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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 A0A059RAT0, Species HUMAN (Homo sapiens, Human), Gene CYTB, Length 380 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M81.8Confident92.6Very high242 Ų242112.2 Ų112.2100%1.19258%0.58SS**  01340-71.1175.4173.100108.5
2T88.3Confident92.7Very high101 Ų101111.1 Ų111.162%0.6257%0.568SS**  trans-65.1133.1173.313.70000109.4I7T2-I7 WeakPolarHBondContact O-CD1 3.46Å
3P93.6Very high92.8Very high59 Ų59112.3 Ų112.338%0.38358%0.575SS.*  trans-69.7149.2-176.728.9-35.3000110.9R5 K6P3-R5 HydrophobicContact CB-CG 4.18Å; P3-R5 HydrophobicContact CG-CG 4.09Å; P3-R5 PolarHBondContact O-N 2.89Å; P3-K6 HydrophobicContact CG-CB 4.41Å; P3-K6 HydrophobicContact CG-CD 4Å; P3-K6 HydrophobicContact CG-CG 4.01Å; P3-K6 PolarHBondContact O-N 3.33Å
4M93.7Very high92.9Very high139 Ų139110.9 Ų110.969%0.68557%0.568SS**Hα-helixtrans-52.4-34.3179.2-79-65.1-175.700113.1K6 I7 N8M4-K6 PolarHBondContact O-N 2.96Å; M4-I7 PolarHBondContact O-N 3.49Å; M4-N8 PolarHBondContact O-N 3.28Å
5R95.1Very high93.1Very high100 Ų100103.5 Ų103.538%0.37753%0.53SS..Hα-helixtrans-59.3-19176.979.2-176.6-160.7-159.94114.6P3 M11 K12 N15 D20P3-R5 HydrophobicContact CB-CG 4.18Å; P3-R5 HydrophobicContact CG-CG 4.09Å; P3-R5 PolarHBondContact O-N 2.89Å; R5-M11 CarbonylContact O-C 3.45Å; R5-K12 WeakPolarHBondContact O-CA 3.22Å; R5-K12 PolarHBondContact O-N 2.93Å; R5-N15 HydrophobicContact CB-CB 4.42Å; R5-N15 WeakPolarHBondContact CD-OD1 3.42Å; R5-N15 HydrophobicContact CG-CB 4.47Å; R5-N15 WeakPolarHBondContact CG-OD1 3.37Å; R5-N15 PolarHBondContact NE-OD1 3.1Å; R5-N15 VanDerWaalsContact O-CB 3.24Å; R5-N15 WeakPolarHBondContact O-CB 3.18Å; R5-D20 IonicContact CZ-OD1 3.64Å; R5-D20 IonicContact NE-OD1 3.99Å; R5-D20 IonicContact NE-OD2 3.98Å; R5-D20 IonicContact NH2-OD1 2.78Å; R5-D20 PolarHBondContact NH2-OD1 3.14Å; R5-D20 IonicContact NH2-OD2 3.59Å
6K94.1Very high93.2Very high95 Ų95103.4 Ų103.441%0.41353%0.526SS..Hα-helixtrans-101.8-13177-66.3-173.3178.5-168.70113.4P3 M4 D20P3-K6 HydrophobicContact CG-CB 4.41Å; P3-K6 HydrophobicContact CG-CD 4Å; P3-K6 HydrophobicContact CG-CG 4.01Å; P3-K6 PolarHBondContact O-N 3.33Å; M4-K6 PolarHBondContact O-N 2.96Å; K6-D20 WeakPolarHBondContact CE-OD2 3.38Å; K6-D20 IonicContact NZ-OD2 2.85Å; K6-D20 PolarHBondContact NZ-OD2 3.43Å
7I94.8Very high93.2Very high94 Ų9498.8 Ų98.848%0.48251%0.506SS..Hα-helixtrans-105.4-49.5-173.5-57.5172.5000110.9T2 M4T2-I7 WeakPolarHBondContact O-CD1 3.46Å; M4-I7 PolarHBondContact O-N 3.49Å
8N95.9Very high93.2Very high63 Ų6398.6 Ų98.634%0.33751%0.506SS..SBendtrans-63.7127.9-177.1175.7-79.3000110M4 L10 M11 K12M4-N8 PolarHBondContact O-N 3.28Å; N8-L10 VanDerWaalsContact C-N 3.29Å; N8-L10 PolarHBondContact O-N 3.11Å; N8-L10 PolarHBondContact OD1-N 3.14Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.06Å; N8-M11 HydrophobicContact CB-SD 4.27Å; N8-M11 PolarHBondContact O-N 3.26Å; N8-M11 PolarHBondContact OD1-N 2.89Å; N8-K12 WeakPolarHBondContact O-CB 3.34Å; N8-K12 PolarHBondContact O-N 2.73Å
9P94.4Very high93.4Very high109 Ų10995.7 Ų95.771%0.70849%0.491SS*.Hα-helixtrans-55.1-38.4-173.6-29.335.5000114.8
10L92.8Very high93.6Very high135 Ų13592.7 Ų92.771%0.70748%0.476SS*.Hα-helixtrans-77.3-47.8179.1-66.1171000111.4N8 K12 L13 I14N8-L10 VanDerWaalsContact C-N 3.29Å; N8-L10 PolarHBondContact O-N 3.11Å; N8-L10 PolarHBondContact OD1-N 3.14Å; L10-K12 PolarHBondContact O-N 3.23Å; L10-L13 WeakPolarHBondContact O-CB 3.36Å; L10-L13 PolarHBondContact O-N 3.43Å; L10-L13 VanDerWaalsContact O-N 3.16Å; L10-I14 PolarHBondContact O-N 3.16Å
11M94.1Very high93.8Very high97 Ų9789.5 Ų89.548%0.47846%0.46SS..Hα-helixtrans-64.5-29.3179.1-60.5-173.9172.600112R5 N8 L13 I14 N15R5-M11 CarbonylContact O-C 3.45Å; N8-M11 HydrophobicContact CB-CB 4.05Å; N8-M11 HydrophobicContact CB-CG 4.06Å; N8-M11 HydrophobicContact CB-SD 4.27Å; N8-M11 PolarHBondContact O-N 3.26Å; N8-M11 PolarHBondContact OD1-N 2.89Å; M11-L13 VanDerWaalsContact C-N 3.35Å; M11-I14 PolarHBondContact O-N 3Å; M11-N15 VanDerWaalsContact O-CB 3.26Å; M11-N15 WeakPolarHBondContact O-CB 3.36Å; M11-N15 PolarHBondContact O-N 3.37Å
12K94.3Very high94.6Very high99 Ų9981.3 Ų81.343%0.4342%0.424SS..Hα-helixtrans-61.7-42.4175.3-178.7175.7180-172.60111.3R5 N8 L10 N15 H16R5-K12 WeakPolarHBondContact O-CA 3.22Å; R5-K12 PolarHBondContact O-N 2.93Å; N8-K12 WeakPolarHBondContact O-CB 3.34Å; N8-K12 PolarHBondContact O-N 2.73Å; L10-K12 PolarHBondContact O-N 3.23Å; K12-N15 PolarHBondContact O-N 3.2Å; K12-H16 WeakPolarHBondContact CE-NE2 3.49Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.47Å; K12-H16 PolarHBondContact O-CD2 3.46Å; K12-H16 PolarHBondContact O-N 3.43Å
13L93.5Very high95Very high127 Ų12776.7 Ų76.767%0.66540%0.396SS*.Hα-helixtrans-61-47175.3-178.366.1000111.2L10 M11 N15 H16 S17L10-L13 WeakPolarHBondContact O-CB 3.36Å; L10-L13 PolarHBondContact O-N 3.43Å; L10-L13 VanDerWaalsContact O-N 3.16Å; M11-L13 VanDerWaalsContact C-N 3.35Å; L13-N15 VanDerWaalsContact C-N 3.33Å; L13-N15 PolarHBondContact O-N 3.12Å; L13-H16 PolarHBondContact O-N 3.07Å; L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 2.94Å; L13-S17 VanDerWaalsContact O-N 3.09Å; L13-S17 PolarHBondContact O-OG 3.41Å
14I94Very high95.3Very high92 Ų9273.9 Ų73.947%0.47238%0.378SS..Hα-helixtrans-62-42.8176.6-62.2172.5000110.6L10 M11 H16 S17 L18L10-I14 PolarHBondContact O-N 3.16Å; M11-I14 PolarHBondContact O-N 3Å; I14-H16 PolarHBondContact O-N 2.86Å; I14-S17 WeakPolarHBondContact CA-OG 3.33Å; I14-S17 PolarHBondContact O-N 3.18Å; I14-S17 PolarHBondContact O-OG 3.1Å; I14-L18 HydrophobicContact CG2-CD1 4.46Å; I14-L18 PolarHBondContact O-N 3.28Å
15N96.3Very high95.5Very high1 Ų169.2 Ų69.21%0.00536%0.359CS..Iπ-helixtrans-62.7-45.3-179.3-175.679.8000111.7R5 M11 K12 L13 S17 I19 D20R5-N15 HydrophobicContact CB-CB 4.42Å; R5-N15 WeakPolarHBondContact CD-OD1 3.42Å; R5-N15 HydrophobicContact CG-CB 4.47Å; R5-N15 WeakPolarHBondContact CG-OD1 3.37Å; R5-N15 PolarHBondContact NE-OD1 3.1Å; R5-N15 VanDerWaalsContact O-CB 3.24Å; R5-N15 WeakPolarHBondContact O-CB 3.18Å; M11-N15 VanDerWaalsContact O-CB 3.26Å; M11-N15 WeakPolarHBondContact O-CB 3.36Å; M11-N15 PolarHBondContact O-N 3.37Å; K12-N15 PolarHBondContact O-N 3.2Å; L13-N15 VanDerWaalsContact C-N 3.33Å; L13-N15 PolarHBondContact O-N 3.12Å; N15-S17 VanDerWaalsContact C-N 3.34Å; N15-I19 PolarHBondContact O-N 2.79Å; N15-I19 VanDerWaalsContact O-N 3.12Å; N15-D20 PolarHBondContact ND2-OD2 2.99Å; N15-D20 PolarHBondContact O-N 2.96Å; N15-D20 PolarHBondContact OD1-OD2 3.04Å
16H94.6Very high95.6Very high101 Ų10167.1 Ų67.147%0.46836%0.355SS..Iπ-helixtrans-72.6-24.7179.7-74-65.2000113.9K12 L13 I14 L21K12-H16 WeakPolarHBondContact CE-NE2 3.49Å; K12-H16 VanDerWaalsContact CG-CD2 3.48Å; K12-H16 WeakPolarHBondContact CG-CD2 3.47Å; K12-H16 PolarHBondContact O-CD2 3.46Å; K12-H16 PolarHBondContact O-N 3.43Å; L13-H16 PolarHBondContact O-N 3.07Å; I14-H16 PolarHBondContact O-N 2.86Å; H16-L21 WeakPolarHBondContact O-CB 3.31Å
17S93.1Very high95.8Very high26 Ų2663.4 Ų63.418%0.18234%0.339CS..Iπ-helixtrans-94.5-27.5-178.652.80000114.3L13 I14 N15 L21L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 2.94Å; L13-S17 VanDerWaalsContact O-N 3.09Å; L13-S17 PolarHBondContact O-OG 3.41Å; I14-S17 WeakPolarHBondContact CA-OG 3.33Å; I14-S17 PolarHBondContact O-N 3.18Å; I14-S17 PolarHBondContact O-OG 3.1Å; N15-S17 VanDerWaalsContact C-N 3.34Å; S17-L21 WeakPolarHBondContact O-CD2 3.39Å
18L93.8Very high96Very high95 Ų9560.6 Ų60.650%0.49733%0.328SS..Iπ-helixtrans-133-19-170.7-66.6174.7000115.2I14 F220I14-L18 HydrophobicContact CG2-CD1 4.46Å; I14-L18 PolarHBondContact O-N 3.28Å; L18-F220 WeakPolarHBondContact O-CD1 3.49Å
19I96.9Very high96.1Very high44 Ų4460.9 Ų60.923%0.22634%0.339CS..Iπ-helixtrans-107.2-69.6-174.7-54178000110.5N15 L21 F220 H221N15-I19 PolarHBondContact O-N 2.79Å; N15-I19 VanDerWaalsContact O-N 3.12Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 3.48Å; I19-F220 PolarHBondContact O-N 3.4Å; I19-H221 HydrophobicContact CB-CB 4.5Å; I19-H221 HydrophobicContact CG2-CB 4.07Å; I19-H221 PolarHBondContact O-N 3.21Å
20D97.4Very high96.3Very high35 Ų3560.3 Ų60.319%0.18732%0.323CS..SBendtrans-91.313-176.9-66.4-12.2000111.7R5 K6 N15 P22R5-D20 IonicContact CZ-OD1 3.64Å; R5-D20 IonicContact NE-OD1 3.99Å; R5-D20 IonicContact NE-OD2 3.98Å; R5-D20 IonicContact NH2-OD1 2.78Å; R5-D20 PolarHBondContact NH2-OD1 3.14Å; R5-D20 IonicContact NH2-OD2 3.59Å; K6-D20 WeakPolarHBondContact CE-OD2 3.38Å; K6-D20 IonicContact NZ-OD2 2.85Å; K6-D20 PolarHBondContact NZ-OD2 3.43Å; N15-D20 PolarHBondContact ND2-OD2 2.99Å; N15-D20 PolarHBondContact O-N 2.96Å; N15-D20 PolarHBondContact OD1-OD2 3.04Å; D20-P22 WeakPolarHBondContact O-CD 3.18Å
21L97.6Very high96.6Very high26 Ų2655 Ų5514%0.13629%0.294CS..  trans-60.7117.5178.3175.767.5000110.3H16 S17 I19 T23 F220H16-L21 WeakPolarHBondContact O-CB 3.31Å; S17-L21 WeakPolarHBondContact O-CD2 3.39Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 3.48Å; L21-T23 PolarHBondContact O-N 3.29Å; L21-T23 PolarHBondContact O-OG1 2.94Å; L21-F220 HydrophobicContact CB-CB 3.94Å; L21-F220 HydrophobicContact CD2-CD2 4.24Å; L21-F220 PolarHBondContact O-N 3.48Å
22P97.6Very high96.8Very high70 Ų7050.9 Ų50.946%0.45527%0.274SS..EExtended strand (participates in β ladder)trans-72.3113.1177.9-17.432.9000110.9D20 K217D20-P22 WeakPolarHBondContact O-CD 3.18Å; P22-K217 HydrophobicContact CB-CB 4.14Å; P22-K217 HydrophobicContact CB-CD 3.63Å
23T98.2Very high97.1Very high3 Ų347.8 Ų47.82%0.01826%0.26CS..EExtended strand (participates in β ladder)trans-118.1139.8-174.5-51.50000109.5L21 S25 I27 K217 I218 Y224L21-T23 PolarHBondContact O-N 3.29Å; L21-T23 PolarHBondContact O-OG1 2.94Å; T23-S25 PolarHBondContact O-N 3.48Å; T23-I27 HydrophobicContact CG2-CD1 3.61Å; T23-I27 HydrophobicContact CG2-CG1 4.26Å; T23-K217 WeakPolarHBondContact O-CA 3.4Å; T23-I218 PolarHBondContact N-O 2.87Å; T23-I218 PolarHBondContact O-N 2.69Å; T23-Y224 HydrophobicContact CG2-CD2 3.49Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.49Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.31Å
24P98.4Very high97.3Very high0 Ų043.2 Ų43.20%024%0.244CC..EExtended strand (participates in β ladder)trans-52.5138.8175.5-1926.5000110.7N26 I27 S205 N207 S213 Y224P24-N26 PolarHBondContact O-N 2.68Å; P24-I27 HydrophobicContact CB-CG2 4.11Å; P24-I27 HydrophobicContact CG-CG2 4.16Å; P24-S205 VanDerWaalsContact CG-O 3.26Å; P24-S205 WeakPolarHBondContact CG-O 3.44Å; P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.18Å; P24-S213 WeakPolarHBondContact CB-OG 3.39Å; P24-S213 WeakPolarHBondContact CG-OG 3.22Å; P24-Y224 PolarHBondContact O-OH 3.39Å
25S98.3Very high97.5Very high42 Ų4241 Ų4129%0.29424%0.237SC..THydrogen-bonded Turntrans-66.6-20.5-177.462.80000114.5T23 D216 Y224T23-S25 PolarHBondContact O-N 3.48Å; S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.39Å; S25-D216 PolarHBondContact N-O 3Å; S25-D216 PolarHBondContact OG-OD2 3.38Å; S25-Y224 VanDerWaalsContact C-OH 3.28Å; S25-Y224 PolarHBondContact O-OH 2.92Å
26N98.3Very high97.6Very high55 Ų5541.6 Ų41.629%0.29424%0.24SC..THydrogen-bonded Turntrans-11115.7-166.669.8-30.5000114.7P24 S28 N207 P208 L209P24-N26 PolarHBondContact O-N 2.68Å; N26-S28 PolarHBondContact O-N 2.89Å; N26-N207 PolarHBondContact ND2-OD1 3.06Å; N26-N207 WeakPolarHBondContact OD1-CB 3.42Å; N26-P208 VanDerWaalsContact O-CD 3.26Å; N26-P208 WeakPolarHBondContact O-CD 3.37Å; N26-P208 WeakPolarHBondContact O-CG 3.43Å; N26-L209 WeakPolarHBondContact ND2-CD1 3.37Å
27I98.5Very high97.8Very high17 Ų1737.9 Ų37.99%0.08722%0.223CC..  trans-68.4129.1177.454.1162.3000111.2T23 P24 W31 N206 N207 Y224 K227T23-I27 HydrophobicContact CG2-CD1 3.61Å; T23-I27 HydrophobicContact CG2-CG1 4.26Å; P24-I27 HydrophobicContact CB-CG2 4.11Å; P24-I27 HydrophobicContact CG-CG2 4.16Å; I27-W31 HydrophobicContact CB-CB 4.03Å; I27-W31 HydrophobicContact CB-CD2 3.74Å; I27-W31 HydrophobicContact CB-CE3 4.2Å; I27-W31 HydrophobicContact CB-CG 3.63Å; I27-W31 HydrophobicContact CD1-CB 3.79Å; I27-W31 HydrophobicContact CD1-CG 3.91Å; I27-W31 HydrophobicContact CG1-CB 4.37Å; I27-W31 HydrophobicContact CG1-CG 4.33Å; I27-W31 HydrophobicContact CG2-CD2 3.76Å; I27-W31 HydrophobicContact CG2-CE3 4.45Å; I27-W31 HydrophobicContact CG2-CG 3.83Å; I27-W31 HydrophobicContact CG2-CZ2 4.28Å; I27-N206 WeakPolarHBondContact CG2-O 3.4Å; I27-N207 HydrophobicContact CG2-CB 4.11Å; I27-Y224 HydrophobicContact CD1-CD1 3.77Å; I27-Y224 HydrophobicContact CD1-CD2 4.48Å; I27-Y224 HydrophobicContact CD1-CE1 3.47Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.47Å; I27-Y224 HydrophobicContact CD1-CE2 4.16Å; I27-Y224 HydrophobicContact CD1-CG 4.3Å; I27-Y224 HydrophobicContact CG1-CD1 4.07Å; I27-Y224 HydrophobicContact CG1-CE1 3.24Å; I27-Y224 HydrophobicContact CG1-CE2 4.14Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.46Å; I27-K227 PolarHBondContact O-NZ 2.99Å
28S98.4Very high98.1Very high35 Ų3538.3 Ų38.325%0.24523%0.232CC..  trans-82.3-177.9-175.564.20000112.6N26 W30 W31 K227N26-S28 PolarHBondContact O-N 2.89Å; S28-W30 PolarHBondContact O-N 3.38Å; S28-W30 VanDerWaalsContact O-N 3.13Å; S28-W31 PolarHBondContact O-N 3.32Å; S28-W31 VanDerWaalsContact O-N 3.11Å; S28-K227 VanDerWaalsContact C-NZ 3.27Å; S28-K227 PolarHBondContact O-NZ 2.76Å
29A98.5Very high98.3Very high69 Ų6935 Ų3557%0.5722%0.218SC*.G310 helixtrans-57.2-24.7177.500000113.4W31 N32A29-W31 PolarHBondContact O-N 2.59Å; A29-W31 VanDerWaalsContact O-N 3.12Å; A29-N32 WeakPolarHBondContact CA-OD1 3.42Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.3Å; A29-N32 PolarHBondContact O-N 3.38Å; A29-N32 PolarHBondContact O-OD1 2.74Å; A29-N32 VanDerWaalsContact O-OD1 3.14Å
30W98.7Very high98.4Very high98 Ų9832.9 Ų32.937%0.37121%0.207SC..G310 helixtrans-61.2-21.1176.8-60.4115.4000113.6S28 N32 F33 L96 R100 Y104S28-W30 PolarHBondContact O-N 3.38Å; S28-W30 VanDerWaalsContact O-N 3.13Å; W30-N32 VanDerWaalsContact C-N 3.34Å; W30-F33 HydrophobicContact CE3-CD2 4.16Å; W30-F33 AromaticContact CE3-CE2 3.61Å; W30-F33 HydrophobicContact CE3-CE2 3.61Å; W30-F33 AromaticContact CZ3-CE2 3.94Å; W30-F33 HydrophobicContact CZ3-CE2 3.94Å; W30-L96 HydrophobicContact CZ3-CB 4.46Å; W30-L96 HydrophobicContact CZ3-CD2 4.03Å; W30-R100 HydrophobicContact CB-CB 4.1Å; W30-R100 HydrophobicContact CB-CG 3.54Å; W30-Y104 HydrophobicContact CB-CE2 4.23Å; W30-Y104 AromaticContact CD1-CE2 3.84Å; W30-Y104 HydrophobicContact CG-CE2 4.18Å
31W98.7Very high98.5Very high22 Ų2232.1 Ų32.18%0.08320%0.203CC..G310 helixtrans-77.2-18.1175.1-87.1-113.1000113.9I27 S28 A29 F33 G34 R100 Y104 N206 P208I27-W31 HydrophobicContact CB-CB 4.03Å; I27-W31 HydrophobicContact CB-CD2 3.74Å; I27-W31 HydrophobicContact CB-CE3 4.2Å; I27-W31 HydrophobicContact CB-CG 3.63Å; I27-W31 HydrophobicContact CD1-CB 3.79Å; I27-W31 HydrophobicContact CD1-CG 3.91Å; I27-W31 HydrophobicContact CG1-CB 4.37Å; I27-W31 HydrophobicContact CG1-CG 4.33Å; I27-W31 HydrophobicContact CG2-CD2 3.76Å; I27-W31 HydrophobicContact CG2-CE3 4.45Å; I27-W31 HydrophobicContact CG2-CG 3.83Å; I27-W31 HydrophobicContact CG2-CZ2 4.28Å; S28-W31 PolarHBondContact O-N 3.32Å; S28-W31 VanDerWaalsContact O-N 3.11Å; A29-W31 PolarHBondContact O-N 2.59Å; A29-W31 VanDerWaalsContact O-N 3.12Å; W31-F33 PolarHBondContact O-N 3.2Å; W31-G34 PolarHBondContact O-N 2.85Å; W31-R100 VanDerWaalsContact CE2-NH1 3.28Å; W31-R100 HydrophobicContact CE3-CG 4.34Å; W31-R100 HydrophobicContact CZ3-CG 4.25Å; W31-Y104 HydrophobicContact CH2-CD1 4.17Å; W31-Y104 AromaticContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CE2 4.02Å; W31-Y104 AromaticContact CH2-CG 3.62Å; W31-Y104 HydrophobicContact CH2-CG 3.62Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.6Å; W31-Y104 HydrophobicContact CZ3-CE2 3.6Å; W31-Y104 HydrophobicContact CZ3-CG 4.09Å; W31-N206 VanDerWaalsContact CE2-O 3.28Å; W31-N206 HydrophobicContact CZ2-CB 4.28Å; W31-N206 VanDerWaalsContact CZ2-O 3.26Å; W31-N206 WeakPolarHBondContact CZ2-O 3.45Å; W31-N206 PolarHBondContact NE1-O 3.29Å; W31-P208 HydrophobicContact CH2-CG 4.09Å; W31-P208 HydrophobicContact CZ3-CG 3.82Å
32N98.7Very high98.5Very high12 Ų1236.3 Ų36.36%0.06422%0.224CC..G310 helixtrans-66.3-23.6178.5-67.263.5000112.7A29 W30 G34 S35 L36 K227 D228A29-N32 WeakPolarHBondContact CA-OD1 3.42Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.3Å; A29-N32 PolarHBondContact O-N 3.38Å; A29-N32 PolarHBondContact O-OD1 2.74Å; A29-N32 VanDerWaalsContact O-OD1 3.14Å; W30-N32 VanDerWaalsContact C-N 3.34Å; N32-G34 PolarHBondContact O-N 3.4Å; N32-G34 VanDerWaalsContact O-N 3.08Å; N32-S35 PolarHBondContact O-N 3.15Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 2.98Å; N32-L36 WeakPolarHBondContact O-CG 3.39Å; N32-L36 PolarHBondContact O-N 3.23Å; N32-K227 PolarHBondContact ND2-O 2.7Å; N32-K227 WeakPolarHBondContact OD1-CE 3.4Å; N32-K227 PolarHBondContact OD1-NZ 3.46Å; N32-D228 PolarHBondContact ND2-OD1 3.31Å
33F98.8Very high98.6Very high33 Ų3334.4 Ų34.415%0.14521%0.21CC..Hα-helixtrans-62.7-20.1-178.6-70-68.9000113.5W30 W31 L36 L37 C93 L96 H97W30-F33 HydrophobicContact CE3-CD2 4.16Å; W30-F33 AromaticContact CE3-CE2 3.61Å; W30-F33 HydrophobicContact CE3-CE2 3.61Å; W30-F33 AromaticContact CZ3-CE2 3.94Å; W30-F33 HydrophobicContact CZ3-CE2 3.94Å; W31-F33 PolarHBondContact O-N 3.2Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.11Å; F33-L37 WeakPolarHBondContact O-CB 3.42Å; F33-L37 WeakPolarHBondContact O-CD1 3.38Å; F33-L37 WeakPolarHBondContact O-CG 3.48Å; F33-L37 PolarHBondContact O-N 3.01Å; F33-C93 HydrophobicContact CD1-CB 4.15Å; F33-L96 HydrophobicContact CD1-CB 4.07Å; F33-L96 HydrophobicContact CD1-CD1 4.36Å; F33-L96 HydrophobicContact CD2-CB 3.92Å; F33-L96 HydrophobicContact CE1-CB 3.93Å; F33-L96 HydrophobicContact CE1-CD1 3.47Å; F33-L96 VanDerWaalsContact CE1-CD1 3.47Å; F33-L96 HydrophobicContact CE1-CG 4.34Å; F33-L96 HydrophobicContact CE2-CB 3.78Å; F33-L96 HydrophobicContact CE2-CD1 4.13Å; F33-L96 HydrophobicContact CG-CB 4.09Å; F33-L96 HydrophobicContact CZ-CB 3.79Å; F33-L96 HydrophobicContact CZ-CD1 3.34Å; F33-L96 HydrophobicContact CZ-CG 4.16Å; F33-H97 HydrophobicContact CB-CB 3.93Å
34G98.2Very high98.6Very high32 Ų3235.4 Ų35.433%0.3322%0.215SC..Hα-helixtrans-65.2-50.8171.100000112.6W31 N32 L37 G38 H97W31-G34 PolarHBondContact O-N 2.85Å; N32-G34 PolarHBondContact O-N 3.4Å; N32-G34 VanDerWaalsContact O-N 3.08Å; G34-L37 PolarHBondContact O-N 3.32Å; G34-G38 PolarHBondContact O-N 3.4Å; G34-H97 PolarHBondContact N-ND1 2.86Å
35S98.3Very high98.7Very high45 Ų4537.3 Ų37.332%0.31522%0.224SC..Hα-helixtrans-70.2-34.8177.746.20000112.3N32 L37 G38 A39 D228N32-S35 PolarHBondContact O-N 3.15Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 2.98Å; S35-L37 PolarHBondContact O-N 2.97Å; S35-G38 PolarHBondContact O-N 3.36Å; S35-A39 PolarHBondContact O-N 3.39Å; S35-D228 WeakPolarHBondContact CB-OD2 3.37Å; S35-D228 PolarHBondContact OG-OD2 3.46Å
36L98.8Very high98.7Very high14 Ų1438.3 Ų38.37%0.07323%0.229CC..Hα-helixtrans-62.6-39.7173.1-66.2-178.9000112.6N32 F33 G38 A39 C40 L232 F235N32-L36 WeakPolarHBondContact O-CG 3.39Å; N32-L36 PolarHBondContact O-N 3.23Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.11Å; L36-G38 VanDerWaalsContact C-N 3.32Å; L36-G38 PolarHBondContact O-N 3.3Å; L36-A39 WeakPolarHBondContact O-CB 3.3Å; L36-A39 PolarHBondContact O-N 3.25Å; L36-C40 PolarHBondContact O-N 3.49Å; L36-C40 PolarHBondContact O-SG 3.28Å; L36-L232 HydrophobicContact CD2-CB 4.47Å; L36-L232 HydrophobicContact CD2-CD1 4.47Å; L36-F235 HydrophobicContact CD1-CB 4.45Å; L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.43Å; L36-F235 HydrophobicContact CD2-CG 4.04Å
37L98.9Very high98.7Very high23 Ų2336.2 Ų36.212%0.1222%0.218CC..Hα-helixtrans-62.7-39.2173.9-76.6169000112.2F33 G34 S35 C40 L41 F90 C93 L94 H97F33-L37 WeakPolarHBondContact O-CB 3.42Å; F33-L37 WeakPolarHBondContact O-CD1 3.38Å; F33-L37 WeakPolarHBondContact O-CG 3.48Å; F33-L37 PolarHBondContact O-N 3.01Å; G34-L37 PolarHBondContact O-N 3.32Å; S35-L37 PolarHBondContact O-N 2.97Å; L37-C40 PolarHBondContact O-N 2.66Å; L37-L41 PolarHBondContact O-N 3.31Å; L37-F90 HydrophobicContact CD2-CD2 4.05Å; L37-F90 HydrophobicContact CD2-CE2 3.87Å; L37-F90 HydrophobicContact CD2-CZ 4.23Å; L37-C93 HydrophobicContact CD2-CB 3.66Å; L37-C93 HydrophobicContact CG-CB 3.98Å; L37-L94 HydrophobicContact CD1-CD2 3.93Å; L37-L94 HydrophobicContact CD2-CB 4.32Å; L37-L94 HydrophobicContact CD2-CD2 3.75Å; L37-L94 HydrophobicContact CD2-CG 3.62Å; L37-H97 HydrophobicContact CD1-CB 3.81Å
38G98.7Very high98.7Very high34 Ų3436.2 Ų36.235%0.35122%0.222SC..Hα-helixtrans-59.9-44.7171.300000112.3G34 S35 L36 L41 I42G34-G38 PolarHBondContact O-N 3.4Å; S35-G38 PolarHBondContact O-N 3.36Å; L36-G38 VanDerWaalsContact C-N 3.32Å; L36-G38 PolarHBondContact O-N 3.3Å; G38-L41 PolarHBondContact O-N 2.88Å; G38-I42 WeakPolarHBondContact O-CG1 3.47Å; G38-I42 PolarHBondContact O-N 3Å; G38-I42 VanDerWaalsContact O-N 3.08Å
39A98.8Very high98.7Very high25 Ų2538.1 Ų38.121%0.20723%0.229CC..Hα-helixtrans-63.6-41.4175.500000112.4S35 L36 L41 I42 L43 L232S35-A39 PolarHBondContact O-N 3.39Å; L36-A39 WeakPolarHBondContact O-CB 3.3Å; L36-A39 PolarHBondContact O-N 3.25Å; A39-L41 VanDerWaalsContact C-N 3.32Å; A39-L41 PolarHBondContact O-N 3.15Å; A39-I42 PolarHBondContact O-N 3.47Å; A39-L43 WeakPolarHBondContact O-CB 3.37Å; A39-L43 PolarHBondContact O-N 2.91Å; A39-L232 HydrophobicContact CB-CD1 3.69Å
40C98.9Very high98.8Very high0 Ų040.1 Ų40.10%023%0.225CC..Hα-helixtrans-61.8-41.4175.1-60.50000110.7L36 L37 L43 Q44 F90 F235L36-C40 PolarHBondContact O-N 3.49Å; L36-C40 PolarHBondContact O-SG 3.28Å; L37-C40 PolarHBondContact O-N 2.66Å; C40-L43 WeakPolarHBondContact O-CB 3.49Å; C40-L43 PolarHBondContact O-N 3.42Å; C40-Q44 WeakPolarHBondContact O-CG 3.39Å; C40-Q44 PolarHBondContact O-N 3.4Å; C40-F90 HydrophobicContact CB-CB 4.15Å; C40-F90 HydrophobicContact CB-CD1 3.16Å; C40-F90 HydrophobicContact CB-CE1 3.7Å; C40-F90 HydrophobicContact CB-CG 3.9Å; C40-F235 WeakPolarHBondContact SG-CE2 3.32Å; C40-F235 WeakPolarHBondContact SG-CZ 3.38Å
