; F107-F110 PolarHBondContact O-N 2.96Å; F108-F110 VanDerWaalsContact C-N 3.33Å; F108-F110 PolarHBondContact O-N 3.12Å; F110-K112 VanDerWaalsContact C-N 3.27Å; F110-K112 PolarHBondContact O-N 2.88Å; F110-I113 WeakPolarHBondContact O-CB 3.34Å; F110-I113 PolarHBondContact O-N 3.48Å; F110-I113 VanDerWaalsContact O-N 3.13Å; F110-I114 WeakPolarHBondContact O-CG1 3.47Å; F110-I114 PolarHBondContact O-N 3.4Å; F110-I114 VanDerWaalsContact O-N 3.07Å
111S98.7Very high98.3Very high3 Ų322.5 Ų22.52%0.02111%0.11CC..Hα-helixtrans-56.9-44.4173.693.60000110.3F107 F108 F109 I113 I114 E115F107-S111 PolarHBondContact O-N 3.21Å; F108-S111 WeakPolarHBondContact O-CB 3.44Å; F108-S111 PolarHBondContact O-N 3.12Å; F108-S111 VanDerWaalsContact O-N 3.14Å; F108-S111 PolarHBondContact O-OG 2.93Å; F109-S111 VanDerWaalsContact C-N 3.28Å; F109-S111 PolarHBondContact O-N 2.71Å; S111-I113 VanDerWaalsContact C-N 3.27Å; S111-I113 PolarHBondContact O-N 3.23Å; S111-I114 CarbonylContact O-C 3.54Å; S111-I114 WeakPolarHBondContact O-CA 3.4Å; S111-I114 WeakPolarHBondContact O-CB 3.08Å; S111-I114 PolarHBondContact O-N 2.83Å; S111-E115 VanDerWaalsContact O-CG 3.23Å; S111-E115 WeakPolarHBondContact O-CG 3.38Å; S111-E115 PolarHBondContact O-N 2.95Å
112K98.6Very high98.2Very high3 Ų323 Ų231%0.01311%0.112CC..Hα-helixtrans-62.4-29.3178.1-54.4-55.6153.8-158.10114.4F108 F109 F110 E115 M142 P143 N165 H169F108-K112 HydrophobicContact CD1-CG 4.37Å; F108-K112 HydrophobicContact CE1-CD 4.15Å; F108-K112 HydrophobicContact CE1-CG 4Å; F108-K112 HydrophobicContact CZ-CD 4.35Å; F108-K112 PolarHBondContact O-N 3.22Å; F109-K112 WeakPolarHBondContact O-CB 3.26Å; F109-K112 PolarHBondContact O-N 3.5Å; F110-K112 VanDerWaalsContact C-N 3.27Å; F110-K112 PolarHBondContact O-N 2.88Å; K112-E115 VanDerWaalsContact CD-OE2 3.3Å; K112-E115 WeakPolarHBondContact CD-OE2 3.43Å; K112-E115 IonicContact NZ-OE1 3.22Å; K112-E115 PolarHBondContact NZ-OE1 2.9Å; K112-E115 IonicContact NZ-OE2 3.35Å; K112-E115 PolarHBondContact NZ-OE2 3.48Å; K112-M142 HydrophobicContact CB-CB 4.45Å; K112-M142 HydrophobicContact CD-CB 4.4Å; K112-M142 HydrophobicContact CD-CE 4.06Å; K112-M142 HydrophobicContact CG-CB 4.39Å; K112-P143 HydrophobicContact CB-CG 4.13Å; K112-N165 PolarHBondContact NZ-OD1 3.21Å; K112-H169 PolarHBondContact NZ-CE1 3.5Å; K112-H169 VanDerWaalsContact NZ-CE1 3.33Å; K112-H169 PolarHBondContact NZ-ND1 3.43Å
113I98.5Very high98.1Very high26 Ų2623 Ų2313%0.13311%0.112CC..Hα-helixtrans-69.3-45.3170.4-59.9178.9000110.5L17 T27 F109 F110 S111 E115 L116 P143L17-I113 HydrophobicContact CD1-CD1 3.42Å; L17-I113 VanDerWaalsContact CD1-CD1 3.42Å; T27-I113 HydrophobicContact CG2-CG2 4.39Å; F109-I113 HydrophobicContact CE1-CD1 3.87Å; F109-I113 HydrophobicContact CE2-CD1 4Å; F109-I113 HydrophobicContact CE2-CG1 4.26Å; F109-I113 HydrophobicContact CZ-CD1 3.5Å; F109-I113 VanDerWaalsContact CZ-CD1 3.5Å; F109-I113 HydrophobicContact CZ-CG1 4.25Å; F109-I113 PolarHBondContact O-N 2.99Å; F110-I113 WeakPolarHBondContact O-CB 3.34Å; F110-I113 PolarHBondContact O-N 3.48Å; F110-I113 VanDerWaalsContact O-N 3.13Å; S111-I113 VanDerWaalsContact C-N 3.27Å; S111-I113 PolarHBondContact O-N 3.23Å; I113-E115 VanDerWaalsContact C-N 3.3Å; I113-E115 PolarHBondContact O-N 3.23Å; I113-L116 VanDerWaalsContact O-CB 3.28Å; I113-L116 WeakPolarHBondContact O-CB 3.36Å; I113-L116 WeakPolarHBondContact O-CG 3.17Å; I113-L116 PolarHBondContact O-N 3.11Å; I113-P143 HydrophobicContact CG1-CB 4.37Å
114I98.4Very high98Very high67 Ų6723.3 Ų23.334%0.34411%0.11SC..Hα-helixtrans-61.9-40.8178.3-62.3167.2000110.5Y59 L63 L66 F110 S111 L116 F117Y59-I114 HydrophobicContact CE2-CG2 4.17Å; Y59-I114 PolarHBondContact OH-O 3.37Å; L63-I114 HydrophobicContact CD2-CG2 3.94Å; L66-I114 HydrophobicContact CD2-CD1 4.32Å; F110-I114 WeakPolarHBondContact O-CG1 3.47Å; F110-I114 PolarHBondContact O-N 3.4Å; F110-I114 VanDerWaalsContact O-N 3.07Å; S111-I114 CarbonylContact O-C 3.54Å; S111-I114 WeakPolarHBondContact O-CA 3.4Å; S111-I114 WeakPolarHBondContact O-CB 3.08Å; S111-I114 PolarHBondContact O-N 2.83Å; I114-L116 PolarHBondContact O-N 3.41Å; I114-L116 VanDerWaalsContact O-N 3.11Å; I114-F117 WeakPolarHBondContact O-CB 3.49Å; I114-F117 WeakPolarHBondContact O-CD2 3.19Å; I114-F117 PolarHBondContact O-N 3.03Å
115E98.5Very high97.8Very high3 Ų326.3 Ų26.31%0.01412%0.121CC..THydrogen-bonded Turntrans-63.8-16.1-179.9-65.5-176.5174.500113.3S111 K112 I113 F117 D118 H139 H169 Y173S111-E115 VanDerWaalsContact O-CG 3.23Å; S111-E115 WeakPolarHBondContact O-CG 3.38Å; S111-E115 PolarHBondContact O-N 2.95Å; K112-E115 VanDerWaalsContact CD-OE2 3.3Å; K112-E115 WeakPolarHBondContact CD-OE2 3.43Å; K112-E115 IonicContact NZ-OE1 3.22Å; K112-E115 PolarHBondContact NZ-OE1 2.9Å; K112-E115 IonicContact NZ-OE2 3.35Å; K112-E115 PolarHBondContact NZ-OE2 3.48Å; I113-E115 VanDerWaalsContact C-N 3.3Å; I113-E115 PolarHBondContact O-N 3.23Å; E115-F117 PolarHBondContact O-N 2.55Å; E115-D118 VanDerWaalsContact O-CB 3.31Å; E115-D118 WeakPolarHBondContact O-CB 3.37Å; E115-D118 PolarHBondContact O-N 2.98Å; E115-D118 VanDerWaalsContact O-N 3.12Å; E115-H139 PolarHBondContact O-CE1 2.79Å; E115-H139 PolarHBondContact O-ND1 3.27Å; E115-H169 IonicContact OE1-CE1 3.84Å; E115-H169 PolarHBondContact OE1-CE1 3.39Å; E115-H169 IonicContact OE1-CG 3.15Å; E115-H169 IonicContact OE1-ND1 3.41Å; E115-H169 PolarHBondContact OE1-ND1 2.86Å; E115-H169 IonicContact OE2-CE1 3.91Å; E115-H169 PolarHBondContact OE2-CE1 3.26Å; E115-H169 VanDerWaalsContact OE2-CE1 3.22Å; E115-H169 IonicContact OE2-ND1 3.77Å; E115-H169 PolarHBondContact OE2-ND1 3.1Å; E115-Y173 VanDerWaalsContact CD-OH 3.27Å; E115-Y173 WeakPolarHBondContact CG-OH 3.14Å; E115-Y173 PolarHBondContact OE1-OH 3.34Å
116L98.5Very high97.5Very high9 Ų928.9 Ų28.95%0.04713%0.133CC..Hα-helixtrans-59.4-27170-64.7178.2000112.2T27 Y31 I113 I114 D118 T119 H139 P143T27-L116 HydrophobicContact CG2-CD1 3.89Å; Y31-L116 HydrophobicContact CD1-CD2 4.14Å; Y31-L116 HydrophobicContact CD2-CB 3.86Å; Y31-L116 HydrophobicContact CD2-CD2 3.89Å; Y31-L116 HydrophobicContact CD2-CG 4.34Å; Y31-L116 HydrophobicContact CE1-CD2 4.25Å; Y31-L116 HydrophobicContact CE2-CB 4.16Å; Y31-L116 HydrophobicContact CE2-CD2 3.96Å; Y31-L116 WeakPolarHBondContact CE2-O 3.3Å; Y31-L116 HydrophobicContact CG-CD1 4.5Å; Y31-L116 HydrophobicContact CG-CD2 3.98Å; I113-L116 VanDerWaalsContact O-CB 3.28Å; I113-L116 WeakPolarHBondContact O-CB 3.36Å; I113-L116 WeakPolarHBondContact O-CG 3.17Å; I113-L116 PolarHBondContact O-N 3.11Å; I114-L116 PolarHBondContact O-N 3.41Å; I114-L116 VanDerWaalsContact O-N 3.11Å; L116-D118 PolarHBondContact O-N 3.35Å; L116-T119 PolarHBondContact O-N 3.1Å; L116-H139 HydrophobicContact CD2-CB 4.03Å; L116-H139 WeakPolarHBondContact CD2-O 3.32Å; L116-P143 HydrophobicContact CD1-CG 4.4Å; L116-P143 HydrophobicContact CD2-CG 4.19Å; L116-P143 HydrophobicContact CG-CG 4.38Å
117F97.9Very high97.3Very high117 Ų11731 Ų3151%0.51314%0.143SC..Hα-helixtrans-69.2-17.8178-74.5-82.8000113Y59 I114 E115 T119 V120 L121Y59-F117 HydrophobicContact CE2-CB 4.05Å; I114-F117 WeakPolarHBondContact O-CB 3.49Å; I114-F117 WeakPolarHBondContact O-CD2 3.19Å; I114-F117 PolarHBondContact O-N 3.03Å; E115-F117 PolarHBondContact O-N 2.55Å; F117-T119 VanDerWaalsContact C-N 3.33Å; F117-T119 PolarHBondContact O-N 3.19Å; F117-V120 HydrophobicContact CD1-CB 4.49Å; F117-V120 WeakPolarHBondContact O-CB 3.43Å; F117-V120 PolarHBondContact O-N 2.87Å; F117-L121 WeakPolarHBondContact O-CB 3.35Å; F117-L121 VanDerWaalsContact O-CG 3.24Å; F117-L121 WeakPolarHBondContact O-CG 3.37Å; F117-L121 PolarHBondContact O-N 3.33Å
118D97.5Very high97Very high4 Ų431.5 Ų31.52%0.02115%0.145CC..Hα-helixtrans-53.5-52.3174.1-76.54.3000110.8Y59 E115 L116 V120 L121 F122 H139 Y173Y59-D118 WeakPolarHBondContact CE1-OD1 3.19Å; Y59-D118 PolarHBondContact OH-N 2.83Å; Y59-D118 PolarHBondContact OH-OD1 3.32Å; E115-D118 VanDerWaalsContact O-CB 3.31Å; E115-D118 WeakPolarHBondContact O-CB 3.37Å; E115-D118 PolarHBondContact O-N 2.98Å; E115-D118 VanDerWaalsContact O-N 3.12Å; L116-D118 PolarHBondContact O-N 3.35Å; D118-V120 VanDerWaalsContact C-N 3.32Å; D118-V120 PolarHBondContact O-N 3.28Å; D118-L121 PolarHBondContact O-N 3.41Å; D118-F122 HydrophobicContact CB-CE2 4.42Å; D118-F122 HydrophobicContact CB-CZ 4.38Å; D118-F122 WeakPolarHBondContact O-CD1 3.33Å; D118-F122 WeakPolarHBondContact O-CG 3.43Å; D118-F122 PolarHBondContact O-N 2.79Å; D118-H139 IonicContact OD2-CE1 3.06Å; D118-Y173 PolarHBondContact OD2-OH 3.44Å; D118-Y173 VanDerWaalsContact OD2-OH 3.11Å
119T97.9Very high96.6Very high0 Ų037.5 Ų37.50%017%0.173CC..Hα-helixtrans-66.7-37.1-178.5-36.30000111.5Y31 V35 L116 F117 F122 I123 V131 H135 V136Y31-T119 HydrophobicContact CE2-CG2 4.47Å; Y31-T119 PolarHBondContact OH-OG1 3.5Å; V35-T119 HydrophobicContact CB-CG2 4.37Å; V35-T119 HydrophobicContact CG1-CG2 3.69Å; V35-T119 HydrophobicContact CG2-CG2 3.67Å; L116-T119 PolarHBondContact O-N 3.1Å; F117-T119 VanDerWaalsContact C-N 3.33Å; F117-T119 PolarHBondContact O-N 3.19Å; T119-F122 PolarHBondContact O-N 3.47Å; T119-I123 HydrophobicContact CG2-CD1 4.47Å; T119-I123 WeakPolarHBondContact O-CG1 3.15Å; T119-I123 PolarHBondContact O-N 3.46Å; T119-V131 HydrophobicContact CG2-CB 4.48Å; T119-V131 HydrophobicContact CG2-CG1 3.75Å; T119-V131 HydrophobicContact CG2-CG2 4.09Å; T119-H135 PolarHBondContact OG1-CD2 2.93Å; T119-H135 VanDerWaalsContact OG1-CD2 3.29Å; T119-H135 PolarHBondContact OG1-NE2 3.04Å; T119-V136 HydrophobicContact CG2-CG2 4.44Å
120V97.5Very high96.3Very high29 Ų2940.8 Ų40.818%0.17619%0.19CC..Hα-helixtrans-60.2-48.4175.6176.60000109.9F34 F117 D118 F122 I123 L124F34-V120 HydrophobicContact CD1-CG1 4.47Å; F34-V120 HydrophobicContact CD1-CG2 3.96Å; F34-V120 HydrophobicContact CE1-CB 4.13Å; F34-V120 HydrophobicContact CE1-CG1 3.75Å; F34-V120 HydrophobicContact CE1-CG2 4.02Å; F34-V120 HydrophobicContact CZ-CG1 4.09Å; F117-V120 HydrophobicContact CD1-CB 4.49Å; F117-V120 WeakPolarHBondContact O-CB 3.43Å; F117-V120 PolarHBondContact O-N 2.87Å; D118-V120 VanDerWaalsContact C-N 3.32Å; D118-V120 PolarHBondContact O-N 3.28Å; V120-F122 VanDerWaalsContact C-N 3.33Å; V120-F122 PolarHBondContact O-N 3.01Å; V120-I123 PolarHBondContact O-N 2.76Å; V120-L124 HydrophobicContact CG1-CD1 4.04Å; V120-L124 HydrophobicContact CG1-CG 4.43Å; V120-L124 WeakPolarHBondContact O-CG 3.32Å; V120-L124 PolarHBondContact O-N 3.22Å
121L96.7Very high96.2Very high12 Ų1239.9 Ų39.96%0.06319%0.189CC..Hα-helixtrans-64.3-35.6178.3-68.5169.4000112.1L52 L55 M56 Y59 F117 D118 R125L52-L121 HydrophobicContact CD1-CD2 3.86Å; L55-L121 HydrophobicContact CD2-CD2 3.87Å; L55-L121 HydrophobicContact CG-CD2 4.5Å; M56-L121 HydrophobicContact CE-CD1 4.45Å; M56-L121 HydrophobicContact SD-CB 3.7Å; M56-L121 HydrophobicContact SD-CD1 3.76Å; M56-L121 HydrophobicContact SD-CD2 4.16Å; M56-L121 HydrophobicContact SD-CG 4.08Å; Y59-L121 HydrophobicContact CD1-CD1 3.76Å; Y59-L121 HydrophobicContact CD2-CD1 4.26Å; Y59-L121 HydrophobicContact CE1-CD1 3.81Å; Y59-L121 HydrophobicContact CE2-CD1 4.3Å; Y59-L121 HydrophobicContact CG-CD1 3.98Å; F117-L121 WeakPolarHBondContact O-CB 3.35Å; F117-L121 VanDerWaalsContact O-CG 3.24Å; F117-L121 WeakPolarHBondContact O-CG 3.37Å; F117-L121 PolarHBondContact O-N 3.33Å; D118-L121 PolarHBondContact O-N 3.41Å; L121-R125 WeakPolarHBondContact O-CB 3.34Å; L121-R125 WeakPolarHBondContact O-CD 3.39Å; L121-R125 VanDerWaalsContact O-CG 3.23Å; L121-R125 WeakPolarHBondContact O-CG 3.43Å; L121-R125 PolarHBondContact O-N 3.33Å; L121-R125 VanDerWaalsContact O-N 3.17Å
122F95.6Very high96.1Very high12 Ų1242 Ų425%0.05320%0.203CC..Hα-helixtrans-62.1-47172.7-62.4-19.6000111.7D118 T119 V120 R125 K126 K127 L130 V131 H135D118-F122 HydrophobicContact CB-CE2 4.42Å; D118-F122 HydrophobicContact CB-CZ 4.38Å; D118-F122 WeakPolarHBondContact O-CD1 3.33Å; D118-F122 WeakPolarHBondContact O-CG 3.43Å; D118-F122 PolarHBondContact O-N 2.79Å; T119-F122 PolarHBondContact O-N 3.47Å; V120-F122 VanDerWaalsContact C-N 3.33Å; V120-F122 PolarHBondContact O-N 3.01Å; F122-R125 CarbonylContact O-C 3.57Å; F122-R125 PolarHBondContact O-N 3.48Å; F122-K126 PolarHBondContact O-N 2.84Å; F122-K126 VanDerWaalsContact O-N 3.16Å; F122-K127 HydrophobicContact CB-CB 4.25Å; F122-K127 PolarHBondContact O-N 2.74Å; F122-L130 HydrophobicContact CD1-CD1 3.93Å; F122-L130 HydrophobicContact CD2-CB 3.74Å; F122-L130 HydrophobicContact CD2-CD1 4.45Å; F122-L130 HydrophobicContact CE1-CD1 3.98Å; F122-L130 HydrophobicContact CE2-CB 4.03Å; F122-L130 HydrophobicContact CE2-CD1 4.48Å; F122-L130 HydrophobicContact CG-CB 4.07Å; F122-L130 HydrophobicContact CG-CD1 4.19Å; F122-L130 HydrophobicContact CZ-CD1 4.26Å; F122-V131 HydrophobicContact CB-CG2 4.01Å; F122-H135 AromaticContact CD2-NE2 3.92Å; F122-H135 AromaticContact CE2-CE1 3.67Å; F122-H135 AromaticContact CE2-NE2 3.69Å
123I96.8Very high95.9Very high0 Ų049 Ų490%023%0.234CC..Hα-helixtrans-62.5-48.6179.2-70.1168.4000111.2F34 V35 M43 T119 V120 R125 K126 F128 V131F34-I123 HydrophobicContact CD1-CD1 4.37Å; F34-I123 HydrophobicContact CE1-CB 4.45Å; F34-I123 HydrophobicContact CE1-CD1 4.2Å; F34-I123 HydrophobicContact CE1-CG2 4.32Å; V35-I123 HydrophobicContact CB-CD1 4.04Å; V35-I123 HydrophobicContact CG1-CD1 4.1Å; V35-I123 HydrophobicContact CG2-CD1 3.89Å; M43-I123 HydrophobicContact CG-CG2 3.83Å; M43-I123 WeakPolarHBondContact CG-O 3.42Å; T119-I123 HydrophobicContact CG2-CD1 4.47Å; T119-I123 WeakPolarHBondContact O-CG1 3.15Å; T119-I123 PolarHBondContact O-N 3.46Å; V120-I123 PolarHBondContact O-N 2.76Å; I123-R125 PolarHBondContact O-N 3.41Å; I123-R125 VanDerWaalsContact O-N 3.16Å; I123-K126 WeakPolarHBondContact O-CA 3.37Å; I123-K126 PolarHBondContact O-N 2.87Å; I123-F128 HydrophobicContact CG1-CE1 4.33Å; I123-F128 HydrophobicContact CG2-CE1 4.14Å; I123-V131 HydrophobicContact CG1-CG2 4.02Å
124L96.1Very high95.8Very high43 Ų4349 Ų4923%0.22523%0.234CC..Hα-helixtrans-61.9-25.6180-66.1178000112.8F34 M43 F50 L52 V120F34-L124 HydrophobicContact CZ-CD2 4.41Å; M43-L124 WeakPolarHBondContact CE-O 3Å; M43-L124 HydrophobicContact SD-CD2 4.12Å; F50-L124 HydrophobicContact CD2-CB 4.12Å; F50-L124 HydrophobicContact CD2-CD2 4.11Å; F50-L124 WeakPolarHBondContact CD2-O 3.23Å; F50-L124 HydrophobicContact CE2-CD2 4.15Å; F50-L124 PolarHBondContact N-O 2.95Å; L52-L124 HydrophobicContact CD1-CB 3.73Å; L52-L124 HydrophobicContact CD1-CD1 4.07Å; V120-L124 HydrophobicContact CG1-CD1 4.04Å; V120-L124 HydrophobicContact CG1-CG 4.43Å; V120-L124 WeakPolarHBondContact O-CG 3.32Å; V120-L124 PolarHBondContact O-N 3.22Å
