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Cytochrome b

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

AlphaFold DB , UniProt , Accession A0A075DCW5, Species MOUSE (Mus musculus, Mouse), Gene CYTB, Length 381 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
1M64.8Low91.1Very high244 Ų244113.8 Ų113.8100%1.20258%0.582SS**  0133.30-64.3178.6-150.100108.5N3M1-N3 PolarHBondContact O-N 2.62Å
2T81.5Confident91.5Very high117 Ų117112.9 Ų112.972%0.71857%0.57SS**  trans-67.5126.2173.141.90000109.8T7T2-T7 WeakPolarHBondContact OG1-CG2 3.35Å
3N92.9Very high91.9Very high95 Ų95112.9 Ų112.951%0.50857%0.571SS.*  trans-63.1140.6-179-177.6-30.2000111M1 R5 K6 T7M1-N3 PolarHBondContact O-N 2.62Å; N3-R5 PolarHBondContact O-N 3.02Å; N3-R5 VanDerWaalsContact O-N 3.07Å; N3-R5 WeakPolarHBondContact OD1-CB 3.23Å; N3-R5 PolarHBondContact OD1-N 3.14Å; N3-K6 PolarHBondContact O-N 3.42Å; N3-T7 PolarHBondContact O-N 3.09Å; N3-T7 PolarHBondContact O-OG1 3.35Å
4M94.8Very high92.1Very high136 Ų136111 Ų11167%0.6756%0.562SS**Hα-helixtrans-47.8-34.5174.3-69.5-165.3-68.600113.7K6 T7 H8M4-K6 PolarHBondContact O-N 3.22Å; M4-T7 WeakPolarHBondContact CA-OG1 3.36Å; M4-T7 PolarHBondContact O-N 3.08Å; M4-H8 VanDerWaalsContact O-CB 3.28Å; M4-H8 WeakPolarHBondContact O-CB 3.49Å; M4-H8 PolarHBondContact O-N 2.91Å
5R95.5Very high92.5Very high75 Ų75103.6 Ų103.628%0.28352%0.524SS..Hα-helixtrans-57.1-29.3176.7-166-178.174-178.910.9113.3N3 F11 K12 N15 I19 D20N3-R5 PolarHBondContact O-N 3.02Å; N3-R5 VanDerWaalsContact O-N 3.07Å; N3-R5 WeakPolarHBondContact OD1-CB 3.23Å; N3-R5 PolarHBondContact OD1-N 3.14Å; R5-F11 CarbonylContact O-C 3.44Å; R5-F11 VanDerWaalsContact O-C 3.24Å; R5-K12 WeakPolarHBondContact O-CA 3.31Å; R5-K12 PolarHBondContact O-N 2.84Å; R5-N15 VanDerWaalsContact CD-OD1 3.22Å; R5-N15 WeakPolarHBondContact CD-OD1 3.49Å; R5-N15 HydrophobicContact CG-CB 3.89Å; R5-N15 WeakPolarHBondContact CG-OD1 3.43Å; R5-N15 VanDerWaalsContact CZ-OD1 3.28Å; R5-N15 PolarHBondContact NE-OD1 3.15Å; R5-N15 PolarHBondContact NH2-OD1 2.9Å; R5-N15 WeakPolarHBondContact O-CB 3.38Å; R5-I19 HydrophobicContact CG-CD1 4.27Å; R5-D20 IonicContact CZ-OD1 2.67Å; R5-D20 IonicContact CZ-OD2 3.61Å; R5-D20 IonicContact NH2-OD1 3.85Å; R5-D20 PolarHBondContact NH2-OD1 3.27Å; R5-D20 IonicContact NH2-OD2 2.69Å; R5-D20 PolarHBondContact NH2-OD2 3.24Å
6K94.6Very high92.7Very high111 Ų111103.6 Ų103.648%0.48352%0.521SS..Hα-helixtrans-100-17.9-179.1-63.3-171.7176.3-171.80113.4N3 M4 D20N3-K6 PolarHBondContact O-N 3.42Å; M4-K6 PolarHBondContact O-N 3.22Å; K6-D20 WeakPolarHBondContact CE-OD2 3.47Å; K6-D20 IonicContact NZ-OD2 3Å; K6-D20 PolarHBondContact NZ-OD2 3.09Å
7T95.5Very high92.7Very high75 Ų7599.9 Ų99.946%0.4651%0.508SS..Hα-helixtrans-106.7-36.6-173.955.80000113.6T2 N3 M4T2-T7 WeakPolarHBondContact OG1-CG2 3.35Å; N3-T7 PolarHBondContact O-N 3.09Å; N3-T7 PolarHBondContact O-OG1 3.35Å; M4-T7 WeakPolarHBondContact CA-OG1 3.36Å; M4-T7 PolarHBondContact O-N 3.08Å
8H96.8Very high92.8Very high84 Ų84100.3 Ų100.339%0.38951%0.506SS..SBendtrans-67.9127.3-179.4-174.6-94.5000110.2M4 L10 F11 K12M4-H8 VanDerWaalsContact O-CB 3.28Å; M4-H8 WeakPolarHBondContact O-CB 3.49Å; M4-H8 PolarHBondContact O-N 2.91Å; H8-L10 VanDerWaalsContact C-N 3.29Å; H8-L10 PolarHBondContact ND1-N 2.94Å; H8-L10 PolarHBondContact O-N 2.91Å; H8-L10 VanDerWaalsContact O-N 3.13Å; H8-F11 HydrophobicContact CB-CB 4.12Å; H8-F11 HydrophobicContact CB-CD2 3.84Å; H8-F11 HydrophobicContact CB-CG 4.21Å; H8-F11 AromaticContact CG-CD2 3.97Å; H8-F11 AromaticContact ND1-CD2 3.88Å; H8-F11 AromaticContact ND1-CG 3.85Å; H8-F11 PolarHBondContact O-N 3.09Å; H8-F11 VanDerWaalsContact O-N 3.08Å; H8-K12 VanDerWaalsContact O-CB 3.29Å; H8-K12 WeakPolarHBondContact O-CB 3.22Å; H8-K12 PolarHBondContact O-N 3.4Å
9P95.8Very high93.1Very high97 Ų9796.9 Ų96.963%0.6349%0.489SS*.Hα-helixtrans-52.6-41-171.3-30.335.7000114.7
10L94.8Very high93.3Very high116 Ų11694.5 Ų94.561%0.60748%0.477SS*.Hα-helixtrans-75.5-43.8177.7-63.2178.6000112.8H8 K12 I13 I14H8-L10 VanDerWaalsContact C-N 3.29Å; H8-L10 PolarHBondContact ND1-N 2.94Å; H8-L10 PolarHBondContact O-N 2.91Å; H8-L10 VanDerWaalsContact O-N 3.13Å; L10-K12 PolarHBondContact O-N 3.27Å; L10-I13 PolarHBondContact O-N 3.41Å; L10-I14 PolarHBondContact O-N 3.5Å
11F95.7Very high93.5Very high102 Ų10291.2 Ų91.245%0.44746%0.461SS..Hα-helixtrans-71.8-26.8-177.1-61.7-25.2000111.7R5 H8 I13 I14 N15R5-F11 CarbonylContact O-C 3.44Å; R5-F11 VanDerWaalsContact O-C 3.24Å; H8-F11 HydrophobicContact CB-CB 4.12Å; H8-F11 HydrophobicContact CB-CD2 3.84Å; H8-F11 HydrophobicContact CB-CG 4.21Å; H8-F11 AromaticContact CG-CD2 3.97Å; H8-F11 AromaticContact ND1-CD2 3.88Å; H8-F11 AromaticContact ND1-CG 3.85Å; H8-F11 PolarHBondContact O-N 3.09Å; H8-F11 VanDerWaalsContact O-N 3.08Å; F11-I13 VanDerWaalsContact C-N 3.32Å; F11-I13 PolarHBondContact O-N 3.29Å; F11-I14 HydrophobicContact CD1-CD1 4.4Å; F11-I14 PolarHBondContact O-N 3.17Å; F11-N15 VanDerWaalsContact O-CB 3.23Å; F11-N15 WeakPolarHBondContact O-CB 3.39Å; F11-N15 PolarHBondContact O-N 3.48Å
12K95.8Very high95.1Very high103 Ų10382.8 Ų82.845%0.44842%0.424SS..Hα-helixtrans-59.2-43.3172.5-177.5175.2179-174.30111.3R5 H8 L10 N15 H16R5-K12 WeakPolarHBondContact O-CA 3.31Å; R5-K12 PolarHBondContact O-N 2.84Å; H8-K12 VanDerWaalsContact O-CB 3.29Å; H8-K12 WeakPolarHBondContact O-CB 3.22Å; H8-K12 PolarHBondContact O-N 3.4Å; L10-K12 PolarHBondContact O-N 3.27Å; K12-N15 WeakPolarHBondContact O-CB 3.4Å; K12-N15 PolarHBondContact O-N 2.66Å; K12-H16 VanDerWaalsContact CG-CD2 3.46Å; K12-H16 WeakPolarHBondContact CG-CD2 3.28Å; K12-H16 PolarHBondContact O-CD2 2.94Å; K12-H16 PolarHBondContact O-N 3.34Å
13I95.9Very high95.9Very high113 Ų11377.4 Ų77.458%0.57939%0.392SS*.Hα-helixtrans-61.8-50.9176.9-61.4169.3000109.9L10 F11 N15 H16 S17L10-I13 PolarHBondContact O-N 3.41Å; F11-I13 VanDerWaalsContact C-N 3.32Å; F11-I13 PolarHBondContact O-N 3.29Å; I13-N15 VanDerWaalsContact C-N 3.27Å; I13-N15 PolarHBondContact O-N 3.01Å; I13-H16 PolarHBondContact O-N 3.45Å; I13-S17 WeakPolarHBondContact O-CB 3.44Å; I13-S17 PolarHBondContact O-N 3.47Å; I13-S17 PolarHBondContact O-OG 3.01Å
14I95.8Very high96.2Very high86 Ų8673 Ų7344%0.44137%0.368SS..Hα-helixtrans-59.3-41.1177.7-60.7174.4000110.7L10 F11 F18 I19L10-I14 PolarHBondContact O-N 3.5Å; F11-I14 HydrophobicContact CD1-CD1 4.4Å; F11-I14 PolarHBondContact O-N 3.17Å; I14-F18 HydrophobicContact CG2-CB 4.5Å; I14-F18 WeakPolarHBondContact O-CA 3.35Å; I14-F18 VanDerWaalsContact O-CB 3.25Å; I14-F18 WeakPolarHBondContact O-CB 3.48Å; I14-F18 PolarHBondContact O-N 3.06Å; I14-I19 HydrophobicContact CG2-CD1 4.33Å; I14-I19 PolarHBondContact O-N 3.4Å
15N97.1Very high96.3Very high0 Ų068.5 Ų68.50%035%0.35CS..Iπ-helixtrans-61-52.1-180-173.365.7000112R5 F11 K12 I13 S17 I19 D20R5-N15 VanDerWaalsContact CD-OD1 3.22Å; R5-N15 WeakPolarHBondContact CD-OD1 3.49Å; R5-N15 HydrophobicContact CG-CB 3.89Å; R5-N15 WeakPolarHBondContact CG-OD1 3.43Å; R5-N15 VanDerWaalsContact CZ-OD1 3.28Å; R5-N15 PolarHBondContact NE-OD1 3.15Å; R5-N15 PolarHBondContact NH2-OD1 2.9Å; R5-N15 WeakPolarHBondContact O-CB 3.38Å; F11-N15 VanDerWaalsContact O-CB 3.23Å; F11-N15 WeakPolarHBondContact O-CB 3.39Å; F11-N15 PolarHBondContact O-N 3.48Å; K12-N15 WeakPolarHBondContact O-CB 3.4Å; K12-N15 PolarHBondContact O-N 2.66Å; I13-N15 VanDerWaalsContact C-N 3.27Å; I13-N15 PolarHBondContact O-N 3.01Å; N15-S17 VanDerWaalsContact C-N 3.35Å; N15-I19 PolarHBondContact O-N 3.31Å; N15-D20 PolarHBondContact ND2-OD2 3.37Å; N15-D20 PolarHBondContact O-N 3.39Å; N15-D20 PolarHBondContact OD1-OD2 3.23Å; N15-D20 VanDerWaalsContact OD1-OD2 3.07Å
16H95.7Very high96.5Very high103 Ų10368 Ų6848%0.47735%0.353SS..Iπ-helixtrans-74-26.1-175.8-71.8-67.4000113.3K12 I13 L21K12-H16 VanDerWaalsContact CG-CD2 3.46Å; K12-H16 WeakPolarHBondContact CG-CD2 3.28Å; K12-H16 PolarHBondContact O-CD2 2.94Å; K12-H16 PolarHBondContact O-N 3.34Å; I13-H16 PolarHBondContact O-N 3.45Å; H16-L21 WeakPolarHBondContact O-CB 3.37Å
17S93.6Very high96.6Very high41 Ų4163.6 Ų63.629%0.28734%0.335SS..Iπ-helixtrans-94.3-15.6-179.259.30000114.5I13 N15 L21I13-S17 WeakPolarHBondContact O-CB 3.44Å; I13-S17 PolarHBondContact O-N 3.47Å; I13-S17 PolarHBondContact O-OG 3.01Å; N15-S17 VanDerWaalsContact C-N 3.35Å; S17-L21 WeakPolarHBondContact O-CD2 3.39Å
18F94.6Very high96.8Very high108 Ų10861.7 Ų61.747%0.47433%0.325SS..Iπ-helixtrans-139.7-34.7-171.5-162.7-96.4000115I14 F220 T225I14-F18 HydrophobicContact CG2-CB 4.5Å; I14-F18 WeakPolarHBondContact O-CA 3.35Å; I14-F18 VanDerWaalsContact O-CB 3.25Å; I14-F18 WeakPolarHBondContact O-CB 3.48Å; I14-F18 PolarHBondContact O-N 3.06Å; F18-F220 HydrophobicContact CD2-CE1 4.41Å; F18-F220 HydrophobicContact CE2-CE1 4.13Å; F18-F220 HydrophobicContact CZ-CE1 4.28Å; F18-F220 WeakPolarHBondContact O-CB 3.45Å; F18-F220 WeakPolarHBondContact O-CD1 3.19Å; F18-T225 HydrophobicContact CD1-CG2 4.46Å; F18-T225 HydrophobicContact CE1-CG2 3.76Å; F18-T225 HydrophobicContact CZ-CG2 4.15Å
19I97.4Very high96.8Very high36 Ų3661.4 Ų61.419%0.18533%0.332CS..Iπ-helixtrans-98.4-64.5-171.7-57.5174.2000110.9R5 I14 N15 L21 H221R5-I19 HydrophobicContact CG-CD1 4.27Å; I14-I19 HydrophobicContact CG2-CD1 4.33Å; I14-I19 PolarHBondContact O-N 3.4Å; N15-I19 PolarHBondContact O-N 3.31Å; I19-L21 VanDerWaalsContact C-N 3.3Å; I19-H221 HydrophobicContact CG2-CB 4.06Å; I19-H221 PolarHBondContact O-N 3.28Å; I19-H221 VanDerWaalsContact O-N 3.07Å
20D97.7Very high97Very high48 Ų4861.1 Ų61.126%0.25732%0.318SS..SBendtrans-92.111.5-179.6-67.9-16.7000112R5 K6 N15 P22R5-D20 IonicContact CZ-OD1 2.67Å; R5-D20 IonicContact CZ-OD2 3.61Å; R5-D20 IonicContact NH2-OD1 3.85Å; R5-D20 PolarHBondContact NH2-OD1 3.27Å; R5-D20 IonicContact NH2-OD2 2.69Å; R5-D20 PolarHBondContact NH2-OD2 3.24Å; K6-D20 WeakPolarHBondContact CE-OD2 3.47Å; K6-D20 IonicContact NZ-OD2 3Å; K6-D20 PolarHBondContact NZ-OD2 3.09Å; N15-D20 PolarHBondContact ND2-OD2 3.37Å; N15-D20 PolarHBondContact O-N 3.39Å; N15-D20 PolarHBondContact OD1-OD2 3.23Å; N15-D20 VanDerWaalsContact OD1-OD2 3.07Å; D20-P22 VanDerWaalsContact O-CD 3.26Å; D20-P22 WeakPolarHBondContact O-CD 3.41Å
21L97.9Very high97.2Very high25 Ų2556.7 Ų56.713%0.13129%0.293CS..  trans-57.6118.9175.9173.267.8000109.2H16 S17 I19 A23 F220H16-L21 WeakPolarHBondContact O-CB 3.37Å; S17-L21 WeakPolarHBondContact O-CD2 3.39Å; I19-L21 VanDerWaalsContact C-N 3.3Å; L21-A23 PolarHBondContact O-N 3.29Å; L21-F220 HydrophobicContact CB-CB 3.95Å; L21-F220 HydrophobicContact CD2-CD2 4.11Å; L21-F220 WeakPolarHBondContact O-CB 3.17Å; L21-F220 PolarHBondContact O-N 3.27Å
22P97.9Very high97.3Very high68 Ų6852.3 Ų52.344%0.44228%0.275SS..EExtended strand (participates in β ladder)trans-77.1115.3178.531.8-36.8000110D20 K217D20-P22 VanDerWaalsContact O-CD 3.26Å; D20-P22 WeakPolarHBondContact O-CD 3.41Å; P22-K217 HydrophobicContact CB-CB 4.11Å; P22-K217 HydrophobicContact CB-CD 3.75Å; P22-K217 HydrophobicContact CG-CD 4.42Å
23A98.2Very high97.5Very high4 Ų448.9 Ų48.93%0.03326%0.26CS..EExtended strand (participates in β ladder)trans-113.5145.2-179.100000110.6L21 S25 K217 I218 Y224L21-A23 PolarHBondContact O-N 3.29Å; A23-S25 PolarHBondContact O-N 2.98Å; A23-K217 CarbonylContact O-C 3.53Å; A23-K217 VanDerWaalsContact O-CA 3.28Å; A23-K217 WeakPolarHBondContact O-CA 3.42Å; A23-I218 PolarHBondContact N-O 2.77Å; A23-I218 PolarHBondContact O-N 3.21Å; A23-Y224 HydrophobicContact CB-CD2 3.52Å; A23-Y224 HydrophobicContact CB-CE2 3.39Å
24P98.4Very high97.6Very high1 Ų145 Ų451%0.00625%0.248CC..EExtended strand (participates in β ladder)trans-54.6138.5174.6-17.827.4000110.3N26 I27 S205 N207 S213 Y224P24-N26 PolarHBondContact O-N 3.02Å; P24-I27 HydrophobicContact CB-CG2 4.1Å; P24-I27 HydrophobicContact CG-CG2 4.1Å; P24-S205 WeakPolarHBondContact CG-O 3.4Å; P24-N207 HydrophobicContact CB-CB 3.8Å; P24-N207 HydrophobicContact CG-CB 4.1Å; P24-S213 WeakPolarHBondContact CB-OG 3.34Å; P24-S213 WeakPolarHBondContact CG-OG 3.5Å; P24-Y224 PolarHBondContact O-OH 3.2Å
25S98.3Very high97.7Very high43 Ų4342.5 Ų42.530%0.30124%0.238SC..THydrogen-bonded Turntrans-65-21.8-177.565.90000114.6A23 D216 Y224A23-S25 PolarHBondContact O-N 2.98Å; S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.37Å; S25-D216 PolarHBondContact N-O 3.16Å; S25-D216 VanDerWaalsContact N-O 3.13Å; S25-D216 PolarHBondContact OG-OD2 3.26Å; S25-Y224 VanDerWaalsContact C-OH 3.29Å; S25-Y224 PolarHBondContact O-OH 2.98Å
26N98.4Very high97.7Very high65 Ų6543 Ų4335%0.34824%0.241SC..THydrogen-bonded Turntrans-110.715.3-166.170.4-27.6000114.7P24 S28 N207 P208P24-N26 PolarHBondContact O-N 3.02Å; N26-S28 PolarHBondContact O-N 3.01Å; N26-N207 PolarHBondContact ND2-OD1 3.44Å; N26-N207 WeakPolarHBondContact OD1-CB 3.42Å; N26-P208 VanDerWaalsContact O-CD 3.28Å; N26-P208 WeakPolarHBondContact O-CD 3.14Å; N26-P208 WeakPolarHBondContact O-CG 3.26Å
27I98.3Very high97.9Very high18 Ų1839.3 Ų39.39%0.09223%0.225CC..  trans-67.9129.1176.952.9163.6000111.2P24 W31 N206 N207 Y224 K227P24-I27 HydrophobicContact CB-CG2 4.1Å; P24-I27 HydrophobicContact CG-CG2 4.1Å; I27-W31 HydrophobicContact CB-CB 4.01Å; I27-W31 HydrophobicContact CB-CD2 3.74Å; I27-W31 HydrophobicContact CB-CE3 4.21Å; I27-W31 HydrophobicContact CB-CG 3.63Å; I27-W31 HydrophobicContact CD1-CB 3.83Å; I27-W31 HydrophobicContact CD1-CG 3.95Å; I27-W31 HydrophobicContact CG1-CB 4.38Å; I27-W31 HydrophobicContact CG1-CG 4.35Å; I27-W31 HydrophobicContact CG2-CD2 3.72Å; I27-W31 HydrophobicContact CG2-CE3 4.41Å; I27-W31 HydrophobicContact CG2-CG 3.8Å; I27-W31 HydrophobicContact CG2-CZ2 4.25Å; I27-N206 WeakPolarHBondContact CG2-O 3.43Å; I27-N207 HydrophobicContact CG2-CB 4.04Å; I27-Y224 HydrophobicContact CD1-CD1 3.8Å; I27-Y224 HydrophobicContact CD1-CD2 4.31Å; I27-Y224 HydrophobicContact CD1-CE1 3.49Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.49Å; I27-Y224 HydrophobicContact CD1-CE2 3.97Å; I27-Y224 HydrophobicContact CD1-CG 4.24Å; I27-Y224 HydrophobicContact CG1-CD1 4.11Å; I27-Y224 HydrophobicContact CG1-CE1 3.28Å; I27-Y224 HydrophobicContact CG1-CE2 4.02Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.39Å; I27-K227 PolarHBondContact O-NZ 3.29Å
28S98.3Very high98.1Very high35 Ų3539 Ų3925%0.24523%0.228CC..  trans-83.9-175.4-175.667.30000112.8N26 W30 W31 K227N26-S28 PolarHBondContact O-N 3.01Å; S28-W30 PolarHBondContact O-N 3.06Å; S28-W30 VanDerWaalsContact O-N 3.16Å; S28-W30 VanDerWaalsContact OG-CD1 3.31Å; S28-W31 PolarHBondContact O-N 3.1Å; S28-W31 VanDerWaalsContact O-N 3.14Å; S28-K227 PolarHBondContact O-NZ 2.85Å
29S98.3Very high98.3Very high77 Ų7735.9 Ų35.954%0.53822%0.216SC..G310 helixtrans-57.5-24.8177.6510000113.6W31 N32S29-W31 PolarHBondContact O-N 3.03Å; S29-W31 VanDerWaalsContact O-N 3.13Å; S29-N32 WeakPolarHBondContact CA-OD1 3.49Å; S29-N32 VanDerWaalsContact O-CB 3.27Å; S29-N32 WeakPolarHBondContact O-CB 3.36Å; S29-N32 PolarHBondContact O-N 2.64Å; S29-N32 PolarHBondContact O-OD1 3.32Å; S29-N32 VanDerWaalsContact O-OD1 3.12Å
30W98.6Very high98.4Very high91 Ų9134.4 Ų34.435%0.34521%0.208SC..G310 helixtrans-62.4-20.9177.6-58.3118.3000113.5S28 N32 F33 L96 R100 Y104S28-W30 PolarHBondContact O-N 3.06Å; S28-W30 VanDerWaalsContact O-N 3.16Å; S28-W30 VanDerWaalsContact OG-CD1 3.31Å; W30-N32 VanDerWaalsContact C-N 3.35Å; W30-F33 HydrophobicContact CE3-CD2 4.2Å; W30-F33 AromaticContact CE3-CE2 3.65Å; W30-F33 HydrophobicContact CE3-CE2 3.65Å; W30-F33 AromaticContact CZ3-CE2 3.99Å; W30-F33 HydrophobicContact CZ3-CE2 3.99Å; W30-L96 HydrophobicContact CZ3-CD2 4.12Å; W30-R100 HydrophobicContact CB-CB 4.04Å; W30-R100 HydrophobicContact CB-CG 3.5Å; W30-R100 HydrophobicContact CG-CG 4.49Å; W30-Y104 HydrophobicContact CB-CE2 4.25Å; W30-Y104 AromaticContact CD1-CE2 3.73Å; W30-Y104 AromaticContact CD1-CZ 3.98Å; W30-Y104 VanDerWaalsContact CD1-OH 3.31Å; W30-Y104 HydrophobicContact CG-CE2 4.16Å
31W98.7Very high98.5Very high23 Ų2332.9 Ų32.99%0.08720%0.2CC..G310 helixtrans-77.5-19.4175.6-87.4-113000113.8I27 S28 S29 F33 G34 R100 Y104 N206 P208I27-W31 HydrophobicContact CB-CB 4.01Å; I27-W31 HydrophobicContact CB-CD2 3.74Å; I27-W31 HydrophobicContact CB-CE3 4.21Å; I27-W31 HydrophobicContact CB-CG 3.63Å; I27-W31 HydrophobicContact CD1-CB 3.83Å; I27-W31 HydrophobicContact CD1-CG 3.95Å; I27-W31 HydrophobicContact CG1-CB 4.38Å; I27-W31 HydrophobicContact CG1-CG 4.35Å; I27-W31 HydrophobicContact CG2-CD2 3.72Å; I27-W31 HydrophobicContact CG2-CE3 4.41Å; I27-W31 HydrophobicContact CG2-CG 3.8Å; I27-W31 HydrophobicContact CG2-CZ2 4.25Å; S28-W31 PolarHBondContact O-N 3.1Å; S28-W31 VanDerWaalsContact O-N 3.14Å; S29-W31 PolarHBondContact O-N 3.03Å; S29-W31 VanDerWaalsContact O-N 3.13Å; W31-F33 PolarHBondContact O-N 3.04Å; W31-G34 PolarHBondContact O-N 2.88Å; W31-R100 VanDerWaalsContact CE2-NH1 3.28Å; W31-R100 HydrophobicContact CE3-CG 4.36Å; W31-R100 HydrophobicContact CZ3-CG 4.28Å; W31-Y104 HydrophobicContact CH2-CD1 4.1Å; W31-Y104 AromaticContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CE2 4.06Å; W31-Y104 AromaticContact CH2-CG 3.6Å; W31-Y104 HydrophobicContact CH2-CG 3.6Å; W31-Y104 AromaticContact CZ3-CD2 3.65Å; W31-Y104 HydrophobicContact CZ3-CD2 3.65Å; W31-Y104 AromaticContact CZ3-CE2 3.66Å; W31-Y104 HydrophobicContact CZ3-CE2 3.66Å; W31-Y104 HydrophobicContact CZ3-CG 4.08Å; W31-N206 VanDerWaalsContact CE2-O 3.24Å; W31-N206 HydrophobicContact CZ2-CB 4.29Å; W31-N206 VanDerWaalsContact CZ2-O 3.24Å; W31-N206 WeakPolarHBondContact CZ2-O 3.45Å; W31-N206 PolarHBondContact NE1-O 3.33Å; W31-P208 HydrophobicContact CH2-CG 4.1Å; W31-P208 HydrophobicContact CZ3-CG 3.85Å
32N98.6Very high98.5Very high10 Ų1036.9 Ų36.95%0.05322%0.219CC..G310 helixtrans-64.5-25.6178.2-67.170.1000112.5S29 W30 G34 S35 L36 K227 D228S29-N32 WeakPolarHBondContact CA-OD1 3.49Å; S29-N32 VanDerWaalsContact O-CB 3.27Å; S29-N32 WeakPolarHBondContact O-CB 3.36Å; S29-N32 PolarHBondContact O-N 2.64Å; S29-N32 PolarHBondContact O-OD1 3.32Å; S29-N32 VanDerWaalsContact O-OD1 3.12Å; W30-N32 VanDerWaalsContact C-N 3.35Å; N32-G34 PolarHBondContact O-N 2.69Å; N32-S35 PolarHBondContact O-N 2.94Å; N32-S35 PolarHBondContact O-OG 3.4Å; N32-L36 WeakPolarHBondContact O-CG 3.36Å; N32-L36 PolarHBondContact O-N 3.49Å; N32-K227 PolarHBondContact ND2-O 3.07Å; N32-K227 VanDerWaalsContact ND2-O 3.09Å; N32-K227 WeakPolarHBondContact OD1-CE 3Å; N32-K227 PolarHBondContact OD1-NZ 2.96Å; N32-D228 PolarHBondContact ND2-OD1 2.94Å; N32-D228 VanDerWaalsContact ND2-OD1 3.14Å
33F98.8Very high98.6Very high31 Ų3134.7 Ų34.714%0.13621%0.205CC..Hα-helixtrans-61.5-19.6-178.8-69.9-70.1000113.5W30 W31 L36 L37 C93 L96 H97W30-F33 HydrophobicContact CE3-CD2 4.2Å; W30-F33 AromaticContact CE3-CE2 3.65Å; W30-F33 HydrophobicContact CE3-CE2 3.65Å; W30-F33 AromaticContact CZ3-CE2 3.99Å; W30-F33 HydrophobicContact CZ3-CE2 3.99Å; W31-F33 PolarHBondContact O-N 3.04Å; F33-L36 HydrophobicContact CD1-CD1 3.85Å; F33-L36 HydrophobicContact CE1-CD1 3.96Å; F33-L37 WeakPolarHBondContact O-CB 3.46Å; F33-L37 WeakPolarHBondContact O-CD1 3.36Å; F33-L37 WeakPolarHBondContact O-CG 3.4Å; F33-L37 PolarHBondContact O-N 2.75Å; F33-L37 VanDerWaalsContact O-N 3.13Å; F33-C93 HydrophobicContact CD1-CB 4.05Å; F33-L96 HydrophobicContact CD1-CB 4.04Å; F33-L96 HydrophobicContact CD1-CD1 4.41Å; F33-L96 HydrophobicContact CD2-CB 3.92Å; F33-L96 HydrophobicContact CE1-CB 3.88Å; F33-L96 HydrophobicContact CE1-CD1 3.48Å; F33-L96 VanDerWaalsContact CE1-CD1 3.48Å; F33-L96 HydrophobicContact CE1-CG 4.31Å; F33-L96 HydrophobicContact CE2-CB 3.77Å; F33-L96 HydrophobicContact CE2-CD1 4.08Å; F33-L96 HydrophobicContact CG-CB 4.08Å; F33-L96 HydrophobicContact CZ-CB 3.76Å; F33-L96 HydrophobicContact CZ-CD1 3.29Å; F33-L96 HydrophobicContact CZ-CG 4.13Å; F33-H97 HydrophobicContact CB-CB 3.9Å
34G98.1Very high98.6Very high33 Ų3335.6 Ų35.634%0.3421%0.209SC..Hα-helixtrans-64.2-50.5170.700000112.6W31 N32 L37 G38 H97W31-G34 PolarHBondContact O-N 2.88Å; N32-G34 PolarHBondContact O-N 2.69Å; G34-L37 PolarHBondContact O-N 2.88Å; G34-G38 PolarHBondContact O-N 3.3Å; G34-H97 PolarHBondContact N-ND1 2.63Å
35S98.1Very high98.6Very high32 Ų3237.6 Ų37.622%0.22422%0.219CC..Hα-helixtrans-70.8-36.7178.146.50000112.3N32 L37 G38 I39 D228N32-S35 PolarHBondContact O-N 2.94Å; N32-S35 PolarHBondContact O-OG 3.4Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 3.46Å; S35-G38 PolarHBondContact O-N 2.68Å; S35-G38 VanDerWaalsContact O-N 3.12Å; S35-I39 PolarHBondContact O-N 3.04Å; S35-D228 WeakPolarHBondContact CB-OD2 3.21Å; S35-D228 PolarHBondContact OG-OD1 2.89Å; S35-D228 PolarHBondContact OG-OD2 3.43Å
36L98.8Very high98.6Very high12 Ų1239.9 Ų39.96%0.06323%0.227CC..Hα-helixtrans-60.4-39174.4-62.4-177.3000112.7N32 F33 G38 I39 C40 I232 M235N32-L36 WeakPolarHBondContact O-CG 3.36Å; N32-L36 PolarHBondContact O-N 3.49Å; F33-L36 HydrophobicContact CD1-CD1 3.85Å; F33-L36 HydrophobicContact CE1-CD1 3.96Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-I39 PolarHBondContact O-N 2.94Å; L36-C40 WeakPolarHBondContact O-CB 3.33Å; L36-C40 PolarHBondContact O-N 2.63Å; L36-C40 PolarHBondContact O-SG 2.98Å; L36-I232 HydrophobicContact CD2-CB 4.44Å; L36-I232 HydrophobicContact CD2-CG1 3.84Å; L36-M235 HydrophobicContact CB-SD 3.99Å; L36-M235 HydrophobicContact CD1-CB 4.43Å; L36-M235 HydrophobicContact CD2-CB 3.97Å; L36-M235 HydrophobicContact CD2-CG 4.47Å; L36-M235 HydrophobicContact CD2-SD 3.92Å; L36-M235 HydrophobicContact CG-SD 4.38Å
37L98.9Very high98.7Very high25 Ų2537.1 Ų37.113%0.13121%0.212CC..Hα-helixtrans-63.4-39.6174-73.7171.6000112.2F33 G34 S35 C40 L41 F90 C93 L94 H97F33-L37 WeakPolarHBondContact O-CB 3.46Å; F33-L37 WeakPolarHBondContact O-CD1 3.36Å; F33-L37 WeakPolarHBondContact O-CG 3.4Å; F33-L37 PolarHBondContact O-N 2.75Å; F33-L37 VanDerWaalsContact O-N 3.13Å; G34-L37 PolarHBondContact O-N 2.88Å; S35-L37 VanDerWaalsContact C-N 3.32Å; S35-L37 PolarHBondContact O-N 3.46Å; L37-C40 PolarHBondContact O-N 2.91Å; L37-L41 PolarHBondContact O-N 2.9Å; L37-F90 HydrophobicContact CB-CE1 4.16Å; L37-F90 HydrophobicContact CD2-CD1 3.48Å; L37-F90 VanDerWaalsContact CD2-CD1 3.48Å; L37-F90 HydrophobicContact CD2-CE1 3.49Å; L37-F90 VanDerWaalsContact CD2-CE1 3.49Å; L37-F90 HydrophobicContact CG-CE1 4.44Å; L37-F90 WeakPolarHBondContact O-CE1 3.42Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 4.09Å; L37-L94 HydrophobicContact CD1-CD2 3.92Å; L37-L94 HydrophobicContact CD2-CB 4.25Å; L37-L94 HydrophobicContact CD2-CD2 3.66Å; L37-L94 HydrophobicContact CD2-CG 3.53Å; L37-L94 HydrophobicContact CG-CD2 4.46Å; L37-H97 HydrophobicContact CD1-CB 3.79Å
38G98.7Very high98.7Very high35 Ų3537.1 Ų37.136%0.36122%0.216SC..Hα-helixtrans-60.4-44.6173.200000112.3G34 S35 L36 L41 M42G34-G38 PolarHBondContact O-N 3.3Å; S35-G38 PolarHBondContact O-N 2.68Å; S35-G38 VanDerWaalsContact O-N 3.12Å; L36-G38 VanDerWaalsContact C-N 3.34Å; G38-L41 PolarHBondContact O-N 3.36Å; G38-M42 WeakPolarHBondContact O-CG 3.36Å; G38-M42 PolarHBondContact O-N 2.96Å
39I98.8Very high98.7Very high41 Ų4139 Ų3921%0.2122%0.224CC..Hα-helixtrans-65.9-42.4175.6-63.3-57.2000111.7S35 L36 L41 M42 V43 I232 M235 F236S35-I39 PolarHBondContact O-N 3.04Å; L36-I39 PolarHBondContact O-N 2.94Å; I39-L41 VanDerWaalsContact C-N 3.32Å; I39-L41 PolarHBondContact O-N 2.85Å; I39-M42 HydrophobicContact CD1-SD 4.38Å; I39-M42 PolarHBondContact O-N 3.01Å; I39-V43 HydrophobicContact CG2-CG2 4.31Å; I39-V43 WeakPolarHBondContact O-CG2 3.29Å; I39-V43 PolarHBondContact O-N 3.17Å; I39-I232 HydrophobicContact CD1-CD1 4.16Å; I39-I232 HydrophobicContact CG1-CD1 3.74Å; I39-I232 HydrophobicContact CG1-CG1 3.94Å; I39-M235 HydrophobicContact CB-CE 4.41Å; I39-M235 HydrophobicContact CG2-CE 3.76Å; I39-F236 HydrophobicContact CG2-CE2 3.64Å; I39-F236 HydrophobicContact CG2-CZ 4.02Å
40C98.9Very high98.7Very high5 Ų540.3 Ų40.33%0.03422%0.22CC..Hα-helixtrans-56.9-47.2174.6-70.60000110.8L36 L37 M42 V43 Q44 F90 M235L36-C40 WeakPolarHBondContact O-CB 3.33Å; L36-C40 PolarHBondContact O-N 2.63Å; L36-C40 PolarHBondContact O-SG 2.98Å; L37-C40 PolarHBondContact O-N 2.91Å; C40-M42 VanDerWaalsContact C-N 3.34Å; C40-M42 PolarHBondContact O-N 2.89Å; C40-V43 PolarHBondContact O-N 3.01Å; C40-Q44 WeakPolarHBondContact O-CG 3.34Å; C40-Q44 PolarHBondContact O-N 2.79Å; C40-F90 HydrophobicContact CB-CB 3.97Å; C40-F90 HydrophobicContact CB-CD1 3.31Å; C40-F90 HydrophobicContact CB-CE1 3.88Å; C40-F90 HydrophobicContact CB-CG 3.76Å; C40-M235 VanDerWaalsContact SG-SD 3.62Å
41L98.9Very high98.7Very high16 Ų1637.1 Ų37.18%0.08421%0.209CC..Hα-helixtrans-58.9-44.3177.1-178.662.3000112L37 G38 I39 Q44 I45 F90 P186 I189 A190L37-L41 PolarHBondContact O-N 2.9Å; G38-L41 PolarHBondContact O-N 3.36Å; I39-L41 VanDerWaalsContact C-N 3.32Å; I39-L41 PolarHBondContact O-N 2.85Å; L41-Q44 PolarHBondContact O-N 2.9Å; L41-I45 HydrophobicContact CD1-CD1 3.97Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.9Å; L41-I45 WeakPolarHBondContact O-CG1 3.39Å; L41-I45 PolarHBondContact O-N 2.97Å; L41-F90 HydrophobicContact CB-CZ 4.16Å; L41-F90 HydrophobicContact CD1-CZ 4.46Å; L41-P186 HydrophobicContact CD1-CB 4.49Å; L41-I189 HydrophobicContact CD1-CB 4.36Å; L41-I189 HydrophobicContact CD1-CG2 3.89Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L41-A190 HydrophobicContact CD2-CB 4.01Å
42M98.8Very high98.7Very high109 Ų10937.1 Ų37.154%0.53721%0.214SC..Hα-helixtrans-62.1-45.1176.1-70.6179.969.900112.1G38 I39 C40 Q44 I45 I46G38-M42 WeakPolarHBondContact O-CG 3.36Å; G38-M42 PolarHBondContact O-N 2.96Å; I39-M42 HydrophobicContact CD1-SD 4.38Å; I39-M42 PolarHBondContact O-N 3.01Å; C40-M42 VanDerWaalsContact C-N 3.34Å; C40-M42 PolarHBondContact O-N 2.89Å; M42-Q44 VanDerWaalsContact C-N 3.33Å; M42-Q44 PolarHBondContact O-N 3.1Å; M42-I45 PolarHBondContact O-N 3.5Å; M42-I46 WeakPolarHBondContact O-CB 3.42Å; M42-I46 VanDerWaalsContact O-CG1 3.26Å; M42-I46 WeakPolarHBondContact O-CG1 3.45Å; M42-I46 PolarHBondContact O-N 3.11Å
43V98.8Very high98.8Very high23 Ų2342.4 Ų42.414%0.13924%0.24CC..Hα-helixtrans-58.4-46.7175.9169.70000110.3I39 C40 I46 T47 F236I39-V43 HydrophobicContact CG2-CG2 4.31Å; I39-V43 WeakPolarHBondContact O-CG2 3.29Å; I39-V43 PolarHBondContact O-N 3.17Å; C40-V43 PolarHBondContact O-N 3.01Å; V43-I46 PolarHBondContact O-N 3.35Å; V43-T47 HydrophobicContact CG1-CG2 4.29Å; V43-T47 WeakPolarHBondContact O-CB 3.46Å; V43-T47 WeakPolarHBondContact O-CG2 3.4Å; V43-T47 PolarHBondContact O-N 3.2Å; V43-T47 PolarHBondContact O-OG1 3.07Å; V43-F236 HydrophobicContact CG2-CE1 4.12Å; V43-F236 HydrophobicContact CG2-CZ 3.72Å
44Q98.9Very high98.7Very high23 Ų2344.8 Ų44.811%0.10725%0.251CS..Hα-helixtrans-64.1-43.5179.6-66.9-49.110300112.5C40 L41 M42 T47 G48 H83 G86 F90C40-Q44 WeakPolarHBondContact O-CG 3.34Å; C40-Q44 PolarHBondContact O-N 2.79Å; L41-Q44 PolarHBondContact O-N 2.9Å; M42-Q44 VanDerWaalsContact C-N 3.33Å; M42-Q44 PolarHBondContact O-N 3.1Å; Q44-T47 PolarHBondContact O-OG1 2.93Å; Q44-G48 WeakPolarHBondContact O-CA 3.38Å; Q44-G48 PolarHBondContact O-N 3.12Å; Q44-H83 PolarHBondContact NE2-O 3.38Å; Q44-H83 PolarHBondContact O-CE1 2.74Å; Q44-H83 VanDerWaalsContact O-CE1 3.25Å; Q44-H83 PolarHBondContact O-ND1 3.23Å; Q44-H83 PolarHBondContact OE1-O 3.2Å; Q44-G86 VanDerWaalsContact OE1-C 3.23Å; Q44-G86 VanDerWaalsContact OE1-CA 3.31Å; Q44-F90 HydrophobicContact CG-CD2 4.48Å
45I98.9Very high98.8Very high42 Ų4244.5 Ų44.522%0.21524%0.24CC..Hα-helixtrans-64.2-47.3178.5-69.8169.5000110.7L41 M42 L49 P186 F187L41-I45 HydrophobicContact CD1-CD1 3.97Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.9Å; L41-I45 WeakPolarHBondContact O-CG1 3.39Å; L41-I45 PolarHBondContact O-N 2.97Å; M42-I45 PolarHBondContact O-N 3.5Å; I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.46Å; I45-L49 PolarHBondContact O-N 2.88Å; I45-P186 HydrophobicContact CD1-CB 4.26Å; I45-P186 HydrophobicContact CG1-CB 3.74Å; I45-F187 HydrophobicContact CG2-CE1 4.11Å; I45-F187 HydrophobicContact CG2-CZ 4.27Å
46I98.9Very high98.8Very high91 Ų9145.8 Ų45.847%0.46725%0.247SC..Hα-helixtrans-65.1-55.7-178.2-66.5166.6000109.8M42 V43 G48 L49 F50M42-I46 WeakPolarHBondContact O-CB 3.42Å; M42-I46 VanDerWaalsContact O-CG1 3.26Å; M42-I46 WeakPolarHBondContact O-CG1 3.45Å; M42-I46 PolarHBondContact O-N 3.11Å; V43-I46 PolarHBondContact O-N 3.35Å; I46-G48 VanDerWaalsContact C-N 3.32Å; I46-G48 PolarHBondContact O-N 2.9Å; I46-L49 PolarHBondContact O-N 2.88Å; I46-F50 HydrophobicContact CG2-CD2 4.24Å; I46-F50 HydrophobicContact CG2-CE2 4.27Å; I46-F50 WeakPolarHBondContact O-CD2 3.43Å; I46-F50 PolarHBondContact O-N 3.36Å
47T98.9Very high98.8Very high8 Ų846.7 Ų46.75%0.04925%0.254CS..Hα-helixtrans-61.7-40.9-179.454.50000111.8V43 Q44 L49 F50 L51 I79 M82 H83V43-T47 HydrophobicContact CG1-CG2 4.29Å; V43-T47 WeakPolarHBondContact O-CB 3.46Å; V43-T47 WeakPolarHBondContact O-CG2 3.4Å; V43-T47 PolarHBondContact O-N 3.2Å; V43-T47 PolarHBondContact O-OG1 3.07Å; Q44-T47 PolarHBondContact O-OG1 2.93Å; T47-L49 PolarHBondContact O-N 3.43Å; T47-F50 PolarHBondContact O-N 3.26Å; T47-L51 VanDerWaalsContact O-CG 3.27Å; T47-L51 WeakPolarHBondContact O-CG 3.34Å; T47-L51 PolarHBondContact O-N 3.38Å; T47-I79 HydrophobicContact CG2-CG2 4.21Å; T47-M82 HydrophobicContact CG2-CB 4.16Å; T47-M82 HydrophobicContact CG2-CE 3.89Å; T47-H83 PolarHBondContact OG1-ND1 3.09Å
48G98.9Very high98.7Very high17 Ų1747.5 Ų47.518%0.17526%0.258CS..Hα-helixtrans-62.8-40.617800000112.9Q44 I46 L51 A52 H83Q44-G48 WeakPolarHBondContact O-CA 3.38Å; Q44-G48 PolarHBondContact O-N 3.12Å; I46-G48 VanDerWaalsContact C-N 3.32Å; I46-G48 PolarHBondContact O-N 2.9Å; G48-L51 PolarHBondContact O-N 3.48Å; G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.28Å; G48-A52 PolarHBondContact O-N 3.3Å; G48-H83 VanDerWaalsContact CA-CE1 3.41Å; G48-H83 WeakPolarHBondContact CA-CE1 3.22Å; G48-H83 PolarHBondContact N-ND1 2.93Å
49L98.8Very high98.7Very high76 Ų7647.3 Ų47.340%0.39825%0.251SS..Hα-helixtrans-62.2-45.2175.417963.7000111.7I45 I46 T47 A52 M53 F183I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.46Å; I45-L49 PolarHBondContact O-N 2.88Å; I46-L49 PolarHBondContact O-N 2.88Å; T47-L49 PolarHBondContact O-N 3.43Å; L49-A52 PolarHBondContact O-N 3.37Å; L49-M53 HydrophobicContact CD1-CE 4.46Å; L49-M53 HydrophobicContact CG-CE 4.08Å; L49-M53 WeakPolarHBondContact O-CG 3.21Å; L49-M53 PolarHBondContact O-N 2.8Å; L49-F183 HydrophobicContact CD1-CE2 4.24Å; L49-F183 HydrophobicContact CD1-CZ 4.09Å
50F98.8Very high98.7Very high104 Ų10452.8 Ų52.846%0.45628%0.277SS..Hα-helixtrans-66.2-36.6177.2-85-94.4000112.4I46 T47 M53 H54 I79I46-F50 HydrophobicContact CG2-CD2 4.24Å; I46-F50 HydrophobicContact CG2-CE2 4.27Å; I46-F50 WeakPolarHBondContact O-CD2 3.43Å; I46-F50 PolarHBondContact O-N 3.36Å; T47-F50 PolarHBondContact O-N 3.26Å; F50-M53 HydrophobicContact CD1-SD 4.49Å; F50-M53 PolarHBondContact O-N 3.45Å; F50-H54 PolarHBondContact O-CD2 2.95Å; F50-I79 HydrophobicContact CB-CD1 4.25Å; F50-I79 HydrophobicContact CB-CG2 4.24Å