41L98.9Very high98.8Very high20 Ų2036.6 Ų36.611%0.10521%0.213CC..Hα-helixtrans-63.6-44.4179-176.761.1000111.8L37 G38 A39 L43 Q44 I45 F90 I189 A190L37-L41 PolarHBondContact O-N 3.31Å; G38-L41 PolarHBondContact O-N 2.88Å; A39-L41 VanDerWaalsContact C-N 3.32Å; A39-L41 PolarHBondContact O-N 3.15Å; L41-L43 VanDerWaalsContact C-N 3.35Å; L41-Q44 PolarHBondContact O-N 3.49Å; L41-I45 HydrophobicContact CD1-CD1 3.98Å; L41-I45 HydrophobicContact CD1-CG1 4.3Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 WeakPolarHBondContact O-CG1 3.46Å; L41-I45 PolarHBondContact O-N 3.44Å; L41-F90 HydrophobicContact CB-CE1 3.93Å; L41-F90 HydrophobicContact CD1-CE1 4.45Å; L41-I189 HydrophobicContact CD1-CB 4.37Å; L41-I189 HydrophobicContact CD1-CG2 3.85Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L41-A190 HydrophobicContact CD2-CB 3.93Å
42I98.9Very high98.8Very high113 Ų11336.7 Ų36.758%0.57922%0.219SC*.Hα-helixtrans-62.2-44.1175.6-66.4167.1000110.4G38 A39 Q44 I45 T46G38-I42 WeakPolarHBondContact O-CG1 3.47Å; G38-I42 PolarHBondContact O-N 3Å; G38-I42 VanDerWaalsContact O-N 3.08Å; A39-I42 PolarHBondContact O-N 3.47Å; I42-Q44 PolarHBondContact O-N 3.22Å; I42-I45 PolarHBondContact O-N 2.71Å; I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.13Å; I42-T46 VanDerWaalsContact O-CG2 3.28Å; I42-T46 WeakPolarHBondContact O-CG2 3.35Å; I42-T46 PolarHBondContact O-N 3.26Å; I42-T46 PolarHBondContact O-OG1 2.89Å
43L98.9Very high98.8Very high30 Ų3041.7 Ų41.716%0.15724%0.243CC..Hα-helixtrans-58.2-48.2176.1178.974.5000111.3A39 C40 L41 T46 T47 L239A39-L43 WeakPolarHBondContact O-CB 3.37Å; A39-L43 PolarHBondContact O-N 2.91Å; C40-L43 WeakPolarHBondContact O-CB 3.49Å; C40-L43 PolarHBondContact O-N 3.42Å; L41-L43 VanDerWaalsContact C-N 3.35Å; L43-T46 PolarHBondContact O-N 3.45Å; L43-T46 PolarHBondContact O-OG1 3.3Å; L43-T47 HydrophobicContact CD1-CG2 4.06Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.4Å; L43-T47 WeakPolarHBondContact O-CG2 3.42Å; L43-T47 PolarHBondContact O-N 3.11Å; L43-T47 PolarHBondContact O-OG1 2.89Å; L43-L239 HydrophobicContact CD2-CD2 3.42Å; L43-L239 VanDerWaalsContact CD2-CD2 3.42Å
44Q98.9Very high98.8Very high25 Ų2544 Ų4412%0.11725%0.254CS..Hα-helixtrans-66-43.1-179-67.6-48.9105.800112.1C40 L41 I42 T47 G48 H83 G86 F90C40-Q44 WeakPolarHBondContact O-CG 3.39Å; C40-Q44 PolarHBondContact O-N 3.4Å; L41-Q44 PolarHBondContact O-N 3.49Å; I42-Q44 PolarHBondContact O-N 3.22Å; Q44-T47 PolarHBondContact O-OG1 3.12Å; Q44-G48 WeakPolarHBondContact O-CA 3.5Å; Q44-G48 PolarHBondContact O-N 3.45Å; Q44-H83 PolarHBondContact NE2-O 3.47Å; Q44-H83 PolarHBondContact O-CE1 3.08Å; Q44-H83 VanDerWaalsContact O-CE1 3.28Å; Q44-H83 PolarHBondContact O-ND1 3.33Å; Q44-H83 PolarHBondContact OE1-O 3.08Å; Q44-G86 VanDerWaalsContact OE1-CA 3.32Å; Q44-F90 HydrophobicContact CG-CD1 4.28Å
45I98.9Very high98.8Very high39 Ų3943.6 Ų43.620%0.224%0.243CC..Hα-helixtrans-63.7-46.3178-69.6170.2000110.5L41 I42 L49 P186 F187L41-I45 HydrophobicContact CD1-CD1 3.98Å; L41-I45 HydrophobicContact CD1-CG1 4.3Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 WeakPolarHBondContact O-CG1 3.46Å; L41-I45 PolarHBondContact O-N 3.44Å; I42-I45 PolarHBondContact O-N 2.71Å; I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.39Å; I45-L49 PolarHBondContact O-N 3.42Å; I45-P186 HydrophobicContact CD1-CB 4.22Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; I45-F187 HydrophobicContact CG2-CE1 4.01Å; I45-F187 HydrophobicContact CG2-CZ 4.18Å
46T98.9Very high98.8Very high64 Ų6443.7 Ų43.739%0.39324%0.243SC..Hα-helixtrans-65.8-55.7-178.151.20000111.2I42 L43 G48 L49 F50I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.13Å; I42-T46 VanDerWaalsContact O-CG2 3.28Å; I42-T46 WeakPolarHBondContact O-CG2 3.35Å; I42-T46 PolarHBondContact O-N 3.26Å; I42-T46 PolarHBondContact O-OG1 2.89Å; L43-T46 PolarHBondContact O-N 3.45Å; L43-T46 PolarHBondContact O-OG1 3.3Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.92Å; T46-L49 PolarHBondContact O-N 3.4Å; T46-F50 VanDerWaalsContact O-CD2 3.3Å; T46-F50 WeakPolarHBondContact O-CD2 3.36Å; T46-F50 PolarHBondContact O-N 2.89Å
47T98.9Very high98.7Very high11 Ų1144.5 Ų44.57%0.06725%0.25CC..Hα-helixtrans-60.6-41.6178.254.50000112L43 Q44 L49 F50 L51 I79 L82 H83L43-T47 HydrophobicContact CD1-CG2 4.06Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.4Å; L43-T47 WeakPolarHBondContact O-CG2 3.42Å; L43-T47 PolarHBondContact O-N 3.11Å; L43-T47 PolarHBondContact O-OG1 2.89Å; Q44-T47 PolarHBondContact O-OG1 3.12Å; T47-L49 PolarHBondContact O-N 2.82Å; T47-F50 PolarHBondContact O-N 2.94Å; T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.25Å; T47-L51 PolarHBondContact O-N 2.93Å; T47-I79 HydrophobicContact CG2-CG2 4.3Å; T47-L82 HydrophobicContact CG2-CB 4.08Å; T47-H83 PolarHBondContact OG1-ND1 2.74Å
48G98.9Very high98.6Very high16 Ų1646.1 Ų46.117%0.16526%0.258CS..Hα-helixtrans-62.5-39.7178.400000112.9Q44 T46 L51 A52 H83Q44-G48 WeakPolarHBondContact O-CA 3.5Å; Q44-G48 PolarHBondContact O-N 3.45Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.92Å; G48-L51 PolarHBondContact O-N 3.29Å; G48-A52 VanDerWaalsContact O-CB 3.31Å; G48-A52 WeakPolarHBondContact O-CB 3.5Å; G48-A52 PolarHBondContact O-N 2.88Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.39Å; G48-H83 PolarHBondContact N-ND1 3.48Å
49L98.8Very high98.5Very high76 Ų7645.3 Ų45.340%0.39825%0.248SC..Hα-helixtrans-62.3-45.1175.3-176.965.9000111.7I45 T46 T47 A52 M53 F183I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.39Å; I45-L49 PolarHBondContact O-N 3.42Å; T46-L49 PolarHBondContact O-N 3.4Å; T47-L49 PolarHBondContact O-N 2.82Å; L49-A52 PolarHBondContact O-N 3.41Å; L49-M53 HydrophobicContact CG-CE 4.13Å; L49-M53 WeakPolarHBondContact O-CG 3.28Å; L49-M53 PolarHBondContact O-N 3.07Å; L49-F183 HydrophobicContact CD1-CE2 4.22Å; L49-F183 HydrophobicContact CD1-CZ 3.97Å
50F98.8Very high98.5Very high110 Ų11048.8 Ų48.848%0.48227%0.271SS..Hα-helixtrans-65.5-38176.7-82.7-82.8000112.3T46 T47 M53 H54 I79T46-F50 VanDerWaalsContact O-CD2 3.3Å; T46-F50 WeakPolarHBondContact O-CD2 3.36Å; T46-F50 PolarHBondContact O-N 2.89Å; T47-F50 PolarHBondContact O-N 2.94Å; F50-M53 HydrophobicContact CD1-SD 4.29Å; F50-M53 PolarHBondContact O-N 3.48Å; F50-H54 PolarHBondContact O-CD2 3.42Å; F50-I79 HydrophobicContact CB-CD1 4.36Å; F50-I79 HydrophobicContact CB-CG2 4.2Å
51L98.9Very high98.4Very high24 Ų2451 Ų5113%0.12629%0.285CS..Hα-helixtrans-64.8-42174-67.5170.6000111.7T47 G48 M53 H54 Y55 I69 I79 R80 H83T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.25Å; T47-L51 PolarHBondContact O-N 2.93Å; G48-L51 PolarHBondContact O-N 3.29Å; L51-M53 PolarHBondContact O-N 3.47Å; L51-H54 PolarHBondContact O-N 3.45Å; L51-Y55 PolarHBondContact O-N 2.82Å; L51-Y55 VanDerWaalsContact O-N 3.13Å; L51-I69 HydrophobicContact CD2-CD1 4.26Å; L51-I69 HydrophobicContact CD2-CG2 3.56Å; L51-I79 HydrophobicContact CD2-CG2 3.96Å; L51-I79 HydrophobicContact CG-CG2 3.88Å; L51-R80 HydrophobicContact CD2-CB 4.1Å; L51-H83 HydrophobicContact CD1-CB 3.5Å
52A98.7Very high98.4Very high24 Ų2450.1 Ų50.120%0.19828%0.28CS..Hα-helixtrans-62.1-27.1-179.500000113.2G48 L49 H54 F179 F183G48-A52 VanDerWaalsContact O-CB 3.31Å; G48-A52 WeakPolarHBondContact O-CB 3.5Å; G48-A52 PolarHBondContact O-N 2.88Å; L49-A52 PolarHBondContact O-N 3.41Å; A52-H54 PolarHBondContact O-N 3.04Å; A52-F179 HydrophobicContact CB-CE2 4.23Å; A52-F179 HydrophobicContact CB-CZ 4.16Å; A52-F183 HydrophobicContact CB-CD2 4.24Å; A52-F183 HydrophobicContact CB-CE2 3.93Å
53M98.7Very high98.4Very high117 Ų11747.4 Ų47.458%0.57626%0.264SS*.THydrogen-bonded Turntrans-63.9-18.5174.6-66.1174.7-173.400113.4L49 F50 L51L49-M53 HydrophobicContact CG-CE 4.13Å; L49-M53 WeakPolarHBondContact O-CG 3.28Å; L49-M53 PolarHBondContact O-N 3.07Å; F50-M53 HydrophobicContact CD1-SD 4.29Å; F50-M53 PolarHBondContact O-N 3.48Å; L51-M53 PolarHBondContact O-N 3.47Å
54H98.6Very high98.4Very high82 Ų8249 Ų4938%0.3828%0.278SS..THydrogen-bonded Turntrans-123.5-2.5-174.5-61.7-68000113.5F50 L51 A52 I69 V73F50-H54 PolarHBondContact O-CD2 3.42Å; L51-H54 PolarHBondContact O-N 3.45Å; A52-H54 PolarHBondContact O-N 3.04Å; H54-I69 HydrophobicContact CB-CD1 3.9Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; H54-V73 HydrophobicContact CB-CG2 4.35Å
55Y98.8Very high98.4Very high24 Ų2448.4 Ų48.49%0.09428%0.277CS..  trans-92.7144.6-177.3175.8-108.6000111.9L51 P57 A62 S65 I66 L133 F179L51-Y55 PolarHBondContact O-N 2.82Å; L51-Y55 VanDerWaalsContact O-N 3.13Å; Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; Y55-A62 HydrophobicContact CE2-CB 3.99Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.37Å; Y55-I66 HydrophobicContact CD2-CD1 3.69Å; Y55-I66 HydrophobicContact CD2-CG1 4.24Å; Y55-I66 HydrophobicContact CE2-CD1 4.11Å; Y55-I66 HydrophobicContact CE2-CG1 4.29Å; Y55-L133 HydrophobicContact CE1-CB 4.44Å; Y55-L133 HydrophobicContact CE2-CB 4.42Å; Y55-L133 WeakPolarHBondContact CE2-O 3.26Å; Y55-L133 PolarHBondContact OH-O 3.46Å; Y55-F179 AromaticContact CD1-CD2 3.64Å; Y55-F179 HydrophobicContact CD1-CD2 3.64Å; Y55-F179 AromaticContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.37Å; Y55-F179 HydrophobicContact CE1-CB 4.32Å; Y55-F179 AromaticContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CE2 4.11Å; Y55-F179 HydrophobicContact CE1-CG 4.03Å
56S98.3Very high98.4Very high46 Ų4647.8 Ų47.832%0.32227%0.273SS..  trans-120.7114.1177-172.60000110.5D58 T61 A62 S65S56-D58 PolarHBondContact O-N 3.08Å; S56-T61 WeakPolarHBondContact CB-OG1 3.31Å; S56-T61 PolarHBondContact OG-OG1 3.38Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.27Å; S56-A62 WeakPolarHBondContact O-CB 3.35Å; S56-S65 PolarHBondContact N-OG 3.05Å
57P97.1Very high98.3Very high32 Ų3246.2 Ų46.221%0.20827%0.267CS..  trans-85.752.5-173.336.5-38.5000113.3Y55 T176 F179Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.7Å; P57-T176 PolarHBondContact O-OG1 2.91Å; P57-F179 HydrophobicContact CB-CB 3.79Å; P57-F179 HydrophobicContact CB-CD1 3.96Å; P57-F179 HydrophobicContact CB-CG 3.9Å; P57-F179 HydrophobicContact CG-CD1 3.93Å; P57-F179 HydrophobicContact CG-CE1 4.42Å; P57-F179 HydrophobicContact CG-CG 4.37Å
58D97.3Very high98.3Very high56 Ų5649.5 Ų49.530%0.29928%0.282SS..SBendtrans-124.9140.5173.1178.7-96.6000110.7S56 S60 T61 A62 S172S56-D58 PolarHBondContact O-N 3.08Å; D58-S60 PolarHBondContact O-N 3.37Å; D58-S60 VanDerWaalsContact O-N 3.12Å; D58-S60 VanDerWaalsContact OD1-CB 3.26Å; D58-S60 WeakPolarHBondContact OD1-CB 3.28Å; D58-S60 PolarHBondContact OD1-N 2.95Å; D58-S60 PolarHBondContact OD1-OG 3.45Å; D58-T61 PolarHBondContact O-N 2.84Å; D58-A62 WeakPolarHBondContact O-CB 3.23Å; D58-A62 PolarHBondContact O-N 3.21Å; D58-S172 PolarHBondContact OD2-OG 2.95Å
59A96.1Very high98.3Very high17 Ų1748.9 Ų48.914%0.1427%0.274CS..THydrogen-bonded Turntrans-59.5-27.2-174.500000113.4W135 S172A59-W135 HydrophobicContact CB-CZ2 3.74Å; A59-S172 WeakPolarHBondContact CB-OG 3.32Å; A59-S172 PolarHBondContact N-OG 3.34Å
60S97.7Very high98.3Very high99 Ų9946.9 Ų46.969%0.69227%0.265SS*.THydrogen-bonded Turntrans-78.1-26.9178.172.30000113.4D58D58-S60 PolarHBondContact O-N 3.37Å; D58-S60 VanDerWaalsContact O-N 3.12Å; D58-S60 VanDerWaalsContact OD1-CB 3.26Å; D58-S60 WeakPolarHBondContact OD1-CB 3.28Å; D58-S60 PolarHBondContact OD1-N 2.95Å; D58-S60 PolarHBondContact OD1-OG 3.45Å
61T98.3Very high98.3Very high47 Ų4751.4 Ų51.429%0.28828%0.279SS..THydrogen-bonded Turntrans-115.4-21.2-173.156.90000114.1S56 D58 F63 S64 S65S56-T61 WeakPolarHBondContact CB-OG1 3.31Å; S56-T61 PolarHBondContact OG-OG1 3.38Å; D58-T61 PolarHBondContact O-N 2.84Å; T61-F63 PolarHBondContact O-N 3.05Å; T61-S64 CarbonylContact O-C 3.56Å; T61-S64 PolarHBondContact O-N 3.37Å; T61-S64 VanDerWaalsContact O-N 3.1Å; T61-S64 PolarHBondContact O-OG 3.28Å; T61-S65 WeakPolarHBondContact O-CB 3.36Å; T61-S65 PolarHBondContact O-N 3.3Å
62A98.6Very high98.3Very high0 Ų055.5 Ų55.50%030%0.301CS..Hα-helixtrans-54.7-53.9-170.800000113.3Y55 S56 D58 S64 S65 I66 W135 L175Y55-A62 HydrophobicContact CE2-CB 3.99Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.27Å; S56-A62 WeakPolarHBondContact O-CB 3.35Å; D58-A62 WeakPolarHBondContact O-CB 3.23Å; D58-A62 PolarHBondContact O-N 3.21Å; A62-S64 VanDerWaalsContact C-N 3.33Å; A62-S64 PolarHBondContact O-N 3.44Å; A62-S65 PolarHBondContact O-N 3.49Å; A62-S65 VanDerWaalsContact O-N 3.14Å; A62-S65 PolarHBondContact O-OG 3.31Å; A62-I66 PolarHBondContact O-N 2.89Å; A62-I66 VanDerWaalsContact O-N 3.12Å; A62-W135 HydrophobicContact CB-CB 3.89Å; A62-W135 HydrophobicContact CB-CG 4.41Å; A62-L175 HydrophobicContact CB-CD2 3.55Å
63F98.6Very high98.3Very high56 Ų5655.6 Ų55.625%0.24630%0.299CS..Hα-helixtrans-58.3-45.2177.6-173.8-91.5000112T61 S65 I66 A67 P134 W135 Y256 L258T61-F63 PolarHBondContact O-N 3.05Å; F63-S65 VanDerWaalsContact C-N 3.33Å; F63-S65 PolarHBondContact O-N 3.29Å; F63-I66 PolarHBondContact O-N 3.42Å; F63-A67 PolarHBondContact O-N 3.16Å; F63-A67 VanDerWaalsContact O-N 3.1Å; F63-P134 WeakPolarHBondContact CA-O 3.48Å; F63-P134 WeakPolarHBondContact CD2-O 3.36Å; F63-W135 HydrophobicContact CB-CB 4.45Å; F63-Y256 WeakPolarHBondContact CZ-O 3.32Å; F63-L258 HydrophobicContact CB-CD1 3.44Å; F63-L258 VanDerWaalsContact CB-CD1 3.44Å; F63-L258 HydrophobicContact CD1-CB 4.21Å; F63-L258 HydrophobicContact CD1-CD1 4.12Å; F63-L258 HydrophobicContact CD2-CB 4.48Å; F63-L258 HydrophobicContact CD2-CD1 4.23Å; F63-L258 HydrophobicContact CE1-CB 4.35Å; F63-L258 HydrophobicContact CG-CB 4.29Å; F63-L258 HydrophobicContact CG-CD1 3.68Å
64S98.6Very high98.3Very high65 Ų6557 Ų5746%0.45531%0.309SS..Hα-helixtrans-66.9-32.3178.271.70000112.9T61 A62 A67 H68T61-S64 CarbonylContact O-C 3.56Å; T61-S64 PolarHBondContact O-N 3.37Å; T61-S64 VanDerWaalsContact O-N 3.1Å; T61-S64 PolarHBondContact O-OG 3.28Å; A62-S64 VanDerWaalsContact C-N 3.33Å; A62-S64 PolarHBondContact O-N 3.44Å; S64-A67 WeakPolarHBondContact O-CB 3.45Å; S64-A67 PolarHBondContact O-N 3.43Å; S64-H68 WeakPolarHBondContact O-CB 3.21Å; S64-H68 PolarHBondContact O-N 3.48Å
65S98.7Very high98.3Very high11 Ų1161.3 Ų61.38%0.07732%0.323CS..Hα-helixtrans-69.2-35.717775.80000111.9Y55 S56 T61 A62 F63 H68 I69Y55-S65 WeakPolarHBondContact CD2-OG 3.37Å; S56-S65 PolarHBondContact N-OG 3.05Å; T61-S65 WeakPolarHBondContact O-CB 3.36Å; T61-S65 PolarHBondContact O-N 3.3Å; A62-S65 PolarHBondContact O-N 3.49Å; A62-S65 VanDerWaalsContact O-N 3.14Å; A62-S65 PolarHBondContact O-OG 3.31Å; F63-S65 VanDerWaalsContact C-N 3.33Å; F63-S65 PolarHBondContact O-N 3.29Å; S65-H68 PolarHBondContact O-N 3.42Å; S65-I69 VanDerWaalsContact O-CG1 3.3Å; S65-I69 WeakPolarHBondContact O-CG1 3.49Å; S65-I69 PolarHBondContact O-N 3.35Å
66I98.6Very high98.3Very high26 Ų2660.3 Ų60.313%0.13332%0.32CS..Hα-helixtrans-66.1-40.1170.4-64.3-54.3000111.3Y55 A62 F63 I69 T70 R80 P134Y55-I66 HydrophobicContact CD2-CD1 3.69Å; Y55-I66 HydrophobicContact CD2-CG1 4.24Å; Y55-I66 HydrophobicContact CE2-CD1 4.11Å; Y55-I66 HydrophobicContact CE2-CG1 4.29Å; A62-I66 PolarHBondContact O-N 2.89Å; A62-I66 VanDerWaalsContact O-N 3.12Å; F63-I66 PolarHBondContact O-N 3.42Å; I66-I69 HydrophobicContact CD1-CD1 4.18Å; I66-I69 PolarHBondContact O-N 3.09Å; I66-T70 PolarHBondContact O-N 2.98Å; I66-T70 PolarHBondContact O-OG1 3.05Å; I66-R80 VanDerWaalsContact CG2-NE 3.25Å; I66-P134 HydrophobicContact CG1-CB 4.41Å
67A98.5Very high98.3Very high32 Ų3263 Ų6326%0.26432%0.323SS..Hα-helixtrans-62.7-43.9174.500000111.5F63 S64 T70 R71F63-A67 PolarHBondContact O-N 3.16Å; F63-A67 VanDerWaalsContact O-N 3.1Å; S64-A67 WeakPolarHBondContact O-CB 3.45Å; S64-A67 PolarHBondContact O-N 3.43Å; A67-T70 PolarHBondContact O-N 2.79Å; A67-T70 VanDerWaalsContact O-N 3.15Å; A67-R71 WeakPolarHBondContact O-CB 3.35Å; A67-R71 WeakPolarHBondContact O-CG 3.28Å; A67-R71 PolarHBondContact O-N 2.88Å
68H98.8Very high98.4Very high80 Ų8063 Ų6337%0.3732%0.321SS..Hα-helixtrans-59.9-46.5174.4165.8-92.2000112.1S64 S65 T70 R71 D72 V73S64-H68 WeakPolarHBondContact O-CB 3.21Å; S64-H68 PolarHBondContact O-N 3.48Å; S65-H68 PolarHBondContact O-N 3.42Å; H68-T70 PolarHBondContact O-N 3.48Å; H68-R71 PolarHBondContact O-N 2.67Å; H68-D72 IonicContact CD2-OD2 3.3Å; H68-D72 PolarHBondContact CD2-OD2 3.11Å; H68-D72 VanDerWaalsContact CD2-OD2 3.3Å; H68-D72 IonicContact CG-OD2 3.89Å; H68-D72 WeakPolarHBondContact O-CB 3.48Å; H68-D72 PolarHBondContact O-N 2.86Å; H68-V73 PolarHBondContact O-N 2.89Å
69I98.8Very high98.5Very high2 Ų262.3 Ų62.31%0.0132%0.317CS..Hα-helixtrans-54.3-44.1173.3-74166.6000110.8L51 H54 S65 I66 G76 R80L51-I69 HydrophobicContact CD2-CD1 4.26Å; L51-I69 HydrophobicContact CD2-CG2 3.56Å; H54-I69 HydrophobicContact CB-CD1 3.9Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; S65-I69 VanDerWaalsContact O-CG1 3.3Å; S65-I69 WeakPolarHBondContact O-CG1 3.49Å; S65-I69 PolarHBondContact O-N 3.35Å; I66-I69 HydrophobicContact CD1-CD1 4.18Å; I66-I69 PolarHBondContact O-N 3.09Å; I69-G76 CarbonylContact O-C 3.34Å; I69-G76 WeakPolarHBondContact O-CA 3.37Å; I69-R80 HydrophobicContact CG2-CB 4.42Å
70T98.5Very high98.6Very high34 Ų3463.5 Ų63.521%0.20932%0.318CS..Hα-helixtrans-72.8-34.4-175.2-50.90000112.1I66 A67 H68 W77 R80I66-T70 PolarHBondContact O-N 2.98Å; I66-T70 PolarHBondContact O-OG1 3.05Å; A67-T70 PolarHBondContact O-N 2.79Å; A67-T70 VanDerWaalsContact O-N 3.15Å; H68-T70 PolarHBondContact O-N 3.48Å; T70-W77 HydrophobicContact CG2-CB 3.96Å; T70-W77 WeakPolarHBondContact O-CB 3.32Å; T70-R80 WeakPolarHBondContact OG1-CD 3.48Å
71R98.6Very high98.7Very high206 Ų20660.2 Ų60.278%0.77729%0.29SS*.Hα-helixtrans-103-35.2-168.4-66178178.5-170-0.3114.2A67 H68A67-R71 WeakPolarHBondContact O-CB 3.35Å; A67-R71 WeakPolarHBondContact O-CG 3.28Å; A67-R71 PolarHBondContact O-N 2.88Å; H68-R71 PolarHBondContact O-N 2.67Å
72D98.7Very high98.7Very high109 Ų10959.3 Ų59.358%0.58328%0.283SS*.THydrogen-bonded Turntrans-114.9-27.3-165.4-52.1-42.1000112.6H68H68-D72 IonicContact CD2-OD2 3.3Å; H68-D72 PolarHBondContact CD2-OD2 3.11Å; H68-D72 VanDerWaalsContact CD2-OD2 3.3Å; H68-D72 IonicContact CG-OD2 3.89Å; H68-D72 WeakPolarHBondContact O-CB 3.48Å; H68-D72 PolarHBondContact O-N 2.86Å
73V98.8Very high98.7Very high27 Ų2760.8 Ų60.816%0.16429%0.29CS..SBendtrans-79.1129.5177.1179.50000110.2H54 H68 Y75 G76H54-V73 HydrophobicContact CB-CG2 4.35Å; H68-V73 PolarHBondContact O-N 2.89Å; V73-Y75 PolarHBondContact O-N 2.8Å; V73-Y75 VanDerWaalsContact O-N 3.14Å; V73-G76 PolarHBondContact O-N 3.14Å
74N98.6Very high98.7Very high145 Ų14560.6 Ų60.678%0.77530%0.299SS*.THydrogen-bonded Turntrans-54.3120175.8-69.1-40.5000111G76N74-G76 PolarHBondContact O-N 3.38Å; N74-G76 VanDerWaalsContact O-N 3.1Å
75Y98.6Very high98.7Very high174 Ų17457.7 Ų57.768%0.68228%0.278SS*.THydrogen-bonded Turntrans57.514.9-174.6-55.1-78.4000114.8V73 W77 I78 I79V73-Y75 PolarHBondContact O-N 2.8Å; V73-Y75 VanDerWaalsContact O-N 3.14Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 2.85Å; Y75-I78 HydrophobicContact CD1-CG2 4.32Å; Y75-I78 WeakPolarHBondContact O-CG2 3.3Å; Y75-I78 PolarHBondContact O-N 2.9Å; Y75-I79 WeakPolarHBondContact O-CG1 3.37Å; Y75-I79 PolarHBondContact O-N 3.48Å; Y75-I79 VanDerWaalsContact O-N 3.15Å
76G98.8Very high98.7Very high2 Ų257.2 Ų57.22%0.02128%0.275CS..Hα-helixtrans-65.4-32.9-179.300000112.9I69 V73 N74 I78 I79 R80I69-G76 CarbonylContact O-C 3.34Å; I69-G76 WeakPolarHBondContact O-CA 3.37Å; V73-G76 PolarHBondContact O-N 3.14Å; N74-G76 PolarHBondContact O-N 3.38Å; N74-G76 VanDerWaalsContact O-N 3.1Å; G76-I78 PolarHBondContact O-N 2.95Å; G76-I79 PolarHBondContact O-N 3.37Å; G76-R80 WeakPolarHBondContact O-CB 3.33Å; G76-R80 PolarHBondContact O-N 3.38Å
77W98.6Very high98.7Very high104 Ų10457 Ų5739%0.39428%0.277SS..Hα-helixtrans-58.2-47.1173.169.1-90.6000112.5T70 Y75 R80 Y81 L244T70-W77 HydrophobicContact CG2-CB 3.96Å; T70-W77 WeakPolarHBondContact O-CB 3.32Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 2.85Å; W77-R80 PolarHBondContact O-N 3.32Å; W77-Y81 HydrophobicContact CE3-CD2 4.06Å; W77-Y81 HydrophobicContact CE3-CE2 4.48Å; W77-Y81 WeakPolarHBondContact O-CD2 3.32Å; W77-Y81 PolarHBondContact O-N 3.25Å; W77-L244 HydrophobicContact CH2-CD2 3.9Å; W77-L244 HydrophobicContact CZ3-CD2 4.22Å
78I98.8Very high98.7Very high32 Ų3255.6 Ų55.616%0.16427%0.265CS..Hα-helixtrans-71.9-37.1-177.7-172.9169000110.7Y75 G76 R80 Y81 L82 M240 T243 L244Y75-I78 HydrophobicContact CD1-CG2 4.32Å; Y75-I78 WeakPolarHBondContact O-CG2 3.3Å; Y75-I78 PolarHBondContact O-N 2.9Å; G76-I78 PolarHBondContact O-N 2.95Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-Y81 PolarHBondContact O-N 3.04Å; I78-L82 HydrophobicContact CG1-CD1 4.08Å; I78-L82 HydrophobicContact CG1-CG 4.21Å; I78-L82 VanDerWaalsContact O-CB 3.28Å; I78-L82 WeakPolarHBondContact O-CB 3.48Å; I78-L82 VanDerWaalsContact O-CG 3.22Å; I78-L82 WeakPolarHBondContact O-CG 3.33Å; I78-L82 PolarHBondContact O-N 3.49Å; I78-M240 HydrophobicContact CD1-CE 4.25Å; I78-T243 HydrophobicContact CG1-CG2 4.27Å; I78-L244 HydrophobicContact CD1-CD2 3.98Å
79I98.8Very high98.7Very high40 Ų4052.8 Ų52.821%0.20525%0.253CS..Hα-helixtrans-62.3-44.2174-62.3169.7000110.2T47 F50 L51 Y75 G76 L82 H83T47-I79 HydrophobicContact CG2-CG2 4.3Å; F50-I79 HydrophobicContact CB-CD1 4.36Å; F50-I79 HydrophobicContact CB-CG2 4.2Å; L51-I79 HydrophobicContact CD2-CG2 3.96Å; L51-I79 HydrophobicContact CG-CG2 3.88Å; Y75-I79 WeakPolarHBondContact O-CG1 3.37Å; Y75-I79 PolarHBondContact O-N 3.48Å; Y75-I79 VanDerWaalsContact O-N 3.15Å; G76-I79 PolarHBondContact O-N 3.37Å; I79-L82 PolarHBondContact O-N 3.39Å; I79-H83 WeakPolarHBondContact O-CB 3.47Å; I79-H83 PolarHBondContact O-N 2.95Å