125R94.3Very high95.7Very high64 Ų6446.7 Ų46.724%0.24222%0.222CC..THydrogen-bonded Turntrans-91.74.3174.1-66.7174.662.5-153.4-3.3113.8P49 L52 L121 F122 I123 K127P49-R125 VanDerWaalsContact CB-O 3.31Å; P49-R125 WeakPolarHBondContact CB-O 3.49Å; L52-R125 HydrophobicContact CB-CG 4.38Å; L52-R125 HydrophobicContact CD1-CG 4.21Å; L52-R125 HydrophobicContact CG-CG 4.46Å; L121-R125 WeakPolarHBondContact O-CB 3.34Å; L121-R125 WeakPolarHBondContact O-CD 3.39Å; L121-R125 VanDerWaalsContact O-CG 3.23Å; L121-R125 WeakPolarHBondContact O-CG 3.43Å; L121-R125 PolarHBondContact O-N 3.33Å; L121-R125 VanDerWaalsContact O-N 3.17Å; F122-R125 CarbonylContact O-C 3.57Å; F122-R125 PolarHBondContact O-N 3.48Å; I123-R125 PolarHBondContact O-N 3.41Å; I123-R125 VanDerWaalsContact O-N 3.16Å; R125-K127 HydrophobicContact CB-CG 4Å; R125-K127 PolarHBondContact O-N 3.38Å
126K93.5Very high95.7Very high56 Ų5647.2 Ų47.224%0.24323%0.225CC..THydrogen-bonded Turntrans55.933-173.6-59.7-169.1170.5-159.40114.2M43 H46 Q47 P49 F122 I123 F128M43-K126 HydrophobicContact CE-CD 4.38Å; M43-K126 HydrophobicContact CE-CG 3.66Å; M43-K126 WeakPolarHBondContact O-CE 3.39Å; M43-K126 PolarHBondContact O-NZ 3.46Å; H46-K126 WeakPolarHBondContact O-CE 3.22Å; H46-K126 PolarHBondContact O-NZ 2.91Å; Q47-K126 VanDerWaalsContact C-NZ 3.31Å; Q47-K126 PolarHBondContact O-NZ 3.27Å; P49-K126 HydrophobicContact CB-CB 4.31Å; P49-K126 HydrophobicContact CB-CG 4.19Å; F122-K126 PolarHBondContact O-N 2.84Å; F122-K126 VanDerWaalsContact O-N 3.16Å; I123-K126 WeakPolarHBondContact O-CA 3.37Å; I123-K126 PolarHBondContact O-N 2.87Å; K126-F128 VanDerWaalsContact C-N 3.26Å; K126-F128 HydrophobicContact CB-CD2 4.28Å; K126-F128 HydrophobicContact CB-CE2 3.81Å; K126-F128 HydrophobicContact CG-CE2 4.05Å; K126-F128 PolarHBondContact O-N 3.45Å
127K92.8Very high95.7Very high79 Ų7950 Ų5034%0.34324%0.237SC..  trans-90.754.2176-63.6-64.4178.9-173.70111.4F122 R125 E129 L130F122-K127 HydrophobicContact CB-CB 4.25Å; F122-K127 PolarHBondContact O-N 2.74Å; R125-K127 HydrophobicContact CB-CG 4Å; R125-K127 PolarHBondContact O-N 3.38Å; K127-E129 VanDerWaalsContact CA-OE2 3.27Å; K127-E129 WeakPolarHBondContact CA-OE2 3.02Å; K127-E129 WeakPolarHBondContact CD-OE1 3.37Å; K127-E129 IonicContact NZ-OE1 3.21Å; K127-E129 PolarHBondContact O-N 3.46Å; K127-L130 HydrophobicContact CB-CD1 3.87Å; K127-L130 HydrophobicContact CB-CG 4.14Å; K127-L130 HydrophobicContact CG-CD1 4.46Å; K127-L130 WeakPolarHBondContact O-CB 3.41Å; K127-L130 PolarHBondContact O-N 2.94Å
128F93.5Very high95.7Very high83 Ų8345.1 Ų45.136%0.36422%0.216SC..G310 helixtrans-64.1-26-175.7-61-72.7000113P40 M43 I123 K126 L130 V131P40-F128 HydrophobicContact CB-CE1 4.27Å; P40-F128 HydrophobicContact CG-CE1 4.38Å; M43-F128 HydrophobicContact CB-CZ 3.86Å; I123-F128 HydrophobicContact CG1-CE1 4.33Å; I123-F128 HydrophobicContact CG2-CE1 4.14Å; K126-F128 VanDerWaalsContact C-N 3.26Å; K126-F128 HydrophobicContact CB-CD2 4.28Å; K126-F128 HydrophobicContact CB-CE2 3.81Å; K126-F128 HydrophobicContact CG-CE2 4.05Å; K126-F128 PolarHBondContact O-N 3.45Å; F128-L130 PolarHBondContact O-N 2.95Å; F128-V131 PolarHBondContact O-N 3.21Å
129E90.6Very high95.7Very high126 Ų12645.5 Ų45.559%0.58922%0.217SC*.G310 helixtrans-61.2-21.9173.272-80.4-168.300113.2K127K127-E129 VanDerWaalsContact CA-OE2 3.27Å; K127-E129 WeakPolarHBondContact CA-OE2 3.02Å; K127-E129 WeakPolarHBondContact CD-OE1 3.37Å; K127-E129 IonicContact NZ-OE1 3.21Å; K127-E129 PolarHBondContact O-N 3.46Å
130L92.8Very high95.7Very high69 Ų6946.1 Ų46.136%0.36122%0.223SC..G310 helixtrans-86.8-19175.4-54.4-177.6000112.4F122 K127 F128 S132F122-L130 HydrophobicContact CD1-CD1 3.93Å; F122-L130 HydrophobicContact CD2-CB 3.74Å; F122-L130 HydrophobicContact CD2-CD1 4.45Å; F122-L130 HydrophobicContact CE1-CD1 3.98Å; F122-L130 HydrophobicContact CE2-CB 4.03Å; F122-L130 HydrophobicContact CE2-CD1 4.48Å; F122-L130 HydrophobicContact CG-CB 4.07Å; F122-L130 HydrophobicContact CG-CD1 4.19Å; F122-L130 HydrophobicContact CZ-CD1 4.26Å; K127-L130 HydrophobicContact CB-CD1 3.87Å; K127-L130 HydrophobicContact CB-CG 4.14Å; K127-L130 HydrophobicContact CG-CD1 4.46Å; K127-L130 WeakPolarHBondContact O-CB 3.41Å; K127-L130 PolarHBondContact O-N 2.94Å; F128-L130 PolarHBondContact O-N 2.95Å; L130-S132 PolarHBondContact O-N 3.21Å
131V95.8Very high95.7Very high32 Ų3246.4 Ų46.419%0.19422%0.223CC..  trans-84.664-179.3-1700000109.8V35 T119 F122 I123 F128 V136V35-V131 HydrophobicContact CG1-CG1 3.87Å; T119-V131 HydrophobicContact CG2-CB 4.48Å; T119-V131 HydrophobicContact CG2-CG1 3.75Å; T119-V131 HydrophobicContact CG2-CG2 4.09Å; F122-V131 HydrophobicContact CB-CG2 4.01Å; I123-V131 HydrophobicContact CG1-CG2 4.02Å; F128-V131 PolarHBondContact O-N 3.21Å; V131-V136 HydrophobicContact CG1-CG2 3.71Å
132S95.3Very high95.8Very high47 Ų4746.3 Ų46.333%0.32922%0.222SC..  trans-78.1160.3178.566.30000112.4L130 L134 H135 V136L130-S132 PolarHBondContact O-N 3.21Å; S132-L134 VanDerWaalsContact C-N 3.27Å; S132-L134 PolarHBondContact O-N 2.83Å; S132-H135 PolarHBondContact O-N 3.47Å; S132-H135 VanDerWaalsContact O-N 3.13Å; S132-H135 WeakPolarHBondContact OG-CB 3.49Å; S132-H135 PolarHBondContact OG-N 3.25Å; S132-V136 PolarHBondContact O-N 3.49Å
133F95.8Very high95.9Very high152 Ų15245.8 Ų45.867%0.66722%0.22SC*.Hα-helixtrans-53.2-45.3171.3172.2-100000111.9H135 V136 F137 L239F133-H135 VanDerWaalsContact C-N 3.32Å; F133-H135 PolarHBondContact O-N 3.16Å; F133-V136 PolarHBondContact O-N 2.87Å; F133-F137 HydrophobicContact CE1-CB 4.4Å; F133-F137 HydrophobicContact CZ-CB 4.28Å; F133-F137 HydrophobicContact CZ-CD2 4.49Å; F133-F137 HydrophobicContact CZ-CG 4.42Å; F133-F137 WeakPolarHBondContact O-CB 3.44Å; F133-F137 PolarHBondContact O-N 3.27Å; F133-L239 HydrophobicContact CE1-CD2 4.47Å
134L95.7Very high96Very high24 Ų2447.6 Ų47.613%0.12623%0.229CC..Hα-helixtrans-54.1-50.2176.6177.7169.7000110.8S132 H138 L239 F240 F243S132-L134 VanDerWaalsContact C-N 3.27Å; S132-L134 PolarHBondContact O-N 2.83Å; L134-H138 VanDerWaalsContact O-CB 3.25Å; L134-H138 WeakPolarHBondContact O-CB 3.44Å; L134-H138 PolarHBondContact O-N 3.17Å; L134-L239 HydrophobicContact CB-CB 4.41Å; L134-L239 VanDerWaalsContact CD1-C 3.49Å; L134-L239 HydrophobicContact CD1-CB 3.71Å; L134-L239 WeakPolarHBondContact CD1-O 3.37Å; L134-L239 HydrophobicContact CG-CB 3.91Å; L134-F240 HydrophobicContact CD1-CD1 4.3Å; L134-F240 HydrophobicContact CD1-CD2 3.99Å; L134-F240 HydrophobicContact CD1-CE2 4.25Å; L134-F240 HydrophobicContact CD1-CG 4.03Å; L134-F240 HydrophobicContact CD2-CD2 4.3Å; L134-F240 HydrophobicContact CD2-CE1 4.29Å; L134-F240 HydrophobicContact CD2-CE2 3.73Å; L134-F240 HydrophobicContact CD2-CZ 3.74Å; L134-F240 HydrophobicContact CG-CD2 4.48Å; L134-F240 HydrophobicContact CG-CE2 4.35Å; L134-F243 HydrophobicContact CD1-CB 4.36Å
135H96.8Very high96.1Very high19 Ų1946.4 Ų46.49%0.08823%0.225CC..Hα-helixtrans-63-51-177.3-178.480.7000111.1T119 F122 S132 F133 F137 H138 H139T119-H135 PolarHBondContact OG1-CD2 2.93Å; T119-H135 VanDerWaalsContact OG1-CD2 3.29Å; T119-H135 PolarHBondContact OG1-NE2 3.04Å; F122-H135 AromaticContact CD2-NE2 3.92Å; F122-H135 AromaticContact CE2-CE1 3.67Å; F122-H135 AromaticContact CE2-NE2 3.69Å; S132-H135 PolarHBondContact O-N 3.47Å; S132-H135 VanDerWaalsContact O-N 3.13Å; S132-H135 WeakPolarHBondContact OG-CB 3.49Å; S132-H135 PolarHBondContact OG-N 3.25Å; F133-H135 VanDerWaalsContact C-N 3.32Å; F133-H135 PolarHBondContact O-N 3.16Å; H135-F137 PolarHBondContact O-N 3.16Å; H135-H138 PolarHBondContact O-N 2.94Å; H135-H139 AromaticContact CE1-CD2 3.34Å; H135-H139 PolarHBondContact CE1-CD2 3.13Å; H135-H139 AromaticContact CE1-CE1 3.88Å; H135-H139 AromaticContact CE1-NE2 3.08Å; H135-H139 PolarHBondContact CE1-NE2 3.07Å; H135-H139 AromaticContact CG-CD2 3.92Å; H135-H139 AromaticContact ND1-CD2 3.45Å; H135-H139 PolarHBondContact ND1-CD2 3.48Å; H135-H139 AromaticContact ND1-NE2 3.41Å; H135-H139 PolarHBondContact ND1-NE2 3.34Å; H135-H139 AromaticContact NE2-CD2 3.79Å; H135-H139 AromaticContact NE2-NE2 3.88Å; H135-H139 WeakPolarHBondContact O-CB 3.39Å; H135-H139 PolarHBondContact O-CD2 3.13Å; H135-H139 VanDerWaalsContact O-CD2 3.23Å; H135-H139 PolarHBondContact O-N 2.94Å
136V98.3Very high96.3Very high15 Ų1544.1 Ų44.19%0.09122%0.216CC..Hα-helixtrans-64.5-41.8-179.3-178.50000111.7Y31 L32 V35 L36 T119 V131 S132 F133 A140Y31-V136 HydrophobicContact CE1-CG1 4.21Å; L32-V136 HydrophobicContact CD2-CG1 3.88Å; V35-V136 HydrophobicContact CG1-CG1 4.22Å; V35-V136 HydrophobicContact CG1-CG2 3.72Å; L36-V136 HydrophobicContact CD2-CG1 4.35Å; T119-V136 HydrophobicContact CG2-CG2 4.44Å; V131-V136 HydrophobicContact CG1-CG2 3.71Å; S132-V136 PolarHBondContact O-N 3.49Å; F133-V136 PolarHBondContact O-N 2.87Å; V136-A140 VanDerWaalsContact O-CB 3.23Å; V136-A140 WeakPolarHBondContact O-CB 3.45Å; V136-A140 PolarHBondContact O-N 3.14Å
137F98Very high96.5Very high68 Ų6841.9 Ų41.930%0.29821%0.206SC..Hα-helixtrans-60.8-48176.7174.5-105.9000111.6F133 H135 A140 I141 V235 F236 L239F133-F137 HydrophobicContact CE1-CB 4.4Å; F133-F137 HydrophobicContact CZ-CB 4.28Å; F133-F137 HydrophobicContact CZ-CD2 4.49Å; F133-F137 HydrophobicContact CZ-CG 4.42Å; F133-F137 WeakPolarHBondContact O-CB 3.44Å; F133-F137 PolarHBondContact O-N 3.27Å; H135-F137 PolarHBondContact O-N 3.16Å; F137-A140 PolarHBondContact O-N 3.43Å; F137-I141 HydrophobicContact CE2-CD1 4.25Å; F137-I141 HydrophobicContact CZ-CD1 3.95Å; F137-I141 VanDerWaalsContact O-CG2 3.31Å; F137-I141 WeakPolarHBondContact O-CG2 3.45Å; F137-I141 PolarHBondContact O-N 2.96Å; F137-I141 VanDerWaalsContact O-N 3.1Å; F137-V235 HydrophobicContact CE1-CG1 3.7Å; F137-V235 HydrophobicContact CZ-CG1 4.25Å; F137-F236 AromaticContact CD1-CE1 3.79Å; F137-F236 HydrophobicContact CD1-CE1 3.79Å; F137-F236 HydrophobicContact CE1-CD1 4.4Å; F137-F236 AromaticContact CE1-CE1 3.71Å; F137-F236 HydrophobicContact CE1-CE1 3.71Å; F137-F236 HydrophobicContact CE1-CZ 4.41Å; F137-L239 HydrophobicContact CD1-CD1 4.04Å; F137-L239 HydrophobicContact CE1-CD1 4.43Å
138H97.5Very high96.8Very high13 Ų1341.1 Ų41.16%0.0620%0.202CC..Hα-helixtrans-61-52.2177.8-178.883.7000111.7L134 H135 A140 I141 M142 F236L134-H138 VanDerWaalsContact O-CB 3.25Å; L134-H138 WeakPolarHBondContact O-CB 3.44Å; L134-H138 PolarHBondContact O-N 3.17Å; H135-H138 PolarHBondContact O-N 2.94Å; H138-A140 VanDerWaalsContact C-N 3.29Å; H138-A140 PolarHBondContact O-N 2.7Å; H138-I141 PolarHBondContact O-N 3.27Å; H138-M142 WeakPolarHBondContact O-CB 3.21Å; H138-M142 WeakPolarHBondContact O-CG 3.22Å; H138-M142 PolarHBondContact O-N 2.9Å; H138-M142 VanDerWaalsContact O-N 3.1Å; H138-F236 HydrophobicContact CB-CE1 3.79Å; H138-F236 HydrophobicContact CB-CZ 4.18Å; H138-F236 AromaticContact CE1-CE2 3.95Å; H138-F236 AromaticContact CG-CE1 3.97Å; H138-F236 AromaticContact CG-CZ 3.98Å; H138-F236 AromaticContact ND1-CD1 3.84Å; H138-F236 AromaticContact ND1-CD2 3.91Å; H138-F236 AromaticContact ND1-CE1 3.36Å; H138-F236 WeakPolarHBondContact ND1-CE1 3.45Å; H138-F236 AromaticContact ND1-CE2 3.43Å; H138-F236 WeakPolarHBondContact ND1-CE2 3.35Å; H138-F236 AromaticContact ND1-CZ 3.14Å; H138-F236 WeakPolarHBondContact ND1-CZ 3.39Å
139H98.1Very high96.9Very high12 Ų1237.7 Ų37.76%0.05619%0.19CC..Hα-helixtrans-65.7-30.3-178.2-80.7-96.6000112.6Y31 E115 L116 D118 H135 P143Y31-H139 WeakPolarHBondContact OH-CB 3.48Å; E115-H139 PolarHBondContact O-CE1 2.79Å; E115-H139 PolarHBondContact O-ND1 3.27Å; L116-H139 HydrophobicContact CD2-CB 4.03Å; L116-H139 WeakPolarHBondContact CD2-O 3.32Å; D118-H139 IonicContact OD2-CE1 3.06Å; H135-H139 AromaticContact CE1-CD2 3.34Å; H135-H139 PolarHBondContact CE1-CD2 3.13Å; H135-H139 AromaticContact CE1-CE1 3.88Å; H135-H139 AromaticContact CE1-NE2 3.08Å; H135-H139 PolarHBondContact CE1-NE2 3.07Å; H135-H139 AromaticContact CG-CD2 3.92Å; H135-H139 AromaticContact ND1-CD2 3.45Å; H135-H139 PolarHBondContact ND1-CD2 3.48Å; H135-H139 AromaticContact ND1-NE2 3.41Å; H135-H139 PolarHBondContact ND1-NE2 3.34Å; H135-H139 AromaticContact NE2-CD2 3.79Å; H135-H139 AromaticContact NE2-NE2 3.88Å; H135-H139 WeakPolarHBondContact O-CB 3.39Å; H135-H139 PolarHBondContact O-CD2 3.13Å; H135-H139 VanDerWaalsContact O-CD2 3.23Å; H135-H139 PolarHBondContact O-N 2.94Å; H139-P143 WeakPolarHBondContact O-CD 3.44Å
140A98.3Very high97.3Very high14 Ų1431.7 Ų31.712%0.11616%0.162CC..Hα-helixtrans-72.9-41.8175.800000113.3V28 Y31 L32 V136 F137 H138V28-A140 HydrophobicContact CG1-CB 3.98Å; Y31-A140 HydrophobicContact CE1-CB 4.36Å; L32-A140 HydrophobicContact CD2-CB 4.11Å; V136-A140 VanDerWaalsContact O-CB 3.23Å; V136-A140 WeakPolarHBondContact O-CB 3.45Å; V136-A140 PolarHBondContact O-N 3.14Å; F137-A140 PolarHBondContact O-N 3.43Å; H138-A140 VanDerWaalsContact C-N 3.29Å; H138-A140 PolarHBondContact O-N 2.7Å
141I98.2Very high97.5Very high34 Ų3428.9 Ų28.917%0.17415%0.146CC..Hα-helixtrans-81.5-28.4-173.7-159.8170.3000113.2F137 H138 I144 S145 W228 F236F137-I141 HydrophobicContact CE2-CD1 4.25Å; F137-I141 HydrophobicContact CZ-CD1 3.95Å; F137-I141 VanDerWaalsContact O-CG2 3.31Å; F137-I141 WeakPolarHBondContact O-CG2 3.45Å; F137-I141 PolarHBondContact O-N 2.96Å; F137-I141 VanDerWaalsContact O-N 3.1Å; H138-I141 PolarHBondContact O-N 3.27Å; I141-I144 PolarHBondContact O-N 3.36Å; I141-S145 WeakPolarHBondContact O-CB 3.34Å; I141-S145 PolarHBondContact O-N 3.06Å; I141-S145 PolarHBondContact O-OG 3.38Å; I141-W228 HydrophobicContact CD1-CH2 3.83Å; I141-W228 HydrophobicContact CD1-CZ2 3.68Å; I141-W228 HydrophobicContact CG1-CH2 4.42Å; I141-W228 HydrophobicContact CG1-CZ2 3.93Å; I141-F236 HydrophobicContact CG2-CE1 4.44Å; I141-F236 HydrophobicContact CG2-CZ 3.74Å
142M98.2Very high97.6Very high11 Ų1129.1 Ų29.15%0.05414%0.144CC..Hα-helixtrans-63.8-50.1-173.8-74.7-67.5-7000113.5K112 H138 I144 S145 W146 F236K112-M142 HydrophobicContact CB-CB 4.45Å; K112-M142 HydrophobicContact CD-CB 4.4Å; K112-M142 HydrophobicContact CD-CE 4.06Å; K112-M142 HydrophobicContact CG-CB 4.39Å; H138-M142 WeakPolarHBondContact O-CB 3.21Å; H138-M142 WeakPolarHBondContact O-CG 3.22Å; H138-M142 PolarHBondContact O-N 2.9Å; H138-M142 VanDerWaalsContact O-N 3.1Å; M142-I144 VanDerWaalsContact C-N 3.32Å; M142-I144 PolarHBondContact O-N 2.8Å; M142-S145 PolarHBondContact O-N 3.43Å; M142-W146 WeakPolarHBondContact O-CB 3.36Å; M142-W146 PolarHBondContact O-N 3.37Å; M142-F236 HydrophobicContact SD-CE2 4.17Å
143P98.4Very high97.7Very high1 Ų127.2 Ų27.21%0.00613%0.131CC..Hα-helixtrans-60.1-40.7178.3-23.933.9000112.8V24 V28 F109 K112 I113 L116 H139 W146 W147V24-P143 HydrophobicContact CG1-CB 4.03Å; V28-P143 HydrophobicContact CG2-CB 4.34Å; V28-P143 HydrophobicContact CG2-CG 4.44Å; F109-P143 WeakPolarHBondContact CE2-O 3.48Å; K112-P143 HydrophobicContact CB-CG 4.13Å; I113-P143 HydrophobicContact CG1-CB 4.37Å; L116-P143 HydrophobicContact CD1-CG 4.4Å; L116-P143 HydrophobicContact CD2-CG 4.19Å; L116-P143 HydrophobicContact CG-CG 4.38Å; H139-P143 WeakPolarHBondContact O-CD 3.44Å; P143-W146 PolarHBondContact O-N 3.07Å; P143-W147 WeakPolarHBondContact O-CB 3.4Å; P143-W147 PolarHBondContact O-N 2.87Å