51L98.9Very high98.6Very high23 Ų2355.2 Ų55.212%0.1229%0.292CS..Hα-helixtrans-65-42.2172.8-67.8170.8000111.7T47 G48 M53 H54 Y55 I69 I79 R80 H83T47-L51 VanDerWaalsContact O-CG 3.27Å; T47-L51 WeakPolarHBondContact O-CG 3.34Å; T47-L51 PolarHBondContact O-N 3.38Å; G48-L51 PolarHBondContact O-N 3.48Å; L51-M53 PolarHBondContact O-N 2.82Å; L51-H54 PolarHBondContact O-N 3.21Å; L51-Y55 WeakPolarHBondContact O-CB 3.4Å; L51-Y55 PolarHBondContact O-N 3.33Å; L51-I69 HydrophobicContact CD2-CD1 4.2Å; L51-I69 HydrophobicContact CD2-CG2 3.57Å; L51-I79 HydrophobicContact CD1-CG2 4.48Å; L51-I79 HydrophobicContact CD2-CB 4.45Å; L51-I79 HydrophobicContact CD2-CG2 3.95Å; L51-I79 HydrophobicContact CG-CG2 3.85Å; L51-R80 HydrophobicContact CD2-CB 4.03Å; L51-H83 HydrophobicContact CD1-CB 3.48Å; L51-H83 VanDerWaalsContact CD1-CB 3.48Å
52A98.8Very high98.6Very high24 Ų2454.5 Ų54.520%0.19829%0.288CS..Hα-helixtrans-62.1-27.7-179.400000113.3G48 L49 H54 F179 F183G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.28Å; G48-A52 PolarHBondContact O-N 3.3Å; L49-A52 PolarHBondContact O-N 3.37Å; A52-H54 PolarHBondContact O-N 3.03Å; A52-F179 HydrophobicContact CB-CE2 4.28Å; A52-F179 HydrophobicContact CB-CZ 4.1Å; A52-F183 HydrophobicContact CB-CD2 4.31Å; A52-F183 HydrophobicContact CB-CE2 4.03Å
53M98.8Very high98.6Very high121 Ų12151.3 Ų51.360%0.59627%0.271SS*.THydrogen-bonded Turntrans-64-18.4174.6-67.1174-176.300113.6L49 F50 L51L49-M53 HydrophobicContact CD1-CE 4.46Å; L49-M53 HydrophobicContact CG-CE 4.08Å; L49-M53 WeakPolarHBondContact O-CG 3.21Å; L49-M53 PolarHBondContact O-N 2.8Å; F50-M53 HydrophobicContact CD1-SD 4.49Å; F50-M53 PolarHBondContact O-N 3.45Å; L51-M53 PolarHBondContact O-N 2.82Å
54H98.7Very high98.6Very high80 Ų8053 Ų5337%0.3728%0.284SS..THydrogen-bonded Turntrans-122.9-6-175.2-61.7-67.6000113.7F50 L51 A52 I69 V73F50-H54 PolarHBondContact O-CD2 2.95Å; L51-H54 PolarHBondContact O-N 3.21Å; A52-H54 PolarHBondContact O-N 3.03Å; H54-I69 HydrophobicContact CB-CD1 3.91Å; H54-I69 HydrophobicContact CB-CG1 3.54Å; H54-V73 HydrophobicContact CB-CG2 4.33Å
55Y98.8Very high98.6Very high27 Ų2752.3 Ų52.311%0.10628%0.282CS..  trans-89.7147.5-179173.5-105000111.9L51 A62 S65 V66 L133 F179L51-Y55 WeakPolarHBondContact O-CB 3.4Å; L51-Y55 PolarHBondContact O-N 3.33Å; Y55-A62 HydrophobicContact CE2-CB 4.03Å; Y55-S65 VanDerWaalsContact CD2-OG 3.28Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.47Å; Y55-V66 HydrophobicContact CD2-CG2 3.87Å; Y55-V66 HydrophobicContact CE2-CG2 4.06Å; Y55-L133 HydrophobicContact CE2-CB 4.47Å; Y55-L133 WeakPolarHBondContact CE2-O 3.37Å; Y55-L133 PolarHBondContact OH-O 3.37Å; Y55-F179 AromaticContact CD1-CD2 3.69Å; Y55-F179 HydrophobicContact CD1-CD2 3.69Å; Y55-F179 AromaticContact CD1-CE2 3.6Å; Y55-F179 HydrophobicContact CD1-CE2 3.6Å; Y55-F179 HydrophobicContact CD1-CG 4.37Å; Y55-F179 HydrophobicContact CD1-CZ 4.22Å; Y55-F179 HydrophobicContact CE1-CB 4.37Å; Y55-F179 AromaticContact CE1-CD2 3.56Å; Y55-F179 HydrophobicContact CE1-CD2 3.56Å; Y55-F179 AromaticContact CE1-CE2 4Å; Y55-F179 HydrophobicContact CE1-CE2 4Å; Y55-F179 AromaticContact CE1-CG 3.98Å; Y55-F179 HydrophobicContact CE1-CG 3.98Å
56T98.6Very high98.6Very high59 Ų5951.4 Ų51.436%0.36228%0.278SS..  trans-123.2128.8173.859.80000111.1D58 T61 A62 S65T56-D58 VanDerWaalsContact C-N 3.31Å; T56-D58 PolarHBondContact O-N 2.86Å; T56-T61 WeakPolarHBondContact OG1-CB 3.29Å; T56-T61 PolarHBondContact OG1-O 2.98Å; T56-T61 PolarHBondContact OG1-OG1 2.79Å; T56-A62 VanDerWaalsContact O-CA 3.3Å; T56-A62 WeakPolarHBondContact O-CA 3.43Å; T56-S65 PolarHBondContact N-OG 3.33Å; T56-S65 WeakPolarHBondContact OG1-CB 3.38Å; T56-S65 PolarHBondContact OG1-OG 3.36Å
57S98.1Very high98.6Very high31 Ų3149.6 Ų49.622%0.21727%0.271CS..  trans-93.145.4-176.9580000113.8T176S57-T176 PolarHBondContact O-OG1 2.91Å
58D98.3Very high98.6Very high42 Ų4253 Ų5323%0.22529%0.287CS..SBendtrans-115.4137.9172.8-174.5-78.2000109.7T56 M60 T61 A62 K172T56-D58 VanDerWaalsContact C-N 3.31Å; T56-D58 PolarHBondContact O-N 2.86Å; D58-M60 PolarHBondContact O-N 3.34Å; D58-M60 VanDerWaalsContact O-N 3.16Å; D58-M60 WeakPolarHBondContact OD1-CB 3.37Å; D58-M60 PolarHBondContact OD1-N 3.44Å; D58-T61 PolarHBondContact O-N 2.85Å; D58-A62 VanDerWaalsContact O-CB 3.26Å; D58-A62 WeakPolarHBondContact O-CB 3.29Å; D58-A62 PolarHBondContact O-N 3.37Å; D58-K172 WeakPolarHBondContact OD2-CE 3.44Å; D58-K172 IonicContact OD2-NZ 3.44Å; D58-K172 PolarHBondContact OD2-NZ 3.5Å
59T97.7Very high98.6Very high32 Ų3252.4 Ų52.420%0.19628%0.279CS..THydrogen-bonded Turntrans-63.5-24-173.348.20000113.5W135 K172 L175T59-W135 HydrophobicContact CG2-CD2 4.46Å; T59-W135 HydrophobicContact CG2-CH2 4.02Å; T59-W135 HydrophobicContact CG2-CZ2 3.37Å; T59-K172 HydrophobicContact CG2-CB 4.04Å; T59-L175 HydrophobicContact CG2-CB 4.39Å; T59-L175 HydrophobicContact CG2-CD2 3.92Å
60M98.1Very high98.6Very high156 Ų15650.2 Ų50.277%0.76827%0.27SS*.THydrogen-bonded Turntrans-78.9-24.7177-60.1-58-62.700112.7D58D58-M60 PolarHBondContact O-N 3.34Å; D58-M60 VanDerWaalsContact O-N 3.16Å; D58-M60 WeakPolarHBondContact OD1-CB 3.37Å; D58-M60 PolarHBondContact OD1-N 3.44Å
61T98.6Very high98.6Very high56 Ų5655.2 Ų55.234%0.34429%0.286SS..THydrogen-bonded Turntrans-123.1-7.7-17262.70000114.7T56 D58 S64 S65T56-T61 WeakPolarHBondContact OG1-CB 3.29Å; T56-T61 PolarHBondContact OG1-O 2.98Å; T56-T61 PolarHBondContact OG1-OG1 2.79Å; D58-T61 PolarHBondContact O-N 2.85Å; T61-S64 WeakPolarHBondContact CA-OG 3.28Å; T61-S64 PolarHBondContact O-N 2.89Å; T61-S64 PolarHBondContact O-OG 2.92Å; T61-S64 VanDerWaalsContact O-OG 3.08Å; T61-S65 WeakPolarHBondContact O-CB 3.45Å; T61-S65 PolarHBondContact O-N 3.34Å; T61-S65 PolarHBondContact O-OG 3.14Å
62A98.6Very high98.6Very high0 Ų059.4 Ų59.40%031%0.308CS..Hα-helixtrans-60-55.3-17700000112.3Y55 T56 D58 S64 S65 V66 W135 L175Y55-A62 HydrophobicContact CE2-CB 4.03Å; T56-A62 VanDerWaalsContact O-CA 3.3Å; T56-A62 WeakPolarHBondContact O-CA 3.43Å; D58-A62 VanDerWaalsContact O-CB 3.26Å; D58-A62 WeakPolarHBondContact O-CB 3.29Å; D58-A62 PolarHBondContact O-N 3.37Å; A62-S64 PolarHBondContact O-N 3.1Å; A62-S65 PolarHBondContact O-N 3.49Å; A62-S65 PolarHBondContact O-OG 3.07Å; A62-V66 PolarHBondContact O-N 3.37Å; A62-V66 VanDerWaalsContact O-N 3.14Å; A62-W135 HydrophobicContact CB-CB 3.82Å; A62-W135 HydrophobicContact CB-CG 4.37Å; A62-L175 HydrophobicContact CB-CD2 3.65Å
63F98.8Very high98.6Very high43 Ų4359.7 Ų59.719%0.18931%0.307CS..Hα-helixtrans-58.2-47.9178-173.4-85.9000111.7S65 V66 T67 P134 Y256 P258F63-S65 PolarHBondContact O-N 3.27Å; F63-V66 PolarHBondContact O-N 3.43Å; F63-T67 HydrophobicContact CD1-CG2 4.07Å; F63-T67 HydrophobicContact CE1-CG2 3.72Å; F63-T67 HydrophobicContact CZ-CG2 4.35Å; F63-T67 WeakPolarHBondContact O-CG2 3.29Å; F63-T67 PolarHBondContact O-N 3.47Å; F63-T67 VanDerWaalsContact O-N 3.09Å; F63-P134 VanDerWaalsContact CA-O 3.31Å; F63-P134 WeakPolarHBondContact CA-O 3.28Å; F63-P134 WeakPolarHBondContact CD2-O 3.47Å; F63-Y256 VanDerWaalsContact CZ-O 3.3Å; F63-Y256 WeakPolarHBondContact CZ-O 3.45Å; F63-P258 HydrophobicContact CD1-CB 4.33Å; F63-P258 HydrophobicContact CD1-CG 3.82Å; F63-P258 HydrophobicContact CD2-CB 4.37Å; F63-P258 HydrophobicContact CD2-CG 4.44Å; F63-P258 HydrophobicContact CE1-CG 3.78Å; F63-P258 HydrophobicContact CE2-CG 4.4Å; F63-P258 HydrophobicContact CG-CB 4.2Å; F63-P258 HydrophobicContact CG-CG 4.17Å; F63-P258 HydrophobicContact CZ-CG 4.09Å
64S98.7Very high98.6Very high57 Ų5760.8 Ų60.840%0.39932%0.316SS..Hα-helixtrans-66.7-35.1-179.7580000112.6T61 A62 V66 T67 H68T61-S64 WeakPolarHBondContact CA-OG 3.28Å; T61-S64 PolarHBondContact O-N 2.89Å; T61-S64 PolarHBondContact O-OG 2.92Å; T61-S64 VanDerWaalsContact O-OG 3.08Å; A62-S64 PolarHBondContact O-N 3.1Å; S64-V66 PolarHBondContact O-N 2.83Å; S64-T67 WeakPolarHBondContact CA-OG1 3.25Å; S64-T67 PolarHBondContact O-N 2.98Å; S64-T67 VanDerWaalsContact O-N 3.17Å; S64-T67 PolarHBondContact O-OG1 3.37Å; S64-H68 WeakPolarHBondContact O-CB 3.28Å; S64-H68 PolarHBondContact O-N 3.24Å
65S98.8Very high98.6Very high9 Ų965 Ų656%0.06333%0.33CS..Hα-helixtrans-64.2-37.8175.672.30000112.4Y55 T56 T61 A62 F63 H68 I69Y55-S65 VanDerWaalsContact CD2-OG 3.28Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.47Å; T56-S65 PolarHBondContact N-OG 3.33Å; T56-S65 WeakPolarHBondContact OG1-CB 3.38Å; T56-S65 PolarHBondContact OG1-OG 3.36Å; T61-S65 WeakPolarHBondContact O-CB 3.45Å; T61-S65 PolarHBondContact O-N 3.34Å; T61-S65 PolarHBondContact O-OG 3.14Å; A62-S65 PolarHBondContact O-N 3.49Å; A62-S65 PolarHBondContact O-OG 3.07Å; F63-S65 PolarHBondContact O-N 3.27Å; S65-H68 WeakPolarHBondContact O-CB 3.48Å; S65-H68 PolarHBondContact O-N 3.08Å; S65-I69 WeakPolarHBondContact O-CG1 3.3Å; S65-I69 PolarHBondContact O-N 3.22Å
66V98.8Very high98.6Very high23 Ų2363.8 Ų63.814%0.13933%0.325CS..Hα-helixtrans-66.4-40172.5176.30000111.1Y55 A62 F63 S64 I69 C70Y55-V66 HydrophobicContact CD2-CG2 3.87Å; Y55-V66 HydrophobicContact CE2-CG2 4.06Å; A62-V66 PolarHBondContact O-N 3.37Å; A62-V66 VanDerWaalsContact O-N 3.14Å; F63-V66 PolarHBondContact O-N 3.43Å; S64-V66 PolarHBondContact O-N 2.83Å; V66-I69 WeakPolarHBondContact O-CB 3.38Å; V66-I69 PolarHBondContact O-N 3.45Å; V66-C70 PolarHBondContact O-N 3.09Å
67T98.6Very high98.6Very high53 Ų5366 Ų6633%0.32533%0.327SS..Hα-helixtrans-66.1-37.9175.565.60000112.4F63 S64 C70 R71F63-T67 HydrophobicContact CD1-CG2 4.07Å; F63-T67 HydrophobicContact CE1-CG2 3.72Å; F63-T67 HydrophobicContact CZ-CG2 4.35Å; F63-T67 WeakPolarHBondContact O-CG2 3.29Å; F63-T67 PolarHBondContact O-N 3.47Å; F63-T67 VanDerWaalsContact O-N 3.09Å; S64-T67 WeakPolarHBondContact CA-OG1 3.25Å; S64-T67 PolarHBondContact O-N 2.98Å; S64-T67 VanDerWaalsContact O-N 3.17Å; S64-T67 PolarHBondContact O-OG1 3.37Å; T67-C70 PolarHBondContact O-N 3.46Å; T67-R71 WeakPolarHBondContact O-CB 3.33Å; T67-R71 WeakPolarHBondContact O-CG 3.44Å; T67-R71 PolarHBondContact O-N 3.21Å
68H98.8Very high98.6Very high80 Ų8066.3 Ų66.337%0.3733%0.326SS..Hα-helixtrans-62.1-42.8174163.7-89.5000111.2S64 S65 C70 R71 D72 V73S64-H68 WeakPolarHBondContact O-CB 3.28Å; S64-H68 PolarHBondContact O-N 3.24Å; S65-H68 WeakPolarHBondContact O-CB 3.48Å; S65-H68 PolarHBondContact O-N 3.08Å; H68-C70 VanDerWaalsContact C-N 3.28Å; H68-C70 PolarHBondContact O-N 2.84Å; H68-R71 PolarHBondContact O-N 2.84Å; H68-D72 IonicContact CD2-OD2 3.23Å; H68-D72 PolarHBondContact CD2-OD2 3.48Å; H68-D72 VanDerWaalsContact CD2-OD2 3.23Å; H68-D72 IonicContact CG-OD2 3.2Å; H68-D72 PolarHBondContact O-N 2.91Å; H68-V73 PolarHBondContact O-N 3.07Å
69I98.9Very high98.7Very high5 Ų566 Ų663%0.02632%0.324CS..Hα-helixtrans-54.6-47.1172.4-72.1166.9000110.8L51 H54 S65 V66 R71 G76 R80L51-I69 HydrophobicContact CD2-CD1 4.2Å; L51-I69 HydrophobicContact CD2-CG2 3.57Å; H54-I69 HydrophobicContact CB-CD1 3.91Å; H54-I69 HydrophobicContact CB-CG1 3.54Å; S65-I69 WeakPolarHBondContact O-CG1 3.3Å; S65-I69 PolarHBondContact O-N 3.22Å; V66-I69 WeakPolarHBondContact O-CB 3.38Å; V66-I69 PolarHBondContact O-N 3.45Å; I69-R71 VanDerWaalsContact C-N 3.35Å; I69-R71 PolarHBondContact O-N 3.42Å; I69-G76 CarbonylContact O-C 3.57Å; I69-G76 VanDerWaalsContact O-CA 3.22Å; I69-G76 WeakPolarHBondContact O-CA 3.34Å; I69-R80 HydrophobicContact CG2-CB 4.41Å
70C98.8Very high98.7Very high30 Ų3066.6 Ų66.620%0.20332%0.323CS..Hα-helixtrans-70.9-29.3-177.7-65.80000113.7V66 T67 H68 W77V66-C70 PolarHBondContact O-N 3.09Å; T67-C70 PolarHBondContact O-N 3.46Å; H68-C70 VanDerWaalsContact C-N 3.28Å; H68-C70 PolarHBondContact O-N 2.84Å; C70-W77 HydrophobicContact CB-CB 4.4Å; C70-W77 WeakPolarHBondContact O-CB 3.35Å
71R98.7Very high98.7Very high209 Ų20960.9 Ų60.979%0.78929%0.293SS*.Hα-helixtrans-102.5-36.3-169.4-68.1-178.7175.4-152.1-0.9114.2T67 H68 I69T67-R71 WeakPolarHBondContact O-CB 3.33Å; T67-R71 WeakPolarHBondContact O-CG 3.44Å; T67-R71 PolarHBondContact O-N 3.21Å; H68-R71 PolarHBondContact O-N 2.84Å; I69-R71 VanDerWaalsContact C-N 3.35Å; I69-R71 PolarHBondContact O-N 3.42Å
72D98.7Very high98.8Very high111 Ų11160 Ų6059%0.59429%0.285SS*.THydrogen-bonded Turntrans-116.6-25.9-166.1-53.6-45.1000112.7H68H68-D72 IonicContact CD2-OD2 3.23Å; H68-D72 PolarHBondContact CD2-OD2 3.48Å; H68-D72 VanDerWaalsContact CD2-OD2 3.23Å; H68-D72 IonicContact CG-OD2 3.2Å; H68-D72 PolarHBondContact O-N 2.91Å
73V98.8Very high98.8Very high29 Ų2961.6 Ų61.618%0.17629%0.293CS..SBendtrans-80.8129.3176.6-179.50000110H54 H68 Y75 G76H54-V73 HydrophobicContact CB-CG2 4.33Å; H68-V73 PolarHBondContact O-N 3.07Å; V73-Y75 PolarHBondContact O-N 3.37Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; V73-G76 PolarHBondContact O-N 2.81Å
74N98.7Very high98.8Very high145 Ų14561.6 Ų61.678%0.77530%0.301SS*.THydrogen-bonded Turntrans-54.2120.4176.7-69.6-40.7000111.2G76N74-G76 PolarHBondContact O-N 2.92Å; N74-G76 VanDerWaalsContact O-N 3.08Å
75Y98.7Very high98.8Very high169 Ų16959.1 Ų59.166%0.66328%0.283SS*.THydrogen-bonded Turntrans56.614.4-173.9-56.5-80000115.1V73 W77 L78 I79V73-Y75 PolarHBondContact O-N 3.37Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; Y75-W77 VanDerWaalsContact C-N 3.29Å; Y75-W77 PolarHBondContact O-N 3.37Å; Y75-L78 WeakPolarHBondContact O-CB 3.38Å; Y75-L78 PolarHBondContact O-N 3.34Å; Y75-I79 WeakPolarHBondContact O-CG1 3.33Å; Y75-I79 PolarHBondContact O-N 3.13Å
76G98.8Very high98.8Very high1 Ų158.9 Ų58.91%0.0128%0.281CS..Hα-helixtrans-64.6-32.9-178.800000112.7I69 V73 N74 L78 I79 R80I69-G76 CarbonylContact O-C 3.57Å; I69-G76 VanDerWaalsContact O-CA 3.22Å; I69-G76 WeakPolarHBondContact O-CA 3.34Å; V73-G76 PolarHBondContact O-N 2.81Å; N74-G76 PolarHBondContact O-N 2.92Å; N74-G76 VanDerWaalsContact O-N 3.08Å; G76-L78 VanDerWaalsContact C-N 3.35Å; G76-L78 PolarHBondContact O-N 2.94Å; G76-I79 PolarHBondContact O-N 2.9Å; G76-R80 VanDerWaalsContact O-CB 3.31Å; G76-R80 WeakPolarHBondContact O-CB 3.44Å; G76-R80 PolarHBondContact O-N 3.41Å
77W98.8Very high98.8Very high106 Ų10658.7 Ų58.740%0.40228%0.282SS..Hα-helixtrans-57.9-46.4169.767.9-90.6000111.8C70 Y75 R80 Y81 L244C70-W77 HydrophobicContact CB-CB 4.4Å; C70-W77 WeakPolarHBondContact O-CB 3.35Å; Y75-W77 VanDerWaalsContact C-N 3.29Å; Y75-W77 PolarHBondContact O-N 3.37Å; W77-R80 PolarHBondContact O-N 3.46Å; W77-Y81 HydrophobicContact CB-CD2 4.39Å; W77-Y81 HydrophobicContact CB-CE2 4.33Å; W77-Y81 HydrophobicContact CE3-CD2 4.08Å; W77-Y81 WeakPolarHBondContact O-CD2 3.43Å; W77-Y81 PolarHBondContact O-N 3.1Å; W77-L244 HydrophobicContact CH2-CD2 4Å; W77-L244 HydrophobicContact CZ3-CD2 4.22Å
78L98.8Very high98.8Very high37 Ų3756.4 Ų56.419%0.19427%0.268CS..Hα-helixtrans-63.4-46.8-178.8177.964.3000110.2Y75 G76 R80 Y81 M82 M240 V243 L244Y75-L78 WeakPolarHBondContact O-CB 3.38Å; Y75-L78 PolarHBondContact O-N 3.34Å; G76-L78 VanDerWaalsContact C-N 3.35Å; G76-L78 PolarHBondContact O-N 2.94Å; L78-R80 PolarHBondContact O-N 3.28Å; L78-Y81 PolarHBondContact O-N 3.47Å; L78-M82 HydrophobicContact CD1-CG 4.25Å; L78-M82 HydrophobicContact CD1-SD 4.48Å; L78-M82 HydrophobicContact CG-CE 4.26Å; L78-M82 HydrophobicContact CG-CG 4.48Å; L78-M82 HydrophobicContact CG-SD 4.37Å; L78-M82 WeakPolarHBondContact O-CB 3.46Å; L78-M82 VanDerWaalsContact O-CG 3.26Å; L78-M82 WeakPolarHBondContact O-CG 3.45Å; L78-M82 PolarHBondContact O-N 3.06Å; L78-M240 HydrophobicContact CD1-CE 4.22Å; L78-V243 HydrophobicContact CD1-CG1 3.54Å; L78-L244 HydrophobicContact CD1-CD2 4.07Å
79I98.9Very high98.8Very high35 Ų3553 Ų5318%0.17925%0.253CS..Hα-helixtrans-61.4-44.3177.4-59.9171.8000110.6T47 F50 L51 Y75 G76 M82 H83T47-I79 HydrophobicContact CG2-CG2 4.21Å; F50-I79 HydrophobicContact CB-CD1 4.25Å; F50-I79 HydrophobicContact CB-CG2 4.24Å; L51-I79 HydrophobicContact CD1-CG2 4.48Å; L51-I79 HydrophobicContact CD2-CB 4.45Å; L51-I79 HydrophobicContact CD2-CG2 3.95Å; L51-I79 HydrophobicContact CG-CG2 3.85Å; Y75-I79 WeakPolarHBondContact O-CG1 3.33Å; Y75-I79 PolarHBondContact O-N 3.13Å; G76-I79 PolarHBondContact O-N 2.9Å; I79-M82 HydrophobicContact CG1-CE 4.37Å; I79-M82 PolarHBondContact O-N 3.36Å; I79-H83 WeakPolarHBondContact O-CB 3.3Å; I79-H83 PolarHBondContact O-N 2.92Å
80R98.8Very high98.8Very high45 Ų4553.6 Ų53.617%0.1726%0.255CS..Hα-helixtrans-60.8-48.4178.3-175.7-88.1-176.4167.71.8111.6L51 I69 G76 W77 L78 H83 A84 Y256L51-R80 HydrophobicContact CD2-CB 4.03Å; I69-R80 HydrophobicContact CG2-CB 4.41Å; G76-R80 VanDerWaalsContact O-CB 3.31Å; G76-R80 WeakPolarHBondContact O-CB 3.44Å; G76-R80 PolarHBondContact O-N 3.41Å; W77-R80 PolarHBondContact O-N 3.46Å; L78-R80 PolarHBondContact O-N 3.28Å; R80-H83 PolarHBondContact O-N 2.85Å; R80-A84 WeakPolarHBondContact O-CB 3.47Å; R80-A84 PolarHBondContact O-N 3.49Å; R80-Y256 PolarHBondContact NH1-OH 3.11Å
81Y98.8Very high98.8Very high35 Ų3552.2 Ų52.214%0.13725%0.246CC..Hα-helixtrans-72.3-33.3-179-71.6-63.3000112.8W77 L78 H83 N85 P247 Y256W77-Y81 HydrophobicContact CB-CD2 4.39Å; W77-Y81 HydrophobicContact CB-CE2 4.33Å; W77-Y81 HydrophobicContact CE3-CD2 4.08Å; W77-Y81 WeakPolarHBondContact O-CD2 3.43Å; W77-Y81 PolarHBondContact O-N 3.1Å; L78-Y81 PolarHBondContact O-N 3.47Å; Y81-H83 VanDerWaalsContact C-N 3.34Å; Y81-N85 VanDerWaalsContact O-CB 3.32Å; Y81-N85 WeakPolarHBondContact O-CB 3.3Å; Y81-N85 PolarHBondContact O-N 3.43Å; Y81-N85 PolarHBondContact O-ND2 3.29Å; Y81-N85 VanDerWaalsContact O-ND2 3.14Å; Y81-P247 HydrophobicContact CD1-CB 3.45Å; Y81-P247 VanDerWaalsContact CD1-CB 3.45Å; Y81-P247 HydrophobicContact CD2-CB 4.21Å; Y81-P247 HydrophobicContact CE1-CB 3.6Å; Y81-P247 HydrophobicContact CE1-CG 4.4Å; Y81-P247 HydrophobicContact CE2-CB 4.38Å; Y81-P247 HydrophobicContact CG-CB 3.78Å; Y81-Y256 PolarHBondContact OH-OH 2.98Å
82M98.9Very high98.8Very high39 Ų3945.1 Ų45.119%0.19222%0.223CC..Hα-helixtrans-61.9-41.6169.2-75.8-168.6-51.100111.4T47 L78 I79 G86 M240 V243T47-M82 HydrophobicContact CG2-CB 4.16Å; T47-M82 HydrophobicContact CG2-CE 3.89Å; L78-M82 HydrophobicContact CD1-CG 4.25Å; L78-M82 HydrophobicContact CD1-SD 4.48Å; L78-M82 HydrophobicContact CG-CE 4.26Å; L78-M82 HydrophobicContact CG-CG 4.48Å; L78-M82 HydrophobicContact CG-SD 4.37Å; L78-M82 WeakPolarHBondContact O-CB 3.46Å; L78-M82 VanDerWaalsContact O-CG 3.26Å; L78-M82 WeakPolarHBondContact O-CG 3.45Å; L78-M82 PolarHBondContact O-N 3.06Å; I79-M82 HydrophobicContact CG1-CE 4.37Å; I79-M82 PolarHBondContact O-N 3.36Å; M82-G86 WeakPolarHBondContact O-CA 3.33Å; M82-G86 PolarHBondContact O-N 2.85Å; M82-M240 HydrophobicContact SD-SD 4.38Å; M82-V243 HydrophobicContact CG-CG1 4.04Å; M82-V243 HydrophobicContact CG-CG2 4.08Å
83H98.9Very high98.8Very high33 Ų3340 Ų4015%0.15320%0.196CC..Hα-helixtrans-67.5-43178.2-165.880.2000112.3Q44 T47 G48 L51 I79 R80 Y81 A87 H182Q44-H83 PolarHBondContact NE2-O 3.38Å; Q44-H83 PolarHBondContact O-CE1 2.74Å; Q44-H83 VanDerWaalsContact O-CE1 3.25Å; Q44-H83 PolarHBondContact O-ND1 3.23Å; Q44-H83 PolarHBondContact OE1-O 3.2Å; T47-H83 PolarHBondContact OG1-ND1 3.09Å; G48-H83 VanDerWaalsContact CA-CE1 3.41Å; G48-H83 WeakPolarHBondContact CA-CE1 3.22Å; G48-H83 PolarHBondContact N-ND1 2.93Å; L51-H83 HydrophobicContact CD1-CB 3.48Å; L51-H83 VanDerWaalsContact CD1-CB 3.48Å; I79-H83 WeakPolarHBondContact O-CB 3.3Å; I79-H83 PolarHBondContact O-N 2.92Å; R80-H83 PolarHBondContact O-N 2.85Å; Y81-H83 VanDerWaalsContact C-N 3.34Å; H83-A87 PolarHBondContact O-N 3.41Å; H83-A87 VanDerWaalsContact O-N 3.16Å; H83-H182 AromaticContact NE2-NE2 3.97Å
84A98.8Very high98.8Very high43 Ų4339.2 Ų39.236%0.35519%0.191SC..Hα-helixtrans-68.8-52.4179.600000112.2R80 G86 A87R80-A84 WeakPolarHBondContact O-CB 3.47Å; R80-A84 PolarHBondContact O-N 3.49Å; A84-G86 VanDerWaalsContact C-N 3.31Å; A84-G86 PolarHBondContact O-N 2.89Å; A84-A87 WeakPolarHBondContact O-CB 3.12Å; A84-A87 PolarHBondContact O-N 3.39Å
85N98.9Very high98.8Very high5 Ų535.5 Ų35.53%0.02717%0.168CC..Hα-helixtrans-72.7-26.5178.1-72.6-76.5000112.4Y81 A87 S88 M89 L239 L242 V243 P247Y81-N85 VanDerWaalsContact O-CB 3.32Å; Y81-N85 WeakPolarHBondContact O-CB 3.3Å; Y81-N85 PolarHBondContact O-N 3.43Å; Y81-N85 PolarHBondContact O-ND2 3.29Å; Y81-N85 VanDerWaalsContact O-ND2 3.14Å; N85-A87 VanDerWaalsContact C-N 3.32Å; N85-S88 WeakPolarHBondContact O-CB 3.26Å; N85-S88 PolarHBondContact O-N 2.89Å; N85-M89 PolarHBondContact O-N 2.84Å; N85-L239 HydrophobicContact CB-CD1 3.9Å; N85-L242 HydrophobicContact CB-CB 4.31Å; N85-V243 HydrophobicContact CB-CG2 4.04Å; N85-P247 PolarHBondContact ND2-O 3.01Å
86G98.9Very high98.8Very high3 Ų330.5 Ų30.53%0.03115%0.152CC..Hα-helixtrans-64-35.5172.300000112.3Q44 M82 A84 M89 F90Q44-G86 VanDerWaalsContact OE1-C 3.23Å; Q44-G86 VanDerWaalsContact OE1-CA 3.31Å; M82-G86 WeakPolarHBondContact O-CA 3.33Å; M82-G86 PolarHBondContact O-N 2.85Å; A84-G86 VanDerWaalsContact C-N 3.31Å; A84-G86 PolarHBondContact O-N 2.89Å; G86-M89 PolarHBondContact O-N 3.44Å; G86-F90 WeakPolarHBondContact O-CB 3.3Å; G86-F90 PolarHBondContact O-N 3.33Å
87A98.8Very high98.8Very high19 Ų1932.1 Ų32.116%0.15716%0.159CC..Hα-helixtrans-61.7-44.7171.100000111.6H83 A84 N85 F90 F91H83-A87 PolarHBondContact O-N 3.41Å; H83-A87 VanDerWaalsContact O-N 3.16Å; A84-A87 WeakPolarHBondContact O-CB 3.12Å; A84-A87 PolarHBondContact O-N 3.39Å; N85-A87 VanDerWaalsContact C-N 3.32Å; A87-F90 WeakPolarHBondContact O-CB 3.35Å; A87-F90 PolarHBondContact O-N 3.37Å; A87-F91 WeakPolarHBondContact O-CD2 3.2Å; A87-F91 PolarHBondContact O-N 3.25Å; A87-F91 VanDerWaalsContact O-N 3.12Å
88S98.8Very high98.9Very high5 Ų528.5 Ų28.54%0.03515%0.149CC..Hα-helixtrans-61.3-45173.7-72.10000112.2N85 F90 F91 I92 W272N85-S88 WeakPolarHBondContact O-CB 3.26Å; N85-S88 PolarHBondContact O-N 2.89Å; S88-F90 PolarHBondContact O-N 2.9Å; S88-F91 PolarHBondContact O-N 3.34Å; S88-I92 WeakPolarHBondContact O-CG1 3.28Å; S88-I92 PolarHBondContact O-N 3.22Å; S88-W272 PolarHBondContact OG-NE1 3.21Å
89M98.8Very high98.9Very high9 Ų927.2 Ų27.24%0.04414%0.144CC..Hα-helixtrans-60.5-35.5175.8-168.457.965.900111.8N85 G86 I92 C93 M235 L238 L239 L242N85-M89 PolarHBondContact O-N 2.84Å; G86-M89 PolarHBondContact O-N 3.44Å; M89-I92 PolarHBondContact O-N 3.28Å; M89-C93 WeakPolarHBondContact O-CB 3.47Å; M89-C93 PolarHBondContact O-N 3.47Å; M89-C93 PolarHBondContact O-SG 3.16Å; M89-M235 HydrophobicContact CG-CG 3.7Å; M89-M235 HydrophobicContact CG-SD 4.09Å; M89-M235 HydrophobicContact SD-CG 3.85Å; M89-L238 HydrophobicContact CE-CB 3.81Å; M89-L239 HydrophobicContact CB-CD1 4.42Å; M89-L239 HydrophobicContact CE-CB 4.34Å; M89-L242 HydrophobicContact CE-CD1 4.44Å
90F98.8Very high98.9Very high17 Ų1726.6 Ų26.68%0.07514%0.14CC..Hα-helixtrans-63.1-44.5176.5-161.520.6000111.4L37 C40 L41 Q44 G86 A87 S88 C93 L94 V123L37-F90 HydrophobicContact CB-CE1 4.16Å; L37-F90 HydrophobicContact CD2-CD1 3.48Å; L37-F90 VanDerWaalsContact CD2-CD1 3.48Å; L37-F90 HydrophobicContact CD2-CE1 3.49Å; L37-F90 VanDerWaalsContact CD2-CE1 3.49Å; L37-F90 HydrophobicContact CG-CE1 4.44Å; L37-F90 WeakPolarHBondContact O-CE1 3.42Å; C40-F90 HydrophobicContact CB-CB 3.97Å; C40-F90 HydrophobicContact CB-CD1 3.31Å; C40-F90 HydrophobicContact CB-CE1 3.88Å; C40-F90 HydrophobicContact CB-CG 3.76Å; L41-F90 HydrophobicContact CB-CZ 4.16Å; L41-F90 HydrophobicContact CD1-CZ 4.46Å; Q44-F90 HydrophobicContact CG-CD2 4.48Å; G86-F90 WeakPolarHBondContact O-CB 3.3Å; G86-F90 PolarHBondContact O-N 3.33Å; A87-F90 WeakPolarHBondContact O-CB 3.35Å; A87-F90 PolarHBondContact O-N 3.37Å; S88-F90 PolarHBondContact O-N 2.9Å; F90-C93 PolarHBondContact O-N 3.5Å; F90-L94 WeakPolarHBondContact O-CB 3.47Å; F90-L94 WeakPolarHBondContact O-CG 3.47Å; F90-L94 PolarHBondContact O-N 3.34Å; F90-V123 HydrophobicContact CD2-CG1 3.73Å; F90-V123 HydrophobicContact CE2-CB 4.37Å; F90-V123 HydrophobicContact CE2-CG1 3.65Å; F90-V123 HydrophobicContact CE2-CG2 3.71Å; F90-V123 HydrophobicContact CZ-CG1 4.39Å; F90-V123 HydrophobicContact CZ-CG2 3.83Å
91F98.9Very high98.9Very high1 Ų124.6 Ų24.60%0.00413%0.133CC..Hα-helixtrans-68.6-38.1175.5-82.9-79.5000113.7A87 S88 C93 L94 F95 V123 M124 A127 W272 Y273 F274A87-F91 WeakPolarHBondContact O-CD2 3.2Å; A87-F91 PolarHBondContact O-N 3.25Å; A87-F91 VanDerWaalsContact O-N 3.12Å; S88-F91 PolarHBondContact O-N 3.34Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 3.27Å; F91-L94 HydrophobicContact CD1-CD1 4.21Å; F91-L94 HydrophobicContact CE1-CD1 4.35Å; F91-L94 PolarHBondContact O-N 3.45Å; F91-F95 HydrophobicContact CB-CD2 4.5Å; F91-F95 HydrophobicContact CB-CE2 4.04Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.27Å; F91-F95 HydrophobicContact CD1-CE2 4.25Å; F91-F95 AromaticContact CD1-CZ 3.79Å; F91-F95 HydrophobicContact CD1-CZ 3.79Å; F91-F95 WeakPolarHBondContact O-CD2 3.47Å; F91-F95 VanDerWaalsContact O-CG 3.29Å; F91-F95 WeakPolarHBondContact O-CG 3.33Å; F91-F95 PolarHBondContact O-N 3.13Å; F91-V123 HydrophobicContact CE1-CG1 4.47Å; F91-V123 HydrophobicContact CE2-CG1 4.2Å; F91-V123 HydrophobicContact CZ-CG1 3.95Å; F91-M124 HydrophobicContact CE1-CG 3.81Å; F91-M124 HydrophobicContact CZ-CG 4.13Å; F91-A127 HydrophobicContact CE2-CB 3.5Å; F91-A127 HydrophobicContact CZ-CB 3.86Å; F91-W272 HydrophobicContact CB-CH2 4.1Å; F91-W272 HydrophobicContact CB-CZ2 4.11Å; F91-Y273 HydrophobicContact CB-CD1 4.22Å; F91-Y273 HydrophobicContact CB-CG 3.99Å; F91-Y273 AromaticContact CD1-CD2 3.98Å; F91-Y273 HydrophobicContact CD1-CD2 3.98Å; F91-Y273 AromaticContact CD1-CG 3.96Å; F91-Y273 HydrophobicContact CD1-CG 3.96Å; F91-Y273 AromaticContact CD2-CD1 3.67Å; F91-Y273 HydrophobicContact CD2-CD1 3.67Å; F91-Y273 AromaticContact CD2-CD2 3.5Å; F91-Y273 HydrophobicContact CD2-CD2 3.5Å; F91-Y273 AromaticContact CD2-CE1 3.99Å; F91-Y273 HydrophobicContact CD2-CE1 3.99Å; F91-Y273 AromaticContact CD2-CE2 3.77Å; F91-Y273 HydrophobicContact CD2-CE2 3.77Å; F91-Y273 AromaticContact CD2-CG 3.44Å; F91-Y273 HydrophobicContact CD2-CG 3.44Å; F91-Y273 VanDerWaalsContact CD2-CG 3.44Å; F91-Y273 AromaticContact CE1-CD2 3.85Å; F91-Y273 HydrophobicContact CE1-CD2 3.85Å; F91-Y273 HydrophobicContact CE1-CG 4.32Å; F91-Y273 HydrophobicContact CE2-CD1 4.27Å; F91-Y273 AromaticContact CE2-CD2 3.37Å; F91-Y273 HydrophobicContact CE2-CD2 3.37Å; F91-Y273 HydrophobicContact CE2-CE1 4.32Å; F91-Y273 AromaticContact CE2-CE2 3.35Å; F91-Y273 HydrophobicContact CE2-CE2 3.35Å; F91-Y273 AromaticContact CE2-CG 3.85Å; F91-Y273 HydrophobicContact CE2-CG 3.85Å; F91-Y273 AromaticContact CE2-CZ 3.89Å; F91-Y273 VanDerWaalsContact CG-CB 3.49Å; F91-Y273 HydrophobicContact CG-CD1 4.01Å; F91-Y273 AromaticContact CG-CD2 3.81Å; F91-Y273 HydrophobicContact CG-CD2 3.81Å; F91-Y273 AromaticContact CG-CG 3.5Å; F91-Y273 HydrophobicContact CG-CG 3.5Å; F91-Y273 AromaticContact CZ-CD2 3.55Å; F91-Y273 HydrophobicContact CZ-CD2 3.55Å; F91-Y273 AromaticContact CZ-CE2 3.78Å; F91-Y273 HydrophobicContact CZ-CE2 3.78Å; F91-Y273 HydrophobicContact CZ-CG 4.27Å; F91-F274 HydrophobicContact CZ-CZ 4.48Å
92I98.9Very high98.9Very high60 Ų6024.3 Ų24.331%0.30813%0.134SC..Hα-helixtrans-56.9-50.3172.1-67.4168.4000109.3S88 M89 L94 F95 L96 W272S88-I92 WeakPolarHBondContact O-CG1 3.28Å; S88-I92 PolarHBondContact O-N 3.22Å; M89-I92 PolarHBondContact O-N 3.28Å; I92-L94 VanDerWaalsContact C-N 3.32Å; I92-L94 PolarHBondContact O-N 3.47Å; I92-F95 PolarHBondContact O-N 3.5Å; I92-L96 HydrophobicContact CG2-CD1 3.93Å; I92-L96 VanDerWaalsContact O-CG 3.27Å; I92-L96 WeakPolarHBondContact O-CG 3.39Å; I92-L96 PolarHBondContact O-N 2.95Å; I92-L96 VanDerWaalsContact O-N 3.1Å; I92-W272 HydrophobicContact CD1-CZ2 4.35Å; I92-W272 HydrophobicContact CG1-CH2 3.59Å; I92-W272 HydrophobicContact CG1-CZ2 3.75Å
93C98.9Very high98.9Very high3 Ų324 Ų242%0.0213%0.131CC..Hα-helixtrans-61.9-39.3177.6-68.60000112.2F33 L37 M89 F90 F91 H97F33-C93 HydrophobicContact CD1-CB 4.05Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 4.09Å; M89-C93 WeakPolarHBondContact O-CB 3.47Å; M89-C93 PolarHBondContact O-N 3.47Å; M89-C93 PolarHBondContact O-SG 3.16Å; F90-C93 PolarHBondContact O-N 3.5Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 3.27Å; C93-H97 WeakPolarHBondContact O-CB 3.26Å; C93-H97 PolarHBondContact O-N 3.36Å
94L98.8Very high98.8Very high14 Ų1423.6 Ų23.67%0.07313%0.128CC..Hα-helixtrans-63.5-49.8178.7-83.4172.7000111.3L37 F90 F91 I92 L96 H97 V98 L120 V123L37-L94 HydrophobicContact CD1-CD2 3.92Å; L37-L94 HydrophobicContact CD2-CB 4.25Å; L37-L94 HydrophobicContact CD2-CD2 3.66Å; L37-L94 HydrophobicContact CD2-CG 3.53Å; L37-L94 HydrophobicContact CG-CD2 4.46Å; F90-L94 WeakPolarHBondContact O-CB 3.47Å; F90-L94 WeakPolarHBondContact O-CG 3.47Å; F90-L94 PolarHBondContact O-N 3.34Å; F91-L94 HydrophobicContact CD1-CD1 4.21Å; F91-L94 HydrophobicContact CE1-CD1 4.35Å; F91-L94 PolarHBondContact O-N 3.45Å; I92-L94 VanDerWaalsContact C-N 3.32Å; I92-L94 PolarHBondContact O-N 3.47Å; L94-L96 VanDerWaalsContact C-N 3.32Å; L94-L96 PolarHBondContact O-N 3.06Å; L94-H97 WeakPolarHBondContact O-CB 3.38Å; L94-H97 PolarHBondContact O-N 3.32Å; L94-V98 WeakPolarHBondContact O-CG2 3.34Å; L94-V98 PolarHBondContact O-N 2.93Å; L94-L120 HydrophobicContact CD1-CD1 4.27Å; L94-V123 HydrophobicContact CD1-CB 3.98Å; L94-V123 HydrophobicContact CD1-CG1 3.64Å; L94-V123 HydrophobicContact CD1-CG2 4.29Å
95F98.9Very high98.8Very high66 Ų6621.6 Ų21.629%0.28911%0.111SC..Hα-helixtrans-63.8-39-178.9-62.6-37.2000111.9F91 I92 G99 W272 Y273 F276F91-F95 HydrophobicContact CB-CD2 4.5Å; F91-F95 HydrophobicContact CB-CE2 4.04Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.27Å; F91-F95 HydrophobicContact CD1-CE2 4.25Å; F91-F95 AromaticContact CD1-CZ 3.79Å; F91-F95 HydrophobicContact CD1-CZ 3.79Å; F91-F95 WeakPolarHBondContact O-CD2 3.47Å; F91-F95 VanDerWaalsContact O-CG 3.29Å; F91-F95 WeakPolarHBondContact O-CG 3.33Å; F91-F95 PolarHBondContact O-N 3.13Å; I92-F95 PolarHBondContact O-N 3.5Å; F95-G99 PolarHBondContact O-N 2.72Å; F95-W272 HydrophobicContact CD2-CH2 4.17Å; F95-W272 HydrophobicContact CD2-CZ3 4.12Å; F95-W272 AromaticContact CE2-CH2 3.98Å; F95-W272 HydrophobicContact CE2-CH2 3.98Å; F95-W272 AromaticContact CE2-CZ3 3.78Å; F95-W272 HydrophobicContact CE2-CZ3 3.78Å; F95-Y273 WeakPolarHBondContact CZ-O 3.49Å; F95-F276 HydrophobicContact CE1-CE1 4.35Å; F95-F276 HydrophobicContact CZ-CE1 4.27Å
96L98.9Very high98.8Very high64 Ų6422.2 Ų22.234%0.33512%0.116SC..Hα-helixtrans-69-36.8174.9-62.5175000111.9W30 F33 I92 L94 G99 R100W30-L96 HydrophobicContact CZ3-CD2 4.12Å; F33-L96 HydrophobicContact CD1-CB 4.04Å; F33-L96 HydrophobicContact CD1-CD1 4.41Å; F33-L96 HydrophobicContact CD2-CB 3.92Å; F33-L96 HydrophobicContact CE1-CB 3.88Å; F33-L96 HydrophobicContact CE1-CD1 3.48Å; F33-L96 VanDerWaalsContact CE1-CD1 3.48Å; F33-L96 HydrophobicContact CE1-CG 4.31Å; F33-L96 HydrophobicContact CE2-CB 3.77Å; F33-L96 HydrophobicContact CE2-CD1 4.08Å; F33-L96 HydrophobicContact CG-CB 4.08Å; F33-L96 HydrophobicContact CZ-CB 3.76Å; F33-L96 HydrophobicContact CZ-CD1 3.29Å; F33-L96 HydrophobicContact CZ-CG 4.13Å; I92-L96 HydrophobicContact CG2-CD1 3.93Å; I92-L96 VanDerWaalsContact O-CG 3.27Å; I92-L96 WeakPolarHBondContact O-CG 3.39Å; I92-L96 PolarHBondContact O-N 2.95Å; I92-L96 VanDerWaalsContact O-N 3.1Å; L94-L96 VanDerWaalsContact C-N 3.32Å; L94-L96 PolarHBondContact O-N 3.06Å; L96-G99 PolarHBondContact O-N 2.95Å; L96-R100 WeakPolarHBondContact O-CB 3.42Å; L96-R100 PolarHBondContact O-N 3.15Å