80R98.8Very high98.8Very high42 Ų4253.4 Ų53.416%0.15826%0.255CS..Hα-helixtrans-59.3-49.8176.3179-176.1175.1-1021.5111.4L51 I66 I69 T70 G76 W77 I78 H83 A84 Y256L51-R80 HydrophobicContact CD2-CB 4.1Å; I66-R80 VanDerWaalsContact CG2-NE 3.25Å; I69-R80 HydrophobicContact CG2-CB 4.42Å; T70-R80 WeakPolarHBondContact OG1-CD 3.48Å; G76-R80 WeakPolarHBondContact O-CB 3.33Å; G76-R80 PolarHBondContact O-N 3.38Å; W77-R80 PolarHBondContact O-N 3.32Å; I78-R80 VanDerWaalsContact C-N 3.35Å; R80-H83 WeakPolarHBondContact O-CB 3.29Å; R80-H83 PolarHBondContact O-N 2.92Å; R80-A84 PolarHBondContact O-N 3.46Å; R80-Y256 PolarHBondContact NH1-OH 3.34Å
81Y98.8Very high98.8Very high30 Ų3051.9 Ų51.912%0.11825%0.246CC..Hα-helixtrans-72.5-32-178.1-70.2-59.3000113.1W77 I78 H83 A84 N85 P247 Y256W77-Y81 HydrophobicContact CE3-CD2 4.06Å; W77-Y81 HydrophobicContact CE3-CE2 4.48Å; W77-Y81 WeakPolarHBondContact O-CD2 3.32Å; W77-Y81 PolarHBondContact O-N 3.25Å; I78-Y81 PolarHBondContact O-N 3.04Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-H83 PolarHBondContact O-N 3.38Å; Y81-A84 PolarHBondContact O-N 2.82Å; Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.4Å; Y81-N85 PolarHBondContact O-N 2.82Å; Y81-N85 PolarHBondContact O-ND2 3.27Å; Y81-P247 HydrophobicContact CD1-CB 3.56Å; Y81-P247 HydrophobicContact CD2-CB 4.02Å; Y81-P247 HydrophobicContact CE1-CB 3.75Å; Y81-P247 HydrophobicContact CE2-CB 4.19Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; Y81-Y256 PolarHBondContact OH-OH 3.41Å
82L98.9Very high98.8Very high28 Ų2844.9 Ų44.915%0.14722%0.223CC..Hα-helixtrans-61.3-40.7168.9-77.7172.5000111.2T47 I78 I79 G86 L239 M240 T243T47-L82 HydrophobicContact CG2-CB 4.08Å; I78-L82 HydrophobicContact CG1-CD1 4.08Å; I78-L82 HydrophobicContact CG1-CG 4.21Å; I78-L82 VanDerWaalsContact O-CB 3.28Å; I78-L82 WeakPolarHBondContact O-CB 3.48Å; I78-L82 VanDerWaalsContact O-CG 3.22Å; I78-L82 WeakPolarHBondContact O-CG 3.33Å; I78-L82 PolarHBondContact O-N 3.49Å; I79-L82 PolarHBondContact O-N 3.39Å; L82-G86 WeakPolarHBondContact O-CA 3.42Å; L82-G86 PolarHBondContact O-N 3.41Å; L82-L239 HydrophobicContact CD2-CD2 3.92Å; L82-L239 HydrophobicContact CD2-CG 4.03Å; L82-M240 HydrophobicContact CD2-SD 3.84Å; L82-T243 HydrophobicContact CD2-CG2 4.21Å; L82-T243 HydrophobicContact CG-CG2 4.19Å
83H98.9Very high98.8Very high32 Ų3239.8 Ų39.815%0.14820%0.196CC..Hα-helixtrans-68.3-44177.5-164.981000112.3Q44 T47 G48 L51 I79 R80 Y81 A87 H182Q44-H83 PolarHBondContact NE2-O 3.47Å; Q44-H83 PolarHBondContact O-CE1 3.08Å; Q44-H83 VanDerWaalsContact O-CE1 3.28Å; Q44-H83 PolarHBondContact O-ND1 3.33Å; Q44-H83 PolarHBondContact OE1-O 3.08Å; T47-H83 PolarHBondContact OG1-ND1 2.74Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.39Å; G48-H83 PolarHBondContact N-ND1 3.48Å; L51-H83 HydrophobicContact CD1-CB 3.5Å; I79-H83 WeakPolarHBondContact O-CB 3.47Å; I79-H83 PolarHBondContact O-N 2.95Å; R80-H83 WeakPolarHBondContact O-CB 3.29Å; R80-H83 PolarHBondContact O-N 2.92Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-H83 PolarHBondContact O-N 3.38Å; H83-A87 PolarHBondContact O-N 2.88Å; H83-A87 VanDerWaalsContact O-N 3.14Å; H83-H182 AromaticContact NE2-NE2 3.94Å
84A98.8Very high98.8Very high51 Ų5139.2 Ų39.242%0.42119%0.192SC..Hα-helixtrans-69.1-51.8-179.800000112.3R80 Y81 G86 A87 S88R80-A84 PolarHBondContact O-N 3.46Å; Y81-A84 PolarHBondContact O-N 2.82Å; A84-G86 VanDerWaalsContact C-N 3.34Å; A84-A87 WeakPolarHBondContact O-CB 3.48Å; A84-A87 PolarHBondContact O-N 3.48Å; A84-S88 PolarHBondContact O-N 3.37Å
85N98.9Very high98.8Very high5 Ų535.3 Ų35.33%0.02717%0.168CC..Hα-helixtrans-71.9-31.3178.1-70.9-52.1000111.9Y81 A87 S88 M89 L239 L242 P247Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.4Å; Y81-N85 PolarHBondContact O-N 2.82Å; Y81-N85 PolarHBondContact O-ND2 3.27Å; N85-A87 VanDerWaalsContact C-N 3.28Å; N85-A87 PolarHBondContact O-N 3.2Å; N85-S88 WeakPolarHBondContact O-CB 3.46Å; N85-S88 PolarHBondContact O-N 2.89Å; N85-S88 VanDerWaalsContact O-N 3.16Å; N85-M89 WeakPolarHBondContact O-CG 3.33Å; N85-M89 PolarHBondContact O-N 2.89Å; N85-L239 HydrophobicContact CB-CD1 3.91Å; N85-L242 HydrophobicContact CB-CD2 3.76Å; N85-L242 HydrophobicContact CB-CG 4.14Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.45Å; N85-P247 PolarHBondContact ND2-O 3.35Å; N85-P247 PolarHBondContact OD1-O 3.13Å
86G98.9Very high98.8Very high0 Ų029.9 Ų29.90%015%0.151CC..Hα-helixtrans-60.5-35.817200000112.7Q44 L82 A84 M89 F90Q44-G86 VanDerWaalsContact OE1-CA 3.32Å; L82-G86 WeakPolarHBondContact O-CA 3.42Å; L82-G86 PolarHBondContact O-N 3.41Å; A84-G86 VanDerWaalsContact C-N 3.34Å; G86-M89 PolarHBondContact O-N 2.81Å; G86-F90 WeakPolarHBondContact O-CB 3.38Å; G86-F90 PolarHBondContact O-N 3.42Å
87A98.8Very high98.8Very high21 Ų2131.5 Ų31.517%0.17416%0.158CC..Hα-helixtrans-63.1-43.7172.100000111.9H83 A84 N85 F90 F91H83-A87 PolarHBondContact O-N 2.88Å; H83-A87 VanDerWaalsContact O-N 3.14Å; A84-A87 WeakPolarHBondContact O-CB 3.48Å; A84-A87 PolarHBondContact O-N 3.48Å; N85-A87 VanDerWaalsContact C-N 3.28Å; N85-A87 PolarHBondContact O-N 3.2Å; A87-F90 VanDerWaalsContact O-CB 3.24Å; A87-F90 WeakPolarHBondContact O-CB 3.38Å; A87-F90 PolarHBondContact O-N 3.49Å; A87-F91 WeakPolarHBondContact O-CD2 3.37Å; A87-F91 PolarHBondContact O-N 3.38Å; A87-F91 VanDerWaalsContact O-N 3.17Å
88S98.8Very high98.8Very high4 Ų427.9 Ų27.93%0.02815%0.146CC..Hα-helixtrans-61.7-45.3173.9-740000111.9A84 N85 F90 F91 I92 L250 W272A84-S88 PolarHBondContact O-N 3.37Å; N85-S88 WeakPolarHBondContact O-CB 3.46Å; N85-S88 PolarHBondContact O-N 2.89Å; N85-S88 VanDerWaalsContact O-N 3.16Å; S88-F90 PolarHBondContact O-N 3.41Å; S88-F91 PolarHBondContact O-N 3.44Å; S88-F91 VanDerWaalsContact O-N 3.13Å; S88-I92 WeakPolarHBondContact O-CG1 3.48Å; S88-I92 PolarHBondContact O-N 3.36Å; S88-L250 VanDerWaalsContact CB-CD1 3.5Å; S88-W272 WeakPolarHBondContact O-CZ2 3.45Å; S88-W272 PolarHBondContact OG-NE1 2.96Å
89M98.8Very high98.8Very high20 Ų2026.9 Ų26.910%0.09914%0.143CC..Hα-helixtrans-62.7-32.7176.2-67.1-58.4-64.300112.3N85 G86 I92 C93 F235 S238 L239N85-M89 WeakPolarHBondContact O-CG 3.33Å; N85-M89 PolarHBondContact O-N 2.89Å; G86-M89 PolarHBondContact O-N 2.81Å; M89-I92 PolarHBondContact O-N 3.49Å; M89-I92 HydrophobicContact SD-CD1 3.9Å; M89-C93 WeakPolarHBondContact O-CB 3.36Å; M89-C93 PolarHBondContact O-N 2.89Å; M89-C93 PolarHBondContact O-SG 3.44Å; M89-C93 VanDerWaalsContact O-SG 3.34Å; M89-F235 HydrophobicContact CB-CE2 3.71Å; M89-F235 HydrophobicContact CB-CZ 4.09Å; M89-F235 HydrophobicContact CE-CD2 3.9Å; M89-F235 HydrophobicContact CE-CE2 3.96Å; M89-F235 HydrophobicContact CG-CE2 4.42Å; M89-S238 WeakPolarHBondContact CE-OG 3Å; M89-L239 HydrophobicContact CG-CB 4.38Å; M89-L239 HydrophobicContact CG-CD1 3.93Å
90F98.9Very high98.9Very high15 Ų1526.1 Ų26.17%0.06614%0.138CC..Hα-helixtrans-59.4-47.4172.4-158109000111L37 C40 L41 Q44 G86 A87 S88 C93 L94 T123L37-F90 HydrophobicContact CD2-CD2 4.05Å; L37-F90 HydrophobicContact CD2-CE2 3.87Å; L37-F90 HydrophobicContact CD2-CZ 4.23Å; C40-F90 HydrophobicContact CB-CB 4.15Å; C40-F90 HydrophobicContact CB-CD1 3.16Å; C40-F90 HydrophobicContact CB-CE1 3.7Å; C40-F90 HydrophobicContact CB-CG 3.9Å; L41-F90 HydrophobicContact CB-CE1 3.93Å; L41-F90 HydrophobicContact CD1-CE1 4.45Å; Q44-F90 HydrophobicContact CG-CD1 4.28Å; G86-F90 WeakPolarHBondContact O-CB 3.38Å; G86-F90 PolarHBondContact O-N 3.42Å; A87-F90 VanDerWaalsContact O-CB 3.24Å; A87-F90 WeakPolarHBondContact O-CB 3.38Å; A87-F90 PolarHBondContact O-N 3.49Å; S88-F90 PolarHBondContact O-N 3.41Å; F90-C93 PolarHBondContact O-N 3.18Å; F90-L94 HydrophobicContact CD2-CD1 3.66Å; F90-L94 HydrophobicContact CD2-CG 3.85Å; F90-L94 HydrophobicContact CE2-CD1 3.72Å; F90-L94 HydrophobicContact CE2-CD2 4.24Å; F90-L94 HydrophobicContact CE2-CG 3.85Å; F90-L94 WeakPolarHBondContact O-CG 3.3Å; F90-L94 PolarHBondContact O-N 3Å; F90-T123 HydrophobicContact CD2-CG2 3.55Å; F90-T123 HydrophobicContact CE2-CG2 3.45Å; F90-T123 VanDerWaalsContact CE2-CG2 3.45Å; F90-T123 HydrophobicContact CG-CG2 4.5Å; F90-T123 HydrophobicContact CZ-CG2 4.36Å
91F98.9Very high98.9Very high2 Ų224.3 Ų24.31%0.00913%0.132CC..Hα-helixtrans-69.7-36.9178.1-82.4-81.1000113.6A87 S88 C93 L94 F95 T123 M124 A127 W272 Y273A87-F91 WeakPolarHBondContact O-CD2 3.37Å; A87-F91 PolarHBondContact O-N 3.38Å; A87-F91 VanDerWaalsContact O-N 3.17Å; S88-F91 PolarHBondContact O-N 3.44Å; S88-F91 VanDerWaalsContact O-N 3.13Å; F91-C93 VanDerWaalsContact C-N 3.34Å; F91-C93 PolarHBondContact O-N 2.83Å; F91-L94 HydrophobicContact CD1-CD1 4.09Å; F91-L94 HydrophobicContact CE1-CD1 4.18Å; F91-L94 PolarHBondContact O-N 3.19Å; F91-F95 HydrophobicContact CB-CD2 4.46Å; F91-F95 HydrophobicContact CB-CE2 4.01Å; F91-F95 HydrophobicContact CB-CZ 4.42Å; F91-F95 HydrophobicContact CD1-CE1 4.29Å; F91-F95 HydrophobicContact CD1-CE2 4.25Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.27Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.48Å; F91-F95 PolarHBondContact O-N 3.12Å; F91-T123 HydrophobicContact CE1-CG2 4.49Å; F91-T123 HydrophobicContact CE2-CG2 4.16Å; F91-T123 HydrophobicContact CZ-CG2 3.91Å; F91-M124 HydrophobicContact CE1-CG 3.81Å; F91-M124 HydrophobicContact CZ-CG 4.15Å; F91-A127 HydrophobicContact CE2-CB 3.49Å; F91-A127 VanDerWaalsContact CE2-CB 3.49Å; F91-A127 HydrophobicContact CZ-CB 3.87Å; F91-W272 HydrophobicContact CB-CH2 4.12Å; F91-W272 HydrophobicContact CB-CZ2 4.14Å; F91-Y273 HydrophobicContact CB-CD1 4.26Å; F91-Y273 HydrophobicContact CB-CG 3.98Å; F91-Y273 AromaticContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.78Å; F91-Y273 HydrophobicContact CD2-CD1 3.78Å; F91-Y273 AromaticContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CE1 4.09Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CG 4.42Å; F91-Y273 HydrophobicContact CE2-CD1 4.42Å; F91-Y273 AromaticContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CD2 3.47Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CE1 4.45Å; F91-Y273 AromaticContact CE2-CE2 3.43Å; F91-Y273 HydrophobicContact CE2-CE2 3.43Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.43Å; F91-Y273 AromaticContact CE2-CG 3.98Å; F91-Y273 HydrophobicContact CE2-CG 3.98Å; F91-Y273 AromaticContact CE2-CZ 3.99Å; F91-Y273 HydrophobicContact CG-CD1 4.09Å; F91-Y273 AromaticContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CE2 4.5Å; F91-Y273 AromaticContact CG-CG 3.54Å; F91-Y273 HydrophobicContact CG-CG 3.54Å; F91-Y273 AromaticContact CZ-CD2 3.66Å; F91-Y273 HydrophobicContact CZ-CD2 3.66Å; F91-Y273 AromaticContact CZ-CE2 3.86Å; F91-Y273 HydrophobicContact CZ-CE2 3.86Å; F91-Y273 HydrophobicContact CZ-CG 4.41Å
92I98.9Very high98.9Very high59 Ų5924.1 Ų24.130%0.30313%0.133SC..Hα-helixtrans-57.5-50.7171.6-67.3168.8000109.6S88 M89 L94 F95 L96 W272S88-I92 WeakPolarHBondContact O-CG1 3.48Å; S88-I92 PolarHBondContact O-N 3.36Å; M89-I92 PolarHBondContact O-N 3.49Å; M89-I92 HydrophobicContact SD-CD1 3.9Å; I92-L94 VanDerWaalsContact C-N 3.33Å; I92-L94 PolarHBondContact O-N 3.45Å; I92-F95 PolarHBondContact O-N 2.88Å; I92-L96 HydrophobicContact CG2-CD1 3.8Å; I92-L96 VanDerWaalsContact O-CG 3.25Å; I92-L96 WeakPolarHBondContact O-CG 3.46Å; I92-L96 PolarHBondContact O-N 3.23Å; I92-W272 HydrophobicContact CD1-CZ2 4.29Å; I92-W272 HydrophobicContact CG1-CH2 3.57Å; I92-W272 HydrophobicContact CG1-CZ2 3.72Å
93C98.9Very high98.9Very high2 Ų224.4 Ų24.41%0.01413%0.132CC..Hα-helixtrans-60.4-40.9176.6-72.50000112.2F33 L37 M89 F90 F91 H97F33-C93 HydrophobicContact CD1-CB 4.15Å; L37-C93 HydrophobicContact CD2-CB 3.66Å; L37-C93 HydrophobicContact CG-CB 3.98Å; M89-C93 WeakPolarHBondContact O-CB 3.36Å; M89-C93 PolarHBondContact O-N 2.89Å; M89-C93 PolarHBondContact O-SG 3.44Å; M89-C93 VanDerWaalsContact O-SG 3.34Å; F90-C93 PolarHBondContact O-N 3.18Å; F91-C93 VanDerWaalsContact C-N 3.34Å; F91-C93 PolarHBondContact O-N 2.83Å; C93-H97 WeakPolarHBondContact O-CB 3.48Å; C93-H97 PolarHBondContact O-N 3.03Å
94L98.8Very high98.9Very high15 Ų1524 Ų248%0.07913%0.13CC..Hα-helixtrans-62.1-50.7178-84.9176.7000111.5L37 F90 F91 I92 L96 H97 I98 L120 T123L37-L94 HydrophobicContact CD1-CD2 3.93Å; L37-L94 HydrophobicContact CD2-CB 4.32Å; L37-L94 HydrophobicContact CD2-CD2 3.75Å; L37-L94 HydrophobicContact CD2-CG 3.62Å; F90-L94 HydrophobicContact CD2-CD1 3.66Å; F90-L94 HydrophobicContact CD2-CG 3.85Å; F90-L94 HydrophobicContact CE2-CD1 3.72Å; F90-L94 HydrophobicContact CE2-CD2 4.24Å; F90-L94 HydrophobicContact CE2-CG 3.85Å; F90-L94 WeakPolarHBondContact O-CG 3.3Å; F90-L94 PolarHBondContact O-N 3Å; F91-L94 HydrophobicContact CD1-CD1 4.09Å; F91-L94 HydrophobicContact CE1-CD1 4.18Å; F91-L94 PolarHBondContact O-N 3.19Å; I92-L94 VanDerWaalsContact C-N 3.33Å; I92-L94 PolarHBondContact O-N 3.45Å; L94-L96 VanDerWaalsContact C-N 3.33Å; L94-L96 PolarHBondContact O-N 2.91Å; L94-H97 WeakPolarHBondContact O-CB 3.49Å; L94-H97 PolarHBondContact O-N 3.02Å; L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.41Å; L94-I98 PolarHBondContact O-N 3.43Å; L94-L120 HydrophobicContact CD1-CD1 4.17Å; L94-T123 HydrophobicContact CD1-CG2 3.77Å
95F98.9Very high98.8Very high63 Ų6321.6 Ų21.628%0.27611%0.11SC..Hα-helixtrans-64.3-39-178.1-62.8-37.9000111.8F91 I92 G99 W272 Y273 F276F91-F95 HydrophobicContact CB-CD2 4.46Å; F91-F95 HydrophobicContact CB-CE2 4.01Å; F91-F95 HydrophobicContact CB-CZ 4.42Å; F91-F95 HydrophobicContact CD1-CE1 4.29Å; F91-F95 HydrophobicContact CD1-CE2 4.25Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.27Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.48Å; F91-F95 PolarHBondContact O-N 3.12Å; I92-F95 PolarHBondContact O-N 2.88Å; F95-G99 PolarHBondContact O-N 3.13Å; F95-W272 HydrophobicContact CD2-CH2 4.16Å; F95-W272 HydrophobicContact CD2-CZ3 4.13Å; F95-W272 AromaticContact CE2-CH2 3.99Å; F95-W272 HydrophobicContact CE2-CH2 3.99Å; F95-W272 AromaticContact CE2-CZ3 3.8Å; F95-W272 HydrophobicContact CE2-CZ3 3.8Å; F95-Y273 WeakPolarHBondContact CZ-O 3.42Å; F95-F276 HydrophobicContact CE1-CE1 4.43Å; F95-F276 HydrophobicContact CZ-CE1 4.31Å
96L98.9Very high98.8Very high61 Ų6122.3 Ų22.332%0.31912%0.115SC..Hα-helixtrans-69-36.2174.8-62171.2000111.7W30 F33 I92 L94 G99 R100W30-L96 HydrophobicContact CZ3-CB 4.46Å; W30-L96 HydrophobicContact CZ3-CD2 4.03Å; F33-L96 HydrophobicContact CD1-CB 4.07Å; F33-L96 HydrophobicContact CD1-CD1 4.36Å; F33-L96 HydrophobicContact CD2-CB 3.92Å; F33-L96 HydrophobicContact CE1-CB 3.93Å; F33-L96 HydrophobicContact CE1-CD1 3.47Å; F33-L96 VanDerWaalsContact CE1-CD1 3.47Å; F33-L96 HydrophobicContact CE1-CG 4.34Å; F33-L96 HydrophobicContact CE2-CB 3.78Å; F33-L96 HydrophobicContact CE2-CD1 4.13Å; F33-L96 HydrophobicContact CG-CB 4.09Å; F33-L96 HydrophobicContact CZ-CB 3.79Å; F33-L96 HydrophobicContact CZ-CD1 3.34Å; F33-L96 HydrophobicContact CZ-CG 4.16Å; I92-L96 HydrophobicContact CG2-CD1 3.8Å; I92-L96 VanDerWaalsContact O-CG 3.25Å; I92-L96 WeakPolarHBondContact O-CG 3.46Å; I92-L96 PolarHBondContact O-N 3.23Å; L94-L96 VanDerWaalsContact C-N 3.33Å; L94-L96 PolarHBondContact O-N 2.91Å; L96-G99 PolarHBondContact O-N 2.99Å; L96-R100 WeakPolarHBondContact O-CB 3.44Å; L96-R100 PolarHBondContact O-N 3.13Å
97H98.9Very high98.8Very high35 Ų3522.7 Ų22.716%0.16212%0.117CC..Hα-helixtrans-64.8-44.5175-168.9101.8000112.3F33 G34 L37 C93 L94 R100 G101F33-H97 HydrophobicContact CB-CB 3.93Å; G34-H97 PolarHBondContact N-ND1 2.86Å; L37-H97 HydrophobicContact CD1-CB 3.81Å; C93-H97 WeakPolarHBondContact O-CB 3.48Å; C93-H97 PolarHBondContact O-N 3.03Å; L94-H97 WeakPolarHBondContact O-CB 3.49Å; L94-H97 PolarHBondContact O-N 3.02Å; H97-R100 PolarHBondContact CE1-NH2 2.86Å; H97-R100 PolarHBondContact ND1-NH2 3.34Å; H97-R100 PolarHBondContact NE2-NH2 3.2Å; H97-G101 PolarHBondContact O-N 2.83Å; H97-G101 VanDerWaalsContact O-N 3.08Å
98I98.9Very high98.8Very high29 Ų2924.9 Ų24.915%0.14913%0.125CC..Hα-helixtrans-65.1-47174.9-66.7163.4000109.7L94 R100 G101 L102 W113 L120 L301L94-I98 VanDerWaalsContact O-CG1 3.29Å; L94-I98 WeakPolarHBondContact O-CG1 3.41Å; L94-I98 PolarHBondContact O-N 3.43Å; I98-R100 VanDerWaalsContact C-N 3.31Å; I98-R100 PolarHBondContact O-N 3.16Å; I98-G101 CarbonylContact O-C 3.51Å; I98-G101 WeakPolarHBondContact O-CA 3.24Å; I98-G101 PolarHBondContact O-N 3.16Å; I98-L102 HydrophobicContact CG2-CD1 4.19Å; I98-L102 HydrophobicContact CG2-CG 4.39Å; I98-L102 WeakPolarHBondContact O-CG 3.3Å; I98-L102 PolarHBondContact O-N 3.13Å; I98-W113 HydrophobicContact CG2-CH2 4.16Å; I98-L120 HydrophobicContact CD1-CD1 4.09Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.43Å; I98-L301 HydrophobicContact CG2-CD1 4.37Å; I98-L301 HydrophobicContact CG2-CD2 4.15Å
99G98.9Very high98.7Very high10 Ų1027.1 Ų27.110%0.10313%0.133CC..Hα-helixtrans-56.9-42.8177.500000112.5F95 L96 G101 L102 Y103 Y325F95-G99 PolarHBondContact O-N 3.13Å; L96-G99 PolarHBondContact O-N 2.99Å; G99-G101 VanDerWaalsContact C-N 3.33Å; G99-G101 PolarHBondContact O-N 3.14Å; G99-L102 PolarHBondContact O-N 3.19Å; G99-Y103 WeakPolarHBondContact O-CB 3.18Å; G99-Y103 PolarHBondContact O-N 2.96Å; G99-Y325 WeakPolarHBondContact CA-OH 3.39Å; G99-Y325 WeakPolarHBondContact O-CE2 3.33Å; G99-Y325 PolarHBondContact O-OH 3.42Å; G99-Y325 VanDerWaalsContact O-OH 3.13Å
100R98.9Very high98.7Very high24 Ų2428.4 Ų28.49%0.09115%0.145CC..Hα-helixtrans-57.6-47170.2177.5-76.6-66-95.9-6.3110.8W30 W31 L96 H97 I98 L102 Y103 Y104W30-R100 HydrophobicContact CB-CB 4.1Å; W30-R100 HydrophobicContact CB-CG 3.54Å; W31-R100 VanDerWaalsContact CE2-NH1 3.28Å; W31-R100 HydrophobicContact CE3-CG 4.34Å; W31-R100 HydrophobicContact CZ3-CG 4.25Å; L96-R100 WeakPolarHBondContact O-CB 3.44Å; L96-R100 PolarHBondContact O-N 3.13Å; H97-R100 PolarHBondContact CE1-NH2 2.86Å; H97-R100 PolarHBondContact ND1-NH2 3.34Å; H97-R100 PolarHBondContact NE2-NH2 3.2Å; I98-R100 VanDerWaalsContact C-N 3.31Å; I98-R100 PolarHBondContact O-N 3.16Å; R100-L102 VanDerWaalsContact C-N 3.32Å; R100-L102 PolarHBondContact O-N 3.39Å; R100-Y103 PolarHBondContact O-N 3.23Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.39Å; R100-Y104 PolarHBondContact O-N 3.38Å
101G98.8Very high98.6Very high4 Ų432.5 Ų32.54%0.04116%0.164CC..Hα-helixtrans-60.5-40.7-179.700000113.1H97 I98 G99 G105 S106 F107H97-G101 PolarHBondContact O-N 2.83Å; H97-G101 VanDerWaalsContact O-N 3.08Å; I98-G101 CarbonylContact O-C 3.51Å; I98-G101 WeakPolarHBondContact O-CA 3.24Å; I98-G101 PolarHBondContact O-N 3.16Å; G99-G101 VanDerWaalsContact C-N 3.33Å; G99-G101 PolarHBondContact O-N 3.14Å; G101-G105 CarbonylContact O-C 3.51Å; G101-G105 PolarHBondContact O-N 3.4Å; G101-S106 PolarHBondContact O-N 3.38Å; G101-F107 WeakPolarHBondContact O-CD1 3.41Å
102L98.8Very high98.6Very high26 Ų2633 Ų3314%0.13617%0.167CC..Hα-helixtrans-65.9-49.4174.3-66175000111.9I98 G99 R100 G105 F107 W113 L301 I304 Y325I98-L102 HydrophobicContact CG2-CD1 4.19Å; I98-L102 HydrophobicContact CG2-CG 4.39Å; I98-L102 WeakPolarHBondContact O-CG 3.3Å; I98-L102 PolarHBondContact O-N 3.13Å; G99-L102 PolarHBondContact O-N 3.19Å; R100-L102 VanDerWaalsContact C-N 3.32Å; R100-L102 PolarHBondContact O-N 3.39Å; L102-G105 PolarHBondContact O-N 2.96Å; L102-F107 HydrophobicContact CD2-CD1 4.28Å; L102-W113 HydrophobicContact CD2-CH2 3.78Å; L102-W113 HydrophobicContact CD2-CZ2 4.01Å; L102-W113 HydrophobicContact CG-CH2 4.11Å; L102-L301 HydrophobicContact CD2-CD2 4.4Å; L102-I304 HydrophobicContact CD2-CB 4.46Å; L102-I304 HydrophobicContact CD2-CD1 4.21Å; L102-I304 HydrophobicContact CD2-CG1 4Å; L102-I304 HydrophobicContact CD2-CG2 3.86Å; L102-Y325 HydrophobicContact CB-CE2 4.19Å
103Y98.9Very high98.6Very high34 Ų3431.4 Ų31.413%0.13316%0.157CC..Hα-helixtrans-66.2-42.3-175.1-171-90.2000112.9G99 R100 M315 Q322 Y325G99-Y103 WeakPolarHBondContact O-CB 3.18Å; G99-Y103 PolarHBondContact O-N 2.96Å; R100-Y103 PolarHBondContact O-N 3.23Å; Y103-M315 HydrophobicContact CD2-CB 4.28Å; Y103-M315 HydrophobicContact CD2-SD 4.32Å; Y103-M315 HydrophobicContact CE1-CB 4.45Å; Y103-M315 HydrophobicContact CE2-CB 4.21Å; Y103-M315 HydrophobicContact CG-CB 4.47Å; Y103-M315 VanDerWaalsContact O-CB 3.27Å; Y103-M315 WeakPolarHBondContact O-CB 3.43Å; Y103-M315 VanDerWaalsContact O-CG 3.31Å; Y103-M315 WeakPolarHBondContact O-CG 3.03Å; Y103-M315 PolarHBondContact O-N 3.19Å; Y103-Q322 HydrophobicContact CE2-CB 4.49Å; Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 VanDerWaalsContact OH-CD 3.24Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.24Å; Y103-Q322 PolarHBondContact OH-OE1 3.12Å; Y103-Y325 AromaticContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD2 4.04Å; Y103-Y325 AromaticContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE2 4.23Å; Y103-Y325 AromaticContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CE2-CD1 4.06Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å; Y103-Y325 HydrophobicContact CG-CE1 4.49Å
104Y98.8Very high98.6Very high24 Ų2434.7 Ų34.79%0.09418%0.175CC..THydrogen-bonded Turntrans-94.24.1-176.9-64-68.9000113.8W30 W31 R100 S106 N206 P208 S314W30-Y104 HydrophobicContact CB-CE2 4.23Å; W30-Y104 AromaticContact CD1-CE2 3.84Å; W30-Y104 HydrophobicContact CG-CE2 4.18Å; W31-Y104 HydrophobicContact CH2-CD1 4.17Å; W31-Y104 AromaticContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CE2 4.02Å; W31-Y104 AromaticContact CH2-CG 3.62Å; W31-Y104 HydrophobicContact CH2-CG 3.62Å; W31-Y104 AromaticContact CZ3-CD2 3.62Å; W31-Y104 HydrophobicContact CZ3-CD2 3.62Å; W31-Y104 AromaticContact CZ3-CE2 3.6Å; W31-Y104 HydrophobicContact CZ3-CE2 3.6Å; W31-Y104 HydrophobicContact CZ3-CG 4.09Å; R100-Y104 HydrophobicContact CG-CD2 3.76Å; R100-Y104 HydrophobicContact CG-CE2 4.12Å; R100-Y104 WeakPolarHBondContact O-CD2 3.39Å; R100-Y104 PolarHBondContact O-N 3.38Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 2.76Å; Y104-N206 PolarHBondContact O-ND2 3.19Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.2Å; Y104-P208 WeakPolarHBondContact CD1-O 3.4Å; Y104-P208 VanDerWaalsContact CE1-CA 3.48Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.33Å