144I98.4Very high97.7Very high37 Ų3720 Ų2019%0.1910%0.099CC..Hα-helixtrans-63.9-52178.1-62168.1000109.6V24 F25 V28 I141 M142 W146 W147 Y148V24-I144 HydrophobicContact CG1-CG1 4.26Å; F25-I144 HydrophobicContact CD1-CD1 3.98Å; F25-I144 HydrophobicContact CD1-CG1 4.39Å; F25-I144 HydrophobicContact CE1-CD1 3.78Å; F25-I144 HydrophobicContact CE1-CG1 4.2Å; F25-I144 HydrophobicContact CE1-CG2 3.98Å; F25-I144 HydrophobicContact CE2-CG2 4.38Å; F25-I144 HydrophobicContact CZ-CG2 3.68Å; V28-I144 HydrophobicContact CB-CD1 4.35Å; V28-I144 HydrophobicContact CG1-CD1 4.16Å; V28-I144 HydrophobicContact CG2-CD1 4.23Å; V28-I144 HydrophobicContact CG2-CG1 4.08Å; I141-I144 PolarHBondContact O-N 3.36Å; M142-I144 VanDerWaalsContact C-N 3.32Å; M142-I144 PolarHBondContact O-N 2.8Å; I144-W146 VanDerWaalsContact C-N 3.27Å; I144-W146 PolarHBondContact O-N 2.96Å; I144-W147 WeakPolarHBondContact O-CB 3.25Å; I144-W147 PolarHBondContact O-N 2.65Å; I144-Y148 HydrophobicContact CG2-CD2 4.25Å; I144-Y148 HydrophobicContact CG2-CE2 4.11Å; I144-Y148 WeakPolarHBondContact O-CD2 3.41Å; I144-Y148 PolarHBondContact O-N 3.24Å
145S97.9Very high97.8Very high19 Ų1919 Ų1913%0.1339%0.094CC..Hα-helixtrans-55.7-44.7179.6-60.20000111.9I141 M142 Y148 G149 W228I141-S145 WeakPolarHBondContact O-CB 3.34Å; I141-S145 PolarHBondContact O-N 3.06Å; I141-S145 PolarHBondContact O-OG 3.38Å; M142-S145 PolarHBondContact O-N 3.43Å; S145-Y148 PolarHBondContact O-N 3Å; S145-G149 PolarHBondContact O-N 3.13Å; S145-W228 WeakPolarHBondContact OG-CZ2 3.44Å; S145-W228 PolarHBondContact OG-NE1 3.47Å
146W98.3Very high97.8Very high16 Ų1618 Ų186%0.0619%0.09CC..Hα-helixtrans-74.9-27.7-178.4-86.694.3000113.5C105 F108 F109 M142 P143 I144 G149 V150 H161 A162C105-W146 HydrophobicContact CB-CZ3 4.45Å; F108-W146 AromaticContact CD1-CD2 3.48Å; F108-W146 HydrophobicContact CD1-CD2 3.48Å; F108-W146 VanDerWaalsContact CD1-CD2 3.48Å; F108-W146 AromaticContact CD1-CE2 3.48Å; F108-W146 VanDerWaalsContact CD1-CE2 3.48Å; F108-W146 AromaticContact CD1-CE3 3.7Å; F108-W146 HydrophobicContact CD1-CE3 3.7Å; F108-W146 HydrophobicContact CD1-CG 4.05Å; F108-W146 AromaticContact CD1-CH2 3.92Å; F108-W146 HydrophobicContact CD1-CH2 3.92Å; F108-W146 AromaticContact CD1-CZ2 3.66Å; F108-W146 HydrophobicContact CD1-CZ2 3.66Å; F108-W146 AromaticContact CD1-CZ3 3.92Å; F108-W146 HydrophobicContact CD1-CZ3 3.92Å; F108-W146 AromaticContact CE1-CD1 3.81Å; F108-W146 AromaticContact CE1-CD2 3.56Å; F108-W146 HydrophobicContact CE1-CD2 3.56Å; F108-W146 AromaticContact CE1-CE2 3.1Å; F108-W146 HydrophobicContact CE1-CE3 4.22Å; F108-W146 AromaticContact CE1-CG 3.97Å; F108-W146 HydrophobicContact CE1-CG 3.97Å; F108-W146 HydrophobicContact CE1-CH2 4.1Å; F108-W146 AromaticContact CE1-CZ2 3.37Å; F108-W146 HydrophobicContact CE1-CZ2 3.37Å; F108-W146 HydrophobicContact CE1-CZ3 4.47Å; F108-W146 AromaticContact CE1-NE1 3.31Å; F108-W146 VanDerWaalsContact CE1-NE1 3.31Å; F108-W146 HydrophobicContact CZ-CZ2 4.06Å; F109-W146 HydrophobicContact CB-CB 4.14Å; F109-W146 HydrophobicContact CD2-CB 4.07Å; M142-W146 WeakPolarHBondContact O-CB 3.36Å; M142-W146 PolarHBondContact O-N 3.37Å; P143-W146 PolarHBondContact O-N 3.07Å; I144-W146 VanDerWaalsContact C-N 3.27Å; I144-W146 PolarHBondContact O-N 2.96Å; W146-G149 PolarHBondContact O-N 2.92Å; W146-V150 HydrophobicContact CE3-CG2 4.35Å; W146-V150 VanDerWaalsContact O-CG2 3.29Å; W146-V150 WeakPolarHBondContact O-CG2 3.46Å; W146-V150 PolarHBondContact O-N 3.33Å; W146-H161 AromaticContact CE2-CE1 3.57Å; W146-H161 AromaticContact CE2-NE2 3.91Å; W146-H161 AromaticContact CZ2-CE1 3.15Å; W146-H161 WeakPolarHBondContact CZ2-CE1 3.22Å; W146-H161 AromaticContact CZ2-ND1 3.81Å; W146-H161 AromaticContact CZ2-NE2 3.68Å; W146-H161 AromaticContact NE1-CE1 3.57Å; W146-H161 AromaticContact NE1-NE2 3.55Å; W146-A162 HydrophobicContact CH2-CB 3.22Å; W146-A162 HydrophobicContact CZ2-CB 3.31Å; W146-A162 HydrophobicContact CZ3-CB 4.35Å
147W98.5Very high97.7Very high8 Ų817.5 Ų17.53%0.039%0.086CC..Hα-helixtrans-58.8-49.2168.9-173.291.3000110.9L17 M18 P21 V24 F109 P143 I144 G149 V150 K151 Y152L17-W147 PolarHBondContact O-NE1 3.41Å; M18-W147 VanDerWaalsContact CE-CD1 3.48Å; M18-W147 HydrophobicContact CE-CG 4.38Å; P21-W147 HydrophobicContact CB-CD2 3.78Å; P21-W147 HydrophobicContact CB-CE3 3.71Å; P21-W147 HydrophobicContact CB-CH2 3.75Å; P21-W147 HydrophobicContact CB-CZ2 3.81Å; P21-W147 HydrophobicContact CB-CZ3 3.7Å; P21-W147 HydrophobicContact CG-CH2 3.93Å; P21-W147 HydrophobicContact CG-CZ2 4.29Å; P21-W147 HydrophobicContact CG-CZ3 4.07Å; P21-W147 VanDerWaalsContact N-CZ2 3.26Å; V24-W147 HydrophobicContact CG2-CB 4.35Å; V24-W147 VanDerWaalsContact CG2-CD1 3.45Å; V24-W147 HydrophobicContact CG2-CG 4.05Å; F109-W147 HydrophobicContact CD2-CB 4.29Å; F109-W147 HydrophobicContact CE2-CB 3.81Å; F109-W147 HydrophobicContact CE2-CG 4.43Å; F109-W147 HydrophobicContact CZ-CB 4.38Å; F109-W147 AromaticContact CZ-CD1 3.84Å; P143-W147 WeakPolarHBondContact O-CB 3.4Å; P143-W147 PolarHBondContact O-N 2.87Å; I144-W147 WeakPolarHBondContact O-CB 3.25Å; I144-W147 PolarHBondContact O-N 2.65Å; W147-G149 VanDerWaalsContact C-N 3.34Å; W147-G149 PolarHBondContact O-N 3.39Å; W147-V150 PolarHBondContact O-N 3.26Å; W147-K151 HydrophobicContact CE3-CB 4.23Å; W147-K151 HydrophobicContact CH2-CB 4.17Å; W147-K151 HydrophobicContact CH2-CD 4.18Å; W147-K151 HydrophobicContact CH2-CG 3.73Å; W147-K151 HydrophobicContact CZ2-CB 4.49Å; W147-K151 HydrophobicContact CZ2-CD 4.29Å; W147-K151 HydrophobicContact CZ2-CG 4.23Å; W147-K151 HydrophobicContact CZ3-CB 4.03Å; W147-K151 HydrophobicContact CZ3-CG 3.96Å; W147-K151 VanDerWaalsContact O-CB 3.22Å; W147-K151 WeakPolarHBondContact O-CB 3.34Å; W147-K151 PolarHBondContact O-N 3.3Å; W147-Y152 HydrophobicContact CZ3-CE2 4.37Å
148Y97.6Very high97.6Very high63 Ų6314.6 Ų14.625%0.2478%0.075CC..Hα-helixtrans-64.2-40.4174.9-76.4-87.5000111.3F5 F25 I144 S145 V150 K151 Y152F5-Y148 HydrophobicContact CE1-CD1 4.2Å; F5-Y148 HydrophobicContact CZ-CD1 4.24Å; F5-Y148 HydrophobicContact CZ-CE1 4.32Å; F25-Y148 HydrophobicContact CE2-CE2 4.37Å; F25-Y148 HydrophobicContact CZ-CE2 4.37Å; I144-Y148 HydrophobicContact CG2-CD2 4.25Å; I144-Y148 HydrophobicContact CG2-CE2 4.11Å; I144-Y148 WeakPolarHBondContact O-CD2 3.41Å; I144-Y148 PolarHBondContact O-N 3.24Å; S145-Y148 PolarHBondContact O-N 3Å; Y148-V150 PolarHBondContact O-N 3.17Å; Y148-K151 PolarHBondContact O-N 3.49Å; Y148-Y152 AromaticContact CD1-CD2 3.99Å; Y148-Y152 HydrophobicContact CD1-CD2 3.99Å; Y148-Y152 AromaticContact CD1-CE2 3.54Å; Y148-Y152 HydrophobicContact CD1-CE2 3.54Å; Y148-Y152 HydrophobicContact CE1-CE2 4.11Å; Y148-Y152 WeakPolarHBondContact O-CB 3.3Å; Y148-Y152 VanDerWaalsContact O-CD2 3.25Å; Y148-Y152 WeakPolarHBondContact O-CD2 3.49Å; Y148-Y152 PolarHBondContact O-N 2.94Å; Y148-Y152 VanDerWaalsContact O-N 3.12Å
149G97.5Very high97.6Very high11 Ų1114 Ų1411%0.1137%0.073CC..Hα-helixtrans-55.1-51.4174.800000112.6S145 W146 W147 V153S145-G149 PolarHBondContact O-N 3.13Å; W146-G149 PolarHBondContact O-N 2.92Å; W147-G149 VanDerWaalsContact C-N 3.34Å; W147-G149 PolarHBondContact O-N 3.39Å; G149-V153 CarbonylContact O-C 3.58Å; G149-V153 VanDerWaalsContact O-CA 3.31Å; G149-V153 WeakPolarHBondContact O-CA 3.22Å; G149-V153 VanDerWaalsContact O-CG2 3.31Å; G149-V153 WeakPolarHBondContact O-CG2 3.24Å; G149-V153 PolarHBondContact O-N 3.23Å
150V98.3Very high97.6Very high0 Ų014.6 Ų14.60%08%0.075CC..Hα-helixtrans-69.4-39.9-179.8179.90000111.7V12 M18 C105 W106 F109 W146 W147 Y148 Y152 P154V12-V150 HydrophobicContact CB-CG1 4.46Å; V12-V150 HydrophobicContact CG1-CG1 4.27Å; V12-V150 HydrophobicContact CG2-CG1 4.5Å; M18-V150 HydrophobicContact SD-CB 3.95Å; M18-V150 HydrophobicContact SD-CG1 3.51Å; M18-V150 VanDerWaalsContact SD-CG1 3.51Å; C105-V150 HydrophobicContact CB-CG2 3.99Å; C105-V150 VanDerWaalsContact O-CG2 3.3Å; C105-V150 WeakPolarHBondContact O-CG2 3.3Å; W106-V150 HydrophobicContact CB-CG1 4.01Å; F109-V150 HydrophobicContact CB-CG2 3.8Å; W146-V150 HydrophobicContact CE3-CG2 4.35Å; W146-V150 VanDerWaalsContact O-CG2 3.29Å; W146-V150 WeakPolarHBondContact O-CG2 3.46Å; W146-V150 PolarHBondContact O-N 3.33Å; W147-V150 PolarHBondContact O-N 3.26Å; Y148-V150 PolarHBondContact O-N 3.17Å; V150-Y152 VanDerWaalsContact C-N 3.29Å; V150-Y152 PolarHBondContact O-N 2.91Å; V150-P154 HydrophobicContact CG1-CB 4.47Å; V150-P154 WeakPolarHBondContact O-CB 3.41Å; V150-P154 WeakPolarHBondContact O-CD 3.35Å; V150-P154 WeakPolarHBondContact O-CG 3.16Å
151K97.7Very high97.6Very high10 Ų1015.5 Ų15.54%0.0438%0.077CC..Hα-helixtrans-65.6-31.4-177.1-174.862.4169.3-175.80113.3T8 D9 M18 W147 Y148T8-K151 HydrophobicContact CG2-CD 4.24Å; T8-K151 HydrophobicContact CG2-CG 4.01Å; D9-K151 PolarHBondContact N-O 3.08Å; M18-K151 WeakPolarHBondContact O-CE 3.07Å; M18-K151 PolarHBondContact O-NZ 3.38Å; W147-K151 HydrophobicContact CE3-CB 4.23Å; W147-K151 HydrophobicContact CH2-CB 4.17Å; W147-K151 HydrophobicContact CH2-CD 4.18Å; W147-K151 HydrophobicContact CH2-CG 3.73Å; W147-K151 HydrophobicContact CZ2-CB 4.49Å; W147-K151 HydrophobicContact CZ2-CD 4.29Å; W147-K151 HydrophobicContact CZ2-CG 4.23Å; W147-K151 HydrophobicContact CZ3-CB 4.03Å; W147-K151 HydrophobicContact CZ3-CG 3.96Å; W147-K151 VanDerWaalsContact O-CB 3.22Å; W147-K151 WeakPolarHBondContact O-CB 3.34Å; W147-K151 PolarHBondContact O-N 3.3Å; Y148-K151 PolarHBondContact O-N 3.49Å
152Y96.8Very high97.6Very high38 Ų3813.9 Ų13.915%0.1497%0.069CC..Hα-helixtrans-118.3-35.2-170.2-68.4-78.3000113.9F5 P6 T8 Y92 W147 Y148 V150 F225F5-Y152 HydrophobicContact CB-CD1 4.15Å; F5-Y152 HydrophobicContact CB-CE1 3.84Å; F5-Y152 HydrophobicContact CG-CE1 4.48Å; P6-Y152 HydrophobicContact CG-CD1 4.08Å; P6-Y152 HydrophobicContact CG-CG 4.42Å; P6-Y152 WeakPolarHBondContact O-CD1 3.46Å; P6-Y152 VanDerWaalsContact O-CE1 3.23Å; P6-Y152 WeakPolarHBondContact O-CE1 3.44Å; T8-Y152 HydrophobicContact CG2-CD1 4.15Å; T8-Y152 HydrophobicContact CG2-CE1 3.48Å; T8-Y152 VanDerWaalsContact CG2-CE1 3.48Å; Y92-Y152 PolarHBondContact OH-O 3.31Å; W147-Y152 HydrophobicContact CZ3-CE2 4.37Å; Y148-Y152 AromaticContact CD1-CD2 3.99Å; Y148-Y152 HydrophobicContact CD1-CD2 3.99Å; Y148-Y152 AromaticContact CD1-CE2 3.54Å; Y148-Y152 HydrophobicContact CD1-CE2 3.54Å; Y148-Y152 HydrophobicContact CE1-CE2 4.11Å; Y148-Y152 WeakPolarHBondContact O-CB 3.3Å; Y148-Y152 VanDerWaalsContact O-CD2 3.25Å; Y148-Y152 WeakPolarHBondContact O-CD2 3.49Å; Y148-Y152 PolarHBondContact O-N 2.94Å; Y148-Y152 VanDerWaalsContact O-N 3.12Å; V150-Y152 VanDerWaalsContact C-N 3.29Å; V150-Y152 PolarHBondContact O-N 2.91Å; Y152-F225 VanDerWaalsContact CB-CZ 3.45Å; Y152-F225 AromaticContact CD2-CZ 3.99Å; Y152-F225 HydrophobicContact CD2-CZ 3.99Å; Y152-F225 AromaticContact CG-CZ 3.9Å; Y152-F225 HydrophobicContact CG-CZ 3.9Å
153V97.2Very high97.6Very high7 Ų714.6 Ų14.64%0.0427%0.071CC..  trans-138.457-173.1-680000112.2P6 V90 G149 G155 Y221 P222 F225P6-V153 HydrophobicContact CG-CG1 4.49Å; V90-V153 HydrophobicContact CG2-CB 3.93Å; V90-V153 HydrophobicContact CG2-CG1 4.16Å; G149-V153 CarbonylContact O-C 3.58Å; G149-V153 VanDerWaalsContact O-CA 3.31Å; G149-V153 WeakPolarHBondContact O-CA 3.22Å; G149-V153 VanDerWaalsContact O-CG2 3.31Å; G149-V153 WeakPolarHBondContact O-CG2 3.24Å; G149-V153 PolarHBondContact O-N 3.23Å; V153-G155 PolarHBondContact O-N 3.06Å; V153-Y221 HydrophobicContact CB-CE2 4.26Å; V153-Y221 HydrophobicContact CG1-CE2 4.43Å; V153-P222 HydrophobicContact CG1-CG 3.81Å; V153-F225 HydrophobicContact CG1-CD2 3.86Å; V153-F225 HydrophobicContact CG1-CE2 4Å; V153-F225 HydrophobicContact CG1-CG 4.37Å; V153-F225 HydrophobicContact CG2-CB 4.29Å; V153-F225 HydrophobicContact CG2-CD1 3.69Å; V153-F225 HydrophobicContact CG2-CD2 4Å; V153-F225 HydrophobicContact CG2-CE1 3.95Å; V153-F225 HydrophobicContact CG2-CE2 4.26Å; V153-F225 HydrophobicContact CG2-CG 3.72Å; V153-F225 HydrophobicContact CG2-CZ 4.24Å
154P96.8Very high97.6Very high1 Ų115.8 Ų15.81%0.0068%0.078CC..SBendtrans-76.463.3-176.933.7-35.9000112.1D9 V12 A102 C105 V150D9-P154 HydrophobicContact CB-CG 4.11Å; D9-P154 WeakPolarHBondContact OD2-CG 3.32Å; V12-P154 HydrophobicContact CG1-CB 4.39Å; V12-P154 HydrophobicContact CG1-CG 4.25Å; A102-P154 WeakPolarHBondContact CA-O 3.34Å; A102-P154 HydrophobicContact CB-CB 3.92Å; A102-P154 HydrophobicContact CB-CG 4.27Å; C105-P154 HydrophobicContact CB-CB 4.4Å; V150-P154 HydrophobicContact CG1-CB 4.47Å; V150-P154 WeakPolarHBondContact O-CB 3.41Å; V150-P154 WeakPolarHBondContact O-CD 3.35Å; V150-P154 WeakPolarHBondContact O-CG 3.16Å
155G97.2Very high97.7Very high1 Ų114.2 Ų14.21%0.017%0.07CC..SBendtrans159.1-169.6-176.700000112.2V153V153-G155 PolarHBondContact O-N 3.06Å
156G96.4Very high97.7Very high0 Ų013.4 Ų13.40%06%0.064CC..G310 helixtrans71.3-165176.100000114.4Y83 Q88 G158 T159Y83-G156 PolarHBondContact OH-N 3.17Å; Q88-G156 CarbonylContact O-C 3.51Å; Q88-G156 VanDerWaalsContact O-CA 3.25Å; Q88-G156 WeakPolarHBondContact O-CA 3.27Å; G156-G158 PolarHBondContact O-N 2.87Å; G156-G158 VanDerWaalsContact O-N 3.09Å; G156-T159 WeakPolarHBondContact O-CB 3.43Å; G156-T159 PolarHBondContact O-N 3.21Å; G156-T159 VanDerWaalsContact O-N 3.1Å; G156-T159 PolarHBondContact O-OG1 3.38Å
157L96.5Very high97.7Very high3 Ų315.3 Ų15.32%0.0168%0.075CC..G310 helixtrans-58.5-26.6-173.668.386.5000114Q88 T159 F160 T213 Y221 N226Q88-L157 HydrophobicContact CB-CB 4.15Å; Q88-L157 PolarHBondContact O-N 2.82Å; L157-T159 PolarHBondContact O-N 3.38Å; L157-F160 WeakPolarHBondContact O-CB 3.36Å; L157-F160 PolarHBondContact O-N 3.14Å; L157-T213 HydrophobicContact CD2-CG2 4.33Å; L157-Y221 HydrophobicContact CD1-CD1 3.86Å; L157-Y221 HydrophobicContact CD1-CE1 3.79Å; L157-Y221 HydrophobicContact CD1-CE2 4.47Å; L157-Y221 HydrophobicContact CD1-CG 4.23Å; L157-Y221 HydrophobicContact CD2-CD1 3.91Å; L157-Y221 HydrophobicContact CD2-CD2 4.1Å; L157-Y221 HydrophobicContact CD2-CG 3.61Å; L157-Y221 HydrophobicContact CG-CD1 3.87Å; L157-Y221 HydrophobicContact CG-CD2 3.78Å; L157-Y221 HydrophobicContact CG-CE1 4.1Å; L157-Y221 HydrophobicContact CG-CE2 4.03Å; L157-Y221 HydrophobicContact CG-CG 3.7Å; L157-N226 HydrophobicContact CD1-CB 4.38Å
158G94.7Very high97.7Very high7 Ų715.5 Ų15.57%0.0728%0.077CC..G310 helixtrans-63.6-23.9179.400000113.8G156 F160 H161 Y221G156-G158 PolarHBondContact O-N 2.87Å; G156-G158 VanDerWaalsContact O-N 3.09Å; G158-F160 VanDerWaalsContact C-N 3.27Å; G158-F160 PolarHBondContact O-N 3.37Å; G158-H161 PolarHBondContact O-ND1 3.03Å; G158-Y221 WeakPolarHBondContact CA-OH 3.21Å