97H98.9Very high98.8Very high36 Ų3622.7 Ų22.717%0.16712%0.117CC..Hα-helixtrans-64.4-44.6174.9-168.6101.9000112.4F33 G34 L37 C93 L94 R100 G101F33-H97 HydrophobicContact CB-CB 3.9Å; G34-H97 PolarHBondContact N-ND1 2.63Å; L37-H97 HydrophobicContact CD1-CB 3.79Å; C93-H97 WeakPolarHBondContact O-CB 3.26Å; C93-H97 PolarHBondContact O-N 3.36Å; L94-H97 WeakPolarHBondContact O-CB 3.38Å; L94-H97 PolarHBondContact O-N 3.32Å; H97-R100 PolarHBondContact CE1-NH2 3.11Å; H97-R100 PolarHBondContact ND1-NH2 3.27Å; H97-R100 PolarHBondContact NE2-NH2 2.79Å; H97-G101 PolarHBondContact O-N 2.94Å; H97-G101 VanDerWaalsContact O-N 3.08Å
98V98.9Very high98.8Very high29 Ų2924.2 Ų24.218%0.17613%0.125CC..Hα-helixtrans-65.6-46.6175.4172.60000110.3L94 R100 G101 L102 W113 L301L94-V98 WeakPolarHBondContact O-CG2 3.34Å; L94-V98 PolarHBondContact O-N 2.93Å; V98-R100 VanDerWaalsContact C-N 3.34Å; V98-R100 PolarHBondContact O-N 3.45Å; V98-G101 CarbonylContact O-C 3.25Å; V98-G101 WeakPolarHBondContact O-CA 3.36Å; V98-G101 PolarHBondContact O-N 2.87Å; V98-L102 HydrophobicContact CG1-CD1 4.25Å; V98-L102 HydrophobicContact CG1-CG 4.44Å; V98-L102 WeakPolarHBondContact O-CG 3.36Å; V98-L102 PolarHBondContact O-N 3.06Å; V98-W113 HydrophobicContact CG1-CH2 4.19Å; V98-L301 HydrophobicContact CG1-CD1 4.09Å; V98-L301 HydrophobicContact CG1-CD2 4.06Å
99G98.8Very high98.7Very high10 Ų1025.7 Ų25.710%0.10313%0.13CC..Hα-helixtrans-57-44.9176.900000112.4F95 L96 G101 L102 Y103 Y325F95-G99 PolarHBondContact O-N 2.72Å; L96-G99 PolarHBondContact O-N 2.95Å; G99-G101 VanDerWaalsContact C-N 3.3Å; G99-G101 PolarHBondContact O-N 2.98Å; G99-L102 PolarHBondContact O-N 2.9Å; G99-Y103 WeakPolarHBondContact O-CB 3.28Å; G99-Y103 PolarHBondContact O-N 3.49Å; G99-Y325 WeakPolarHBondContact CA-OH 3.41Å; G99-Y325 PolarHBondContact O-OH 3.48Å
100R98.9Very high98.7Very high23 Ų2329 Ų299%0.08715%0.146CC..Hα-helixtrans-54.5-47.5169.6177.5-77.4-67.1-97-6.8111W30 W31 L96 H97 V98 L102 Y103 Y104W30-R100 HydrophobicContact CB-CB 4.04Å; W30-R100 HydrophobicContact CB-CG 3.5Å; W30-R100 HydrophobicContact CG-CG 4.49Å; W31-R100 VanDerWaalsContact CE2-NH1 3.28Å; W31-R100 HydrophobicContact CE3-CG 4.36Å; W31-R100 HydrophobicContact CZ3-CG 4.28Å; L96-R100 WeakPolarHBondContact O-CB 3.42Å; L96-R100 PolarHBondContact O-N 3.15Å; H97-R100 PolarHBondContact CE1-NH2 3.11Å; H97-R100 PolarHBondContact ND1-NH2 3.27Å; H97-R100 PolarHBondContact NE2-NH2 2.79Å; V98-R100 VanDerWaalsContact C-N 3.34Å; V98-R100 PolarHBondContact O-N 3.45Å; R100-L102 VanDerWaalsContact C-N 3.32Å; R100-L102 PolarHBondContact O-N 3.25Å; R100-Y103 PolarHBondContact O-N 2.97Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.13Å; R100-Y104 VanDerWaalsContact O-CD2 3.32Å; R100-Y104 WeakPolarHBondContact O-CD2 3.47Å; R100-Y104 PolarHBondContact O-N 2.87Å
101G98.8Very high98.7Very high3 Ų333.2 Ų33.23%0.03117%0.167CC..Hα-helixtrans-61.8-39.1-17900000113.2H97 V98 G99 G105 S106 Y107H97-G101 PolarHBondContact O-N 2.94Å; H97-G101 VanDerWaalsContact O-N 3.08Å; V98-G101 CarbonylContact O-C 3.25Å; V98-G101 WeakPolarHBondContact O-CA 3.36Å; V98-G101 PolarHBondContact O-N 2.87Å; G99-G101 VanDerWaalsContact C-N 3.3Å; G99-G101 PolarHBondContact O-N 2.98Å; G101-G105 PolarHBondContact O-N 3.45Å; G101-S106 PolarHBondContact O-N 2.93Å; G101-Y107 WeakPolarHBondContact O-CD1 3.33Å
102L98.8Very high98.7Very high28 Ų2833.9 Ų33.915%0.14717%0.17CC..Hα-helixtrans-66.5-48.6173.3-65.2174.2000111.7V98 G99 R100 Y104 G105 Y107 W113 L301 M304 Y325V98-L102 HydrophobicContact CG1-CD1 4.25Å; V98-L102 HydrophobicContact CG1-CG 4.44Å; V98-L102 WeakPolarHBondContact O-CG 3.36Å; V98-L102 PolarHBondContact O-N 3.06Å; G99-L102 PolarHBondContact O-N 2.9Å; R100-L102 VanDerWaalsContact C-N 3.32Å; R100-L102 PolarHBondContact O-N 3.25Å; L102-Y104 PolarHBondContact O-N 3.33Å; L102-G105 PolarHBondContact O-N 3.44Å; L102-Y107 HydrophobicContact CD2-CD1 4.23Å; L102-W113 HydrophobicContact CD2-CH2 3.79Å; L102-W113 HydrophobicContact CD2-CZ2 3.98Å; L102-W113 HydrophobicContact CG-CH2 4.07Å; L102-L301 HydrophobicContact CD1-CD2 4.31Å; L102-L301 HydrophobicContact CD2-CD2 4.2Å; L102-M304 HydrophobicContact CD2-CE 3.7Å; L102-M304 HydrophobicContact CD2-CG 3.7Å; L102-M304 HydrophobicContact CD2-SD 3.86Å; L102-Y325 HydrophobicContact CB-CD2 4.49Å; L102-Y325 HydrophobicContact CB-CE2 4.1Å
103Y98.9Very high98.7Very high34 Ų3432.1 Ų32.113%0.13316%0.16CC..Hα-helixtrans-67.3-38.1-175.1-168.8-88.6000113.5G99 R100 L315 Q322 Y325G99-Y103 WeakPolarHBondContact O-CB 3.28Å; G99-Y103 PolarHBondContact O-N 3.49Å; R100-Y103 PolarHBondContact O-N 2.97Å; Y103-L315 HydrophobicContact CD1-CB 4.4Å; Y103-L315 HydrophobicContact CD2-CB 4.27Å; Y103-L315 HydrophobicContact CD2-CD1 4.03Å; Y103-L315 HydrophobicContact CE1-CB 4.3Å; Y103-L315 HydrophobicContact CE2-CB 4.19Å; Y103-L315 HydrophobicContact CE2-CD1 4.44Å; Y103-L315 HydrophobicContact CG-CB 4.4Å; Y103-L315 HydrophobicContact CG-CD1 4.48Å; Y103-L315 VanDerWaalsContact O-CB 3.23Å; Y103-L315 WeakPolarHBondContact O-CB 2.88Å; Y103-L315 WeakPolarHBondContact O-CG 3.41Å; Y103-L315 PolarHBondContact O-N 3Å; Y103-Q322 HydrophobicContact CE2-CG 4.07Å; Y103-Q322 VanDerWaalsContact OH-CD 3.24Å; Y103-Q322 WeakPolarHBondContact OH-CG 2.96Å; Y103-Q322 PolarHBondContact OH-OE1 2.57Å; Y103-Y325 AromaticContact CD2-CD1 3.45Å; Y103-Y325 HydrophobicContact CD2-CD1 3.45Å; Y103-Y325 VanDerWaalsContact CD2-CD1 3.45Å; Y103-Y325 HydrophobicContact CD2-CD2 4.13Å; Y103-Y325 AromaticContact CD2-CE1 3.58Å; Y103-Y325 HydrophobicContact CD2-CE1 3.58Å; Y103-Y325 HydrophobicContact CD2-CE2 4.24Å; Y103-Y325 AromaticContact CD2-CG 3.74Å; Y103-Y325 HydrophobicContact CD2-CG 3.74Å; Y103-Y325 AromaticContact CD2-CZ 3.98Å; Y103-Y325 AromaticContact CE2-CD1 3.94Å; Y103-Y325 HydrophobicContact CE2-CD1 3.94Å; Y103-Y325 HydrophobicContact CE2-CE1 4.29Å; Y103-Y325 HydrophobicContact CE2-CG 4.41Å; Y103-Y325 HydrophobicContact CG-CE1 4.42Å
104Y98.8Very high98.7Very high24 Ų2434.8 Ų34.89%0.09417%0.174CC..THydrogen-bonded Turntrans-97.66.3-178-64.1-70.3000113.4W30 W31 R100 L102 S106 N206 P208 S314W30-Y104 HydrophobicContact CB-CE2 4.25Å; W30-Y104 AromaticContact CD1-CE2 3.73Å; W30-Y104 AromaticContact CD1-CZ 3.98Å; W30-Y104 VanDerWaalsContact CD1-OH 3.31Å; W30-Y104 HydrophobicContact CG-CE2 4.16Å; W31-Y104 HydrophobicContact CH2-CD1 4.1Å; W31-Y104 AromaticContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CE2 4.06Å; W31-Y104 AromaticContact CH2-CG 3.6Å; W31-Y104 HydrophobicContact CH2-CG 3.6Å; W31-Y104 AromaticContact CZ3-CD2 3.65Å; W31-Y104 HydrophobicContact CZ3-CD2 3.65Å; W31-Y104 AromaticContact CZ3-CE2 3.66Å; W31-Y104 HydrophobicContact CZ3-CE2 3.66Å; W31-Y104 HydrophobicContact CZ3-CG 4.08Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.13Å; R100-Y104 VanDerWaalsContact O-CD2 3.32Å; R100-Y104 WeakPolarHBondContact O-CD2 3.47Å; R100-Y104 PolarHBondContact O-N 2.87Å; L102-Y104 PolarHBondContact O-N 3.33Å; Y104-S106 VanDerWaalsContact C-N 3.26Å; Y104-S106 PolarHBondContact O-N 2.71Å; Y104-N206 PolarHBondContact O-ND2 3.4Å; Y104-P208 HydrophobicContact CD1-CB 4.24Å; Y104-P208 WeakPolarHBondContact CD1-O 3.46Å; Y104-P208 HydrophobicContact CE1-CB 3.7Å; Y104-P208 HydrophobicContact CE1-CG 4.45Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.33Å
105G98.6Very high98.7Very high0 Ų035.3 Ų35.30%018%0.177CC..THydrogen-bonded Turntrans6331.8-179.600000112.9G101 L102 Y107 T108 R313G101-G105 PolarHBondContact O-N 3.45Å; L102-G105 PolarHBondContact O-N 3.44Å; G105-Y107 PolarHBondContact O-N 3.24Å; G105-T108 WeakPolarHBondContact O-CG2 3.43Å; G105-T108 PolarHBondContact O-N 3.07Å; G105-T108 PolarHBondContact O-OG1 3.22Å; G105-R313 PolarHBondContact O-NE 2.94Å
106S98.6Very high98.7Very high18 Ų1833.3 Ų33.313%0.12617%0.174CC..G310 helixtrans-71.9-16.9178.4-57.80000112.3G101 Y104 T108 F109 N206G101-S106 PolarHBondContact O-N 2.93Å; Y104-S106 VanDerWaalsContact C-N 3.26Å; Y104-S106 PolarHBondContact O-N 2.71Å; S106-T108 PolarHBondContact O-N 3.26Å; S106-T108 VanDerWaalsContact O-N 3.11Å; S106-F109 PolarHBondContact O-N 3.08Å; S106-N206 PolarHBondContact OG-ND2 2.9Å
107Y98.6Very high98.7Very high14 Ų1430.7 Ų30.76%0.05516%0.161CC..G310 helixtrans-60.4-15.9173.654.8-106.6000113.7G101 L102 G105 F109 W113 M304 P305 H308G101-Y107 WeakPolarHBondContact O-CD1 3.33Å; L102-Y107 HydrophobicContact CD2-CD1 4.23Å; G105-Y107 PolarHBondContact O-N 3.24Å; Y107-F109 PolarHBondContact O-N 3.01Å; Y107-W113 VanDerWaalsContact CB-CE2 3.49Å; Y107-M304 HydrophobicContact CD1-CB 4.19Å; Y107-M304 HydrophobicContact CD1-CE 4.32Å; Y107-M304 HydrophobicContact CD2-CB 4.16Å; Y107-M304 HydrophobicContact CE1-CE 3.86Å; Y107-M304 HydrophobicContact CG-CB 3.93Å; Y107-P305 WeakPolarHBondContact O-CG 3.43Å; Y107-H308 HydrophobicContact CE2-CB 3.95Å; Y107-H308 AromaticContact CE2-ND1 3.53Å; Y107-H308 AromaticContact CZ-ND1 3.59Å; Y107-H308 PolarHBondContact OH-ND1 3.35Å
108T97.9Very high98.7Very high51 Ų5133.5 Ų33.531%0.31318%0.177SC..G310 helixtrans-66.4-17173.462.40000113.1G105 S106 M110 R313G105-T108 WeakPolarHBondContact O-CG2 3.43Å; G105-T108 PolarHBondContact O-N 3.07Å; G105-T108 PolarHBondContact O-OG1 3.22Å; S106-T108 PolarHBondContact O-N 3.26Å; S106-T108 VanDerWaalsContact O-N 3.11Å; T108-M110 VanDerWaalsContact C-N 3.27Å; T108-M110 PolarHBondContact O-N 3.49Å; T108-M110 VanDerWaalsContact O-N 3.1Å; T108-R313 PolarHBondContact OG1-NE 2.95Å; T108-R313 PolarHBondContact OG1-NH2 3.38Å
109F98.4Very high98.7Very high35 Ų3533.1 Ų33.115%0.15417%0.174CC..SBendtrans-79.480.3163.8-59-35.2000108.7S106 Y107 E111 T112 W113 T203 N206 R313S106-F109 PolarHBondContact O-N 3.08Å; Y107-F109 PolarHBondContact O-N 3.01Å; F109-E111 PolarHBondContact O-N 3.25Å; F109-T112 PolarHBondContact O-N 3.08Å; F109-W113 VanDerWaalsContact O-CB 3.28Å; F109-W113 WeakPolarHBondContact O-CB 3.19Å; F109-W113 PolarHBondContact O-N 2.91Å; F109-T203 HydrophobicContact CD1-CG2 4.06Å; F109-T203 HydrophobicContact CE1-CG2 4.11Å; F109-N206 HydrophobicContact CE2-CB 3.78Å; F109-N206 HydrophobicContact CZ-CB 4.25Å; F109-R313 VanDerWaalsContact CD2-NH2 3.31Å
110M98.4Very high98.7Very high78 Ų7833.1 Ų33.138%0.38417%0.171SC..Hα-helixtrans-59.5-42.7-163.4-65.2-168.6-177.300113.3T108 W113 N114 P305T108-M110 VanDerWaalsContact C-N 3.27Å; T108-M110 PolarHBondContact O-N 3.49Å; T108-M110 VanDerWaalsContact O-N 3.1Å; M110-W113 PolarHBondContact O-N 3.35Å; M110-N114 VanDerWaalsContact O-CB 3.29Å; M110-N114 WeakPolarHBondContact O-CB 3.22Å; M110-N114 VanDerWaalsContact O-CG 3.24Å; M110-N114 PolarHBondContact O-N 2.81Å; M110-N114 PolarHBondContact O-ND2 2.98Å; M110-P305 HydrophobicContact CE-CB 3.89Å; M110-P305 HydrophobicContact CG-CB 3.97Å; M110-P305 HydrophobicContact CG-CG 4.35Å; M110-P305 HydrophobicContact SD-CB 4.32Å
111E98.5Very high98.7Very high107 Ų10735 Ų3550%0.518%0.18SC..Hα-helixtrans-65.4-52.7-179.5-61.679.1-178.300110.3F109 W113 N114 I115 F199F109-E111 PolarHBondContact O-N 3.25Å; E111-W113 VanDerWaalsContact C-N 3.29Å; E111-W113 PolarHBondContact O-N 2.82Å; E111-N114 PolarHBondContact O-N 3.3Å; E111-I115 VanDerWaalsContact O-CG1 3.3Å; E111-I115 WeakPolarHBondContact O-CG1 3.35Å; E111-I115 PolarHBondContact O-N 3.33Å; E111-F199 HydrophobicContact CB-CB 4.08Å; E111-F199 HydrophobicContact CB-CD1 3.51Å; E111-F199 HydrophobicContact CB-CD2 3.96Å; E111-F199 HydrophobicContact CB-CE1 3.82Å; E111-F199 HydrophobicContact CB-CE2 4.22Å; E111-F199 HydrophobicContact CB-CG 3.59Å; E111-F199 HydrophobicContact CB-CZ 4.16Å; E111-F199 HydrophobicContact CG-CD1 3.96Å; E111-F199 HydrophobicContact CG-CE1 3.88Å; E111-F199 HydrophobicContact CG-CZ 4.35Å
112T98.8Very high98.7Very high14 Ų1435.5 Ų35.59%0.08618%0.184CC..Hα-helixtrans-55.2-46.2175.4-55.60000110.9F109 G116 H196 F199 L200F109-T112 PolarHBondContact O-N 3.08Å; T112-G116 PolarHBondContact O-N 3.16Å; T112-H196 VanDerWaalsContact CG2-CE1 3.42Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.33Å; T112-H196 PolarHBondContact O-CE1 2.83Å; T112-H196 PolarHBondContact O-ND1 3.11Å; T112-F199 VanDerWaalsContact OG1-C 3.27Å; T112-F199 WeakPolarHBondContact OG1-CB 3.43Å; T112-L200 HydrophobicContact CG2-CB 4.1Å; T112-L200 HydrophobicContact CG2-CD1 4.43Å; T112-L200 PolarHBondContact OG1-N 3.17Å
113W98.9Very high98.7Very high24 Ų2434.5 Ų34.59%0.09118%0.179CC..Hα-helixtrans-63.9-48.2180-178.5-103.7000112.9V98 L102 Y107 F109 M110 E111 I115 G116 V117 L301 M304V98-W113 HydrophobicContact CG1-CH2 4.19Å; L102-W113 HydrophobicContact CD2-CH2 3.79Å; L102-W113 HydrophobicContact CD2-CZ2 3.98Å; L102-W113 HydrophobicContact CG-CH2 4.07Å; Y107-W113 VanDerWaalsContact CB-CE2 3.49Å; F109-W113 VanDerWaalsContact O-CB 3.28Å; F109-W113 WeakPolarHBondContact O-CB 3.19Å; F109-W113 PolarHBondContact O-N 2.91Å; M110-W113 PolarHBondContact O-N 3.35Å; E111-W113 VanDerWaalsContact C-N 3.29Å; E111-W113 PolarHBondContact O-N 2.82Å; W113-I115 PolarHBondContact O-N 3.33Å; W113-G116 CarbonylContact O-C 3.47Å; W113-G116 VanDerWaalsContact O-CA 3.25Å; W113-G116 WeakPolarHBondContact O-CA 3.18Å; W113-G116 PolarHBondContact O-N 3.41Å; W113-V117 PolarHBondContact O-N 3.25Å; W113-L301 HydrophobicContact CH2-CD2 4.47Å; W113-L301 HydrophobicContact CZ2-CB 4.09Å; W113-L301 HydrophobicContact CZ2-CD2 4.06Å; W113-L301 PolarHBondContact NE1-O 3.42Å; W113-M304 HydrophobicContact CZ2-CB 4.31Å; W113-M304 HydrophobicContact CZ2-CG 4.15Å
114N98.7Very high98.7Very high58 Ų5833.7 Ų33.731%0.3118%0.177SC..Hα-helixtrans-67.6-37-179.1-72.6-35.7000111.9M110 E111 G116 V117 L118M110-N114 VanDerWaalsContact O-CB 3.29Å; M110-N114 WeakPolarHBondContact O-CB 3.22Å; M110-N114 VanDerWaalsContact O-CG 3.24Å; M110-N114 PolarHBondContact O-N 2.81Å; M110-N114 PolarHBondContact O-ND2 2.98Å; E111-N114 PolarHBondContact O-N 3.3Å; N114-G116 VanDerWaalsContact C-N 3.26Å; N114-G116 PolarHBondContact O-N 2.88Å; N114-V117 PolarHBondContact O-N 3.13Å; N114-L118 WeakPolarHBondContact O-CG 3.39Å; N114-L118 PolarHBondContact O-N 2.55Å
115I98.8Very high98.7Very high26 Ų2634.4 Ų34.413%0.13319%0.188CC..Hα-helixtrans-62.5-36.9168.2-62.4-66.9000110.5E111 W113 V117 L118 L119 V195 H196 F199E111-I115 VanDerWaalsContact O-CG1 3.3Å; E111-I115 WeakPolarHBondContact O-CG1 3.35Å; E111-I115 PolarHBondContact O-N 3.33Å; W113-I115 PolarHBondContact O-N 3.33Å; I115-V117 PolarHBondContact O-N 3.43Å; I115-L118 HydrophobicContact CD1-CD1 4.27Å; I115-L118 PolarHBondContact O-N 3.14Å; I115-L119 HydrophobicContact CG2-CD1 4.24Å; I115-L119 HydrophobicContact CG2-CG 4.48Å; I115-L119 WeakPolarHBondContact O-CB 3.45Å; I115-L119 WeakPolarHBondContact O-CG 3.44Å; I115-L119 PolarHBondContact O-N 3.21Å; I115-V195 HydrophobicContact CD1-CG1 4Å; I115-V195 HydrophobicContact CG1-CG1 4.22Å; I115-H196 HydrophobicContact CB-CB 4.47Å; I115-H196 HydrophobicContact CG2-CB 3.65Å; I115-F199 HydrophobicContact CG1-CD2 4.07Å; I115-F199 HydrophobicContact CG1-CE2 4.19Å
116G98.8Very high98.7Very high23 Ų2335 Ų3524%0.23719%0.191CC..Hα-helixtrans-60.1-40.5172.500000113.4T112 W113 N114 L119 L120T112-G116 PolarHBondContact O-N 3.16Å; W113-G116 CarbonylContact O-C 3.47Å; W113-G116 VanDerWaalsContact O-CA 3.25Å; W113-G116 WeakPolarHBondContact O-CA 3.18Å; W113-G116 PolarHBondContact O-N 3.41Å; N114-G116 VanDerWaalsContact C-N 3.26Å; N114-G116 PolarHBondContact O-N 2.88Å; G116-L119 WeakPolarHBondContact O-CB 3.48Å; G116-L119 PolarHBondContact O-N 3.37Å; G116-L120 PolarHBondContact O-N 3.47Å
117V98.8Very high98.7Very high10 Ų1034.8 Ų34.86%0.06119%0.191CC..Hα-helixtrans-64.6-42.3173.6176.90000110.8W113 N114 I115 L120 F121 L301W113-V117 PolarHBondContact O-N 3.25Å; N114-V117 PolarHBondContact O-N 3.13Å; I115-V117 PolarHBondContact O-N 3.43Å; V117-L120 WeakPolarHBondContact O-CB 3.23Å; V117-L120 PolarHBondContact O-N 2.57Å; V117-F121 HydrophobicContact CG1-CD2 3.98Å; V117-F121 HydrophobicContact CG1-CE2 3.77Å; V117-F121 VanDerWaalsContact O-CD2 3.28Å; V117-F121 WeakPolarHBondContact O-CD2 3.48Å; V117-F121 PolarHBondContact O-N 3.23Å; V117-L301 HydrophobicContact CG2-CB 3.88Å
118L98.8Very high98.7Very high94 Ų9436.1 Ų36.149%0.49220%0.197SC..Hα-helixtrans-63.5-41.3174.8-67.4176.4000112.4N114 I115 L120 F121 A122N114-L118 WeakPolarHBondContact O-CG 3.39Å; N114-L118 PolarHBondContact O-N 2.55Å; I115-L118 HydrophobicContact CD1-CD1 4.27Å; I115-L118 PolarHBondContact O-N 3.14Å; L118-L120 VanDerWaalsContact C-N 3.32Å; L118-L120 PolarHBondContact O-N 3.12Å; L118-F121 PolarHBondContact O-N 3.32Å; L118-A122 WeakPolarHBondContact O-CB 3.43Å; L118-A122 PolarHBondContact O-N 2.89Å
119L98.9Very high98.7Very high21 Ų2134.7 Ų34.711%0.1119%0.187CC..Hα-helixtrans-59.2-43.5173.4-81167.3000111.3I115 G116 A122 V123 I189 L192 A193 H196I115-L119 HydrophobicContact CG2-CD1 4.24Å; I115-L119 HydrophobicContact CG2-CG 4.48Å; I115-L119 WeakPolarHBondContact O-CB 3.45Å; I115-L119 WeakPolarHBondContact O-CG 3.44Å; I115-L119 PolarHBondContact O-N 3.21Å; G116-L119 WeakPolarHBondContact O-CB 3.48Å; G116-L119 PolarHBondContact O-N 3.37Å; L119-A122 PolarHBondContact O-N 2.63Å; L119-V123 WeakPolarHBondContact O-CG2 3.28Å; L119-V123 PolarHBondContact O-N 3.33Å; L119-I189 HydrophobicContact CD2-CG2 3.85Å; L119-L192 HydrophobicContact CD2-CB 3.53Å; L119-L192 HydrophobicContact CD2-CD1 4.48Å; L119-L192 HydrophobicContact CG-CB 4.03Å; L119-A193 HydrophobicContact CD2-CB 4.42Å; L119-H196 HydrophobicContact CD1-CB 3.8Å
120L98.8Very high98.7Very high11 Ų1133.8 Ų33.86%0.05819%0.187CC..Hα-helixtrans-58.7-49.3175.9177.861.6000111.1L94 G116 V117 L118 A122 V123 M124 I298 L301L94-L120 HydrophobicContact CD1-CD1 4.27Å; G116-L120 PolarHBondContact O-N 3.47Å; V117-L120 WeakPolarHBondContact O-CB 3.23Å; V117-L120 PolarHBondContact O-N 2.57Å; L118-L120 VanDerWaalsContact C-N 3.32Å; L118-L120 PolarHBondContact O-N 3.12Å; L120-A122 VanDerWaalsContact C-N 3.34Å; L120-A122 PolarHBondContact O-N 3Å; L120-V123 PolarHBondContact O-N 2.9Å; L120-M124 HydrophobicContact CD1-CG 4.22Å; L120-M124 HydrophobicContact CD1-SD 4Å; L120-M124 HydrophobicContact CG-SD 3.92Å; L120-M124 WeakPolarHBondContact O-CB 3.43Å; L120-M124 WeakPolarHBondContact O-CG 3.43Å; L120-M124 PolarHBondContact O-N 3.47Å; L120-I298 HydrophobicContact CD2-CG2 3.84Å; L120-I298 HydrophobicContact CG-CG2 4.41Å; L120-L301 HydrophobicContact CD2-CD1 3.76Å
121F98.7Very high98.7Very high62 Ų6232 Ų3227%0.27218%0.177SC..Hα-helixtrans-60-42.1175.7-82.3-69.2000112.7V117 L118 M124 A125 I298 L299V117-F121 HydrophobicContact CG1-CD2 3.98Å; V117-F121 HydrophobicContact CG1-CE2 3.77Å; V117-F121 VanDerWaalsContact O-CD2 3.28Å; V117-F121 WeakPolarHBondContact O-CD2 3.48Å; V117-F121 PolarHBondContact O-N 3.23Å; L118-F121 PolarHBondContact O-N 3.32Å; F121-M124 PolarHBondContact O-N 2.89Å; F121-A125 WeakPolarHBondContact O-CB 3.48Å; F121-A125 PolarHBondContact O-N 3.38Å; F121-I298 HydrophobicContact CD1-CG2 4.46Å; F121-I298 HydrophobicContact CD2-CG2 4.41Å; F121-I298 HydrophobicContact CE1-CB 4.03Å; F121-I298 HydrophobicContact CE1-CD1 4.01Å; F121-I298 HydrophobicContact CE1-CG2 3.83Å; F121-I298 HydrophobicContact CE2-CB 4.43Å; F121-I298 HydrophobicContact CE2-CG2 3.75Å; F121-I298 HydrophobicContact CZ-CB 3.68Å; F121-I298 HydrophobicContact CZ-CG2 3.42Å; F121-I298 VanDerWaalsContact CZ-CG2 3.42Å; F121-L299 HydrophobicContact CE2-CD2 3.64Å; F121-L299 HydrophobicContact CE2-CG 4.27Å; F121-L299 HydrophobicContact CZ-CD2 3.77Å; F121-L299 HydrophobicContact CZ-CG 3.9Å
122A98.8Very high98.7Very high14 Ų1427 Ų2712%0.11615%0.153CC..Hα-helixtrans-64.7-43.1179.400000111.9L118 L119 L120 A125 T126 I189 L192L118-A122 WeakPolarHBondContact O-CB 3.43Å; L118-A122 PolarHBondContact O-N 2.89Å; L119-A122 PolarHBondContact O-N 2.63Å; L120-A122 VanDerWaalsContact C-N 3.34Å; L120-A122 PolarHBondContact O-N 3Å; A122-A125 PolarHBondContact O-N 3.34Å; A122-T126 WeakPolarHBondContact O-CB 3.32Å; A122-T126 PolarHBondContact O-N 3.47Å; A122-T126 PolarHBondContact O-OG1 2.87Å; A122-I189 HydrophobicContact CB-CD1 4.2Å; A122-I189 HydrophobicContact CB-CG1 3.63Å; A122-L192 HydrophobicContact CB-CD1 4.44Å
123V98.9Very high98.7Very high6 Ų627.1 Ų27.14%0.03615%0.153CC..Hα-helixtrans-66.3-41175.9176.50000111F90 F91 L94 L119 L120 T126 A127 I189F90-V123 HydrophobicContact CD2-CG1 3.73Å; F90-V123 HydrophobicContact CE2-CB 4.37Å; F90-V123 HydrophobicContact CE2-CG1 3.65Å; F90-V123 HydrophobicContact CE2-CG2 3.71Å; F90-V123 HydrophobicContact CZ-CG1 4.39Å; F90-V123 HydrophobicContact CZ-CG2 3.83Å; F91-V123 HydrophobicContact CE1-CG1 4.47Å; F91-V123 HydrophobicContact CE2-CG1 4.2Å; F91-V123 HydrophobicContact CZ-CG1 3.95Å; L94-V123 HydrophobicContact CD1-CB 3.98Å; L94-V123 HydrophobicContact CD1-CG1 3.64Å; L94-V123 HydrophobicContact CD1-CG2 4.29Å; L119-V123 WeakPolarHBondContact O-CG2 3.28Å; L119-V123 PolarHBondContact O-N 3.33Å; L120-V123 PolarHBondContact O-N 2.9Å; V123-T126 PolarHBondContact O-N 3.24Å; V123-A127 WeakPolarHBondContact O-CB 3.37Å; V123-A127 PolarHBondContact O-N 3.38Å; V123-I189 HydrophobicContact CG2-CD1 3.84Å; V123-I189 HydrophobicContact CG2-CG1 4.36Å; V123-I189 HydrophobicContact CG2-CG2 4.17Å
124M98.8Very high98.7Very high17 Ų1727.3 Ų27.38%0.08416%0.158CC..Hα-helixtrans-58.7-49174.1-73.5177.687.600112.1F91 L120 F121 T126 A127 F128 F274 I298F91-M124 HydrophobicContact CE1-CG 3.81Å; F91-M124 HydrophobicContact CZ-CG 4.13Å; L120-M124 HydrophobicContact CD1-CG 4.22Å; L120-M124 HydrophobicContact CD1-SD 4Å; L120-M124 HydrophobicContact CG-SD 3.92Å; L120-M124 WeakPolarHBondContact O-CB 3.43Å; L120-M124 WeakPolarHBondContact O-CG 3.43Å; L120-M124 PolarHBondContact O-N 3.47Å; F121-M124 PolarHBondContact O-N 2.89Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.31Å; M124-A127 PolarHBondContact O-N 3.41Å; M124-F128 WeakPolarHBondContact O-CB 3.22Å; M124-F128 PolarHBondContact O-N 2.66Å; M124-F274 HydrophobicContact CB-CE1 3.84Å; M124-F274 HydrophobicContact CB-CZ 4.27Å; M124-F274 HydrophobicContact CE-CD1 3.6Å; M124-F274 HydrophobicContact CE-CE1 3.47Å; M124-F274 VanDerWaalsContact CE-CE1 3.47Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.33Å; M124-I298 HydrophobicContact CE-CD1 3.37Å; M124-I298 HydrophobicContact CE-CG1 4.24Å; M124-I298 HydrophobicContact SD-CD1 3.74Å; M124-I298 HydrophobicContact SD-CG1 4.43Å; M124-I298 HydrophobicContact SD-CG2 4.45Å
125A98.6Very high98.7Very high39 Ų3925.3 Ų25.332%0.32215%0.146SC..Hα-helixtrans-60.2-45.7176.100000111.4F121 A122 A127 F128 M129 L185F121-A125 WeakPolarHBondContact O-CB 3.48Å; F121-A125 PolarHBondContact O-N 3.38Å; A122-A125 PolarHBondContact O-N 3.34Å; A125-A127 PolarHBondContact O-N 3.36Å; A125-F128 PolarHBondContact O-N 3.07Å; A125-M129 VanDerWaalsContact C-CE 3.48Å; A125-M129 HydrophobicContact CB-CE 3.92Å; A125-M129 WeakPolarHBondContact O-CE 3.42Å; A125-M129 PolarHBondContact O-N 2.92Å; A125-L185 HydrophobicContact CB-CD1 4.4Å
126T98.9Very high98.7Very high13 Ų1324.1 Ų24.18%0.0814%0.14CC..Hα-helixtrans-59.3-48.6179.4-56.70000111.5A122 V123 M124 M129 G130 H182 L185 P186 I189A122-T126 WeakPolarHBondContact O-CB 3.32Å; A122-T126 PolarHBondContact O-N 3.47Å; A122-T126 PolarHBondContact O-OG1 2.87Å; V123-T126 PolarHBondContact O-N 3.24Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.31Å; T126-M129 PolarHBondContact O-N 2.82Å; T126-G130 PolarHBondContact O-N 3.48Å; T126-H182 PolarHBondContact O-CE1 2.76Å; T126-H182 PolarHBondContact O-ND1 3Å; T126-L185 HydrophobicContact CG2-CB 4.43Å; T126-L185 WeakPolarHBondContact OG1-CB 3.48Å; T126-P186 HydrophobicContact CG2-CG 3.87Å; T126-I189 VanDerWaalsContact OG1-CD1 3.3Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.08Å
127A98.7Very high98.7Very high14 Ų1423.3 Ų23.312%0.11613%0.13CC..Hα-helixtrans-67.2-41.6-178.700000112.3F91 V123 M124 A125 M129 G130 Y131 Y273F91-A127 HydrophobicContact CE2-CB 3.5Å; F91-A127 HydrophobicContact CZ-CB 3.86Å; V123-A127 WeakPolarHBondContact O-CB 3.37Å; V123-A127 PolarHBondContact O-N 3.38Å; M124-A127 PolarHBondContact O-N 3.41Å; A125-A127 PolarHBondContact O-N 3.36Å; A127-M129 PolarHBondContact O-N 3.47Å; A127-G130 PolarHBondContact O-N 3.13Å; A127-Y131 WeakPolarHBondContact O-CB 3.39Å; A127-Y131 PolarHBondContact O-N 3.08Å; A127-Y273 HydrophobicContact CB-CE2 3.99Å
128F98.6Very high98.6Very high41 Ų4122.9 Ų22.918%0.1813%0.127CC..Hα-helixtrans-56.6-51.4174.3170-105.1000111.3M124 A125 G130 Y131 V132 I146 T147 F178 F274M124-F128 WeakPolarHBondContact O-CB 3.22Å; M124-F128 PolarHBondContact O-N 2.66Å; A125-F128 PolarHBondContact O-N 3.07Å; F128-G130 PolarHBondContact O-N 2.83Å; F128-Y131 PolarHBondContact O-N 3.23Å; F128-V132 WeakPolarHBondContact O-CG2 3.42Å; F128-V132 PolarHBondContact O-N 2.89Å; F128-I146 HydrophobicContact CD2-CG2 4.41Å; F128-I146 HydrophobicContact CE2-CB 3.76Å; F128-I146 HydrophobicContact CE2-CG1 4.1Å; F128-I146 HydrophobicContact CE2-CG2 3.76Å; F128-I146 HydrophobicContact CZ-CB 3.98Å; F128-I146 HydrophobicContact CZ-CG2 3.9Å; F128-T147 HydrophobicContact CE1-CG2 4.23Å; F128-T147 HydrophobicContact CZ-CG2 4.11Å; F128-F178 AromaticContact CE1-CE2 3.89Å; F128-F178 HydrophobicContact CE1-CE2 3.89Å; F128-F178 HydrophobicContact CE1-CZ 4.23Å; F128-F178 HydrophobicContact CZ-CE2 4.47Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.18Å
129M98.6Very high98.5Very high21 Ų2118.4 Ų18.410%0.10310%0.104CC..Hα-helixtrans-66.2-37.2179.2-74.4176.9-82.400112.6A125 T126 A127 Y131 V132 L133 F178 F181 H182 L185A125-M129 VanDerWaalsContact C-CE 3.48Å; A125-M129 HydrophobicContact CB-CE 3.92Å; A125-M129 WeakPolarHBondContact O-CE 3.42Å; A125-M129 PolarHBondContact O-N 2.92Å; T126-M129 PolarHBondContact O-N 2.82Å; A127-M129 PolarHBondContact O-N 3.47Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.37Å; M129-V132 WeakPolarHBondContact O-CB 3.48Å; M129-V132 PolarHBondContact O-N 2.89Å; M129-V132 VanDerWaalsContact O-N 3.13Å; M129-L133 WeakPolarHBondContact O-CG 3.24Å; M129-F178 HydrophobicContact CB-CB 4.4Å; M129-F178 HydrophobicContact CB-CD2 4.35Å; M129-F178 HydrophobicContact CB-CG 4.43Å; M129-F178 HydrophobicContact CG-CB 4.37Å; M129-F178 HydrophobicContact CG-CD1 4.28Å; M129-F178 HydrophobicContact CG-CD2 3.9Å; M129-F178 HydrophobicContact CG-CE2 4.22Å; M129-F178 HydrophobicContact CG-CG 3.94Å; M129-F178 HydrophobicContact SD-CD1 4.37Å; M129-F178 HydrophobicContact SD-CG 4.5Å; M129-F181 HydrophobicContact CE-CB 4.2Å; M129-F181 HydrophobicContact SD-CB 3.44Å; M129-F181 WeakPolarHBondContact SD-CB 3.33Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.28Å; M129-H182 HydrophobicContact CB-CB 4.09Å; M129-L185 HydrophobicContact CE-CD1 3.2Å
130G98.6Very high98.5Very high16 Ų1618 Ų1817%0.16510%0.101CC..Hα-helixtrans-60.8-39175.400000112.5T126 A127 F128 V132 L133 P134 H182T126-G130 PolarHBondContact O-N 3.48Å; A127-G130 PolarHBondContact O-N 3.13Å; F128-G130 PolarHBondContact O-N 2.83Å; G130-V132 PolarHBondContact O-N 3.45Å; G130-L133 WeakPolarHBondContact O-CB 3.28Å; G130-L133 WeakPolarHBondContact O-CG 3.45Å; G130-L133 PolarHBondContact O-N 3.46Å; G130-P134 WeakPolarHBondContact O-CD 3.49Å; G130-H182 WeakPolarHBondContact CA-CE1 3.31Å; G130-H182 WeakPolarHBondContact CA-ND1 3.33Å; G130-H182 PolarHBondContact N-ND1 3.33Å
131Y98.6Very high98.5Very high42 Ų4219 Ų1917%0.16510%0.104CC..Hα-helixtrans-67.6-19.2177.6-168.1-105.3000113.4A127 F128 M129 P134 M138 S139 E271A127-Y131 WeakPolarHBondContact O-CB 3.39Å; A127-Y131 PolarHBondContact O-N 3.08Å; F128-Y131 PolarHBondContact O-N 3.23Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.37Å; Y131-P134 WeakPolarHBondContact O-CD 3.28Å; Y131-M138 HydrophobicContact CE1-CB 4.12Å; Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.26Å; Y131-S139 PolarHBondContact O-OG 2.98Å; Y131-E271 HydrophobicContact CD1-CG 4.24Å; Y131-E271 HydrophobicContact CD2-CG 3.47Å; Y131-E271 VanDerWaalsContact CD2-CG 3.47Å; Y131-E271 HydrophobicContact CE1-CG 4.17Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.41Å; Y131-E271 HydrophobicContact CG-CG 3.89Å; Y131-E271 PolarHBondContact OH-OE1 3.18Å
132V98.7Very high98.4Very high1 Ų116.5 Ų16.51%0.00610%0.096CC..Hα-helixtrans-78.2-27175.6-177.50000112F128 M129 G130 W135 A143 F178F128-V132 WeakPolarHBondContact O-CG2 3.42Å; F128-V132 PolarHBondContact O-N 2.89Å; M129-V132 WeakPolarHBondContact O-CB 3.48Å; M129-V132 PolarHBondContact O-N 2.89Å; M129-V132 VanDerWaalsContact O-N 3.13Å; G130-V132 PolarHBondContact O-N 3.45Å; V132-W135 HydrophobicContact CG1-CE3 4.1Å; V132-W135 HydrophobicContact CG1-CZ3 3.9Å; V132-W135 PolarHBondContact O-N 3.28Å; V132-A143 HydrophobicContact CG1-CB 4.12Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; V132-F178 HydrophobicContact CB-CD2 3.92Å; V132-F178 HydrophobicContact CG1-CD2 3.98Å; V132-F178 HydrophobicContact CG2-CD2 3.83Å; V132-F178 HydrophobicContact CG2-CE2 4Å
133L98.8Very high98.3Very high16 Ų1615.9 Ų15.98%0.0849%0.091CC..THydrogen-bonded Turntrans-62.5-35.5-170.5-53.4-176.4000115.3Y55 M129 G130 W135 L175 F178 F179 H182Y55-L133 HydrophobicContact CE2-CB 4.47Å; Y55-L133 WeakPolarHBondContact CE2-O 3.37Å; Y55-L133 PolarHBondContact OH-O 3.37Å; M129-L133 WeakPolarHBondContact O-CG 3.24Å; G130-L133 WeakPolarHBondContact O-CB 3.28Å; G130-L133 WeakPolarHBondContact O-CG 3.45Å; G130-L133 PolarHBondContact O-N 3.46Å; L133-W135 PolarHBondContact O-N 3.49Å; L133-W135 VanDerWaalsContact O-N 3.11Å; L133-L175 HydrophobicContact CD2-CD1 4.16Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; L133-F179 HydrophobicContact CD1-CD2 3.99Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L133-F179 HydrophobicContact CD2-CD2 4.46Å; L133-H182 HydrophobicContact CD1-CB 4.23Å; L133-H182 VanDerWaalsContact CD1-CD2 3.46Å; L133-H182 WeakPolarHBondContact CD1-CD2 3.33Å
134P98.6Very high98.2Very high28 Ų2817.1 Ų17.118%0.18210%0.098CC..THydrogen-bonded Turntrans-61.3-17.6174-25.336.1000114.3F63 G130 Y131 G136F63-P134 VanDerWaalsContact CA-O 3.31Å; F63-P134 WeakPolarHBondContact CA-O 3.28Å; F63-P134 WeakPolarHBondContact CD2-O 3.47Å; G130-P134 WeakPolarHBondContact O-CD 3.49Å; Y131-P134 WeakPolarHBondContact O-CD 3.28Å; P134-G136 PolarHBondContact O-N 2.96Å
135W98.6Very high98.1Very high17 Ų1718.9 Ų18.96%0.06411%0.11CC..  trans55.337.3177.7-152.6-111000114.1T59 A62 V132 L133 F140 V170 L175 A259T59-W135 HydrophobicContact CG2-CD2 4.46Å; T59-W135 HydrophobicContact CG2-CH2 4.02Å; T59-W135 HydrophobicContact CG2-CZ2 3.37Å; A62-W135 HydrophobicContact CB-CB 3.82Å; A62-W135 HydrophobicContact CB-CG 4.37Å; V132-W135 HydrophobicContact CG1-CE3 4.1Å; V132-W135 HydrophobicContact CG1-CZ3 3.9Å; V132-W135 PolarHBondContact O-N 3.28Å; L133-W135 PolarHBondContact O-N 3.49Å; L133-W135 VanDerWaalsContact O-N 3.11Å; W135-F140 AromaticContact CH2-CD2 3.96Å; W135-F140 HydrophobicContact CH2-CD2 3.96Å; W135-F140 HydrophobicContact CH2-CE2 4.45Å; W135-F140 AromaticContact CZ2-CD2 3.81Å; W135-F140 HydrophobicContact CZ2-CD2 3.81Å; W135-F140 HydrophobicContact CZ2-CE2 4.24Å; W135-V170 HydrophobicContact CH2-CG1 3.72Å; W135-V170 HydrophobicContact CZ3-CG1 4.07Å; W135-L175 HydrophobicContact CD2-CD1 4.46Å; W135-L175 HydrophobicContact CD2-CD2 3.83Å; W135-L175 HydrophobicContact CE3-CB 4.2Å; W135-L175 HydrophobicContact CE3-CD1 3.61Å; W135-L175 HydrophobicContact CE3-CD2 3.76Å; W135-L175 HydrophobicContact CE3-CG 4.06Å; W135-L175 HydrophobicContact CG-CD2 4.21Å; W135-L175 HydrophobicContact CH2-CB 4.12Å; W135-L175 HydrophobicContact CZ3-CB 3.77Å; W135-L175 HydrophobicContact CZ3-CD1 3.9Å; W135-L175 HydrophobicContact CZ3-CD2 4.16Å; W135-L175 HydrophobicContact CZ3-CG 4.15Å; W135-A259 HydrophobicContact CG-CB 4.31Å; W135-A259 WeakPolarHBondContact O-CB 3.3Å; W135-A259 PolarHBondContact O-N 2.86Å