105G98.6Very high98.6Very high0 Ų035 Ų350%018%0.176CC..THydrogen-bonded Turntrans67.429.4179.200000113.7G101 L102 F107 L108 Q313G101-G105 CarbonylContact O-C 3.51Å; G101-G105 PolarHBondContact O-N 3.4Å; L102-G105 PolarHBondContact O-N 2.96Å; G105-F107 PolarHBondContact O-N 3.06Å; G105-L108 WeakPolarHBondContact O-CG 3.42Å; G105-L108 PolarHBondContact O-N 3.47Å; G105-Q313 PolarHBondContact O-NE2 2.94Å
106S98.6Very high98.6Very high20 Ų2033.1 Ų33.114%0.1418%0.175CC..G310 helixtrans-73.1-14.2178.3-54.40000112.8G101 Y104 L108 Y109 N206G101-S106 PolarHBondContact O-N 3.38Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 2.76Å; S106-L108 PolarHBondContact O-N 3.46Å; S106-L108 VanDerWaalsContact O-N 3.16Å; S106-Y109 PolarHBondContact O-N 3.37Å; S106-Y109 VanDerWaalsContact O-N 3.13Å; S106-N206 PolarHBondContact OG-ND2 3.4Å
107F98.5Very high98.6Very high9 Ų930.8 Ų30.84%0.03916%0.163CC..G310 helixtrans-62.5-14.5172.557-107.1000113.5G101 L102 G105 Y109 W113 I304 P305 H308G101-F107 WeakPolarHBondContact O-CD1 3.41Å; L102-F107 HydrophobicContact CD2-CD1 4.28Å; G105-F107 PolarHBondContact O-N 3.06Å; F107-Y109 PolarHBondContact O-N 3.04Å; F107-W113 HydrophobicContact CB-CB 4.42Å; F107-W113 HydrophobicContact CB-CD2 3.31Å; F107-W113 VanDerWaalsContact CB-CE2 3.49Å; F107-W113 HydrophobicContact CB-CE3 3.58Å; F107-W113 HydrophobicContact CB-CG 3.71Å; F107-W113 HydrophobicContact CB-CH2 4.14Å; F107-W113 HydrophobicContact CB-CZ2 3.91Å; F107-W113 HydrophobicContact CB-CZ3 3.99Å; F107-I304 HydrophobicContact CB-CG2 4.32Å; F107-I304 HydrophobicContact CD1-CG2 3.46Å; F107-I304 VanDerWaalsContact CD1-CG2 3.46Å; F107-I304 HydrophobicContact CD2-CG2 3.8Å; F107-I304 HydrophobicContact CE1-CG2 3.55Å; F107-I304 HydrophobicContact CE2-CG2 3.92Å; F107-I304 HydrophobicContact CG-CG2 3.58Å; F107-I304 HydrophobicContact CZ-CG2 3.79Å; F107-P305 HydrophobicContact CB-CG 4.3Å; F107-P305 HydrophobicContact CD2-CB 4.28Å; F107-P305 HydrophobicContact CD2-CG 4.19Å; F107-P305 WeakPolarHBondContact O-CG 3.42Å; F107-H308 HydrophobicContact CE2-CB 3.82Å; F107-H308 AromaticContact CE2-CG 3.94Å; F107-H308 AromaticContact CE2-ND1 3.82Å; F107-H308 HydrophobicContact CZ-CB 4.31Å; F107-H308 AromaticContact CZ-ND1 3.6Å
108L98.3Very high98.6Very high67 Ų6733 Ų3335%0.35118%0.175SC..G310 helixtrans-66.3-18.6173.2-65.6-177.8000112.7G105 S106 S110 H308 Q313G105-L108 WeakPolarHBondContact O-CG 3.42Å; G105-L108 PolarHBondContact O-N 3.47Å; S106-L108 PolarHBondContact O-N 3.46Å; S106-L108 VanDerWaalsContact O-N 3.16Å; L108-S110 VanDerWaalsContact C-N 3.29Å; L108-S110 PolarHBondContact O-N 2.84Å; L108-S110 VanDerWaalsContact O-N 3.07Å; L108-H308 HydrophobicContact CD2-CB 4.28Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å
109Y98.1Very high98.6Very high50 Ų5032.6 Ų32.620%0.19617%0.173CC..SBendtrans-80.282.8166.1-55.1-39000109S106 F107 E111 T112 W113 T203 N206S106-Y109 PolarHBondContact O-N 3.37Å; S106-Y109 VanDerWaalsContact O-N 3.13Å; F107-Y109 PolarHBondContact O-N 3.04Å; Y109-E111 VanDerWaalsContact C-N 3.34Å; Y109-E111 PolarHBondContact O-N 2.87Å; Y109-T112 PolarHBondContact O-N 3.04Å; Y109-W113 WeakPolarHBondContact O-CB 3.44Å; Y109-W113 PolarHBondContact O-N 3.07Å; Y109-T203 HydrophobicContact CD1-CG2 4.1Å; Y109-T203 HydrophobicContact CE1-CG2 4.38Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å
110S96.8Very high98.6Very high48 Ų4832.6 Ų32.634%0.33617%0.17SC..Hα-helixtrans-59.1-40.9-162.474.50000113.9L108 W113 N114L108-S110 VanDerWaalsContact C-N 3.29Å; L108-S110 PolarHBondContact O-N 2.84Å; L108-S110 VanDerWaalsContact O-N 3.07Å; S110-W113 PolarHBondContact O-N 3.28Å; S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.43Å; S110-N114 PolarHBondContact O-N 3.28Å; S110-N114 PolarHBondContact O-ND2 3.32Å
111E98.1Very high98.6Very high100 Ų10034.6 Ų34.647%0.46718%0.183SC..Hα-helixtrans-68.6-51.1-179-6482.3168.600109.9Y109 W113 N114 I115 F199Y109-E111 VanDerWaalsContact C-N 3.34Å; Y109-E111 PolarHBondContact O-N 2.87Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 2.9Å; E111-N114 PolarHBondContact O-N 2.86Å; E111-I115 WeakPolarHBondContact O-CG1 3.31Å; E111-I115 PolarHBondContact O-N 3.18Å; E111-F199 HydrophobicContact CB-CB 4.08Å; E111-F199 HydrophobicContact CB-CD1 3.62Å; E111-F199 HydrophobicContact CB-CD2 4Å; E111-F199 HydrophobicContact CB-CE1 3.97Å; E111-F199 HydrophobicContact CB-CE2 4.31Å; E111-F199 HydrophobicContact CB-CG 3.64Å; E111-F199 HydrophobicContact CB-CZ 4.3Å; E111-F199 HydrophobicContact CG-CD1 4.06Å; E111-F199 HydrophobicContact CG-CE1 4.04Å
112T98.6Very high98.6Very high14 Ų1435.1 Ų35.19%0.08619%0.186CC..Hα-helixtrans-57.1-45.4174.7-54.90000110.8Y109 G116 H196 L200Y109-T112 PolarHBondContact O-N 3.04Å; T112-G116 PolarHBondContact O-N 2.95Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.32Å; T112-H196 PolarHBondContact O-CE1 2.85Å; T112-H196 PolarHBondContact O-ND1 3.06Å; T112-L200 HydrophobicContact CG2-CB 4.19Å; T112-L200 HydrophobicContact CG2-CD1 4.5Å; T112-L200 PolarHBondContact OG1-N 2.86Å
113W98.8Very high98.6Very high25 Ų2534.4 Ų34.410%0.09518%0.183CC..Hα-helixtrans-63.3-48.4179.4-176.3-107.7000112.7I98 L102 F107 Y109 S110 E111 G116 I117 L301I98-W113 HydrophobicContact CG2-CH2 4.16Å; L102-W113 HydrophobicContact CD2-CH2 3.78Å; L102-W113 HydrophobicContact CD2-CZ2 4.01Å; L102-W113 HydrophobicContact CG-CH2 4.11Å; F107-W113 HydrophobicContact CB-CB 4.42Å; F107-W113 HydrophobicContact CB-CD2 3.31Å; F107-W113 VanDerWaalsContact CB-CE2 3.49Å; F107-W113 HydrophobicContact CB-CE3 3.58Å; F107-W113 HydrophobicContact CB-CG 3.71Å; F107-W113 HydrophobicContact CB-CH2 4.14Å; F107-W113 HydrophobicContact CB-CZ2 3.91Å; F107-W113 HydrophobicContact CB-CZ3 3.99Å; Y109-W113 WeakPolarHBondContact O-CB 3.44Å; Y109-W113 PolarHBondContact O-N 3.07Å; S110-W113 PolarHBondContact O-N 3.28Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 2.9Å; W113-G116 CarbonylContact O-C 3.5Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.42Å; W113-G116 PolarHBondContact O-N 3.16Å; W113-I117 PolarHBondContact O-N 3.41Å; W113-L301 HydrophobicContact CH2-CD2 4.4Å; W113-L301 HydrophobicContact CZ2-CB 4.14Å; W113-L301 HydrophobicContact CZ2-CD2 4Å; W113-L301 PolarHBondContact NE1-O 3.15Å
114N98.6Very high98.6Very high70 Ų7033.6 Ų33.637%0.37418%0.18SC..Hα-helixtrans-66.3-40.4-179.1-71.9-31.3000111.9S110 E111 G116 I117 I118S110-N114 VanDerWaalsContact O-CB 3.27Å; S110-N114 WeakPolarHBondContact O-CB 3.43Å; S110-N114 PolarHBondContact O-N 3.28Å; S110-N114 PolarHBondContact O-ND2 3.32Å; E111-N114 PolarHBondContact O-N 2.86Å; N114-G116 PolarHBondContact O-N 2.89Å; N114-I117 PolarHBondContact O-N 3.26Å; N114-I118 WeakPolarHBondContact O-CG1 3.34Å; N114-I118 PolarHBondContact O-N 3.32Å; N114-I118 VanDerWaalsContact O-N 3.09Å
115I98.8Very high98.6Very high21 Ų2134.4 Ų34.411%0.10819%0.192CC..Hα-helixtrans-62.4-35.9169.7-62.8-57.7000110.7E111 I117 I118 L119 L195 H196 F199E111-I115 WeakPolarHBondContact O-CG1 3.31Å; E111-I115 PolarHBondContact O-N 3.18Å; I115-I117 VanDerWaalsContact C-N 3.33Å; I115-I117 PolarHBondContact O-N 2.67Å; I115-I118 HydrophobicContact CD1-CD1 4.18Å; I115-I118 PolarHBondContact O-N 3.36Å; I115-L119 HydrophobicContact CG2-CD1 4.2Å; I115-L119 HydrophobicContact CG2-CG 4.43Å; I115-L119 WeakPolarHBondContact O-CB 3.34Å; I115-L119 WeakPolarHBondContact O-CG 3.5Å; I115-L119 PolarHBondContact O-N 2.94Å; I115-L195 HydrophobicContact CD1-CD2 3.76Å; I115-L195 HydrophobicContact CD1-CG 4.37Å; I115-L195 HydrophobicContact CG1-CD2 4.33Å; I115-L195 HydrophobicContact CG1-CG 4.4Å; I115-H196 HydrophobicContact CB-CB 4.48Å; I115-H196 HydrophobicContact CG2-CB 3.69Å; I115-F199 HydrophobicContact CG1-CD2 4.02Å; I115-F199 HydrophobicContact CG1-CE2 4.08Å
116G98.8Very high98.6Very high24 Ų2435 Ų3525%0.24720%0.196CC..Hα-helixtrans-59.2-39.3172.800000113.5T112 W113 N114 L119 L120T112-G116 PolarHBondContact O-N 2.95Å; W113-G116 CarbonylContact O-C 3.5Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.42Å; W113-G116 PolarHBondContact O-N 3.16Å; N114-G116 PolarHBondContact O-N 2.89Å; G116-L119 WeakPolarHBondContact O-CB 3.27Å; G116-L119 PolarHBondContact O-N 3.16Å; G116-L120 PolarHBondContact O-N 2.75Å
117I98.8Very high98.6Very high13 Ų1334.7 Ų34.77%0.06720%0.195CC..Hα-helixtrans-66.6-42.2174.3-62.8168.5000110.7W113 N114 I115 L119 L120 L121 L301 A302W113-I117 PolarHBondContact O-N 3.41Å; N114-I117 PolarHBondContact O-N 3.26Å; I115-I117 VanDerWaalsContact C-N 3.33Å; I115-I117 PolarHBondContact O-N 2.67Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.95Å; I117-L120 WeakPolarHBondContact O-CB 3.48Å; I117-L120 PolarHBondContact O-N 2.86Å; I117-L121 HydrophobicContact CG2-CD1 4.24Å; I117-L121 WeakPolarHBondContact O-CG 3.42Å; I117-L121 PolarHBondContact O-N 3.24Å; I117-L301 HydrophobicContact CD1-CB 3.84Å; I117-L301 HydrophobicContact CG1-CB 3.98Å; I117-A302 HydrophobicContact CD1-CB 3.9Å
118I98.8Very high98.6Very high81 Ų8136.2 Ų36.242%0.41520%0.201SC..Hα-helixtrans-62.9-42176-62.7171.9000110.5N114 I115 L121 A122 L192N114-I118 WeakPolarHBondContact O-CG1 3.34Å; N114-I118 PolarHBondContact O-N 3.32Å; N114-I118 VanDerWaalsContact O-N 3.09Å; I115-I118 HydrophobicContact CD1-CD1 4.18Å; I115-I118 PolarHBondContact O-N 3.36Å; I118-L121 PolarHBondContact O-N 2.9Å; I118-A122 WeakPolarHBondContact O-CB 3.4Å; I118-A122 PolarHBondContact O-N 3.25Å; I118-L192 HydrophobicContact CG2-CD1 3.87Å; I118-L192 HydrophobicContact CG2-CD2 4.35Å
119L98.9Very high98.6Very high21 Ų2134 Ų3411%0.1119%0.189CC..Hα-helixtrans-59-46.8173.9-79.9167.4000111.5I115 G116 I117 L121 A122 T123 I189 L192 A193 H196I115-L119 HydrophobicContact CG2-CD1 4.2Å; I115-L119 HydrophobicContact CG2-CG 4.43Å; I115-L119 WeakPolarHBondContact O-CB 3.34Å; I115-L119 WeakPolarHBondContact O-CG 3.5Å; I115-L119 PolarHBondContact O-N 2.94Å; G116-L119 WeakPolarHBondContact O-CB 3.27Å; G116-L119 PolarHBondContact O-N 3.16Å; I117-L119 VanDerWaalsContact C-N 3.33Å; I117-L119 PolarHBondContact O-N 2.95Å; L119-L121 PolarHBondContact O-N 3.15Å; L119-A122 PolarHBondContact O-N 3.39Å; L119-T123 PolarHBondContact O-N 2.91Å; L119-T123 PolarHBondContact O-OG1 2.96Å; L119-T123 VanDerWaalsContact O-OG1 3.08Å; L119-I189 HydrophobicContact CD2-CG2 3.85Å; L119-L192 HydrophobicContact CD2-CB 3.56Å; L119-L192 HydrophobicContact CG-CB 4.09Å; L119-A193 HydrophobicContact CD2-CB 4.42Å; L119-H196 HydrophobicContact CD1-CB 3.8Å
120L98.9Very high98.6Very high9 Ų932.3 Ų32.35%0.04719%0.188CC..Hα-helixtrans-56.2-51175.6173.564.2000111.2L94 I98 G116 I117 A122 T123 M124 I298 L301L94-L120 HydrophobicContact CD1-CD1 4.17Å; I98-L120 HydrophobicContact CD1-CD1 4.09Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.43Å; G116-L120 PolarHBondContact O-N 2.75Å; I117-L120 WeakPolarHBondContact O-CB 3.48Å; I117-L120 PolarHBondContact O-N 2.86Å; L120-A122 PolarHBondContact O-N 3.17Å; L120-T123 PolarHBondContact O-N 3.43Å; L120-M124 HydrophobicContact CD1-CG 4.16Å; L120-M124 HydrophobicContact CD1-SD 3.94Å; L120-M124 HydrophobicContact CG-SD 3.9Å; L120-M124 WeakPolarHBondContact O-CB 3.43Å; L120-M124 VanDerWaalsContact O-CG 3.23Å; L120-M124 WeakPolarHBondContact O-CG 3.48Å; L120-M124 PolarHBondContact O-N 3.21Å; L120-I298 HydrophobicContact CD2-CG2 3.89Å; L120-L301 HydrophobicContact CD2-CD1 3.77Å
121L98.8Very high98.7Very high67 Ų6732 Ų3235%0.35118%0.179SC..Hα-helixtrans-61.9-41.9179.7-70.7170.1000112.1I117 I118 L119 M124 A125 I298 L299I117-L121 HydrophobicContact CG2-CD1 4.24Å; I117-L121 WeakPolarHBondContact O-CG 3.42Å; I117-L121 PolarHBondContact O-N 3.24Å; I118-L121 PolarHBondContact O-N 2.9Å; L119-L121 PolarHBondContact O-N 3.15Å; L121-M124 PolarHBondContact O-N 3.49Å; L121-A125 WeakPolarHBondContact O-CB 3.29Å; L121-A125 PolarHBondContact O-N 3.5Å; L121-I298 HydrophobicContact CD2-CG2 3.79Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; L121-L299 HydrophobicContact CD1-CD2 4.21Å
122A98.9Very high98.7Very high14 Ų1427.4 Ų27.412%0.11616%0.158CC..Hα-helixtrans-64.9-42.3177.100000111.8I118 L119 L120 A125 T126 I189I118-A122 WeakPolarHBondContact O-CB 3.4Å; I118-A122 PolarHBondContact O-N 3.25Å; L119-A122 PolarHBondContact O-N 3.39Å; L120-A122 PolarHBondContact O-N 3.17Å; A122-A125 PolarHBondContact O-N 2.94Å; A122-T126 WeakPolarHBondContact O-CB 3.48Å; A122-T126 PolarHBondContact O-N 2.62Å; A122-T126 PolarHBondContact O-OG1 3.35Å; A122-I189 HydrophobicContact CB-CD1 4.18Å; A122-I189 HydrophobicContact CB-CG1 3.71Å
123T98.9Very high98.8Very high11 Ų1127.5 Ų27.57%0.06716%0.158CC..Hα-helixtrans-65.2-41.8174.8-59.30000111.5F90 F91 L94 L119 L120 T126 A127F90-T123 HydrophobicContact CD2-CG2 3.55Å; F90-T123 HydrophobicContact CE2-CG2 3.45Å; F90-T123 VanDerWaalsContact CE2-CG2 3.45Å; F90-T123 HydrophobicContact CG-CG2 4.5Å; F90-T123 HydrophobicContact CZ-CG2 4.36Å; F91-T123 HydrophobicContact CE1-CG2 4.49Å; F91-T123 HydrophobicContact CE2-CG2 4.16Å; F91-T123 HydrophobicContact CZ-CG2 3.91Å; L94-T123 HydrophobicContact CD1-CG2 3.77Å; L119-T123 PolarHBondContact O-N 2.91Å; L119-T123 PolarHBondContact O-OG1 2.96Å; L119-T123 VanDerWaalsContact O-OG1 3.08Å; L120-T123 PolarHBondContact O-N 3.43Å; T123-T126 PolarHBondContact O-N 2.92Å; T123-A127 WeakPolarHBondContact O-CB 3.02Å; T123-A127 PolarHBondContact O-N 3.31Å
124M98.8Very high98.7Very high17 Ų1727.6 Ų27.68%0.08416%0.162CC..Hα-helixtrans-58.1-48.7174.3-73.5176.886.900111.5F91 L120 L121 T126 A127 F128 F274 I298F91-M124 HydrophobicContact CE1-CG 3.81Å; F91-M124 HydrophobicContact CZ-CG 4.15Å; L120-M124 HydrophobicContact CD1-CG 4.16Å; L120-M124 HydrophobicContact CD1-SD 3.94Å; L120-M124 HydrophobicContact CG-SD 3.9Å; L120-M124 WeakPolarHBondContact O-CB 3.43Å; L120-M124 VanDerWaalsContact O-CG 3.23Å; L120-M124 WeakPolarHBondContact O-CG 3.48Å; L120-M124 PolarHBondContact O-N 3.21Å; L121-M124 PolarHBondContact O-N 3.49Å; M124-T126 VanDerWaalsContact C-N 3.35Å; M124-T126 PolarHBondContact O-N 3.23Å; M124-A127 PolarHBondContact O-N 3.13Å; M124-F128 WeakPolarHBondContact O-CB 3.4Å; M124-F128 PolarHBondContact O-N 2.92Å; M124-F274 HydrophobicContact CB-CE1 3.83Å; M124-F274 HydrophobicContact CB-CZ 4.24Å; M124-F274 HydrophobicContact CE-CD1 3.64Å; M124-F274 HydrophobicContact CE-CE1 3.49Å; M124-F274 VanDerWaalsContact CE-CE1 3.49Å; M124-F274 HydrophobicContact CG-CE1 3.83Å; M124-F274 WeakPolarHBondContact O-CZ 3.16Å; M124-I298 HydrophobicContact CE-CD1 3.41Å; M124-I298 VanDerWaalsContact CE-CD1 3.41Å; M124-I298 HydrophobicContact CE-CG1 4.15Å; M124-I298 HydrophobicContact SD-CD1 3.87Å; M124-I298 HydrophobicContact SD-CG1 4.44Å; M124-I298 HydrophobicContact SD-CG2 4.4Å
125A98.7Very high98.7Very high41 Ų4124.9 Ų24.934%0.33915%0.146SC..Hα-helixtrans-60.2-45175.900000111.9L121 A122 A127 F128 M129 L185L121-A125 WeakPolarHBondContact O-CB 3.29Å; L121-A125 PolarHBondContact O-N 3.5Å; A122-A125 PolarHBondContact O-N 2.94Å; A125-A127 PolarHBondContact O-N 3.38Å; A125-F128 PolarHBondContact O-N 3.08Å; A125-M129 HydrophobicContact CB-CE 4.26Å; A125-M129 VanDerWaalsContact O-CE 3.22Å; A125-M129 WeakPolarHBondContact O-CE 3.38Å; A125-M129 PolarHBondContact O-N 3.42Å; A125-M129 VanDerWaalsContact O-N 3.07Å; A125-L185 HydrophobicContact CB-CD1 4.13Å
126T98.9Very high98.7Very high14 Ų1423.9 Ų23.99%0.08614%0.141CC..Hα-helixtrans-59.7-48.8179-56.70000111.4A122 T123 M124 M129 G130 H182 L185 P186 I189A122-T126 WeakPolarHBondContact O-CB 3.48Å; A122-T126 PolarHBondContact O-N 2.62Å; A122-T126 PolarHBondContact O-OG1 3.35Å; T123-T126 PolarHBondContact O-N 2.92Å; M124-T126 VanDerWaalsContact C-N 3.35Å; M124-T126 PolarHBondContact O-N 3.23Å; T126-M129 PolarHBondContact O-N 3.36Å; T126-G130 PolarHBondContact O-N 2.55Å; T126-H182 PolarHBondContact O-CE1 3.46Å; T126-H182 PolarHBondContact O-ND1 3.41Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 WeakPolarHBondContact OG1-CB 3.38Å; T126-L185 WeakPolarHBondContact OG1-CD1 3.21Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.5Å
127A98.8Very high98.7Very high13 Ų1323.3 Ų23.311%0.10713%0.132CC..Hα-helixtrans-67.9-41-178.100000112.4F91 T123 M124 A125 M129 G130 Y131 Y273F91-A127 HydrophobicContact CE2-CB 3.49Å; F91-A127 VanDerWaalsContact CE2-CB 3.49Å; F91-A127 HydrophobicContact CZ-CB 3.87Å; T123-A127 WeakPolarHBondContact O-CB 3.02Å; T123-A127 PolarHBondContact O-N 3.31Å; M124-A127 PolarHBondContact O-N 3.13Å; A125-A127 PolarHBondContact O-N 3.38Å; A127-M129 PolarHBondContact O-N 2.88Å; A127-G130 PolarHBondContact O-N 2.74Å; A127-Y131 WeakPolarHBondContact O-CB 3.29Å; A127-Y131 PolarHBondContact O-N 2.77Å; A127-Y273 HydrophobicContact CB-CE2 3.97Å
128F98.6Very high98.6Very high41 Ų4122.8 Ų22.818%0.1813%0.129CC..Hα-helixtrans-56.6-51.6174170-104.1000111.3M124 A125 G130 Y131 V132 I146 T147 F178 F274M124-F128 WeakPolarHBondContact O-CB 3.4Å; M124-F128 PolarHBondContact O-N 2.92Å; A125-F128 PolarHBondContact O-N 3.08Å; F128-G130 VanDerWaalsContact C-N 3.35Å; F128-G130 PolarHBondContact O-N 3.05Å; F128-Y131 PolarHBondContact O-N 3.42Å; F128-V132 WeakPolarHBondContact O-CG2 3.26Å; F128-V132 PolarHBondContact O-N 3.23Å; F128-I146 HydrophobicContact CD2-CG2 4.4Å; F128-I146 HydrophobicContact CE2-CB 3.75Å; F128-I146 HydrophobicContact CE2-CG1 4.08Å; F128-I146 HydrophobicContact CE2-CG2 3.74Å; F128-I146 HydrophobicContact CZ-CB 3.98Å; F128-I146 HydrophobicContact CZ-CG2 3.89Å; F128-T147 HydrophobicContact CE1-CG2 4.24Å; F128-T147 HydrophobicContact CZ-CG2 4.13Å; F128-F178 AromaticContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CZ 4.2Å; F128-F178 HydrophobicContact CZ-CE2 4.48Å; F128-F274 HydrophobicContact CB-CE2 4.26Å; F128-F274 HydrophobicContact CB-CZ 4.19Å
129M98.6Very high98.5Very high19 Ų1918.9 Ų18.99%0.09411%0.109CC..Hα-helixtrans-66.4-37.2179.7-70-178.3-73.400112.4A125 T126 A127 Y131 V132 L133 F178 F181 H182 L185A125-M129 HydrophobicContact CB-CE 4.26Å; A125-M129 VanDerWaalsContact O-CE 3.22Å; A125-M129 WeakPolarHBondContact O-CE 3.38Å; A125-M129 PolarHBondContact O-N 3.42Å; A125-M129 VanDerWaalsContact O-N 3.07Å; T126-M129 PolarHBondContact O-N 3.36Å; A127-M129 PolarHBondContact O-N 2.88Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.13Å; M129-V132 WeakPolarHBondContact O-CB 3.34Å; M129-V132 PolarHBondContact O-N 2.97Å; M129-V132 VanDerWaalsContact O-N 3.11Å; M129-L133 WeakPolarHBondContact O-CG 3.45Å; M129-F178 HydrophobicContact CB-CB 4.26Å; M129-F178 HydrophobicContact CB-CD2 4.39Å; M129-F178 HydrophobicContact CB-CG 4.34Å; M129-F178 HydrophobicContact CG-CB 4.33Å; M129-F178 HydrophobicContact CG-CD1 4.2Å; M129-F178 HydrophobicContact CG-CD2 4.02Å; M129-F178 HydrophobicContact CG-CE2 4.38Å; M129-F178 HydrophobicContact CG-CG 3.94Å; M129-F178 HydrophobicContact SD-CD1 4.13Å; M129-F178 HydrophobicContact SD-CG 4.34Å; M129-F181 HydrophobicContact CE-CB 3.79Å; M129-F181 HydrophobicContact SD-CB 3.46Å; M129-F181 WeakPolarHBondContact SD-CB 3.37Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.3Å; M129-H182 HydrophobicContact CB-CB 4.1Å; M129-L185 HydrophobicContact CE-CD1 3.24Å; M129-L185 HydrophobicContact CE-CG 4.46Å
130G98.6Very high98.5Very high16 Ų1618.4 Ų18.417%0.16511%0.106CC..Hα-helixtrans-60.3-38.917500000112.5T126 A127 F128 V132 L133 P134 H182T126-G130 PolarHBondContact O-N 2.55Å; A127-G130 PolarHBondContact O-N 2.74Å; F128-G130 VanDerWaalsContact C-N 3.35Å; F128-G130 PolarHBondContact O-N 3.05Å; G130-V132 PolarHBondContact O-N 3.01Å; G130-L133 WeakPolarHBondContact O-CB 3.19Å; G130-L133 WeakPolarHBondContact O-CG 3.28Å; G130-L133 PolarHBondContact O-N 3.45Å; G130-P134 WeakPolarHBondContact O-CD 3.2Å; G130-H182 WeakPolarHBondContact CA-CE1 3.35Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.49Å; G130-H182 PolarHBondContact N-ND1 2.79Å
131Y98.6Very high98.5Very high42 Ų4219.6 Ų19.617%0.16511%0.11CC..Hα-helixtrans-68.6-18.7177.2-169.1-105.4000113.6A127 F128 M129 P134 M138 S139 E271A127-Y131 WeakPolarHBondContact O-CB 3.29Å; A127-Y131 PolarHBondContact O-N 2.77Å; F128-Y131 PolarHBondContact O-N 3.42Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.13Å; Y131-P134 WeakPolarHBondContact O-CD 3.35Å; Y131-M138 HydrophobicContact CE1-CB 4.17Å; Y131-S139 VanDerWaalsContact O-CB 3.28Å; Y131-S139 WeakPolarHBondContact O-CB 3.35Å; Y131-S139 PolarHBondContact O-OG 3.08Å; Y131-E271 HydrophobicContact CD1-CG 4.17Å; Y131-E271 HydrophobicContact CD2-CG 3.45Å; Y131-E271 VanDerWaalsContact CD2-CG 3.45Å; Y131-E271 HydrophobicContact CE1-CG 4.12Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.26Å; Y131-E271 HydrophobicContact CG-CG 3.84Å; Y131-E271 PolarHBondContact OH-OE1 3.24Å
132V98.6Very high98.3Very high2 Ų216.8 Ų16.81%0.01210%0.098CC..Hα-helixtrans-78.6-27.8174.9-1780000111.8F128 M129 G130 P134 W135 A143 L175 F178F128-V132 WeakPolarHBondContact O-CG2 3.26Å; F128-V132 PolarHBondContact O-N 3.23Å; M129-V132 WeakPolarHBondContact O-CB 3.34Å; M129-V132 PolarHBondContact O-N 2.97Å; M129-V132 VanDerWaalsContact O-N 3.11Å; G130-V132 PolarHBondContact O-N 3.01Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; V132-W135 HydrophobicContact CG1-CE3 4.15Å; V132-W135 HydrophobicContact CG1-CZ3 3.94Å; V132-W135 PolarHBondContact O-N 3.06Å; V132-A143 HydrophobicContact CG1-CB 4.06Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; V132-L175 HydrophobicContact CG1-CD1 4.39Å; V132-F178 HydrophobicContact CB-CD2 3.95Å; V132-F178 HydrophobicContact CG1-CD2 3.98Å; V132-F178 HydrophobicContact CG2-CD2 3.89Å; V132-F178 HydrophobicContact CG2-CE2 4.05Å