159T98.3Very high97.8Very high2 Ų212.9 Ų12.91%0.0127%0.067CC..Hα-helixtrans-75.1-13.6179.165.20000113.6F74 W79 M101 C105 G156 L157 H161 A162 F163F74-T159 HydrophobicContact CE1-CG2 4.31Å; W79-T159 VanDerWaalsContact CZ2-OG1 3.31Å; W79-T159 WeakPolarHBondContact CZ2-OG1 3.45Å; W79-T159 PolarHBondContact NE1-OG1 2.85Å; M101-T159 HydrophobicContact CG-CG2 4.44Å; M101-T159 HydrophobicContact SD-CG2 3.94Å; C105-T159 WeakPolarHBondContact SG-CG2 3.12Å; G156-T159 WeakPolarHBondContact O-CB 3.43Å; G156-T159 PolarHBondContact O-N 3.21Å; G156-T159 VanDerWaalsContact O-N 3.1Å; G156-T159 PolarHBondContact O-OG1 3.38Å; L157-T159 PolarHBondContact O-N 3.38Å; T159-H161 PolarHBondContact O-N 3.48Å; T159-A162 VanDerWaalsContact O-CB 3.32Å; T159-A162 WeakPolarHBondContact O-CB 3.25Å; T159-A162 PolarHBondContact O-N 2.88Å; T159-F163 PolarHBondContact O-N 2.74Å
160F98.5Very high97.8Very high24 Ų2413 Ų1311%0.1057%0.067CC..Hα-helixtrans-63.1-44-179-171.3-124.2000111.7W79 L85 L157 G158 A162 F163 L164 I205 H209W79-F160 AromaticContact CD2-CD2 3.86Å; W79-F160 HydrophobicContact CD2-CD2 3.86Å; W79-F160 AromaticContact CE3-CD2 3.71Å; W79-F160 HydrophobicContact CE3-CD2 3.71Å; W79-F160 HydrophobicContact CE3-CE2 4.32Å; W79-F160 HydrophobicContact CH2-CB 3.55Å; W79-F160 AromaticContact CH2-CD2 3.94Å; W79-F160 HydrophobicContact CH2-CD2 3.94Å; W79-F160 HydrophobicContact CH2-CG 4.03Å; W79-F160 VanDerWaalsContact CZ2-CA 3.42Å; W79-F160 HydrophobicContact CZ2-CB 3.38Å; W79-F160 HydrophobicContact CZ2-CD2 4.08Å; W79-F160 HydrophobicContact CZ2-CG 4.17Å; W79-F160 VanDerWaalsContact CZ2-N 3.25Å; W79-F160 HydrophobicContact CZ3-CB 4.25Å; W79-F160 AromaticContact CZ3-CD2 3.74Å; W79-F160 HydrophobicContact CZ3-CD2 3.74Å; W79-F160 HydrophobicContact CZ3-CG 4.24Å; L85-F160 HydrophobicContact CD2-CD2 4.05Å; L85-F160 HydrophobicContact CD2-CE1 4.31Å; L85-F160 HydrophobicContact CD2-CE2 3.49Å; L85-F160 VanDerWaalsContact CD2-CE2 3.49Å; L85-F160 HydrophobicContact CD2-CZ 3.64Å; L157-F160 WeakPolarHBondContact O-CB 3.36Å; L157-F160 PolarHBondContact O-N 3.14Å; G158-F160 VanDerWaalsContact C-N 3.27Å; G158-F160 PolarHBondContact O-N 3.37Å; F160-A162 VanDerWaalsContact C-N 3.26Å; F160-A162 PolarHBondContact O-N 3.36Å; F160-F163 WeakPolarHBondContact O-CB 3.46Å; F160-F163 PolarHBondContact O-N 2.9Å; F160-L164 HydrophobicContact CD1-CD1 4.11Å; F160-L164 HydrophobicContact CE1-CD1 3.7Å; F160-L164 HydrophobicContact CE1-CG 4.44Å; F160-L164 HydrophobicContact CE2-CG 4.46Å; F160-L164 HydrophobicContact CZ-CD1 3.93Å; F160-L164 HydrophobicContact CZ-CD2 4.4Å; F160-L164 HydrophobicContact CZ-CG 4.3Å; F160-L164 WeakPolarHBondContact O-CG 3.29Å; F160-L164 PolarHBondContact O-N 3.23Å; F160-I205 HydrophobicContact CE1-CG2 3.88Å; F160-I205 HydrophobicContact CZ-CG2 4.32Å; F160-H209 HydrophobicContact CD1-CB 3.95Å; F160-H209 AromaticContact CD1-CD2 3.62Å; F160-H209 AromaticContact CD1-CE1 3.8Å; F160-H209 AromaticContact CD1-CG 3.45Å; F160-H209 VanDerWaalsContact CD1-CG 3.45Å; F160-H209 AromaticContact CD1-ND1 3.59Å; F160-H209 AromaticContact CD1-NE2 3.82Å; F160-H209 HydrophobicContact CE1-CB 4Å; F160-H209 AromaticContact CE1-CD2 3.91Å; F160-H209 AromaticContact CE1-CG 3.87Å
161H97.8Very high97.8Very high32 Ų3218.6 Ų18.615%0.1489%0.091CC..Hα-helixtrans-66.1-33.6179.1104.4-96.7000111.7W146 G158 T159 N165 V206W146-H161 AromaticContact CE2-CE1 3.57Å; W146-H161 AromaticContact CE2-NE2 3.91Å; W146-H161 AromaticContact CZ2-CE1 3.15Å; W146-H161 WeakPolarHBondContact CZ2-CE1 3.22Å; W146-H161 AromaticContact CZ2-ND1 3.81Å; W146-H161 AromaticContact CZ2-NE2 3.68Å; W146-H161 AromaticContact NE1-CE1 3.57Å; W146-H161 AromaticContact NE1-NE2 3.55Å; G158-H161 PolarHBondContact O-ND1 3.03Å; T159-H161 PolarHBondContact O-N 3.48Å; H161-N165 VanDerWaalsContact O-CB 3.25Å; H161-N165 WeakPolarHBondContact O-CB 3.3Å; H161-N165 PolarHBondContact O-N 2.96Å; H161-V206 HydrophobicContact CB-CB 4.32Å; H161-V206 HydrophobicContact CB-CG1 3.7Å; H161-V206 HydrophobicContact CB-CG2 3.56Å
162A98.7Very high97.8Very high0 Ų018.5 Ų18.50%09%0.091CC..Hα-helixtrans-64.9-46.1175.200000110.9F74 F108 W146 T159 F160 L164 N165 C166F74-A162 HydrophobicContact CE1-CB 4.21Å; F74-A162 HydrophobicContact CE2-CB 3.85Å; F74-A162 HydrophobicContact CZ-CB 3.59Å; F108-A162 HydrophobicContact CD1-CB 4.35Å; F108-A162 HydrophobicContact CD2-CB 4.15Å; F108-A162 HydrophobicContact CE1-CB 4.23Å; F108-A162 HydrophobicContact CE2-CB 3.95Å; F108-A162 HydrophobicContact CG-CB 4.3Å; F108-A162 HydrophobicContact CZ-CB 3.97Å; W146-A162 HydrophobicContact CH2-CB 3.22Å; W146-A162 HydrophobicContact CZ2-CB 3.31Å; W146-A162 HydrophobicContact CZ3-CB 4.35Å; T159-A162 VanDerWaalsContact O-CB 3.32Å; T159-A162 WeakPolarHBondContact O-CB 3.25Å; T159-A162 PolarHBondContact O-N 2.88Å; F160-A162 VanDerWaalsContact C-N 3.26Å; F160-A162 PolarHBondContact O-N 3.36Å; A162-L164 PolarHBondContact O-N 2.93Å; A162-N165 WeakPolarHBondContact O-CB 3.41Å; A162-N165 PolarHBondContact O-N 2.91Å; A162-N165 VanDerWaalsContact O-N 3.14Å; A162-C166 PolarHBondContact O-N 2.94Å; A162-C166 PolarHBondContact O-SG 2.78Å
163F98.8Very high97.9Very high26 Ų2616.7 Ų16.711%0.1148%0.084CC..Hα-helixtrans-57.1-49.7177174.9-130.6000111.4V71 F74 A75 W79 T159 F160 N165 C166 I167V71-F163 HydrophobicContact CB-CE2 4.49Å; V71-F163 HydrophobicContact CG1-CD2 4.5Å; V71-F163 HydrophobicContact CG1-CE2 3.76Å; V71-F163 WeakPolarHBondContact O-CE2 3.43Å; F74-F163 HydrophobicContact CB-CB 3.92Å; F74-F163 HydrophobicContact CB-CD2 3.54Å; F74-F163 HydrophobicContact CB-CE2 4.37Å; F74-F163 HydrophobicContact CB-CG 4.02Å; F74-F163 HydrophobicContact CD2-CB 4.39Å; F74-F163 HydrophobicContact CG-CB 4.13Å; F74-F163 HydrophobicContact CG-CD2 4.45Å; A75-F163 HydrophobicContact CB-CE2 4.01Å; A75-F163 HydrophobicContact CB-CZ 4.22Å; W79-F163 HydrophobicContact CB-CD1 4.04Å; W79-F163 HydrophobicContact CB-CE1 4.09Å; W79-F163 HydrophobicContact CG-CD1 4.03Å; W79-F163 HydrophobicContact CG-CG 4.38Å; T159-F163 PolarHBondContact O-N 2.74Å; F160-F163 WeakPolarHBondContact O-CB 3.46Å; F160-F163 PolarHBondContact O-N 2.9Å; F163-N165 VanDerWaalsContact C-N 3.33Å; F163-N165 PolarHBondContact O-N 3.29Å; F163-C166 PolarHBondContact O-N 3.46Å; F163-I167 HydrophobicContact CE1-CD1 4.32Å; F163-I167 HydrophobicContact CE2-CD1 4.16Å; F163-I167 HydrophobicContact CZ-CD1 4.03Å; F163-I167 PolarHBondContact O-N 2.75Å
164L98.6Very high97.9Very high27 Ų2719 Ų1914%0.14110%0.098CC..Hα-helixtrans-63.5-38.5175.6-62176.6000112.2F160 A162 C166 I167 V168 Q202 I205 V206F160-L164 HydrophobicContact CD1-CD1 4.11Å; F160-L164 HydrophobicContact CE1-CD1 3.7Å; F160-L164 HydrophobicContact CE1-CG 4.44Å; F160-L164 HydrophobicContact CE2-CG 4.46Å; F160-L164 HydrophobicContact CZ-CD1 3.93Å; F160-L164 HydrophobicContact CZ-CD2 4.4Å; F160-L164 HydrophobicContact CZ-CG 4.3Å; F160-L164 WeakPolarHBondContact O-CG 3.29Å; F160-L164 PolarHBondContact O-N 3.23Å; A162-L164 PolarHBondContact O-N 2.93Å; L164-C166 PolarHBondContact O-N 3.33Å; L164-I167 PolarHBondContact O-N 3.45Å; L164-V168 PolarHBondContact O-N 2.89Å; L164-V168 VanDerWaalsContact O-N 3.13Å; L164-Q202 HydrophobicContact CB-CG 3.76Å; L164-I205 HydrophobicContact CD1-CB 4.18Å; L164-I205 HydrophobicContact CD1-CG2 3.58Å; L164-V206 HydrophobicContact CD1-CG2 3.99Å
165N98.7Very high97.8Very high4 Ų420 Ų202%0.02110%0.102CC..Hα-helixtrans-60.8-43.6175.9-178.8-104.9000111.8F108 K112 H161 A162 F163 I167 V168 H169F108-N165 HydrophobicContact CE2-CB 4.27Å; F108-N165 HydrophobicContact CZ-CB 4.15Å; F108-N165 WeakPolarHBondContact CZ-OD1 3.12Å; K112-N165 PolarHBondContact NZ-OD1 3.21Å; H161-N165 VanDerWaalsContact O-CB 3.25Å; H161-N165 WeakPolarHBondContact O-CB 3.3Å; H161-N165 PolarHBondContact O-N 2.96Å; A162-N165 WeakPolarHBondContact O-CB 3.41Å; A162-N165 PolarHBondContact O-N 2.91Å; A162-N165 VanDerWaalsContact O-N 3.14Å; F163-N165 VanDerWaalsContact C-N 3.33Å; F163-N165 PolarHBondContact O-N 3.29Å; N165-I167 VanDerWaalsContact C-N 3.3Å; N165-I167 PolarHBondContact O-N 2.91Å; N165-V168 PolarHBondContact O-N 3.29Å; N165-H169 PolarHBondContact ND2-CD2 3.3Å; N165-H169 PolarHBondContact ND2-NE2 3.39Å; N165-H169 VanDerWaalsContact O-CB 3.3Å; N165-H169 WeakPolarHBondContact O-CB 3.41Å; N165-H169 PolarHBondContact O-CD2 2.91Å; N165-H169 PolarHBondContact O-N 3.38Å
166C98.8Very high97.7Very high2 Ų223 Ų231%0.01411%0.113CC..Hα-helixtrans-59.9-40.2176.9-68.30000112.2L70 V71 F108 A162 F163 L164 H169 A170L70-C166 HydrophobicContact CB-CB 4.24Å; L70-C166 WeakPolarHBondContact CB-SG 3.32Å; V71-C166 VanDerWaalsContact CG2-C 3.49Å; V71-C166 HydrophobicContact CG2-CB 3.49Å; V71-C166 VanDerWaalsContact CG2-CB 3.49Å; F108-C166 WeakPolarHBondContact CD2-SG 3.08Å; F108-C166 WeakPolarHBondContact CE2-SG 3.23Å; A162-C166 PolarHBondContact O-N 2.94Å; A162-C166 PolarHBondContact O-SG 2.78Å; F163-C166 PolarHBondContact O-N 3.46Å; L164-C166 PolarHBondContact O-N 3.33Å; C166-H169 PolarHBondContact O-N 2.79Å; C166-A170 WeakPolarHBondContact O-CB 3.49Å; C166-A170 PolarHBondContact O-N 2.95Å
167I98.8Very high97.5Very high55 Ų5523.7 Ų23.728%0.28212%0.12SC..Hα-helixtrans-61-51176.9-64.1170.7000109.6V71 F163 L164 N165 H169 A170 F171V71-I167 HydrophobicContact CB-CG1 4.44Å; V71-I167 HydrophobicContact CG1-CG1 3.89Å; V71-I167 HydrophobicContact CG2-CB 4.3Å; V71-I167 HydrophobicContact CG2-CG1 3.61Å; F163-I167 HydrophobicContact CE1-CD1 4.32Å; F163-I167 HydrophobicContact CE2-CD1 4.16Å; F163-I167 HydrophobicContact CZ-CD1 4.03Å; F163-I167 PolarHBondContact O-N 2.75Å; L164-I167 PolarHBondContact O-N 3.45Å; N165-I167 VanDerWaalsContact C-N 3.3Å; N165-I167 PolarHBondContact O-N 2.91Å; I167-H169 VanDerWaalsContact C-N 3.33Å; I167-H169 PolarHBondContact O-N 3.44Å; I167-A170 PolarHBondContact O-N 3.38Å; I167-F171 HydrophobicContact CG2-CD2 4.29Å; I167-F171 HydrophobicContact CG2-CE2 3.9Å; I167-F171 WeakPolarHBondContact O-CD2 3.15Å; I167-F171 PolarHBondContact O-N 3.34Å
168V98.7Very high97.3Very high12 Ų1225.7 Ų25.77%0.07313%0.131CC..Hα-helixtrans-64.7-38.3179.7175.40000111.6L164 N165 F171 M172 Q199 Q202L164-V168 PolarHBondContact O-N 2.89Å; L164-V168 VanDerWaalsContact O-N 3.13Å; N165-V168 PolarHBondContact O-N 3.29Å; V168-F171 PolarHBondContact O-N 3.14Å; V168-M172 WeakPolarHBondContact O-CB 3.33Å; V168-M172 PolarHBondContact O-N 2.88Å; V168-Q199 HydrophobicContact CG1-CB 4.41Å; V168-Q199 HydrophobicContact CG1-CG 3.41Å; V168-Q199 VanDerWaalsContact CG1-CG 3.41Å; V168-Q202 HydrophobicContact CG2-CB 4.04Å; V168-Q202 HydrophobicContact CG2-CG 4.21Å; V168-Q202 VanDerWaalsContact CG2-OE1 3.3Å
169H98.4Very high97.1Very high9 Ų926.9 Ų26.94%0.04214%0.14CC..Hα-helixtrans-67.7-35.8178.6-82.4-135.9000112.2K112 E115 N165 C166 I167 F171 M172 Y173K112-H169 PolarHBondContact NZ-CE1 3.5Å; K112-H169 VanDerWaalsContact NZ-CE1 3.33Å; K112-H169 PolarHBondContact NZ-ND1 3.43Å; E115-H169 IonicContact OE1-CE1 3.84Å; E115-H169 PolarHBondContact OE1-CE1 3.39Å; E115-H169 IonicContact OE1-CG 3.15Å; E115-H169 IonicContact OE1-ND1 3.41Å; E115-H169 PolarHBondContact OE1-ND1 2.86Å; E115-H169 IonicContact OE2-CE1 3.91Å; E115-H169 PolarHBondContact OE2-CE1 3.26Å; E115-H169 VanDerWaalsContact OE2-CE1 3.22Å; E115-H169 IonicContact OE2-ND1 3.77Å; E115-H169 PolarHBondContact OE2-ND1 3.1Å; N165-H169 PolarHBondContact ND2-CD2 3.3Å; N165-H169 PolarHBondContact ND2-NE2 3.39Å; N165-H169 VanDerWaalsContact O-CB 3.3Å; N165-H169 WeakPolarHBondContact O-CB 3.41Å; N165-H169 PolarHBondContact O-CD2 2.91Å; N165-H169 PolarHBondContact O-N 3.38Å; C166-H169 PolarHBondContact O-N 2.79Å; I167-H169 VanDerWaalsContact C-N 3.33Å; I167-H169 PolarHBondContact O-N 3.44Å; H169-F171 VanDerWaalsContact C-N 3.3Å; H169-F171 PolarHBondContact O-N 2.86Å; H169-M172 PolarHBondContact O-N 2.96Å; H169-Y173 HydrophobicContact CB-CD2 4.24Å; H169-Y173 HydrophobicContact CB-CE2 4.11Å; H169-Y173 AromaticContact ND1-CE2 3.82Å; H169-Y173 WeakPolarHBondContact O-CD2 3.27Å; H169-Y173 PolarHBondContact O-N 3.42Å
170A98.7Very high96.6Very high13 Ų1327.2 Ų27.211%0.10714%0.142CC..Hα-helixtrans-58.2-43.9172.500000111.4C166 I167 T174C166-A170 WeakPolarHBondContact O-CB 3.49Å; C166-A170 PolarHBondContact O-N 2.95Å; I167-A170 PolarHBondContact O-N 3.38Å; A170-T174 WeakPolarHBondContact O-CB 3.19Å; A170-T174 PolarHBondContact O-N 2.99Å; A170-T174 VanDerWaalsContact O-N 3.16Å; A170-T174 PolarHBondContact O-OG1 2.73Å
171F98.3Very high96.1Very high117 Ų11726.8 Ų26.851%0.51314%0.144SC..Hα-helixtrans-68.4-41.8173.1-67.7-66.9000112.4I167 V168 H169 Y173 T174 Y175 W191 L195I167-F171 HydrophobicContact CG2-CD2 4.29Å; I167-F171 HydrophobicContact CG2-CE2 3.9Å; I167-F171 WeakPolarHBondContact O-CD2 3.15Å; I167-F171 PolarHBondContact O-N 3.34Å; V168-F171 PolarHBondContact O-N 3.14Å; H169-F171 VanDerWaalsContact C-N 3.3Å; H169-F171 PolarHBondContact O-N 2.86Å; F171-Y173 PolarHBondContact O-N 3.13Å; F171-T174 WeakPolarHBondContact O-CB 3.37Å; F171-T174 PolarHBondContact O-N 2.93Å; F171-Y175 PolarHBondContact O-N 3.45Å; F171-W191 HydrophobicContact CB-CH2 4.4Å; F171-W191 HydrophobicContact CB-CZ3 4.32Å; F171-W191 WeakPolarHBondContact O-CH2 3.35Å; F171-L195 HydrophobicContact CB-CD1 4.06Å
172M97.7Very high95.5Very high8 Ų825.8 Ų25.84%0.03914%0.141CC..Hα-helixtrans-59.9-48.4180-173.4-17478.300112.3V168 H169 T174 Y175 Y176 L195V168-M172 WeakPolarHBondContact O-CB 3.33Å; V168-M172 PolarHBondContact O-N 2.88Å; H169-M172 PolarHBondContact O-N 2.96Å; M172-T174 VanDerWaalsContact C-N 3.31Å; M172-T174 PolarHBondContact O-N 3.46Å; M172-Y175 VanDerWaalsContact O-CB 3.31Å; M172-Y175 WeakPolarHBondContact O-CB 3.46Å; M172-Y175 PolarHBondContact O-N 3.28Å; M172-Y175 VanDerWaalsContact O-N 3.16Å; M172-Y176 HydrophobicContact CE-CD2 4.43Å; M172-Y176 HydrophobicContact CE-CE2 3.82Å; M172-Y176 HydrophobicContact CG-CD2 4.24Å; M172-Y176 HydrophobicContact CG-CE1 4.32Å; M172-Y176 HydrophobicContact CG-CE2 3.7Å; M172-Y176 PolarHBondContact O-N 3.18Å; M172-Y176 HydrophobicContact SD-CE2 3.91Å; M172-L195 HydrophobicContact CB-CD1 4.15Å; M172-L195 HydrophobicContact CB-CD2 4.34Å; M172-L195 HydrophobicContact CG-CD2 4.28Å