136G98.4Very high98Very high0 Ų019.3 Ų19.30%011%0.106CC..BIsolated β-bridgetrans-86.5-178.117000000112.8P134 S139 F140 N255 M257P134-G136 PolarHBondContact O-N 2.96Å; G136-S139 WeakPolarHBondContact O-CB 3.48Å; G136-S139 PolarHBondContact O-N 3.46Å; G136-F140 WeakPolarHBondContact O-CB 3.23Å; G136-F140 PolarHBondContact O-N 3.43Å; G136-N255 VanDerWaalsContact C-OD1 3.27Å; G136-N255 VanDerWaalsContact CA-OD1 3.23Å; G136-N255 WeakPolarHBondContact CA-OD1 3.33Å; G136-M257 CarbonylContact C-O 3.24Å; G136-M257 WeakPolarHBondContact CA-O 3.45Å
137Q98.1Very high97.9Very high7 Ų719.1 Ų19.13%0.03311%0.105CC..Hα-helixtrans-60.1-49.7-178.7-72.7-77.951.400112.8S139 F140 W141 D254 M257 N263 P265Q137-S139 VanDerWaalsContact C-N 3.35Å; Q137-S139 PolarHBondContact O-N 3.36Å; Q137-F140 PolarHBondContact O-N 3.02Å; Q137-W141 WeakPolarHBondContact O-CB 3.22Å; Q137-W141 PolarHBondContact O-N 3.07Å; Q137-D254 HydrophobicContact CB-CB 4.47Å; Q137-D254 WeakPolarHBondContact CB-O 3.46Å; Q137-M257 HydrophobicContact CG-CB 3.8Å; Q137-M257 HydrophobicContact CG-CE 4.35Å; Q137-M257 PolarHBondContact N-O 2.93Å; Q137-N263 PolarHBondContact NE2-O 3.23Å; Q137-P265 HydrophobicContact CB-CG 3.89Å
138M97.3Very high97.8Very high1 Ų121.5 Ų21.51%0.00512%0.116CC..Hα-helixtrans-68.1-35.7179.6-69.8-62.6165.400112.1Y131 G142 D252 D254 N255 P265Y131-M138 HydrophobicContact CE1-CB 4.12Å; M138-G142 WeakPolarHBondContact O-CA 3.01Å; M138-G142 PolarHBondContact O-N 3.29Å; M138-D252 HydrophobicContact CG-CB 4.07Å; M138-D254 HydrophobicContact CE-CB 3.52Å; M138-D254 WeakPolarHBondContact CE-OD2 3.41Å; M138-D254 HydrophobicContact CG-CB 3.82Å; M138-N255 HydrophobicContact CB-CB 4.15Å; M138-N255 PolarHBondContact N-OD1 3.42Å; M138-P265 HydrophobicContact CE-CB 3.48Å; M138-P265 VanDerWaalsContact CE-CB 3.48Å; M138-P265 HydrophobicContact CE-CG 3.98Å; M138-P265 HydrophobicContact SD-CB 4.48Å
139S97.6Very high97.6Very high0 Ų020.6 Ų20.60%011%0.113CC..Hα-helixtrans-55.3-53.8171.6-66.30000112Y131 G136 Q137 A143 N255Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.26Å; Y131-S139 PolarHBondContact O-OG 2.98Å; G136-S139 WeakPolarHBondContact O-CB 3.48Å; G136-S139 PolarHBondContact O-N 3.46Å; Q137-S139 VanDerWaalsContact C-N 3.35Å; Q137-S139 PolarHBondContact O-N 3.36Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.29Å; S139-A143 PolarHBondContact O-N 3.14Å; S139-N255 PolarHBondContact N-OD1 3.38Å; S139-N255 PolarHBondContact OG-ND2 3.27Å; S139-N255 PolarHBondContact OG-OD1 3.39Å
140F98.3Very high97.4Very high12 Ų1222 Ų225%0.05312%0.12CC..Hα-helixtrans-69.8-49.9-175.6174.7-91.6000112.7W135 G136 Q137 A143 T144 V170 A259 P261W135-F140 AromaticContact CH2-CD2 3.96Å; W135-F140 HydrophobicContact CH2-CD2 3.96Å; W135-F140 HydrophobicContact CH2-CE2 4.45Å; W135-F140 AromaticContact CZ2-CD2 3.81Å; W135-F140 HydrophobicContact CZ2-CD2 3.81Å; W135-F140 HydrophobicContact CZ2-CE2 4.24Å; G136-F140 WeakPolarHBondContact O-CB 3.23Å; G136-F140 PolarHBondContact O-N 3.43Å; Q137-F140 PolarHBondContact O-N 3.02Å; F140-A143 PolarHBondContact O-N 3.25Å; F140-T144 WeakPolarHBondContact O-CB 3.44Å; F140-T144 PolarHBondContact O-N 2.72Å; F140-T144 PolarHBondContact O-OG1 3.45Å; F140-V170 HydrophobicContact CD2-CG1 4.07Å; F140-V170 HydrophobicContact CE2-CB 4.15Å; F140-V170 HydrophobicContact CE2-CG1 4.11Å; F140-V170 VanDerWaalsContact CE2-O 3.27Å; F140-V170 WeakPolarHBondContact CE2-O 3.35Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.25Å; F140-A259 HydrophobicContact CG-CB 3.93Å; F140-P261 HydrophobicContact CE1-CB 4.12Å; F140-P261 HydrophobicContact CE1-CG 4.28Å; F140-P261 HydrophobicContact CE2-CG 4.24Å; F140-P261 HydrophobicContact CZ-CB 3.88Å; F140-P261 HydrophobicContact CZ-CG 3.82Å
141W98.4Very high97.3Very high33 Ų3322.6 Ų22.613%0.12512%0.122CC..Hα-helixtrans-71.8-35.9-177.3-73.8107.2000111.9Q137 T144 V145 N260 P261 N263 T264 P265 I268Q137-W141 WeakPolarHBondContact O-CB 3.22Å; Q137-W141 PolarHBondContact O-N 3.07Å; W141-T144 PolarHBondContact O-N 2.89Å; W141-V145 WeakPolarHBondContact O-CG2 3.28Å; W141-V145 PolarHBondContact O-N 2.91Å; W141-N260 PolarHBondContact NE1-O 3.4Å; W141-P261 WeakPolarHBondContact CH2-O 3.38Å; W141-P261 WeakPolarHBondContact CZ2-O 3.34Å; W141-N263 PolarHBondContact NE1-O 3.23Å; W141-T264 HydrophobicContact CD2-CG2 4.22Å; W141-T264 HydrophobicContact CE3-CG2 4.22Å; W141-T264 HydrophobicContact CH2-CG2 4.5Å; W141-T264 VanDerWaalsContact CH2-OG1 3.27Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.5Å; W141-T264 HydrophobicContact CZ2-CG2 4.48Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.36Å; W141-T264 HydrophobicContact CZ3-CG2 4.37Å; W141-P265 HydrophobicContact CG-CG 4.39Å; W141-I268 HydrophobicContact CB-CD1 3.71Å; W141-I268 HydrophobicContact CB-CG1 3.9Å; W141-I268 HydrophobicContact CB-CG2 4.16Å; W141-I268 HydrophobicContact CD2-CD1 4.28Å; W141-I268 HydrophobicContact CE3-CD1 4.19Å; W141-I268 HydrophobicContact CG-CD1 4.12Å
142G96.3Very high97.2Very high9 Ų921.4 Ų21.49%0.09312%0.121CC..Hα-helixtrans-59.7-47.1170.100000111.8M138 T144 V145 I146M138-G142 WeakPolarHBondContact O-CA 3.01Å; M138-G142 PolarHBondContact O-N 3.29Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 3Å; G142-V145 PolarHBondContact O-N 2.89Å; G142-I146 WeakPolarHBondContact O-CB 3.41Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.39Å; G142-I146 PolarHBondContact O-N 3.24Å
143A97Very high97.1Very high1 Ų123.9 Ų23.91%0.00813%0.134CC..Hα-helixtrans-57.9-47.7175.200000111.7V132 S139 F140 T147 V170V132-A143 HydrophobicContact CG1-CB 4.12Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.29Å; S139-A143 PolarHBondContact O-N 3.14Å; F140-A143 PolarHBondContact O-N 3.25Å; A143-T147 WeakPolarHBondContact O-CB 3.38Å; A143-T147 WeakPolarHBondContact O-CG2 3.32Å; A143-T147 PolarHBondContact O-N 2.95Å; A143-T147 PolarHBondContact O-OG1 3.36Å; A143-V170 HydrophobicContact CB-CG1 4.19Å; A143-V170 HydrophobicContact CB-CG2 4.27Å
144T97.3Very high97Very high31 Ų3126.6 Ų26.619%0.1915%0.152CC..Hα-helixtrans-60.3-50.3-178.6-600000111.7F140 W141 G142 N148F140-T144 WeakPolarHBondContact O-CB 3.44Å; F140-T144 PolarHBondContact O-N 2.72Å; F140-T144 PolarHBondContact O-OG1 3.45Å; W141-T144 PolarHBondContact O-N 2.89Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 3Å; T144-N148 WeakPolarHBondContact O-CB 3.48Å; T144-N148 PolarHBondContact O-N 2.88Å
145V96.6Very high96.9Very high55 Ų5536.1 Ų36.133%0.33319%0.186SC..Hα-helixtrans-66.4-49.6-178.1171.80000111.2W141 G142 N148 L149 I268W141-V145 WeakPolarHBondContact O-CG2 3.28Å; W141-V145 PolarHBondContact O-N 2.91Å; G142-V145 PolarHBondContact O-N 2.89Å; V145-N148 PolarHBondContact O-N 2.86Å; V145-L149 PolarHBondContact O-N 2.91Å; V145-I268 HydrophobicContact CG2-CD1 4.19Å; V145-I268 HydrophobicContact CG2-CG2 4.23Å
146I95.7Very high96.8Very high47 Ų4740.2 Ų40.224%0.24121%0.208CC..Hα-helixtrans-68.9-43.8-173.1-63.7-61.5000111.7F128 G142 N148 L149F128-I146 HydrophobicContact CD2-CG2 4.41Å; F128-I146 HydrophobicContact CE2-CB 3.76Å; F128-I146 HydrophobicContact CE2-CG1 4.1Å; F128-I146 HydrophobicContact CE2-CG2 3.76Å; F128-I146 HydrophobicContact CZ-CB 3.98Å; F128-I146 HydrophobicContact CZ-CG2 3.9Å; G142-I146 WeakPolarHBondContact O-CB 3.41Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.39Å; G142-I146 PolarHBondContact O-N 3.24Å; I146-N148 PolarHBondContact O-N 3.14Å; I146-L149 HydrophobicContact CD1-CD1 4.2Å; I146-L149 WeakPolarHBondContact O-CB 3.4Å; I146-L149 WeakPolarHBondContact O-CG 3.33Å; I146-L149 PolarHBondContact O-N 2.75Å
147T96.9Very high96.8Very high9 Ų940.3 Ų40.36%0.05521%0.209CC..Hα-helixtrans-68.5-35.6178.754.40000112F128 A143 L149 L150 V161 I164 W165 F178F128-T147 HydrophobicContact CE1-CG2 4.23Å; F128-T147 HydrophobicContact CZ-CG2 4.11Å; A143-T147 WeakPolarHBondContact O-CB 3.38Å; A143-T147 WeakPolarHBondContact O-CG2 3.32Å; A143-T147 PolarHBondContact O-N 2.95Å; A143-T147 PolarHBondContact O-OG1 3.36Å; T147-L149 PolarHBondContact O-N 2.8Å; T147-L149 VanDerWaalsContact O-N 3.11Å; T147-L150 WeakPolarHBondContact O-CB 3.38Å; T147-L150 PolarHBondContact O-N 2.93Å; T147-L150 VanDerWaalsContact O-N 3.13Å; T147-V161 WeakPolarHBondContact O-CG2 3.47Å; T147-I164 HydrophobicContact CG2-CG2 4.43Å; T147-W165 PolarHBondContact OG1-NE1 3.43Å; T147-F178 HydrophobicContact CG2-CZ 4.11Å
148N97Very high96.7Very high64 Ų6444 Ų4434%0.34223%0.232SC..G310 helixtrans-69.6-3.9175.8-16933.1000113.7T144 V145 I146 L150 S151 W165 K287T144-N148 WeakPolarHBondContact O-CB 3.48Å; T144-N148 PolarHBondContact O-N 2.88Å; V145-N148 PolarHBondContact O-N 2.86Å; I146-N148 PolarHBondContact O-N 3.14Å; N148-L150 PolarHBondContact O-N 2.74Å; N148-S151 PolarHBondContact O-N 3.44Å; N148-S151 PolarHBondContact O-OG 3.28Å; N148-S151 PolarHBondContact OD1-OG 3.35Å; N148-W165 HydrophobicContact CB-CH2 4.26Å; N148-W165 HydrophobicContact CB-CZ2 4.06Å; N148-K287 WeakPolarHBondContact O-CE 3.32Å; N148-K287 PolarHBondContact O-NZ 3.46Å
149L95Very high96.8Very high22 Ų2248.4 Ų48.412%0.11526%0.259CS..G310 helixtrans-63-32.5167.7-67.8-179.9000111.5V145 I146 T147 S151 A152 L281 V291 L294V145-L149 PolarHBondContact O-N 2.91Å; I146-L149 HydrophobicContact CD1-CD1 4.2Å; I146-L149 WeakPolarHBondContact O-CB 3.4Å; I146-L149 WeakPolarHBondContact O-CG 3.33Å; I146-L149 PolarHBondContact O-N 2.75Å; T147-L149 PolarHBondContact O-N 2.8Å; T147-L149 VanDerWaalsContact O-N 3.11Å; L149-S151 PolarHBondContact O-N 3.45Å; L149-A152 VanDerWaalsContact O-CB 3.26Å; L149-A152 WeakPolarHBondContact O-CB 3.34Å; L149-A152 PolarHBondContact O-N 2.94Å; L149-A152 VanDerWaalsContact O-N 3.1Å; L149-L281 HydrophobicContact CD1-CD1 4.36Å; L149-L281 HydrophobicContact CD1-CD2 3.63Å; L149-L281 HydrophobicContact CD2-CD1 4.24Å; L149-L281 HydrophobicContact CD2-CD2 4.12Å; L149-V291 HydrophobicContact CB-CG2 3.7Å; L149-V291 HydrophobicContact CD2-CG2 4.03Å; L149-V291 HydrophobicContact CG-CG2 4.28Å; L149-L294 HydrophobicContact CD1-CD2 4.09Å
150L94.4Very high96.8Very high51 Ų5151 Ų5127%0.26727%0.273SS..G310 helixtrans-66.2-20.3179.9-64.1171.8000113.3T147 N148 A152 I153 G157 L160 V161 I164T147-L150 WeakPolarHBondContact O-CB 3.38Å; T147-L150 PolarHBondContact O-N 2.93Å; T147-L150 VanDerWaalsContact O-N 3.13Å; N148-L150 PolarHBondContact O-N 2.74Å; L150-A152 PolarHBondContact O-N 2.93Å; L150-A152 VanDerWaalsContact O-N 3.11Å; L150-I153 HydrophobicContact CD2-CD1 4.05Å; L150-I153 WeakPolarHBondContact O-CB 3.42Å; L150-I153 WeakPolarHBondContact O-CG1 3.36Å; L150-I153 PolarHBondContact O-N 3.27Å; L150-G157 VanDerWaalsContact O-CA 3.26Å; L150-G157 WeakPolarHBondContact O-CA 3.45Å; L150-L160 HydrophobicContact CB-CD2 4.32Å; L150-L160 HydrophobicContact CD1-CD2 4.27Å; L150-V161 HydrophobicContact CB-CG2 3.78Å; L150-I164 HydrophobicContact CD1-CD1 3.31Å
151S96.3Very high96.8Very high29 Ų2950.7 Ų50.720%0.20327%0.271CS..G310 helixtrans-67.8-8.9174.264.70000113.5N148 L149 I153 K287N148-S151 PolarHBondContact O-N 3.44Å; N148-S151 PolarHBondContact O-OG 3.28Å; N148-S151 PolarHBondContact OD1-OG 3.35Å; L149-S151 PolarHBondContact O-N 3.45Å; S151-I153 PolarHBondContact O-N 3.18Å; S151-K287 PolarHBondContact OG-NZ 3.28Å
152A95.9Very high96.7Very high17 Ų1753.5 Ų53.514%0.1429%0.286CS..G310 helixtrans-71.9-16.4170.600000113.6L149 L150 P154 K287 L288 V291L149-A152 VanDerWaalsContact O-CB 3.26Å; L149-A152 WeakPolarHBondContact O-CB 3.34Å; L149-A152 PolarHBondContact O-N 2.94Å; L149-A152 VanDerWaalsContact O-N 3.1Å; L150-A152 PolarHBondContact O-N 2.93Å; L150-A152 VanDerWaalsContact O-N 3.11Å; A152-P154 WeakPolarHBondContact O-CD 3.3Å; A152-K287 HydrophobicContact CB-CB 4.39Å; A152-K287 HydrophobicContact CB-CD 3.91Å; A152-K287 HydrophobicContact CB-CG 3.84Å; A152-L288 HydrophobicContact CB-CB 4.23Å; A152-L288 HydrophobicContact CB-CD1 4.41Å; A152-V291 HydrophobicContact CB-CG2 4.4Å
153I96.6Very high96.8Very high53 Ų5362 Ų6227%0.27232%0.316SS..SBendtrans-69.5122.3179.6-60.3171.3000109L150 S151 I156 G157 L160L150-I153 HydrophobicContact CD2-CD1 4.05Å; L150-I153 WeakPolarHBondContact O-CB 3.42Å; L150-I153 WeakPolarHBondContact O-CG1 3.36Å; L150-I153 PolarHBondContact O-N 3.27Å; S151-I153 PolarHBondContact O-N 3.18Å; I153-I156 HydrophobicContact CG2-CD1 4.1Å; I153-I156 HydrophobicContact CG2-CG1 3.63Å; I153-G157 VanDerWaalsContact O-CA 3.28Å; I153-G157 WeakPolarHBondContact O-CA 3.31Å; I153-G157 PolarHBondContact O-N 2.84Å; I153-L160 HydrophobicContact CD1-CD2 4.16Å
154P96.3Very high96.8Very high72 Ų7263.7 Ų63.747%0.46832%0.324SS..THydrogen-bonded Turntrans-57.5144.2179.2-25.334.9000112.5A152 I156 L288A152-P154 WeakPolarHBondContact O-CD 3.3Å; P154-I156 PolarHBondContact O-N 3.41Å; P154-L288 HydrophobicContact CG-CD2 4.34Å
155Y96.3Very high96.9Very high228 Ų22863.3 Ų63.389%0.89432%0.319SS*.THydrogen-bonded Turntrans68.4-48.3176.9-46.5-71000116.2
156I97.8Very high96.9Very high104 Ų10462.5 Ų62.553%0.53332%0.322SS..THydrogen-bonded Turntrans-107-9.8-171.562.4169.5000114.3I153 P154 T158 T159 L160I153-I156 HydrophobicContact CG2-CD1 4.1Å; I153-I156 HydrophobicContact CG2-CG1 3.63Å; P154-I156 PolarHBondContact O-N 3.41Å; I156-T158 PolarHBondContact O-N 3.18Å; I156-T159 PolarHBondContact O-N 3.19Å; I156-L160 WeakPolarHBondContact O-CB 3.39Å; I156-L160 PolarHBondContact O-N 3.15Å
157G97.3Very high97Very high1 Ų161.8 Ų61.81%0.0133%0.326CS..Hα-helixtrans-61.5-47.6-167.700000114.4L150 I153 L160 V161L150-G157 VanDerWaalsContact O-CA 3.26Å; L150-G157 WeakPolarHBondContact O-CA 3.45Å; I153-G157 VanDerWaalsContact O-CA 3.28Å; I153-G157 WeakPolarHBondContact O-CA 3.31Å; I153-G157 PolarHBondContact O-N 2.84Å; G157-L160 PolarHBondContact O-N 2.89Å; G157-V161 WeakPolarHBondContact O-CG2 3.21Å; G157-V161 PolarHBondContact O-N 3.5Å
158T97Very high97Very high85 Ų8569.8 Ų69.852%0.52136%0.361SS..Hα-helixtrans-63.8-47-179.650.40000111.4I156 L160 V161 E162I156-T158 PolarHBondContact O-N 3.18Å; T158-L160 VanDerWaalsContact C-N 3.29Å; T158-L160 PolarHBondContact O-N 3.05Å; T158-V161 PolarHBondContact O-N 3.04Å; T158-E162 PolarHBondContact O-N 3.35Å
159T98.1Very high97Very high94 Ų9469.8 Ų69.858%0.57737%0.366SS*.Hα-helixtrans-58.9-40.3175.7-49.90000111.8I156 W163I156-T159 PolarHBondContact O-N 3.19Å; T159-W163 WeakPolarHBondContact O-CB 3.49Å; T159-W163 PolarHBondContact O-N 3.38Å
160L97.8Very high97.1Very high55 Ų5568.9 Ų68.929%0.28836%0.361SS..Hα-helixtrans-64.8-41.8177.9-177.863.4000111.9L150 I153 I156 G157 T158 W163 I164L150-L160 HydrophobicContact CB-CD2 4.32Å; L150-L160 HydrophobicContact CD1-CD2 4.27Å; I153-L160 HydrophobicContact CD1-CD2 4.16Å; I156-L160 WeakPolarHBondContact O-CB 3.39Å; I156-L160 PolarHBondContact O-N 3.15Å; G157-L160 PolarHBondContact O-N 2.89Å; T158-L160 VanDerWaalsContact C-N 3.29Å; T158-L160 PolarHBondContact O-N 3.05Å; L160-W163 HydrophobicContact CD1-CE3 4.27Å; L160-W163 PolarHBondContact O-N 3.49Å; L160-I164 HydrophobicContact CD1-CD1 4.36Å; L160-I164 HydrophobicContact CG-CD1 4.14Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.42Å; L160-I164 PolarHBondContact O-N 3.22Å
161V98.1Very high97.3Very high4 Ų470.5 Ų70.52%0.02437%0.37CS..Hα-helixtrans-63.9-51177.8171.10000111T147 L150 G157 T158 W163 I164 W165T147-V161 WeakPolarHBondContact O-CG2 3.47Å; L150-V161 HydrophobicContact CB-CG2 3.78Å; G157-V161 WeakPolarHBondContact O-CG2 3.21Å; G157-V161 PolarHBondContact O-N 3.5Å; T158-V161 PolarHBondContact O-N 3.04Å; V161-W163 PolarHBondContact O-N 3.25Å; V161-I164 PolarHBondContact O-N 3.44Å; V161-I164 VanDerWaalsContact O-N 3.14Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.46Å; V161-W165 VanDerWaalsContact CG1-CH2 3.46Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.59Å; V161-W165 PolarHBondContact O-N 3.13Å
162E98.1Very high97.3Very high92 Ų9274 Ų7443%0.4338%0.381SS..Hα-helixtrans-61.8-35.3178.1-69.5177.3-173.200111.8T158 W165 G166 G167T158-E162 PolarHBondContact O-N 3.35Å; E162-W165 PolarHBondContact O-N 3.11Å; E162-G166 WeakPolarHBondContact O-CA 3.33Å; E162-G166 PolarHBondContact O-N 3.21Å; E162-G167 WeakPolarHBondContact CA-O 3.22Å; E162-G167 PolarHBondContact O-N 3.39Å
163W98.3Very high97.4Very high189 Ų18975.3 Ų75.372%0.71639%0.392SS*.Hα-helixtrans-65-44.9173.7-178.781.2000112.2T159 L160 V161 W165 G166 R177T159-W163 WeakPolarHBondContact O-CB 3.49Å; T159-W163 PolarHBondContact O-N 3.38Å; L160-W163 HydrophobicContact CD1-CE3 4.27Å; L160-W163 PolarHBondContact O-N 3.49Å; V161-W163 PolarHBondContact O-N 3.25Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.43Å; W163-G166 PolarHBondContact O-N 3.33Å; W163-R177 PolarHBondContact O-NH1 3.36Å
164I97Very high97.5Very high36 Ų3672.8 Ų72.819%0.18538%0.379CS..Hα-helixtrans-62.4-41.3175.5-71.8168.2000110.7T147 L150 L160 V161 R177 F178T147-I164 HydrophobicContact CG2-CG2 4.43Å; L150-I164 HydrophobicContact CD1-CD1 3.31Å; L160-I164 HydrophobicContact CD1-CD1 4.36Å; L160-I164 HydrophobicContact CG-CD1 4.14Å; L160-I164 VanDerWaalsContact O-CG1 3.3Å; L160-I164 WeakPolarHBondContact O-CG1 3.42Å; L160-I164 PolarHBondContact O-N 3.22Å; V161-I164 PolarHBondContact O-N 3.44Å; V161-I164 VanDerWaalsContact O-N 3.14Å; I164-R177 VanDerWaalsContact C-NH1 3.32Å; I164-R177 WeakPolarHBondContact O-CD 3.36Å; I164-R177 PolarHBondContact O-NH1 3.48Å; I164-F178 HydrophobicContact CG2-CE1 4.26Å; I164-F178 HydrophobicContact CG2-CZ 4.48Å
165W98.3Very high97.6Very high22 Ų2269.3 Ų69.38%0.08336%0.357CS..Hα-helixtrans-70-34.7177.3-67.1-15.8000112.4T147 N148 V161 E162 W163 G167 F168 S169 V170 T174T147-W165 PolarHBondContact OG1-NE1 3.43Å; N148-W165 HydrophobicContact CB-CH2 4.26Å; N148-W165 HydrophobicContact CB-CZ2 4.06Å; V161-W165 HydrophobicContact CG1-CD2 3.63Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.46Å; V161-W165 VanDerWaalsContact CG1-CH2 3.46Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.59Å; V161-W165 PolarHBondContact O-N 3.13Å; E162-W165 PolarHBondContact O-N 3.11Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.43Å; W165-G167 VanDerWaalsContact C-N 3.34Å; W165-F168 VanDerWaalsContact CZ3-O 3.26Å; W165-F168 WeakPolarHBondContact CZ3-O 3.48Å; W165-S169 VanDerWaalsContact CE3-CA 3.48Å; W165-V170 HydrophobicContact CD2-CG2 4.44Å; W165-V170 HydrophobicContact CG-CG2 4.38Å; W165-V170 HydrophobicContact CZ2-CG2 4.36Å; W165-T174 WeakPolarHBondContact CA-OG1 3.46Å; W165-T174 PolarHBondContact O-N 3.24Å; W165-T174 PolarHBondContact O-OG1 2.79Å
166G97.4Very high97.7Very high39 Ų3961.4 Ų61.440%0.40233%0.332SS..THydrogen-bonded Turntrans73.629.1-169.100000112.8E162 W163E162-G166 WeakPolarHBondContact O-CA 3.33Å; E162-G166 PolarHBondContact O-N 3.21Å; W163-G166 PolarHBondContact O-N 3.33Å
167G96.6Very high97.7Very high31 Ų3159.9 Ų59.932%0.3232%0.32SS..SBendtrans169.2-168.5-17200000110.8E162 W165E162-G167 WeakPolarHBondContact CA-O 3.22Å; E162-G167 PolarHBondContact O-N 3.39Å; W165-G167 VanDerWaalsContact C-N 3.34Å
168F97.2Very high97.8Very high178 Ų17860.3 Ų60.378%0.78132%0.321SS*.SBendtrans-86.7-10.1-175.1-55.7-69.6000114.3W165W165-F168 VanDerWaalsContact CZ3-O 3.26Å; W165-F168 WeakPolarHBondContact CZ3-O 3.48Å
169S96.5Very high97.9Very high64 Ų6458.5 Ų58.545%0.44831%0.306SS..SBendtrans-151.6167.7177.860.30000110W165 D171W165-S169 VanDerWaalsContact CE3-CA 3.48Å; S169-D171 PolarHBondContact O-N 2.89Å
170V98Very high97.9Very high2 Ų256.7 Ų56.71%0.01230%0.301CS..SBendtrans-59.9119.8165.9174.80000108.5W135 F140 A143 W165 T174W135-V170 HydrophobicContact CH2-CG1 3.72Å; W135-V170 HydrophobicContact CZ3-CG1 4.07Å; F140-V170 HydrophobicContact CD2-CG1 4.07Å; F140-V170 HydrophobicContact CE2-CB 4.15Å; F140-V170 HydrophobicContact CE2-CG1 4.11Å; F140-V170 VanDerWaalsContact CE2-O 3.27Å; F140-V170 WeakPolarHBondContact CE2-O 3.35Å; A143-V170 HydrophobicContact CB-CG1 4.19Å; A143-V170 HydrophobicContact CB-CG2 4.27Å; W165-V170 HydrophobicContact CD2-CG2 4.44Å; W165-V170 HydrophobicContact CG-CG2 4.38Å; W165-V170 HydrophobicContact CZ2-CG2 4.36Å; V170-T174 HydrophobicContact CG1-CG2 4.18Å; V170-T174 HydrophobicContact CG2-CG2 4.49Å
171D97.7Very high98Very high85 Ų8559.3 Ų59.346%0.45531%0.31SS..SBendtrans-157.5-162.2-178.3-164.33.8000110.4S169 A173 T174 L175S169-D171 PolarHBondContact O-N 2.89Å; D171-A173 VanDerWaalsContact C-N 3.34Å; D171-A173 PolarHBondContact O-N 3.4Å; D171-T174 PolarHBondContact N-OG1 3.14Å; D171-T174 WeakPolarHBondContact O-CA 3.45Å; D171-T174 VanDerWaalsContact O-CB 3.24Å; D171-T174 WeakPolarHBondContact O-CB 3.2Å; D171-T174 PolarHBondContact O-N 3.26Å; D171-T174 PolarHBondContact O-OG1 2.75Å; D171-L175 PolarHBondContact O-N 2.94Å
172K97.6Very high98Very high103 Ų10360.4 Ų60.445%0.44832%0.315SS..Hα-helixtrans-45.7-50.1-178.6179.9169.4174.9159.40114.2D58 T59 T174 L175 T176D58-K172 WeakPolarHBondContact OD2-CE 3.44Å; D58-K172 IonicContact OD2-NZ 3.44Å; D58-K172 PolarHBondContact OD2-NZ 3.5Å; T59-K172 HydrophobicContact CG2-CB 4.04Å; K172-T174 PolarHBondContact O-N 3.39Å; K172-L175 PolarHBondContact O-N 3.28Å; K172-T176 PolarHBondContact O-N 2.84Å; K172-T176 PolarHBondContact O-OG1 3.26Å; K172-T176 VanDerWaalsContact O-OG1 3.06Å
173A97.9Very high98Very high44 Ų4460 Ų6036%0.36431%0.312SS..Hα-helixtrans-59.9-35.3179.300000112.3D171 R177D171-A173 VanDerWaalsContact C-N 3.34Å; D171-A173 PolarHBondContact O-N 3.4Å; A173-R177 VanDerWaalsContact O-CG 3.32Å; A173-R177 WeakPolarHBondContact O-CG 3.45Å; A173-R177 PolarHBondContact O-N 2.93Å; A173-R177 PolarHBondContact O-NE 2.92Å
174T98.3Very high98Very high0 Ų055.3 Ų55.30%030%0.3CS..Hα-helixtrans-71.3-45.4177-41.30000111.4W165 V170 D171 K172 R177 F178W165-T174 WeakPolarHBondContact CA-OG1 3.46Å; W165-T174 PolarHBondContact O-N 3.24Å; W165-T174 PolarHBondContact O-OG1 2.79Å; V170-T174 HydrophobicContact CG1-CG2 4.18Å; V170-T174 HydrophobicContact CG2-CG2 4.49Å; D171-T174 PolarHBondContact N-OG1 3.14Å; D171-T174 WeakPolarHBondContact O-CA 3.45Å; D171-T174 VanDerWaalsContact O-CB 3.24Å; D171-T174 WeakPolarHBondContact O-CB 3.2Å; D171-T174 PolarHBondContact O-N 3.26Å; D171-T174 PolarHBondContact O-OG1 2.75Å; K172-T174 PolarHBondContact O-N 3.39Å; T174-R177 VanDerWaalsContact O-CG 3.23Å; T174-R177 WeakPolarHBondContact O-CG 3.3Å; T174-F178 HydrophobicContact CG2-CD1 4.18Å; T174-F178 HydrophobicContact CG2-CD2 4.5Å; T174-F178 HydrophobicContact CG2-CE1 3.91Å; T174-F178 HydrophobicContact CG2-CE2 4.26Å; T174-F178 HydrophobicContact CG2-CG 4.46Å; T174-F178 HydrophobicContact CG2-CZ 3.96Å; T174-F178 VanDerWaalsContact O-CB 3.31Å; T174-F178 WeakPolarHBondContact O-CB 3.48Å; T174-F178 WeakPolarHBondContact O-CD1 3.2Å; T174-F178 WeakPolarHBondContact O-CG 3.44Å; T174-F178 PolarHBondContact O-N 2.71Å
175L98.6Very high98.1Very high0 Ų055 Ų550%030%0.298CS..Hα-helixtrans-63.4-46.7-179.4-178.256.2000112T59 A62 L133 W135 D171 K172 R177 F178 F179T59-L175 HydrophobicContact CG2-CB 4.39Å; T59-L175 HydrophobicContact CG2-CD2 3.92Å; A62-L175 HydrophobicContact CB-CD2 3.65Å; L133-L175 HydrophobicContact CD2-CD1 4.16Å; W135-L175 HydrophobicContact CD2-CD1 4.46Å; W135-L175 HydrophobicContact CD2-CD2 3.83Å; W135-L175 HydrophobicContact CE3-CB 4.2Å; W135-L175 HydrophobicContact CE3-CD1 3.61Å; W135-L175 HydrophobicContact CE3-CD2 3.76Å; W135-L175 HydrophobicContact CE3-CG 4.06Å; W135-L175 HydrophobicContact CG-CD2 4.21Å; W135-L175 HydrophobicContact CH2-CB 4.12Å; W135-L175 HydrophobicContact CZ3-CB 3.77Å; W135-L175 HydrophobicContact CZ3-CD1 3.9Å; W135-L175 HydrophobicContact CZ3-CD2 4.16Å; W135-L175 HydrophobicContact CZ3-CG 4.15Å; D171-L175 PolarHBondContact O-N 2.94Å; K172-L175 PolarHBondContact O-N 3.28Å; L175-R177 PolarHBondContact O-N 3.42Å; L175-F178 PolarHBondContact O-N 3.18Å; L175-F179 PolarHBondContact O-N 2.89Å
176T98.5Very high98.1Very high61 Ų6154.8 Ų54.837%0.37430%0.3SS..Hα-helixtrans-62.7-42.4-179-52.10000111.9S57 K172 A180S57-T176 PolarHBondContact O-OG1 2.91Å; K172-T176 PolarHBondContact O-N 2.84Å; K172-T176 PolarHBondContact O-OG1 3.26Å; K172-T176 VanDerWaalsContact O-OG1 3.06Å; T176-A180 PolarHBondContact O-N 3.45Å
177R98.2Very high98.2Very high73 Ų7357.9 Ų57.928%0.27530%0.302SS..Hα-helixtrans-72.6-35.9177.473.8-174.764-165.5-12.3112.4W163 I164 A173 T174 L175 F179 A180 F181W163-R177 PolarHBondContact O-NH1 3.36Å; I164-R177 VanDerWaalsContact C-NH1 3.32Å; I164-R177 WeakPolarHBondContact O-CD 3.36Å; I164-R177 PolarHBondContact O-NH1 3.48Å; A173-R177 VanDerWaalsContact O-CG 3.32Å; A173-R177 WeakPolarHBondContact O-CG 3.45Å; A173-R177 PolarHBondContact O-N 2.93Å; A173-R177 PolarHBondContact O-NE 2.92Å; T174-R177 VanDerWaalsContact O-CG 3.23Å; T174-R177 WeakPolarHBondContact O-CG 3.3Å; L175-R177 PolarHBondContact O-N 3.42Å; R177-F179 VanDerWaalsContact C-N 3.28Å; R177-F179 PolarHBondContact O-N 3.38Å; R177-A180 PolarHBondContact O-N 3.31Å; R177-A180 VanDerWaalsContact O-N 3.16Å; R177-F181 HydrophobicContact CB-CD2 4.37Å; R177-F181 HydrophobicContact CB-CE2 4.25Å; R177-F181 HydrophobicContact CG-CE2 4.46Å; R177-F181 WeakPolarHBondContact O-CD2 3.35Å; R177-F181 PolarHBondContact O-N 2.9Å
178F98.6Very high98.3Very high10 Ų1060.1 Ų60.14%0.04431%0.306CS..Hα-helixtrans-64.5-37176.8-84.922000110.7F128 M129 V132 L133 T147 I164 T174 L175 F181 H182F128-F178 AromaticContact CE1-CE2 3.89Å; F128-F178 HydrophobicContact CE1-CE2 3.89Å; F128-F178 HydrophobicContact CE1-CZ 4.23Å; F128-F178 HydrophobicContact CZ-CE2 4.47Å; M129-F178 HydrophobicContact CB-CB 4.4Å; M129-F178 HydrophobicContact CB-CD2 4.35Å; M129-F178 HydrophobicContact CB-CG 4.43Å; M129-F178 HydrophobicContact CG-CB 4.37Å; M129-F178 HydrophobicContact CG-CD1 4.28Å; M129-F178 HydrophobicContact CG-CD2 3.9Å; M129-F178 HydrophobicContact CG-CE2 4.22Å; M129-F178 HydrophobicContact CG-CG 3.94Å; M129-F178 HydrophobicContact SD-CD1 4.37Å; M129-F178 HydrophobicContact SD-CG 4.5Å; V132-F178 HydrophobicContact CB-CD2 3.92Å; V132-F178 HydrophobicContact CG1-CD2 3.98Å; V132-F178 HydrophobicContact CG2-CD2 3.83Å; V132-F178 HydrophobicContact CG2-CE2 4Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; T147-F178 HydrophobicContact CG2-CZ 4.11Å; I164-F178 HydrophobicContact CG2-CE1 4.26Å; I164-F178 HydrophobicContact CG2-CZ 4.48Å; T174-F178 HydrophobicContact CG2-CD1 4.18Å; T174-F178 HydrophobicContact CG2-CD2 4.5Å; T174-F178 HydrophobicContact CG2-CE1 3.91Å; T174-F178 HydrophobicContact CG2-CE2 4.26Å; T174-F178 HydrophobicContact CG2-CG 4.46Å; T174-F178 HydrophobicContact CG2-CZ 3.96Å; T174-F178 VanDerWaalsContact O-CB 3.31Å; T174-F178 WeakPolarHBondContact O-CB 3.48Å; T174-F178 WeakPolarHBondContact O-CD1 3.2Å; T174-F178 WeakPolarHBondContact O-CG 3.44Å; T174-F178 PolarHBondContact O-N 2.71Å; L175-F178 PolarHBondContact O-N 3.18Å; F178-F181 PolarHBondContact O-N 2.7Å; F178-H182 WeakPolarHBondContact O-CB 3.42Å; F178-H182 PolarHBondContact O-N 3.42Å
179F98.8Very high98.4Very high46 Ų4651.9 Ų51.920%0.20227%0.27CS..Hα-helixtrans-59.6-48.7169.9176.7-111.3000111.9A52 Y55 L133 L175 R177 F181 H182 F183A52-F179 HydrophobicContact CB-CE2 4.28Å; A52-F179 HydrophobicContact CB-CZ 4.1Å; Y55-F179 AromaticContact CD1-CD2 3.69Å; Y55-F179 HydrophobicContact CD1-CD2 3.69Å; Y55-F179 AromaticContact CD1-CE2 3.6Å; Y55-F179 HydrophobicContact CD1-CE2 3.6Å; Y55-F179 HydrophobicContact CD1-CG 4.37Å; Y55-F179 HydrophobicContact CD1-CZ 4.22Å; Y55-F179 HydrophobicContact CE1-CB 4.37Å; Y55-F179 AromaticContact CE1-CD2 3.56Å; Y55-F179 HydrophobicContact CE1-CD2 3.56Å; Y55-F179 AromaticContact CE1-CE2 4Å; Y55-F179 HydrophobicContact CE1-CE2 4Å; Y55-F179 AromaticContact CE1-CG 3.98Å; Y55-F179 HydrophobicContact CE1-CG 3.98Å; L133-F179 HydrophobicContact CD1-CD2 3.99Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L133-F179 HydrophobicContact CD2-CD2 4.46Å; L175-F179 PolarHBondContact O-N 2.89Å; R177-F179 VanDerWaalsContact C-N 3.28Å; R177-F179 PolarHBondContact O-N 3.38Å; F179-F181 PolarHBondContact O-N 3.32Å; F179-H182 PolarHBondContact O-N 3.26Å; F179-F183 HydrophobicContact CZ-CD2 4.44Å; F179-F183 WeakPolarHBondContact O-CB 3.38Å; F179-F183 PolarHBondContact O-N 3.37Å
180A98.8Very high98.5Very high56 Ų5650.3 Ų50.346%0.46326%0.261SS..Hα-helixtrans-60.4-44.9178.700000112.7T176 R177 F183 I184T176-A180 PolarHBondContact O-N 3.45Å; R177-A180 PolarHBondContact O-N 3.31Å; R177-A180 VanDerWaalsContact O-N 3.16Å; A180-F183 PolarHBondContact O-N 2.87Å; A180-I184 WeakPolarHBondContact O-CG2 3.35Å; A180-I184 PolarHBondContact O-N 2.9Å; A180-I184 VanDerWaalsContact O-N 3.12Å
181F98.8Very high98.5Very high111 Ų11152.8 Ų52.849%0.48728%0.282SS..Hα-helixtrans-66.9-43.7176.9-74.2-57.7000112.6M129 R177 F178 F179 F183 I184 L185M129-F181 HydrophobicContact CE-CB 4.2Å; M129-F181 HydrophobicContact SD-CB 3.44Å; M129-F181 WeakPolarHBondContact SD-CB 3.33Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.28Å; R177-F181 HydrophobicContact CB-CD2 4.37Å; R177-F181 HydrophobicContact CB-CE2 4.25Å; R177-F181 HydrophobicContact CG-CE2 4.46Å; R177-F181 WeakPolarHBondContact O-CD2 3.35Å; R177-F181 PolarHBondContact O-N 2.9Å; F178-F181 PolarHBondContact O-N 2.7Å; F179-F181 PolarHBondContact O-N 3.32Å; F181-F183 PolarHBondContact O-N 2.95Å; F181-I184 PolarHBondContact O-N 3.34Å; F181-L185 WeakPolarHBondContact O-CB 3.45Å; F181-L185 VanDerWaalsContact O-CG 3.31Å; F181-L185 WeakPolarHBondContact O-CG 3.48Å; F181-L185 PolarHBondContact O-N 3.31Å
182H98.8Very high98.6Very high27 Ų2750.6 Ų50.613%0.12527%0.27CS..Hα-helixtrans-60.7-34.5175.5-179.870.6000111.9H83 T126 M129 G130 L133 F178 F179 P186H83-H182 AromaticContact NE2-NE2 3.97Å; T126-H182 PolarHBondContact O-CE1 2.76Å; T126-H182 PolarHBondContact O-ND1 3Å; M129-H182 HydrophobicContact CB-CB 4.09Å; G130-H182 WeakPolarHBondContact CA-CE1 3.31Å; G130-H182 WeakPolarHBondContact CA-ND1 3.33Å; G130-H182 PolarHBondContact N-ND1 3.33Å; L133-H182 HydrophobicContact CD1-CB 4.23Å; L133-H182 VanDerWaalsContact CD1-CD2 3.46Å; L133-H182 WeakPolarHBondContact CD1-CD2 3.33Å; F178-H182 WeakPolarHBondContact O-CB 3.42Å; F178-H182 PolarHBondContact O-N 3.42Å; F179-H182 PolarHBondContact O-N 3.26Å; H182-P186 WeakPolarHBondContact O-CD 3.21Å; H182-P186 WeakPolarHBondContact O-CG 3.46Å
183F98.8Very high98.6Very high83 Ų8347 Ų4736%0.36426%0.26SS..Hα-helixtrans-71-43.1177.2-167.3-84.3000112.5L49 A52 F179 A180 F181 F187L49-F183 HydrophobicContact CD1-CE2 4.24Å; L49-F183 HydrophobicContact CD1-CZ 4.09Å; A52-F183 HydrophobicContact CB-CD2 4.31Å; A52-F183 HydrophobicContact CB-CE2 4.03Å; F179-F183 HydrophobicContact CZ-CD2 4.44Å; F179-F183 WeakPolarHBondContact O-CB 3.38Å; F179-F183 PolarHBondContact O-N 3.37Å; A180-F183 PolarHBondContact O-N 2.87Å; F181-F183 PolarHBondContact O-N 2.95Å; F183-F187 HydrophobicContact CD1-CE2 4.09Å; F183-F187 AromaticContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CZ 4.46Å; F183-F187 HydrophobicContact CZ-CE2 4.5Å; F183-F187 VanDerWaalsContact O-CD2 3.28Å; F183-F187 WeakPolarHBondContact O-CD2 3.33Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.37Å
184I98.8Very high98.7Very high90 Ų9050.7 Ų50.746%0.46227%0.272SS..Hα-helixtrans-80.4-33.4-174.9-166.4157.1000113.9A180 F181 F187 I188A180-I184 WeakPolarHBondContact O-CG2 3.35Å; A180-I184 PolarHBondContact O-N 2.9Å; A180-I184 VanDerWaalsContact O-N 3.12Å; F181-I184 PolarHBondContact O-N 3.34Å; I184-F187 PolarHBondContact O-N 3.13Å; I184-F187 VanDerWaalsContact O-N 3.11Å; I184-I188 HydrophobicContact CG1-CD1 4.36Å; I184-I188 PolarHBondContact O-N 3.14Å