133L98.8Very high98.2Very high17 Ų1716.2 Ų16.29%0.0899%0.093CC..THydrogen-bonded Turntrans-60.3-34.4-171.6-53.8-174.8000115.2Y55 M129 G130 W135 L175 F178 F179 H182Y55-L133 HydrophobicContact CE1-CB 4.44Å; Y55-L133 HydrophobicContact CE2-CB 4.42Å; Y55-L133 WeakPolarHBondContact CE2-O 3.26Å; Y55-L133 PolarHBondContact OH-O 3.46Å; M129-L133 WeakPolarHBondContact O-CG 3.45Å; G130-L133 WeakPolarHBondContact O-CB 3.19Å; G130-L133 WeakPolarHBondContact O-CG 3.28Å; G130-L133 PolarHBondContact O-N 3.45Å; L133-W135 PolarHBondContact O-N 3.39Å; L133-W135 VanDerWaalsContact O-N 3.15Å; L133-L175 HydrophobicContact CD2-CD1 3.99Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; L133-F179 HydrophobicContact CD1-CD2 4.07Å; L133-F179 HydrophobicContact CD2-CB 3.91Å; L133-H182 HydrophobicContact CD1-CB 4.3Å
134P98.5Very high98.2Very high27 Ų2717.1 Ų17.118%0.17510%0.099CC..THydrogen-bonded Turntrans-63.2-18.2175.4-25.235.8000115F63 I66 G130 Y131 V132 G136F63-P134 WeakPolarHBondContact CA-O 3.48Å; F63-P134 WeakPolarHBondContact CD2-O 3.36Å; I66-P134 HydrophobicContact CG1-CB 4.41Å; G130-P134 WeakPolarHBondContact O-CD 3.2Å; Y131-P134 WeakPolarHBondContact O-CD 3.35Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; P134-G136 PolarHBondContact O-N 3.11Å
135W98.5Very high98.1Very high13 Ų1319 Ų195%0.04911%0.11CC..  trans56.335.3177.5-150.6-111.6000114.3A59 A62 F63 V132 L133 F140 V170 L175 A259A59-W135 HydrophobicContact CB-CZ2 3.74Å; A62-W135 HydrophobicContact CB-CB 3.89Å; A62-W135 HydrophobicContact CB-CG 4.41Å; F63-W135 HydrophobicContact CB-CB 4.45Å; V132-W135 HydrophobicContact CG1-CE3 4.15Å; V132-W135 HydrophobicContact CG1-CZ3 3.94Å; V132-W135 PolarHBondContact O-N 3.06Å; L133-W135 PolarHBondContact O-N 3.39Å; L133-W135 VanDerWaalsContact O-N 3.15Å; W135-F140 HydrophobicContact CH2-CD2 4.1Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.33Å; W135-V170 HydrophobicContact CH2-CG1 3.69Å; W135-V170 HydrophobicContact CZ3-CG1 4.04Å; W135-L175 HydrophobicContact CD2-CD2 3.85Å; W135-L175 HydrophobicContact CE3-CB 4.25Å; W135-L175 HydrophobicContact CE3-CD1 3.64Å; W135-L175 HydrophobicContact CE3-CD2 3.7Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.26Å; W135-L175 HydrophobicContact CH2-CB 4.13Å; W135-L175 HydrophobicContact CZ3-CB 3.8Å; W135-L175 HydrophobicContact CZ3-CD1 3.86Å; W135-L175 HydrophobicContact CZ3-CD2 4.08Å; W135-L175 HydrophobicContact CZ3-CG 4.12Å; W135-A259 HydrophobicContact CG-CB 4.42Å; W135-A259 WeakPolarHBondContact O-CB 3.41Å; W135-A259 PolarHBondContact O-N 3.07Å; W135-A259 VanDerWaalsContact O-N 3.12Å
136G98.3Very high97.9Very high0 Ų019.2 Ų19.20%011%0.106CC..BIsolated β-bridgetrans-85.6-179.716900000112.7P134 M138 S139 F140 N255 T257P134-G136 PolarHBondContact O-N 3.11Å; G136-M138 PolarHBondContact O-N 2.99Å; G136-S139 WeakPolarHBondContact O-CB 3.26Å; G136-S139 PolarHBondContact O-N 3.49Å; G136-F140 PolarHBondContact O-N 3.18Å; G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.35Å; G136-T257 CarbonylContact C-O 3.56Å; G136-T257 WeakPolarHBondContact CA-O 3.44Å
137Q98.1Very high97.8Very high12 Ų1219 Ų196%0.05610%0.104CC..Hα-helixtrans-58.4-48.6-179.1-75.6-76.26600113F140 W141 D254 T257 N263 P265Q137-F140 PolarHBondContact O-N 3.21Å; Q137-W141 WeakPolarHBondContact O-CB 3.36Å; Q137-W141 PolarHBondContact O-N 3.09Å; Q137-D254 HydrophobicContact CB-CB 4.44Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.19Å; Q137-T257 PolarHBondContact N-O 2.58Å; Q137-N263 PolarHBondContact NE2-O 2.83Å; Q137-P265 HydrophobicContact CB-CG 3.87Å
138M97.3Very high97.7Very high1 Ų121.3 Ų21.31%0.00512%0.115CC..Hα-helixtrans-68.6-36.4179.9-70.4-62.7162.200112.1Y131 G136 G142 D252 D254 N255 P265Y131-M138 HydrophobicContact CE1-CB 4.17Å; G136-M138 PolarHBondContact O-N 2.99Å; M138-G142 WeakPolarHBondContact O-CA 3.28Å; M138-G142 PolarHBondContact O-N 2.91Å; M138-D252 HydrophobicContact CG-CB 4.1Å; M138-D254 HydrophobicContact CE-CB 3.52Å; M138-D254 WeakPolarHBondContact CE-OD2 3.42Å; M138-D254 HydrophobicContact CG-CB 3.81Å; M138-N255 HydrophobicContact CB-CB 4.16Å; M138-N255 PolarHBondContact N-OD1 3.27Å; M138-P265 HydrophobicContact CE-CB 3.49Å; M138-P265 VanDerWaalsContact CE-CB 3.49Å; M138-P265 HydrophobicContact CE-CG 3.99Å
139S97.4Very high97.6Very high0 Ų020.5 Ų20.50%011%0.112CC..Hα-helixtrans-55.6-54.1171.9-66.30000112Y131 G136 A143 N255Y131-S139 VanDerWaalsContact O-CB 3.28Å; Y131-S139 WeakPolarHBondContact O-CB 3.35Å; Y131-S139 PolarHBondContact O-OG 3.08Å; G136-S139 WeakPolarHBondContact O-CB 3.26Å; G136-S139 PolarHBondContact O-N 3.49Å; S139-A143 VanDerWaalsContact O-CB 3.32Å; S139-A143 WeakPolarHBondContact O-CB 3.41Å; S139-A143 PolarHBondContact O-N 3.37Å; S139-N255 PolarHBondContact N-OD1 2.96Å; S139-N255 PolarHBondContact OG-ND2 2.9Å; S139-N255 PolarHBondContact OG-OD1 2.97Å
140F98.1Very high97.4Very high11 Ų1122.3 Ų22.35%0.04812%0.122CC..Hα-helixtrans-68.6-49.6-175.5175.5-90.8000112.7W135 G136 Q137 A143 T144 V170 A259 P261W135-F140 HydrophobicContact CH2-CD2 4.1Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.33Å; G136-F140 PolarHBondContact O-N 3.18Å; Q137-F140 PolarHBondContact O-N 3.21Å; F140-A143 PolarHBondContact O-N 3.39Å; F140-T144 WeakPolarHBondContact O-CB 3.44Å; F140-T144 PolarHBondContact O-N 2.94Å; F140-T144 PolarHBondContact O-OG1 3.45Å; F140-V170 HydrophobicContact CD2-CG1 4.09Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.12Å; F140-V170 VanDerWaalsContact CE2-O 3.29Å; F140-V170 WeakPolarHBondContact CE2-O 3.32Å; 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 4.09Å; F140-P261 HydrophobicContact CE1-CG 4.26Å; F140-P261 HydrophobicContact CE2-CG 4.19Å; F140-P261 HydrophobicContact CZ-CB 3.83Å; F140-P261 HydrophobicContact CZ-CG 3.77Å
141W98.3Very high97.3Very high33 Ų3323 Ų2313%0.12512%0.124CC..Hα-helixtrans-72.2-35.5-177.7-74105.6000112Q137 T144 V145 N260 P261 N263 T264 P265 I268Q137-W141 WeakPolarHBondContact O-CB 3.36Å; Q137-W141 PolarHBondContact O-N 3.09Å; W141-T144 PolarHBondContact O-N 3.41Å; W141-V145 WeakPolarHBondContact O-CB 3.46Å; W141-V145 WeakPolarHBondContact O-CG2 3.27Å; W141-V145 PolarHBondContact O-N 3.3Å; W141-N260 PolarHBondContact NE1-O 2.99Å; W141-P261 WeakPolarHBondContact CH2-O 3.3Å; W141-P261 WeakPolarHBondContact CZ2-O 3.39Å; W141-N263 PolarHBondContact NE1-O 3.38Å; W141-T264 HydrophobicContact CD2-CG2 4.19Å; W141-T264 HydrophobicContact CE3-CG2 4.17Å; W141-T264 HydrophobicContact CH2-CG2 4.45Å; W141-T264 VanDerWaalsContact CH2-OG1 3.26Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.49Å; W141-T264 HydrophobicContact CZ2-CG2 4.46Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.48Å; W141-T264 HydrophobicContact CZ3-CG2 4.31Å; W141-P265 HydrophobicContact CG-CG 4.37Å; W141-I268 HydrophobicContact CB-CD1 3.73Å; W141-I268 HydrophobicContact CB-CG1 3.91Å; W141-I268 HydrophobicContact CB-CG2 4.17Å; W141-I268 HydrophobicContact CD2-CD1 4.26Å; W141-I268 HydrophobicContact CE3-CD1 4.17Å; W141-I268 HydrophobicContact CG-CD1 4.12Å
142G96Very high97.2Very high9 Ų921.7 Ų21.79%0.09312%0.123CC..Hα-helixtrans-59.4-47.717000000111.6M138 T144 V145 I146M138-G142 WeakPolarHBondContact O-CA 3.28Å; M138-G142 PolarHBondContact O-N 2.91Å; G142-T144 PolarHBondContact O-N 2.95Å; G142-V145 PolarHBondContact O-N 2.97Å; G142-I146 WeakPolarHBondContact O-CB 3.38Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.32Å; G142-I146 PolarHBondContact O-N 2.81Å
143A96.8Very high97.1Very high1 Ų124.3 Ų24.31%0.00814%0.136CC..Hα-helixtrans-57.5-48.5175.200000111.7V132 S139 F140 T147 V170V132-A143 HydrophobicContact CG1-CB 4.06Å; V132-A143 HydrophobicContact CG2-CB 3.76Å; S139-A143 VanDerWaalsContact O-CB 3.32Å; S139-A143 WeakPolarHBondContact O-CB 3.41Å; S139-A143 PolarHBondContact O-N 3.37Å; F140-A143 PolarHBondContact O-N 3.39Å; A143-T147 WeakPolarHBondContact O-CB 3.25Å; A143-T147 WeakPolarHBondContact O-CG2 3.29Å; A143-T147 PolarHBondContact O-N 3.49Å; A143-T147 PolarHBondContact O-OG1 2.97Å; A143-V170 HydrophobicContact CB-CG1 4.19Å; A143-V170 HydrophobicContact CB-CG2 4.27Å
144T97.3Very high96.9Very high31 Ų3126.9 Ų26.919%0.1915%0.153CC..Hα-helixtrans-59.9-49.4-178.7-60.10000111.9F140 W141 G142 N148F140-T144 WeakPolarHBondContact O-CB 3.44Å; F140-T144 PolarHBondContact O-N 2.94Å; F140-T144 PolarHBondContact O-OG1 3.45Å; W141-T144 PolarHBondContact O-N 3.41Å; G142-T144 PolarHBondContact O-N 2.95Å; T144-N148 WeakPolarHBondContact O-CB 3.36Å; T144-N148 PolarHBondContact O-N 3.41Å
145V96.6Very high96.8Very high55 Ų5536.5 Ų36.533%0.33319%0.188SC..Hα-helixtrans-67.4-49.9-178171.90000111.2W141 G142 N148 L149 I268W141-V145 WeakPolarHBondContact O-CB 3.46Å; W141-V145 WeakPolarHBondContact O-CG2 3.27Å; W141-V145 PolarHBondContact O-N 3.3Å; G142-V145 PolarHBondContact O-N 2.97Å; V145-N148 PolarHBondContact O-N 2.92Å; V145-L149 PolarHBondContact O-N 3.41Å; V145-I268 HydrophobicContact CG2-CD1 4.23Å; V145-I268 HydrophobicContact CG2-CG2 4.25Å
146I95.5Very high96.8Very high46 Ų4640.9 Ų40.924%0.23621%0.211CC..Hα-helixtrans-68.8-44.6-172.9-63.4-61.6000111.6F128 G142 N148 L149F128-I146 HydrophobicContact CD2-CG2 4.4Å; F128-I146 HydrophobicContact CE2-CB 3.75Å; F128-I146 HydrophobicContact CE2-CG1 4.08Å; F128-I146 HydrophobicContact CE2-CG2 3.74Å; F128-I146 HydrophobicContact CZ-CB 3.98Å; F128-I146 HydrophobicContact CZ-CG2 3.89Å; G142-I146 WeakPolarHBondContact O-CB 3.38Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.32Å; G142-I146 PolarHBondContact O-N 2.81Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 3.33Å; I146-L149 HydrophobicContact CD1-CD1 4.23Å; I146-L149 WeakPolarHBondContact O-CB 3.49Å; I146-L149 WeakPolarHBondContact O-CG 3.47Å; I146-L149 PolarHBondContact O-N 3Å
147T96.9Very high96.8Very high10 Ų1040.9 Ų40.96%0.06121%0.212CC..Hα-helixtrans-68-35.5178.855.10000112F128 A143 L149 L150 V161 I164 W165 F178F128-T147 HydrophobicContact CE1-CG2 4.24Å; F128-T147 HydrophobicContact CZ-CG2 4.13Å; A143-T147 WeakPolarHBondContact O-CB 3.25Å; A143-T147 WeakPolarHBondContact O-CG2 3.29Å; A143-T147 PolarHBondContact O-N 3.49Å; A143-T147 PolarHBondContact O-OG1 2.97Å; T147-L149 PolarHBondContact O-N 3.1Å; T147-L149 VanDerWaalsContact O-N 3.12Å; T147-L150 WeakPolarHBondContact O-CB 3.36Å; T147-L150 PolarHBondContact O-N 3.45Å; T147-L150 VanDerWaalsContact O-N 3.13Å; T147-V161 WeakPolarHBondContact O-CG2 3.34Å; T147-I164 HydrophobicContact CG2-CG2 4.4Å; T147-W165 PolarHBondContact OG1-NE1 3.44Å; T147-F178 HydrophobicContact CG2-CZ 4.03Å
148N97.1Very high96.7Very high62 Ų6244.2 Ų44.233%0.33223%0.233SC..G310 helixtrans-69.6-4.7175.8-169.635.7000113.7T144 V145 I146 L150 S151 W165 K287T144-N148 WeakPolarHBondContact O-CB 3.36Å; T144-N148 PolarHBondContact O-N 3.41Å; V145-N148 PolarHBondContact O-N 2.92Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 3.33Å; N148-L150 PolarHBondContact O-N 3.14Å; N148-S151 PolarHBondContact O-N 3.28Å; N148-S151 PolarHBondContact O-OG 3Å; N148-S151 PolarHBondContact OD1-OG 3.11Å; N148-W165 HydrophobicContact CB-CH2 4.28Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; N148-K287 WeakPolarHBondContact O-CE 2.93Å; N148-K287 PolarHBondContact O-NZ 3.45Å
149L95.1Very high96.8Very high24 Ų2449.4 Ų49.413%0.12626%0.26CS..G310 helixtrans-62.8-31.5167.9-67.4179.2000111.6V145 I146 T147 S151 A152 L281 V291V145-L149 PolarHBondContact O-N 3.41Å; I146-L149 HydrophobicContact CD1-CD1 4.23Å; I146-L149 WeakPolarHBondContact O-CB 3.49Å; I146-L149 WeakPolarHBondContact O-CG 3.47Å; I146-L149 PolarHBondContact O-N 3Å; T147-L149 PolarHBondContact O-N 3.1Å; T147-L149 VanDerWaalsContact O-N 3.12Å; L149-S151 PolarHBondContact O-N 3.28Å; L149-A152 VanDerWaalsContact O-CB 3.24Å; L149-A152 WeakPolarHBondContact O-CB 3.46Å; L149-A152 PolarHBondContact O-N 3.11Å; L149-A152 VanDerWaalsContact O-N 3.08Å; L149-L281 HydrophobicContact CD1-CD1 4.34Å; L149-L281 HydrophobicContact CD1-CD2 3.65Å; L149-L281 HydrophobicContact CD2-CD1 4.23Å; L149-L281 HydrophobicContact CD2-CD2 4.14Å; L149-V291 HydrophobicContact CB-CG2 3.73Å; L149-V291 HydrophobicContact CD2-CG2 4.04Å; L149-V291 HydrophobicContact CG-CG2 4.31Å
150L94.8Very high96.8Very high56 Ų5652 Ų5229%0.29327%0.274SS..G310 helixtrans-66.5-20.3179.6-64.3172.3000113.3T147 N148 A152 I153 G157 L160 V161 I164T147-L150 WeakPolarHBondContact O-CB 3.36Å; T147-L150 PolarHBondContact O-N 3.45Å; T147-L150 VanDerWaalsContact O-N 3.13Å; N148-L150 PolarHBondContact O-N 3.14Å; L150-A152 PolarHBondContact O-N 3.27Å; L150-A152 VanDerWaalsContact O-N 3.11Å; L150-I153 HydrophobicContact CD2-CD1 4.04Å; L150-I153 WeakPolarHBondContact O-CB 3.49Å; L150-I153 WeakPolarHBondContact O-CG1 3.49Å; L150-I153 PolarHBondContact O-N 3.19Å; L150-G157 VanDerWaalsContact O-CA 3.29Å; L150-G157 WeakPolarHBondContact O-CA 3.15Å; L150-L160 HydrophobicContact CB-CD2 4.28Å; L150-L160 HydrophobicContact CD1-CD2 4.22Å; L150-V161 HydrophobicContact CB-CG2 3.82Å; L150-I164 HydrophobicContact CD1-CD1 3.31Å
151S96.5Very high96.8Very high30 Ų3051.6 Ų51.621%0.2127%0.273CS..G310 helixtrans-67.6-8.7173.463.60000113.4N148 L149 I153 K287N148-S151 PolarHBondContact O-N 3.28Å; N148-S151 PolarHBondContact O-OG 3Å; N148-S151 PolarHBondContact OD1-OG 3.11Å; L149-S151 PolarHBondContact O-N 3.28Å; S151-I153 PolarHBondContact O-N 2.91Å; S151-K287 PolarHBondContact OG-NZ 3.16Å
152A96.1Very high96.8Very high16 Ų1653.4 Ų53.413%0.13228%0.283CS..G310 helixtrans-71.8-16.6170.400000113.3L149 L150 P154 K287 L288 V291L149-A152 VanDerWaalsContact O-CB 3.24Å; L149-A152 WeakPolarHBondContact O-CB 3.46Å; L149-A152 PolarHBondContact O-N 3.11Å; L149-A152 VanDerWaalsContact O-N 3.08Å; L150-A152 PolarHBondContact O-N 3.27Å; L150-A152 VanDerWaalsContact O-N 3.11Å; A152-P154 WeakPolarHBondContact O-CD 3.42Å; A152-K287 HydrophobicContact CB-CB 4.46Å; A152-K287 HydrophobicContact CB-CD 3.96Å; A152-K287 HydrophobicContact CB-CG 3.88Å; A152-L288 HydrophobicContact CB-CB 4.24Å; A152-L288 HydrophobicContact CB-CD1 4.38Å; A152-V291 HydrophobicContact CB-CG2 4.33Å
153I96.6Very high96.9Very high56 Ų5661.9 Ų61.929%0.28731%0.312SS..SBendtrans-68.6122.7178.6-61.1170.4000108.9L150 S151 I156 G157 L160L150-I153 HydrophobicContact CD2-CD1 4.04Å; L150-I153 WeakPolarHBondContact O-CB 3.49Å; L150-I153 WeakPolarHBondContact O-CG1 3.49Å; L150-I153 PolarHBondContact O-N 3.19Å; S151-I153 PolarHBondContact O-N 2.91Å; I153-I156 HydrophobicContact CG2-CD1 4.16Å; I153-I156 HydrophobicContact CG2-CG1 3.67Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.45Å; I153-G157 PolarHBondContact O-N 3.07Å; I153-L160 HydrophobicContact CD1-CD2 4.1Å
154P96.4Very high96.9Very high71 Ų7163.4 Ų63.446%0.46132%0.319SS..THydrogen-bonded Turntrans-57.6143.5179.4-25.334.9000112.4A152 I156 L288A152-P154 WeakPolarHBondContact O-CD 3.42Å; P154-I156 PolarHBondContact O-N 3.43Å; P154-L288 HydrophobicContact CG-CD2 4.41Å
155Y96.4Very high97Very high229 Ų22963 Ų6390%0.89831%0.314SS*.THydrogen-bonded Turntrans68.8-56.1177.4-45.5-70.1000115.3
156I97.8Very high97Very high105 Ų10562.1 Ų62.154%0.53832%0.317SS..THydrogen-bonded Turntrans-100.3-6.8-170.362.4170.1000114.3I153 P154 T158 D159 L160I153-I156 HydrophobicContact CG2-CD1 4.16Å; I153-I156 HydrophobicContact CG2-CG1 3.67Å; P154-I156 PolarHBondContact O-N 3.43Å; I156-T158 PolarHBondContact O-N 3.38Å; I156-D159 PolarHBondContact O-N 2.82Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 3.13Å
157G97.4Very high97Very high1 Ų161.4 Ų61.41%0.0132%0.32CS..Hα-helixtrans-61.6-46.4-168.800000114.1L150 I153 L160 V161L150-G157 VanDerWaalsContact O-CA 3.29Å; L150-G157 WeakPolarHBondContact O-CA 3.15Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.45Å; I153-G157 PolarHBondContact O-N 3.07Å; G157-L160 PolarHBondContact O-N 2.77Å; G157-V161 WeakPolarHBondContact O-CG2 3.28Å; G157-V161 PolarHBondContact O-N 3.11Å
158T97.1Very high97.1Very high82 Ų8270.4 Ų70.450%0.50335%0.354SS..Hα-helixtrans-64.6-44.9-179.3-54.60000111.6I156 L160 V161 Q162I156-T158 PolarHBondContact O-N 3.38Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 2.99Å; T158-V161 PolarHBondContact O-N 3.38Å; T158-Q162 PolarHBondContact O-N 2.57Å
159D98.2Very high97Very high109 Ų10970.5 Ų70.558%0.58336%0.36SS*.Hα-helixtrans-63.3-40178.3-62.7-18.1000111I156 V161 Q162 W163I156-D159 PolarHBondContact O-N 2.82Å; D159-V161 PolarHBondContact O-N 3.46Å; D159-Q162 PolarHBondContact O-N 3.26Å; D159-W163 WeakPolarHBondContact O-CB 3.25Å; D159-W163 PolarHBondContact O-N 2.87Å
160L97.9Very high97.2Very high55 Ų5569.5 Ų69.529%0.28836%0.355SS..Hα-helixtrans-62.4-42.9176.3-177.464.1000111.9L150 I153 I156 G157 T158 W163 I164L150-L160 HydrophobicContact CB-CD2 4.28Å; L150-L160 HydrophobicContact CD1-CD2 4.22Å; I153-L160 HydrophobicContact CD1-CD2 4.1Å; I156-L160 WeakPolarHBondContact O-CB 3.36Å; I156-L160 PolarHBondContact O-N 3.13Å; G157-L160 PolarHBondContact O-N 2.77Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 2.99Å; L160-W163 HydrophobicContact CD1-CE3 4.19Å; L160-W163 PolarHBondContact O-N 2.89Å; L160-I164 HydrophobicContact CD1-CD1 4.33Å; L160-I164 HydrophobicContact CG-CD1 4.11Å; L160-I164 VanDerWaalsContact O-CG1 3.28Å; L160-I164 WeakPolarHBondContact O-CG1 3.44Å; L160-I164 PolarHBondContact O-N 3.18Å
161V98.1Very high97.3Very high3 Ų370.8 Ų70.82%0.01836%0.362CS..Hα-helixtrans-63.7-49.2177.61710000110.9T147 L150 G157 T158 D159 W163 I164 W165T147-V161 WeakPolarHBondContact O-CG2 3.34Å; L150-V161 HydrophobicContact CB-CG2 3.82Å; G157-V161 WeakPolarHBondContact O-CG2 3.28Å; G157-V161 PolarHBondContact O-N 3.11Å; T158-V161 PolarHBondContact O-N 3.38Å; D159-V161 PolarHBondContact O-N 3.46Å; V161-W163 VanDerWaalsContact C-N 3.28Å; V161-W163 PolarHBondContact O-N 2.88Å; V161-I164 PolarHBondContact O-N 2.74Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.7Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.47Å; V161-W165 VanDerWaalsContact CG1-CH2 3.47Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.62Å; V161-W165 PolarHBondContact O-N 3.17Å
162Q98.1Very high97.3Very high71 Ų7170.5 Ų70.533%0.33236%0.36SS..Hα-helixtrans-64.1-35.5178.5-69.5-178.8-3.200112T158 D159 W165 G166 G167T158-Q162 PolarHBondContact O-N 2.57Å; D159-Q162 PolarHBondContact O-N 3.26Å; Q162-W165 PolarHBondContact O-N 3.42Å; Q162-G166 WeakPolarHBondContact O-CA 3.49Å; Q162-G166 PolarHBondContact O-N 3.28Å; Q162-G167 WeakPolarHBondContact CA-O 3.46Å; Q162-G167 PolarHBondContact O-N 3.12Å
163W98.3Very high97.4Very high187 Ų18772.6 Ų72.671%0.70837%0.372SS*.Hα-helixtrans-64-44.5173.2-179.479.6000111.7D159 L160 V161 W165 G166 R177D159-W163 WeakPolarHBondContact O-CB 3.25Å; D159-W163 PolarHBondContact O-N 2.87Å; L160-W163 HydrophobicContact CD1-CE3 4.19Å; L160-W163 PolarHBondContact O-N 2.89Å; V161-W163 VanDerWaalsContact C-N 3.28Å; V161-W163 PolarHBondContact O-N 2.88Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.03Å; W163-G166 PolarHBondContact O-N 3.19Å; W163-R177 PolarHBondContact O-NH1 3.36Å
164I97.3Very high97.4Very high32 Ų3269.9 Ų69.916%0.16436%0.359CS..Hα-helixtrans-63.2-38.9175.1-71.9167.6000111.2T147 L150 L160 V161 R177 F178T147-I164 HydrophobicContact CG2-CG2 4.4Å; L150-I164 HydrophobicContact CD1-CD1 3.31Å; L160-I164 HydrophobicContact CD1-CD1 4.33Å; L160-I164 HydrophobicContact CG-CD1 4.11Å; L160-I164 VanDerWaalsContact O-CG1 3.28Å; L160-I164 WeakPolarHBondContact O-CG1 3.44Å; L160-I164 PolarHBondContact O-N 3.18Å; V161-I164 PolarHBondContact O-N 2.74Å; I164-R177 WeakPolarHBondContact O-CD 3.25Å; I164-R177 PolarHBondContact O-NE 3.23Å; I164-R177 PolarHBondContact O-NH1 3.48Å; I164-F178 HydrophobicContact CG2-CE1 4.22Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å
165W98.3Very high97.5Very high23 Ų2366.5 Ų66.59%0.08734%0.337CS..Hα-helixtrans-73.7-33.3177.8-66.5-16.4000112.7T147 N148 V161 Q162 W163 G167 Y168 V170 T174T147-W165 PolarHBondContact OG1-NE1 3.44Å; N148-W165 HydrophobicContact CB-CH2 4.28Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.7Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.47Å; V161-W165 VanDerWaalsContact CG1-CH2 3.47Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.62Å; V161-W165 PolarHBondContact O-N 3.17Å; Q162-W165 PolarHBondContact O-N 3.42Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.03Å; W165-G167 VanDerWaalsContact C-N 3.32Å; W165-Y168 VanDerWaalsContact CZ3-O 3.27Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.19Å; W165-V170 HydrophobicContact CD2-CG2 4.4Å; W165-V170 HydrophobicContact CG-CG2 4.37Å; W165-V170 HydrophobicContact CZ2-CG2 4.34Å; W165-T174 WeakPolarHBondContact CA-OG1 3.48Å; W165-T174 PolarHBondContact O-N 3.2Å; W165-T174 PolarHBondContact O-OG1 3.32Å
166G97.4Very high97.6Very high37 Ų3758.6 Ų58.638%0.38131%0.312SS..THydrogen-bonded Turntrans73.927.5-169.200000113Q162 W163Q162-G166 WeakPolarHBondContact O-CA 3.49Å; Q162-G166 PolarHBondContact O-N 3.28Å; W163-G166 PolarHBondContact O-N 3.19Å
167G96.4Very high97.6Very high30 Ų3057 Ų5731%0.30930%0.299SS..SBendtrans171.8-165.6-171.700000110.8Q162 W165Q162-G167 WeakPolarHBondContact CA-O 3.46Å; Q162-G167 PolarHBondContact O-N 3.12Å; W165-G167 VanDerWaalsContact C-N 3.32Å
168Y97.1Very high97.7Very high199 Ų19957.4 Ų57.478%0.7830%0.301SS*.SBendtrans-91-10.7-176.5-59.1-71.4000114.1W165W165-Y168 VanDerWaalsContact CZ3-O 3.27Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.19Å
169S96.4Very high97.8Very high65 Ų6555.6 Ų55.646%0.45529%0.286SS..SBendtrans-150168177.556.80000109.8D171S169-D171 PolarHBondContact O-N 3.31Å
170V97.8Very high97.8Very high3 Ų354.2 Ų54.22%0.01828%0.282CS..SBendtrans-61.6123.2166.8175.40000108.7W135 F140 A143 W165 T174W135-V170 HydrophobicContact CH2-CG1 3.69Å; W135-V170 HydrophobicContact CZ3-CG1 4.04Å; F140-V170 HydrophobicContact CD2-CG1 4.09Å; F140-V170 HydrophobicContact CE2-CB 4.12Å; F140-V170 HydrophobicContact CE2-CG1 4.12Å; F140-V170 VanDerWaalsContact CE2-O 3.29Å; F140-V170 WeakPolarHBondContact CE2-O 3.32Å; A143-V170 HydrophobicContact CB-CG1 4.19Å; A143-V170 HydrophobicContact CB-CG2 4.27Å; W165-V170 HydrophobicContact CD2-CG2 4.4Å; W165-V170 HydrophobicContact CG-CG2 4.37Å; W165-V170 HydrophobicContact CZ2-CG2 4.34Å; V170-T174 HydrophobicContact CG1-CG2 4.21Å