173Y98.3Very high94.7Very high0 Ų031 Ų310%018%0.176CC..Hα-helixtrans-72-27.2178.8-69.8-61.1000112.6N60 L63 V64 E115 D118 H169 F171 Y175 Y176 G177N60-Y173 WeakPolarHBondContact OD1-CD1 3.48Å; L63-Y173 HydrophobicContact CB-CD1 3.86Å; L63-Y173 HydrophobicContact CB-CD2 3.53Å; L63-Y173 HydrophobicContact CB-CE1 4.19Å; L63-Y173 HydrophobicContact CB-CE2 3.86Å; L63-Y173 HydrophobicContact CB-CG 3.55Å; L63-Y173 HydrophobicContact CD1-CD1 3.76Å; L63-Y173 HydrophobicContact CD1-CD2 4.32Å; L63-Y173 HydrophobicContact CD1-CE1 3.32Å; L63-Y173 HydrophobicContact CD1-CE2 3.92Å; L63-Y173 HydrophobicContact CD1-CG 4.26Å; L63-Y173 VanDerWaalsContact CD1-CZ 3.43Å; L63-Y173 HydrophobicContact CG-CD1 4.48Å; L63-Y173 HydrophobicContact CG-CE1 4.39Å; L63-Y173 HydrophobicContact CG-CE2 4.4Å; V64-Y173 VanDerWaalsContact CG2-C 3.42Å; E115-Y173 VanDerWaalsContact CD-OH 3.27Å; E115-Y173 WeakPolarHBondContact CG-OH 3.14Å; E115-Y173 PolarHBondContact OE1-OH 3.34Å; D118-Y173 PolarHBondContact OD2-OH 3.44Å; D118-Y173 VanDerWaalsContact OD2-OH 3.11Å; H169-Y173 HydrophobicContact CB-CD2 4.24Å; H169-Y173 HydrophobicContact CB-CE2 4.11Å; H169-Y173 AromaticContact ND1-CE2 3.82Å; H169-Y173 WeakPolarHBondContact O-CD2 3.27Å; H169-Y173 PolarHBondContact O-N 3.42Å; F171-Y173 PolarHBondContact O-N 3.13Å; Y173-Y175 VanDerWaalsContact C-N 3.32Å; Y173-Y176 AromaticContact CD1-CD2 3.95Å; Y173-Y176 HydrophobicContact CD1-CD2 3.95Å; Y173-Y176 HydrophobicContact CE1-CD2 4.11Å; Y173-Y176 PolarHBondContact O-N 2.74Å; Y173-G177 PolarHBondContact O-N 3.4Å
174T96.6Very high94.1Very high55 Ų5539.8 Ų39.834%0.33721%0.208SC..Hα-helixtrans-62-44.8168.9-60.40000110.1V64 A170 F171 M172 G177 L178V64-T174 WeakPolarHBondContact CG2-OG1 2.97Å; A170-T174 WeakPolarHBondContact O-CB 3.19Å; A170-T174 PolarHBondContact O-N 2.99Å; A170-T174 VanDerWaalsContact O-N 3.16Å; A170-T174 PolarHBondContact O-OG1 2.73Å; F171-T174 WeakPolarHBondContact O-CB 3.37Å; F171-T174 PolarHBondContact O-N 2.93Å; M172-T174 VanDerWaalsContact C-N 3.31Å; M172-T174 PolarHBondContact O-N 3.46Å; T174-G177 PolarHBondContact O-N 2.88Å; T174-L178 HydrophobicContact CG2-CD1 4.29Å; T174-L178 WeakPolarHBondContact O-CG 3.26Å; T174-L178 PolarHBondContact O-N 3.04Å
175Y95.6Very high93.5Very high23 Ų2342.2 Ų42.29%0.0922%0.218CC..Hα-helixtrans-61.3-47.5175.3-179.8-90.4000112.2F171 M172 Y173 G177 L178 A179 I189 W191 K192 L195F171-Y175 PolarHBondContact O-N 3.45Å; M172-Y175 VanDerWaalsContact O-CB 3.31Å; M172-Y175 WeakPolarHBondContact O-CB 3.46Å; M172-Y175 PolarHBondContact O-N 3.28Å; M172-Y175 VanDerWaalsContact O-N 3.16Å; Y173-Y175 VanDerWaalsContact C-N 3.32Å; Y175-G177 PolarHBondContact O-N 2.95Å; Y175-L178 PolarHBondContact O-N 2.75Å; Y175-A179 HydrophobicContact CE1-CB 4.44Å; Y175-A179 VanDerWaalsContact O-CB 3.31Å; Y175-A179 WeakPolarHBondContact O-CB 3.44Å; Y175-A179 PolarHBondContact O-N 3.36Å; Y175-I189 HydrophobicContact CE2-CB 3.7Å; Y175-I189 HydrophobicContact CE2-CG2 4.48Å; Y175-I189 VanDerWaalsContact CE2-O 3.32Å; Y175-I189 WeakPolarHBondContact CE2-O 3.47Å; Y175-W191 HydrophobicContact CD2-CD2 4.15Å; Y175-W191 AromaticContact CD2-CE2 3.83Å; Y175-W191 HydrophobicContact CD2-CE3 4.47Å; Y175-W191 HydrophobicContact CD2-CH2 4.31Å; Y175-W191 AromaticContact CD2-CZ2 3.92Å; Y175-W191 HydrophobicContact CD2-CZ2 3.92Å; Y175-W191 HydrophobicContact CG-CH2 4.46Å; Y175-W191 HydrophobicContact CG-CZ2 4.35Å; Y175-K192 HydrophobicContact CE1-CD 4.46Å; Y175-K192 HydrophobicContact CE1-CG 4.2Å; Y175-K192 HydrophobicContact CE2-CB 3.71Å; Y175-K192 HydrophobicContact CE2-CG 4.26Å; Y175-K192 WeakPolarHBondContact OH-CB 3.23Å; Y175-K192 WeakPolarHBondContact OH-CD 3.41Å; Y175-L195 HydrophobicContact CD1-CD2 4.12Å; Y175-L195 HydrophobicContact CD2-CD2 4.48Å; Y175-L195 HydrophobicContact CG-CD2 3.88Å
176Y94.1Very high92.7Very high64 Ų6446.3 Ų46.325%0.25124%0.237SC..Hα-helixtrans-65.4-37.5178.4-67.5-15.3000112.9N60 M172 Y173 A179 S180N60-Y176 WeakPolarHBondContact OD1-CB 3.32Å; M172-Y176 HydrophobicContact CE-CD2 4.43Å; M172-Y176 HydrophobicContact CE-CE2 3.82Å; M172-Y176 HydrophobicContact CG-CD2 4.24Å; M172-Y176 HydrophobicContact CG-CE1 4.32Å; M172-Y176 HydrophobicContact CG-CE2 3.7Å; M172-Y176 PolarHBondContact O-N 3.18Å; M172-Y176 HydrophobicContact SD-CE2 3.91Å; Y173-Y176 AromaticContact CD1-CD2 3.95Å; Y173-Y176 HydrophobicContact CD1-CD2 3.95Å; Y173-Y176 HydrophobicContact CE1-CD2 4.11Å; Y173-Y176 PolarHBondContact O-N 2.74Å; Y176-A179 PolarHBondContact O-N 2.91Å; Y176-S180 WeakPolarHBondContact O-CB 3.47Å; Y176-S180 PolarHBondContact O-N 3.14Å; Y176-S180 PolarHBondContact O-OG 3.4Å; Y176-S180 VanDerWaalsContact O-OG 3.05Å
177G93.3Very high92.1Very high14 Ų1452.9 Ų52.914%0.14427%0.265CS..Hα-helixtrans-57.4-53.7171.400000111.3Y173 T174 Y175 A179 S180 A181Y173-G177 PolarHBondContact O-N 3.4Å; T174-G177 PolarHBondContact O-N 2.88Å; Y175-G177 PolarHBondContact O-N 2.95Å; G177-A179 PolarHBondContact O-N 3.03Å; G177-S180 PolarHBondContact O-N 3.32Å; G177-S180 PolarHBondContact O-OG 2.85Å; G177-A181 WeakPolarHBondContact O-CB 3.37Å; G177-A181 PolarHBondContact O-N 3.2Å
178L92.9Very high91.5Very high45 Ų4555.6 Ų55.624%0.23627%0.272CS..Hα-helixtrans-61.3-42.2177.4-68.9172.7000112.6T174 Y175 S180 A181 F185 I189T174-L178 HydrophobicContact CG2-CD1 4.29Å; T174-L178 WeakPolarHBondContact O-CG 3.26Å; T174-L178 PolarHBondContact O-N 3.04Å; Y175-L178 PolarHBondContact O-N 2.75Å; L178-S180 VanDerWaalsContact C-N 3.27Å; L178-S180 PolarHBondContact O-N 3.45Å; L178-A181 PolarHBondContact O-N 3.49Å; L178-F185 HydrophobicContact CD2-CD1 3.93Å; L178-F185 WeakPolarHBondContact O-CB 3.42Å; L178-I189 HydrophobicContact CB-CG2 4.38Å
179A89.7Confident91.1Very high33 Ų3356.5 Ų56.527%0.27328%0.277SS..Hα-helixtrans-65.1-30.3178.600000112.7Y175 Y176 G177 Q186 I189Y175-A179 HydrophobicContact CE1-CB 4.44Å; Y175-A179 VanDerWaalsContact O-CB 3.31Å; Y175-A179 WeakPolarHBondContact O-CB 3.44Å; Y175-A179 PolarHBondContact O-N 3.36Å; Y176-A179 PolarHBondContact O-N 2.91Å; G177-A179 PolarHBondContact O-N 3.03Å; A179-Q186 PolarHBondContact O-NE2 2.96Å; A179-I189 HydrophobicContact CB-CG2 4.32Å
180S88Confident90.7Very high8 Ų864.7 Ų64.76%0.05631%0.307CS..Hα-helixtrans-87-19.3176.768.20000113.8R53 Y176 G177 L178 G182R53-S180 WeakPolarHBondContact CG-O 3.44Å; R53-S180 PolarHBondContact NE-O 3.35Å; Y176-S180 WeakPolarHBondContact O-CB 3.47Å; Y176-S180 PolarHBondContact O-N 3.14Å; Y176-S180 PolarHBondContact O-OG 3.4Å; Y176-S180 VanDerWaalsContact O-OG 3.05Å; G177-S180 PolarHBondContact O-N 3.32Å; G177-S180 PolarHBondContact O-OG 2.85Å; L178-S180 VanDerWaalsContact C-N 3.27Å; L178-S180 PolarHBondContact O-N 3.45Å; S180-G182 PolarHBondContact O-N 3.26Å; S180-G182 VanDerWaalsContact O-N 3.07Å
181A88.1Confident90.4Very high16 Ų1666.2 Ų66.213%0.13231%0.31CS..SBendtrans-70.5-0.4-177.200000115R53 G177 L178 F185R53-A181 PolarHBondContact NH2-O 3.01Å; G177-A181 WeakPolarHBondContact O-CB 3.37Å; G177-A181 PolarHBondContact O-N 3.2Å; L178-A181 PolarHBondContact O-N 3.49Å; A181-F185 HydrophobicContact CB-CB 4.18Å; A181-F185 HydrophobicContact CB-CD2 3.53Å; A181-F185 HydrophobicContact CB-CE2 3.99Å; A181-F185 HydrophobicContact CB-CG 3.85Å; A181-F185 WeakPolarHBondContact O-CD2 3.27Å
182G84Confident90.2Very high10 Ų1064.4 Ų64.410%0.10330%0.302CS..  trans102.7-177.2168.500000115.5S180 R184 F185S180-G182 PolarHBondContact O-N 3.26Å; S180-G182 VanDerWaalsContact O-N 3.07Å; G182-R184 VanDerWaalsContact C-N 3.31Å; G182-R184 PolarHBondContact O-N 3.12Å; G182-F185 PolarHBondContact O-N 3.39Å
183P82.9Confident89.9Confident111 Ų11168.2 Ų68.272%0.72132%0.318SS*.Hα-helixtrans-57.7-38.2-169.8-27.435.4000114.2F185 Q186P183-F185 PolarHBondContact O-N 2.9Å; P183-F185 VanDerWaalsContact O-N 3.13Å; P183-Q186 WeakPolarHBondContact O-CB 3.46Å; P183-Q186 PolarHBondContact O-N 2.93Å; P183-Q186 VanDerWaalsContact O-N 3.1Å
184R85.5Confident89.8Confident210 Ų21075.7 Ų75.779%0.79235%0.348SS*.Hα-helixtrans-58.8-27.3179.2-172.3176.3178.1177-0.2113.3G182G182-R184 VanDerWaalsContact C-N 3.31Å; G182-R184 PolarHBondContact O-N 3.12Å
185F86.1Confident89.8Confident78 Ų7873.6 Ų73.634%0.34233%0.334SS..Hα-helixtrans-96.7-8.9-178.4-66.8-86.3000113.7L178 A181 G182 P183 K187 Y188L178-F185 HydrophobicContact CD2-CD1 3.93Å; L178-F185 WeakPolarHBondContact O-CB 3.42Å; A181-F185 HydrophobicContact CB-CB 4.18Å; A181-F185 HydrophobicContact CB-CD2 3.53Å; A181-F185 HydrophobicContact CB-CE2 3.99Å; A181-F185 HydrophobicContact CB-CG 3.85Å; A181-F185 WeakPolarHBondContact O-CD2 3.27Å; G182-F185 PolarHBondContact O-N 3.39Å; P183-F185 PolarHBondContact O-N 2.9Å; P183-F185 VanDerWaalsContact O-N 3.13Å; F185-K187 PolarHBondContact O-N 3.44Å; F185-K187 VanDerWaalsContact O-N 3.14Å; F185-Y188 HydrophobicContact CD1-CD2 4.1Å; F185-Y188 HydrophobicContact CD1-CE2 4.39Å; F185-Y188 PolarHBondContact O-N 3.35Å
186Q82.6Confident89.7Confident90 Ų9072.7 Ų72.742%0.42133%0.331SS..Hα-helixtrans-58.5-31.1180-65.9-68.4-54.700112A179 P183 Y188 I189A179-Q186 PolarHBondContact O-NE2 2.96Å; P183-Q186 WeakPolarHBondContact O-CB 3.46Å; P183-Q186 PolarHBondContact O-N 2.93Å; P183-Q186 VanDerWaalsContact O-N 3.1Å; Q186-Y188 PolarHBondContact O-N 3.23Å; Q186-Y188 VanDerWaalsContact O-N 3.1Å; Q186-I189 HydrophobicContact CB-CD1 4.36Å; Q186-I189 VanDerWaalsContact O-CG1 3.22Å; Q186-I189 WeakPolarHBondContact O-CG1 3.46Å; Q186-I189 PolarHBondContact O-N 2.9Å
187K85.1Confident89.9Confident140 Ų14070.7 Ų70.761%0.60933%0.33SS*.THydrogen-bonded Turntrans-61.5-18.3174.767.5179-178167.90114.5F185F185-K187 PolarHBondContact O-N 3.44Å; F185-K187 VanDerWaalsContact O-N 3.14Å
188Y87.6Confident90.1Very high112 Ų11271.9 Ų71.944%0.43934%0.339SS..THydrogen-bonded Turntrans-96.61.5-179.4-60.2-70.6000113.8F185 Q186 W191F185-Y188 HydrophobicContact CD1-CD2 4.1Å; F185-Y188 HydrophobicContact CD1-CE2 4.39Å; F185-Y188 PolarHBondContact O-N 3.35Å; Q186-Y188 PolarHBondContact O-N 3.23Å; Q186-Y188 VanDerWaalsContact O-N 3.1Å; Y188-W191 PolarHBondContact O-NE1 3.37Å
189I90.1Very high90.4Very high31 Ų3170.7 Ų70.716%0.15933%0.332CS..  trans-96.413.1-176.180.9-165.6000113.5Y175 L178 A179 Q186 W191Y175-I189 HydrophobicContact CE2-CB 3.7Å; Y175-I189 HydrophobicContact CE2-CG2 4.48Å; Y175-I189 VanDerWaalsContact CE2-O 3.32Å; Y175-I189 WeakPolarHBondContact CE2-O 3.47Å; L178-I189 HydrophobicContact CB-CG2 4.38Å; A179-I189 HydrophobicContact CB-CG2 4.32Å; Q186-I189 HydrophobicContact CB-CD1 4.36Å; Q186-I189 VanDerWaalsContact O-CG1 3.22Å; Q186-I189 WeakPolarHBondContact O-CG1 3.46Å; Q186-I189 PolarHBondContact O-N 2.9Å; I189-W191 PolarHBondContact O-N 3.45Å; I189-W191 VanDerWaalsContact O-N 3.08Å
190W90.5Very high90.8Very high180 Ų18070.3 Ų70.368%0.68233%0.325SS*.THydrogen-bonded Turntrans-61.1-19.4-176.856.8-93.8000113.7K192 Y194W190-K192 PolarHBondContact O-N 2.87Å; W190-Y194 HydrophobicContact CE3-CE2 4.07Å; W190-Y194 HydrophobicContact CZ3-CD2 4.14Å; W190-Y194 AromaticContact CZ3-CE2 3.69Å; W190-Y194 HydrophobicContact CZ3-CE2 3.69Å
191W91.9Very high91.3Very high45 Ų4573.4 Ų73.417%0.1734%0.343CS..THydrogen-bonded Turntrans-92.512.3-171.258.8-84000115.2F171 Y175 Y188 I189 K193 Y194 L195F171-W191 HydrophobicContact CB-CH2 4.4Å; F171-W191 HydrophobicContact CB-CZ3 4.32Å; F171-W191 WeakPolarHBondContact O-CH2 3.35Å; Y175-W191 HydrophobicContact CD2-CD2 4.15Å; Y175-W191 AromaticContact CD2-CE2 3.83Å; Y175-W191 HydrophobicContact CD2-CE3 4.47Å; Y175-W191 HydrophobicContact CD2-CH2 4.31Å; Y175-W191 AromaticContact CD2-CZ2 3.92Å; Y175-W191 HydrophobicContact CD2-CZ2 3.92Å; Y175-W191 HydrophobicContact CG-CH2 4.46Å; Y175-W191 HydrophobicContact CG-CZ2 4.35Å; Y188-W191 PolarHBondContact O-NE1 3.37Å; I189-W191 PolarHBondContact O-N 3.45Å; I189-W191 VanDerWaalsContact O-N 3.08Å; W191-K193 PolarHBondContact O-N 3.31Å; W191-K193 VanDerWaalsContact O-N 3.12Å; W191-Y194 HydrophobicContact CB-CD2 3.88Å; W191-Y194 PolarHBondContact O-N 3.22Å; W191-L195 HydrophobicContact CE3-CB 4.02Å; W191-L195 HydrophobicContact CZ3-CB 3.96Å; W191-L195 HydrophobicContact CZ3-CD1 4.2Å; W191-L195 HydrophobicContact CZ3-CD2 4.45Å; W191-L195 HydrophobicContact CZ3-CG 4.43Å; W191-L195 PolarHBondContact O-N 2.9Å
192K92.7Very high91.8Very high80 Ų8073 Ų7335%0.34834%0.339SS..Hα-helixtrans-50.2-38.8176.4-169-176.7175179.10113.4Y175 W190 Y194 L195 T196Y175-K192 HydrophobicContact CE1-CD 4.46Å; Y175-K192 HydrophobicContact CE1-CG 4.2Å; Y175-K192 HydrophobicContact CE2-CB 3.71Å; Y175-K192 HydrophobicContact CE2-CG 4.26Å; Y175-K192 WeakPolarHBondContact OH-CB 3.23Å; Y175-K192 WeakPolarHBondContact OH-CD 3.41Å; W190-K192 PolarHBondContact O-N 2.87Å; K192-Y194 VanDerWaalsContact C-N 3.35Å; K192-L195 WeakPolarHBondContact O-CB 3.45Å; K192-L195 PolarHBondContact O-N 3.11Å; K192-T196 PolarHBondContact O-N 3.46Å; K192-T196 PolarHBondContact O-OG1 3.08Å
193K93.2Very high92.5Very high88 Ų8873.1 Ų73.138%0.38334%0.336SS..Hα-helixtrans-62.9-40.9178.4-177.9177.9176.9178.70111.7W191 G197 Y244 Y248W191-K193 PolarHBondContact O-N 3.31Å; W191-K193 VanDerWaalsContact O-N 3.12Å; K193-G197 PolarHBondContact O-N 3.07Å; K193-Y244 WeakPolarHBondContact CE-OH 3.45Å; K193-Y244 HydrophobicContact CG-CE2 3.95Å; K193-Y248 HydrophobicContact CB-CD1 4.35Å; K193-Y248 HydrophobicContact CB-CE1 3.92Å; K193-Y248 HydrophobicContact CB-CE2 4.25Å; K193-Y248 HydrophobicContact CD-CD1 4.15Å; K193-Y248 HydrophobicContact CD-CG 4.26Å; K193-Y248 HydrophobicContact CG-CD1 4.17Å; K193-Y248 HydrophobicContact CG-CD2 4.15Å; K193-Y248 HydrophobicContact CG-CE1 4.23Å; K193-Y248 HydrophobicContact CG-CE2 4.21Å; K193-Y248 HydrophobicContact CG-CG 4.14Å
194Y95.6Very high93.2Very high157 Ų15770.9 Ų70.962%0.61632%0.318SS*.Hα-helixtrans-71.5-36.3177.3-56.1-75.2000111.5W190 W191 K192 G197 A198W190-Y194 HydrophobicContact CE3-CE2 4.07Å; W190-Y194 HydrophobicContact CZ3-CD2 4.14Å; W190-Y194 AromaticContact CZ3-CE2 3.69Å; W190-Y194 HydrophobicContact CZ3-CE2 3.69Å; W191-Y194 HydrophobicContact CB-CD2 3.88Å; W191-Y194 PolarHBondContact O-N 3.22Å; K192-Y194 VanDerWaalsContact C-N 3.35Å; Y194-G197 CarbonylContact O-C 3.02Å; Y194-G197 WeakPolarHBondContact O-CA 3.04Å; Y194-G197 PolarHBondContact O-N 3.21Å; Y194-A198 PolarHBondContact O-N 3.37Å
195L95.7Very high93.9Very high10 Ų1064.3 Ų64.35%0.05230%0.298CS..Hα-helixtrans-59.8-47.4173.4176.963.8000111.8F171 M172 Y175 W191 K192 G197 A198 Q199F171-L195 HydrophobicContact CB-CD1 4.06Å; M172-L195 HydrophobicContact CB-CD1 4.15Å; M172-L195 HydrophobicContact CB-CD2 4.34Å; M172-L195 HydrophobicContact CG-CD2 4.28Å; Y175-L195 HydrophobicContact CD1-CD2 4.12Å; Y175-L195 HydrophobicContact CD2-CD2 4.48Å; Y175-L195 HydrophobicContact CG-CD2 3.88Å; W191-L195 HydrophobicContact CE3-CB 4.02Å; W191-L195 HydrophobicContact CZ3-CB 3.96Å; W191-L195 HydrophobicContact CZ3-CD1 4.2Å; W191-L195 HydrophobicContact CZ3-CD2 4.45Å; W191-L195 HydrophobicContact CZ3-CG 4.43Å; W191-L195 PolarHBondContact O-N 2.9Å; K192-L195 WeakPolarHBondContact O-CB 3.45Å; K192-L195 PolarHBondContact O-N 3.11Å; L195-G197 VanDerWaalsContact C-N 3.28Å; L195-G197 PolarHBondContact O-N 3.39Å; L195-A198 WeakPolarHBondContact O-CB 3.22Å; L195-A198 PolarHBondContact O-N 2.86Å; L195-A198 VanDerWaalsContact O-N 3.14Å; L195-Q199 PolarHBondContact O-N 3.45Å