185L98.7Very high98.7Very high29 Ų2953.3 Ų53.315%0.15229%0.288CS..Hα-helixtrans-60.7-38.4-174.9-80167.1000115.2A125 T126 M129 F181 F187 I188 I189A125-L185 HydrophobicContact CB-CD1 4.4Å; T126-L185 HydrophobicContact CG2-CB 4.43Å; T126-L185 WeakPolarHBondContact OG1-CB 3.48Å; M129-L185 HydrophobicContact CE-CD1 3.2Å; F181-L185 WeakPolarHBondContact O-CB 3.45Å; F181-L185 VanDerWaalsContact O-CG 3.31Å; F181-L185 WeakPolarHBondContact O-CG 3.48Å; F181-L185 PolarHBondContact O-N 3.31Å; L185-F187 PolarHBondContact O-N 3.39Å; L185-I188 HydrophobicContact CD2-CD1 4.15Å; L185-I188 CarbonylContact O-C 2.87Å; L185-I188 WeakPolarHBondContact O-CA 3.12Å; L185-I188 WeakPolarHBondContact O-CB 3.5Å; L185-I188 PolarHBondContact O-N 3.11Å; L185-I189 WeakPolarHBondContact O-CG1 3.44Å; L185-I189 PolarHBondContact O-N 3.47Å
186P98.8Very high98.7Very high18 Ų1854.7 Ų54.712%0.11729%0.294CS..Hα-helixtrans-54-34.4173.1-2934.7000113.9L41 I45 T126 H182 I189 A190L41-P186 HydrophobicContact CD1-CB 4.49Å; I45-P186 HydrophobicContact CD1-CB 4.26Å; I45-P186 HydrophobicContact CG1-CB 3.74Å; T126-P186 HydrophobicContact CG2-CG 3.87Å; H182-P186 WeakPolarHBondContact O-CD 3.21Å; H182-P186 WeakPolarHBondContact O-CG 3.46Å; P186-I189 PolarHBondContact O-N 3.22Å; P186-A190 PolarHBondContact O-N 3.03Å
187F98.7Very high98.7Very high105 Ų10555.8 Ų55.846%0.46130%0.297SS..Hα-helixtrans-75.4-35176.4-57.8-76.4000112.2I45 F183 I184 L185 I189 A190 A191I45-F187 HydrophobicContact CG2-CE1 4.11Å; I45-F187 HydrophobicContact CG2-CZ 4.27Å; F183-F187 HydrophobicContact CD1-CE2 4.09Å; F183-F187 AromaticContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CZ 4.46Å; F183-F187 HydrophobicContact CZ-CE2 4.5Å; F183-F187 VanDerWaalsContact O-CD2 3.28Å; F183-F187 WeakPolarHBondContact O-CD2 3.33Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.37Å; I184-F187 PolarHBondContact O-N 3.13Å; I184-F187 VanDerWaalsContact O-N 3.11Å; L185-F187 PolarHBondContact O-N 3.39Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.35Å; F187-A190 PolarHBondContact O-N 3.2Å; F187-A191 PolarHBondContact O-N 2.73Å
188I98.8Very high98.7Very high77 Ų7756.8 Ų56.840%0.39531%0.308SS..Hα-helixtrans-64.5-41.6171-62.9171.6000110.1I184 L185 A190 A191 L192I184-I188 HydrophobicContact CG1-CD1 4.36Å; I184-I188 PolarHBondContact O-N 3.14Å; L185-I188 HydrophobicContact CD2-CD1 4.15Å; L185-I188 CarbonylContact O-C 2.87Å; L185-I188 WeakPolarHBondContact O-CA 3.12Å; L185-I188 WeakPolarHBondContact O-CB 3.5Å; L185-I188 PolarHBondContact O-N 3.11Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 3.32Å; I188-A191 PolarHBondContact O-N 2.81Å; I188-L192 HydrophobicContact CG2-CD1 4.23Å; I188-L192 HydrophobicContact CG2-CG 4.49Å; I188-L192 WeakPolarHBondContact O-CG 3.47Å; I188-L192 PolarHBondContact O-N 2.96Å
189I98.9Very high98.7Very high5 Ų559.7 Ų59.73%0.02632%0.32CS..Hα-helixtrans-60.2-43.2174.1-68.8161.2000110.4L41 L119 A122 V123 T126 L185 P186 F187 A191 L192 A193L41-I189 HydrophobicContact CD1-CB 4.36Å; L41-I189 HydrophobicContact CD1-CG2 3.89Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L119-I189 HydrophobicContact CD2-CG2 3.85Å; A122-I189 HydrophobicContact CB-CD1 4.2Å; A122-I189 HydrophobicContact CB-CG1 3.63Å; V123-I189 HydrophobicContact CG2-CD1 3.84Å; V123-I189 HydrophobicContact CG2-CG1 4.36Å; V123-I189 HydrophobicContact CG2-CG2 4.17Å; T126-I189 VanDerWaalsContact OG1-CD1 3.3Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.08Å; L185-I189 WeakPolarHBondContact O-CG1 3.44Å; L185-I189 PolarHBondContact O-N 3.47Å; P186-I189 PolarHBondContact O-N 3.22Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 3.47Å; I189-L192 PolarHBondContact O-N 3.32Å; I189-A193 WeakPolarHBondContact O-CB 3.45Å; I189-A193 PolarHBondContact O-N 3.04Å
190A98.8Very high98.6Very high32 Ų3259.1 Ų59.126%0.26432%0.319SS..Hα-helixtrans-60.2-42.9175.700000112L41 P186 F187 I188 A193 I194L41-A190 HydrophobicContact CD2-CB 4.01Å; P186-A190 PolarHBondContact O-N 3.03Å; F187-A190 WeakPolarHBondContact O-CB 3.35Å; F187-A190 PolarHBondContact O-N 3.2Å; I188-A190 VanDerWaalsContact C-N 3.33Å; I188-A190 PolarHBondContact O-N 3.32Å; A190-A193 PolarHBondContact O-N 3.24Å; A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.25Å; A190-I194 VanDerWaalsContact O-N 3.12Å
191A98.8Very high98.6Very high53 Ų5359.7 Ų59.744%0.43831%0.312SS..Hα-helixtrans-64-44.9175.300000112.2F187 I188 I189 A193 I194 V195F187-A191 PolarHBondContact O-N 2.73Å; I188-A191 PolarHBondContact O-N 2.81Å; I189-A191 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 3.47Å; A191-A193 VanDerWaalsContact C-N 3.3Å; A191-A193 PolarHBondContact O-N 2.78Å; A191-I194 WeakPolarHBondContact O-CB 3.25Å; A191-I194 PolarHBondContact O-N 3.48Å; A191-V195 PolarHBondContact O-N 3.05Å; A191-V195 VanDerWaalsContact O-N 3.14Å
192L98.7Very high98.5Very high40 Ų4061.6 Ų61.621%0.20932%0.323CS..Hα-helixtrans-62.8-35.4175.2-73.4174.1000112.2L119 A122 I188 I189 I194 V195 H196L119-L192 HydrophobicContact CD2-CB 3.53Å; L119-L192 HydrophobicContact CD2-CD1 4.48Å; L119-L192 HydrophobicContact CG-CB 4.03Å; A122-L192 HydrophobicContact CB-CD1 4.44Å; I188-L192 HydrophobicContact CG2-CD1 4.23Å; I188-L192 HydrophobicContact CG2-CG 4.49Å; I188-L192 WeakPolarHBondContact O-CG 3.47Å; I188-L192 PolarHBondContact O-N 2.96Å; I189-L192 PolarHBondContact O-N 3.32Å; L192-I194 VanDerWaalsContact C-N 3.34Å; L192-V195 PolarHBondContact O-N 3.45Å; L192-H196 WeakPolarHBondContact O-CB 3.47Å; L192-H196 PolarHBondContact O-N 3.16Å
193A98.8Very high98.3Very high28 Ų2863.8 Ų63.823%0.23134%0.338CS..Hα-helixtrans-66.5-35.4176.200000111.9L119 I189 A190 A191 H196 L197L119-A193 HydrophobicContact CD2-CB 4.42Å; I189-A193 WeakPolarHBondContact O-CB 3.45Å; I189-A193 PolarHBondContact O-N 3.04Å; A190-A193 PolarHBondContact O-N 3.24Å; A191-A193 VanDerWaalsContact C-N 3.3Å; A191-A193 PolarHBondContact O-N 2.78Å; A193-H196 WeakPolarHBondContact O-CB 3.41Å; A193-H196 PolarHBondContact O-N 3.43Å; A193-L197 WeakPolarHBondContact O-CG 3.43Å; A193-L197 PolarHBondContact O-N 2.69Å
194I98.5Very high98.2Very high120 Ų12060.4 Ų60.462%0.61533%0.327SS*.Hα-helixtrans-63.4-45.1171.7-66.5166.2000110.3A190 A191 L192 H196 L197 L198A190-I194 WeakPolarHBondContact O-CG1 3.49Å; A190-I194 PolarHBondContact O-N 3.25Å; A190-I194 VanDerWaalsContact O-N 3.12Å; A191-I194 WeakPolarHBondContact O-CB 3.25Å; A191-I194 PolarHBondContact O-N 3.48Å; L192-I194 VanDerWaalsContact C-N 3.34Å; I194-H196 VanDerWaalsContact C-N 3.33Å; I194-H196 PolarHBondContact O-N 2.82Å; I194-L197 PolarHBondContact O-N 2.89Å; I194-L198 WeakPolarHBondContact O-CB 3.2Å; I194-L198 PolarHBondContact O-N 3.07Å
195V98.7Very high98.1Very high56 Ų5657.9 Ų57.934%0.33932%0.317SS..Hα-helixtrans-63.2-39.71761770000111.4I115 A191 L192 L197 L198 F199I115-V195 HydrophobicContact CD1-CG1 4Å; I115-V195 HydrophobicContact CG1-CG1 4.22Å; A191-V195 PolarHBondContact O-N 3.05Å; A191-V195 VanDerWaalsContact O-N 3.14Å; L192-V195 PolarHBondContact O-N 3.45Å; V195-L197 PolarHBondContact O-N 2.93Å; V195-L198 WeakPolarHBondContact O-CB 3.5Å; V195-L198 PolarHBondContact O-N 3.07Å; V195-F199 HydrophobicContact CG1-CD2 3.89Å; V195-F199 HydrophobicContact CG1-CE2 3.68Å; V195-F199 WeakPolarHBondContact O-CD2 3.4Å; V195-F199 PolarHBondContact O-N 3.33Å; V195-F199 VanDerWaalsContact O-N 3.1Å
196H98.7Very high98.1Very high29 Ų2956.9 Ų56.913%0.13431%0.311CS..Hα-helixtrans-59.3-46.4175.6-173.477.6000111.9T112 I115 L119 L192 A193 I194 L200T112-H196 VanDerWaalsContact CG2-CE1 3.42Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.33Å; T112-H196 PolarHBondContact O-CE1 2.83Å; T112-H196 PolarHBondContact O-ND1 3.11Å; I115-H196 HydrophobicContact CB-CB 4.47Å; I115-H196 HydrophobicContact CG2-CB 3.65Å; L119-H196 HydrophobicContact CD1-CB 3.8Å; L192-H196 WeakPolarHBondContact O-CB 3.47Å; L192-H196 PolarHBondContact O-N 3.16Å; A193-H196 WeakPolarHBondContact O-CB 3.41Å; A193-H196 PolarHBondContact O-N 3.43Å; I194-H196 VanDerWaalsContact C-N 3.33Å; I194-H196 PolarHBondContact O-N 2.82Å; H196-L200 WeakPolarHBondContact O-CB 3.17Å; H196-L200 PolarHBondContact O-N 3.31Å
197L98.3Very high98.1Very high84 Ų8456.1 Ų56.144%0.4431%0.307SS..Hα-helixtrans-69.7-32.9177.3-70173.5000112.4A193 I194 V195 L200 H201A193-L197 WeakPolarHBondContact O-CG 3.43Å; A193-L197 PolarHBondContact O-N 2.69Å; I194-L197 PolarHBondContact O-N 2.89Å; V195-L197 PolarHBondContact O-N 2.93Å; L197-L200 HydrophobicContact CD2-CD2 4.11Å; L197-L200 PolarHBondContact O-N 3.3Å; L197-H201 WeakPolarHBondContact O-CB 3.2Å; L197-H201 PolarHBondContact O-CD2 3.47Å; L197-H201 PolarHBondContact O-N 2.88Å
198L98.1Very high98.1Very high94 Ų9451.9 Ų51.949%0.49229%0.289SS..Hα-helixtrans-59.1-54.3174.3-174.2159.4000110.4I194 V195 L200 H201 E202I194-L198 WeakPolarHBondContact O-CB 3.2Å; I194-L198 PolarHBondContact O-N 3.07Å; V195-L198 WeakPolarHBondContact O-CB 3.5Å; V195-L198 PolarHBondContact O-N 3.07Å; L198-L200 VanDerWaalsContact C-N 3.28Å; L198-L200 PolarHBondContact O-N 3.06Å; L198-H201 PolarHBondContact O-N 3.49Å; L198-H201 VanDerWaalsContact O-N 3.08Å; L198-E202 PolarHBondContact O-N 2.85Å
199F98.5Very high98Very high71 Ų7149.9 Ų49.931%0.31128%0.281SS..Hα-helixtrans-62.8-35177.1-75.5-62.4000112.7E111 T112 I115 V195 H201 E202E111-F199 HydrophobicContact CB-CB 4.08Å; E111-F199 HydrophobicContact CB-CD1 3.51Å; E111-F199 HydrophobicContact CB-CD2 3.96Å; E111-F199 HydrophobicContact CB-CE1 3.82Å; E111-F199 HydrophobicContact CB-CE2 4.22Å; E111-F199 HydrophobicContact CB-CG 3.59Å; E111-F199 HydrophobicContact CB-CZ 4.16Å; E111-F199 HydrophobicContact CG-CD1 3.96Å; E111-F199 HydrophobicContact CG-CE1 3.88Å; E111-F199 HydrophobicContact CG-CZ 4.35Å; T112-F199 VanDerWaalsContact OG1-C 3.27Å; T112-F199 WeakPolarHBondContact OG1-CB 3.43Å; I115-F199 HydrophobicContact CG1-CD2 4.07Å; I115-F199 HydrophobicContact CG1-CE2 4.19Å; V195-F199 HydrophobicContact CG1-CD2 3.89Å; V195-F199 HydrophobicContact CG1-CE2 3.68Å; V195-F199 WeakPolarHBondContact O-CD2 3.4Å; V195-F199 PolarHBondContact O-N 3.33Å; V195-F199 VanDerWaalsContact O-N 3.1Å; F199-H201 VanDerWaalsContact C-N 3.29Å; F199-H201 PolarHBondContact O-N 2.88Å; F199-E202 PolarHBondContact O-N 3.46Å
200L98.1Very high98Very high34 Ų3450.3 Ų50.318%0.17829%0.287CS..Hα-helixtrans-62.4-37.7173.9179.364.2000112.1T112 H196 L197 L198 E202 T203 G204T112-L200 HydrophobicContact CG2-CB 4.1Å; T112-L200 HydrophobicContact CG2-CD1 4.43Å; T112-L200 PolarHBondContact OG1-N 3.17Å; H196-L200 WeakPolarHBondContact O-CB 3.17Å; H196-L200 PolarHBondContact O-N 3.31Å; L197-L200 HydrophobicContact CD2-CD2 4.11Å; L197-L200 PolarHBondContact O-N 3.3Å; L198-L200 VanDerWaalsContact C-N 3.28Å; L198-L200 PolarHBondContact O-N 3.06Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-T203 PolarHBondContact O-N 2.96Å; L200-T203 PolarHBondContact O-OG1 3.32Å; L200-G204 CarbonylContact O-C 3.57Å; L200-G204 VanDerWaalsContact O-CA 3.29Å; L200-G204 WeakPolarHBondContact O-CA 3.48Å; L200-G204 PolarHBondContact O-N 2.83Å
201H97.1Very high97.9Very high68 Ų6854.5 Ų54.532%0.31530%0.304SS..Hα-helixtrans-76.2-19.4-178.4-69.4172000113.5L197 L198 F199L197-H201 WeakPolarHBondContact O-CB 3.2Å; L197-H201 PolarHBondContact O-CD2 3.47Å; L197-H201 PolarHBondContact O-N 2.88Å; L198-H201 PolarHBondContact O-N 3.49Å; L198-H201 VanDerWaalsContact O-N 3.08Å; F199-H201 VanDerWaalsContact C-N 3.29Å; F199-H201 PolarHBondContact O-N 2.88Å
202E96.8Very high97.8Very high151 Ų15157.9 Ų57.971%0.70631%0.314SS*.Hα-helixtrans-63.5-40.5170.8-67.4-60.3126.700111.8L198 F199 L200L198-E202 PolarHBondContact O-N 2.85Å; F199-E202 PolarHBondContact O-N 3.46Å; L200-E202 VanDerWaalsContact C-N 3.33Å
203T94.8Very high97.7Very high73 Ų7356.9 Ų56.945%0.44831%0.311SS..Hα-helixtrans-98.1-23.6-179.761.30000113.7F109 L200F109-T203 HydrophobicContact CD1-CG2 4.06Å; F109-T203 HydrophobicContact CE1-CG2 4.11Å; L200-T203 PolarHBondContact O-N 2.96Å; L200-T203 PolarHBondContact O-OG1 3.32Å
204G96.2Very high97.7Very high12 Ų1260.2 Ų60.212%0.12433%0.325CS..  trans74.5173.3-162.100000112.8L200L200-G204 CarbonylContact O-C 3.57Å; L200-G204 VanDerWaalsContact O-CA 3.29Å; L200-G204 WeakPolarHBondContact O-CA 3.48Å; L200-G204 PolarHBondContact O-N 2.83Å
205S97.4Very high97.6Very high37 Ų3759.8 Ų59.826%0.25934%0.339SS..  trans-69.7141.6179.9-75.60000112.6P24P24-S205 WeakPolarHBondContact CG-O 3.4Å
206N98.1Very high97.6Very high7 Ų761.4 Ų61.44%0.03735%0.346CS..  trans-67.2173.5161-172.325000110.1I27 W31 Y104 S106 F109 R313I27-N206 WeakPolarHBondContact CG2-O 3.43Å; W31-N206 VanDerWaalsContact CE2-O 3.24Å; W31-N206 HydrophobicContact CZ2-CB 4.29Å; W31-N206 VanDerWaalsContact CZ2-O 3.24Å; W31-N206 WeakPolarHBondContact CZ2-O 3.45Å; W31-N206 PolarHBondContact NE1-O 3.33Å; Y104-N206 PolarHBondContact O-ND2 3.4Å; S106-N206 PolarHBondContact OG-ND2 2.9Å; F109-N206 HydrophobicContact CE2-CB 3.78Å; F109-N206 HydrophobicContact CZ-CB 4.25Å; N206-R313 PolarHBondContact ND2-NE 3.4Å; N206-R313 PolarHBondContact OD1-NH1 3.04Å; N206-R313 VanDerWaalsContact OD1-NH1 3.14Å
207N98.6Very high97.5Very high3 Ų363.5 Ų63.52%0.01636%0.355CS..  trans-141.1168.9176.172.278.8000112.6P24 N26 I27 T209 G210 L211P24-N207 HydrophobicContact CB-CB 3.8Å; P24-N207 HydrophobicContact CG-CB 4.1Å; N26-N207 PolarHBondContact ND2-OD1 3.44Å; N26-N207 WeakPolarHBondContact OD1-CB 3.42Å; I27-N207 HydrophobicContact CG2-CB 4.04Å; N207-T209 VanDerWaalsContact C-N 3.27Å; N207-T209 PolarHBondContact O-N 3.34Å; N207-T209 VanDerWaalsContact O-N 3.16Å; N207-T209 PolarHBondContact OD1-N 2.84Å; N207-T209 VanDerWaalsContact OD1-N 3.11Å; N207-T209 PolarHBondContact OD1-OG1 3.23Å; N207-G210 PolarHBondContact O-N 2.95Å; N207-L211 PolarHBondContact ND2-O 3.2Å
208P98.6Very high97.6Very high15 Ų1561.1 Ų61.110%0.09734%0.342CS..THydrogen-bonded Turntrans-57.9-31-172.4-30.237.7000116N26 W31 Y104 G210 S314N26-P208 VanDerWaalsContact O-CD 3.28Å; N26-P208 WeakPolarHBondContact O-CD 3.14Å; N26-P208 WeakPolarHBondContact O-CG 3.26Å; W31-P208 HydrophobicContact CH2-CG 4.1Å; W31-P208 HydrophobicContact CZ3-CG 3.85Å; Y104-P208 HydrophobicContact CD1-CB 4.24Å; Y104-P208 WeakPolarHBondContact CD1-O 3.46Å; Y104-P208 HydrophobicContact CE1-CB 3.7Å; Y104-P208 HydrophobicContact CE1-CG 4.45Å; P208-G210 VanDerWaalsContact C-N 3.31Å; P208-S314 WeakPolarHBondContact O-CB 3.27Å; P208-S314 PolarHBondContact O-OG 3.24Å
209T98.2Very high97.6Very high36 Ų3659.4 Ų59.422%0.22134%0.336CS..THydrogen-bonded Turntrans-78.9-19.6-179.470.70000112N207 L211 M316N207-T209 VanDerWaalsContact C-N 3.27Å; N207-T209 PolarHBondContact O-N 3.34Å; N207-T209 VanDerWaalsContact O-N 3.16Å; N207-T209 PolarHBondContact OD1-N 2.84Å; N207-T209 VanDerWaalsContact OD1-N 3.11Å; N207-T209 PolarHBondContact OD1-OG1 3.23Å; T209-L211 PolarHBondContact O-N 2.76Å; T209-L211 PolarHBondContact OG1-N 3.46Å; T209-M316 HydrophobicContact CG2-SD 4.08Å
210G97.4Very high97.6Very high14 Ų1457.3 Ų57.314%0.14433%0.327CS..  trans71.58.6-174.800000114.3N207 P208N207-G210 PolarHBondContact O-N 2.95Å; P208-G210 VanDerWaalsContact C-N 3.31Å
211L96.9Very high97.6Very high119 Ų11960.2 Ų60.262%0.62334%0.34SS*.SBendtrans-90.5163.2176.2-59176.9000111.3N207 T209 S213N207-L211 PolarHBondContact ND2-O 3.2Å; T209-L211 PolarHBondContact O-N 2.76Å; T209-L211 PolarHBondContact OG1-N 3.46Å; L211-S213 PolarHBondContact O-N 3.13Å
212N97.4Very high97.6Very high124 Ų12460.1 Ų60.166%0.66335%0.345SS*.  trans-63.8127.8171.8-174.9-27.8000109.7D214N212-D214 PolarHBondContact ND2-OD2 3.45Å; N212-D214 WeakPolarHBondContact OD1-CB 3.39Å; N212-D214 PolarHBondContact OD1-N 3.21Å; N212-D214 PolarHBondContact OD1-OD2 3.03Å; N212-D214 VanDerWaalsContact OD1-OD2 3.07Å
213S97.2Very high97.7Very high19 Ų1958.9 Ų58.913%0.13334%0.335CS..  trans-10611.9-178.962.50000114.3P24 L211 A215 D216 K217P24-S213 WeakPolarHBondContact CB-OG 3.34Å; P24-S213 WeakPolarHBondContact CG-OG 3.5Å; L211-S213 PolarHBondContact O-N 3.13Å; S213-A215 PolarHBondContact O-N 3.37Å; S213-D216 CarbonylContact O-C 3.54Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 2.9Å; S213-K217 WeakPolarHBondContact O-CG 3.25Å
214D97.6Very high97.9Very high99 Ų9955.9 Ų55.953%0.52932%0.315SS..THydrogen-bonded Turntrans-58.2-30.2-179-69.8-25.2000112.6N212 D216 K217N212-D214 PolarHBondContact ND2-OD2 3.45Å; N212-D214 WeakPolarHBondContact OD1-CB 3.39Å; N212-D214 PolarHBondContact OD1-N 3.21Å; N212-D214 PolarHBondContact OD1-OD2 3.03Å; N212-D214 VanDerWaalsContact OD1-OD2 3.07Å; D214-D216 PolarHBondContact O-N 3Å; D214-K217 WeakPolarHBondContact OD1-CE 3.38Å; D214-K217 IonicContact OD1-NZ 2.79Å; D214-K217 PolarHBondContact OD1-NZ 3.2Å
215A97.3Very high98Very high110 Ų11056.2 Ų56.291%0.90932%0.315SS*.THydrogen-bonded Turntrans-67.7-21.3175.900000113.6S213S213-A215 PolarHBondContact O-N 3.37Å
216D97.8Very high98Very high91 Ų9159.8 Ų59.849%0.48733%0.33SS..SBendtrans-143.975.6-177.6-173.120.9000111.4S25 S213 D214S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.37Å; S25-D216 PolarHBondContact N-O 3.16Å; S25-D216 VanDerWaalsContact N-O 3.13Å; S25-D216 PolarHBondContact OG-OD2 3.26Å; S213-D216 CarbonylContact O-C 3.54Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 2.9Å; D214-D216 PolarHBondContact O-N 3Å
217K98.1Very high98.1Very high73 Ų7362 Ų6232%0.31734%0.339SS..EExtended strand (participates in β ladder)trans-106.4140.9170.3-65.1-169.2-178.4165.30110.8P22 A23 S213 D214P22-K217 HydrophobicContact CB-CB 4.11Å; P22-K217 HydrophobicContact CB-CD 3.75Å; P22-K217 HydrophobicContact CG-CD 4.42Å; A23-K217 CarbonylContact O-C 3.53Å; A23-K217 VanDerWaalsContact O-CA 3.28Å; A23-K217 WeakPolarHBondContact O-CA 3.42Å; S213-K217 WeakPolarHBondContact O-CG 3.25Å; D214-K217 WeakPolarHBondContact OD1-CE 3.38Å; D214-K217 IonicContact OD1-NZ 2.79Å; D214-K217 PolarHBondContact OD1-NZ 3.2Å
218I98.4Very high98.1Very high34 Ų3462.8 Ų62.817%0.17434%0.344CS..EExtended strand (participates in β ladder)trans-113.3151.9172.662.4-179.9000109.4A23 Y223 Y224A23-I218 PolarHBondContact N-O 2.77Å; A23-I218 PolarHBondContact O-N 3.21Å; I218-Y223 HydrophobicContact CB-CD2 4.05Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.23Å; I218-Y223 HydrophobicContact CD1-CD2 3.92Å; I218-Y223 HydrophobicContact CD1-CG 3.71Å; I218-Y223 HydrophobicContact CG1-CD2 4.23Å; I218-Y223 HydrophobicContact CG1-CG 4.48Å; I218-Y224 HydrophobicContact CD1-CE2 3.75Å; I218-Y224 HydrophobicContact CG1-CE2 3.78Å
219P98.1Very high98.1Very high57 Ų5766.4 Ų66.437%0.3736%0.361SS..EExtended strand (participates in β ladder)trans-63.7145.7173.128.7-35.6000110.3H221 Y223P219-H221 VanDerWaalsContact C-N 3.33Å; P219-H221 WeakPolarHBondContact CB-O 3.39Å; P219-H221 PolarHBondContact O-N 2.75Å; P219-Y223 HydrophobicContact CG-CD2 4.29Å; P219-Y223 HydrophobicContact CG-CE2 4.17Å; P219-Y223 WeakPolarHBondContact O-CD2 3.44Å
220F98.5Very high98.1Very high27 Ų2769.5 Ų69.512%0.11838%0.376CS..SBendtrans-61.4-42.2179.1-170.9-82.7000112.1F18 L21 P222 Y223 Y224 T225F18-F220 HydrophobicContact CD2-CE1 4.41Å; F18-F220 HydrophobicContact CE2-CE1 4.13Å; F18-F220 HydrophobicContact CZ-CE1 4.28Å; F18-F220 WeakPolarHBondContact O-CB 3.45Å; F18-F220 WeakPolarHBondContact O-CD1 3.19Å; L21-F220 HydrophobicContact CB-CB 3.95Å; L21-F220 HydrophobicContact CD2-CD2 4.11Å; L21-F220 WeakPolarHBondContact O-CB 3.17Å; L21-F220 PolarHBondContact O-N 3.27Å; F220-P222 CarbonylContact O-C 3.58Å; F220-Y223 PolarHBondContact O-N 2.77Å; F220-Y224 VanDerWaalsContact CD2-CB 3.48Å; F220-Y224 HydrophobicContact CD2-CD2 4.07Å; F220-Y224 HydrophobicContact CD2-CG 4.11Å; F220-Y224 HydrophobicContact CE2-CG 4.18Å; F220-Y224 WeakPolarHBondContact O-CA 3.29Å; F220-Y224 PolarHBondContact O-N 3.49Å; F220-T225 HydrophobicContact CD1-CG2 3.7Å; F220-T225 HydrophobicContact CE1-CG2 3.73Å; F220-T225 PolarHBondContact O-N 2.59Å
221H98.3Very high98.2Very high95 Ų9569.4 Ų69.444%0.4438%0.375SS..THydrogen-bonded Turntrans-93.1131.7169.9-176.171.8000111.1I19 P219 T225I19-H221 HydrophobicContact CG2-CB 4.06Å; I19-H221 PolarHBondContact O-N 3.28Å; I19-H221 VanDerWaalsContact O-N 3.07Å; P219-H221 VanDerWaalsContact C-N 3.33Å; P219-H221 WeakPolarHBondContact CB-O 3.39Å; P219-H221 PolarHBondContact O-N 2.75Å; H221-T225 HydrophobicContact CB-CG2 3.96Å; H221-T225 PolarHBondContact ND1-OG1 3.43Å
222P98.3Very high98.2Very high66 Ų6665.6 Ų65.643%0.42936%0.355SS..THydrogen-bonded Turncis-89.8-14.45.135.1-35.6000115F220 Y224 T225 I226F220-P222 CarbonylContact O-C 3.58Å; P222-Y224 PolarHBondContact O-N 3.48Å; P222-T225 VanDerWaalsContact C-OG1 3.26Å; P222-T225 WeakPolarHBondContact CA-OG1 3.39Å; P222-T225 PolarHBondContact O-N 3.48Å; P222-T225 PolarHBondContact O-OG1 2.83Å; P222-I226 WeakPolarHBondContact O-CG2 3.45Å; P222-I226 PolarHBondContact O-N 3.47Å
223Y98.6Very high98.3Very high126 Ų12665 Ų6549%0.49435%0.351SS..Hα-helixtrans-58.1-55.7-164-62.2-78.7000114.2I218 P219 F220 I226 K227I218-Y223 HydrophobicContact CB-CD2 4.05Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.23Å; I218-Y223 HydrophobicContact CD1-CD2 3.92Å; I218-Y223 HydrophobicContact CD1-CG 3.71Å; I218-Y223 HydrophobicContact CG1-CD2 4.23Å; I218-Y223 HydrophobicContact CG1-CG 4.48Å; P219-Y223 HydrophobicContact CG-CD2 4.29Å; P219-Y223 HydrophobicContact CG-CE2 4.17Å; P219-Y223 WeakPolarHBondContact O-CD2 3.44Å; F220-Y223 PolarHBondContact O-N 2.77Å; Y223-I226 VanDerWaalsContact O-CG2 3.32Å; Y223-I226 WeakPolarHBondContact O-CG2 3.41Å; Y223-K227 WeakPolarHBondContact O-CB 3.06Å; Y223-K227 PolarHBondContact O-N 3.05Å
224Y98.4Very high98.4Very high10 Ų1068.4 Ų68.44%0.03937%0.367CS..Hα-helixtrans-82-26-179.6-66.7-57.4000112.4A23 P24 S25 I27 I218 F220 P222 I226 K227 D228A23-Y224 HydrophobicContact CB-CD2 3.52Å; A23-Y224 HydrophobicContact CB-CE2 3.39Å; P24-Y224 PolarHBondContact O-OH 3.2Å; S25-Y224 VanDerWaalsContact C-OH 3.29Å; S25-Y224 PolarHBondContact O-OH 2.98Å; I27-Y224 HydrophobicContact CD1-CD1 3.8Å; I27-Y224 HydrophobicContact CD1-CD2 4.31Å; I27-Y224 HydrophobicContact CD1-CE1 3.49Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.49Å; I27-Y224 HydrophobicContact CD1-CE2 3.97Å; I27-Y224 HydrophobicContact CD1-CG 4.24Å; I27-Y224 HydrophobicContact CG1-CD1 4.11Å; I27-Y224 HydrophobicContact CG1-CE1 3.28Å; I27-Y224 HydrophobicContact CG1-CE2 4.02Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.39Å; I218-Y224 HydrophobicContact CD1-CE2 3.75Å; I218-Y224 HydrophobicContact CG1-CE2 3.78Å; F220-Y224 VanDerWaalsContact CD2-CB 3.48Å; F220-Y224 HydrophobicContact CD2-CD2 4.07Å; F220-Y224 HydrophobicContact CD2-CG 4.11Å; F220-Y224 HydrophobicContact CE2-CG 4.18Å; F220-Y224 WeakPolarHBondContact O-CA 3.29Å; F220-Y224 PolarHBondContact O-N 3.49Å; P222-Y224 PolarHBondContact O-N 3.48Å; Y224-I226 PolarHBondContact O-N 3.45Å; Y224-K227 HydrophobicContact CD1-CD 3.92Å; Y224-K227 HydrophobicContact CE1-CD 4.06Å; Y224-K227 PolarHBondContact O-N 3.43Å; Y224-D228 WeakPolarHBondContact O-CB 3.37Å; Y224-D228 VanDerWaalsContact O-CG 3.29Å; Y224-D228 PolarHBondContact O-N 2.87Å
225T98.4Very high98.4Very high19 Ų1964 Ų6412%0.11734%0.344CS..Hα-helixtrans-59.8-46.8170.553.90000112.5F18 F220 H221 P222 D228 I229F18-T225 HydrophobicContact CD1-CG2 4.46Å; F18-T225 HydrophobicContact CE1-CG2 3.76Å; F18-T225 HydrophobicContact CZ-CG2 4.15Å; F220-T225 HydrophobicContact CD1-CG2 3.7Å; F220-T225 HydrophobicContact CE1-CG2 3.73Å; F220-T225 PolarHBondContact O-N 2.59Å; H221-T225 HydrophobicContact CB-CG2 3.96Å; H221-T225 PolarHBondContact ND1-OG1 3.43Å; P222-T225 VanDerWaalsContact C-OG1 3.26Å; P222-T225 WeakPolarHBondContact CA-OG1 3.39Å; P222-T225 PolarHBondContact O-N 3.48Å; P222-T225 PolarHBondContact O-OG1 2.83Å; T225-D228 PolarHBondContact O-N 3.45Å; T225-I229 VanDerWaalsContact O-CG1 3.27Å; T225-I229 WeakPolarHBondContact O-CG1 3.39Å; T225-I229 PolarHBondContact O-N 3.21Å
226I98.6Very high98.5Very high112 Ų11262.2 Ų62.257%0.57432%0.315SS*.Hα-helixtrans-72-36.9-179.7-168.260.5000111.8P222 Y223 Y224 D228 I229 L230P222-I226 WeakPolarHBondContact O-CG2 3.45Å; P222-I226 PolarHBondContact O-N 3.47Å; Y223-I226 VanDerWaalsContact O-CG2 3.32Å; Y223-I226 WeakPolarHBondContact O-CG2 3.41Å; Y224-I226 PolarHBondContact O-N 3.45Å; I226-D228 VanDerWaalsContact C-N 3.34Å; I226-I229 PolarHBondContact O-N 2.86Å; I226-L230 PolarHBondContact O-N 3.41Å
227K98.6Very high98.5Very high52 Ų5263.5 Ų63.523%0.22632%0.321CS..Hα-helixtrans-64.8-39.4176.2-172-174.4166-151.80111.6I27 S28 N32 Y223 Y224 L230 G231I27-K227 PolarHBondContact O-NZ 3.29Å; S28-K227 PolarHBondContact O-NZ 2.85Å; N32-K227 PolarHBondContact ND2-O 3.07Å; N32-K227 VanDerWaalsContact ND2-O 3.09Å; N32-K227 WeakPolarHBondContact OD1-CE 3Å; N32-K227 PolarHBondContact OD1-NZ 2.96Å; Y223-K227 WeakPolarHBondContact O-CB 3.06Å; Y223-K227 PolarHBondContact O-N 3.05Å; Y224-K227 HydrophobicContact CD1-CD 3.92Å; Y224-K227 HydrophobicContact CE1-CD 4.06Å; Y224-K227 PolarHBondContact O-N 3.43Å; K227-L230 PolarHBondContact O-N 3.46Å; K227-G231 PolarHBondContact O-N 3.37Å; K227-G231 VanDerWaalsContact O-N 3.08Å
228D98.6Very high98.6Very high21 Ų2164.7 Ų64.711%0.11233%0.331CS..Hα-helixtrans-69.1-41.1176.7-79.78.5000111.6N32 S35 Y224 T225 I226 L230 G231 I232N32-D228 PolarHBondContact ND2-OD1 2.94Å; N32-D228 VanDerWaalsContact ND2-OD1 3.14Å; S35-D228 WeakPolarHBondContact CB-OD2 3.21Å; S35-D228 PolarHBondContact OG-OD1 2.89Å; S35-D228 PolarHBondContact OG-OD2 3.43Å; Y224-D228 WeakPolarHBondContact O-CB 3.37Å; Y224-D228 VanDerWaalsContact O-CG 3.29Å; Y224-D228 PolarHBondContact O-N 2.87Å; T225-D228 PolarHBondContact O-N 3.45Å; I226-D228 VanDerWaalsContact C-N 3.34Å; D228-L230 VanDerWaalsContact C-N 3.28Å; D228-L230 PolarHBondContact O-N 3.3Å; D228-G231 PolarHBondContact O-N 2.88Å; D228-G231 VanDerWaalsContact O-N 3.11Å; D228-I232 VanDerWaalsContact O-CG1 3.25Å; D228-I232 WeakPolarHBondContact O-CG1 3.47Å; D228-I232 PolarHBondContact O-N 3.32Å
229I98.8Very high98.6Very high90 Ų9063.3 Ų63.346%0.46232%0.324SS..Hα-helixtrans-56.7-43.5172.5-70.2166.7000110.9T225 I226 G231 I232 L233T225-I229 VanDerWaalsContact O-CG1 3.27Å; T225-I229 WeakPolarHBondContact O-CG1 3.39Å; T225-I229 PolarHBondContact O-N 3.21Å; I226-I229 PolarHBondContact O-N 2.86Å; I229-G231 PolarHBondContact O-N 3.1Å; I229-I232 PolarHBondContact O-N 3.45Å; I229-L233 HydrophobicContact CG2-CD1 4.21Å; I229-L233 WeakPolarHBondContact O-CG 3.27Å; I229-L233 PolarHBondContact O-N 3.45Å
230L98.7Very high98.6Very high101 Ų10163.1 Ų63.153%0.52932%0.319SS..Hα-helixtrans-60.3-46.2175.3176.862.7000111.9I226 K227 D228 I232 L233 I234I226-L230 PolarHBondContact O-N 3.41Å; K227-L230 PolarHBondContact O-N 3.46Å; D228-L230 VanDerWaalsContact C-N 3.28Å; D228-L230 PolarHBondContact O-N 3.3Å; L230-I232 VanDerWaalsContact C-N 3.3Å; L230-I232 PolarHBondContact O-N 3.49Å; L230-L233 PolarHBondContact O-N 2.83Å; L230-I234 HydrophobicContact CD1-CD1 4.19Å; L230-I234 HydrophobicContact CD1-CG1 4.46Å; L230-I234 HydrophobicContact CG-CD1 4.15Å; L230-I234 WeakPolarHBondContact O-CG1 3.14Å; L230-I234 PolarHBondContact O-N 3.45Å; L230-I234 VanDerWaalsContact O-N 3.07Å
231G98.7Very high98.6Very high13 Ų1364.4 Ų64.413%0.13433%0.328CS..Hα-helixtrans-58.7-42.8176.100000112.4K227 D228 I229 I234 M235K227-G231 PolarHBondContact O-N 3.37Å; K227-G231 VanDerWaalsContact O-N 3.08Å; D228-G231 PolarHBondContact O-N 2.88Å; D228-G231 VanDerWaalsContact O-N 3.11Å; I229-G231 PolarHBondContact O-N 3.1Å; G231-I234 PolarHBondContact O-N 3.39Å; G231-M235 WeakPolarHBondContact O-CB 3.11Å; G231-M235 PolarHBondContact O-N 3.02Å
232I98.8Very high98.6Very high38 Ų3861.1 Ų61.120%0.19531%0.314CS..Hα-helixtrans-62-44.8177.7-69.2166.7000110.5L36 I39 D228 I229 L230 I234 M235 F236L36-I232 HydrophobicContact CD2-CB 4.44Å; L36-I232 HydrophobicContact CD2-CG1 3.84Å; I39-I232 HydrophobicContact CD1-CD1 4.16Å; I39-I232 HydrophobicContact CG1-CD1 3.74Å; I39-I232 HydrophobicContact CG1-CG1 3.94Å; D228-I232 VanDerWaalsContact O-CG1 3.25Å; D228-I232 WeakPolarHBondContact O-CG1 3.47Å; D228-I232 PolarHBondContact O-N 3.32Å; I229-I232 PolarHBondContact O-N 3.45Å; L230-I232 VanDerWaalsContact C-N 3.3Å; L230-I232 PolarHBondContact O-N 3.49Å; I232-I234 PolarHBondContact O-N 2.87Å; I232-M235 PolarHBondContact O-N 3.32Å; I232-F236 HydrophobicContact CG2-CD2 3.58Å; I232-F236 HydrophobicContact CG2-CE2 3.78Å; I232-F236 WeakPolarHBondContact O-CB 3.4Å; I232-F236 WeakPolarHBondContact O-CD2 3.3Å; I232-F236 PolarHBondContact O-N 2.79Å
233L98.8Very high98.6Very high112 Ų11258.1 Ų58.159%0.58629%0.294SS*.Hα-helixtrans-60.8-42.9177.4-72.4171.5000112.1I229 L230 L237I229-L233 HydrophobicContact CG2-CD1 4.21Å; I229-L233 WeakPolarHBondContact O-CG 3.27Å; I229-L233 PolarHBondContact O-N 3.45Å; L230-L233 PolarHBondContact O-N 2.83Å; L233-L237 WeakPolarHBondContact O-CB 3.45Å; L233-L237 PolarHBondContact O-N 3.04Å
234I98.8Very high98.6Very high90 Ų9056.1 Ų56.146%0.46229%0.292SS..Hα-helixtrans-64.9-45.3176.9-65.6167.7000110.6L230 G231 I232 L237 L238L230-I234 HydrophobicContact CD1-CD1 4.19Å; L230-I234 HydrophobicContact CD1-CG1 4.46Å; L230-I234 HydrophobicContact CG-CD1 4.15Å; L230-I234 WeakPolarHBondContact O-CG1 3.14Å; L230-I234 PolarHBondContact O-N 3.45Å; L230-I234 VanDerWaalsContact O-N 3.07Å; G231-I234 PolarHBondContact O-N 3.39Å; I232-I234 PolarHBondContact O-N 2.87Å; I234-L237 WeakPolarHBondContact O-CB 3.32Å; I234-L237 PolarHBondContact O-N 3.16Å; I234-L238 HydrophobicContact CG2-CD1 4.47Å; I234-L238 WeakPolarHBondContact O-CG 3.41Å; I234-L238 PolarHBondContact O-N 3.37Å
235M98.6Very high98.7Very high8 Ų862.7 Ų62.74%0.03932%0.321CS..Hα-helixtrans-62.1-44.8178.2-174.3-157.171.100111.6L36 I39 C40 M89 G231 I232 L237 L238 L239L36-M235 HydrophobicContact CB-SD 3.99Å; L36-M235 HydrophobicContact CD1-CB 4.43Å; L36-M235 HydrophobicContact CD2-CB 3.97Å; L36-M235 HydrophobicContact CD2-CG 4.47Å; L36-M235 HydrophobicContact CD2-SD 3.92Å; L36-M235 HydrophobicContact CG-SD 4.38Å; I39-M235 HydrophobicContact CB-CE 4.41Å; I39-M235 HydrophobicContact CG2-CE 3.76Å; C40-M235 VanDerWaalsContact SG-SD 3.62Å; M89-M235 HydrophobicContact CG-CG 3.7Å; M89-M235 HydrophobicContact CG-SD 4.09Å; M89-M235 HydrophobicContact SD-CG 3.85Å; G231-M235 WeakPolarHBondContact O-CB 3.11Å; G231-M235 PolarHBondContact O-N 3.02Å; I232-M235 PolarHBondContact O-N 3.32Å; M235-L237 VanDerWaalsContact C-N 3.35Å; M235-L238 PolarHBondContact O-N 3.35Å; M235-L239 WeakPolarHBondContact O-CB 3.1Å; M235-L239 PolarHBondContact O-N 3.43Å
236F98.5Very high98.7Very high72 Ų7266.8 Ų66.832%0.31634%0.337SS..Hα-helixtrans-65.3-37.1176-92.7-71.2000112.3I39 V43 I232 L238 L239 M240I39-F236 HydrophobicContact CG2-CE2 3.64Å; I39-F236 HydrophobicContact CG2-CZ 4.02Å; V43-F236 HydrophobicContact CG2-CE1 4.12Å; V43-F236 HydrophobicContact CG2-CZ 3.72Å; I232-F236 HydrophobicContact CG2-CD2 3.58Å; I232-F236 HydrophobicContact CG2-CE2 3.78Å; I232-F236 WeakPolarHBondContact O-CB 3.4Å; I232-F236 WeakPolarHBondContact O-CD2 3.3Å; I232-F236 PolarHBondContact O-N 2.79Å; F236-L238 VanDerWaalsContact C-N 3.34Å; F236-L238 PolarHBondContact O-N 3.04Å; F236-L239 HydrophobicContact CD1-CD2 4.3Å; F236-L239 HydrophobicContact CE1-CD2 4.34Å; F236-L239 PolarHBondContact O-N 3.43Å; F236-M240 WeakPolarHBondContact O-CB 3.43Å; F236-M240 WeakPolarHBondContact O-CG 3.21Å; F236-M240 PolarHBondContact O-N 3.12Å