171D97Very high97.8Very high83 Ų8357 Ų5744%0.44429%0.292SS..SBendtrans-157.9-170.5-178.2-161.80.8000110.8S169 P173 T174 L175S169-D171 PolarHBondContact O-N 3.31Å; D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; D171-T174 PolarHBondContact N-OG1 3.45Å; D171-T174 WeakPolarHBondContact O-CA 3.11Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.48Å; D171-T174 PolarHBondContact O-N 2.92Å; D171-L175 PolarHBondContact O-N 2.89Å
172S97Very high97.9Very high23 Ų2358.1 Ų58.116%0.16130%0.297CS..Hα-helixtrans-43.8-47.2178.6-83.60000114D58 A59 T174 L175 T176D58-S172 PolarHBondContact OD2-OG 2.95Å; A59-S172 WeakPolarHBondContact CB-OG 3.32Å; A59-S172 PolarHBondContact N-OG 3.34Å; S172-T174 PolarHBondContact O-N 2.85Å; S172-L175 PolarHBondContact O-N 3.47Å; S172-L175 VanDerWaalsContact O-N 3.09Å; S172-T176 PolarHBondContact O-N 2.87Å; S172-T176 PolarHBondContact O-OG1 3.29Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å
173P98Very high97.9Very high60 Ų6058.6 Ų58.639%0.3930%0.298SS..Hα-helixtrans-58.4-34.9177-2535.2000113.6D171 R177D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; P173-R177 WeakPolarHBondContact O-CG 3.15Å; P173-R177 PolarHBondContact O-N 3.33Å; P173-R177 PolarHBondContact O-NE 3.45Å
174T98.1Very high97.9Very high0 Ų053.6 Ų53.60%028%0.284CS..Hα-helixtrans-71.6-40.4175.8-44.10000111.4W165 V170 D171 S172 R177 F178W165-T174 WeakPolarHBondContact CA-OG1 3.48Å; W165-T174 PolarHBondContact O-N 3.2Å; W165-T174 PolarHBondContact O-OG1 3.32Å; V170-T174 HydrophobicContact CG1-CG2 4.21Å; D171-T174 PolarHBondContact N-OG1 3.45Å; D171-T174 WeakPolarHBondContact O-CA 3.11Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.48Å; D171-T174 PolarHBondContact O-N 2.92Å; S172-T174 PolarHBondContact O-N 2.85Å; T174-R177 WeakPolarHBondContact O-CG 3.47Å; T174-F178 HydrophobicContact CG2-CD1 4.35Å; T174-F178 HydrophobicContact CG2-CD2 4.47Å; T174-F178 HydrophobicContact CG2-CE1 4.07Å; T174-F178 HydrophobicContact CG2-CE2 4.21Å; T174-F178 HydrophobicContact CG2-CZ 4Å; T174-F178 WeakPolarHBondContact O-CB 3.43Å; T174-F178 WeakPolarHBondContact O-CG 3.46Å; T174-F178 PolarHBondContact O-N 3.03Å
175L98.1Very high98Very high0 Ų053.5 Ų53.50%028%0.284CS..Hα-helixtrans-66.6-45.2-179.9-174.955.9000112A62 V132 L133 W135 D171 S172 R177 F178 F179A62-L175 HydrophobicContact CB-CD2 3.55Å; V132-L175 HydrophobicContact CG1-CD1 4.39Å; L133-L175 HydrophobicContact CD2-CD1 3.99Å; W135-L175 HydrophobicContact CD2-CD2 3.85Å; W135-L175 HydrophobicContact CE3-CB 4.25Å; W135-L175 HydrophobicContact CE3-CD1 3.64Å; W135-L175 HydrophobicContact CE3-CD2 3.7Å; W135-L175 HydrophobicContact CE3-CG 4.07Å; W135-L175 HydrophobicContact CG-CD2 4.26Å; W135-L175 HydrophobicContact CH2-CB 4.13Å; W135-L175 HydrophobicContact CZ3-CB 3.8Å; W135-L175 HydrophobicContact CZ3-CD1 3.86Å; W135-L175 HydrophobicContact CZ3-CD2 4.08Å; W135-L175 HydrophobicContact CZ3-CG 4.12Å; D171-L175 PolarHBondContact O-N 2.89Å; S172-L175 PolarHBondContact O-N 3.47Å; S172-L175 VanDerWaalsContact O-N 3.09Å; L175-R177 PolarHBondContact O-N 3.35Å; L175-F178 PolarHBondContact O-N 2.84Å; L175-F179 PolarHBondContact O-N 2.94Å
176T98.4Very high98Very high63 Ų6353.2 Ų53.239%0.38729%0.285SS..Hα-helixtrans-60.8-46.2179.7-51.60000111.9P57 S172 F179 T180P57-T176 PolarHBondContact O-OG1 2.91Å; S172-T176 PolarHBondContact O-N 2.87Å; S172-T176 PolarHBondContact O-OG1 3.29Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å; T176-F179 WeakPolarHBondContact O-CB 3.33Å; T176-F179 PolarHBondContact O-N 3.49Å; T176-T180 PolarHBondContact O-N 2.88Å; T176-T180 PolarHBondContact O-OG1 3.41Å; T176-T180 VanDerWaalsContact O-OG1 3.1Å
177R98.2Very high98.1Very high71 Ų7156 Ų5627%0.26829%0.287SS..Hα-helixtrans-66.7-39176.965.7-174.368-155.4-11.4112.4W163 I164 P173 T174 L175 F179 T180 F181W163-R177 PolarHBondContact O-NH1 3.36Å; I164-R177 WeakPolarHBondContact O-CD 3.25Å; I164-R177 PolarHBondContact O-NE 3.23Å; I164-R177 PolarHBondContact O-NH1 3.48Å; P173-R177 WeakPolarHBondContact O-CG 3.15Å; P173-R177 PolarHBondContact O-N 3.33Å; P173-R177 PolarHBondContact O-NE 3.45Å; T174-R177 WeakPolarHBondContact O-CG 3.47Å; L175-R177 PolarHBondContact O-N 3.35Å; R177-F179 VanDerWaalsContact C-N 3.29Å; R177-F179 PolarHBondContact O-N 3.26Å; R177-T180 PolarHBondContact O-N 2.84Å; R177-T180 VanDerWaalsContact O-N 3.16Å; R177-F181 HydrophobicContact CB-CD2 4.37Å; R177-F181 HydrophobicContact CB-CE2 4.3Å; R177-F181 WeakPolarHBondContact O-CD2 3.23Å; R177-F181 PolarHBondContact O-N 3.23Å
178F98.6Very high98.2Very high10 Ų1058.2 Ų58.24%0.04429%0.291CS..Hα-helixtrans-65.8-37178.7-83.116000110.6F128 M129 V132 L133 T147 I164 T174 L175 H182F128-F178 AromaticContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CZ 4.2Å; F128-F178 HydrophobicContact CZ-CE2 4.48Å; M129-F178 HydrophobicContact CB-CB 4.26Å; M129-F178 HydrophobicContact CB-CD2 4.39Å; M129-F178 HydrophobicContact CB-CG 4.34Å; M129-F178 HydrophobicContact CG-CB 4.33Å; M129-F178 HydrophobicContact CG-CD1 4.2Å; M129-F178 HydrophobicContact CG-CD2 4.02Å; M129-F178 HydrophobicContact CG-CE2 4.38Å; M129-F178 HydrophobicContact CG-CG 3.94Å; M129-F178 HydrophobicContact SD-CD1 4.13Å; M129-F178 HydrophobicContact SD-CG 4.34Å; V132-F178 HydrophobicContact CB-CD2 3.95Å; V132-F178 HydrophobicContact CG1-CD2 3.98Å; V132-F178 HydrophobicContact CG2-CD2 3.89Å; V132-F178 HydrophobicContact CG2-CE2 4.05Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; T147-F178 HydrophobicContact CG2-CZ 4.03Å; I164-F178 HydrophobicContact CG2-CE1 4.22Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å; T174-F178 HydrophobicContact CG2-CD1 4.35Å; T174-F178 HydrophobicContact CG2-CD2 4.47Å; T174-F178 HydrophobicContact CG2-CE1 4.07Å; T174-F178 HydrophobicContact CG2-CE2 4.21Å; T174-F178 HydrophobicContact CG2-CZ 4Å; T174-F178 WeakPolarHBondContact O-CB 3.43Å; T174-F178 WeakPolarHBondContact O-CG 3.46Å; T174-F178 PolarHBondContact O-N 3.03Å; L175-F178 PolarHBondContact O-N 2.84Å; F178-H182 WeakPolarHBondContact O-CB 3.35Å; F178-H182 PolarHBondContact O-N 2.8Å
179F98.8Very high98.3Very high43 Ų4349.1 Ų49.119%0.18926%0.255CS..Hα-helixtrans-59.9-48.9169.3174.3-108.3000111.8A52 Y55 P57 L133 L175 T176 R177 F181 H182 F183A52-F179 HydrophobicContact CB-CE2 4.23Å; A52-F179 HydrophobicContact CB-CZ 4.16Å; Y55-F179 AromaticContact CD1-CD2 3.64Å; Y55-F179 HydrophobicContact CD1-CD2 3.64Å; Y55-F179 AromaticContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CE2 3.66Å; Y55-F179 HydrophobicContact CD1-CG 4.34Å; Y55-F179 HydrophobicContact CD1-CZ 4.37Å; Y55-F179 HydrophobicContact CE1-CB 4.32Å; Y55-F179 AromaticContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CD2 3.59Å; Y55-F179 HydrophobicContact CE1-CE2 4.11Å; Y55-F179 HydrophobicContact CE1-CG 4.03Å; P57-F179 HydrophobicContact CB-CB 3.79Å; P57-F179 HydrophobicContact CB-CD1 3.96Å; P57-F179 HydrophobicContact CB-CG 3.9Å; P57-F179 HydrophobicContact CG-CD1 3.93Å; P57-F179 HydrophobicContact CG-CE1 4.42Å; P57-F179 HydrophobicContact CG-CG 4.37Å; L133-F179 HydrophobicContact CD1-CD2 4.07Å; L133-F179 HydrophobicContact CD2-CB 3.91Å; L175-F179 PolarHBondContact O-N 2.94Å; T176-F179 WeakPolarHBondContact O-CB 3.33Å; T176-F179 PolarHBondContact O-N 3.49Å; R177-F179 VanDerWaalsContact C-N 3.29Å; R177-F179 PolarHBondContact O-N 3.26Å; F179-F181 PolarHBondContact O-N 3.44Å; F179-H182 PolarHBondContact O-N 3.49Å; F179-F183 HydrophobicContact CZ-CD2 4.29Å; F179-F183 WeakPolarHBondContact O-CB 3.49Å; F179-F183 PolarHBondContact O-N 2.91Å
180T98.6Very high98.4Very high81 Ų8148 Ų4850%0.49725%0.25SS..Hα-helixtrans-58.6-46.5178.1-53.70000112.3T176 R177 F183 I184T176-T180 PolarHBondContact O-N 2.88Å; T176-T180 PolarHBondContact O-OG1 3.41Å; T176-T180 VanDerWaalsContact O-OG1 3.1Å; R177-T180 PolarHBondContact O-N 2.84Å; R177-T180 VanDerWaalsContact O-N 3.16Å; T180-F183 PolarHBondContact O-N 2.99Å; T180-I184 WeakPolarHBondContact O-CG2 3.48Å; T180-I184 PolarHBondContact O-N 3.43Å; T180-I184 VanDerWaalsContact O-N 3.11Å
181F98.7Very high98.4Very high112 Ų11251.1 Ų51.149%0.49128%0.277SS..Hα-helixtrans-68-42.2178.4-75-59.1000112.5M129 R177 F179 F183 I184 L185M129-F181 HydrophobicContact CE-CB 3.79Å; M129-F181 HydrophobicContact SD-CB 3.46Å; M129-F181 WeakPolarHBondContact SD-CB 3.37Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.3Å; R177-F181 HydrophobicContact CB-CD2 4.37Å; R177-F181 HydrophobicContact CB-CE2 4.3Å; R177-F181 WeakPolarHBondContact O-CD2 3.23Å; R177-F181 PolarHBondContact O-N 3.23Å; F179-F181 PolarHBondContact O-N 3.44Å; F181-F183 PolarHBondContact O-N 3.05Å; F181-I184 WeakPolarHBondContact O-CG2 3.45Å; F181-I184 PolarHBondContact O-N 3.25Å; F181-L185 WeakPolarHBondContact O-CB 3.47Å; F181-L185 WeakPolarHBondContact O-CG 3.19Å; F181-L185 PolarHBondContact O-N 3.34Å
182H98.8Very high98.5Very high28 Ų2848.8 Ų48.813%0.1326%0.264CS..Hα-helixtrans-61.5-33.9174.818072.4000112H83 T126 M129 G130 L133 F178 F179 P186H83-H182 AromaticContact NE2-NE2 3.94Å; T126-H182 PolarHBondContact O-CE1 3.46Å; T126-H182 PolarHBondContact O-ND1 3.41Å; M129-H182 HydrophobicContact CB-CB 4.1Å; G130-H182 WeakPolarHBondContact CA-CE1 3.35Å; G130-H182 VanDerWaalsContact CA-ND1 3.26Å; G130-H182 WeakPolarHBondContact CA-ND1 3.49Å; G130-H182 PolarHBondContact N-ND1 2.79Å; L133-H182 HydrophobicContact CD1-CB 4.3Å; F178-H182 WeakPolarHBondContact O-CB 3.35Å; F178-H182 PolarHBondContact O-N 2.8Å; F179-H182 PolarHBondContact O-N 3.49Å; H182-P186 WeakPolarHBondContact O-CD 3.42Å; H182-P186 WeakPolarHBondContact O-CG 3.28Å
183F98.8Very high98.6Very high81 Ų8149.1 Ų49.136%0.35527%0.268SS..Hα-helixtrans-72.3-42.9177.5-166.6-84000112.5L49 A52 F179 T180 F181 F187L49-F183 HydrophobicContact CD1-CE2 4.22Å; L49-F183 HydrophobicContact CD1-CZ 3.97Å; A52-F183 HydrophobicContact CB-CD2 4.24Å; A52-F183 HydrophobicContact CB-CE2 3.93Å; F179-F183 HydrophobicContact CZ-CD2 4.29Å; F179-F183 WeakPolarHBondContact O-CB 3.49Å; F179-F183 PolarHBondContact O-N 2.91Å; T180-F183 PolarHBondContact O-N 2.99Å; F181-F183 PolarHBondContact O-N 3.05Å; F183-F187 HydrophobicContact CD1-CE2 4.12Å; F183-F187 AromaticContact CE1-CE2 3.88Å; F183-F187 HydrophobicContact CE1-CE2 3.88Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.42Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.48Å
184I98.8Very high98.6Very high82 Ų8248.3 Ų48.342%0.42127%0.27SS..Hα-helixtrans-79.8-35.1-175.6-168.761.1000113.6T180 F181 F187 I188T180-I184 WeakPolarHBondContact O-CG2 3.48Å; T180-I184 PolarHBondContact O-N 3.43Å; T180-I184 VanDerWaalsContact O-N 3.11Å; F181-I184 WeakPolarHBondContact O-CG2 3.45Å; F181-I184 PolarHBondContact O-N 3.25Å; I184-F187 PolarHBondContact O-N 3.1Å; I184-F187 VanDerWaalsContact O-N 3.13Å; I184-I188 HydrophobicContact CG1-CD1 4.2Å; I184-I188 PolarHBondContact O-N 3.37Å
185L98.7Very high98.6Very high30 Ų3051.4 Ų51.416%0.15729%0.287CS..Hα-helixtrans-59.8-39.3-174.6-81.1178000114.9A125 T126 M129 F181 F187 I188 I189A125-L185 HydrophobicContact CB-CD1 4.13Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 WeakPolarHBondContact OG1-CB 3.38Å; T126-L185 WeakPolarHBondContact OG1-CD1 3.21Å; M129-L185 HydrophobicContact CE-CD1 3.24Å; M129-L185 HydrophobicContact CE-CG 4.46Å; F181-L185 WeakPolarHBondContact O-CB 3.47Å; F181-L185 WeakPolarHBondContact O-CG 3.19Å; F181-L185 PolarHBondContact O-N 3.34Å; L185-F187 PolarHBondContact O-N 2.91Å; L185-I188 HydrophobicContact CD2-CD1 4.16Å; L185-I188 CarbonylContact O-C 3.38Å; L185-I188 WeakPolarHBondContact O-CA 3.47Å; L185-I188 WeakPolarHBondContact O-CB 2.87Å; L185-I188 PolarHBondContact O-N 3.3Å; L185-I189 WeakPolarHBondContact O-CG1 3.26Å; L185-I189 PolarHBondContact O-N 3.41Å
186P98.8Very high98.7Very high17 Ų1752.8 Ų52.811%0.1129%0.293CS..Hα-helixtrans-54.6-34.7174.6-28.934.9000113.9I45 T126 H182 I189 A190I45-P186 HydrophobicContact CD1-CB 4.22Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; T126-P186 HydrophobicContact CG2-CG 3.88Å; H182-P186 WeakPolarHBondContact O-CD 3.42Å; H182-P186 WeakPolarHBondContact O-CG 3.28Å; P186-I189 PolarHBondContact O-N 3.11Å; P186-A190 PolarHBondContact O-N 3.26Å
187F98.7Very high98.6Very high95 Ų9553.8 Ų53.842%0.41730%0.296SS..Hα-helixtrans-74.4-35.7176.3-58.8-76.5000112.1I45 F183 I184 L185 I189 A190 A191I45-F187 HydrophobicContact CG2-CE1 4.01Å; I45-F187 HydrophobicContact CG2-CZ 4.18Å; F183-F187 HydrophobicContact CD1-CE2 4.12Å; F183-F187 AromaticContact CE1-CE2 3.88Å; F183-F187 HydrophobicContact CE1-CE2 3.88Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.42Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.48Å; I184-F187 PolarHBondContact O-N 3.1Å; I184-F187 VanDerWaalsContact O-N 3.13Å; L185-F187 PolarHBondContact O-N 2.91Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.45Å; F187-A190 PolarHBondContact O-N 3.05Å; F187-A191 PolarHBondContact O-N 2.95Å; F187-A191 VanDerWaalsContact O-N 3.07Å
188I98.8Very high98.6Very high77 Ų7755.1 Ų55.140%0.39531%0.307SS..Hα-helixtrans-64.3-42.6171.3-64.6168.2000110I184 L185 A190 A191 L192I184-I188 HydrophobicContact CG1-CD1 4.2Å; I184-I188 PolarHBondContact O-N 3.37Å; L185-I188 HydrophobicContact CD2-CD1 4.16Å; L185-I188 CarbonylContact O-C 3.38Å; L185-I188 WeakPolarHBondContact O-CA 3.47Å; L185-I188 WeakPolarHBondContact O-CB 2.87Å; L185-I188 PolarHBondContact O-N 3.3Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.95Å; I188-A191 PolarHBondContact O-N 3.47Å; I188-L192 HydrophobicContact CG2-CD1 4.04Å; I188-L192 HydrophobicContact CG2-CG 4.41Å; I188-L192 WeakPolarHBondContact O-CG 3.38Å; I188-L192 PolarHBondContact O-N 3.22Å
189I98.9Very high98.6Very high7 Ų758 Ų584%0.03632%0.32CS..Hα-helixtrans-59.4-41.9174-69.3162.6000110.5L41 L119 A122 T126 L185 P186 F187 A191 L192 A193L41-I189 HydrophobicContact CD1-CB 4.37Å; L41-I189 HydrophobicContact CD1-CG2 3.85Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L119-I189 HydrophobicContact CD2-CG2 3.85Å; A122-I189 HydrophobicContact CB-CD1 4.18Å; A122-I189 HydrophobicContact CB-CG1 3.71Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.5Å; L185-I189 WeakPolarHBondContact O-CG1 3.26Å; L185-I189 PolarHBondContact O-N 3.41Å; P186-I189 PolarHBondContact O-N 3.11Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 2.9Å; I189-L192 PolarHBondContact O-N 3.49Å; I189-A193 VanDerWaalsContact O-CB 3.32Å; I189-A193 WeakPolarHBondContact O-CB 3.26Å; I189-A193 PolarHBondContact O-N 3.44Å
190A98.8Very high98.5Very high42 Ų4257.6 Ų57.635%0.34732%0.32SS..Hα-helixtrans-61.4-42.517600000112.4L41 P186 F187 I188 A193 G194L41-A190 HydrophobicContact CD2-CB 3.93Å; P186-A190 PolarHBondContact O-N 3.26Å; F187-A190 WeakPolarHBondContact O-CB 3.45Å; F187-A190 PolarHBondContact O-N 3.05Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 2.95Å; A190-A193 PolarHBondContact O-N 2.97Å; A190-G194 PolarHBondContact O-N 3.12Å
191A98.8Very high98.4Very high69 Ų6957 Ų5757%0.5731%0.311SS*.Hα-helixtrans-64.6-44.617500000112F187 I188 I189 A193 G194 L195F187-A191 PolarHBondContact O-N 2.95Å; F187-A191 VanDerWaalsContact O-N 3.07Å; I188-A191 PolarHBondContact O-N 3.47Å; I189-A191 PolarHBondContact O-N 2.9Å; A191-A193 VanDerWaalsContact C-N 3.31Å; A191-A193 PolarHBondContact O-N 3.01Å; A191-G194 PolarHBondContact O-N 2.97Å; A191-L195 PolarHBondContact O-N 3.38Å
192L98.8Very high98.3Very high33 Ų3358.9 Ų58.917%0.17332%0.321CS..Hα-helixtrans-63.1-35.7175.4-72.2171.1000112.3I118 L119 I188 I189 G194 L195 H196I118-L192 HydrophobicContact CG2-CD1 3.87Å; I118-L192 HydrophobicContact CG2-CD2 4.35Å; L119-L192 HydrophobicContact CD2-CB 3.56Å; L119-L192 HydrophobicContact CG-CB 4.09Å; I188-L192 HydrophobicContact CG2-CD1 4.04Å; I188-L192 HydrophobicContact CG2-CG 4.41Å; I188-L192 WeakPolarHBondContact O-CG 3.38Å; I188-L192 PolarHBondContact O-N 3.22Å; I189-L192 PolarHBondContact O-N 3.49Å; L192-G194 VanDerWaalsContact C-N 3.35Å; L192-L195 PolarHBondContact O-N 3.41Å; L192-H196 WeakPolarHBondContact O-CB 3.35Å; L192-H196 PolarHBondContact O-N 3.41Å
193A98.7Very high98.1Very high30 Ų3060.9 Ų60.925%0.24834%0.336CS..Hα-helixtrans-66.6-37.6174.900000111.4L119 I189 A190 A191 H196 L197L119-A193 HydrophobicContact CD2-CB 4.42Å; I189-A193 VanDerWaalsContact O-CB 3.32Å; I189-A193 WeakPolarHBondContact O-CB 3.26Å; I189-A193 PolarHBondContact O-N 3.44Å; A190-A193 PolarHBondContact O-N 2.97Å; A191-A193 VanDerWaalsContact C-N 3.31Å; A191-A193 PolarHBondContact O-N 3.01Å; A193-H196 WeakPolarHBondContact O-CB 3.48Å; A193-H196 PolarHBondContact O-N 3.47Å; A193-L197 WeakPolarHBondContact O-CG 3.33Å; A193-L197 PolarHBondContact O-N 3.35Å
194G98.3Very high97.9Very high43 Ų4357.5 Ų57.544%0.44332%0.324SS..Hα-helixtrans-59.5-44.8169.600000112.5A190 A191 L192 L197 L198A190-G194 PolarHBondContact O-N 3.12Å; A191-G194 PolarHBondContact O-N 2.97Å; L192-G194 VanDerWaalsContact C-N 3.35Å; G194-L197 PolarHBondContact O-N 3.01Å; G194-L198 PolarHBondContact O-N 3.23Å
195L98.4Very high97.8Very high65 Ų6555 Ų5534%0.3431%0.313SS..Hα-helixtrans-65.3-39.4175.4-177.660.9000112.5I115 A191 L192 L197 L198 F199I115-L195 HydrophobicContact CD1-CD2 3.76Å; I115-L195 HydrophobicContact CD1-CG 4.37Å; I115-L195 HydrophobicContact CG1-CD2 4.33Å; I115-L195 HydrophobicContact CG1-CG 4.4Å; A191-L195 PolarHBondContact O-N 3.38Å; L192-L195 PolarHBondContact O-N 3.41Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.35Å; L195-L198 HydrophobicContact CD1-CD2 4.18Å; L195-L198 WeakPolarHBondContact O-CB 3.14Å; L195-L198 PolarHBondContact O-N 3.14Å; L195-F199 HydrophobicContact CD1-CD2 4.02Å; L195-F199 HydrophobicContact CD1-CE2 3.55Å; L195-F199 HydrophobicContact CD1-CZ 4.22Å; L195-F199 HydrophobicContact CD2-CE2 4.28Å; L195-F199 HydrophobicContact CG-CD2 4.06Å; L195-F199 HydrophobicContact CG-CE2 3.76Å; L195-F199 WeakPolarHBondContact O-CD2 3.43Å; L195-F199 PolarHBondContact O-N 2.92Å; L195-F199 VanDerWaalsContact O-N 3.11Å
196H98.6Very high97.8Very high29 Ų2953.8 Ų53.813%0.13431%0.307CS..Hα-helixtrans-59.8-45.6175.7-174.581.5000111.6T112 I115 L119 L192 A193 L200T112-H196 WeakPolarHBondContact CG2-CE1 3.32Å; T112-H196 PolarHBondContact O-CE1 2.85Å; T112-H196 PolarHBondContact O-ND1 3.06Å; I115-H196 HydrophobicContact CB-CB 4.48Å; I115-H196 HydrophobicContact CG2-CB 3.69Å; L119-H196 HydrophobicContact CD1-CB 3.8Å; L192-H196 WeakPolarHBondContact O-CB 3.35Å; L192-H196 PolarHBondContact O-N 3.41Å; A193-H196 WeakPolarHBondContact O-CB 3.48Å; A193-H196 PolarHBondContact O-N 3.47Å; H196-L200 WeakPolarHBondContact O-CB 3.38Å; H196-L200 PolarHBondContact O-N 2.86Å
197L98.2Very high97.8Very high85 Ų8553.1 Ų53.145%0.44530%0.303SS..Hα-helixtrans-67.8-35.5176.1-71.9177000112.5A193 G194 L195 L200 H201A193-L197 WeakPolarHBondContact O-CG 3.33Å; A193-L197 PolarHBondContact O-N 3.35Å; G194-L197 PolarHBondContact O-N 3.01Å; L195-L197 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.35Å; L197-L200 HydrophobicContact CD2-CD2 4.11Å; L197-L200 PolarHBondContact O-N 3.34Å; L197-H201 WeakPolarHBondContact O-CB 3.35Å; L197-H201 PolarHBondContact O-CD2 3.44Å; L197-H201 PolarHBondContact O-N 2.98Å
198L97.5Very high97.8Very high98 Ų9849.2 Ų49.251%0.51329%0.287SS..Hα-helixtrans-57.9-53.8174.7-177.370.2000110.7G194 L195 L200 H201 E202G194-L198 PolarHBondContact O-N 3.23Å; L195-L198 HydrophobicContact CD1-CD2 4.18Å; L195-L198 WeakPolarHBondContact O-CB 3.14Å; L195-L198 PolarHBondContact O-N 3.14Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 3.06Å; L198-H201 PolarHBondContact O-N 3.12Å; L198-H201 VanDerWaalsContact O-N 3.1Å; L198-E202 PolarHBondContact O-N 2.98Å
199F98.2Very high97.7Very high70 Ų7048.2 Ų48.231%0.30728%0.282SS..Hα-helixtrans-62.4-36.5177.1-74.3-59.6000112.8E111 I115 L195 H201 E202E111-F199 HydrophobicContact CB-CB 4.08Å; E111-F199 HydrophobicContact CB-CD1 3.62Å; E111-F199 HydrophobicContact CB-CD2 4Å; E111-F199 HydrophobicContact CB-CE1 3.97Å; E111-F199 HydrophobicContact CB-CE2 4.31Å; E111-F199 HydrophobicContact CB-CG 3.64Å; E111-F199 HydrophobicContact CB-CZ 4.3Å; E111-F199 HydrophobicContact CG-CD1 4.06Å; E111-F199 HydrophobicContact CG-CE1 4.04Å; I115-F199 HydrophobicContact CG1-CD2 4.02Å; I115-F199 HydrophobicContact CG1-CE2 4.08Å; L195-F199 HydrophobicContact CD1-CD2 4.02Å; L195-F199 HydrophobicContact CD1-CE2 3.55Å; L195-F199 HydrophobicContact CD1-CZ 4.22Å; L195-F199 HydrophobicContact CD2-CE2 4.28Å; L195-F199 HydrophobicContact CG-CD2 4.06Å; L195-F199 HydrophobicContact CG-CE2 3.76Å; L195-F199 WeakPolarHBondContact O-CD2 3.43Å; L195-F199 PolarHBondContact O-N 2.92Å; L195-F199 VanDerWaalsContact O-N 3.11Å; F199-H201 VanDerWaalsContact C-N 3.29Å; F199-H201 PolarHBondContact O-N 3.17Å; F199-E202 WeakPolarHBondContact O-CB 3.44Å; F199-E202 PolarHBondContact O-N 2.87Å
200L97.6Very high97.7Very high35 Ų3548.4 Ų48.418%0.18329%0.286CS..Hα-helixtrans-62.3-37174.6177.964.9000112.1T112 H196 L197 L198 E202 T203 G204T112-L200 HydrophobicContact CG2-CB 4.19Å; T112-L200 HydrophobicContact CG2-CD1 4.5Å; T112-L200 PolarHBondContact OG1-N 2.86Å; H196-L200 WeakPolarHBondContact O-CB 3.38Å; H196-L200 PolarHBondContact O-N 2.86Å; L197-L200 HydrophobicContact CD2-CD2 4.11Å; L197-L200 PolarHBondContact O-N 3.34Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 3.06Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-T203 PolarHBondContact O-N 3.29Å; L200-T203 PolarHBondContact O-OG1 3.08Å; L200-G204 CarbonylContact O-C 3.58Å; L200-G204 VanDerWaalsContact O-CA 3.25Å; L200-G204 WeakPolarHBondContact O-CA 3.47Å; L200-G204 PolarHBondContact O-N 3.44Å
201H96.3Very high97.6Very high68 Ų6851.4 Ų51.432%0.31530%0.295SS..Hα-helixtrans-74.3-21.9-179-69.6170.8000113.3L197 L198 F199L197-H201 WeakPolarHBondContact O-CB 3.35Å; L197-H201 PolarHBondContact O-CD2 3.44Å; L197-H201 PolarHBondContact O-N 2.98Å; L198-H201 PolarHBondContact O-N 3.12Å; L198-H201 VanDerWaalsContact O-N 3.1Å; F199-H201 VanDerWaalsContact C-N 3.29Å; F199-H201 PolarHBondContact O-N 3.17Å