196T95Very high94.5Very high5 Ų560.7 Ų60.73%0.03128%0.282CS..Hα-helixtrans-64-37.7176-47.10000110.9K192 A198 Q199 I200 F243 Y244K192-T196 PolarHBondContact O-N 3.46Å; K192-T196 PolarHBondContact O-OG1 3.08Å; T196-A198 VanDerWaalsContact C-N 3.34Å; T196-A198 PolarHBondContact O-N 3.44Å; T196-Q199 PolarHBondContact O-N 3.08Å; T196-I200 WeakPolarHBondContact O-CG1 3.47Å; T196-I200 PolarHBondContact O-N 2.83Å; T196-I200 VanDerWaalsContact O-N 3.09Å; T196-F243 HydrophobicContact CG2-CD1 3.78Å; T196-F243 HydrophobicContact CG2-CE1 3.86Å; T196-Y244 HydrophobicContact CG2-CD2 3.82Å
197G96.8Very high95.2Very high21 Ų2157.3 Ų57.322%0.21627%0.268CS..Hα-helixtrans-59.2-42171.600000112.8K193 Y194 L195 I200 T201K193-G197 PolarHBondContact O-N 3.07Å; Y194-G197 CarbonylContact O-C 3.02Å; Y194-G197 WeakPolarHBondContact O-CA 3.04Å; Y194-G197 PolarHBondContact O-N 3.21Å; L195-G197 VanDerWaalsContact C-N 3.28Å; L195-G197 PolarHBondContact O-N 3.39Å; G197-I200 PolarHBondContact O-N 3.27Å; G197-T201 PolarHBondContact O-N 2.96Å; G197-T201 PolarHBondContact O-OG1 3.27Å; G197-T201 VanDerWaalsContact O-OG1 3.06Å
198A98.1Very high95.9Very high40 Ų4057.7 Ų57.733%0.33127%0.27SS..Hα-helixtrans-64.6-39.6177.200000112.3Y194 L195 T196 T201 Q202Y194-A198 PolarHBondContact O-N 3.37Å; L195-A198 WeakPolarHBondContact O-CB 3.22Å; L195-A198 PolarHBondContact O-N 2.86Å; L195-A198 VanDerWaalsContact O-N 3.14Å; T196-A198 VanDerWaalsContact C-N 3.34Å; T196-A198 PolarHBondContact O-N 3.44Å; A198-T201 PolarHBondContact O-N 3.46Å; A198-Q202 WeakPolarHBondContact O-CB 3.44Å; A198-Q202 PolarHBondContact O-N 3.22Å
199Q98.3Very high96.4Very high20 Ų2053.3 Ų53.39%0.09325%0.253CS..Hα-helixtrans-60.3-44.5172.6-71.9171.3-39.900111.7V168 L195 T196 Q202 F203 F240V168-Q199 HydrophobicContact CG1-CB 4.41Å; V168-Q199 HydrophobicContact CG1-CG 3.41Å; V168-Q199 VanDerWaalsContact CG1-CG 3.41Å; L195-Q199 PolarHBondContact O-N 3.45Å; T196-Q199 PolarHBondContact O-N 3.08Å; Q199-Q202 WeakPolarHBondContact O-CB 3.3Å; Q199-Q202 PolarHBondContact O-N 3.41Å; Q199-F203 WeakPolarHBondContact O-CD2 3.23Å; Q199-F203 PolarHBondContact O-N 2.65Å; Q199-F203 VanDerWaalsContact O-N 3.13Å; Q199-F240 HydrophobicContact CB-CD1 4.21Å; Q199-F240 HydrophobicContact CB-CE1 4.2Å; Q199-F240 HydrophobicContact CG-CE1 4.39Å
200I98.4Very high96.7Very high24 Ų2451.8 Ų51.812%0.12325%0.245CC..Hα-helixtrans-63.3-47.5176.6-69.5168.2000110.7T196 G197 Q202 F203 I204 L237 F240 Y244T196-I200 WeakPolarHBondContact O-CG1 3.47Å; T196-I200 PolarHBondContact O-N 2.83Å; T196-I200 VanDerWaalsContact O-N 3.09Å; G197-I200 PolarHBondContact O-N 3.27Å; I200-Q202 VanDerWaalsContact C-N 3.28Å; I200-Q202 PolarHBondContact O-N 3.26Å; I200-F203 PolarHBondContact O-N 2.9Å; I200-F203 VanDerWaalsContact O-N 3.13Å; I200-I204 HydrophobicContact CG2-CD1 3.91Å; I200-I204 HydrophobicContact CG2-CG1 4.47Å; I200-I204 WeakPolarHBondContact O-CG1 3.39Å; I200-I204 PolarHBondContact O-N 3.47Å; I200-L237 HydrophobicContact CG2-CD1 3.84Å; I200-F240 HydrophobicContact CG1-CB 3.88Å; I200-Y244 HydrophobicContact CD1-CD2 3.96Å; I200-Y244 HydrophobicContact CD1-CG 3.99Å
201T98.6Very high97.1Very high73 Ų7346.3 Ų46.345%0.44823%0.232SC..Hα-helixtrans-58.3-40.9176.7-60.50000111.6G197 A198 F203 I204 I205G197-T201 PolarHBondContact O-N 2.96Å; G197-T201 PolarHBondContact O-OG1 3.27Å; G197-T201 VanDerWaalsContact O-OG1 3.06Å; A198-T201 PolarHBondContact O-N 3.46Å; T201-F203 PolarHBondContact O-N 3.1Å; T201-I204 PolarHBondContact O-N 3.01Å; T201-I205 HydrophobicContact CG2-CD1 3.91Å; T201-I205 HydrophobicContact CG2-CG1 4.43Å; T201-I205 WeakPolarHBondContact O-CG1 3.36Å; T201-I205 PolarHBondContact O-N 3.47Å
202Q98.6Very high97.4Very high8 Ų850.4 Ų50.44%0.03725%0.248CC..Hα-helixtrans-55.7-51173.6-173.7-152.7-53.500111.1L164 V168 A198 Q199 I200 I204 I205 V206L164-Q202 HydrophobicContact CB-CG 3.76Å; V168-Q202 HydrophobicContact CG2-CB 4.04Å; V168-Q202 HydrophobicContact CG2-CG 4.21Å; V168-Q202 VanDerWaalsContact CG2-OE1 3.3Å; A198-Q202 WeakPolarHBondContact O-CB 3.44Å; A198-Q202 PolarHBondContact O-N 3.22Å; Q199-Q202 WeakPolarHBondContact O-CB 3.3Å; Q199-Q202 PolarHBondContact O-N 3.41Å; I200-Q202 VanDerWaalsContact C-N 3.28Å; I200-Q202 PolarHBondContact O-N 3.26Å; Q202-I204 VanDerWaalsContact C-N 3.32Å; Q202-I204 PolarHBondContact O-N 3.29Å; Q202-I205 PolarHBondContact O-N 2.89Å; Q202-V206 VanDerWaalsContact O-CG2 3.24Å; Q202-V206 WeakPolarHBondContact O-CG2 3.31Å; Q202-V206 PolarHBondContact O-N 3.33Å
203F98.5Very high97.6Very high12 Ų1246.7 Ų46.75%0.05323%0.232CC..Hα-helixtrans-65.9-33.2179.8-66-59.5000113.1Q199 I200 T201 T207 F236 L237 F240Q199-F203 WeakPolarHBondContact O-CD2 3.23Å; Q199-F203 PolarHBondContact O-N 2.65Å; Q199-F203 VanDerWaalsContact O-N 3.13Å; I200-F203 PolarHBondContact O-N 2.9Å; I200-F203 VanDerWaalsContact O-N 3.13Å; T201-F203 PolarHBondContact O-N 3.1Å; F203-T207 WeakPolarHBondContact O-CB 3.44Å; F203-T207 PolarHBondContact O-N 2.83Å; F203-T207 PolarHBondContact O-OG1 2.8Å; F203-F236 HydrophobicContact CD1-CB 3.92Å; F203-F236 HydrophobicContact CD1-CD2 4.48Å; F203-F236 HydrophobicContact CD2-CB 4.18Å; F203-F236 HydrophobicContact CE1-CB 3.61Å; F203-F236 AromaticContact CE1-CD2 3.71Å; F203-F236 HydrophobicContact CE1-CD2 3.71Å; F203-F236 HydrophobicContact CE1-CG 4.06Å; F203-F236 HydrophobicContact CE2-CB 3.91Å; F203-F236 HydrophobicContact CG-CB 4.21Å; F203-F236 HydrophobicContact CZ-CB 3.61Å; F203-F236 HydrophobicContact CZ-CD2 4.09Å; F203-F236 HydrophobicContact CZ-CG 4.1Å; F203-L237 HydrophobicContact CB-CB 4.01Å; F203-L237 HydrophobicContact CB-CD1 4.24Å; F203-F240 HydrophobicContact CD2-CD2 4.09Å; F203-F240 AromaticContact CE2-CD2 3.39Å; F203-F240 HydrophobicContact CE2-CD2 3.39Å; F203-F240 AromaticContact CE2-CE2 3.52Å; F203-F240 HydrophobicContact CE2-CE2 3.52Å; F203-F240 HydrophobicContact CE2-CG 4.09Å; F203-F240 HydrophobicContact CE2-CZ 4.3Å; F203-F240 HydrophobicContact CZ-CD2 4.17Å; F203-F240 AromaticContact CZ-CE2 3.93Å; F203-F240 HydrophobicContact CZ-CE2 3.93Å
204I98.8Very high97.7Very high64 Ų6443.8 Ų43.833%0.32822%0.221SC..Hα-helixtrans-62.2-50.9172.8-68.8170000110.3I200 T201 Q202 V206 T207 F208 L237I200-I204 HydrophobicContact CG2-CD1 3.91Å; I200-I204 HydrophobicContact CG2-CG1 4.47Å; I200-I204 WeakPolarHBondContact O-CG1 3.39Å; I200-I204 PolarHBondContact O-N 3.47Å; T201-I204 PolarHBondContact O-N 3.01Å; Q202-I204 VanDerWaalsContact C-N 3.32Å; Q202-I204 PolarHBondContact O-N 3.29Å; I204-V206 VanDerWaalsContact C-N 3.32Å; I204-V206 PolarHBondContact O-N 3.28Å; I204-T207 WeakPolarHBondContact O-CB 3.28Å; I204-T207 PolarHBondContact O-N 3.31Å; I204-F208 HydrophobicContact CG2-CD2 3.68Å; I204-F208 HydrophobicContact CG2-CE2 3.57Å; I204-F208 VanDerWaalsContact O-CD2 3.27Å; I204-F208 WeakPolarHBondContact O-CD2 3.12Å; I204-F208 PolarHBondContact O-N 2.95Å; I204-L237 HydrophobicContact CD1-CD1 4.38Å; I204-L237 HydrophobicContact CG1-CD1 3.73Å; I204-L237 HydrophobicContact CG1-CD2 4.14Å
205I98.8Very high97.7Very high72 Ų7240.9 Ų40.937%0.36922%0.22SC..Hα-helixtrans-59-45.2179-67.3166.9000110.6F160 L164 T201 Q202 T207 F208 H209F160-I205 HydrophobicContact CE1-CG2 3.88Å; F160-I205 HydrophobicContact CZ-CG2 4.32Å; L164-I205 HydrophobicContact CD1-CB 4.18Å; L164-I205 HydrophobicContact CD1-CG2 3.58Å; T201-I205 HydrophobicContact CG2-CD1 3.91Å; T201-I205 HydrophobicContact CG2-CG1 4.43Å; T201-I205 WeakPolarHBondContact O-CG1 3.36Å; T201-I205 PolarHBondContact O-N 3.47Å; Q202-I205 PolarHBondContact O-N 2.89Å; I205-T207 VanDerWaalsContact C-N 3.34Å; I205-T207 PolarHBondContact O-N 3.36Å; I205-F208 PolarHBondContact O-N 3.4Å; I205-H209 WeakPolarHBondContact O-CB 3.39Å; I205-H209 PolarHBondContact O-N 3.06Å
206V98.6Very high97.7Very high3 Ų342.5 Ų42.52%0.01823%0.228CC..Hα-helixtrans-62.8-40.9178.2172.80000111.5H161 L164 Q202 I204 H209 S210 I229 A233H161-V206 HydrophobicContact CB-CB 4.32Å; H161-V206 HydrophobicContact CB-CG1 3.7Å; H161-V206 HydrophobicContact CB-CG2 3.56Å; L164-V206 HydrophobicContact CD1-CG2 3.99Å; Q202-V206 VanDerWaalsContact O-CG2 3.24Å; Q202-V206 WeakPolarHBondContact O-CG2 3.31Å; Q202-V206 PolarHBondContact O-N 3.33Å; I204-V206 VanDerWaalsContact C-N 3.32Å; I204-V206 PolarHBondContact O-N 3.28Å; V206-H209 PolarHBondContact O-N 3.28Å; V206-S210 VanDerWaalsContact O-CB 3.22Å; V206-S210 WeakPolarHBondContact O-CB 3.31Å; V206-S210 PolarHBondContact O-N 3.48Å; V206-I229 HydrophobicContact CG1-CG2 3.73Å; V206-A233 HydrophobicContact CB-CB 4.38Å; V206-A233 HydrophobicContact CG1-CB 3.8Å
207T98.7Very high97.4Very high19 Ų1946.9 Ų46.912%0.11726%0.255CS..Hα-helixtrans-61.4-47177.1-59.60000110.9F203 I204 I205 T211 L230 L234F203-T207 WeakPolarHBondContact O-CB 3.44Å; F203-T207 PolarHBondContact O-N 2.83Å; F203-T207 PolarHBondContact O-OG1 2.8Å; I204-T207 WeakPolarHBondContact O-CB 3.28Å; I204-T207 PolarHBondContact O-N 3.31Å; I205-T207 VanDerWaalsContact C-N 3.34Å; I205-T207 PolarHBondContact O-N 3.36Å; T207-T211 VanDerWaalsContact O-CB 3.3Å; T207-T211 WeakPolarHBondContact O-CB 3.47Å; T207-T211 PolarHBondContact O-N 2.89Å; T207-T211 PolarHBondContact O-OG1 3.24Å; T207-L230 HydrophobicContact CG2-CD1 3.9Å; T207-L234 HydrophobicContact CG2-CD2 3.69Å; T207-L234 HydrophobicContact CG2-CG 4.28Å
208F98.6Very high97Very high148 Ų14853.1 Ų53.165%0.64928%0.283SS*.Hα-helixtrans-64.9-46.5177.1-81.1-67000112.3I204 I205 S210 T211 Y212I204-F208 HydrophobicContact CG2-CD2 3.68Å; I204-F208 HydrophobicContact CG2-CE2 3.57Å; I204-F208 VanDerWaalsContact O-CD2 3.27Å; I204-F208 WeakPolarHBondContact O-CD2 3.12Å; I204-F208 PolarHBondContact O-N 2.95Å; I205-F208 PolarHBondContact O-N 3.4Å; F208-S210 PolarHBondContact O-N 3.35Å; F208-T211 PolarHBondContact O-N 3.02Å; F208-Y212 VanDerWaalsContact O-CB 3.23Å; F208-Y212 WeakPolarHBondContact O-CB 3.43Å; F208-Y212 PolarHBondContact O-N 2.88Å
209H98.1Very high96.7Very high19 Ų1952 Ų529%0.08827%0.273CS..Hα-helixtrans-60.7-44.9178.2173.7-95.1000111.9L85 F160 I205 V206 Y212 T213L85-H209 PolarHBondContact O-CD2 2.82Å; F160-H209 HydrophobicContact CD1-CB 3.95Å; F160-H209 AromaticContact CD1-CD2 3.62Å; F160-H209 AromaticContact CD1-CE1 3.8Å; F160-H209 AromaticContact CD1-CG 3.45Å; F160-H209 VanDerWaalsContact CD1-CG 3.45Å; F160-H209 AromaticContact CD1-ND1 3.59Å; F160-H209 AromaticContact CD1-NE2 3.82Å; F160-H209 HydrophobicContact CE1-CB 4Å; F160-H209 AromaticContact CE1-CD2 3.91Å; F160-H209 AromaticContact CE1-CG 3.87Å; I205-H209 WeakPolarHBondContact O-CB 3.39Å; I205-H209 PolarHBondContact O-N 3.06Å; V206-H209 PolarHBondContact O-N 3.28Å; H209-Y212 PolarHBondContact O-N 3.37Å; H209-T213 WeakPolarHBondContact O-CB 3.44Å; H209-T213 VanDerWaalsContact O-CG2 3.31Å; H209-T213 WeakPolarHBondContact O-CG2 3.5Å; H209-T213 PolarHBondContact O-N 3.02Å; H209-T213 PolarHBondContact O-OG1 3.18Å
210S98.1Very high96.5Very high0 Ų057.7 Ų57.70%030%0.304CS..Hα-helixtrans-66.7-42.4178.4-175.70000111.8V206 F208 T213 L214 N226 L230V206-S210 VanDerWaalsContact O-CB 3.22Å; V206-S210 WeakPolarHBondContact O-CB 3.31Å; V206-S210 PolarHBondContact O-N 3.48Å; F208-S210 PolarHBondContact O-N 3.35Å; S210-T213 WeakPolarHBondContact CA-OG1 3.43Å; S210-T213 PolarHBondContact O-N 2.86Å; S210-T213 PolarHBondContact O-OG1 3.4Å; S210-T213 VanDerWaalsContact O-OG1 3.1Å; S210-L214 WeakPolarHBondContact O-CB 3.42Å; S210-L214 VanDerWaalsContact O-CG 3.27Å; S210-L214 WeakPolarHBondContact O-CG 3.47Å; S210-L214 PolarHBondContact O-N 3.07Å; S210-N226 WeakPolarHBondContact CB-OD1 3.34Å; S210-N226 PolarHBondContact OG-O 2.86Å; S210-N226 VanDerWaalsContact OG-O 3.07Å; S210-N226 PolarHBondContact OG-OD1 3.38Å; S210-L230 WeakPolarHBondContact OG-CB 3.34Å
211T98Very high96.3Very high65 Ų6557.1 Ų57.140%0.39930%0.3SS..Hα-helixtrans-61.9-48175.2-56.80000111.3T207 F208 L214 T215T207-T211 VanDerWaalsContact O-CB 3.3Å; T207-T211 WeakPolarHBondContact O-CB 3.47Å; T207-T211 PolarHBondContact O-N 2.89Å; T207-T211 PolarHBondContact O-OG1 3.24Å; F208-T211 PolarHBondContact O-N 3.02Å; T211-L214 PolarHBondContact O-N 2.94Å; T211-T215 WeakPolarHBondContact O-CG2 3.39Å; T211-T215 PolarHBondContact O-N 3.45Å
212Y97.6Very high96.1Very high130 Ų13055.1 Ų55.151%0.5129%0.288SS..Hα-helixtrans-60.3-48.3177.6168.9-120000111.9F208 H209 L214 T215 I216F208-Y212 VanDerWaalsContact O-CB 3.23Å; F208-Y212 WeakPolarHBondContact O-CB 3.43Å; F208-Y212 PolarHBondContact O-N 2.88Å; H209-Y212 PolarHBondContact O-N 3.37Å; Y212-L214 PolarHBondContact O-N 3.27Å; Y212-T215 PolarHBondContact O-N 2.83Å; Y212-T215 PolarHBondContact O-OG1 3.24Å; Y212-I216 HydrophobicContact CE1-CD1 4.23Å; Y212-I216 HydrophobicContact CE2-CD1 4.47Å
213T96.8Very high95.9Very high3 Ų360.3 Ų60.32%0.01831%0.308CS..Hα-helixtrans-67.3-25179.951.50000113.1G86 L157 H209 S210 T215 I216 N226G86-T213 WeakPolarHBondContact O-CG2 3.39Å; L157-T213 HydrophobicContact CD2-CG2 4.33Å; H209-T213 WeakPolarHBondContact O-CB 3.44Å; H209-T213 VanDerWaalsContact O-CG2 3.31Å; H209-T213 WeakPolarHBondContact O-CG2 3.5Å; H209-T213 PolarHBondContact O-N 3.02Å; H209-T213 PolarHBondContact O-OG1 3.18Å; S210-T213 WeakPolarHBondContact CA-OG1 3.43Å; S210-T213 PolarHBondContact O-N 2.86Å; S210-T213 PolarHBondContact O-OG1 3.4Å; S210-T213 VanDerWaalsContact O-OG1 3.1Å; T213-T215 VanDerWaalsContact C-N 3.34Å; T213-I216 PolarHBondContact O-N 2.77Å; T213-N226 PolarHBondContact OG1-ND2 3.48Å
214L96.4Very high95.7Very high26 Ų2662.1 Ų62.114%0.13632%0.32CS..Hα-helixtrans-72-22.7171.4-77.7168.9000113.6S210 T211 Y212 I216 R223 N226 Y227 L230S210-L214 WeakPolarHBondContact O-CB 3.42Å; S210-L214 VanDerWaalsContact O-CG 3.27Å; S210-L214 WeakPolarHBondContact O-CG 3.47Å; S210-L214 PolarHBondContact O-N 3.07Å; T211-L214 PolarHBondContact O-N 2.94Å; Y212-L214 PolarHBondContact O-N 3.27Å; L214-I216 VanDerWaalsContact C-N 3.31Å; L214-R223 HydrophobicContact CD2-CB 4.45Å; L214-N226 HydrophobicContact CD2-CB 3.95Å; L214-N226 HydrophobicContact CG-CB 4.3Å; L214-Y227 HydrophobicContact CD1-CD1 3.81Å; L214-Y227 HydrophobicContact CD1-CE1 3.78Å; L214-Y227 HydrophobicContact CD2-CD1 4.33Å; L214-Y227 HydrophobicContact CD2-CD2 4.34Å; L214-Y227 HydrophobicContact CD2-CE1 4.1Å; L214-Y227 HydrophobicContact CD2-CE2 4.1Å; L214-Y227 HydrophobicContact CD2-CG 4.44Å; L214-L230 HydrophobicContact CD1-CD2 3.77Å
215T96.1Very high95.6Very high97 Ų9759.9 Ų59.960%0.59531%0.307SS*.Hα-helixtrans-79.5-15.3175.469.40000113T211 Y212 T213 T217T211-T215 WeakPolarHBondContact O-CG2 3.39Å; T211-T215 PolarHBondContact O-N 3.45Å; Y212-T215 PolarHBondContact O-N 2.83Å; Y212-T215 PolarHBondContact O-OG1 3.24Å; T213-T215 VanDerWaalsContact C-N 3.34Å; T215-T217 PolarHBondContact O-N 3.16Å