237L98.8Very high98.6Very high117 Ų11763.1 Ų63.161%0.61332%0.321SS*.Hα-helixtrans-57.1-50.2173.3176.964.8000110.3L233 I234 M235 L239 M240 T241L233-L237 WeakPolarHBondContact O-CB 3.45Å; L233-L237 PolarHBondContact O-N 3.04Å; I234-L237 WeakPolarHBondContact O-CB 3.32Å; I234-L237 PolarHBondContact O-N 3.16Å; M235-L237 VanDerWaalsContact C-N 3.35Å; L237-L239 PolarHBondContact O-N 3.16Å; L237-M240 PolarHBondContact O-N 3.37Å; L237-T241 PolarHBondContact O-N 2.9Å; L237-T241 PolarHBondContact O-OG1 3.13Å
238L98.6Very high98.6Very high99 Ų9964.1 Ų64.152%0.51833%0.329SS..Hα-helixtrans-61.9-44.8177.9-65.9173.6000112.4M89 I234 M235 F236 T241 L242M89-L238 HydrophobicContact CE-CB 3.81Å; I234-L238 HydrophobicContact CG2-CD1 4.47Å; I234-L238 WeakPolarHBondContact O-CG 3.41Å; I234-L238 PolarHBondContact O-N 3.37Å; M235-L238 PolarHBondContact O-N 3.35Å; F236-L238 VanDerWaalsContact C-N 3.34Å; F236-L238 PolarHBondContact O-N 3.04Å; L238-T241 PolarHBondContact O-N 3.12Å; L238-L242 PolarHBondContact O-N 3.05Å
239L98.8Very high98.6Very high4 Ų468.7 Ų68.72%0.02135%0.351CS..Hα-helixtrans-60.4-47.6177.4178.162.4000110.9N85 M89 M235 F236 L237 T241 L242 V243N85-L239 HydrophobicContact CB-CD1 3.9Å; M89-L239 HydrophobicContact CB-CD1 4.42Å; M89-L239 HydrophobicContact CE-CB 4.34Å; M235-L239 WeakPolarHBondContact O-CB 3.1Å; M235-L239 PolarHBondContact O-N 3.43Å; F236-L239 HydrophobicContact CD1-CD2 4.3Å; F236-L239 HydrophobicContact CE1-CD2 4.34Å; F236-L239 PolarHBondContact O-N 3.43Å; L237-L239 PolarHBondContact O-N 3.16Å; L239-T241 VanDerWaalsContact C-N 3.32Å; L239-T241 PolarHBondContact O-N 2.77Å; L239-L242 WeakPolarHBondContact O-CB 3.27Å; L239-L242 PolarHBondContact O-N 3.38Å; L239-V243 HydrophobicContact CD1-CG2 4.07Å; L239-V243 HydrophobicContact CG-CG2 4.28Å; L239-V243 WeakPolarHBondContact O-CB 3.37Å; L239-V243 VanDerWaalsContact O-CG2 3.22Å; L239-V243 WeakPolarHBondContact O-CG2 3.18Å; L239-V243 PolarHBondContact O-N 3.33Å
240M98.7Very high98.6Very high54 Ų5466.9 Ų66.927%0.26634%0.342SS..Hα-helixtrans-68.9-31.3180-66.5-53.6-62.300111.9L78 M82 F236 L237 V243 L244L78-M240 HydrophobicContact CD1-CE 4.22Å; M82-M240 HydrophobicContact SD-SD 4.38Å; F236-M240 WeakPolarHBondContact O-CB 3.43Å; F236-M240 WeakPolarHBondContact O-CG 3.21Å; F236-M240 PolarHBondContact O-N 3.12Å; L237-M240 PolarHBondContact O-N 3.37Å; M240-V243 PolarHBondContact O-N 3.37Å; M240-L244 HydrophobicContact CB-CD1 4.43Å; M240-L244 HydrophobicContact CE-CD1 3.77Å; M240-L244 HydrophobicContact CE-CD2 4.13Å; M240-L244 HydrophobicContact CE-CG 3.9Å; M240-L244 VanDerWaalsContact O-CB 3.25Å; M240-L244 WeakPolarHBondContact O-CB 3.25Å; M240-L244 VanDerWaalsContact O-CG 3.27Å; M240-L244 WeakPolarHBondContact O-CG 3.28Å; M240-L244 PolarHBondContact O-N 2.94Å
241T98.8Very high98.4Very high53 Ų5364.1 Ų64.133%0.32534%0.337SS..Hα-helixtrans-61.1-46.3170.4-60.80000111.2L237 L238 L239 F245 F246L237-T241 PolarHBondContact O-N 2.9Å; L237-T241 PolarHBondContact O-OG1 3.13Å; L238-T241 PolarHBondContact O-N 3.12Å; L239-T241 VanDerWaalsContact C-N 3.32Å; L239-T241 PolarHBondContact O-N 2.77Å; T241-F245 HydrophobicContact CG2-CD2 4.33Å; T241-F245 WeakPolarHBondContact O-CB 2.94Å; T241-F245 PolarHBondContact O-N 3.39Å; T241-F246 HydrophobicContact CG2-CD2 4.37Å; T241-F246 HydrophobicContact CG2-CE2 4.46Å
242L98.5Very high98.4Very high27 Ų2764.6 Ų64.614%0.14134%0.337CS..Hα-helixtrans-61-52.8174.2-70.6171.7000110.8N85 M89 L238 L239 L244 F246 P247 M249 L250N85-L242 HydrophobicContact CB-CB 4.31Å; M89-L242 HydrophobicContact CE-CD1 4.44Å; L238-L242 PolarHBondContact O-N 3.05Å; L239-L242 WeakPolarHBondContact O-CB 3.27Å; L239-L242 PolarHBondContact O-N 3.38Å; L242-L244 VanDerWaalsContact C-N 3.35Å; L242-L244 PolarHBondContact O-N 3.12Å; L242-F246 CarbonylContact O-C 3.37Å; L242-F246 WeakPolarHBondContact O-CA 3.37Å; L242-F246 PolarHBondContact O-N 3.46Å; L242-P247 VanDerWaalsContact O-CA 3.23Å; L242-P247 WeakPolarHBondContact O-CA 3.42Å; L242-M249 HydrophobicContact CD2-SD 4.34Å; L242-L250 HydrophobicContact CD1-CD1 3.96Å; L242-L250 HydrophobicContact CD2-CD1 4.45Å
243V98.8Very high98.3Very high2 Ų267.3 Ų67.31%0.01236%0.357CS..Hα-helixtrans-61.5-39.6-174.6170.70000113L78 M82 N85 L239 M240L78-V243 HydrophobicContact CD1-CG1 3.54Å; M82-V243 HydrophobicContact CG-CG1 4.04Å; M82-V243 HydrophobicContact CG-CG2 4.08Å; N85-V243 HydrophobicContact CB-CG2 4.04Å; L239-V243 HydrophobicContact CD1-CG2 4.07Å; L239-V243 HydrophobicContact CG-CG2 4.28Å; L239-V243 WeakPolarHBondContact O-CB 3.37Å; L239-V243 VanDerWaalsContact O-CG2 3.22Å; L239-V243 WeakPolarHBondContact O-CG2 3.18Å; L239-V243 PolarHBondContact O-N 3.33Å; M240-V243 PolarHBondContact O-N 3.37Å
244L98.7Very high98.2Very high85 Ų8564 Ų6445%0.44534%0.34SS..Hα-helixtrans-93.5-31.3-172.5-60.7176.7000113.7W77 L78 M240 L242W77-L244 HydrophobicContact CH2-CD2 4Å; W77-L244 HydrophobicContact CZ3-CD2 4.22Å; L78-L244 HydrophobicContact CD1-CD2 4.07Å; M240-L244 HydrophobicContact CB-CD1 4.43Å; M240-L244 HydrophobicContact CE-CD1 3.77Å; M240-L244 HydrophobicContact CE-CD2 4.13Å; M240-L244 HydrophobicContact CE-CG 3.9Å; M240-L244 VanDerWaalsContact O-CB 3.25Å; M240-L244 WeakPolarHBondContact O-CB 3.25Å; M240-L244 VanDerWaalsContact O-CG 3.27Å; M240-L244 WeakPolarHBondContact O-CG 3.28Å; M240-L244 PolarHBondContact O-N 2.94Å; L242-L244 VanDerWaalsContact C-N 3.35Å; L242-L244 PolarHBondContact O-N 3.12Å
245F98.6Very high98.2Very high148 Ų14860.5 Ų60.565%0.64932%0.322SS*.Hα-helixtrans-111.5-31-175.3-62.8-79000113.6T241 P247T241-F245 HydrophobicContact CG2-CD2 4.33Å; T241-F245 WeakPolarHBondContact O-CB 2.94Å; T241-F245 PolarHBondContact O-N 3.39Å; F245-P247 VanDerWaalsContact C-CD 3.49Å
246F98.4Very high98.1Very high104 Ų10465.1 Ų65.146%0.45634%0.34SS..  trans-136.749.8-173.1-55.8-68.7000113.2T241 L242 D248 M249T241-F246 HydrophobicContact CG2-CD2 4.37Å; T241-F246 HydrophobicContact CG2-CE2 4.46Å; L242-F246 CarbonylContact O-C 3.37Å; L242-F246 WeakPolarHBondContact O-CA 3.37Å; L242-F246 PolarHBondContact O-N 3.46Å; F246-D248 PolarHBondContact O-N 2.99Å; F246-D248 VanDerWaalsContact O-N 3.07Å; F246-M249 HydrophobicContact CB-CB 3.95Å; F246-M249 HydrophobicContact CB-CE 3.79Å; F246-M249 HydrophobicContact CB-SD 4.31Å; F246-M249 HydrophobicContact CD1-CE 3.65Å; F246-M249 HydrophobicContact CD2-CE 4.19Å; F246-M249 HydrophobicContact CE1-CE 4.27Å; F246-M249 HydrophobicContact CG-CE 3.6Å; F246-M249 WeakPolarHBondContact O-CB 3.16Å; F246-M249 PolarHBondContact O-N 3.06Å; F246-M249 VanDerWaalsContact O-N 3.13Å
247P98.3Very high98.1Very high35 Ų3565.9 Ų65.923%0.22735%0.345CS..THydrogen-bonded Turntrans-62.9-24.9-165.222.2-33.9000114.4Y81 N85 L242 F245Y81-P247 HydrophobicContact CD1-CB 3.45Å; Y81-P247 VanDerWaalsContact CD1-CB 3.45Å; Y81-P247 HydrophobicContact CD2-CB 4.21Å; Y81-P247 HydrophobicContact CE1-CB 3.6Å; Y81-P247 HydrophobicContact CE1-CG 4.4Å; Y81-P247 HydrophobicContact CE2-CB 4.38Å; Y81-P247 HydrophobicContact CG-CB 3.78Å; N85-P247 PolarHBondContact ND2-O 3.01Å; L242-P247 VanDerWaalsContact O-CA 3.23Å; L242-P247 WeakPolarHBondContact O-CA 3.42Å; F245-P247 VanDerWaalsContact C-CD 3.49Å
248D98.2Very high98.1Very high73 Ų7364 Ų6439%0.3934%0.341SS..THydrogen-bonded Turntrans-105.50.1-176.4-63.2-50.1000113.8F246 L250 G251 Y256F246-D248 PolarHBondContact O-N 2.99Å; F246-D248 VanDerWaalsContact O-N 3.07Å; D248-L250 PolarHBondContact O-N 2.73Å; D248-L250 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact O-N 3.49Å; D248-G251 VanDerWaalsContact O-N 3.17Å; D248-Y256 PolarHBondContact OD1-OH 2.73Å
249M98.1Very high98Very high118 Ų11860.3 Ų60.358%0.58132%0.324SS*.THydrogen-bonded Turntrans-58.6-31.1-173.3175.6-177.5-78.100113.6L242 F246L242-M249 HydrophobicContact CD2-SD 4.34Å; F246-M249 HydrophobicContact CB-CB 3.95Å; F246-M249 HydrophobicContact CB-CE 3.79Å; F246-M249 HydrophobicContact CB-SD 4.31Å; F246-M249 HydrophobicContact CD1-CE 3.65Å; F246-M249 HydrophobicContact CD2-CE 4.19Å; F246-M249 HydrophobicContact CE1-CE 4.27Å; F246-M249 HydrophobicContact CG-CE 3.6Å; F246-M249 WeakPolarHBondContact O-CB 3.16Å; F246-M249 PolarHBondContact O-N 3.06Å; F246-M249 VanDerWaalsContact O-N 3.13Å
250L97.9Very high98Very high52 Ų5263.2 Ų63.227%0.27234%0.34SS..THydrogen-bonded Turntrans-100.7-4.4-176.3-59-179.6000113.9L242 D248L242-L250 HydrophobicContact CD1-CD1 3.96Å; L242-L250 HydrophobicContact CD2-CD1 4.45Å; D248-L250 PolarHBondContact O-N 2.73Å; D248-L250 VanDerWaalsContact O-N 3.12Å
251G96Very high97.9Very high42 Ų4264.4 Ų64.443%0.43335%0.351SS..SBendtrans-101172.5-179.700000112.9D248D248-G251 PolarHBondContact O-N 3.49Å; D248-G251 VanDerWaalsContact O-N 3.17Å
252D97.2Very high97.8Very high23 Ų2369.8 Ų69.812%0.12338%0.377CS..  trans-100.9129.4176.1-161.5-71.6000111.7M138 D254 N255 K269M138-D252 HydrophobicContact CG-CB 4.07Å; D252-D254 PolarHBondContact O-N 3.09Å; D252-D254 WeakPolarHBondContact OD1-CB 3.2Å; D252-D254 PolarHBondContact OD1-N 3.34Å; D252-N255 WeakPolarHBondContact O-CB 3.32Å; D252-N255 PolarHBondContact O-N 3.48Å; D252-N255 VanDerWaalsContact O-N 3.1Å; D252-K269 WeakPolarHBondContact OD2-CE 3.4Å; D252-K269 IonicContact OD2-NZ 2.64Å; D252-K269 PolarHBondContact OD2-NZ 3.43Å
253P97.3Very high97.6Very high96 Ų9672.8 Ų72.862%0.62339%0.394SS*.G310 helixtrans-61.5-27.4-178.525.5-35.7000113.4N255 Y256P253-N255 PolarHBondContact O-N 3.14Å; P253-N255 VanDerWaalsContact O-N 3.14Å; P253-Y256 WeakPolarHBondContact O-CB 3.41Å; P253-Y256 PolarHBondContact O-N 2.94Å
254D97.1Very high97.5Very high41 Ų4176.4 Ų76.422%0.21942%0.415CS..G310 helixtrans-64.2-21.5179.1-76.7-11.5000111.7Q137 M138 D252 Y256 M257Q137-D254 HydrophobicContact CB-CB 4.47Å; Q137-D254 WeakPolarHBondContact CB-O 3.46Å; M138-D254 HydrophobicContact CE-CB 3.52Å; M138-D254 WeakPolarHBondContact CE-OD2 3.41Å; M138-D254 HydrophobicContact CG-CB 3.82Å; D252-D254 PolarHBondContact O-N 3.09Å; D252-D254 WeakPolarHBondContact OD1-CB 3.2Å; D252-D254 PolarHBondContact OD1-N 3.34Å; D254-Y256 PolarHBondContact O-N 3.43Å; D254-M257 HydrophobicContact CB-CE 3.95Å; D254-M257 PolarHBondContact O-N 3.48Å; D254-M257 VanDerWaalsContact OD1-CE 3.26Å; D254-M257 WeakPolarHBondContact OD1-CE 3.32Å
255N97.9Very high97.3Very high18 Ų1872.8 Ų72.810%0.09640%0.397CS..G310 helixtrans-75.1-2.7176.4-139.731.8000114.1G136 M138 S139 D252 P253 M257G136-N255 VanDerWaalsContact C-OD1 3.27Å; G136-N255 VanDerWaalsContact CA-OD1 3.23Å; G136-N255 WeakPolarHBondContact CA-OD1 3.33Å; M138-N255 HydrophobicContact CB-CB 4.15Å; M138-N255 PolarHBondContact N-OD1 3.42Å; S139-N255 PolarHBondContact N-OD1 3.38Å; S139-N255 PolarHBondContact OG-ND2 3.27Å; S139-N255 PolarHBondContact OG-OD1 3.39Å; D252-N255 WeakPolarHBondContact O-CB 3.32Å; D252-N255 PolarHBondContact O-N 3.48Å; D252-N255 VanDerWaalsContact O-N 3.1Å; P253-N255 PolarHBondContact O-N 3.14Å; P253-N255 VanDerWaalsContact O-N 3.14Å; N255-M257 VanDerWaalsContact C-N 3.34Å
256Y97.9Very high96.9Very high105 Ų10572.1 Ų72.141%0.41241%0.408SS..G310 helixtrans-87.6-0.8166.3-75.3-72.5000113.6F63 R80 Y81 D248 P253 D254F63-Y256 VanDerWaalsContact CZ-O 3.3Å; F63-Y256 WeakPolarHBondContact CZ-O 3.45Å; R80-Y256 PolarHBondContact NH1-OH 3.11Å; Y81-Y256 PolarHBondContact OH-OH 2.98Å; D248-Y256 PolarHBondContact OD1-OH 2.73Å; P253-Y256 WeakPolarHBondContact O-CB 3.41Å; P253-Y256 PolarHBondContact O-N 2.94Å; D254-Y256 PolarHBondContact O-N 3.43Å
257M98Very high96.6Very high87 Ų8769.6 Ų69.643%0.42940%0.397SS..SBendtrans-99.2135.1167.8-64.3-175.5-74.800109.8G136 Q137 D254 N255G136-M257 CarbonylContact C-O 3.24Å; G136-M257 WeakPolarHBondContact CA-O 3.45Å; Q137-M257 HydrophobicContact CG-CB 3.8Å; Q137-M257 HydrophobicContact CG-CE 4.35Å; Q137-M257 PolarHBondContact N-O 2.93Å; D254-M257 HydrophobicContact CB-CE 3.95Å; D254-M257 PolarHBondContact O-N 3.48Å; D254-M257 VanDerWaalsContact OD1-CE 3.26Å; D254-M257 WeakPolarHBondContact OD1-CE 3.32Å; N255-M257 VanDerWaalsContact C-N 3.34Å
258P97.9Very high96.4Very high79 Ų7969.3 Ų69.351%0.51339%0.393SS..BIsolated β-bridgetrans-56.3145.4173.4-21.931.1000111.8F63 N260F63-P258 HydrophobicContact CD1-CB 4.33Å; F63-P258 HydrophobicContact CD1-CG 3.82Å; F63-P258 HydrophobicContact CD2-CB 4.37Å; F63-P258 HydrophobicContact CD2-CG 4.44Å; F63-P258 HydrophobicContact CE1-CG 3.78Å; F63-P258 HydrophobicContact CE2-CG 4.4Å; F63-P258 HydrophobicContact CG-CB 4.2Å; F63-P258 HydrophobicContact CG-CG 4.17Å; F63-P258 HydrophobicContact CZ-CG 4.09Å; P258-N260 PolarHBondContact O-N 2.96Å
259A97.6Very high96.3Very high20 Ų2068.8 Ų68.817%0.16539%0.388CS..PPolyproline II helixtrans-55.2128.517700000111.9W135 F140W135-A259 HydrophobicContact CG-CB 4.31Å; W135-A259 WeakPolarHBondContact O-CB 3.3Å; W135-A259 PolarHBondContact O-N 2.86Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.25Å; F140-A259 HydrophobicContact CG-CB 3.93Å
260N97.6Very high96.2Very high66 Ų6664.1 Ų64.135%0.35337%0.366SS..  trans-126.5107.3172.8-177-12.7000109.5W141 P258 L262 N263W141-N260 PolarHBondContact NE1-O 3.4Å; P258-N260 PolarHBondContact O-N 2.96Å; N260-L262 PolarHBondContact O-N 3.04Å; N260-L262 WeakPolarHBondContact OD1-CB 3.48Å; N260-L262 PolarHBondContact OD1-N 3Å; N260-N263 HydrophobicContact CB-CB 4.17Å; N260-N263 PolarHBondContact O-N 3.37Å; N260-N263 VanDerWaalsContact O-N 3.09Å
261P96.3Very high96.2Very high79 Ų7962.7 Ų62.751%0.51336%0.358SS..THydrogen-bonded Turntrans-60.6-15.8179.4-2434.1000114.9F140 W141F140-P261 HydrophobicContact CE1-CB 4.12Å; F140-P261 HydrophobicContact CE1-CG 4.28Å; F140-P261 HydrophobicContact CE2-CG 4.24Å; F140-P261 HydrophobicContact CZ-CB 3.88Å; F140-P261 HydrophobicContact CZ-CG 3.82Å; W141-P261 WeakPolarHBondContact CH2-O 3.38Å; W141-P261 WeakPolarHBondContact CZ2-O 3.34Å
262L96.7Very high96.3Very high165 Ų16563.6 Ų63.686%0.86435%0.349SS*.THydrogen-bonded Turntrans-100-5.1-179.3-55.9179.4000113.4N260N260-L262 PolarHBondContact O-N 3.04Å; N260-L262 WeakPolarHBondContact OD1-CB 3.48Å; N260-L262 PolarHBondContact OD1-N 3Å
263N96.4Very high96.4Very high91 Ų9163 Ų6349%0.48734%0.344SS..  trans-128.799.7-179.8-174.30.6000110.6Q137 W141 N260Q137-N263 PolarHBondContact NE2-O 3.23Å; W141-N263 PolarHBondContact NE1-O 3.23Å; N260-N263 HydrophobicContact CB-CB 4.17Å; N260-N263 PolarHBondContact O-N 3.37Å; N260-N263 VanDerWaalsContact O-N 3.09Å
264T94.6Very high96.5Very high77 Ų7759.8 Ų59.847%0.47232%0.321SS..  trans-78.6126.5178.3-48.50000110.7W141 I268W141-T264 HydrophobicContact CD2-CG2 4.22Å; W141-T264 HydrophobicContact CE3-CG2 4.22Å; W141-T264 HydrophobicContact CH2-CG2 4.5Å; W141-T264 VanDerWaalsContact CH2-OG1 3.27Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.5Å; W141-T264 HydrophobicContact CZ2-CG2 4.48Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.36Å; W141-T264 HydrophobicContact CZ3-CG2 4.37Å; T264-I268 HydrophobicContact CG2-CD1 3.48Å; T264-I268 VanDerWaalsContact CG2-CD1 3.48Å; T264-I268 HydrophobicContact CG2-CG1 4.32Å
265P94.6Very high96.5Very high9 Ų958.8 Ų58.86%0.05832%0.315CS..  trans-57.4150.3173.2-27.935.5000112.7Q137 M138 W141 H267 I268Q137-P265 HydrophobicContact CB-CG 3.89Å; M138-P265 HydrophobicContact CE-CB 3.48Å; M138-P265 VanDerWaalsContact CE-CB 3.48Å; M138-P265 HydrophobicContact CE-CG 3.98Å; M138-P265 HydrophobicContact SD-CB 4.48Å; W141-P265 HydrophobicContact CG-CG 4.39Å; P265-H267 VanDerWaalsContact C-N 3.28Å; P265-H267 PolarHBondContact O-N 2.8Å; P265-I268 HydrophobicContact CB-CG1 4.41Å
266P91.5Very high96.6Very high135 Ų13559 Ų5988%0.87732%0.316SS*.SBendtrans-57.6-36.9-178.1-25.434000114.1
267H92.5Very high96.6Very high50 Ų5054.1 Ų54.123%0.23130%0.297CS..SBendtrans-139.395.3178.9-174.4-153.8000111.6P265 K269 R282 G340 Q341P265-H267 VanDerWaalsContact C-N 3.28Å; P265-H267 PolarHBondContact O-N 2.8Å; H267-K269 PolarHBondContact O-N 2.98Å; H267-R282 PolarHBondContact NE2-NH1 3.19Å; H267-G340 PolarHBondContact CE1-O 3.45Å; H267-G340 VanDerWaalsContact CE1-O 3.25Å; H267-Q341 VanDerWaalsContact CE1-C 3.41Å; H267-Q341 PolarHBondContact CE1-O 3.09Å; H267-Q341 VanDerWaalsContact CE1-O 3.23Å; H267-Q341 PolarHBondContact NE2-O 2.92Å
268I94.3Very high96.6Very high29 Ų2951.4 Ų51.415%0.14928%0.282CS..  trans-74.2124.3174.3-57.7161.9000109.6W141 V145 T264 P265 Y278W141-I268 HydrophobicContact CB-CD1 3.71Å; W141-I268 HydrophobicContact CB-CG1 3.9Å; W141-I268 HydrophobicContact CB-CG2 4.16Å; W141-I268 HydrophobicContact CD2-CD1 4.28Å; W141-I268 HydrophobicContact CE3-CD1 4.19Å; W141-I268 HydrophobicContact CG-CD1 4.12Å; V145-I268 HydrophobicContact CG2-CD1 4.19Å; V145-I268 HydrophobicContact CG2-CG2 4.23Å; T264-I268 HydrophobicContact CG2-CD1 3.48Å; T264-I268 VanDerWaalsContact CG2-CD1 3.48Å; T264-I268 HydrophobicContact CG2-CG1 4.32Å; P265-I268 HydrophobicContact CB-CG1 4.41Å; I268-Y278 PolarHBondContact O-OH 3.49Å; I268-Y278 VanDerWaalsContact O-OH 3.08Å
269K94.8Very high96.7Very high62 Ų6247.7 Ų47.727%0.2726%0.258SS..  trans-146.6152.2177.362.9-172.7175.8-173.90109.6D252 H267 L275 Y278D252-K269 WeakPolarHBondContact OD2-CE 3.4Å; D252-K269 IonicContact OD2-NZ 2.64Å; D252-K269 PolarHBondContact OD2-NZ 3.43Å; H267-K269 PolarHBondContact O-N 2.98Å; K269-L275 HydrophobicContact CB-CD2 4.16Å; K269-Y278 HydrophobicContact CB-CE1 4.28Å
270P96.8Very high96.7Very high20 Ų2046.8 Ų46.813%0.1325%0.25CS..  trans-77.7173.8171.636-37.1000110.9F274 L275 Y278P270-F274 HydrophobicContact CB-CB 3.78Å; P270-F274 HydrophobicContact CB-CD2 4.12Å; P270-F274 HydrophobicContact CB-CG 4.38Å; P270-F274 HydrophobicContact CG-CB 3.69Å; P270-L275 HydrophobicContact CG-CD2 4.14Å; P270-L275 WeakPolarHBondContact O-CD2 3.43Å; P270-Y278 HydrophobicContact CG-CD1 4.46Å; P270-Y278 HydrophobicContact CG-CG 4.12Å
271E97.7Very high96.8Very high22 Ų2244.5 Ų44.510%0.10324%0.238CC..  trans-57.6156.8172-69.3-68.8110.500112.6Y131 Y273 F274Y131-E271 HydrophobicContact CD1-CG 4.24Å; Y131-E271 HydrophobicContact CD2-CG 3.47Å; Y131-E271 VanDerWaalsContact CD2-CG 3.47Å; Y131-E271 HydrophobicContact CE1-CG 4.17Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.41Å; Y131-E271 HydrophobicContact CG-CG 3.89Å; Y131-E271 PolarHBondContact OH-OE1 3.18Å; E271-Y273 HydrophobicContact CB-CD1 4.22Å; E271-Y273 HydrophobicContact CB-CE1 3.6Å; E271-Y273 HydrophobicContact CB-CE2 4.04Å; E271-Y273 VanDerWaalsContact CB-CZ 3.48Å; E271-Y273 HydrophobicContact CG-CE1 4.34Å; E271-Y273 PolarHBondContact O-N 3.21Å; E271-F274 PolarHBondContact O-N 3.43Å
272W98.6Very high96.8Very high62 Ų6243.6 Ų43.624%0.23522%0.224CC..G310 helixtrans-53.6-36.9-166.371.5-92.8000114.2S88 F91 I92 F95 F274 L275S88-W272 PolarHBondContact OG-NE1 3.21Å; F91-W272 HydrophobicContact CB-CH2 4.1Å; F91-W272 HydrophobicContact CB-CZ2 4.11Å; I92-W272 HydrophobicContact CD1-CZ2 4.35Å; I92-W272 HydrophobicContact CG1-CH2 3.59Å; I92-W272 HydrophobicContact CG1-CZ2 3.75Å; F95-W272 HydrophobicContact CD2-CH2 4.17Å; F95-W272 HydrophobicContact CD2-CZ3 4.12Å; F95-W272 AromaticContact CE2-CH2 3.98Å; F95-W272 HydrophobicContact CE2-CH2 3.98Å; F95-W272 AromaticContact CE2-CZ3 3.78Å; F95-W272 HydrophobicContact CE2-CZ3 3.78Å; W272-F274 PolarHBondContact O-N 2.83Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.4Å; W272-L275 PolarHBondContact O-N 3.03Å; W272-L275 VanDerWaalsContact O-N 3.11Å
273Y98.4Very high96.9Very high9 Ų936.3 Ų36.34%0.03519%0.187CC..G310 helixtrans-70.3-9.1-178.845-97.3000113.9F91 F95 A127 E271 F276F91-Y273 HydrophobicContact CB-CD1 4.22Å; F91-Y273 HydrophobicContact CB-CG 3.99Å; F91-Y273 AromaticContact CD1-CD2 3.98Å; F91-Y273 HydrophobicContact CD1-CD2 3.98Å; F91-Y273 AromaticContact CD1-CG 3.96Å; F91-Y273 HydrophobicContact CD1-CG 3.96Å; F91-Y273 AromaticContact CD2-CD1 3.67Å; F91-Y273 HydrophobicContact CD2-CD1 3.67Å; F91-Y273 AromaticContact CD2-CD2 3.5Å; F91-Y273 HydrophobicContact CD2-CD2 3.5Å; F91-Y273 AromaticContact CD2-CE1 3.99Å; F91-Y273 HydrophobicContact CD2-CE1 3.99Å; F91-Y273 AromaticContact CD2-CE2 3.77Å; F91-Y273 HydrophobicContact CD2-CE2 3.77Å; F91-Y273 AromaticContact CD2-CG 3.44Å; F91-Y273 HydrophobicContact CD2-CG 3.44Å; F91-Y273 VanDerWaalsContact CD2-CG 3.44Å; F91-Y273 AromaticContact CE1-CD2 3.85Å; F91-Y273 HydrophobicContact CE1-CD2 3.85Å; F91-Y273 HydrophobicContact CE1-CG 4.32Å; F91-Y273 HydrophobicContact CE2-CD1 4.27Å; F91-Y273 AromaticContact CE2-CD2 3.37Å; F91-Y273 HydrophobicContact CE2-CD2 3.37Å; F91-Y273 HydrophobicContact CE2-CE1 4.32Å; F91-Y273 AromaticContact CE2-CE2 3.35Å; F91-Y273 HydrophobicContact CE2-CE2 3.35Å; F91-Y273 AromaticContact CE2-CG 3.85Å; F91-Y273 HydrophobicContact CE2-CG 3.85Å; F91-Y273 AromaticContact CE2-CZ 3.89Å; F91-Y273 VanDerWaalsContact CG-CB 3.49Å; F91-Y273 HydrophobicContact CG-CD1 4.01Å; F91-Y273 AromaticContact CG-CD2 3.81Å; F91-Y273 HydrophobicContact CG-CD2 3.81Å; F91-Y273 AromaticContact CG-CG 3.5Å; F91-Y273 HydrophobicContact CG-CG 3.5Å; F91-Y273 AromaticContact CZ-CD2 3.55Å; F91-Y273 HydrophobicContact CZ-CD2 3.55Å; F91-Y273 AromaticContact CZ-CE2 3.78Å; F91-Y273 HydrophobicContact CZ-CE2 3.78Å; F91-Y273 HydrophobicContact CZ-CG 4.27Å; F95-Y273 WeakPolarHBondContact CZ-O 3.49Å; A127-Y273 HydrophobicContact CB-CE2 3.99Å; E271-Y273 HydrophobicContact CB-CD1 4.22Å; E271-Y273 HydrophobicContact CB-CE1 3.6Å; E271-Y273 HydrophobicContact CB-CE2 4.04Å; E271-Y273 VanDerWaalsContact CB-CZ 3.48Å; E271-Y273 HydrophobicContact CG-CE1 4.34Å; E271-Y273 PolarHBondContact O-N 3.21Å; Y273-F276 WeakPolarHBondContact O-CE1 3.27Å
274F98.6Very high96.9Very high30 Ų3035 Ų3513%0.13218%0.18CC..G310 helixtrans-102.7-10.2171.5-66.3-58.8000113.8F91 M124 F128 P270 E271 W272 F276 A277 Y278F91-F274 HydrophobicContact CZ-CZ 4.48Å; M124-F274 HydrophobicContact CB-CE1 3.84Å; M124-F274 HydrophobicContact CB-CZ 4.27Å; M124-F274 HydrophobicContact CE-CD1 3.6Å; M124-F274 HydrophobicContact CE-CE1 3.47Å; M124-F274 VanDerWaalsContact CE-CE1 3.47Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.33Å; F128-F274 HydrophobicContact CB-CE2 4.27Å; F128-F274 HydrophobicContact CB-CZ 4.18Å; P270-F274 HydrophobicContact CB-CB 3.78Å; P270-F274 HydrophobicContact CB-CD2 4.12Å; P270-F274 HydrophobicContact CB-CG 4.38Å; P270-F274 HydrophobicContact CG-CB 3.69Å; E271-F274 PolarHBondContact O-N 3.43Å; W272-F274 PolarHBondContact O-N 2.83Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 3.4Å; F274-A277 PolarHBondContact O-N 3.08Å; F274-A277 VanDerWaalsContact O-N 3.16Å; F274-Y278 PolarHBondContact O-N 2.93Å
275L98.7Very high97Very high19 Ų1937.5 Ų37.510%0.09920%0.197CC..Hα-helixtrans-62.5-34.9-170.2-67.3178000113.2K269 P270 W272 A277 Y278 A279 T336K269-L275 HydrophobicContact CB-CD2 4.16Å; P270-L275 HydrophobicContact CG-CD2 4.14Å; P270-L275 WeakPolarHBondContact O-CD2 3.43Å; W272-L275 HydrophobicContact CB-CD1 4.28Å; W272-L275 WeakPolarHBondContact O-CB 3.4Å; W272-L275 PolarHBondContact O-N 3.03Å; W272-L275 VanDerWaalsContact O-N 3.11Å; L275-A277 VanDerWaalsContact C-N 3.31Å; L275-A277 PolarHBondContact O-N 3.36Å; L275-Y278 HydrophobicContact CD2-CD1 4.39Å; L275-Y278 PolarHBondContact O-N 2.89Å; L275-A279 WeakPolarHBondContact O-CB 3.24Å; L275-A279 PolarHBondContact O-N 2.93Å; L275-T336 HydrophobicContact CB-CG2 4.07Å; L275-T336 WeakPolarHBondContact CB-O 3.32Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å
276F98.8Very high97.2Very high23 Ų2341.5 Ų41.510%0.10122%0.218CC..Hα-helixtrans-60.6-42.6178.181.3-85.1000111.9F95 Y273 F274 A279 I280 L332 L335F95-F276 HydrophobicContact CE1-CE1 4.35Å; F95-F276 HydrophobicContact CZ-CE1 4.27Å; Y273-F276 WeakPolarHBondContact O-CE1 3.27Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 3.4Å; F276-A279 PolarHBondContact O-N 3.44Å; F276-I280 WeakPolarHBondContact O-CG1 3.23Å; F276-I280 PolarHBondContact O-N 2.95Å; F276-L332 HydrophobicContact CB-CD2 4.28Å; F276-L332 HydrophobicContact CD2-CD2 3.66Å; F276-L332 HydrophobicContact CE2-CD2 4.31Å; F276-L332 HydrophobicContact CG-CD2 4.1Å; F276-L335 HydrophobicContact CB-CB 3.97Å
277A98.5Very high97.3Very high2 Ų239.8 Ų39.82%0.01720%0.197CC..Hα-helixtrans-76.3-36.3-179.200000110.4F274 L275 A279 I280 L281 L294F274-A277 PolarHBondContact O-N 3.08Å; F274-A277 VanDerWaalsContact O-N 3.16Å; L275-A277 VanDerWaalsContact C-N 3.31Å; L275-A277 PolarHBondContact O-N 3.36Å; A277-A279 VanDerWaalsContact C-N 3.32Å; A277-A279 PolarHBondContact O-N 3.38Å; A277-I280 PolarHBondContact O-N 3.38Å; A277-L281 PolarHBondContact O-N 2.87Å; A277-L294 VanDerWaalsContact C-CD1 3.4Å; A277-L294 HydrophobicContact CB-CD1 3.44Å; A277-L294 VanDerWaalsContact CB-CD1 3.44Å; A277-L294 WeakPolarHBondContact O-CD1 3.31Å
278Y98.4Very high97.5Very high30 Ų3040.2 Ų40.212%0.11820%0.2CC..Hα-helixtrans-61.3-37.4171.8-179-120.2000112.7I268 K269 P270 F274 L275 L281 R282 G339I268-Y278 PolarHBondContact O-OH 3.49Å; I268-Y278 VanDerWaalsContact O-OH 3.08Å; K269-Y278 HydrophobicContact CB-CE1 4.28Å; P270-Y278 HydrophobicContact CG-CD1 4.46Å; P270-Y278 HydrophobicContact CG-CG 4.12Å; F274-Y278 PolarHBondContact O-N 2.93Å; L275-Y278 HydrophobicContact CD2-CD1 4.39Å; L275-Y278 PolarHBondContact O-N 2.89Å; Y278-L281 HydrophobicContact CD2-CD2 4.02Å; Y278-L281 HydrophobicContact CE2-CD2 4.36Å; Y278-L281 WeakPolarHBondContact O-CB 3.31Å; Y278-L281 PolarHBondContact O-N 3.33Å; Y278-R282 HydrophobicContact CD2-CG 4.47Å; Y278-R282 VanDerWaalsContact CE1-CZ 3.49Å; Y278-R282 HydrophobicContact CE2-CG 4.09Å; Y278-R282 VanDerWaalsContact CZ-CD 3.5Å; Y278-R282 WeakPolarHBondContact O-CG 3.49Å; Y278-R282 PolarHBondContact O-N 3.04Å; Y278-R282 VanDerWaalsContact O-N 3.14Å; Y278-G339 WeakPolarHBondContact CD1-O 3.36Å
279A98.7Very high97.7Very high1 Ų139.8 Ų39.81%0.00820%0.204CC..Hα-helixtrans-63.4-43.4172.400000111.8L275 F276 A277 L281 R282 S283 L335 I338L275-A279 WeakPolarHBondContact O-CB 3.24Å; L275-A279 PolarHBondContact O-N 2.93Å; F276-A279 PolarHBondContact O-N 3.44Å; A277-A279 VanDerWaalsContact C-N 3.32Å; A277-A279 PolarHBondContact O-N 3.38Å; A279-L281 PolarHBondContact O-N 3.34Å; A279-R282 PolarHBondContact O-N 2.9Å; A279-S283 PolarHBondContact O-N 2.89Å; A279-S283 VanDerWaalsContact O-N 3.07Å; A279-S283 PolarHBondContact O-OG 2.98Å; A279-L335 HydrophobicContact CB-CB 4.33Å; A279-L335 HydrophobicContact CB-CD2 3.96Å; A279-L335 WeakPolarHBondContact CB-O 3.46Å; A279-I338 HydrophobicContact CB-CB 4.46Å; A279-I338 HydrophobicContact CB-CG2 4.27Å
280I98.8Very high97.8Very high1 Ų136.9 Ų36.91%0.00519%0.191CC..Hα-helixtrans-61.7-43.9176.4-67.3170.9000111.3F276 A277 R282 S283 A293 L335 Y358 F359F276-I280 WeakPolarHBondContact O-CG1 3.23Å; F276-I280 PolarHBondContact O-N 2.95Å; A277-I280 PolarHBondContact O-N 3.38Å; I280-R282 VanDerWaalsContact C-N 3.34Å; I280-R282 PolarHBondContact O-N 3.11Å; I280-S283 WeakPolarHBondContact O-CB 3.48Å; I280-S283 PolarHBondContact O-N 3.26Å; I280-A293 HydrophobicContact CG2-CB 3.82Å; I280-L335 HydrophobicContact CD1-CD1 3.99Å; I280-L335 HydrophobicContact CG1-CD1 4.07Å; I280-L335 HydrophobicContact CG1-CD2 4.07Å; I280-Y358 HydrophobicContact CD1-CD1 3.94Å; I280-Y358 HydrophobicContact CD1-CE1 4.27Å; I280-Y358 HydrophobicContact CD1-CG 4.25Å; I280-F359 HydrophobicContact CG2-CE2 3.89Å; I280-F359 HydrophobicContact CG2-CZ 4.33Å
281L98.3Very high97.8Very high18 Ų1836.4 Ų36.49%0.09419%0.188CC..Hα-helixtrans-52.9-50.5174.4169.266.8000111.6L149 A277 Y278 A279 S283 G290 V291 L294L149-L281 HydrophobicContact CD1-CD1 4.36Å; L149-L281 HydrophobicContact CD1-CD2 3.63Å; L149-L281 HydrophobicContact CD2-CD1 4.24Å; L149-L281 HydrophobicContact CD2-CD2 4.12Å; A277-L281 PolarHBondContact O-N 2.87Å; Y278-L281 HydrophobicContact CD2-CD2 4.02Å; Y278-L281 HydrophobicContact CE2-CD2 4.36Å; Y278-L281 WeakPolarHBondContact O-CB 3.31Å; Y278-L281 PolarHBondContact O-N 3.33Å; A279-L281 PolarHBondContact O-N 3.34Å; L281-S283 VanDerWaalsContact C-N 3.3Å; L281-S283 PolarHBondContact O-N 3.23Å; L281-G290 WeakPolarHBondContact CD1-O 3.39Å; L281-V291 HydrophobicContact CD1-CG2 4.21Å; L281-L294 HydrophobicContact CB-CB 4.25Å; L281-L294 HydrophobicContact CB-CD1 4.3Å
282R97.4Very high97.8Very high60 Ų6039.7 Ų39.723%0.22621%0.205CC..Hα-helixtrans-73.6-18.9-175.9-67.5-169.2-59170.810.2113.8H267 Y278 A279 I280 I284 I338 G339 Q341H267-R282 PolarHBondContact NE2-NH1 3.19Å; Y278-R282 HydrophobicContact CD2-CG 4.47Å; Y278-R282 VanDerWaalsContact CE1-CZ 3.49Å; Y278-R282 HydrophobicContact CE2-CG 4.09Å; Y278-R282 VanDerWaalsContact CZ-CD 3.5Å; Y278-R282 WeakPolarHBondContact O-CG 3.49Å; Y278-R282 PolarHBondContact O-N 3.04Å; Y278-R282 VanDerWaalsContact O-N 3.14Å; A279-R282 PolarHBondContact O-N 2.9Å; I280-R282 VanDerWaalsContact C-N 3.34Å; I280-R282 PolarHBondContact O-N 3.11Å; R282-I284 VanDerWaalsContact C-N 3.26Å; R282-I284 PolarHBondContact O-N 3.22Å; R282-I338 PolarHBondContact NH2-O 3.24Å; R282-G339 PolarHBondContact NH2-O 3.05Å; R282-Q341 PolarHBondContact NH1-O 3.04Å; R282-Q341 PolarHBondContact NH2-O 3.32Å
283S97.9Very high97.8Very high12 Ų1237.1 Ų37.18%0.08420%0.197CC..Hα-helixtrans-68.7-24179.8-67.90000113.4A279 I280 L281 G351 Q352 S355A279-S283 PolarHBondContact O-N 2.89Å; A279-S283 VanDerWaalsContact O-N 3.07Å; A279-S283 PolarHBondContact O-OG 2.98Å; I280-S283 WeakPolarHBondContact O-CB 3.48Å; I280-S283 PolarHBondContact O-N 3.26Å; L281-S283 VanDerWaalsContact C-N 3.3Å; L281-S283 PolarHBondContact O-N 3.23Å; S283-G351 PolarHBondContact OG-O 3.13Å; S283-Q352 WeakPolarHBondContact O-CG 3.48Å; S283-Q352 PolarHBondContact O-NE2 2.77Å; S283-Q352 PolarHBondContact OG-N 2.91Å; S283-S355 WeakPolarHBondContact CB-OG 3.46Å; S283-S355 PolarHBondContact OG-OG 3.21Å
284I97.8Very high97.8Very high65 Ų6538.4 Ų38.433%0.33321%0.205SC..SBendtrans-97118.3-179-58.1-174.3000109.5R282 N286 A293R282-I284 VanDerWaalsContact C-N 3.26Å; R282-I284 PolarHBondContact O-N 3.22Å; I284-N286 HydrophobicContact CG2-CB 4.14Å; I284-N286 PolarHBondContact O-N 2.93Å; I284-A293 HydrophobicContact CD1-CB 3.31Å; I284-A293 HydrophobicContact CG1-CB 4.39Å
285P96.3Very high97.7Very high128 Ų12840.5 Ų40.583%0.83122%0.217SC*.SBendtrans-78.144.6-179.334.9-37.2000112.2
286N97.4Very high97.6Very high94 Ų9443.8 Ų43.850%0.50323%0.234SC..SBendtrans-150.8128176.1-180-81.1000108.8I284 L288 G289 G290I284-N286 HydrophobicContact CG2-CB 4.14Å; I284-N286 PolarHBondContact O-N 2.93Å; N286-L288 PolarHBondContact O-N 3.42Å; N286-L288 PolarHBondContact OD1-N 3.27Å; N286-L288 VanDerWaalsContact OD1-N 3.09Å; N286-G289 PolarHBondContact O-N 2.93Å; N286-G289 PolarHBondContact OD1-N 3.13Å; N286-G290 PolarHBondContact O-N 3.3Å
287K94.4Very high97.6Very high98 Ų9842.8 Ų42.843%0.42623%0.23SC..Hα-helixtrans-57.9-52.3-175.5-165.6-174.5178.8178.80112.1N148 S151 A152 G290 V291N148-K287 WeakPolarHBondContact O-CE 3.32Å; N148-K287 PolarHBondContact O-NZ 3.46Å; S151-K287 PolarHBondContact OG-NZ 3.28Å; A152-K287 HydrophobicContact CB-CB 4.39Å; A152-K287 HydrophobicContact CB-CD 3.91Å; A152-K287 HydrophobicContact CB-CG 3.84Å; K287-G290 PolarHBondContact O-N 3.25Å; K287-V291 VanDerWaalsContact O-CG2 3.3Å; K287-V291 WeakPolarHBondContact O-CG2 3.36Å; K287-V291 PolarHBondContact O-N 3.2Å; K287-V291 VanDerWaalsContact O-N 3.09Å