202E95.7Very high97.5Very high152 Ų15252.8 Ų52.871%0.7130%0.297SS*.Hα-helixtrans-63-42172.5-66.6-60.7133.500111.7L198 F199 L200L198-E202 PolarHBondContact O-N 2.98Å; F199-E202 WeakPolarHBondContact O-CB 3.44Å; F199-E202 PolarHBondContact O-N 2.87Å; L200-E202 VanDerWaalsContact C-N 3.33Å
203T94.1Very high97.4Very high70 Ų7052 Ų5243%0.42929%0.294SS..Hα-helixtrans-94.2-27.2179.560.80000113.1Y109 L200Y109-T203 HydrophobicContact CD1-CG2 4.1Å; Y109-T203 HydrophobicContact CE1-CG2 4.38Å; L200-T203 PolarHBondContact O-N 3.29Å; L200-T203 PolarHBondContact O-OG1 3.08Å
204G95.3Very high97.2Very high11 Ų1157.5 Ų57.511%0.11331%0.314CS..  trans76.2172.8-161.700000112.6L200L200-G204 CarbonylContact O-C 3.58Å; L200-G204 VanDerWaalsContact O-CA 3.25Å; L200-G204 WeakPolarHBondContact O-CA 3.47Å; L200-G204 PolarHBondContact O-N 3.44Å
205S97.2Very high97.1Very high28 Ų2861.1 Ų61.120%0.19633%0.333CS..  trans-69.3140.7178.9-73.40000112.7P24P24-S205 VanDerWaalsContact CG-O 3.26Å; P24-S205 WeakPolarHBondContact CG-O 3.44Å
206N98Very high97.1Very high5 Ų562 Ų623%0.02734%0.338CS..  trans-65.1173.6160-173.321.3000110.2I27 W31 Y104 S106 Y109 Q313I27-N206 WeakPolarHBondContact CG2-O 3.4Å; W31-N206 VanDerWaalsContact CE2-O 3.28Å; W31-N206 HydrophobicContact CZ2-CB 4.28Å; W31-N206 VanDerWaalsContact CZ2-O 3.26Å; W31-N206 WeakPolarHBondContact CZ2-O 3.45Å; W31-N206 PolarHBondContact NE1-O 3.29Å; Y104-N206 PolarHBondContact O-ND2 3.19Å; S106-N206 PolarHBondContact OG-ND2 3.4Å; Y109-N206 HydrophobicContact CE2-CB 3.64Å; N206-Q313 PolarHBondContact ND2-NE2 3.5Å
207N98.6Very high97Very high4 Ų463.9 Ų63.92%0.02135%0.346CS..  trans-140.4166.7175.570.485.9000112.7P24 N26 I27 L209 G210 I211P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.18Å; N26-N207 PolarHBondContact ND2-OD1 3.06Å; N26-N207 WeakPolarHBondContact OD1-CB 3.42Å; I27-N207 HydrophobicContact CG2-CB 4.11Å; N207-L209 PolarHBondContact O-N 2.78Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 3.48Å; N207-L209 PolarHBondContact OD1-N 2.59Å; N207-L209 VanDerWaalsContact OD1-N 3.13Å; N207-G210 PolarHBondContact O-N 3.48Å; N207-I211 PolarHBondContact ND2-O 2.98Å
208P98.6Very high97Very high13 Ų1361.8 Ų61.88%0.08434%0.335CS..THydrogen-bonded Turntrans-56.4-32-173.7-30.237.5000115.6N26 W31 Y104 G210 S314 M316N26-P208 VanDerWaalsContact O-CD 3.26Å; N26-P208 WeakPolarHBondContact O-CD 3.37Å; N26-P208 WeakPolarHBondContact O-CG 3.43Å; W31-P208 HydrophobicContact CH2-CG 4.09Å; W31-P208 HydrophobicContact CZ3-CG 3.82Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.2Å; Y104-P208 WeakPolarHBondContact CD1-O 3.4Å; Y104-P208 VanDerWaalsContact CE1-CA 3.48Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.46Å; P208-S314 WeakPolarHBondContact O-CB 3.17Å; P208-S314 PolarHBondContact O-OG 3.03Å; P208-M316 HydrophobicContact CB-SD 4.27Å
209L98.2Very high97Very high55 Ų5560.1 Ų60.129%0.28833%0.328SS..THydrogen-bonded Turntrans-76.2-18.7-178.2-59.9171.5000112.4N26 N207 I211 M316 F317N26-L209 WeakPolarHBondContact ND2-CD1 3.37Å; N207-L209 PolarHBondContact O-N 2.78Å; N207-L209 VanDerWaalsContact O-N 3.12Å; N207-L209 WeakPolarHBondContact OD1-CB 3.48Å; N207-L209 PolarHBondContact OD1-N 2.59Å; N207-L209 VanDerWaalsContact OD1-N 3.13Å; L209-I211 HydrophobicContact CB-CD1 4.23Å; L209-I211 HydrophobicContact CB-CG1 3.81Å; L209-I211 HydrophobicContact CD1-CD1 4.12Å; L209-I211 HydrophobicContact CD1-CG1 4.41Å; L209-I211 PolarHBondContact O-N 2.78Å; L209-M316 HydrophobicContact CD2-CE 3.84Å; L209-M316 HydrophobicContact CD2-SD 3.7Å; L209-F317 HydrophobicContact CD2-CE2 3.99Å; L209-F317 HydrophobicContact CD2-CZ 3.65Å
210G97.3Very high97.1Very high12 Ų1258.3 Ų58.312%0.12432%0.321CS..  trans63.727.8-177.200000113.7N207 P208N207-G210 PolarHBondContact O-N 3.48Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.46Å
211I96.8Very high97.1Very high104 Ų10461.1 Ų61.153%0.53333%0.332SS..SBendtrans-117.7163.7173.861.5174.6000109.9N207 L209 S213N207-I211 PolarHBondContact ND2-O 2.98Å; L209-I211 HydrophobicContact CB-CD1 4.23Å; L209-I211 HydrophobicContact CB-CG1 3.81Å; L209-I211 HydrophobicContact CD1-CD1 4.12Å; L209-I211 HydrophobicContact CD1-CG1 4.41Å; L209-I211 PolarHBondContact O-N 2.78Å; I211-S213 PolarHBondContact O-N 3.07Å
212T96.8Very high97.2Very high99 Ų9961 Ų6161%0.60734%0.338SS*.  trans-57.1133174.4175.30000111.6H214T212-H214 PolarHBondContact OG1-CD2 3.44Å; T212-H214 PolarHBondContact OG1-N 3.5Å
213S96.6Very high97.3Very high16 Ų1660.1 Ų60.111%0.11233%0.329CS..  trans-105.412.6177.180.30000112.7P24 I211 S215 D216 K217P24-S213 WeakPolarHBondContact CB-OG 3.39Å; P24-S213 WeakPolarHBondContact CG-OG 3.22Å; I211-S213 PolarHBondContact O-N 3.07Å; S213-S215 PolarHBondContact O-N 2.92Å; S213-D216 CarbonylContact O-C 3.54Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 3.42Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.37Å
214H95.3Very high97.5Very high146 Ų14657.2 Ų57.268%0.67631%0.31SS*.THydrogen-bonded Turntrans-59.2-30-175.8-74.7-63.8000113.3T212 D216T212-H214 PolarHBondContact OG1-CD2 3.44Å; T212-H214 PolarHBondContact OG1-N 3.5Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 3.45Å
215S96.4Very high97.6Very high119 Ų11959.5 Ų59.583%0.83232%0.322SS*.THydrogen-bonded Turntrans-71-19.917755.20000113.8S213S213-S215 PolarHBondContact O-N 2.92Å
216D97.4Very high97.7Very high84 Ų8463.9 Ų63.945%0.44934%0.342SS..SBendtrans-146.182.8-177.2-172.918.4000111.3S25 S213 H214S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.39Å; S25-D216 PolarHBondContact N-O 3Å; S25-D216 PolarHBondContact OG-OD2 3.38Å; S213-D216 CarbonylContact O-C 3.54Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 3.42Å; H214-D216 VanDerWaalsContact C-N 3.27Å; H214-D216 PolarHBondContact O-N 3.45Å
217K97.9Very high97.7Very high68 Ų6866 Ų6630%0.29635%0.351SS..EExtended strand (participates in β ladder)trans-112.8139.8170.2-64.4-165.5176.9-171.40109.9P22 T23 S213P22-K217 HydrophobicContact CB-CB 4.14Å; P22-K217 HydrophobicContact CB-CD 3.63Å; T23-K217 WeakPolarHBondContact O-CA 3.4Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.37Å
218I98.3Very high97.7Very high41 Ų4167.4 Ų67.421%0.2136%0.358CS..EExtended strand (participates in β ladder)trans-111158.1170.762.7-178.3000109.4T23 Y223 Y224T23-I218 PolarHBondContact N-O 2.87Å; T23-I218 PolarHBondContact O-N 2.69Å; I218-Y223 HydrophobicContact CB-CD2 4.05Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.32Å; I218-Y223 HydrophobicContact CD1-CD2 3.83Å; I218-Y223 HydrophobicContact CD1-CE2 4.5Å; I218-Y223 HydrophobicContact CD1-CG 3.72Å; I218-Y223 HydrophobicContact CG1-CD2 4.18Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.5Å; I218-Y224 HydrophobicContact CG1-CE2 3.74Å
219T97.6Very high97.7Very high62 Ų6269.2 Ų69.238%0.3837%0.374SS..EExtended strand (participates in β ladder)trans-68.3145.8172.850.40000110.4H221 Y223T219-H221 WeakPolarHBondContact CB-O 3.27Å; T219-H221 PolarHBondContact O-N 3.27Å; T219-H221 PolarHBondContact OG1-O 3.08Å; T219-Y223 WeakPolarHBondContact O-CD2 3.35Å
220F98.4Very high97.8Very high33 Ų3371.4 Ų71.415%0.14539%0.386CS..SBendtrans-59.8-46.5178-171.3-81.3000111.9L18 I19 L21 P222 Y223 Y224 T225L18-F220 WeakPolarHBondContact O-CD1 3.49Å; I19-F220 PolarHBondContact O-N 3.4Å; L21-F220 HydrophobicContact CB-CB 3.94Å; L21-F220 HydrophobicContact CD2-CD2 4.24Å; L21-F220 PolarHBondContact O-N 3.48Å; F220-P222 CarbonylContact O-C 3.59Å; F220-Y223 PolarHBondContact O-N 3.27Å; F220-Y224 VanDerWaalsContact CD2-CB 3.5Å; F220-Y224 HydrophobicContact CD2-CD2 4.25Å; F220-Y224 HydrophobicContact CD2-CG 4.19Å; F220-Y224 HydrophobicContact CE2-CG 4.28Å; F220-Y224 WeakPolarHBondContact O-CA 3.49Å; F220-Y224 PolarHBondContact O-N 3.47Å; F220-T225 PolarHBondContact O-N 3.31Å
221H98.1Very high97.8Very high93 Ų9371.4 Ų71.443%0.43139%0.386SS..THydrogen-bonded Turntrans-88.7134170.7-172.874.5000110.7I19 T219 T225I19-H221 HydrophobicContact CB-CB 4.5Å; I19-H221 HydrophobicContact CG2-CB 4.07Å; I19-H221 PolarHBondContact O-N 3.21Å; T219-H221 WeakPolarHBondContact CB-O 3.27Å; T219-H221 PolarHBondContact O-N 3.27Å; T219-H221 PolarHBondContact OG1-O 3.08Å; H221-T225 PolarHBondContact ND1-OG1 2.71Å; H221-T225 VanDerWaalsContact ND1-OG1 3.13Å
222P98.1Very high97.9Very high67 Ų6769.6 Ų69.644%0.43538%0.377SS..THydrogen-bonded Turncis-89.6-13.81.335.4-35.4000114.7F220 Y224 T225 I226F220-P222 CarbonylContact O-C 3.59Å; P222-Y224 PolarHBondContact O-N 2.88Å; P222-T225 PolarHBondContact O-N 2.75Å; P222-I226 WeakPolarHBondContact O-CG2 3.36Å; P222-I226 PolarHBondContact O-N 2.92Å
223Y98.6Very high98Very high132 Ų13270.2 Ų70.252%0.51838%0.376SS..Hα-helixtrans-58.6-52.8-164.4-62-76.1000114.2I218 T219 F220 I226 K227I218-Y223 HydrophobicContact CB-CD2 4.05Å; I218-Y223 HydrophobicContact CB-CE2 4.2Å; I218-Y223 HydrophobicContact CD1-CD1 4.32Å; I218-Y223 HydrophobicContact CD1-CD2 3.83Å; I218-Y223 HydrophobicContact CD1-CE2 4.5Å; I218-Y223 HydrophobicContact CD1-CG 3.72Å; I218-Y223 HydrophobicContact CG1-CD2 4.18Å; T219-Y223 WeakPolarHBondContact O-CD2 3.35Å; F220-Y223 PolarHBondContact O-N 3.27Å; Y223-I226 VanDerWaalsContact O-CG2 3.3Å; Y223-I226 WeakPolarHBondContact O-CG2 3.34Å; Y223-K227 WeakPolarHBondContact O-CB 3.32Å; Y223-K227 PolarHBondContact O-N 3.46Å
224Y98.4Very high98.1Very high10 Ų1074.3 Ų74.34%0.03940%0.396CS..Hα-helixtrans-83.6-25.5-179.9-67-60.5000112.3T23 P24 S25 I27 I218 F220 P222 K227 D228T23-Y224 HydrophobicContact CG2-CD2 3.49Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.49Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.31Å; P24-Y224 PolarHBondContact O-OH 3.39Å; S25-Y224 VanDerWaalsContact C-OH 3.28Å; S25-Y224 PolarHBondContact O-OH 2.92Å; I27-Y224 HydrophobicContact CD1-CD1 3.77Å; I27-Y224 HydrophobicContact CD1-CD2 4.48Å; I27-Y224 HydrophobicContact CD1-CE1 3.47Å; I27-Y224 VanDerWaalsContact CD1-CE1 3.47Å; I27-Y224 HydrophobicContact CD1-CE2 4.16Å; I27-Y224 HydrophobicContact CD1-CG 4.3Å; I27-Y224 HydrophobicContact CG1-CD1 4.07Å; I27-Y224 HydrophobicContact CG1-CE1 3.24Å; I27-Y224 HydrophobicContact CG1-CE2 4.14Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.46Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.5Å; I218-Y224 HydrophobicContact CG1-CE2 3.74Å; F220-Y224 VanDerWaalsContact CD2-CB 3.5Å; F220-Y224 HydrophobicContact CD2-CD2 4.25Å; F220-Y224 HydrophobicContact CD2-CG 4.19Å; F220-Y224 HydrophobicContact CE2-CG 4.28Å; F220-Y224 WeakPolarHBondContact O-CA 3.49Å; F220-Y224 PolarHBondContact O-N 3.47Å; P222-Y224 PolarHBondContact O-N 2.88Å; Y224-K227 HydrophobicContact CD1-CD 3.92Å; Y224-K227 HydrophobicContact CE1-CD 4.02Å; Y224-K227 PolarHBondContact O-N 3.18Å; Y224-D228 WeakPolarHBondContact O-CB 3.37Å; Y224-D228 VanDerWaalsContact O-CG 3.28Å; Y224-D228 PolarHBondContact O-N 2.81Å
225T98.4Very high98.3Very high58 Ų5867.9 Ų67.936%0.35637%0.366SS..Hα-helixtrans-59.3-48.5169.6-45.60000111.8F220 H221 P222 A229F220-T225 PolarHBondContact O-N 3.31Å; H221-T225 PolarHBondContact ND1-OG1 2.71Å; H221-T225 VanDerWaalsContact ND1-OG1 3.13Å; P222-T225 PolarHBondContact O-N 2.75Å; T225-A229 WeakPolarHBondContact O-CB 3.39Å; T225-A229 PolarHBondContact O-N 2.8Å
226I98.5Very high98.4Very high120 Ų12065.7 Ų65.762%0.61535%0.345SS*.Hα-helixtrans-71.4-37-179.6-167.961.4000111.9P222 Y223 A229 L230P222-I226 WeakPolarHBondContact O-CG2 3.36Å; P222-I226 PolarHBondContact O-N 2.92Å; Y223-I226 VanDerWaalsContact O-CG2 3.3Å; Y223-I226 WeakPolarHBondContact O-CG2 3.34Å; I226-A229 PolarHBondContact O-N 3.37Å; I226-L230 PolarHBondContact O-N 3.49Å
227K98.6Very high98.5Very high51 Ų5167 Ų6722%0.22235%0.351CS..Hα-helixtrans-64.8-40.8175.9-174.4-177.3164.9-146.90111.7I27 S28 N32 Y223 Y224 L230 G231I27-K227 PolarHBondContact O-NZ 2.99Å; S28-K227 VanDerWaalsContact C-NZ 3.27Å; S28-K227 PolarHBondContact O-NZ 2.76Å; N32-K227 PolarHBondContact ND2-O 2.7Å; N32-K227 WeakPolarHBondContact OD1-CE 3.4Å; N32-K227 PolarHBondContact OD1-NZ 3.46Å; Y223-K227 WeakPolarHBondContact O-CB 3.32Å; Y223-K227 PolarHBondContact O-N 3.46Å; Y224-K227 HydrophobicContact CD1-CD 3.92Å; Y224-K227 HydrophobicContact CE1-CD 4.02Å; Y224-K227 PolarHBondContact O-N 3.18Å; K227-L230 PolarHBondContact O-N 2.72Å; K227-G231 PolarHBondContact O-N 3.21Å
228D98.6Very high98.5Very high32 Ų3266.1 Ų66.117%0.17135%0.354CS..Hα-helixtrans-70.2-37.1176.8-78.210.4000111.6N32 S35 Y224 L230 G231 L232N32-D228 PolarHBondContact ND2-OD1 3.31Å; S35-D228 WeakPolarHBondContact CB-OD2 3.37Å; S35-D228 PolarHBondContact OG-OD2 3.46Å; Y224-D228 WeakPolarHBondContact O-CB 3.37Å; Y224-D228 VanDerWaalsContact O-CG 3.28Å; Y224-D228 PolarHBondContact O-N 2.81Å; D228-L230 VanDerWaalsContact C-N 3.32Å; D228-L230 PolarHBondContact O-N 3.42Å; D228-G231 PolarHBondContact O-N 3.43Å; D228-L232 WeakPolarHBondContact O-CB 3.43Å; D228-L232 PolarHBondContact O-N 3.44Å
229A98.7Very high98.5Very high51 Ų5164.1 Ų64.142%0.42134%0.344SS..Hα-helixtrans-60.6-40.6172.300000112.2T225 I226 L232 L233T225-A229 WeakPolarHBondContact O-CB 3.39Å; T225-A229 PolarHBondContact O-N 2.8Å; I226-A229 PolarHBondContact O-N 3.37Å; A229-L232 PolarHBondContact O-N 2.8Å; A229-L233 PolarHBondContact O-N 3.38Å
230L98.7Very high98.6Very high102 Ų10264.2 Ų64.253%0.53434%0.34SS..Hα-helixtrans-63.2-45.4172.7176.562.3000111.6I226 K227 D228 L232 L233 L234I226-L230 PolarHBondContact O-N 3.49Å; K227-L230 PolarHBondContact O-N 2.72Å; D228-L230 VanDerWaalsContact C-N 3.32Å; D228-L230 PolarHBondContact O-N 3.42Å; L230-L232 VanDerWaalsContact C-N 3.3Å; L230-L232 PolarHBondContact O-N 2.68Å; L230-L233 PolarHBondContact O-N 3.33Å; L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 2.8Å; L230-L234 VanDerWaalsContact O-N 3.09Å
231G98.7Very high98.6Very high12 Ų1265.8 Ų65.812%0.12435%0.353CS..Hα-helixtrans-57.6-43.9175.200000112.2K227 D228 L234 F235K227-G231 PolarHBondContact O-N 3.21Å; D228-G231 PolarHBondContact O-N 3.43Å; G231-L234 PolarHBondContact O-N 2.89Å; G231-F235 WeakPolarHBondContact O-CB 3.5Å; G231-F235 PolarHBondContact O-N 3.04Å
232L98.8Very high98.6Very high65 Ų6562.2 Ų62.234%0.3434%0.337SS..Hα-helixtrans-64-40.5177.1-178.262000112L36 A39 D228 A229 L230 F235 L236L36-L232 HydrophobicContact CD2-CB 4.47Å; L36-L232 HydrophobicContact CD2-CD1 4.47Å; A39-L232 HydrophobicContact CB-CD1 3.69Å; D228-L232 WeakPolarHBondContact O-CB 3.43Å; D228-L232 PolarHBondContact O-N 3.44Å; A229-L232 PolarHBondContact O-N 2.8Å; L230-L232 VanDerWaalsContact C-N 3.3Å; L230-L232 PolarHBondContact O-N 2.68Å; L232-F235 HydrophobicContact CD1-CD1 4.17Å; L232-F235 WeakPolarHBondContact O-CB 3.02Å; L232-F235 PolarHBondContact O-N 3.19Å; L232-L236 HydrophobicContact CD1-CD1 4.32Å; L232-L236 HydrophobicContact CD1-CG 4.19Å; L232-L236 HydrophobicContact CG-CD1 4.1Å; L232-L236 HydrophobicContact CG-CG 4.39Å; L232-L236 WeakPolarHBondContact O-CB 3.45Å; L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 3.41Å; L232-L236 PolarHBondContact O-N 3.48Å
233L98.8Very high98.6Very high112 Ų11259.1 Ų59.159%0.58632%0.316SS*.Hα-helixtrans-60.4-46.2176.1178.764.8000111.6A229 L230 L236 L237A229-L233 PolarHBondContact O-N 3.38Å; L230-L233 PolarHBondContact O-N 3.33Å; L233-L236 PolarHBondContact O-N 3.06Å; L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 PolarHBondContact O-N 3.09Å
234L98.7Very high98.6Very high103 Ų10356.7 Ų56.754%0.53931%0.312SS..Hα-helixtrans-65.4-40.7177.7-66176.3000111.8L230 G231 L237 S238L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 2.8Å; L230-L234 VanDerWaalsContact O-N 3.09Å; G231-L234 PolarHBondContact O-N 2.89Å; L234-L237 PolarHBondContact O-N 3.32Å; L234-S238 PolarHBondContact O-N 3.44Å; L234-S238 PolarHBondContact O-OG 3.14Å
235F98.6Very high98.6Very high10 Ų1064.1 Ų64.14%0.04435%0.345CS..Hα-helixtrans-57.7-52.6173.1168.8-90.8000111.3L36 C40 M89 G231 L232 L237 S238 L239L36-F235 HydrophobicContact CD1-CB 4.45Å; L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.43Å; L36-F235 HydrophobicContact CD2-CG 4.04Å; C40-F235 WeakPolarHBondContact SG-CE2 3.32Å; C40-F235 WeakPolarHBondContact SG-CZ 3.38Å; M89-F235 HydrophobicContact CB-CE2 3.71Å; M89-F235 HydrophobicContact CB-CZ 4.09Å; M89-F235 HydrophobicContact CE-CD2 3.9Å; M89-F235 HydrophobicContact CE-CE2 3.96Å; M89-F235 HydrophobicContact CG-CE2 4.42Å; G231-F235 WeakPolarHBondContact O-CB 3.5Å; G231-F235 PolarHBondContact O-N 3.04Å; L232-F235 HydrophobicContact CD1-CD1 4.17Å; L232-F235 WeakPolarHBondContact O-CB 3.02Å; L232-F235 PolarHBondContact O-N 3.19Å; F235-L237 VanDerWaalsContact C-N 3.32Å; F235-L237 PolarHBondContact O-N 2.96Å; F235-S238 PolarHBondContact O-N 3.28Å; F235-S238 VanDerWaalsContact O-N 3.17Å; F235-S238 PolarHBondContact O-OG 3.12Å; F235-L239 HydrophobicContact CE1-CD2 4.09Å; F235-L239 HydrophobicContact CZ-CD2 4.31Å; F235-L239 PolarHBondContact O-N 3.42Å
236L98.6Very high98.6Very high74 Ų7463.4 Ų63.439%0.38734%0.342SS..Hα-helixtrans-62.4-40.3179.7-70.9174000111.4L232 L233 S238 L239 M240L232-L236 HydrophobicContact CD1-CD1 4.32Å; L232-L236 HydrophobicContact CD1-CG 4.19Å; L232-L236 HydrophobicContact CG-CD1 4.1Å; L232-L236 HydrophobicContact CG-CG 4.39Å; L232-L236 WeakPolarHBondContact O-CB 3.45Å; L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 3.41Å; L232-L236 PolarHBondContact O-N 3.48Å; L233-L236 PolarHBondContact O-N 3.06Å; L236-S238 VanDerWaalsContact C-N 3.34Å; L236-S238 PolarHBondContact O-N 3.09Å; L236-L239 PolarHBondContact O-N 2.69Å; L236-M240 VanDerWaalsContact O-CB 3.25Å; L236-M240 WeakPolarHBondContact O-CB 3.17Å; L236-M240 WeakPolarHBondContact O-CG 3.4Å; L236-M240 PolarHBondContact O-N 3.34Å
237L98.7Very high98.6Very high110 Ų11059.3 Ų59.358%0.57632%0.323SS*.Hα-helixtrans-57.8-47.3174.5-179.664000111.2L233 L234 F235 T241L233-L237 WeakPolarHBondContact O-CB 3.48Å; L233-L237 PolarHBondContact O-N 3.09Å; L234-L237 PolarHBondContact O-N 3.32Å; F235-L237 VanDerWaalsContact C-N 3.32Å; F235-L237 PolarHBondContact O-N 2.96Å; L237-T241 WeakPolarHBondContact O-CB 2.94Å; L237-T241 PolarHBondContact O-N 3.48Å; L237-T241 PolarHBondContact O-OG1 3.06Å
238S98.5Very high98.6Very high50 Ų5060.3 Ų60.335%0.3533%0.331SS..Hα-helixtrans-64.3-45.6178.6680000112.7M89 L234 F235 L236 T241 L242M89-S238 WeakPolarHBondContact CE-OG 3Å; L234-S238 PolarHBondContact O-N 3.44Å; L234-S238 PolarHBondContact O-OG 3.14Å; F235-S238 PolarHBondContact O-N 3.28Å; F235-S238 VanDerWaalsContact O-N 3.17Å; F235-S238 PolarHBondContact O-OG 3.12Å; L236-S238 VanDerWaalsContact C-N 3.34Å; L236-S238 PolarHBondContact O-N 3.09Å; S238-T241 PolarHBondContact O-N 2.99Å; S238-L242 PolarHBondContact O-N 2.84Å
239L98.8Very high98.6Very high0 Ų064.7 Ų64.70%035%0.354CS..Hα-helixtrans-62.9-45.1178173.764000111.6L43 L82 N85 M89 F235 L236 L242 T243L43-L239 HydrophobicContact CD2-CD2 3.42Å; L43-L239 VanDerWaalsContact CD2-CD2 3.42Å; L82-L239 HydrophobicContact CD2-CD2 3.92Å; L82-L239 HydrophobicContact CD2-CG 4.03Å; N85-L239 HydrophobicContact CB-CD1 3.91Å; M89-L239 HydrophobicContact CG-CB 4.38Å; M89-L239 HydrophobicContact CG-CD1 3.93Å; F235-L239 HydrophobicContact CE1-CD2 4.09Å; F235-L239 HydrophobicContact CZ-CD2 4.31Å; F235-L239 PolarHBondContact O-N 3.42Å; L236-L239 PolarHBondContact O-N 2.69Å; L239-L242 PolarHBondContact O-N 3.4Å; L239-T243 WeakPolarHBondContact O-CB 3.39Å; L239-T243 PolarHBondContact O-N 3.47Å; L239-T243 PolarHBondContact O-OG1 3.1Å
240M98.6Very high98.5Very high63 Ų6365 Ų6531%0.3135%0.348SS..Hα-helixtrans-67.8-37.3178.9-68.7-56.9-60.200111.3I78 L82 L236 T243 L244I78-M240 HydrophobicContact CD1-CE 4.25Å; L82-M240 HydrophobicContact CD2-SD 3.84Å; L236-M240 VanDerWaalsContact O-CB 3.25Å; L236-M240 WeakPolarHBondContact O-CB 3.17Å; L236-M240 WeakPolarHBondContact O-CG 3.4Å; L236-M240 PolarHBondContact O-N 3.34Å; M240-T243 PolarHBondContact O-N 3.31Å; M240-L244 HydrophobicContact CE-CD1 3.69Å; M240-L244 HydrophobicContact CE-CD2 4.23Å; M240-L244 HydrophobicContact CE-CG 3.94Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.5Å; M240-L244 VanDerWaalsContact O-CG 3.25Å; M240-L244 WeakPolarHBondContact O-CG 3.41Å; M240-L244 PolarHBondContact O-N 2.99Å
241T98.7Very high98.4Very high66 Ų6662.1 Ų62.141%0.40534%0.344SS..Hα-helixtrans-61.2-49.1175.1-57.10000110.5L237 S238 F245L237-T241 WeakPolarHBondContact O-CB 2.94Å; L237-T241 PolarHBondContact O-N 3.48Å; L237-T241 PolarHBondContact O-OG1 3.06Å; S238-T241 PolarHBondContact O-N 2.99Å; T241-F245 HydrophobicContact CG2-CD2 4.07Å; T241-F245 WeakPolarHBondContact O-CB 3.39Å; T241-F245 WeakPolarHBondContact O-CD2 3.47Å; T241-F245 PolarHBondContact O-N 2.66Å
242L98.5Very high98.3Very high19 Ų1962.5 Ų62.510%0.09934%0.343CS..Hα-helixtrans-59.7-48.7175.917861.9000111.3N85 S238 L239 L244 S246 P247 L249 L250N85-L242 HydrophobicContact CB-CD2 3.76Å; N85-L242 HydrophobicContact CB-CG 4.14Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.45Å; S238-L242 PolarHBondContact O-N 2.84Å; L239-L242 PolarHBondContact O-N 3.4Å; L242-L244 PolarHBondContact O-N 3.43Å; L242-S246 WeakPolarHBondContact CD1-O 3.34Å; L242-S246 CarbonylContact O-C 2.91Å; L242-S246 WeakPolarHBondContact O-CA 3.42Å; L242-S246 PolarHBondContact O-N 2.91Å; L242-P247 WeakPolarHBondContact O-CA 3.37Å; L242-L249 HydrophobicContact CD1-CB 3.98Å; L242-L249 HydrophobicContact CD1-CD2 4.11Å; L242-L250 HydrophobicContact CD1-CG 4.39Å; L242-L250 HydrophobicContact CD2-CD1 3.68Å; L242-L250 HydrophobicContact CD2-CG 4.36Å
243T98.3Very high98.2Very high1 Ų163.9 Ų63.91%0.00636%0.355CS..Hα-helixtrans-67.5-36.9-175.2-61.70000113.4I78 L82 L239 M240 P247I78-T243 HydrophobicContact CG1-CG2 4.27Å; L82-T243 HydrophobicContact CD2-CG2 4.21Å; L82-T243 HydrophobicContact CG-CG2 4.19Å; L239-T243 WeakPolarHBondContact O-CB 3.39Å; L239-T243 PolarHBondContact O-N 3.47Å; L239-T243 PolarHBondContact O-OG1 3.1Å; M240-T243 PolarHBondContact O-N 3.31Å; T243-P247 WeakPolarHBondContact O-CB 3.32Å