216I95Very high95.5Very high44 Ų4456.7 Ų56.723%0.22629%0.291CS..  trans-78.6102.9177.3-54.1174.1000108.8C87 Y212 T213 L214 D218 C219C87-I216 HydrophobicContact CB-CD1 4.15Å; C87-I216 HydrophobicContact CB-CG2 4.03Å; Y212-I216 HydrophobicContact CE1-CD1 4.23Å; Y212-I216 HydrophobicContact CE2-CD1 4.47Å; T213-I216 PolarHBondContact O-N 2.77Å; L214-I216 VanDerWaalsContact C-N 3.31Å; I216-D218 PolarHBondContact O-N 3.41Å; I216-C219 HydrophobicContact CB-CB 4.3Å; I216-C219 HydrophobicContact CG2-CB 4.1Å; I216-C219 WeakPolarHBondContact O-CB 3.15Å
217T88.2Confident95.4Very high97 Ų9762.3 Ų62.360%0.59531%0.313SS*.THydrogen-bonded Turntrans-64.3-40.8-173.450.90000113.1T215 C219 R223T215-T217 PolarHBondContact O-N 3.16Å; T217-C219 PolarHBondContact O-N 3.09Å; T217-R223 PolarHBondContact O-NH2 2.97Å
218D89.6Confident95.4Very high151 Ų15167 Ų6781%0.80733%0.328SS*.THydrogen-bonded Turntrans-87.621.2-171.9-55.2-22.4000112.7I216 N220I216-D218 PolarHBondContact O-N 3.41Å; D218-N220 PolarHBondContact O-N 2.99Å
219C91.8Very high95.4Very high18 Ų1860.9 Ų60.912%0.12230%0.303CS..  trans-85.3115.4-178.2-167.90000112.5C87 I216 T217 Y221C87-C219 VanDerWaalsContact CA-SG 3.56Å; C87-C219 HydrophobicContact CB-CB 3.62Å; C87-C219 WeakPolarHBondContact CB-SG 3.39Å; C87-C219 WeakPolarHBondContact SG-CA 3.31Å; C87-C219 WeakPolarHBondContact SG-CB 3.49Å; C87-C219 CovalentContact SG-SG 2.03Å; C87-C219 PolarHBondContact SG-SG 3.17Å; I216-C219 HydrophobicContact CB-CB 4.3Å; I216-C219 HydrophobicContact CG2-CB 4.1Å; I216-C219 WeakPolarHBondContact O-CB 3.15Å; T217-C219 PolarHBondContact O-N 3.09Å; C219-Y221 PolarHBondContact O-N 2.85Å
220N92.4Very high95.4Very high138 Ų13861.2 Ų61.274%0.73831%0.305SS*.  trans-81.355.8176-168.618.4000112.3S89 D218S89-N220 WeakPolarHBondContact CB-O 3.41Å; S89-N220 PolarHBondContact OG-O 3.21Å; D218-N220 PolarHBondContact O-N 2.99Å
221Y94.5Very high95.4Very high13 Ų1365 Ų655%0.05133%0.328CS..SBendtrans-122.4132.2169.9-173.4-89.9000108.8V90 V153 L157 G158 C219 R223 F225 N226V90-Y221 HydrophobicContact CG2-CD2 3.93Å; V90-Y221 HydrophobicContact CG2-CE2 3.79Å; V153-Y221 HydrophobicContact CB-CE2 4.26Å; V153-Y221 HydrophobicContact CG1-CE2 4.43Å; L157-Y221 HydrophobicContact CD1-CD1 3.86Å; L157-Y221 HydrophobicContact CD1-CE1 3.79Å; L157-Y221 HydrophobicContact CD1-CE2 4.47Å; L157-Y221 HydrophobicContact CD1-CG 4.23Å; L157-Y221 HydrophobicContact CD2-CD1 3.91Å; L157-Y221 HydrophobicContact CD2-CD2 4.1Å; L157-Y221 HydrophobicContact CD2-CG 3.61Å; L157-Y221 HydrophobicContact CG-CD1 3.87Å; L157-Y221 HydrophobicContact CG-CD2 3.78Å; L157-Y221 HydrophobicContact CG-CE1 4.1Å; L157-Y221 HydrophobicContact CG-CE2 4.03Å; L157-Y221 HydrophobicContact CG-CG 3.7Å; G158-Y221 WeakPolarHBondContact CA-OH 3.21Å; C219-Y221 PolarHBondContact O-N 2.85Å; Y221-R223 PolarHBondContact O-N 2.69Å; Y221-F225 HydrophobicContact CE1-CB 3.87Å; Y221-N226 HydrophobicContact CD1-CB 4.25Å; Y221-N226 HydrophobicContact CE1-CB 4.19Å
222P94.5Very high95.4Very high31 Ų3162.9 Ų62.920%0.20132%0.315CS..  trans-64.4112.2-174.8-14.525.8000111P6 V153 V224 F225P6-P222 HydrophobicContact CB-CG 4.17Å; P6-P222 HydrophobicContact CG-CB 4.34Å; P6-P222 HydrophobicContact CG-CG 3.89Å; V153-P222 HydrophobicContact CG1-CG 3.81Å; P222-V224 PolarHBondContact O-N 3.48Å; P222-V224 VanDerWaalsContact O-N 3.08Å; P222-F225 HydrophobicContact CB-CD2 4.08Å; P222-F225 PolarHBondContact O-N 3.25Å; P222-F225 VanDerWaalsContact O-N 3.11Å
223R94Very high95.5Very high116 Ų11656.9 Ų56.944%0.43829%0.293SS..Hα-helixtrans-58.4-28.6-170.2-65.9-172.1-180-178.32.3113.7L214 T217 Y221 F225 N226 Y227L214-R223 HydrophobicContact CD2-CB 4.45Å; T217-R223 PolarHBondContact O-NH2 2.97Å; Y221-R223 PolarHBondContact O-N 2.69Å; R223-F225 VanDerWaalsContact C-N 3.28Å; R223-F225 PolarHBondContact O-N 3.5Å; R223-N226 PolarHBondContact O-N 2.94Å; R223-N226 VanDerWaalsContact O-N 3.08Å; R223-Y227 HydrophobicContact CB-CD2 4.15Å; R223-Y227 HydrophobicContact CB-CE2 4.01Å; R223-Y227 WeakPolarHBondContact O-CD2 3.31Å; R223-Y227 PolarHBondContact O-N 3.1Å
224V95.4Very high95.6Very high51 Ų5160.2 Ų60.231%0.30931%0.31SS..Hα-helixtrans-55.4-41.1177.367.30000112.4I4 P222 W228I4-V224 HydrophobicContact CG2-CB 4.49Å; I4-V224 HydrophobicContact CG2-CG2 3.94Å; P222-V224 PolarHBondContact O-N 3.48Å; P222-V224 VanDerWaalsContact O-N 3.08Å; V224-W228 WeakPolarHBondContact O-CB 3.37Å; V224-W228 PolarHBondContact O-N 3.07Å
225F96.6Very high95.7Very high16 Ų1661.6 Ų61.67%0.0732%0.319CS..Hα-helixtrans-71.7-36.2177.8-71.6-84.4000111.5F5 P6 Y152 V153 Y221 P222 R223 W228 I229F5-F225 AromaticContact CD1-CE2 3.97Å; F5-F225 HydrophobicContact CD1-CE2 3.97Å; F5-F225 AromaticContact CD1-CZ 3.71Å; F5-F225 HydrophobicContact CD1-CZ 3.71Å; F5-F225 HydrophobicContact CE1-CE2 4.48Å; F5-F225 AromaticContact CE1-CZ 3.99Å; F5-F225 HydrophobicContact CE1-CZ 3.99Å; P6-F225 HydrophobicContact CG-CE2 4.15Å; Y152-F225 VanDerWaalsContact CB-CZ 3.45Å; Y152-F225 AromaticContact CD2-CZ 3.99Å; Y152-F225 HydrophobicContact CD2-CZ 3.99Å; Y152-F225 AromaticContact CG-CZ 3.9Å; Y152-F225 HydrophobicContact CG-CZ 3.9Å; V153-F225 HydrophobicContact CG1-CD2 3.86Å; V153-F225 HydrophobicContact CG1-CE2 4Å; V153-F225 HydrophobicContact CG1-CG 4.37Å; V153-F225 HydrophobicContact CG2-CB 4.29Å; V153-F225 HydrophobicContact CG2-CD1 3.69Å; V153-F225 HydrophobicContact CG2-CD2 4Å; V153-F225 HydrophobicContact CG2-CE1 3.95Å; V153-F225 HydrophobicContact CG2-CE2 4.26Å; V153-F225 HydrophobicContact CG2-CG 3.72Å; V153-F225 HydrophobicContact CG2-CZ 4.24Å; Y221-F225 HydrophobicContact CE1-CB 3.87Å; P222-F225 HydrophobicContact CB-CD2 4.08Å; P222-F225 PolarHBondContact O-N 3.25Å; P222-F225 VanDerWaalsContact O-N 3.11Å; R223-F225 VanDerWaalsContact C-N 3.28Å; R223-F225 PolarHBondContact O-N 3.5Å; F225-W228 PolarHBondContact O-N 3.18Å; F225-I229 VanDerWaalsContact O-CG1 3.26Å; F225-I229 WeakPolarHBondContact O-CG1 3.42Å; F225-I229 PolarHBondContact O-N 3.21Å
226N96.5Very high95.8Very high5 Ų557.3 Ų57.33%0.02729%0.292CS..Hα-helixtrans-68.9-40.9177-1576.6000111.3L157 S210 T213 L214 Y221 R223 W228 I229 L230L157-N226 HydrophobicContact CD1-CB 4.38Å; S210-N226 WeakPolarHBondContact CB-OD1 3.34Å; S210-N226 PolarHBondContact OG-O 2.86Å; S210-N226 VanDerWaalsContact OG-O 3.07Å; S210-N226 PolarHBondContact OG-OD1 3.38Å; T213-N226 PolarHBondContact OG1-ND2 3.48Å; L214-N226 HydrophobicContact CD2-CB 3.95Å; L214-N226 HydrophobicContact CG-CB 4.3Å; Y221-N226 HydrophobicContact CD1-CB 4.25Å; Y221-N226 HydrophobicContact CE1-CB 4.19Å; R223-N226 PolarHBondContact O-N 2.94Å; R223-N226 VanDerWaalsContact O-N 3.08Å; N226-W228 VanDerWaalsContact C-N 3.34Å; N226-W228 PolarHBondContact O-N 2.79Å; N226-I229 PolarHBondContact O-N 3.46Å; N226-L230 PolarHBondContact O-N 3.2Å
227Y97.6Very high95.9Very high121 Ų12156.7 Ų56.748%0.47529%0.29SS..Hα-helixtrans-61-41.2170.7-77.4-60.3000112.3L214 R223 L230 V231L214-Y227 HydrophobicContact CD1-CD1 3.81Å; L214-Y227 HydrophobicContact CD1-CE1 3.78Å; L214-Y227 HydrophobicContact CD2-CD1 4.33Å; L214-Y227 HydrophobicContact CD2-CD2 4.34Å; L214-Y227 HydrophobicContact CD2-CE1 4.1Å; L214-Y227 HydrophobicContact CD2-CE2 4.1Å; L214-Y227 HydrophobicContact CD2-CG 4.44Å; R223-Y227 HydrophobicContact CB-CD2 4.15Å; R223-Y227 HydrophobicContact CB-CE2 4.01Å; R223-Y227 WeakPolarHBondContact O-CD2 3.31Å; R223-Y227 PolarHBondContact O-N 3.1Å; Y227-L230 PolarHBondContact O-N 3.04Å; Y227-V231 WeakPolarHBondContact O-CG2 3.19Å; Y227-V231 PolarHBondContact O-N 3.45Å
228W98Very high96.4Very high117 Ų11757.8 Ų57.844%0.44329%0.29SS..Hα-helixtrans-60.9-44.3175.4-178.8-103.8000112.2I141 S145 V224 F225 N226 S232I141-W228 HydrophobicContact CD1-CH2 3.83Å; I141-W228 HydrophobicContact CD1-CZ2 3.68Å; I141-W228 HydrophobicContact CG1-CH2 4.42Å; I141-W228 HydrophobicContact CG1-CZ2 3.93Å; S145-W228 WeakPolarHBondContact OG-CZ2 3.44Å; S145-W228 PolarHBondContact OG-NE1 3.47Å; V224-W228 WeakPolarHBondContact O-CB 3.37Å; V224-W228 PolarHBondContact O-N 3.07Å; F225-W228 PolarHBondContact O-N 3.18Å; N226-W228 VanDerWaalsContact C-N 3.34Å; N226-W228 PolarHBondContact O-N 2.79Å; W228-S232 WeakPolarHBondContact O-CB 3.5Å; W228-S232 PolarHBondContact O-N 2.87Å; W228-S232 PolarHBondContact O-OG 3.06Å
229I98.2Very high96.7Very high21 Ų2152.2 Ų52.211%0.10826%0.261CS..Hα-helixtrans-60.4-47174.8-68.7164.5000110.3V206 F225 N226 S232 A233V206-I229 HydrophobicContact CG1-CG2 3.73Å; F225-I229 VanDerWaalsContact O-CG1 3.26Å; F225-I229 WeakPolarHBondContact O-CG1 3.42Å; F225-I229 PolarHBondContact O-N 3.21Å; N226-I229 PolarHBondContact O-N 3.46Å; I229-S232 PolarHBondContact O-N 3.36Å; I229-A233 VanDerWaalsContact O-CB 3.22Å; I229-A233 WeakPolarHBondContact O-CB 3.06Å; I229-A233 PolarHBondContact O-N 2.92Å
230L98.6Very high97Very high26 Ų2652.2 Ų52.214%0.13626%0.259CS..Hα-helixtrans-59.3-53.4179.1-179.456.9000112.1T207 S210 L214 N226 Y227 S232 A233 L234T207-L230 HydrophobicContact CG2-CD1 3.9Å; S210-L230 WeakPolarHBondContact OG-CB 3.34Å; L214-L230 HydrophobicContact CD1-CD2 3.77Å; N226-L230 PolarHBondContact O-N 3.2Å; Y227-L230 PolarHBondContact O-N 3.04Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 3.39Å; L230-A233 PolarHBondContact O-N 3.06Å; L230-L234 HydrophobicContact CD1-CD1 4.13Å; L230-L234 HydrophobicContact CD1-CG 4.28Å; L230-L234 HydrophobicContact CG-CD1 4.15Å; L230-L234 WeakPolarHBondContact O-CG 3.42Å; L230-L234 PolarHBondContact O-N 2.82Å
231V98.6Very high97.2Very high80 Ų8048 Ų4849%0.48524%0.24SC..Hα-helixtrans-62-44.3-178.7171.70000110.3Y227 A233 L234 V235Y227-V231 WeakPolarHBondContact O-CG2 3.19Å; Y227-V231 PolarHBondContact O-N 3.45Å; V231-A233 PolarHBondContact O-N 3.21Å; V231-L234 PolarHBondContact O-N 2.87Å; V231-V235 HydrophobicContact CG1-CG2 4.47Å; V231-V235 WeakPolarHBondContact O-CG2 3.34Å; V231-V235 PolarHBondContact O-N 3.17Å
232S98.3Very high97.2Very high19 Ų1953.2 Ų53.213%0.13326%0.263CS..Hα-helixtrans-62.3-43.6177.4-59.30000111.8W228 I229 L230 V235 F236W228-S232 WeakPolarHBondContact O-CB 3.5Å; W228-S232 PolarHBondContact O-N 2.87Å; W228-S232 PolarHBondContact O-OG 3.06Å; I229-S232 PolarHBondContact O-N 3.36Å; L230-S232 VanDerWaalsContact C-N 3.33Å; L230-S232 PolarHBondContact O-N 3.39Å; S232-V235 PolarHBondContact O-N 2.68Å; S232-F236 WeakPolarHBondContact O-CD2 3.32Å; S232-F236 WeakPolarHBondContact O-CG 3.46Å; S232-F236 PolarHBondContact O-N 3.21Å
233A98.6Very high97.1Very high4 Ų455.5 Ų55.53%0.03327%0.269CS..Hα-helixtrans-62.9-41.5177.400000111.9V206 I229 L230 V231 L237V206-A233 HydrophobicContact CB-CB 4.38Å; V206-A233 HydrophobicContact CG1-CB 3.8Å; I229-A233 VanDerWaalsContact O-CB 3.22Å; I229-A233 WeakPolarHBondContact O-CB 3.06Å; I229-A233 PolarHBondContact O-N 2.92Å; L230-A233 PolarHBondContact O-N 3.06Å; V231-A233 PolarHBondContact O-N 3.21Å; A233-L237 WeakPolarHBondContact O-CB 3.24Å; A233-L237 PolarHBondContact O-N 3.41Å
234L98.6Very high97.1Very high73 Ų7352.1 Ų52.138%0.38226%0.257SS..Hα-helixtrans-64.3-45.6175.5-72.5171.3000112T207 L230 V231 L237 I238T207-L234 HydrophobicContact CG2-CD2 3.69Å; T207-L234 HydrophobicContact CG2-CG 4.28Å; L230-L234 HydrophobicContact CD1-CD1 4.13Å; L230-L234 HydrophobicContact CD1-CG 4.28Å; L230-L234 HydrophobicContact CG-CD1 4.15Å; L230-L234 WeakPolarHBondContact O-CG 3.42Å; L230-L234 PolarHBondContact O-N 2.82Å; V231-L234 PolarHBondContact O-N 2.87Å; L234-L237 PolarHBondContact O-N 2.9Å; L234-I238 VanDerWaalsContact O-CG1 3.29Å; L234-I238 WeakPolarHBondContact O-CG1 3.25Å; L234-I238 PolarHBondContact O-N 3.4Å
235V98.5Very high97Very high55 Ų5555.9 Ų55.933%0.33327%0.267SS..Hα-helixtrans-59.8-49.3176.6170.60000110.5F137 V231 S232 I238 L239F137-V235 HydrophobicContact CE1-CG1 3.7Å; F137-V235 HydrophobicContact CZ-CG1 4.25Å; V231-V235 HydrophobicContact CG1-CG2 4.47Å; V231-V235 WeakPolarHBondContact O-CG2 3.34Å; V231-V235 PolarHBondContact O-N 3.17Å; S232-V235 PolarHBondContact O-N 2.68Å; V235-I238 PolarHBondContact O-N 3.38Å; V235-L239 HydrophobicContact CG1-CD1 3.93Å; V235-L239 VanDerWaalsContact O-CG 3.31Å; V235-L239 WeakPolarHBondContact O-CG 3.47Å; V235-L239 PolarHBondContact O-N 3.44Å
236F98Very high96.8Very high7 Ų760 Ų603%0.03129%0.286CS..Hα-helixtrans-66.1-38.8178.2-65.4-39000112.4F137 H138 I141 M142 F203 S232 I238 L239 F240F137-F236 AromaticContact CD1-CE1 3.79Å; F137-F236 HydrophobicContact CD1-CE1 3.79Å; F137-F236 HydrophobicContact CE1-CD1 4.4Å; F137-F236 AromaticContact CE1-CE1 3.71Å; F137-F236 HydrophobicContact CE1-CE1 3.71Å; F137-F236 HydrophobicContact CE1-CZ 4.41Å; H138-F236 HydrophobicContact CB-CE1 3.79Å; H138-F236 HydrophobicContact CB-CZ 4.18Å; H138-F236 AromaticContact CE1-CE2 3.95Å; H138-F236 AromaticContact CG-CE1 3.97Å; H138-F236 AromaticContact CG-CZ 3.98Å; H138-F236 AromaticContact ND1-CD1 3.84Å; H138-F236 AromaticContact ND1-CD2 3.91Å; H138-F236 AromaticContact ND1-CE1 3.36Å; H138-F236 WeakPolarHBondContact ND1-CE1 3.45Å; H138-F236 AromaticContact ND1-CE2 3.43Å; H138-F236 WeakPolarHBondContact ND1-CE2 3.35Å; H138-F236 AromaticContact ND1-CZ 3.14Å; H138-F236 WeakPolarHBondContact ND1-CZ 3.39Å; I141-F236 HydrophobicContact CG2-CE1 4.44Å; I141-F236 HydrophobicContact CG2-CZ 3.74Å; M142-F236 HydrophobicContact SD-CE2 4.17Å; F203-F236 HydrophobicContact CD1-CB 3.92Å; F203-F236 HydrophobicContact CD1-CD2 4.48Å; F203-F236 HydrophobicContact CD2-CB 4.18Å; F203-F236 HydrophobicContact CE1-CB 3.61Å; F203-F236 AromaticContact CE1-CD2 3.71Å; F203-F236 HydrophobicContact CE1-CD2 3.71Å; F203-F236 HydrophobicContact CE1-CG 4.06Å; F203-F236 HydrophobicContact CE2-CB 3.91Å; F203-F236 HydrophobicContact CG-CB 4.21Å; F203-F236 HydrophobicContact CZ-CB 3.61Å; F203-F236 HydrophobicContact CZ-CD2 4.09Å; F203-F236 HydrophobicContact CZ-CG 4.1Å; S232-F236 WeakPolarHBondContact O-CD2 3.32Å; S232-F236 WeakPolarHBondContact O-CG 3.46Å; S232-F236 PolarHBondContact O-N 3.21Å; F236-I238 VanDerWaalsContact C-N 3.32Å; F236-I238 PolarHBondContact O-N 2.88Å; F236-L239 PolarHBondContact O-N 2.62Å; F236-F240 HydrophobicContact CB-CD2 4.29Å; F236-F240 WeakPolarHBondContact O-CB 3.4Å; F236-F240 WeakPolarHBondContact O-CD2 3.31Å; F236-F240 PolarHBondContact O-N 3.15Å
237L98.2Very high96.3Very high32 Ų3262.4 Ų62.417%0.16831%0.306CS..Hα-helixtrans-57.1-46.2175.3178.858.6000111.3I200 F203 I204 A233 L234 S241I200-L237 HydrophobicContact CG2-CD1 3.84Å; F203-L237 HydrophobicContact CB-CB 4.01Å; F203-L237 HydrophobicContact CB-CD1 4.24Å; I204-L237 HydrophobicContact CD1-CD1 4.38Å; I204-L237 HydrophobicContact CG1-CD1 3.73Å; I204-L237 HydrophobicContact CG1-CD2 4.14Å; A233-L237 WeakPolarHBondContact O-CB 3.24Å; A233-L237 PolarHBondContact O-N 3.41Å; L234-L237 PolarHBondContact O-N 2.9Å; L237-S241 WeakPolarHBondContact O-CB 3.33Å; L237-S241 PolarHBondContact O-N 2.83Å; L237-S241 PolarHBondContact O-OG 2.96Å