288L96.5Very high97.6Very high59 Ų5943.3 Ų43.331%0.30923%0.232SC..Hα-helixtrans-65.2-45.5-179.8176.860.1000111.4A152 P154 N286 G290 V291 L292A152-L288 HydrophobicContact CB-CB 4.23Å; A152-L288 HydrophobicContact CB-CD1 4.41Å; P154-L288 HydrophobicContact CG-CD2 4.34Å; N286-L288 PolarHBondContact O-N 3.42Å; N286-L288 PolarHBondContact OD1-N 3.27Å; N286-L288 VanDerWaalsContact OD1-N 3.09Å; L288-G290 VanDerWaalsContact C-N 3.34Å; L288-G290 PolarHBondContact O-N 2.91Å; L288-V291 PolarHBondContact O-N 3.12Å; L288-L292 HydrophobicContact CD1-CD1 4.26Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.14Å; L288-L292 HydrophobicContact CG-CG 4.47Å; L288-L292 WeakPolarHBondContact O-CG 3.38Å; L288-L292 PolarHBondContact O-N 3.41Å
289G98Very high97.6Very high21 Ų2145.5 Ų45.522%0.21625%0.246CC..Hα-helixtrans-58.3-44.4177.900000112.5N286 L292 A293N286-G289 PolarHBondContact O-N 2.93Å; N286-G289 PolarHBondContact OD1-N 3.13Å; G289-L292 PolarHBondContact O-N 2.96Å; G289-A293 WeakPolarHBondContact O-CB 3.44Å; G289-A293 PolarHBondContact O-N 3.46Å
290G97.8Very high97.5Very high1 Ų145.7 Ų45.71%0.0125%0.246CC..Hα-helixtrans-61.9-43.1175.200000112.7L281 N286 K287 L288 A293 L294L281-G290 WeakPolarHBondContact CD1-O 3.39Å; N286-G290 PolarHBondContact O-N 3.3Å; K287-G290 PolarHBondContact O-N 3.25Å; L288-G290 VanDerWaalsContact C-N 3.34Å; L288-G290 PolarHBondContact O-N 2.91Å; G290-A293 PolarHBondContact O-N 3.31Å; G290-L294 WeakPolarHBondContact O-CB 3.48Å; G290-L294 PolarHBondContact O-N 3.01Å
291V97.3Very high97.5Very high9 Ų946.5 Ų46.56%0.05525%0.25CS..Hα-helixtrans-63.4-42.8176.7173.40000111.5L149 A152 L281 K287 L288 L294 I295L149-V291 HydrophobicContact CB-CG2 3.7Å; L149-V291 HydrophobicContact CD2-CG2 4.03Å; L149-V291 HydrophobicContact CG-CG2 4.28Å; A152-V291 HydrophobicContact CB-CG2 4.4Å; L281-V291 HydrophobicContact CD1-CG2 4.21Å; K287-V291 VanDerWaalsContact O-CG2 3.3Å; K287-V291 WeakPolarHBondContact O-CG2 3.36Å; K287-V291 PolarHBondContact O-N 3.2Å; K287-V291 VanDerWaalsContact O-N 3.09Å; L288-V291 PolarHBondContact O-N 3.12Å; V291-L294 WeakPolarHBondContact O-CB 3.33Å; V291-L294 PolarHBondContact O-N 3.21Å; V291-I295 HydrophobicContact CG1-CD1 4.13Å; V291-I295 WeakPolarHBondContact O-CG1 3.49Å; V291-I295 PolarHBondContact O-N 2.96Å; V291-I295 VanDerWaalsContact O-N 3.13Å
292L97.9Very high97.5Very high91 Ų9146.9 Ų46.948%0.47626%0.256SS..Hα-helixtrans-62.1-43.8175.2-68.4174.5000111.2L288 G289 L294 I295 L296L288-L292 HydrophobicContact CD1-CD1 4.26Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.14Å; L288-L292 HydrophobicContact CG-CG 4.47Å; L288-L292 WeakPolarHBondContact O-CG 3.38Å; L288-L292 PolarHBondContact O-N 3.41Å; G289-L292 PolarHBondContact O-N 2.96Å; L292-L294 PolarHBondContact O-N 2.99Å; L292-I295 PolarHBondContact O-N 3.18Å; L292-L296 VanDerWaalsContact O-CB 3.28Å; L292-L296 WeakPolarHBondContact O-CB 3.23Å; L292-L296 WeakPolarHBondContact O-CG 3.46Å; L292-L296 PolarHBondContact O-N 3.27Å
293A98.2Very high97.6Very high8 Ų847.9 Ų47.97%0.06627%0.266CS..Hα-helixtrans-66.2-36.8178.300000113.3I280 I284 G289 G290 L296 S297I280-A293 HydrophobicContact CG2-CB 3.82Å; I284-A293 HydrophobicContact CD1-CB 3.31Å; I284-A293 HydrophobicContact CG1-CB 4.39Å; G289-A293 WeakPolarHBondContact O-CB 3.44Å; G289-A293 PolarHBondContact O-N 3.46Å; G290-A293 PolarHBondContact O-N 3.31Å; A293-L296 PolarHBondContact O-N 3.06Å; A293-S297 WeakPolarHBondContact O-CB 3.34Å; A293-S297 PolarHBondContact O-N 2.94Å
294L97.5Very high97.6Very high36 Ų3647.9 Ų47.919%0.18826%0.264CS..Hα-helixtrans-56.8-52.7172.1176.874000110.7L149 A277 L281 G290 V291 L292 L296 S297L149-L294 HydrophobicContact CD1-CD2 4.09Å; A277-L294 VanDerWaalsContact C-CD1 3.4Å; A277-L294 HydrophobicContact CB-CD1 3.44Å; A277-L294 VanDerWaalsContact CB-CD1 3.44Å; A277-L294 WeakPolarHBondContact O-CD1 3.31Å; L281-L294 HydrophobicContact CB-CB 4.25Å; L281-L294 HydrophobicContact CB-CD1 4.3Å; G290-L294 WeakPolarHBondContact O-CB 3.48Å; G290-L294 PolarHBondContact O-N 3.01Å; V291-L294 WeakPolarHBondContact O-CB 3.33Å; V291-L294 PolarHBondContact O-N 3.21Å; L292-L294 PolarHBondContact O-N 2.99Å; L294-L296 PolarHBondContact O-N 3.25Å; L294-S297 PolarHBondContact O-N 2.86Å; L294-S297 PolarHBondContact O-OG 2.9Å
295I96.7Very high97.6Very high74 Ų7445.4 Ų45.438%0.37925%0.252SS..Hα-helixtrans-64.2-44.2-179.3-64.7170000110.2V291 L292 S297 I298 L299V291-I295 HydrophobicContact CG1-CD1 4.13Å; V291-I295 WeakPolarHBondContact O-CG1 3.49Å; V291-I295 PolarHBondContact O-N 2.96Å; V291-I295 VanDerWaalsContact O-N 3.13Å; L292-I295 PolarHBondContact O-N 3.18Å; I295-S297 VanDerWaalsContact C-N 3.28Å; I295-S297 PolarHBondContact O-N 3.19Å; I295-I298 PolarHBondContact O-N 3.38Å; I295-I298 VanDerWaalsContact O-N 3.15Å; I295-L299 HydrophobicContact CG2-CD1 3.54Å; I295-L299 HydrophobicContact CG2-CG 4.01Å; I295-L299 PolarHBondContact O-N 2.94Å
296L97.9Very high97.7Very high89 Ų8946.4 Ų46.447%0.46624%0.244SC..Hα-helixtrans-64.1-29.6178-72.7171.1000112.9L292 A293 L294 I298 L299 I300 F359L292-L296 VanDerWaalsContact O-CB 3.28Å; L292-L296 WeakPolarHBondContact O-CB 3.23Å; L292-L296 WeakPolarHBondContact O-CG 3.46Å; L292-L296 PolarHBondContact O-N 3.27Å; A293-L296 PolarHBondContact O-N 3.06Å; L294-L296 PolarHBondContact O-N 3.25Å; L296-I298 PolarHBondContact O-N 3.44Å; L296-I298 VanDerWaalsContact O-N 3.11Å; L296-L299 PolarHBondContact O-N 3.37Å; L296-I300 WeakPolarHBondContact O-CB 3.33Å; L296-I300 WeakPolarHBondContact O-CG2 3.4Å; L296-I300 PolarHBondContact O-N 3.23Å; L296-F359 HydrophobicContact CB-CE1 4.2Å; L296-F359 HydrophobicContact CB-CZ 4.35Å
297S98.2Very high97.7Very high2 Ų244 Ų441%0.01423%0.231CC..Hα-helixtrans-64.2-14.1175.875.50000114A293 L294 I295 Y358A293-S297 WeakPolarHBondContact O-CB 3.34Å; A293-S297 PolarHBondContact O-N 2.94Å; L294-S297 PolarHBondContact O-N 2.86Å; L294-S297 PolarHBondContact O-OG 2.9Å; I295-S297 VanDerWaalsContact C-N 3.28Å; I295-S297 PolarHBondContact O-N 3.19Å; S297-Y358 PolarHBondContact O-OH 2.84Å
298I98Very high97.9Very high13 Ų1341.7 Ų41.77%0.06722%0.222CC..Hα-helixtrans-109-45.5174.3-53.3160.1000109.3L120 F121 M124 I295 L296 I300 L301L120-I298 HydrophobicContact CD2-CG2 3.84Å; L120-I298 HydrophobicContact CG-CG2 4.41Å; F121-I298 HydrophobicContact CD1-CG2 4.46Å; F121-I298 HydrophobicContact CD2-CG2 4.41Å; F121-I298 HydrophobicContact CE1-CB 4.03Å; F121-I298 HydrophobicContact CE1-CD1 4.01Å; F121-I298 HydrophobicContact CE1-CG2 3.83Å; F121-I298 HydrophobicContact CE2-CB 4.43Å; F121-I298 HydrophobicContact CE2-CG2 3.75Å; F121-I298 HydrophobicContact CZ-CB 3.68Å; F121-I298 HydrophobicContact CZ-CG2 3.42Å; F121-I298 VanDerWaalsContact CZ-CG2 3.42Å; M124-I298 HydrophobicContact CE-CD1 3.37Å; M124-I298 HydrophobicContact CE-CG1 4.24Å; M124-I298 HydrophobicContact SD-CD1 3.74Å; M124-I298 HydrophobicContact SD-CG1 4.43Å; M124-I298 HydrophobicContact SD-CG2 4.45Å; I295-I298 PolarHBondContact O-N 3.38Å; I295-I298 VanDerWaalsContact O-N 3.15Å; L296-I298 PolarHBondContact O-N 3.44Å; L296-I298 VanDerWaalsContact O-N 3.11Å; I298-I300 PolarHBondContact O-N 2.87Å; I298-I300 VanDerWaalsContact O-N 3.17Å; I298-L301 WeakPolarHBondContact O-CB 3.37Å; I298-L301 WeakPolarHBondContact O-CG 3.37Å; I298-L301 PolarHBondContact O-N 3.34Å
299L97.8Very high98Very high76 Ų7641.4 Ų41.440%0.39822%0.222SC..Hα-helixtrans-61.9-23.2179-77.2-177.8000113.5F121 I295 L296 L301 A302F121-L299 HydrophobicContact CE2-CD2 3.64Å; F121-L299 HydrophobicContact CE2-CG 4.27Å; F121-L299 HydrophobicContact CZ-CD2 3.77Å; F121-L299 HydrophobicContact CZ-CG 3.9Å; I295-L299 HydrophobicContact CG2-CD1 3.54Å; I295-L299 HydrophobicContact CG2-CG 4.01Å; I295-L299 PolarHBondContact O-N 2.94Å; L296-L299 PolarHBondContact O-N 3.37Å; L299-L301 PolarHBondContact O-N 2.89Å; L299-L301 VanDerWaalsContact O-N 3.1Å; L299-A302 WeakPolarHBondContact O-CB 3.27Å; L299-A302 PolarHBondContact O-N 3.46Å
300I98.4Very high97.9Very high5 Ų540.7 Ų40.73%0.02621%0.214CC..Hα-helixtrans-56.3-26.1173.8-167.9163.7000112.6L296 I298 A302 L303 Y358 F359 I362 L363L296-I300 WeakPolarHBondContact O-CB 3.33Å; L296-I300 WeakPolarHBondContact O-CG2 3.4Å; L296-I300 PolarHBondContact O-N 3.23Å; I298-I300 PolarHBondContact O-N 2.87Å; I298-I300 VanDerWaalsContact O-N 3.17Å; I300-A302 VanDerWaalsContact C-N 3.27Å; I300-A302 PolarHBondContact O-N 3.41Å; I300-L303 WeakPolarHBondContact O-CB 3.26Å; I300-L303 PolarHBondContact O-N 3.21Å; I300-Y358 HydrophobicContact CG2-CE1 4.16Å; I300-Y358 VanDerWaalsContact CG2-OH 3.28Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.26Å; I300-F359 HydrophobicContact CD1-CD1 3.76Å; I300-F359 HydrophobicContact CD1-CE1 4.19Å; I300-I362 HydrophobicContact CD1-CB 3.81Å; I300-I362 HydrophobicContact CD1-CD1 4.1Å; I300-I362 HydrophobicContact CD1-CG2 3.62Å; I300-I362 HydrophobicContact CG1-CB 4.49Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.29Å; I300-L363 HydrophobicContact CD1-CD1 4.28Å; I300-L363 HydrophobicContact CD1-CD2 3.6Å; I300-L363 HydrophobicContact CD1-CG 3.72Å; I300-L363 HydrophobicContact CG1-CD2 4.03Å
301L98.6Very high97.9Very high17 Ų1745.7 Ų45.79%0.08924%0.235CC..Hα-helixtrans-59.5-37.6173.5-67175.2000111.9V98 L102 W113 V117 L120 I298 L299 L303 M304V98-L301 HydrophobicContact CG1-CD1 4.09Å; V98-L301 HydrophobicContact CG1-CD2 4.06Å; L102-L301 HydrophobicContact CD1-CD2 4.31Å; L102-L301 HydrophobicContact CD2-CD2 4.2Å; W113-L301 HydrophobicContact CH2-CD2 4.47Å; W113-L301 HydrophobicContact CZ2-CB 4.09Å; W113-L301 HydrophobicContact CZ2-CD2 4.06Å; W113-L301 PolarHBondContact NE1-O 3.42Å; V117-L301 HydrophobicContact CG2-CB 3.88Å; L120-L301 HydrophobicContact CD2-CD1 3.76Å; I298-L301 WeakPolarHBondContact O-CB 3.37Å; I298-L301 WeakPolarHBondContact O-CG 3.37Å; I298-L301 PolarHBondContact O-N 3.34Å; L299-L301 PolarHBondContact O-N 2.89Å; L299-L301 VanDerWaalsContact O-N 3.1Å; L301-L303 PolarHBondContact O-N 2.83Å; L301-M304 VanDerWaalsContact O-CB 3.29Å; L301-M304 WeakPolarHBondContact O-CB 3.36Å; L301-M304 VanDerWaalsContact O-CG 3.28Å; L301-M304 WeakPolarHBondContact O-CG 3.25Å; L301-M304 PolarHBondContact O-N 2.86Å; L301-M304 VanDerWaalsContact O-N 3.12Å
302A98.4Very high97.9Very high26 Ų2647.8 Ų47.822%0.21525%0.245CC..Hα-helixtrans-66.3-19.6176.800000112.8L299 I300 P305L299-A302 WeakPolarHBondContact O-CB 3.27Å; L299-A302 PolarHBondContact O-N 3.46Å; I300-A302 VanDerWaalsContact C-N 3.27Å; I300-A302 PolarHBondContact O-N 3.41Å; A302-P305 WeakPolarHBondContact O-CD 3.27Å
303L98.1Very high97.9Very high81 Ų8145.9 Ų45.942%0.42423%0.231SC..Hα-helixtrans-82-16.8175.8-58.3-179.2000113.1I300 L301 P305 F306 L307 L363I300-L303 WeakPolarHBondContact O-CB 3.26Å; I300-L303 PolarHBondContact O-N 3.21Å; L301-L303 PolarHBondContact O-N 2.83Å; L303-P305 VanDerWaalsContact C-CD 3.42Å; L303-F306 PolarHBondContact O-N 3.29Å; L303-L307 HydrophobicContact CB-CD1 3.99Å; L303-L307 HydrophobicContact CB-CG 4.39Å; L303-L307 WeakPolarHBondContact O-CG 3.46Å; L303-L307 PolarHBondContact O-N 3.28Å; L303-L307 VanDerWaalsContact O-N 3.09Å; L303-L363 HydrophobicContact CD1-CD2 4.45Å
304M98.2Very high97.9Very high12 Ų1245.6 Ų45.66%0.05923%0.229CC..THydrogen-bonded Turntrans-51.8-43.5-175.9-69.4-61.1-48.200114.9L102 Y107 W113 L301 F306 L307 H308 I362L102-M304 HydrophobicContact CD2-CE 3.7Å; L102-M304 HydrophobicContact CD2-CG 3.7Å; L102-M304 HydrophobicContact CD2-SD 3.86Å; Y107-M304 HydrophobicContact CD1-CB 4.19Å; Y107-M304 HydrophobicContact CD1-CE 4.32Å; Y107-M304 HydrophobicContact CD2-CB 4.16Å; Y107-M304 HydrophobicContact CE1-CE 3.86Å; Y107-M304 HydrophobicContact CG-CB 3.93Å; W113-M304 HydrophobicContact CZ2-CB 4.31Å; W113-M304 HydrophobicContact CZ2-CG 4.15Å; L301-M304 VanDerWaalsContact O-CB 3.29Å; L301-M304 WeakPolarHBondContact O-CB 3.36Å; L301-M304 VanDerWaalsContact O-CG 3.28Å; L301-M304 WeakPolarHBondContact O-CG 3.25Å; L301-M304 PolarHBondContact O-N 2.86Å; L301-M304 VanDerWaalsContact O-N 3.12Å; M304-F306 PolarHBondContact O-N 3.42Å; M304-L307 PolarHBondContact O-N 3.34Å; M304-H308 PolarHBondContact O-N 3.49Å; M304-I362 HydrophobicContact SD-CG2 3.63Å
305P97.9Very high97.9Very high13 Ų1344.2 Ų44.28%0.08422%0.221CC..THydrogen-bonded Turntrans-62.5-31.3178.8-19.632.7000113.1Y107 M110 A302 L303Y107-P305 WeakPolarHBondContact O-CG 3.43Å; M110-P305 HydrophobicContact CE-CB 3.89Å; M110-P305 HydrophobicContact CG-CB 3.97Å; M110-P305 HydrophobicContact CG-CG 4.35Å; M110-P305 HydrophobicContact SD-CB 4.32Å; A302-P305 WeakPolarHBondContact O-CD 3.27Å; L303-P305 VanDerWaalsContact C-CD 3.42Å
306F98.1Very high98Very high150 Ų15044.6 Ų44.666%0.65822%0.223SC*.THydrogen-bonded Turntrans-84.7-21.2-179.5-52.7-71.5000113L303 M304 H308L303-F306 PolarHBondContact O-N 3.29Å; M304-F306 PolarHBondContact O-N 3.42Å; F306-H308 VanDerWaalsContact C-N 3.31Å
307L98.2Very high98Very high42 Ų4245.3 Ų45.322%0.2222%0.222CC..SBendtrans-85.7-3.1176.2-65.4171.7000112.8L303 M304 T309 I362 L363 P367L303-L307 HydrophobicContact CB-CD1 3.99Å; L303-L307 HydrophobicContact CB-CG 4.39Å; L303-L307 WeakPolarHBondContact O-CG 3.46Å; L303-L307 PolarHBondContact O-N 3.28Å; L303-L307 VanDerWaalsContact O-N 3.09Å; M304-L307 PolarHBondContact O-N 3.34Å; L307-T309 PolarHBondContact O-N 3.11Å; L307-I362 HydrophobicContact CD1-CG2 4.09Å; L307-L363 HydrophobicContact CD1-CD2 3.85Å; L307-P367 HydrophobicContact CB-CG 4.18Å; L307-P367 HydrophobicContact CD2-CG 4.31Å
308H98.2Very high98Very high51 Ų5145.5 Ų45.524%0.23622%0.223CC..  trans-74.6111.1179.7-166.183000111.4Y107 M304 F306 S310Y107-H308 HydrophobicContact CE2-CB 3.95Å; Y107-H308 AromaticContact CE2-ND1 3.53Å; Y107-H308 AromaticContact CZ-ND1 3.59Å; Y107-H308 PolarHBondContact OH-ND1 3.35Å; M304-H308 PolarHBondContact O-N 3.49Å; F306-H308 VanDerWaalsContact C-N 3.31Å; H308-S310 PolarHBondContact CD2-O 3.08Å; H308-S310 VanDerWaalsContact CD2-O 3.32Å; H308-S310 PolarHBondContact NE2-O 3.39Å
309T97.8Very high98Very high52 Ų5248.9 Ų48.932%0.31925%0.245SC..  trans-106.3-23.3-178.952.30000114.2L307 P367 I371L307-T309 PolarHBondContact O-N 3.11Å; T309-P367 HydrophobicContact CG2-CB 3.85Å; T309-P367 WeakPolarHBondContact OG1-CA 3.37Å; T309-P367 PolarHBondContact OG1-O 2.9Å; T309-I371 HydrophobicContact CG2-CD1 4.24Å; T309-I371 HydrophobicContact CG2-CG1 4.2Å
310S97.4Very high98Very high7 Ų748.3 Ų48.35%0.04924%0.242CC..  trans-73.6147-174.8162.70000112.2H308 Q312 R318 D374H308-S310 PolarHBondContact CD2-O 3.08Å; H308-S310 VanDerWaalsContact CD2-O 3.32Å; H308-S310 PolarHBondContact NE2-O 3.39Å; S310-Q312 VanDerWaalsContact C-N 3.34Å; S310-Q312 PolarHBondContact OG-N 3.06Å; S310-Q312 PolarHBondContact OG-O 3.48Å; S310-R318 WeakPolarHBondContact OG-CD 3.35Å; S310-R318 VanDerWaalsContact OG-CZ 3.29Å; S310-R318 PolarHBondContact OG-NE 2.82Å; S310-R318 PolarHBondContact OG-NH1 2.95Å; S310-D374 WeakPolarHBondContact CA-OD2 3.45Å
311K96.6Very high98Very high105 Ų10548.2 Ų48.246%0.45724%0.242SC..SBendtrans-78.9-19.1171.4-72.6176167.9-159.30113.8D374 L379 Y380 P381K311-D374 WeakPolarHBondContact CG-OD2 3.04Å; K311-D374 PolarHBondContact N-OD1 3.29Å; K311-D374 PolarHBondContact N-OD2 2.9Å; K311-L379 HydrophobicContact CB-CD1 4.2Å; K311-L379 HydrophobicContact CD-CB 3.66Å; K311-L379 WeakPolarHBondContact CD-O 3.25Å; K311-L379 VanDerWaalsContact CE-O 3.31Å; K311-L379 WeakPolarHBondContact CE-O 3.22Å; K311-L379 PolarHBondContact NZ-O 3.22Å; K311-Y380 PolarHBondContact NZ-O 3.15Å; K311-P381 VanDerWaalsContact NZ-CA 3.28Å
312Q97.4Very high98Very high54 Ų5449.7 Ų49.725%0.25225%0.248SC..SBendtrans-92.8128.2171.4-65177.8-30.800110.3S310 R318S310-Q312 VanDerWaalsContact C-N 3.34Å; S310-Q312 PolarHBondContact OG-N 3.06Å; S310-Q312 PolarHBondContact OG-O 3.48Å; Q312-R318 HydrophobicContact CB-CG 4.41Å
313R97.7Very high98Very high50 Ų5053.6 Ų53.619%0.18926%0.264CS..SBendtrans-66.7-55.1-177.7-175-176.6-173173.88.3112.9G105 T108 F109 N206G105-R313 PolarHBondContact O-NE 2.94Å; T108-R313 PolarHBondContact OG1-NE 2.95Å; T108-R313 PolarHBondContact OG1-NH2 3.38Å; F109-R313 VanDerWaalsContact CD2-NH2 3.31Å; N206-R313 PolarHBondContact ND2-NE 3.4Å; N206-R313 PolarHBondContact OD1-NH1 3.04Å; N206-R313 VanDerWaalsContact OD1-NH1 3.14Å
314S98.2Very high98Very high2 Ų250.9 Ų50.91%0.01425%0.25CS..SBendtrans-83.9149.9-175.2175.10000111.7Y104 P208 M316 R318Y104-S314 WeakPolarHBondContact CD1-OG 3.33Å; P208-S314 WeakPolarHBondContact O-CB 3.27Å; P208-S314 PolarHBondContact O-OG 3.24Å; S314-M316 PolarHBondContact O-N 3.25Å; S314-M316 WeakPolarHBondContact OG-CB 3.36Å; S314-M316 PolarHBondContact OG-N 3.47Å; S314-M316 VanDerWaalsContact OG-N 3.08Å; S314-R318 WeakPolarHBondContact O-CD 3.39Å
315L98.5Very high98.1Very high7 Ų751.3 Ų51.34%0.03725%0.251CS..G310 helixtrans-73.3-9.7170.4-60.6-170.3000113.2Y103 F317 R318 T321 Q322 Y325Y103-L315 HydrophobicContact CD1-CB 4.4Å; Y103-L315 HydrophobicContact CD2-CB 4.27Å; Y103-L315 HydrophobicContact CD2-CD1 4.03Å; Y103-L315 HydrophobicContact CE1-CB 4.3Å; Y103-L315 HydrophobicContact CE2-CB 4.19Å; Y103-L315 HydrophobicContact CE2-CD1 4.44Å; Y103-L315 HydrophobicContact CG-CB 4.4Å; Y103-L315 HydrophobicContact CG-CD1 4.48Å; Y103-L315 VanDerWaalsContact O-CB 3.23Å; Y103-L315 WeakPolarHBondContact O-CB 2.88Å; Y103-L315 WeakPolarHBondContact O-CG 3.41Å; Y103-L315 PolarHBondContact O-N 3Å; L315-F317 PolarHBondContact O-N 3.37Å; L315-R318 HydrophobicContact CD2-CB 4.39Å; L315-R318 PolarHBondContact O-N 2.98Å; L315-T321 HydrophobicContact CD1-CG2 4.09Å; L315-T321 HydrophobicContact CD2-CG2 3.41Å; L315-T321 VanDerWaalsContact CD2-CG2 3.41Å; L315-T321 HydrophobicContact CG-CG2 4.39Å; L315-Q322 HydrophobicContact CB-CG 3.98Å; L315-Q322 WeakPolarHBondContact O-CG 3.37Å; L315-Q322 PolarHBondContact O-NE2 2.98Å; L315-Y325 HydrophobicContact CD1-CD2 4.42Å; L315-Y325 HydrophobicContact CD1-CG 4.27Å
316M97.9Very high98.1Very high83 Ų8357 Ų5741%0.40927%0.271SS..G310 helixtrans-48.8-34.4-175.8-177.6173.8-179.100114.6T209 S314 Q322T209-M316 HydrophobicContact CG2-SD 4.08Å; S314-M316 PolarHBondContact O-N 3.25Å; S314-M316 WeakPolarHBondContact OG-CB 3.36Å; S314-M316 PolarHBondContact OG-N 3.47Å; S314-M316 VanDerWaalsContact OG-N 3.08Å; M316-Q322 VanDerWaalsContact C-NE2 3.32Å; M316-Q322 PolarHBondContact O-NE2 3Å
317F97.7Very high98.1Very high103 Ų10353.9 Ų53.945%0.45226%0.261SS..G310 helixtrans-111.418.3-179-52.4-61.8000113.7L315 P319L315-F317 PolarHBondContact O-N 3.37Å; F317-P319 WeakPolarHBondContact O-CD 3.5Å
318R98.2Very high98.2Very high7 Ų752.2 Ų52.23%0.02625%0.252CS..  trans-123.576.8-171.7-68-178.960.3-164-3.5111.5S310 Q312 S314 L315 I320 T321 Q322 E373S310-R318 WeakPolarHBondContact OG-CD 3.35Å; S310-R318 VanDerWaalsContact OG-CZ 3.29Å; S310-R318 PolarHBondContact OG-NE 2.82Å; S310-R318 PolarHBondContact OG-NH1 2.95Å; Q312-R318 HydrophobicContact CB-CG 4.41Å; S314-R318 WeakPolarHBondContact O-CD 3.39Å; L315-R318 HydrophobicContact CD2-CB 4.39Å; L315-R318 PolarHBondContact O-N 2.98Å; R318-I320 PolarHBondContact O-N 3.3Å; R318-T321 PolarHBondContact NH2-OG1 2.99Å; R318-T321 PolarHBondContact O-N 3.49Å; R318-Q322 WeakPolarHBondContact O-CG 3.45Å; R318-Q322 PolarHBondContact O-N 2.94Å; R318-E373 WeakPolarHBondContact CA-OE1 3.5Å; R318-E373 WeakPolarHBondContact CB-OE1 3.34Å; R318-E373 WeakPolarHBondContact CB-OE2 3.42Å; R318-E373 IonicContact CZ-OE2 3.8Å; R318-E373 IonicContact NE-OE2 3.47Å; R318-E373 PolarHBondContact NE-OE2 3.19Å; R318-E373 IonicContact NH2-OE2 2.82Å; R318-E373 PolarHBondContact NH2-OE2 3.34Å
319P98.1Very high98.2Very high83 Ų8351.8 Ų51.854%0.53925%0.252SS..Hα-helixtrans-64.2-33.9-167.124.4-34.3000114F317 I323F317-P319 WeakPolarHBondContact O-CD 3.5Å; P319-I323 WeakPolarHBondContact O-CG1 3.27Å; P319-I323 PolarHBondContact O-N 2.65Å
320I98.3Very high98.3Very high64 Ų6451.5 Ų51.533%0.32826%0.255SS..Hα-helixtrans-68-47.3179.1-57.9176.2000108.7R318 Q322 I323 L324 I372 E373 M376R318-I320 PolarHBondContact O-N 3.3Å; I320-Q322 VanDerWaalsContact C-N 3.34Å; I320-Q322 PolarHBondContact O-N 3.39Å; I320-I323 PolarHBondContact O-N 2.95Å; I320-L324 PolarHBondContact O-N 3.11Å; I320-L324 VanDerWaalsContact O-N 3.16Å; I320-I372 HydrophobicContact CD1-CG2 4.1Å; I320-E373 WeakPolarHBondContact CA-OE1 3.41Å; I320-E373 HydrophobicContact CB-CG 4.22Å; I320-E373 WeakPolarHBondContact CB-OE1 3.35Å; I320-E373 HydrophobicContact CD1-CG 4.13Å; I320-E373 HydrophobicContact CG1-CG 4.35Å; I320-E373 PolarHBondContact N-OE1 2.96Å; I320-M376 HydrophobicContact CD1-SD 3.98Å
321T98.4Very high98.3Very high4 Ų451.6 Ų51.63%0.02526%0.256CS..Hα-helixtrans-71.1-29.6-179.1-50.10000112.3L315 R318 L324 Y325 M366 S369 E373L315-T321 HydrophobicContact CD1-CG2 4.09Å; L315-T321 HydrophobicContact CD2-CG2 3.41Å; L315-T321 VanDerWaalsContact CD2-CG2 3.41Å; L315-T321 HydrophobicContact CG-CG2 4.39Å; R318-T321 PolarHBondContact NH2-OG1 2.99Å; R318-T321 PolarHBondContact O-N 3.49Å; T321-L324 PolarHBondContact O-N 3.02Å; T321-Y325 PolarHBondContact O-N 2.9Å; T321-M366 HydrophobicContact CG2-CG 4.28Å; T321-S369 WeakPolarHBondContact OG1-CB 3.42Å; T321-S369 PolarHBondContact OG1-OG 3.01Å; T321-E373 PolarHBondContact N-OE1 3.44Å; T321-E373 VanDerWaalsContact OG1-CD 3.27Å; T321-E373 PolarHBondContact OG1-OE1 3.2Å; T321-E373 PolarHBondContact OG1-OE2 3.38Å
322Q98.6Very high98.4Very high47 Ų4749.2 Ų49.222%0.2225%0.247CC..Hα-helixtrans-59.9-44.9170-77.5-178.942.600112.2Y103 L315 M316 R318 I320 L324 Y325 W326Y103-Q322 HydrophobicContact CE2-CG 4.07Å; Y103-Q322 VanDerWaalsContact OH-CD 3.24Å; Y103-Q322 WeakPolarHBondContact OH-CG 2.96Å; Y103-Q322 PolarHBondContact OH-OE1 2.57Å; L315-Q322 HydrophobicContact CB-CG 3.98Å; L315-Q322 WeakPolarHBondContact O-CG 3.37Å; L315-Q322 PolarHBondContact O-NE2 2.98Å; M316-Q322 VanDerWaalsContact C-NE2 3.32Å; M316-Q322 PolarHBondContact O-NE2 3Å; R318-Q322 WeakPolarHBondContact O-CG 3.45Å; R318-Q322 PolarHBondContact O-N 2.94Å; I320-Q322 VanDerWaalsContact C-N 3.34Å; I320-Q322 PolarHBondContact O-N 3.39Å; Q322-L324 VanDerWaalsContact C-N 3.33Å; Q322-L324 PolarHBondContact O-N 3Å; Q322-Y325 WeakPolarHBondContact O-CB 3.45Å; Q322-Y325 PolarHBondContact O-N 2.89Å; Q322-W326 VanDerWaalsContact O-CD1 3.24Å; Q322-W326 PolarHBondContact O-N 3.32Å
323I98.7Very high98.5Very high108 Ų10852.2 Ų52.255%0.55427%0.265SS*.Hα-helixtrans-61.4-45.6176.8-68.1167.2000109.8P319 I320 Y325 W326 I327P319-I323 WeakPolarHBondContact O-CG1 3.27Å; P319-I323 PolarHBondContact O-N 2.65Å; I320-I323 PolarHBondContact O-N 2.95Å; I323-Y325 VanDerWaalsContact C-N 3.31Å; I323-Y325 PolarHBondContact O-N 3.31Å; I323-W326 PolarHBondContact O-N 2.67Å; I323-I327 HydrophobicContact CG2-CD1 3.75Å; I323-I327 HydrophobicContact CG2-CG1 4.32Å; I323-I327 VanDerWaalsContact O-CG1 3.3Å; I323-I327 WeakPolarHBondContact O-CG1 3.47Å; I323-I327 PolarHBondContact O-N 3.26Å
324L98.8Very high98.6Very high24 Ų2453.2 Ų53.213%0.12627%0.273CS..Hα-helixtrans-60.6-38176.4-69.2176000112.8I320 T321 Q322 I327 L328 I361 L365 M366I320-L324 PolarHBondContact O-N 3.11Å; I320-L324 VanDerWaalsContact O-N 3.16Å; T321-L324 PolarHBondContact O-N 3.02Å; Q322-L324 VanDerWaalsContact C-N 3.33Å; Q322-L324 PolarHBondContact O-N 3Å; L324-I327 PolarHBondContact O-N 3.19Å; L324-L328 WeakPolarHBondContact O-CB 3.44Å; L324-L328 PolarHBondContact O-N 3.23Å; L324-I361 HydrophobicContact CB-CG2 4.47Å; L324-L365 HydrophobicContact CD1-CB 3.96Å; L324-L365 HydrophobicContact CD2-CB 4.18Å; L324-L365 HydrophobicContact CD2-CD1 4.25Å; L324-M366 HydrophobicContact CB-CE 4.38Å; L324-M366 HydrophobicContact CB-CG 4.26Å; L324-M366 HydrophobicContact CD1-CG 4.43Å
325Y98.8Very high98.6Very high22 Ų2253.1 Ų53.19%0.08627%0.272CS..Hα-helixtrans-61.4-46.5173.8171.3-89.3000111.8G99 L102 Y103 L315 T321 Q322 I323 I327 L328 V329G99-Y325 WeakPolarHBondContact CA-OH 3.41Å; G99-Y325 PolarHBondContact O-OH 3.48Å; L102-Y325 HydrophobicContact CB-CD2 4.49Å; L102-Y325 HydrophobicContact CB-CE2 4.1Å; Y103-Y325 AromaticContact CD2-CD1 3.45Å; Y103-Y325 HydrophobicContact CD2-CD1 3.45Å; Y103-Y325 VanDerWaalsContact CD2-CD1 3.45Å; Y103-Y325 HydrophobicContact CD2-CD2 4.13Å; Y103-Y325 AromaticContact CD2-CE1 3.58Å; Y103-Y325 HydrophobicContact CD2-CE1 3.58Å; Y103-Y325 HydrophobicContact CD2-CE2 4.24Å; Y103-Y325 AromaticContact CD2-CG 3.74Å; Y103-Y325 HydrophobicContact CD2-CG 3.74Å; Y103-Y325 AromaticContact CD2-CZ 3.98Å; Y103-Y325 AromaticContact CE2-CD1 3.94Å; Y103-Y325 HydrophobicContact CE2-CD1 3.94Å; Y103-Y325 HydrophobicContact CE2-CE1 4.29Å; Y103-Y325 HydrophobicContact CE2-CG 4.41Å; Y103-Y325 HydrophobicContact CG-CE1 4.42Å; L315-Y325 HydrophobicContact CD1-CD2 4.42Å; L315-Y325 HydrophobicContact CD1-CG 4.27Å; T321-Y325 PolarHBondContact O-N 2.9Å; Q322-Y325 WeakPolarHBondContact O-CB 3.45Å; Q322-Y325 PolarHBondContact O-N 2.89Å; I323-Y325 VanDerWaalsContact C-N 3.31Å; I323-Y325 PolarHBondContact O-N 3.31Å; Y325-I327 VanDerWaalsContact C-N 3.35Å; Y325-I327 PolarHBondContact O-N 2.95Å; Y325-L328 WeakPolarHBondContact O-CB 3.45Å; Y325-L328 PolarHBondContact O-N 3.42Å; Y325-L328 VanDerWaalsContact O-N 3.15Å; Y325-V329 HydrophobicContact CD1-CG2 4.22Å; Y325-V329 HydrophobicContact CE1-CG2 3.72Å; Y325-V329 HydrophobicContact CE2-CG2 4.34Å; Y325-V329 WeakPolarHBondContact O-CG2 3.44Å; Y325-V329 PolarHBondContact O-N 3.3Å
326W98.8Very high98.6Very high132 Ų13254.6 Ų54.650%0.528%0.281SS..Hα-helixtrans-70.6-32179.3-72.7115.8000112.8Q322 I323 L328 V329 A330Q322-W326 VanDerWaalsContact O-CD1 3.24Å; Q322-W326 PolarHBondContact O-N 3.32Å; I323-W326 PolarHBondContact O-N 2.67Å; W326-L328 VanDerWaalsContact C-N 3.32Å; W326-V329 HydrophobicContact CE3-CB 4.11Å; W326-V329 HydrophobicContact CE3-CG1 4.24Å; W326-V329 HydrophobicContact CE3-CG2 4.18Å; W326-V329 HydrophobicContact CZ3-CG1 4.27Å; W326-V329 HydrophobicContact CZ3-CG2 4.41Å; W326-V329 PolarHBondContact O-N 2.94Å; W326-A330 WeakPolarHBondContact O-CB 3.18Å; W326-A330 PolarHBondContact O-N 3.31Å
327I98.8Very high98.7Very high85 Ų8556.6 Ų56.644%0.43629%0.285SS..Hα-helixtrans-62.5-41.3168.8-66.9169.9000110.2I323 L324 Y325 A330 N331 I361I323-I327 HydrophobicContact CG2-CD1 3.75Å; I323-I327 HydrophobicContact CG2-CG1 4.32Å; I323-I327 VanDerWaalsContact O-CG1 3.3Å; I323-I327 WeakPolarHBondContact O-CG1 3.47Å; I323-I327 PolarHBondContact O-N 3.26Å; L324-I327 PolarHBondContact O-N 3.19Å; Y325-I327 VanDerWaalsContact C-N 3.35Å; Y325-I327 PolarHBondContact O-N 2.95Å; I327-A330 PolarHBondContact O-N 3.16Å; I327-N331 VanDerWaalsContact O-CB 3.22Å; I327-N331 WeakPolarHBondContact O-CB 3.28Å; I327-N331 PolarHBondContact O-N 2.77Å; I327-I361 HydrophobicContact CG2-CD1 3.75Å
328L98.9Very high98.7Very high7 Ų752 Ų524%0.03727%0.265CS..Hα-helixtrans-61.9-44.4175178.462.8000111.9L324 Y325 W326 N331 L332 Y358 I361 I362 M366L324-L328 WeakPolarHBondContact O-CB 3.44Å; L324-L328 PolarHBondContact O-N 3.23Å; Y325-L328 WeakPolarHBondContact O-CB 3.45Å; Y325-L328 PolarHBondContact O-N 3.42Å; Y325-L328 VanDerWaalsContact O-N 3.15Å; W326-L328 VanDerWaalsContact C-N 3.32Å; L328-N331 WeakPolarHBondContact O-CB 3.41Å; L328-N331 PolarHBondContact O-N 2.86Å; L328-L332 PolarHBondContact O-N 2.89Å; L328-Y358 HydrophobicContact CD1-CD2 3.68Å; L328-Y358 HydrophobicContact CD1-CE2 4Å; L328-I361 HydrophobicContact CB-CG2 4.05Å; L328-I361 HydrophobicContact CD1-CG2 4.49Å; L328-I362 HydrophobicContact CD1-CD1 4.14Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.2Å; L328-I362 HydrophobicContact CD2-CG1 3.93Å; L328-M366 HydrophobicContact CB-CE 4.35Å; L328-M366 HydrophobicContact CD2-CE 3.94Å
329V98.9Very high98.7Very high41 Ų4151.7 Ų51.725%0.24826%0.263CS..Hα-helixtrans-61.6-47.8176.5173.30000110.8Y325 W326 N331 L332 L333Y325-V329 HydrophobicContact CD1-CG2 4.22Å; Y325-V329 HydrophobicContact CE1-CG2 3.72Å; Y325-V329 HydrophobicContact CE2-CG2 4.34Å; Y325-V329 WeakPolarHBondContact O-CG2 3.44Å; Y325-V329 PolarHBondContact O-N 3.3Å; W326-V329 HydrophobicContact CE3-CB 4.11Å; W326-V329 HydrophobicContact CE3-CG1 4.24Å; W326-V329 HydrophobicContact CE3-CG2 4.18Å; W326-V329 HydrophobicContact CZ3-CG1 4.27Å; W326-V329 HydrophobicContact CZ3-CG2 4.41Å; W326-V329 PolarHBondContact O-N 2.94Å; V329-N331 VanDerWaalsContact C-N 3.27Å; V329-N331 PolarHBondContact O-N 3.06Å; V329-L332 PolarHBondContact O-N 2.88Å; V329-L333 PolarHBondContact O-N 3.35Å; V329-L333 VanDerWaalsContact O-N 3.13Å
330A98.9Very high98.7Very high46 Ų4648.6 Ų48.638%0.3825%0.247SC..Hα-helixtrans-60.3-39.5176.100000111.7W326 I327 L333 I334W326-A330 WeakPolarHBondContact O-CB 3.18Å; W326-A330 PolarHBondContact O-N 3.31Å; I327-A330 PolarHBondContact O-N 3.16Å; A330-L333 WeakPolarHBondContact O-CB 3.3Å; A330-L333 PolarHBondContact O-N 3.26Å; A330-I334 WeakPolarHBondContact O-CG1 3.41Å; A330-I334 PolarHBondContact O-N 2.85Å
331N98.9Very high98.7Very high10 Ų1048.1 Ų48.15%0.05324%0.243CC..Hα-helixtrans-64.8-38.7176.9-170.943.3000112.7I327 L328 V329 L333 I334 L335 A354 S357 Y358I327-N331 VanDerWaalsContact O-CB 3.22Å; I327-N331 WeakPolarHBondContact O-CB 3.28Å; I327-N331 PolarHBondContact O-N 2.77Å; L328-N331 WeakPolarHBondContact O-CB 3.41Å; L328-N331 PolarHBondContact O-N 2.86Å; V329-N331 VanDerWaalsContact C-N 3.27Å; V329-N331 PolarHBondContact O-N 3.06Å; N331-L333 VanDerWaalsContact C-N 3.31Å; N331-L333 PolarHBondContact O-N 3.28Å; N331-I334 PolarHBondContact O-N 3.37Å; N331-L335 WeakPolarHBondContact O-CG 3.49Å; N331-L335 PolarHBondContact O-N 2.95Å; N331-A354 PolarHBondContact ND2-O 3.44Å; N331-A354 WeakPolarHBondContact OD1-CA 3.26Å; N331-A354 VanDerWaalsContact OD1-CB 3.31Å; N331-A354 WeakPolarHBondContact OD1-CB 3.16Å; N331-A354 PolarHBondContact OD1-O 3.34Å; N331-S357 VanDerWaalsContact CG-OG 3.23Å; N331-S357 PolarHBondContact ND2-OG 3.44Å; N331-S357 PolarHBondContact OD1-OG 3.21Å; N331-Y358 VanDerWaalsContact ND2-CA 3.33Å; N331-Y358 WeakPolarHBondContact ND2-CA 3.32Å; N331-Y358 WeakPolarHBondContact ND2-CB 3.48Å; N331-Y358 PolarHBondContact ND2-N 2.91Å; N331-Y358 VanDerWaalsContact ND2-N 3.13Å
332L98.9Very high98.6Very high54 Ų5450 Ų5028%0.28326%0.256SS..Hα-helixtrans-62.8-37.3172.6-77.9167.6000112.2F276 L328 V329 L335 T336 Y358F276-L332 HydrophobicContact CB-CD2 4.28Å; F276-L332 HydrophobicContact CD2-CD2 3.66Å; F276-L332 HydrophobicContact CE2-CD2 4.31Å; F276-L332 HydrophobicContact CG-CD2 4.1Å; L328-L332 PolarHBondContact O-N 2.89Å; V329-L332 PolarHBondContact O-N 2.88Å; L332-L335 PolarHBondContact O-N 3.3Å; L332-T336 WeakPolarHBondContact O-CB 3.46Å; L332-T336 PolarHBondContact O-N 3.49Å; L332-T336 PolarHBondContact O-OG1 3.29Å; L332-Y358 HydrophobicContact CD2-CD2 4.01Å; L332-Y358 HydrophobicContact CD2-CE2 3.77Å; L332-Y358 HydrophobicContact CG-CD2 4.43Å; L332-Y358 HydrophobicContact CG-CE2 4.35Å
333L98.8Very high98.5Very high118 Ų11852.2 Ų52.262%0.61827%0.272SS*.Hα-helixtrans-66.2-40.6173.5-64.2174.9000111.5V329 A330 N331 T336 W337V329-L333 PolarHBondContact O-N 3.35Å; V329-L333 VanDerWaalsContact O-N 3.13Å; A330-L333 WeakPolarHBondContact O-CB 3.3Å; A330-L333 PolarHBondContact O-N 3.26Å; N331-L333 VanDerWaalsContact C-N 3.31Å; N331-L333 PolarHBondContact O-N 3.28Å; L333-T336 PolarHBondContact O-N 3.46Å; L333-W337 PolarHBondContact O-N 3.07Å