238I98Very high96Very high119 Ų11960.1 Ų60.161%0.6130%0.297SS*.Hα-helixtrans-62.3-48.7177.2-67.8164.8000110.5L234 V235 F236 S241 K242L234-I238 VanDerWaalsContact O-CG1 3.29Å; L234-I238 WeakPolarHBondContact O-CG1 3.25Å; L234-I238 PolarHBondContact O-N 3.4Å; V235-I238 PolarHBondContact O-N 3.38Å; F236-I238 VanDerWaalsContact C-N 3.32Å; F236-I238 PolarHBondContact O-N 2.88Å; I238-S241 PolarHBondContact O-N 2.98Å; I238-K242 WeakPolarHBondContact O-CB 3.45Å; I238-K242 PolarHBondContact O-N 2.93Å
239L97.1Very high95.3Very high35 Ų3561 Ų6118%0.18331%0.305CS..Hα-helixtrans-64.3-45.8-177.4-68.5175.1000112.4F133 L134 F137 V235 F236 K242 F243F133-L239 HydrophobicContact CE1-CD2 4.47Å; L134-L239 HydrophobicContact CB-CB 4.41Å; L134-L239 VanDerWaalsContact CD1-C 3.49Å; L134-L239 HydrophobicContact CD1-CB 3.71Å; L134-L239 WeakPolarHBondContact CD1-O 3.37Å; L134-L239 HydrophobicContact CG-CB 3.91Å; F137-L239 HydrophobicContact CD1-CD1 4.04Å; F137-L239 HydrophobicContact CE1-CD1 4.43Å; V235-L239 HydrophobicContact CG1-CD1 3.93Å; V235-L239 VanDerWaalsContact O-CG 3.31Å; V235-L239 WeakPolarHBondContact O-CG 3.47Å; V235-L239 PolarHBondContact O-N 3.44Å; F236-L239 PolarHBondContact O-N 2.62Å; L239-K242 PolarHBondContact O-N 3.19Å; L239-F243 PolarHBondContact O-N 3.47Å
240F96.3Very high94.3Very high18 Ų1866.3 Ų66.38%0.07933%0.327CS..Hα-helixtrans-68.3-36.6177.2-86.3-85.3000112.1L134 Q199 I200 F203 F236 F243 Y244L134-F240 HydrophobicContact CD1-CD1 4.3Å; L134-F240 HydrophobicContact CD1-CD2 3.99Å; L134-F240 HydrophobicContact CD1-CE2 4.25Å; L134-F240 HydrophobicContact CD1-CG 4.03Å; L134-F240 HydrophobicContact CD2-CD2 4.3Å; L134-F240 HydrophobicContact CD2-CE1 4.29Å; L134-F240 HydrophobicContact CD2-CE2 3.73Å; L134-F240 HydrophobicContact CD2-CZ 3.74Å; L134-F240 HydrophobicContact CG-CD2 4.48Å; L134-F240 HydrophobicContact CG-CE2 4.35Å; Q199-F240 HydrophobicContact CB-CD1 4.21Å; Q199-F240 HydrophobicContact CB-CE1 4.2Å; Q199-F240 HydrophobicContact CG-CE1 4.39Å; I200-F240 HydrophobicContact CG1-CB 3.88Å; F203-F240 HydrophobicContact CD2-CD2 4.09Å; F203-F240 AromaticContact CE2-CD2 3.39Å; F203-F240 HydrophobicContact CE2-CD2 3.39Å; F203-F240 AromaticContact CE2-CE2 3.52Å; F203-F240 HydrophobicContact CE2-CE2 3.52Å; F203-F240 HydrophobicContact CE2-CG 4.09Å; F203-F240 HydrophobicContact CE2-CZ 4.3Å; F203-F240 HydrophobicContact CZ-CD2 4.17Å; F203-F240 AromaticContact CZ-CE2 3.93Å; F203-F240 HydrophobicContact CZ-CE2 3.93Å; F236-F240 HydrophobicContact CB-CD2 4.29Å; F236-F240 WeakPolarHBondContact O-CB 3.4Å; F236-F240 WeakPolarHBondContact O-CD2 3.31Å; F236-F240 PolarHBondContact O-N 3.15Å; F240-F243 PolarHBondContact O-N 3.24Å; F240-Y244 WeakPolarHBondContact O-CB 3.03Å; F240-Y244 PolarHBondContact O-N 3.18Å
241S96.6Very high92.7Very high48 Ų4870 Ų7034%0.33635%0.352SS..Hα-helixtrans-65.3-41.9175.5-62.10000111.8L237 I238 Y244 Y245L237-S241 WeakPolarHBondContact O-CB 3.33Å; L237-S241 PolarHBondContact O-N 2.83Å; L237-S241 PolarHBondContact O-OG 2.96Å; I238-S241 PolarHBondContact O-N 2.98Å; S241-Y244 PolarHBondContact O-N 3.5Å; S241-Y245 WeakPolarHBondContact O-CB 3.19Å; S241-Y245 PolarHBondContact O-N 2.7Å
242K95.8Very high91Very high124 Ų12469.9 Ų69.954%0.53935%0.351SS..Hα-helixtrans-59.4-50.1173179-177.1172.9-176.10111I238 L239 Y244 Y245 E246I238-K242 WeakPolarHBondContact O-CB 3.45Å; I238-K242 PolarHBondContact O-N 2.93Å; L239-K242 PolarHBondContact O-N 3.19Å; K242-Y244 VanDerWaalsContact C-N 3.31Å; K242-Y244 PolarHBondContact O-N 3.29Å; K242-Y245 PolarHBondContact O-N 3.36Å; K242-E246 WeakPolarHBondContact CE-OE1 3.41Å; K242-E246 IonicContact NZ-OE1 3.67Å; K242-E246 WeakPolarHBondContact O-CG 3.18Å; K242-E246 PolarHBondContact O-N 3.38Å
243F92.7Very high88.9Confident78 Ų7873.7 Ų73.734%0.34238%0.376SS..Hα-helixtrans-55.8-45.7176.8170.4-98.1000111.9L134 T196 L239 F240 Y245 E246 A247L134-F243 HydrophobicContact CD1-CB 4.36Å; T196-F243 HydrophobicContact CG2-CD1 3.78Å; T196-F243 HydrophobicContact CG2-CE1 3.86Å; L239-F243 PolarHBondContact O-N 3.47Å; F240-F243 PolarHBondContact O-N 3.24Å; F243-Y245 PolarHBondContact O-N 2.91Å; F243-E246 PolarHBondContact O-N 3.5Å; F243-A247 VanDerWaalsContact O-CB 3.23Å; F243-A247 WeakPolarHBondContact O-CB 3.45Å; F243-A247 PolarHBondContact O-N 2.95Å
244Y93.5Very high86.7Confident45 Ų4577.1 Ų77.118%0.17639%0.393CS..Hα-helixtrans-63.2-43.4178.8-172.1-78.2000112.3K193 T196 I200 F240 S241 K242 A247 Y248 K249K193-Y244 WeakPolarHBondContact CE-OH 3.45Å; K193-Y244 HydrophobicContact CG-CE2 3.95Å; T196-Y244 HydrophobicContact CG2-CD2 3.82Å; I200-Y244 HydrophobicContact CD1-CD2 3.96Å; I200-Y244 HydrophobicContact CD1-CG 3.99Å; F240-Y244 WeakPolarHBondContact O-CB 3.03Å; F240-Y244 PolarHBondContact O-N 3.18Å; S241-Y244 PolarHBondContact O-N 3.5Å; K242-Y244 VanDerWaalsContact C-N 3.31Å; K242-Y244 PolarHBondContact O-N 3.29Å; Y244-A247 PolarHBondContact O-N 2.03Å; Y244-Y248 HydrophobicContact CD1-CD2 4.21Å; Y244-Y248 AromaticContact CD2-CD2 3.74Å; Y244-Y248 HydrophobicContact CD2-CD2 3.74Å; Y244-Y248 HydrophobicContact CD2-CE2 4.09Å; Y244-Y248 HydrophobicContact CE1-CD2 4.29Å; Y244-Y248 AromaticContact CE2-CD2 3.86Å; Y244-Y248 HydrophobicContact CE2-CD2 3.86Å; Y244-Y248 HydrophobicContact CE2-CE2 4.27Å; Y244-Y248 AromaticContact CG-CD2 3.93Å; Y244-Y248 HydrophobicContact CG-CD2 3.93Å; Y244-Y248 WeakPolarHBondContact O-CB 3.01Å; Y244-Y248 WeakPolarHBondContact O-CD2 2.94Å; Y244-Y248 PolarHBondContact O-N 2.84Å; Y244-K249 HydrophobicContact CE1-CG 4.5Å
245Y93.3Very high84.7Confident131 Ų13178.2 Ų78.251%0.51440%0.403SS..Hα-helixtrans-62.2-48178.9179.1-94.7000111.4S241 K242 F243 A247 K249 K250S241-Y245 WeakPolarHBondContact O-CB 3.19Å; S241-Y245 PolarHBondContact O-N 2.7Å; K242-Y245 PolarHBondContact O-N 3.36Å; F243-Y245 PolarHBondContact O-N 2.91Å; Y245-A247 PolarHBondContact O-N 3.41Å; Y245-K249 HydrophobicContact CD2-CB 3.79Å; Y245-K249 HydrophobicContact CD2-CD 4.2Å; Y245-K249 HydrophobicContact CE2-CB 4.07Å; Y245-K249 HydrophobicContact CG-CB 4.44Å; Y245-K249 CarbonylContact O-C 3.53Å; Y245-K249 WeakPolarHBondContact O-CA 3.49Å; Y245-K249 PolarHBondContact O-N 3.08Å; Y245-K250 PolarHBondContact O-N 2.81Å
246E90.9Very high82.7Confident103 Ų10383 Ų8348%0.48143%0.426SS..Hα-helixtrans-64.4-38.3179-70.9176.3172.200112.4K242 F243K242-E246 WeakPolarHBondContact CE-OE1 3.41Å; K242-E246 IonicContact NZ-OE1 3.67Å; K242-E246 WeakPolarHBondContact O-CG 3.18Å; K242-E246 PolarHBondContact O-N 3.38Å; F243-E246 PolarHBondContact O-N 3.5Å
247A87.6Confident80.6Confident54 Ų5484.4 Ų84.445%0.44644%0.443SS..Hα-helixtrans-79.5-30.3-177.600000114.3F243 Y244 Y245F243-A247 VanDerWaalsContact O-CB 3.23Å; F243-A247 WeakPolarHBondContact O-CB 3.45Å; F243-A247 PolarHBondContact O-N 2.95Å; Y244-A247 PolarHBondContact O-N 2.03Å; Y245-A247 PolarHBondContact O-N 3.41Å
248Y90Very high78.2Confident73 Ų7386.6 Ų86.629%0.28646%0.455SS..Hα-helixtrans-130.1-13.4-167-58.8-63.2000116K193 Y244K193-Y248 HydrophobicContact CB-CD1 4.35Å; K193-Y248 HydrophobicContact CB-CE1 3.92Å; K193-Y248 HydrophobicContact CB-CE2 4.25Å; K193-Y248 HydrophobicContact CD-CD1 4.15Å; K193-Y248 HydrophobicContact CD-CG 4.26Å; K193-Y248 HydrophobicContact CG-CD1 4.17Å; K193-Y248 HydrophobicContact CG-CD2 4.15Å; K193-Y248 HydrophobicContact CG-CE1 4.23Å; K193-Y248 HydrophobicContact CG-CE2 4.21Å; K193-Y248 HydrophobicContact CG-CG 4.14Å; Y244-Y248 HydrophobicContact CD1-CD2 4.21Å; Y244-Y248 AromaticContact CD2-CD2 3.74Å; Y244-Y248 HydrophobicContact CD2-CD2 3.74Å; Y244-Y248 HydrophobicContact CD2-CE2 4.09Å; Y244-Y248 HydrophobicContact CE1-CD2 4.29Å; Y244-Y248 AromaticContact CE2-CD2 3.86Å; Y244-Y248 HydrophobicContact CE2-CD2 3.86Å; Y244-Y248 HydrophobicContact CE2-CE2 4.27Å; Y244-Y248 AromaticContact CG-CD2 3.93Å; Y244-Y248 HydrophobicContact CG-CD2 3.93Å; Y244-Y248 WeakPolarHBondContact O-CB 3.01Å; Y244-Y248 WeakPolarHBondContact O-CD2 2.94Å; Y244-Y248 PolarHBondContact O-N 2.84Å
249K82.9Confident75.8Confident137 Ų13782.7 Ų82.760%0.59644%0.436SS*.THydrogen-bonded Turntrans-123.1-21.5-175.8-66-167.5176.7-176.10114.3Y244 Y245 P251Y244-K249 HydrophobicContact CE1-CG 4.5Å; Y245-K249 HydrophobicContact CD2-CB 3.79Å; Y245-K249 HydrophobicContact CD2-CD 4.2Å; Y245-K249 HydrophobicContact CE2-CB 4.07Å; Y245-K249 HydrophobicContact CG-CB 4.44Å; Y245-K249 CarbonylContact O-C 3.53Å; Y245-K249 WeakPolarHBondContact O-CA 3.49Å; Y245-K249 PolarHBondContact O-N 3.08Å; K249-P251 WeakPolarHBondContact O-CD 3.42Å
250K78.2Confident73.6Confident132 Ų13286.2 Ų86.257%0.57446%0.459SS*.SBendtrans-62.9121.7177.6-167.8176.4-178.7-1800109.7Y245 V252Y245-K250 PolarHBondContact O-N 2.81Å; K250-V252 PolarHBondContact O-N 3.24Å
251P64.1Low71.4Confident102 Ų10292.1 Ų92.166%0.66249%0.491SS*.PPolyproline II helixtrans-58.6133.2172.9-20.231.4000109.6K249 P253K249-P251 WeakPolarHBondContact O-CD 3.42Å; P251-P253 WeakPolarHBondContact O-CD 3.1Å
252V63.6Low68.9Low78 Ų7892.4 Ų92.447%0.47350%0.502SS..PPolyproline II helixtrans-68.1123.5168.9-176.60000106.5K250 L254 V260K250-V252 PolarHBondContact O-N 3.24Å; V252-L254 PolarHBondContact O-N 2.98Å; V252-L254 VanDerWaalsContact O-N 3.14Å; V252-V260 HydrophobicContact CG1-CB 4.03Å; V252-V260 HydrophobicContact CG1-CG2 3.6Å
253P54.2Low66.2Low99 Ų9993.9 Ų93.964%0.64351%0.508SS*.PPolyproline II helixtrans-54123.7175.7-22.331.8000109.3P251 V255P251-P253 WeakPolarHBondContact O-CD 3.1Å; P253-V255 PolarHBondContact O-N 2.9Å; P253-V255 VanDerWaalsContact O-N 3.15Å
254L53Low63.5Low76 Ų7698.6 Ų98.640%0.39853%0.525SS..  trans-67.5111.1172.2-64.9172.1000107.3V252 N256 L258 T259 D265V252-L254 PolarHBondContact O-N 2.98Å; V252-L254 VanDerWaalsContact O-N 3.14Å; L254-N256 PolarHBondContact O-N 2.82Å; L254-L258 WeakPolarHBondContact CA-O 3.49Å; L254-L258 VanDerWaalsContact CD2-C 3.41Å; L254-T259 HydrophobicContact CD2-CG2 3.42Å; L254-T259 VanDerWaalsContact CD2-CG2 3.42Å; L254-D265 HydrophobicContact CD1-CB 4.33Å
255V55.9Low61.2Low97 Ų97100.1 Ų100.159%0.58854%0.536SS*.BIsolated β-bridgetrans-80116.9164.71790000105.5P253 G257 L258P253-V255 PolarHBondContact O-N 2.9Å; P253-V255 VanDerWaalsContact O-N 3.15Å; V255-G257 VanDerWaalsContact C-N 3.32Å; V255-G257 PolarHBondContact O-N 2.72Å; V255-L258 PolarHBondContact N-O 3.38Å; V255-L258 VanDerWaalsContact N-O 3.15Å; V255-L258 PolarHBondContact O-N 3.1Å; V255-L258 VanDerWaalsContact O-N 3.08Å
256N57.6Low59.1Low155 Ų155103.4 Ų103.483%0.82955%0.553SS**THydrogen-bonded Turntrans54.939.3-179.5-59.8-13.4000114.6L254 L258L254-N256 PolarHBondContact O-N 2.82Å; N256-L258 PolarHBondContact O-N 3.45Å
257G52.6Low56.9Low37 Ų37107.1 Ų107.138%0.38157%0.568SS.*THydrogen-bonded Turntrans74.40.6-179.800000114.9V255V255-G257 VanDerWaalsContact C-N 3.32Å; V255-G257 PolarHBondContact O-N 2.72Å
258L47.1Very low54.4Low78 Ų78109.4 Ų109.441%0.40858%0.576SS.*BIsolated β-bridgetrans-103.7131.3176-66.2165.9000109.9L254 V255 N256 Y264L254-L258 WeakPolarHBondContact CA-O 3.49Å; L254-L258 VanDerWaalsContact CD2-C 3.41Å; V255-L258 PolarHBondContact N-O 3.38Å; V255-L258 VanDerWaalsContact N-O 3.15Å; V255-L258 PolarHBondContact O-N 3.1Å; V255-L258 VanDerWaalsContact O-N 3.08Å; N256-L258 PolarHBondContact O-N 3.45Å; L258-Y264 HydrophobicContact CD2-CD2 3.97Å; L258-Y264 HydrophobicContact CD2-CE2 3.86Å
259T48.6Very low52Low36 Ų36118.5 Ų118.522%0.22162%0.621CS.*  trans-63.4152.4163.857.20000108.5L254 D261 G262 K263L254-T259 HydrophobicContact CD2-CG2 3.42Å; L254-T259 VanDerWaalsContact CD2-CG2 3.42Å; T259-D261 PolarHBondContact O-N 2.84Å; T259-G262 WeakPolarHBondContact O-CA 3.4Å; T259-G262 PolarHBondContact O-N 3.44Å; T259-K263 WeakPolarHBondContact CB-O 3.3Å; T259-K263 WeakPolarHBondContact CG2-O 3.4Å; T259-K263 PolarHBondContact N-O 2.89Å; T259-K263 WeakPolarHBondContact OG1-CA 3.49Å; T259-K263 WeakPolarHBondContact OG1-CB 3.28Å; T259-K263 PolarHBondContact OG1-N 2.63Å; T259-K263 PolarHBondContact OG1-O 3.49Å
260V49.9Very low50.5Low109 Ų109117.6 Ų117.666%0.66162%0.622SS**THydrogen-bonded Turntrans-57.7-21.9176.7177.20000111.9V252 G262V252-V260 HydrophobicContact CG1-CB 4.03Å; V252-V260 HydrophobicContact CG1-CG2 3.6Å; V260-G262 VanDerWaalsContact C-N 3.28Å; V260-G262 PolarHBondContact O-N 2.97Å
261D52Low49Very low142 Ų142116.8 Ų116.876%0.75963%0.625SS**THydrogen-bonded Turntrans-87.611.9173.7-61.8-21.9000113.6T259 K263T259-D261 PolarHBondContact O-N 2.84Å; D261-K263 PolarHBondContact O-N 3.22Å
262G43Very low48.1Very low54 Ų54117.7 Ų117.756%0.55762%0.623SS**SBendtrans69.68.617700000115.2T259 V260T259-G262 WeakPolarHBondContact O-CA 3.4Å; T259-G262 PolarHBondContact O-N 3.44Å; V260-G262 VanDerWaalsContact C-N 3.28Å; V260-G262 PolarHBondContact O-N 2.97Å
263K39.7Very low47.2Very low156 Ų156120 Ų12068%0.67863%0.631SS**PPolyproline II helixtrans-86.4128.4176.1-72.3-177.8179.2174.90110.6T259 D261T259-K263 WeakPolarHBondContact CB-O 3.3Å; T259-K263 WeakPolarHBondContact CG2-O 3.4Å; T259-K263 PolarHBondContact N-O 2.89Å; T259-K263 WeakPolarHBondContact OG1-CA 3.49Å; T259-K263 WeakPolarHBondContact OG1-CB 3.28Å; T259-K263 PolarHBondContact OG1-N 2.63Å; T259-K263 PolarHBondContact OG1-O 3.49Å; D261-K263 PolarHBondContact O-N 3.22Å
264Y36.6Very low46.8Very low176 Ų176121.3 Ų121.369%0.6963%0.631SS**BIsolated β-bridgetrans-62.8136.6166.5-107.8-97.1000110.2L258 K266L258-Y264 HydrophobicContact CD2-CD2 3.97Å; L258-Y264 HydrophobicContact CD2-CE2 3.86Å; Y264-K266 PolarHBondContact O-N 3.05Å
265D44.2Very low46.4Very low77 Ų77124.3 Ų124.341%0.41265%0.646SS.*PPolyproline II helixtrans-70119.3165.9-167.7-8000108.5L254 K267L254-D265 HydrophobicContact CD1-CB 4.33Å; D265-K267 PolarHBondContact O-N 2.9Å; D265-K267 WeakPolarHBondContact OD1-CB 3.49Å; D265-K267 PolarHBondContact OD1-N 3.15Å
266K48.7Very low45.7Very low200 Ų200126.3 Ų126.387%0.8765%0.65SS**THydrogen-bonded Turntrans-75.64.5179.7-77.6-170.7174.9-173.10113.2Y264Y264-K266 PolarHBondContact O-N 3.05Å
267K44.9Very low44.8Very low182 Ų182124.1 Ų124.179%0.79164%0.637SS**THydrogen-bonded Turntrans-88.60.8-177.8-76.2-170173.8-173.30115.8D265 H269D265-K267 PolarHBondContact O-N 2.9Å; D265-K267 WeakPolarHBondContact OD1-CB 3.49Å; D265-K267 PolarHBondContact OD1-N 3.15Å; K267-H269 PolarHBondContact O-N 3.39Å
268T36.5Very low44.1Very low102 Ų102131.3 Ų131.363%0.62666%0.658SS**  trans-92.984.5170.647.90000110.5
269H38.6Very low43.9Very low264 Ų264136.2 Ų136.2100%1.22268%0.681SS**  trans-153.10150.1-80.8-52.6000109.2K267K267-H269 PolarHBondContact O-N 3.39Å

Retrieved 269 of 269 residues in 712.8 ms (Link to these results)

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