334I98.9Very high98.4Very high70 Ų7052.9 Ų52.936%0.35927%0.273SS..Hα-helixtrans-61.8-47.8173.5-68.3167000110.5A330 N331 T336 W337 I338 I350 A354A330-I334 WeakPolarHBondContact O-CG1 3.41Å; A330-I334 PolarHBondContact O-N 2.85Å; N331-I334 PolarHBondContact O-N 3.37Å; I334-T336 VanDerWaalsContact C-N 3.3Å; I334-T336 PolarHBondContact O-N 2.65Å; I334-W337 HydrophobicContact CG2-CE3 4.41Å; I334-W337 WeakPolarHBondContact O-CB 3.48Å; I334-W337 PolarHBondContact O-N 3.47Å; I334-I338 HydrophobicContact CG2-CG1 4.17Å; I334-I338 WeakPolarHBondContact O-CB 3.41Å; I334-I338 VanDerWaalsContact O-CG1 3.3Å; I334-I338 WeakPolarHBondContact O-CG1 3.27Å; I334-I338 PolarHBondContact O-N 3.27Å; I334-I350 HydrophobicContact CG2-CG2 4.02Å; I334-A354 HydrophobicContact CG2-CB 4.08Å
335L98.9Very high98.3Very high0 Ų059.3 Ų59.30%030%0.302CS..Hα-helixtrans-59.9-40.9176.7-74.6169.4000111.8F276 A279 I280 N331 L332 I338 G339 A354 Y358F276-L335 HydrophobicContact CB-CB 3.97Å; A279-L335 HydrophobicContact CB-CB 4.33Å; A279-L335 HydrophobicContact CB-CD2 3.96Å; A279-L335 WeakPolarHBondContact CB-O 3.46Å; I280-L335 HydrophobicContact CD1-CD1 3.99Å; I280-L335 HydrophobicContact CG1-CD1 4.07Å; I280-L335 HydrophobicContact CG1-CD2 4.07Å; N331-L335 WeakPolarHBondContact O-CG 3.49Å; N331-L335 PolarHBondContact O-N 2.95Å; L332-L335 PolarHBondContact O-N 3.3Å; L335-I338 PolarHBondContact O-N 2.95Å; L335-G339 PolarHBondContact O-N 2.91Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.92Å; L335-Y358 HydrophobicContact CD1-CD2 4.31Å; L335-Y358 HydrophobicContact CD1-CG 4.34Å
336T98.8Very high98.3Very high38 Ų3860.8 Ų60.823%0.23332%0.315CS..Hα-helixtrans-61.3-47175.3-56.60000110.9L275 L332 L333 I334 G339 G340L275-T336 HydrophobicContact CB-CG2 4.07Å; L275-T336 WeakPolarHBondContact CB-O 3.32Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å; L332-T336 WeakPolarHBondContact O-CB 3.46Å; L332-T336 PolarHBondContact O-N 3.49Å; L332-T336 PolarHBondContact O-OG1 3.29Å; L333-T336 PolarHBondContact O-N 3.46Å; I334-T336 VanDerWaalsContact C-N 3.3Å; I334-T336 PolarHBondContact O-N 2.65Å; T336-G339 PolarHBondContact O-N 3.27Å; T336-G340 PolarHBondContact O-N 3.17Å
337W98.8Very high98.3Very high126 Ų12656.5 Ų56.548%0.47730%0.3SS..Hα-helixtrans-60-50.5175.8166.259.6000111.8L333 I334 G339 G340 Q341 F347 I350L333-W337 PolarHBondContact O-N 3.07Å; I334-W337 HydrophobicContact CG2-CE3 4.41Å; I334-W337 WeakPolarHBondContact O-CB 3.48Å; I334-W337 PolarHBondContact O-N 3.47Å; W337-G339 VanDerWaalsContact C-N 3.3Å; W337-G339 PolarHBondContact O-N 3.49Å; W337-G340 PolarHBondContact O-N 3.28Å; W337-Q341 VanDerWaalsContact NE1-NE2 3.17Å; W337-Q341 WeakPolarHBondContact O-CG 3.36Å; W337-Q341 PolarHBondContact O-N 2.97Å; W337-F347 HydrophobicContact CH2-CD1 4.27Å; W337-F347 AromaticContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CZ2-CD1 4.28Å; W337-F347 AromaticContact CZ2-CE1 3.68Å; W337-F347 HydrophobicContact CZ2-CE1 3.68Å; W337-I350 HydrophobicContact CH2-CD1 4.35Å; W337-I350 HydrophobicContact CZ3-CD1 4.43Å; W337-I350 HydrophobicContact CZ3-CG2 4.37Å
338I98.6Very high98.2Very high6 Ų656 Ų563%0.03130%0.297CS..Hα-helixtrans-61.6-37.9179.2-67.4-62.5000111.6A279 R282 I334 L335 G340 Q341 F347 I350A279-I338 HydrophobicContact CB-CB 4.46Å; A279-I338 HydrophobicContact CB-CG2 4.27Å; R282-I338 PolarHBondContact NH2-O 3.24Å; I334-I338 HydrophobicContact CG2-CG1 4.17Å; I334-I338 WeakPolarHBondContact O-CB 3.41Å; I334-I338 VanDerWaalsContact O-CG1 3.3Å; I334-I338 WeakPolarHBondContact O-CG1 3.27Å; I334-I338 PolarHBondContact O-N 3.27Å; L335-I338 PolarHBondContact O-N 2.95Å; I338-G340 PolarHBondContact O-N 3.21Å; I338-Q341 PolarHBondContact O-N 3.04Å; I338-F347 HydrophobicContact CD1-CB 4.17Å; I338-F347 HydrophobicContact CD1-CD1 3.78Å; I338-F347 HydrophobicContact CD1-CG 4.42Å; I338-I350 HydrophobicContact CD1-CB 3.84Å; I338-I350 HydrophobicContact CD1-CD1 4.42Å; I338-I350 HydrophobicContact CD1-CG2 3.64Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.84Å
339G98.3Very high98.2Very high0 Ų059.1 Ų59.10%031%0.313CS..Hα-helixtrans-56.8-32174.500000112.8Y278 R282 L335 T336 W337Y278-G339 WeakPolarHBondContact CD1-O 3.36Å; R282-G339 PolarHBondContact NH2-O 3.05Å; L335-G339 PolarHBondContact O-N 2.91Å; T336-G339 PolarHBondContact O-N 3.27Å; W337-G339 VanDerWaalsContact C-N 3.3Å; W337-G339 PolarHBondContact O-N 3.49Å
340G97.5Very high98.2Very high19 Ų1959.7 Ų59.720%0.19631%0.314CS..THydrogen-bonded Turntrans-83.2-7.4175.900000115.3H267 T336 W337 I338H267-G340 PolarHBondContact CE1-O 3.45Å; H267-G340 VanDerWaalsContact CE1-O 3.25Å; T336-G340 PolarHBondContact O-N 3.17Å; W337-G340 PolarHBondContact O-N 3.28Å; I338-G340 PolarHBondContact O-N 3.21Å
341Q98.2Very high98.2Very high53 Ų5357.6 Ų57.625%0.24830%0.297CS..SBendtrans-93.4154.7179.7-60.6-49.8-45.400112.7H267 R282 W337 I338 F347H267-Q341 VanDerWaalsContact CE1-C 3.41Å; H267-Q341 PolarHBondContact CE1-O 3.09Å; H267-Q341 VanDerWaalsContact CE1-O 3.23Å; H267-Q341 PolarHBondContact NE2-O 2.92Å; R282-Q341 PolarHBondContact NH1-O 3.04Å; R282-Q341 PolarHBondContact NH2-O 3.32Å; W337-Q341 VanDerWaalsContact NE1-NE2 3.17Å; W337-Q341 WeakPolarHBondContact O-CG 3.36Å; W337-Q341 PolarHBondContact O-N 2.97Å; I338-Q341 PolarHBondContact O-N 3.04Å; Q341-F347 HydrophobicContact CB-CB 4.17Å; Q341-F347 HydrophobicContact CB-CD1 3.98Å; Q341-F347 HydrophobicContact CB-CD2 3.71Å; Q341-F347 HydrophobicContact CB-CE1 4.29Å; Q341-F347 HydrophobicContact CB-CE2 4.02Å; Q341-F347 HydrophobicContact CB-CG 3.67Å; Q341-F347 HydrophobicContact CB-CZ 4.3Å; Q341-F347 HydrophobicContact CG-CD1 3.83Å; Q341-F347 HydrophobicContact CG-CD2 4.28Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.25Å; Q341-F347 HydrophobicContact CG-CG 4.07Å; Q341-F347 HydrophobicContact CG-CZ 4.01Å
342P96.9Very high98.2Very high45 Ų4560 Ų6029%0.29231%0.308SS..  trans-63.4160.8172.728.5-36.4000112E344 F347P342-E344 HydrophobicContact CB-CG 4.33Å; P342-E344 PolarHBondContact O-N 3.24Å; P342-F347 HydrophobicContact CG-CD2 4.3Å; P342-F347 HydrophobicContact CG-CE2 4.29Å
343V96.6Very high98.2Very high93 Ų9362.5 Ų62.556%0.56432%0.321SS*.SBendtrans-82.970.7-179.6-170.50000109.9I348V343-I348 HydrophobicContact CG1-CD1 4.06Å; V343-I348 HydrophobicContact CG1-CG1 3.9Å
344E97.3Very high98.2Very high121 Ų12157.1 Ų57.157%0.56529%0.293SS*.  trans-136.4166.6-176-66179.3-171.400111.5P342 F347 I348P342-E344 HydrophobicContact CB-CG 4.33Å; P342-E344 PolarHBondContact O-N 3.24Å; E344-F347 WeakPolarHBondContact O-CA 3.41Å; E344-F347 WeakPolarHBondContact O-CB 3.47Å; E344-F347 PolarHBondContact O-N 3.06Å; E344-I348 PolarHBondContact O-N 2.98Å
345H96.4Very high98.2Very high159 Ų15954.2 Ų54.274%0.73628%0.279SS*.THydrogen-bonded Turntrans-70.8137170.3-177.180.2000110.1
346P97.8Very high98.2Very high54 Ų5459.3 Ų59.335%0.35131%0.305SS..THydrogen-bonded Turncis-92.23.83.337-35.9000114.9I348 I349 I350P346-I348 VanDerWaalsContact C-N 3.31Å; P346-I348 PolarHBondContact O-N 3.24Å; P346-I349 HydrophobicContact CB-CG2 4.47Å; P346-I349 WeakPolarHBondContact O-CG2 3.37Å; P346-I349 PolarHBondContact O-N 3Å; P346-I350 HydrophobicContact CB-CD1 4.18Å; P346-I350 HydrophobicContact CG-CD1 4.16Å; P346-I350 WeakPolarHBondContact O-CG1 3.34Å; P346-I350 PolarHBondContact O-N 2.94Å
347F98.6Very high98.2Very high42 Ų4259.2 Ų59.218%0.18431%0.306CS..Hα-helixtrans-63.3-33.1-173.3-54.6-53.2000113.9W337 I338 Q341 P342 E344 I350 G351W337-F347 HydrophobicContact CH2-CD1 4.27Å; W337-F347 AromaticContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CZ2-CD1 4.28Å; W337-F347 AromaticContact CZ2-CE1 3.68Å; W337-F347 HydrophobicContact CZ2-CE1 3.68Å; I338-F347 HydrophobicContact CD1-CB 4.17Å; I338-F347 HydrophobicContact CD1-CD1 3.78Å; I338-F347 HydrophobicContact CD1-CG 4.42Å; Q341-F347 HydrophobicContact CB-CB 4.17Å; Q341-F347 HydrophobicContact CB-CD1 3.98Å; Q341-F347 HydrophobicContact CB-CD2 3.71Å; Q341-F347 HydrophobicContact CB-CE1 4.29Å; Q341-F347 HydrophobicContact CB-CE2 4.02Å; Q341-F347 HydrophobicContact CB-CG 3.67Å; Q341-F347 HydrophobicContact CB-CZ 4.3Å; Q341-F347 HydrophobicContact CG-CD1 3.83Å; Q341-F347 HydrophobicContact CG-CD2 4.28Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.25Å; Q341-F347 HydrophobicContact CG-CG 4.07Å; Q341-F347 HydrophobicContact CG-CZ 4.01Å; P342-F347 HydrophobicContact CG-CD2 4.3Å; P342-F347 HydrophobicContact CG-CE2 4.29Å; E344-F347 WeakPolarHBondContact O-CA 3.41Å; E344-F347 WeakPolarHBondContact O-CB 3.47Å; E344-F347 PolarHBondContact O-N 3.06Å; F347-I350 PolarHBondContact O-N 3.26Å; F347-G351 PolarHBondContact O-N 3.17Å
348I98.4Very high98.2Very high74 Ų7453.8 Ų53.838%0.37929%0.286SS..Hα-helixtrans-57.5-53.1176-63.7167.9000110.9V343 E344 P346 G351 Q352V343-I348 HydrophobicContact CG1-CD1 4.06Å; V343-I348 HydrophobicContact CG1-CG1 3.9Å; E344-I348 PolarHBondContact O-N 2.98Å; P346-I348 VanDerWaalsContact C-N 3.31Å; P346-I348 PolarHBondContact O-N 3.24Å; I348-G351 PolarHBondContact O-N 3.12Å; I348-Q352 WeakPolarHBondContact O-CG 3.45Å; I348-Q352 PolarHBondContact O-N 2.96Å
349I98.6Very high98.2Very high73 Ų7355.6 Ų55.637%0.37429%0.294SS..Hα-helixtrans-70.6-35.8-176.2-173.560.6000111.4P346 Q352 L353P346-I349 HydrophobicContact CB-CG2 4.47Å; P346-I349 WeakPolarHBondContact O-CG2 3.37Å; P346-I349 PolarHBondContact O-N 3Å; I349-Q352 PolarHBondContact O-N 3.14Å; I349-L353 HydrophobicContact CD1-CG 4.3Å; I349-L353 HydrophobicContact CG1-CD1 4.16Å; I349-L353 HydrophobicContact CG1-CG 4.4Å; I349-L353 WeakPolarHBondContact O-CG 3.45Å; I349-L353 PolarHBondContact O-N 2.73Å
350I98.8Very high98.2Very high52 Ų5257.8 Ų57.827%0.26731%0.309SS..Hα-helixtrans-63.1-44.8174.8-60.9165.8000110I334 W337 I338 P346 F347 Q352 L353 A354I334-I350 HydrophobicContact CG2-CG2 4.02Å; W337-I350 HydrophobicContact CH2-CD1 4.35Å; W337-I350 HydrophobicContact CZ3-CD1 4.43Å; W337-I350 HydrophobicContact CZ3-CG2 4.37Å; I338-I350 HydrophobicContact CD1-CB 3.84Å; I338-I350 HydrophobicContact CD1-CD1 4.42Å; I338-I350 HydrophobicContact CD1-CG2 3.64Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.84Å; P346-I350 HydrophobicContact CB-CD1 4.18Å; P346-I350 HydrophobicContact CG-CD1 4.16Å; P346-I350 WeakPolarHBondContact O-CG1 3.34Å; P346-I350 PolarHBondContact O-N 2.94Å; F347-I350 PolarHBondContact O-N 3.26Å; I350-Q352 PolarHBondContact O-N 3.22Å; I350-L353 PolarHBondContact O-N 3.08Å; I350-A354 WeakPolarHBondContact O-CB 3.47Å; I350-A354 PolarHBondContact O-N 3.1Å
351G98.7Very high98.3Very high2 Ų257.1 Ų57.12%0.02130%0.301CS..Hα-helixtrans-59-44.4176.300000112.8S283 F347 I348 A354 S355S283-G351 PolarHBondContact OG-O 3.13Å; F347-G351 PolarHBondContact O-N 3.17Å; I348-G351 PolarHBondContact O-N 3.12Å; G351-A354 PolarHBondContact O-N 2.95Å; G351-S355 WeakPolarHBondContact O-CB 3.34Å; G351-S355 PolarHBondContact O-N 3.16Å; G351-S355 PolarHBondContact O-OG 3.14Å
352Q98.8Very high98.3Very high62 Ų6254.9 Ų54.929%0.2929%0.29SS..Hα-helixtrans-61.4-49.6176.8-74.3173.5-20.300112.1S283 I348 I349 I350 A354 S355 I356S283-Q352 WeakPolarHBondContact O-CG 3.48Å; S283-Q352 PolarHBondContact O-NE2 2.77Å; S283-Q352 PolarHBondContact OG-N 2.91Å; I348-Q352 WeakPolarHBondContact O-CG 3.45Å; I348-Q352 PolarHBondContact O-N 2.96Å; I349-Q352 PolarHBondContact O-N 3.14Å; I350-Q352 PolarHBondContact O-N 3.22Å; Q352-A354 PolarHBondContact O-N 3.06Å; Q352-S355 PolarHBondContact O-N 3.32Å; Q352-I356 VanDerWaalsContact O-CG1 3.3Å; Q352-I356 WeakPolarHBondContact O-CG1 3.47Å; Q352-I356 PolarHBondContact O-N 3.04Å
353L98.8Very high98.4Very high106 Ų10656.1 Ų56.156%0.55529%0.294SS*.Hα-helixtrans-64-41.3179-67.9175.1000112I349 I350 S355 I356 S357I349-L353 HydrophobicContact CD1-CG 4.3Å; I349-L353 HydrophobicContact CG1-CD1 4.16Å; I349-L353 HydrophobicContact CG1-CG 4.4Å; I349-L353 WeakPolarHBondContact O-CG 3.45Å; I349-L353 PolarHBondContact O-N 2.73Å; I350-L353 PolarHBondContact O-N 3.08Å; L353-S355 VanDerWaalsContact C-N 3.34Å; L353-I356 PolarHBondContact O-N 3.46Å; L353-S357 WeakPolarHBondContact O-CB 3.03Å; L353-S357 PolarHBondContact O-N 3.29Å; L353-S357 PolarHBondContact O-OG 3.25Å
354A98.8Very high98.5Very high5 Ų555 Ų554%0.04129%0.288CS..Hα-helixtrans-65.2-36.3176.300000112.3N331 I334 L335 I350 G351 Q352 S357 Y358N331-A354 PolarHBondContact ND2-O 3.44Å; N331-A354 WeakPolarHBondContact OD1-CA 3.26Å; N331-A354 VanDerWaalsContact OD1-CB 3.31Å; N331-A354 WeakPolarHBondContact OD1-CB 3.16Å; N331-A354 PolarHBondContact OD1-O 3.34Å; I334-A354 HydrophobicContact CG2-CB 4.08Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.92Å; I350-A354 WeakPolarHBondContact O-CB 3.47Å; I350-A354 PolarHBondContact O-N 3.1Å; G351-A354 PolarHBondContact O-N 2.95Å; Q352-A354 PolarHBondContact O-N 3.06Å; A354-S357 WeakPolarHBondContact CA-OG 3.47Å; A354-S357 PolarHBondContact O-OG 3.42Å; A354-Y358 WeakPolarHBondContact O-CB 3.38Å; A354-Y358 PolarHBondContact O-N 3.41Å
355S98.8Very high98.6Very high9 Ų953 Ų536%0.06328%0.28CS..Hα-helixtrans-69.9-43176.3-57.20000111.3S283 G351 Q352 L353 Y358 F359S283-S355 WeakPolarHBondContact CB-OG 3.46Å; S283-S355 PolarHBondContact OG-OG 3.21Å; G351-S355 WeakPolarHBondContact O-CB 3.34Å; G351-S355 PolarHBondContact O-N 3.16Å; G351-S355 PolarHBondContact O-OG 3.14Å; Q352-S355 PolarHBondContact O-N 3.32Å; L353-S355 VanDerWaalsContact C-N 3.34Å; S355-Y358 WeakPolarHBondContact O-CB 3.13Å; S355-Y358 PolarHBondContact O-N 3.3Å; S355-F359 VanDerWaalsContact O-CD2 3.3Å; S355-F359 WeakPolarHBondContact O-CD2 3.23Å; S355-F359 PolarHBondContact O-N 2.79Å
356I98.8Very high98.7Very high106 Ų10646.5 Ų46.554%0.54425%0.251SS..Hα-helixtrans-61.4-46.1174.9-68.9165.3000110.3Q352 L353 Y358 S360Q352-I356 VanDerWaalsContact O-CG1 3.3Å; Q352-I356 WeakPolarHBondContact O-CG1 3.47Å; Q352-I356 PolarHBondContact O-N 3.04Å; L353-I356 PolarHBondContact O-N 3.46Å; I356-Y358 VanDerWaalsContact C-N 3.33Å; I356-Y358 PolarHBondContact O-N 2.92Å; I356-S360 WeakPolarHBondContact O-CB 3.21Å; I356-S360 PolarHBondContact O-N 3.36Å; I356-S360 PolarHBondContact O-OG 3.5Å
357S98.8Very high98.7Very high37 Ų3744.8 Ų44.826%0.25924%0.239SC..Hα-helixtrans-64.9-37.1179.3680000111.8N331 L353 A354 S360 I361N331-S357 VanDerWaalsContact CG-OG 3.23Å; N331-S357 PolarHBondContact ND2-OG 3.44Å; N331-S357 PolarHBondContact OD1-OG 3.21Å; L353-S357 WeakPolarHBondContact O-CB 3.03Å; L353-S357 PolarHBondContact O-N 3.29Å; L353-S357 PolarHBondContact O-OG 3.25Å; A354-S357 WeakPolarHBondContact CA-OG 3.47Å; A354-S357 PolarHBondContact O-OG 3.42Å; S357-S360 PolarHBondContact O-N 2.82Å; S357-I361 WeakPolarHBondContact O-CB 3.4Å; S357-I361 WeakPolarHBondContact O-CD1 3.31Å; S357-I361 WeakPolarHBondContact O-CG1 3.34Å; S357-I361 PolarHBondContact O-N 2.76Å
358Y98.9Very high98.7Very high11 Ų1146.7 Ų46.74%0.04325%0.251CS..Hα-helixtrans-55.6-56.2176.1173.9-95.1000111.6I280 S297 I300 L328 N331 L332 L335 A354 S355 I356 I362I280-Y358 HydrophobicContact CD1-CD1 3.94Å; I280-Y358 HydrophobicContact CD1-CE1 4.27Å; I280-Y358 HydrophobicContact CD1-CG 4.25Å; S297-Y358 PolarHBondContact O-OH 2.84Å; I300-Y358 HydrophobicContact CG2-CE1 4.16Å; I300-Y358 VanDerWaalsContact CG2-OH 3.28Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.26Å; L328-Y358 HydrophobicContact CD1-CD2 3.68Å; L328-Y358 HydrophobicContact CD1-CE2 4Å; N331-Y358 VanDerWaalsContact ND2-CA 3.33Å; N331-Y358 WeakPolarHBondContact ND2-CA 3.32Å; N331-Y358 WeakPolarHBondContact ND2-CB 3.48Å; N331-Y358 PolarHBondContact ND2-N 2.91Å; N331-Y358 VanDerWaalsContact ND2-N 3.13Å; L332-Y358 HydrophobicContact CD2-CD2 4.01Å; L332-Y358 HydrophobicContact CD2-CE2 3.77Å; L332-Y358 HydrophobicContact CG-CD2 4.43Å; L332-Y358 HydrophobicContact CG-CE2 4.35Å; L335-Y358 HydrophobicContact CD1-CD2 4.31Å; L335-Y358 HydrophobicContact CD1-CG 4.34Å; A354-Y358 WeakPolarHBondContact O-CB 3.38Å; A354-Y358 PolarHBondContact O-N 3.41Å; S355-Y358 WeakPolarHBondContact O-CB 3.13Å; S355-Y358 PolarHBondContact O-N 3.3Å; I356-Y358 VanDerWaalsContact C-N 3.33Å; I356-Y358 PolarHBondContact O-N 2.92Å; Y358-I362 HydrophobicContact CD2-CD1 4.3Å; Y358-I362 HydrophobicContact CE1-CD1 3.98Å; Y358-I362 HydrophobicContact CE2-CD1 3.72Å; Y358-I362 WeakPolarHBondContact O-CG1 3.34Å; Y358-I362 PolarHBondContact O-N 2.86Å
359F98.8Very high98.7Very high44 Ų4443.4 Ų43.419%0.19323%0.234CC..Hα-helixtrans-68.2-39.2179.9-72.6-72.5000112I280 L296 I300 S355 I361 I362 L363I280-F359 HydrophobicContact CG2-CE2 3.89Å; I280-F359 HydrophobicContact CG2-CZ 4.33Å; L296-F359 HydrophobicContact CB-CE1 4.2Å; L296-F359 HydrophobicContact CB-CZ 4.35Å; I300-F359 HydrophobicContact CD1-CD1 3.76Å; I300-F359 HydrophobicContact CD1-CE1 4.19Å; S355-F359 VanDerWaalsContact O-CD2 3.3Å; S355-F359 WeakPolarHBondContact O-CD2 3.23Å; S355-F359 PolarHBondContact O-N 2.79Å; F359-I361 PolarHBondContact O-N 3.44Å; F359-I362 PolarHBondContact O-N 2.87Å; F359-L363 HydrophobicContact CB-CD1 4.39Å; F359-L363 HydrophobicContact CD1-CD1 4.43Å; F359-L363 VanDerWaalsContact O-CB 3.29Å; F359-L363 WeakPolarHBondContact O-CB 3.31Å; F359-L363 WeakPolarHBondContact O-CG 3.22Å; F359-L363 PolarHBondContact O-N 3.45Å
360S98.8Very high98.7Very high46 Ų4639.9 Ų39.932%0.32222%0.216SC..Hα-helixtrans-65.4-39.8-179.3-57.90000112.3I356 S357 V364 L365I356-S360 WeakPolarHBondContact O-CB 3.21Å; I356-S360 PolarHBondContact O-N 3.36Å; I356-S360 PolarHBondContact O-OG 3.5Å; S357-S360 PolarHBondContact O-N 2.82Å; S360-V364 WeakPolarHBondContact O-CA 3.37Å; S360-V364 WeakPolarHBondContact O-CB 3.47Å; S360-V364 PolarHBondContact O-N 3.46Å; S360-L365 PolarHBondContact O-N 2.87Å
361I98.8Very high98.6Very high5 Ų541.1 Ų41.13%0.02622%0.223CC..Iπ-helixtrans-61.7-47.8177.9-69.7160.9000110.2L324 I327 L328 S357 F359 L365 M366L324-I361 HydrophobicContact CB-CG2 4.47Å; I327-I361 HydrophobicContact CG2-CD1 3.75Å; L328-I361 HydrophobicContact CB-CG2 4.05Å; L328-I361 HydrophobicContact CD1-CG2 4.49Å; S357-I361 WeakPolarHBondContact O-CB 3.4Å; S357-I361 WeakPolarHBondContact O-CD1 3.31Å; S357-I361 WeakPolarHBondContact O-CG1 3.34Å; S357-I361 PolarHBondContact O-N 2.76Å; F359-I361 PolarHBondContact O-N 3.44Å; I361-L365 HydrophobicContact CG1-CD1 3.98Å; I361-L365 PolarHBondContact O-N 2.96Å; I361-M366 HydrophobicContact CG2-CE 3.88Å; I361-M366 HydrophobicContact CG2-CG 4.09Å; I361-M366 HydrophobicContact CG2-SD 4.35Å; I361-M366 WeakPolarHBondContact O-CB 3.42Å; I361-M366 WeakPolarHBondContact O-CG 3.43Å; I361-M366 PolarHBondContact O-N 3.35Å
362I98.7Very high98.6Very high6 Ų644.7 Ų44.73%0.03124%0.24CC..Iπ-helixtrans-73.6-48.9-175.1-59.6173.4000111.6I300 M304 L307 L328 Y358 F359 P367I300-I362 HydrophobicContact CD1-CB 3.81Å; I300-I362 HydrophobicContact CD1-CD1 4.1Å; I300-I362 HydrophobicContact CD1-CG2 3.62Å; I300-I362 HydrophobicContact CG1-CB 4.49Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.29Å; M304-I362 HydrophobicContact SD-CG2 3.63Å; L307-I362 HydrophobicContact CD1-CG2 4.09Å; L328-I362 HydrophobicContact CD1-CD1 4.14Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.2Å; L328-I362 HydrophobicContact CD2-CG1 3.93Å; Y358-I362 HydrophobicContact CD2-CD1 4.3Å; Y358-I362 HydrophobicContact CE1-CD1 3.98Å; Y358-I362 HydrophobicContact CE2-CD1 3.72Å; Y358-I362 WeakPolarHBondContact O-CG1 3.34Å; Y358-I362 PolarHBondContact O-N 2.86Å; F359-I362 PolarHBondContact O-N 2.87Å; I362-P367 WeakPolarHBondContact O-CD 3.48Å
363L98.7Very high98.6Very high71 Ų7142.1 Ų42.137%0.37223%0.228SC..Iπ-helixtrans-81.5-26.2-171.6-62.4178000113.7I300 L303 L307 F359I300-L363 HydrophobicContact CD1-CD1 4.28Å; I300-L363 HydrophobicContact CD1-CD2 3.6Å; I300-L363 HydrophobicContact CD1-CG 3.72Å; I300-L363 HydrophobicContact CG1-CD2 4.03Å; L303-L363 HydrophobicContact CD1-CD2 4.45Å; L307-L363 HydrophobicContact CD1-CD2 3.85Å; F359-L363 HydrophobicContact CB-CD1 4.39Å; F359-L363 HydrophobicContact CD1-CD1 4.43Å; F359-L363 VanDerWaalsContact O-CB 3.29Å; F359-L363 WeakPolarHBondContact O-CB 3.31Å; F359-L363 WeakPolarHBondContact O-CG 3.22Å; F359-L363 PolarHBondContact O-N 3.45Å
364V98.7Very high98.5Very high71 Ų7137.8 Ų37.843%0.4321%0.205SC..Iπ-helixtrans-124.2-58.1-169.1-177.10000111.6S360 P367 I368S360-V364 WeakPolarHBondContact O-CA 3.37Å; S360-V364 WeakPolarHBondContact O-CB 3.47Å; S360-V364 PolarHBondContact O-N 3.46Å; V364-P367 WeakPolarHBondContact O-CD 3.32Å; V364-I368 HydrophobicContact CG1-CD1 3.63Å; V364-I368 WeakPolarHBondContact O-CB 3.26Å; V364-I368 WeakPolarHBondContact O-CG1 3.34Å; V364-I368 PolarHBondContact O-N 3.48Å; V364-I368 VanDerWaalsContact O-N 3.09Å
365L98.8Very high98.4Very high77 Ų7744.7 Ų44.740%0.40324%0.235SC..Iπ-helixtrans-71.2-43.8-168.6-57177.7000112.9L324 S360 I361 I368 S369L324-L365 HydrophobicContact CD1-CB 3.96Å; L324-L365 HydrophobicContact CD2-CB 4.18Å; L324-L365 HydrophobicContact CD2-CD1 4.25Å; S360-L365 PolarHBondContact O-N 2.87Å; I361-L365 HydrophobicContact CG1-CD1 3.98Å; I361-L365 PolarHBondContact O-N 2.96Å; L365-I368 PolarHBondContact O-N 3.03Å; L365-S369 WeakPolarHBondContact O-CB 3.22Å; L365-S369 PolarHBondContact O-N 2.88Å; L365-S369 PolarHBondContact O-OG 3.14Å
366M98.5Very high98.3Very high24 Ų2450.7 Ų50.712%0.11826%0.263CS..Hα-helixtrans-65.2-42.7178-76.6-175.6174.100113.4T321 L324 L328 I361 S369 G370T321-M366 HydrophobicContact CG2-CG 4.28Å; L324-M366 HydrophobicContact CB-CE 4.38Å; L324-M366 HydrophobicContact CB-CG 4.26Å; L324-M366 HydrophobicContact CD1-CG 4.43Å; L328-M366 HydrophobicContact CB-CE 4.35Å; L328-M366 HydrophobicContact CD2-CE 3.94Å; I361-M366 HydrophobicContact CG2-CE 3.88Å; I361-M366 HydrophobicContact CG2-CG 4.09Å; I361-M366 HydrophobicContact CG2-SD 4.35Å; I361-M366 WeakPolarHBondContact O-CB 3.42Å; I361-M366 WeakPolarHBondContact O-CG 3.43Å; I361-M366 PolarHBondContact O-N 3.35Å; M366-S369 WeakPolarHBondContact CA-OG 3.23Å; M366-S369 PolarHBondContact O-N 3.47Å; M366-S369 PolarHBondContact O-OG 2.49Å; M366-G370 PolarHBondContact O-N 3.42Å; M366-G370 VanDerWaalsContact O-N 3.15Å
367P98.5Very high98.2Very high17 Ų1750 Ų5011%0.1126%0.26CS..Hα-helixtrans-60.9-43.7171.7-28.636.4000113.1L307 T309 I362 V364 G370 I371L307-P367 HydrophobicContact CB-CG 4.18Å; L307-P367 HydrophobicContact CD2-CG 4.31Å; T309-P367 HydrophobicContact CG2-CB 3.85Å; T309-P367 WeakPolarHBondContact OG1-CA 3.37Å; T309-P367 PolarHBondContact OG1-O 2.9Å; I362-P367 WeakPolarHBondContact O-CD 3.48Å; V364-P367 WeakPolarHBondContact O-CD 3.32Å; P367-G370 PolarHBondContact O-N 3.07Å; P367-I371 PolarHBondContact O-N 3.25Å
368I98.6Very high98Very high83 Ų8355.3 Ų55.343%0.42628%0.279SS..Hα-helixtrans-65.1-43178.4-70.5172.2000111V364 L365 G370 I371 I372V364-I368 HydrophobicContact CG1-CD1 3.63Å; V364-I368 WeakPolarHBondContact O-CB 3.26Å; V364-I368 WeakPolarHBondContact O-CG1 3.34Å; V364-I368 PolarHBondContact O-N 3.48Å; V364-I368 VanDerWaalsContact O-N 3.09Å; L365-I368 PolarHBondContact O-N 3.03Å; I368-G370 VanDerWaalsContact C-N 3.29Å; I368-G370 PolarHBondContact O-N 3.07Å; I368-I371 PolarHBondContact O-N 2.93Å; I368-I371 VanDerWaalsContact O-N 3.17Å; I368-I372 HydrophobicContact CG2-CD1 3.7Å; I368-I372 HydrophobicContact CG2-CG1 4.3Å; I368-I372 WeakPolarHBondContact O-CG1 3.39Å; I368-I372 PolarHBondContact O-N 3.38Å
369S98.3Very high97.5Very high4 Ų458 Ų583%0.02829%0.293CS..Hα-helixtrans-62.3-36.9179.666.90000112T321 L365 M366 I371 I372 E373T321-S369 WeakPolarHBondContact OG1-CB 3.42Å; T321-S369 PolarHBondContact OG1-OG 3.01Å; L365-S369 WeakPolarHBondContact O-CB 3.22Å; L365-S369 PolarHBondContact O-N 2.88Å; L365-S369 PolarHBondContact O-OG 3.14Å; M366-S369 WeakPolarHBondContact CA-OG 3.23Å; M366-S369 PolarHBondContact O-N 3.47Å; M366-S369 PolarHBondContact O-OG 2.49Å; S369-I371 PolarHBondContact O-N 3.04Å; S369-I372 PolarHBondContact O-N 2.82Å; S369-E373 WeakPolarHBondContact O-CB 3.3Å; S369-E373 VanDerWaalsContact O-CG 3.28Å; S369-E373 WeakPolarHBondContact O-CG 3.43Å; S369-E373 PolarHBondContact O-N 3.37Å
370G97.7Very high96.5Very high0 Ų063.8 Ų63.80%032%0.315CS..Hα-helixtrans-59-45.5172.800000113.3M366 P367 I368 I372 E373 D374M366-G370 PolarHBondContact O-N 3.42Å; M366-G370 VanDerWaalsContact O-N 3.15Å; P367-G370 PolarHBondContact O-N 3.07Å; I368-G370 VanDerWaalsContact C-N 3.29Å; I368-G370 PolarHBondContact O-N 3.07Å; G370-I372 VanDerWaalsContact C-N 3.33Å; G370-I372 PolarHBondContact O-N 2.68Å; G370-E373 PolarHBondContact O-N 3.17Å; G370-D374 PolarHBondContact O-N 3Å
371I98.1Very high94.7Very high78 Ų7870.4 Ų70.440%0.436%0.357SS..Hα-helixtrans-64.2-39.9177.5-61.2168000111.1T309 P367 I368 S369 K375T309-I371 HydrophobicContact CG2-CD1 4.24Å; T309-I371 HydrophobicContact CG2-CG1 4.2Å; P367-I371 PolarHBondContact O-N 3.25Å; I368-I371 PolarHBondContact O-N 2.93Å; I368-I371 VanDerWaalsContact O-N 3.17Å; S369-I371 PolarHBondContact O-N 3.04Å; I371-K375 HydrophobicContact CG2-CD 4.39Å; I371-K375 WeakPolarHBondContact O-CG 3.34Å; I371-K375 PolarHBondContact O-N 3.33Å; I371-K375 VanDerWaalsContact O-N 3.14Å
372I98.1Very high94.5Very high77 Ų7773.7 Ų73.740%0.39537%0.373SS..Hα-helixtrans-64.4-49178-68.5170.1000110.4I320 I368 S369 G370 D374 K375 M376I320-I372 HydrophobicContact CD1-CG2 4.1Å; I368-I372 HydrophobicContact CG2-CD1 3.7Å; I368-I372 HydrophobicContact CG2-CG1 4.3Å; I368-I372 WeakPolarHBondContact O-CG1 3.39Å; I368-I372 PolarHBondContact O-N 3.38Å; S369-I372 PolarHBondContact O-N 2.82Å; G370-I372 VanDerWaalsContact C-N 3.33Å; G370-I372 PolarHBondContact O-N 2.68Å; I372-D374 PolarHBondContact O-N 3.34Å; I372-K375 PolarHBondContact O-N 3.37Å; I372-M376 HydrophobicContact CG2-CG 4.44Å; I372-M376 HydrophobicContact CG2-SD 4.02Å; I372-M376 WeakPolarHBondContact O-CG 3.27Å; I372-M376 PolarHBondContact O-N 3.06Å
373E98.3Very high94.3Very high8 Ų877.2 Ų77.24%0.03739%0.391CS..Hα-helixtrans-60.9-43.4-179.8-72.8170.6149.700111.6R318 I320 T321 S369 G370 K375 M376 L377R318-E373 WeakPolarHBondContact CA-OE1 3.5Å; R318-E373 WeakPolarHBondContact CB-OE1 3.34Å; R318-E373 WeakPolarHBondContact CB-OE2 3.42Å; R318-E373 IonicContact CZ-OE2 3.8Å; R318-E373 IonicContact NE-OE2 3.47Å; R318-E373 PolarHBondContact NE-OE2 3.19Å; R318-E373 IonicContact NH2-OE2 2.82Å; R318-E373 PolarHBondContact NH2-OE2 3.34Å; I320-E373 WeakPolarHBondContact CA-OE1 3.41Å; I320-E373 HydrophobicContact CB-CG 4.22Å; I320-E373 WeakPolarHBondContact CB-OE1 3.35Å; I320-E373 HydrophobicContact CD1-CG 4.13Å; I320-E373 HydrophobicContact CG1-CG 4.35Å; I320-E373 PolarHBondContact N-OE1 2.96Å; T321-E373 PolarHBondContact N-OE1 3.44Å; T321-E373 VanDerWaalsContact OG1-CD 3.27Å; T321-E373 PolarHBondContact OG1-OE1 3.2Å; T321-E373 PolarHBondContact OG1-OE2 3.38Å; S369-E373 WeakPolarHBondContact O-CB 3.3Å; S369-E373 VanDerWaalsContact O-CG 3.28Å; S369-E373 WeakPolarHBondContact O-CG 3.43Å; S369-E373 PolarHBondContact O-N 3.37Å; G370-E373 PolarHBondContact O-N 3.17Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 2.83Å; E373-M376 WeakPolarHBondContact O-CB 3.5Å; E373-M376 PolarHBondContact O-N 3.47Å; E373-L377 WeakPolarHBondContact O-CG 3.35Å; E373-L377 PolarHBondContact O-N 3.09Å
374D97.8Very high94.1Very high14 Ų1477.6 Ų77.68%0.07539%0.392CS..Hα-helixtrans-61.7-40.6176.1-77.5-13.9000112.2S310 K311 G370 I372 L377 K378 L379S310-D374 WeakPolarHBondContact CA-OD2 3.45Å; K311-D374 WeakPolarHBondContact CG-OD2 3.04Å; K311-D374 PolarHBondContact N-OD1 3.29Å; K311-D374 PolarHBondContact N-OD2 2.9Å; G370-D374 PolarHBondContact O-N 3Å; I372-D374 PolarHBondContact O-N 3.34Å; D374-L377 CarbonylContact O-C 3.53Å; D374-L377 PolarHBondContact O-N 3.05Å; D374-K378 PolarHBondContact O-N 3.34Å; D374-K378 VanDerWaalsContact O-N 3.08Å; D374-L379 HydrophobicContact CB-CB 4.38Å; D374-L379 PolarHBondContact O-N 2.85Å
375K97Very high93.8Very high151 Ų15177.9 Ų77.966%0.65739%0.39SS*.Hα-helixtrans-65.3-41.2175.2-75.9178.3-179.4-179.30112I371 I372 E373 L377 K378I371-K375 HydrophobicContact CG2-CD 4.39Å; I371-K375 WeakPolarHBondContact O-CG 3.34Å; I371-K375 PolarHBondContact O-N 3.33Å; I371-K375 VanDerWaalsContact O-N 3.14Å; I372-K375 PolarHBondContact O-N 3.37Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 2.83Å; K375-L377 PolarHBondContact O-N 3.42Å; K375-K378 PolarHBondContact O-N 3.08Å; K375-K378 VanDerWaalsContact O-N 3.09Å
376M96.9Very high93.5Very high135 Ų13578 Ų7867%0.66539%0.389SS*.Hα-helixtrans-60.2-35.6175.8-71174.665.400111.7I320 I372 E373 K378I320-M376 HydrophobicContact CD1-SD 3.98Å; I372-M376 HydrophobicContact CG2-CG 4.44Å; I372-M376 HydrophobicContact CG2-SD 4.02Å; I372-M376 WeakPolarHBondContact O-CG 3.27Å; I372-M376 PolarHBondContact O-N 3.06Å; E373-M376 WeakPolarHBondContact O-CB 3.5Å; E373-M376 PolarHBondContact O-N 3.47Å; M376-K378 VanDerWaalsContact C-N 3.34Å
377L96.6Very high93.1Very high90 Ų9081.6 Ų81.647%0.47141%0.407SS..THydrogen-bonded Turntrans-87.11.2177.6-65.3177.1000114.1E373 D374 K375 L379E373-L377 WeakPolarHBondContact O-CG 3.35Å; E373-L377 PolarHBondContact O-N 3.09Å; D374-L377 CarbonylContact O-C 3.53Å; D374-L377 PolarHBondContact O-N 3.05Å; K375-L377 PolarHBondContact O-N 3.42Å; L377-L379 HydrophobicContact CB-CD1 3.97Å; L377-L379 HydrophobicContact CB-CG 3.79Å; L377-L379 HydrophobicContact CD1-CD1 4.07Å; L377-L379 PolarHBondContact O-N 3.48Å
378K94.7Very high92.8Very high149 Ų14986.2 Ų86.265%0.64843%0.429SS*.THydrogen-bonded Turntrans55.134.5-176.5-57.8178.3-178.61760113.1D374 K375 M376 Y380D374-K378 PolarHBondContact O-N 3.34Å; D374-K378 VanDerWaalsContact O-N 3.08Å; K375-K378 PolarHBondContact O-N 3.08Å; K375-K378 VanDerWaalsContact O-N 3.09Å; M376-K378 VanDerWaalsContact C-N 3.34Å; K378-Y380 VanDerWaalsContact C-N 3.27Å; K378-Y380 HydrophobicContact CB-CD2 4.45Å; K378-Y380 HydrophobicContact CB-CE2 3.74Å; K378-Y380 HydrophobicContact CG-CE2 4.4Å; K378-Y380 VanDerWaalsContact O-CD2 3.23Å; K378-Y380 WeakPolarHBondContact O-CD2 3.41Å; K378-Y380 PolarHBondContact O-N 3.23Å
379L87.2Confident92.3Very high67 Ų6786.5 Ų86.535%0.35143%0.429SS..  trans-81.971.3176.5-60.4174.9000109.9K311 D374 L377K311-L379 HydrophobicContact CB-CD1 4.2Å; K311-L379 HydrophobicContact CD-CB 3.66Å; K311-L379 WeakPolarHBondContact CD-O 3.25Å; K311-L379 VanDerWaalsContact CE-O 3.31Å; K311-L379 WeakPolarHBondContact CE-O 3.22Å; K311-L379 PolarHBondContact NZ-O 3.22Å; D374-L379 HydrophobicContact CB-CB 4.38Å; D374-L379 PolarHBondContact O-N 2.85Å; L377-L379 HydrophobicContact CB-CD1 3.97Å; L377-L379 HydrophobicContact CB-CG 3.79Å; L377-L379 HydrophobicContact CD1-CD1 4.07Å; L377-L379 PolarHBondContact O-N 3.48Å
380Y78.1Confident91.8Very high167 Ų16793.3 Ų93.366%0.65546%0.462SS*.  trans-67.6143.4179.8-57-71.2000112.4K311 K378K311-Y380 PolarHBondContact NZ-O 3.15Å; K378-Y380 VanDerWaalsContact C-N 3.27Å; K378-Y380 HydrophobicContact CB-CD2 4.45Å; K378-Y380 HydrophobicContact CB-CE2 3.74Å; K378-Y380 HydrophobicContact CG-CE2 4.4Å; K378-Y380 VanDerWaalsContact O-CD2 3.23Å; K378-Y380 WeakPolarHBondContact O-CD2 3.41Å; K378-Y380 PolarHBondContact O-N 3.23Å
381P61.4Low91.3Very high184 Ų184101.8 Ų101.8100%1.19550%0.504SS*.  trans-43.90-179.914.8-28.9000113.6K311K311-P381 VanDerWaalsContact NZ-CA 3.28Å

Retrieved 381 of 381 residues in 491.9 ms (Link to these results)

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