244L98.6Very high98.1Very high81 Ų8161.1 Ų61.142%0.42434%0.341SS..Hα-helixtrans-90.9-34.1-174.8-64.2177.9000113.1W77 I78 M240 L242W77-L244 HydrophobicContact CH2-CD2 3.9Å; W77-L244 HydrophobicContact CZ3-CD2 4.22Å; I78-L244 HydrophobicContact CD1-CD2 3.98Å; M240-L244 HydrophobicContact CE-CD1 3.69Å; M240-L244 HydrophobicContact CE-CD2 4.23Å; M240-L244 HydrophobicContact CE-CG 3.94Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.5Å; M240-L244 VanDerWaalsContact O-CG 3.25Å; M240-L244 WeakPolarHBondContact O-CG 3.41Å; M240-L244 PolarHBondContact O-N 2.99Å; L242-L244 PolarHBondContact O-N 3.43Å
245F98.6Very high98.1Very high167 Ų16757.3 Ų57.373%0.73232%0.321SS*.Hα-helixtrans-105.3-28.3-173.8-64.2-73.3000113.9T241T241-F245 HydrophobicContact CG2-CD2 4.07Å; T241-F245 WeakPolarHBondContact O-CB 3.39Å; T241-F245 WeakPolarHBondContact O-CD2 3.47Å; T241-F245 PolarHBondContact O-N 2.66Å
246S98.4Very high98Very high43 Ų4361.7 Ų61.730%0.30134%0.338SS..  trans-145.355.2-176.563.80000112.3L242 D248 L249L242-S246 WeakPolarHBondContact CD1-O 3.34Å; L242-S246 CarbonylContact O-C 2.91Å; L242-S246 WeakPolarHBondContact O-CA 3.42Å; L242-S246 PolarHBondContact O-N 2.91Å; S246-D248 PolarHBondContact O-N 3.33Å; S246-D248 VanDerWaalsContact O-N 3.09Å; S246-L249 VanDerWaalsContact O-CB 3.3Å; S246-L249 WeakPolarHBondContact O-CB 3.43Å; S246-L249 PolarHBondContact O-N 2.95Å; S246-L249 VanDerWaalsContact O-N 3.1Å
247P98.2Very high98Very high33 Ų3361.5 Ų61.521%0.21434%0.34CS..THydrogen-bonded Turntrans-60.5-26.2-167.820.6-32.8000114.7Y81 N85 L242 T243Y81-P247 HydrophobicContact CD1-CB 3.56Å; Y81-P247 HydrophobicContact CD2-CB 4.02Å; Y81-P247 HydrophobicContact CE1-CB 3.75Å; Y81-P247 HydrophobicContact CE2-CB 4.19Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; N85-P247 PolarHBondContact ND2-O 3.35Å; N85-P247 PolarHBondContact OD1-O 3.13Å; L242-P247 WeakPolarHBondContact O-CA 3.37Å; T243-P247 WeakPolarHBondContact O-CB 3.32Å
248D98.3Very high98Very high72 Ų7260.9 Ų60.939%0.38534%0.337SS..THydrogen-bonded Turntrans-100.12-176.7-63.5-52.9000113.6S246 L250 G251 Y256S246-D248 PolarHBondContact O-N 3.33Å; S246-D248 VanDerWaalsContact O-N 3.09Å; D248-L250 PolarHBondContact O-N 3.38Å; D248-L250 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact O-N 3.2Å; D248-G251 VanDerWaalsContact O-N 3.14Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.48Å; D248-Y256 VanDerWaalsContact OD1-CZ 3.32Å; D248-Y256 PolarHBondContact OD1-OH 3.35Å
249L98.5Very high97.9Very high124 Ų12459.2 Ų59.265%0.64933%0.326SS*.THydrogen-bonded Turntrans-56.1-34.2-173.1179.163.6000113.6L242 S246L242-L249 HydrophobicContact CD1-CB 3.98Å; L242-L249 HydrophobicContact CD1-CD2 4.11Å; S246-L249 VanDerWaalsContact O-CB 3.3Å; S246-L249 WeakPolarHBondContact O-CB 3.43Å; S246-L249 PolarHBondContact O-N 2.95Å; S246-L249 VanDerWaalsContact O-N 3.1Å
250L97.9Very high97.8Very high57 Ų5762.3 Ų62.330%0.29834%0.343SS..THydrogen-bonded Turntrans-99.5-6-175.8-58.3-177.2000113.7S88 L242 D248S88-L250 VanDerWaalsContact CB-CD1 3.5Å; L242-L250 HydrophobicContact CD1-CG 4.39Å; L242-L250 HydrophobicContact CD2-CD1 3.68Å; L242-L250 HydrophobicContact CD2-CG 4.36Å; D248-L250 PolarHBondContact O-N 3.38Å; D248-L250 VanDerWaalsContact O-N 3.12Å
251G95.7Very high97.7Very high43 Ų4363.1 Ų63.144%0.44335%0.353SS..SBendtrans-96.8170.9-178.500000113D248D248-G251 PolarHBondContact O-N 3.2Å; D248-G251 VanDerWaalsContact O-N 3.14Å
252D96.9Very high97.6Very high19 Ų1967.7 Ų67.710%0.10237%0.374CS..  trans-101.5129175.4-162-71.2000111.5M138 D254 N255 K269M138-D252 HydrophobicContact CG-CB 4.1Å; D252-D254 PolarHBondContact O-N 3.4Å; D252-D254 WeakPolarHBondContact OD1-CB 3.24Å; D252-D254 PolarHBondContact OD1-N 3.09Å; D252-N255 WeakPolarHBondContact O-CB 3.28Å; D252-N255 PolarHBondContact O-N 3.03Å; D252-N255 VanDerWaalsContact O-N 3.1Å; D252-K269 WeakPolarHBondContact OD2-CE 3.36Å; D252-K269 IonicContact OD2-NZ 3.57Å; D252-K269 PolarHBondContact OD2-NZ 2.82Å
253P97.1Very high97.4Very high94 Ų9471.2 Ų71.261%0.6139%0.393SS*.G310 helixtrans-62.2-27.1-177.925.7-35.8000113.5N255 Y256P253-N255 PolarHBondContact O-N 3.23Å; P253-N255 VanDerWaalsContact O-N 3.15Å; P253-Y256 WeakPolarHBondContact O-CB 3.44Å; P253-Y256 PolarHBondContact O-N 3.42Å
254D96.9Very high97.2Very high55 Ų5574.6 Ų74.629%0.29441%0.414SS..G310 helixtrans-63.3-23.5178.7-76.7-9.6000111.2Q137 M138 D252 Y256 T257Q137-D254 HydrophobicContact CB-CB 4.44Å; M138-D254 HydrophobicContact CE-CB 3.52Å; M138-D254 WeakPolarHBondContact CE-OD2 3.42Å; M138-D254 HydrophobicContact CG-CB 3.81Å; D252-D254 PolarHBondContact O-N 3.4Å; D252-D254 WeakPolarHBondContact OD1-CB 3.24Å; D252-D254 PolarHBondContact OD1-N 3.09Å; D254-Y256 PolarHBondContact O-N 3.02Å; D254-T257 PolarHBondContact O-N 3.45Å; D254-T257 PolarHBondContact O-OG1 3.14Å
255N97.6Very high97Very high22 Ų2271.3 Ų71.312%0.11840%0.397CS..G310 helixtrans-72.9-5.4177.1-14032.1000114.2G136 M138 S139 D252 P253 T257G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.35Å; M138-N255 HydrophobicContact CB-CB 4.16Å; M138-N255 PolarHBondContact N-OD1 3.27Å; S139-N255 PolarHBondContact N-OD1 2.96Å; S139-N255 PolarHBondContact OG-ND2 2.9Å; S139-N255 PolarHBondContact OG-OD1 2.97Å; D252-N255 WeakPolarHBondContact O-CB 3.28Å; D252-N255 PolarHBondContact O-N 3.03Å; D252-N255 VanDerWaalsContact O-N 3.1Å; P253-N255 PolarHBondContact O-N 3.23Å; P253-N255 VanDerWaalsContact O-N 3.15Å; N255-T257 VanDerWaalsContact C-N 3.3Å
256Y97.6Very high96.6Very high102 Ų10268.6 Ų68.640%0.440%0.397SS..G310 helixtrans-87.13167.8-74.6-70.6000113.7F63 R80 Y81 D248 P253 D254F63-Y256 WeakPolarHBondContact CZ-O 3.32Å; R80-Y256 PolarHBondContact NH1-OH 3.34Å; Y81-Y256 PolarHBondContact OH-OH 3.41Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.48Å; D248-Y256 VanDerWaalsContact OD1-CZ 3.32Å; D248-Y256 PolarHBondContact OD1-OH 3.35Å; P253-Y256 WeakPolarHBondContact O-CB 3.44Å; P253-Y256 PolarHBondContact O-N 3.42Å; D254-Y256 PolarHBondContact O-N 3.02Å
257T97.9Very high96.3Very high70 Ų7071.9 Ų71.943%0.42941%0.407SS..SBendtrans-107.6135.2170.660.90000110G136 Q137 D254 N255 A259G136-T257 CarbonylContact C-O 3.56Å; G136-T257 WeakPolarHBondContact CA-O 3.44Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.19Å; Q137-T257 PolarHBondContact N-O 2.58Å; D254-T257 PolarHBondContact O-N 3.45Å; D254-T257 PolarHBondContact O-OG1 3.14Å; N255-T257 VanDerWaalsContact C-N 3.3Å; T257-A259 PolarHBondContact O-N 3.21Å
258L97.7Very high96.1Very high97 Ų9771.9 Ų71.951%0.50841%0.405SS..BIsolated β-bridgetrans-56.7137.9179175.265.3000110.4F63 N260F63-L258 HydrophobicContact CB-CD1 3.44Å; F63-L258 VanDerWaalsContact CB-CD1 3.44Å; F63-L258 HydrophobicContact CD1-CB 4.21Å; F63-L258 HydrophobicContact CD1-CD1 4.12Å; F63-L258 HydrophobicContact CD2-CB 4.48Å; F63-L258 HydrophobicContact CD2-CD1 4.23Å; F63-L258 HydrophobicContact CE1-CB 4.35Å; F63-L258 HydrophobicContact CG-CB 4.29Å; F63-L258 HydrophobicContact CG-CD1 3.68Å; L258-N260 PolarHBondContact O-N 2.83Å
259A97.3Very high95.9Very high15 Ų1571.6 Ų71.612%0.12440%0.4CS..  trans-52.9128176.200000112.2W135 F140 T257W135-A259 HydrophobicContact CG-CB 4.42Å; W135-A259 WeakPolarHBondContact O-CB 3.41Å; W135-A259 PolarHBondContact O-N 3.07Å; W135-A259 VanDerWaalsContact O-N 3.12Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.25Å; F140-A259 HydrophobicContact CG-CB 3.93Å; T257-A259 PolarHBondContact O-N 3.21Å
260N97.1Very high95.8Very high66 Ų6666.6 Ų66.635%0.35338%0.375SS..  trans-125.6108173-177.5-11.9000109.3W141 L258 L262 N263W141-N260 PolarHBondContact NE1-O 2.99Å; L258-N260 PolarHBondContact O-N 2.83Å; N260-L262 PolarHBondContact O-N 2.82Å; N260-L262 WeakPolarHBondContact OD1-CB 3.29Å; N260-L262 PolarHBondContact OD1-N 3.2Å; N260-N263 HydrophobicContact CB-CB 4.18Å; N260-N263 PolarHBondContact O-N 3.47Å; N260-N263 VanDerWaalsContact O-N 3.1Å
261P95.8Very high95.8Very high79 Ų7965 Ų6551%0.51337%0.366SS..THydrogen-bonded Turntrans-60.2-16.3179.1-24.334.2000114.8F140 W141F140-P261 HydrophobicContact CE1-CB 4.09Å; F140-P261 HydrophobicContact CE1-CG 4.26Å; F140-P261 HydrophobicContact CE2-CG 4.19Å; F140-P261 HydrophobicContact CZ-CB 3.83Å; F140-P261 HydrophobicContact CZ-CG 3.77Å; W141-P261 WeakPolarHBondContact CH2-O 3.3Å; W141-P261 WeakPolarHBondContact CZ2-O 3.39Å
262L96.4Very high95.9Very high163 Ų16365.8 Ų65.885%0.85336%0.356SS*.THydrogen-bonded Turntrans-99.2-5.8-178.9-55.6179.5000113.5N260N260-L262 PolarHBondContact O-N 2.82Å; N260-L262 WeakPolarHBondContact OD1-CB 3.29Å; N260-L262 PolarHBondContact OD1-N 3.2Å
263N95.9Very high96Very high92 Ų9265.3 Ų65.349%0.49235%0.353SS..  trans-127.7101.6-179.5-174.114.3000110.7Q137 W141 N260Q137-N263 PolarHBondContact NE2-O 2.83Å; W141-N263 PolarHBondContact NE1-O 3.38Å; N260-N263 HydrophobicContact CB-CB 4.18Å; N260-N263 PolarHBondContact O-N 3.47Å; N260-N263 VanDerWaalsContact O-N 3.1Å
264T93.8Very high96.1Very high73 Ų7362.2 Ų62.245%0.44833%0.329SS..  trans-79.4127.3179.1-48.30000110.7W141 I268W141-T264 HydrophobicContact CD2-CG2 4.19Å; W141-T264 HydrophobicContact CE3-CG2 4.17Å; W141-T264 HydrophobicContact CH2-CG2 4.45Å; W141-T264 VanDerWaalsContact CH2-OG1 3.26Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.49Å; W141-T264 HydrophobicContact CZ2-CG2 4.46Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.48Å; W141-T264 HydrophobicContact CZ3-CG2 4.31Å; T264-I268 HydrophobicContact CG2-CD1 3.44Å; T264-I268 VanDerWaalsContact CG2-CD1 3.44Å; T264-I268 HydrophobicContact CG2-CG1 4.29Å
265P93.8Very high96.2Very high11 Ų1160.4 Ų60.47%0.07132%0.32CS..  trans-57.3150.1172.8-27.535.3000112.4Q137 M138 W141 H267 I268Q137-P265 HydrophobicContact CB-CG 3.87Å; M138-P265 HydrophobicContact CE-CB 3.49Å; M138-P265 VanDerWaalsContact CE-CB 3.49Å; M138-P265 HydrophobicContact CE-CG 3.99Å; W141-P265 HydrophobicContact CG-CG 4.37Å; P265-H267 VanDerWaalsContact C-N 3.26Å; P265-H267 PolarHBondContact O-N 3.38Å; P265-I268 HydrophobicContact CB-CG1 4.39Å
266P90.2Very high96.2Very high111 Ų11160.3 Ų60.372%0.72132%0.318SS*.SBendtrans-57.2-37.1-179-2533.6000113.8
267H92Very high96.3Very high111 Ų11155.6 Ų55.651%0.51430%0.3SS..SBendtrans-137.787-175.7-63.7-47.8000111.8P265 K269P265-H267 VanDerWaalsContact C-N 3.26Å; P265-H267 PolarHBondContact O-N 3.38Å; H267-K269 PolarHBondContact O-N 2.98Å
268I93.6Very high96.3Very high33 Ų3353.8 Ų53.817%0.16929%0.286CS..  trans-71.3124.4173.5-57162.5000109.8W141 V145 T264 P265 Y278W141-I268 HydrophobicContact CB-CD1 3.73Å; W141-I268 HydrophobicContact CB-CG1 3.91Å; W141-I268 HydrophobicContact CB-CG2 4.17Å; W141-I268 HydrophobicContact CD2-CD1 4.26Å; W141-I268 HydrophobicContact CE3-CD1 4.17Å; W141-I268 HydrophobicContact CG-CD1 4.12Å; V145-I268 HydrophobicContact CG2-CD1 4.23Å; V145-I268 HydrophobicContact CG2-CG2 4.25Å; T264-I268 HydrophobicContact CG2-CD1 3.44Å; T264-I268 VanDerWaalsContact CG2-CD1 3.44Å; T264-I268 HydrophobicContact CG2-CG1 4.29Å; P265-I268 HydrophobicContact CB-CG1 4.39Å; I268-Y278 PolarHBondContact O-OH 3.32Å
269K94.4Very high96.3Very high66 Ų6649.2 Ų49.229%0.28726%0.262SS..  trans-147.4152.2176.863.9-171.4177.6-167.80109.5D252 H267 L275 Y278D252-K269 WeakPolarHBondContact OD2-CE 3.36Å; D252-K269 IonicContact OD2-NZ 3.57Å; D252-K269 PolarHBondContact OD2-NZ 2.82Å; H267-K269 PolarHBondContact O-N 2.98Å; K269-L275 HydrophobicContact CB-CD2 4.17Å; K269-Y278 HydrophobicContact CB-CE1 4.19Å
270P96.6Very high96.4Very high20 Ų2048.6 Ų48.613%0.1326%0.257CS..  trans-77.7174.117136-36.7000110.9F274 L275 Y278P270-F274 HydrophobicContact CB-CB 3.81Å; P270-F274 HydrophobicContact CB-CD2 4.16Å; P270-F274 HydrophobicContact CB-CG 4.42Å; P270-F274 HydrophobicContact CG-CB 3.71Å; P270-L275 HydrophobicContact CG-CD2 4.13Å; P270-L275 WeakPolarHBondContact O-CD2 3.4Å; P270-Y278 HydrophobicContact CG-CD1 4.41Å; P270-Y278 HydrophobicContact CG-CG 4.09Å
271E97.6Very high96.5Very high22 Ų2246.3 Ų46.310%0.10324%0.244CC..  trans-57.4156.5171.8-69.4-68.5109.100112.8Y131 Y273 F274Y131-E271 HydrophobicContact CD1-CG 4.17Å; Y131-E271 HydrophobicContact CD2-CG 3.45Å; Y131-E271 VanDerWaalsContact CD2-CG 3.45Å; Y131-E271 HydrophobicContact CE1-CG 4.12Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.26Å; Y131-E271 HydrophobicContact CG-CG 3.84Å; Y131-E271 PolarHBondContact OH-OE1 3.24Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.56Å; E271-Y273 HydrophobicContact CB-CE2 4.09Å; E271-Y273 VanDerWaalsContact CB-CZ 3.5Å; E271-Y273 HydrophobicContact CG-CE1 4.29Å; E271-Y273 PolarHBondContact O-N 3.46Å; E271-F274 PolarHBondContact O-N 3.32Å
272W98.6Very high96.5Very high61 Ų6145.7 Ų45.723%0.23123%0.232CC..G310 helixtrans-53.7-36.7-166.671.8-93.8000114.1S88 F91 I92 F95 F274 L275S88-W272 WeakPolarHBondContact O-CZ2 3.45Å; S88-W272 PolarHBondContact OG-NE1 2.96Å; F91-W272 HydrophobicContact CB-CH2 4.12Å; F91-W272 HydrophobicContact CB-CZ2 4.14Å; I92-W272 HydrophobicContact CD1-CZ2 4.29Å; I92-W272 HydrophobicContact CG1-CH2 3.57Å; I92-W272 HydrophobicContact CG1-CZ2 3.72Å; F95-W272 HydrophobicContact CD2-CH2 4.16Å; F95-W272 HydrophobicContact CD2-CZ3 4.13Å; F95-W272 AromaticContact CE2-CH2 3.99Å; F95-W272 HydrophobicContact CE2-CH2 3.99Å; F95-W272 AromaticContact CE2-CZ3 3.8Å; F95-W272 HydrophobicContact CE2-CZ3 3.8Å; W272-F274 PolarHBondContact O-N 3.11Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.12Å; W272-L275 PolarHBondContact O-N 3.31Å; W272-L275 VanDerWaalsContact O-N 3.11Å
273Y98.5Very high96.6Very high9 Ų938.5 Ų38.54%0.03520%0.195CC..G310 helixtrans-70.9-8.2-178.646-95.9000114F91 F95 A127 E271F91-Y273 HydrophobicContact CB-CD1 4.26Å; F91-Y273 HydrophobicContact CB-CG 3.98Å; F91-Y273 AromaticContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CD2 3.96Å; F91-Y273 HydrophobicContact CD1-CG 4.01Å; F91-Y273 AromaticContact CD2-CD1 3.78Å; F91-Y273 HydrophobicContact CD2-CD1 3.78Å; F91-Y273 AromaticContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CD2 3.53Å; F91-Y273 HydrophobicContact CD2-CE1 4.09Å; F91-Y273 AromaticContact CD2-CE2 3.79Å; F91-Y273 HydrophobicContact CD2-CE2 3.79Å; F91-Y273 AromaticContact CD2-CG 3.52Å; F91-Y273 HydrophobicContact CD2-CG 3.52Å; F91-Y273 AromaticContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CG 4.42Å; F91-Y273 HydrophobicContact CE2-CD1 4.42Å; F91-Y273 AromaticContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CD2 3.47Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CE1 4.45Å; F91-Y273 AromaticContact CE2-CE2 3.43Å; F91-Y273 HydrophobicContact CE2-CE2 3.43Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.43Å; F91-Y273 AromaticContact CE2-CG 3.98Å; F91-Y273 HydrophobicContact CE2-CG 3.98Å; F91-Y273 AromaticContact CE2-CZ 3.99Å; F91-Y273 HydrophobicContact CG-CD1 4.09Å; F91-Y273 AromaticContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CD2 3.79Å; F91-Y273 HydrophobicContact CG-CE2 4.5Å; F91-Y273 AromaticContact CG-CG 3.54Å; F91-Y273 HydrophobicContact CG-CG 3.54Å; F91-Y273 AromaticContact CZ-CD2 3.66Å; F91-Y273 HydrophobicContact CZ-CD2 3.66Å; F91-Y273 AromaticContact CZ-CE2 3.86Å; F91-Y273 HydrophobicContact CZ-CE2 3.86Å; F91-Y273 HydrophobicContact CZ-CG 4.41Å; F95-Y273 WeakPolarHBondContact CZ-O 3.42Å; A127-Y273 HydrophobicContact CB-CE2 3.97Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.56Å; E271-Y273 HydrophobicContact CB-CE2 4.09Å; E271-Y273 VanDerWaalsContact CB-CZ 3.5Å; E271-Y273 HydrophobicContact CG-CE1 4.29Å; E271-Y273 PolarHBondContact O-N 3.46Å
274F98.6Very high96.7Very high28 Ų2836.7 Ų36.712%0.12319%0.187CC..G310 helixtrans-103.8-8.8171.4-66.6-58.1000113.8M124 F128 P270 E271 W272 F276 A277 Y278M124-F274 HydrophobicContact CB-CE1 3.83Å; M124-F274 HydrophobicContact CB-CZ 4.24Å; M124-F274 HydrophobicContact CE-CD1 3.64Å; M124-F274 HydrophobicContact CE-CE1 3.49Å; M124-F274 VanDerWaalsContact CE-CE1 3.49Å; M124-F274 HydrophobicContact CG-CE1 3.83Å; M124-F274 WeakPolarHBondContact O-CZ 3.16Å; F128-F274 HydrophobicContact CB-CE2 4.26Å; F128-F274 HydrophobicContact CB-CZ 4.19Å; P270-F274 HydrophobicContact CB-CB 3.81Å; P270-F274 HydrophobicContact CB-CD2 4.16Å; P270-F274 HydrophobicContact CB-CG 4.42Å; P270-F274 HydrophobicContact CG-CB 3.71Å; E271-F274 PolarHBondContact O-N 3.32Å; W272-F274 PolarHBondContact O-N 3.11Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 3.41Å; F274-A277 PolarHBondContact O-N 3.41Å; F274-Y278 WeakPolarHBondContact O-CB 3.25Å; F274-Y278 PolarHBondContact O-N 2.92Å
275L98.7Very high96.8Very high17 Ų1739.3 Ų39.39%0.08921%0.206CC..Hα-helixtrans-62.8-34.1-170.5-71-178.5000113.5K269 P270 W272 A277 Y278 T279 T336K269-L275 HydrophobicContact CB-CD2 4.17Å; P270-L275 HydrophobicContact CG-CD2 4.13Å; P270-L275 WeakPolarHBondContact O-CD2 3.4Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.12Å; W272-L275 PolarHBondContact O-N 3.31Å; W272-L275 VanDerWaalsContact O-N 3.11Å; L275-A277 PolarHBondContact O-N 3.25Å; L275-Y278 HydrophobicContact CD2-CD1 4.28Å; L275-Y278 PolarHBondContact O-N 3.46Å; L275-T279 PolarHBondContact O-N 3.28Å; L275-T279 PolarHBondContact O-OG1 3.45Å; L275-T336 HydrophobicContact CB-CG2 4.04Å; L275-T336 WeakPolarHBondContact CB-O 3.34Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å
276F98.9Very high97Very high21 Ų2143.2 Ų43.29%0.09223%0.226CC..Hα-helixtrans-61.3-46.7177.780.5-83.9000111.8F95 F274 T279 I280 L332 L335F95-F276 HydrophobicContact CE1-CE1 4.43Å; F95-F276 HydrophobicContact CZ-CE1 4.31Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 3.41Å; F276-T279 PolarHBondContact O-N 2.92Å; F276-I280 PolarHBondContact O-N 3.46Å; F276-L332 HydrophobicContact CB-CD2 4.2Å; F276-L332 HydrophobicContact CD2-CD2 3.65Å; F276-L332 HydrophobicContact CE2-CD2 4.33Å; F276-L332 HydrophobicContact CG-CD2 4.04Å; F276-L335 HydrophobicContact CB-CB 3.91Å
277A98.6Very high97.2Very high3 Ų342.8 Ų42.83%0.02521%0.213CC..Hα-helixtrans-70.4-36.617800000110.9F274 L275 T279 I280 L281 L294F274-A277 PolarHBondContact O-N 3.41Å; L275-A277 PolarHBondContact O-N 3.25Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.49Å; A277-I280 PolarHBondContact O-N 3.27Å; A277-I280 VanDerWaalsContact O-N 3.15Å; A277-L281 PolarHBondContact O-N 2.94Å; A277-L294 HydrophobicContact CB-CD1 3.96Å; A277-L294 HydrophobicContact CB-CG 4.33Å
278Y98.4Very high97.4Very high31 Ų3140.3 Ų40.312%0.12220%0.203CC..Hα-helixtrans-61.3-34.9174.4-178.9-123.5000112.7I268 K269 P270 F274 L275 L281 R282I268-Y278 PolarHBondContact O-OH 3.32Å; K269-Y278 HydrophobicContact CB-CE1 4.19Å; P270-Y278 HydrophobicContact CG-CD1 4.41Å; P270-Y278 HydrophobicContact CG-CG 4.09Å; F274-Y278 WeakPolarHBondContact O-CB 3.25Å; F274-Y278 PolarHBondContact O-N 2.92Å; L275-Y278 HydrophobicContact CD2-CD1 4.28Å; L275-Y278 PolarHBondContact O-N 3.46Å; Y278-L281 HydrophobicContact CD2-CD2 4.08Å; Y278-L281 HydrophobicContact CE2-CD2 4.42Å; Y278-R282 HydrophobicContact CD2-CG 4.42Å; Y278-R282 VanDerWaalsContact CE1-NE 3.27Å; Y278-R282 HydrophobicContact CE2-CG 4.05Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.35Å; Y278-R282 PolarHBondContact O-N 3.08Å; Y278-R282 PolarHBondContact O-NE 3.22Å
279T98.7Very high97.6Very high2 Ų239.9 Ų39.91%0.01221%0.207CC..Hα-helixtrans-64.5-48.4170.5-65.20000111.4L275 F276 A277 L281 R282 S283 L335 I338 G339L275-T279 PolarHBondContact O-N 3.28Å; L275-T279 PolarHBondContact O-OG1 3.45Å; F276-T279 PolarHBondContact O-N 2.92Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.49Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.46Å; T279-R282 PolarHBondContact O-N 2.78Å; T279-R282 VanDerWaalsContact O-N 3.08Å; T279-S283 PolarHBondContact O-N 3.03Å; T279-S283 PolarHBondContact O-OG 2.72Å; T279-L335 WeakPolarHBondContact CB-O 3.38Å; T279-L335 HydrophobicContact CG2-CD2 3.53Å; T279-L335 PolarHBondContact OG1-O 3.39Å; T279-I338 HydrophobicContact CG2-CB 4.03Å; T279-I338 HydrophobicContact CG2-CG2 3.64Å; T279-G339 WeakPolarHBondContact OG1-CA 3.38Å; T279-G339 PolarHBondContact OG1-N 2.93Å
280I98.8Very high97.8Very high1 Ų136.7 Ų36.71%0.00519%0.193CC..Hα-helixtrans-58.1-41.6178.7-66.7171.3000111.5F276 A277 R282 S283 A293 S297 L335 Y358 F359F276-I280 PolarHBondContact O-N 3.46Å; A277-I280 PolarHBondContact O-N 3.27Å; A277-I280 VanDerWaalsContact O-N 3.15Å; I280-R282 PolarHBondContact O-N 3.33Å; I280-S283 PolarHBondContact O-N 3.32Å; I280-A293 HydrophobicContact CG2-CB 3.79Å; I280-S297 VanDerWaalsContact CD1-CB 3.5Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.22Å; I280-L335 HydrophobicContact CG1-CD2 4.12Å; I280-Y358 HydrophobicContact CD1-CD1 3.93Å; I280-Y358 HydrophobicContact CD1-CE1 4.27Å; I280-Y358 HydrophobicContact CD1-CG 4.26Å; I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.31Å
281L98.3Very high97.9Very high18 Ų1836.3 Ų36.39%0.09419%0.19CC..Hα-helixtrans-54.2-51.3173.1171.264.7000111.8L149 A277 Y278 T279 S283 G290 V291 L294L149-L281 HydrophobicContact CD1-CD1 4.34Å; L149-L281 HydrophobicContact CD1-CD2 3.65Å; L149-L281 HydrophobicContact CD2-CD1 4.23Å; L149-L281 HydrophobicContact CD2-CD2 4.14Å; A277-L281 PolarHBondContact O-N 2.94Å; Y278-L281 HydrophobicContact CD2-CD2 4.08Å; Y278-L281 HydrophobicContact CE2-CD2 4.42Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.46Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.3Å; L281-G290 WeakPolarHBondContact CD1-O 3.38Å; L281-G290 WeakPolarHBondContact O-CA 3.4Å; L281-V291 HydrophobicContact CD1-CG2 4.26Å; L281-L294 HydrophobicContact CB-CB 4.16Å; L281-L294 HydrophobicContact CB-CD1 3.95Å; L281-L294 HydrophobicContact CD2-CD1 4.31Å
282R97.2Very high97.9Very high66 Ų6639.5 Ų39.525%0.24921%0.207CC..Hα-helixtrans-75.3-19.9-174.8-68.2-176.4-62.9162.312.7113.5Y278 T279 I280 V284 I338 G339 Q341Y278-R282 HydrophobicContact CD2-CG 4.42Å; Y278-R282 VanDerWaalsContact CE1-NE 3.27Å; Y278-R282 HydrophobicContact CE2-CG 4.05Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.35Å; Y278-R282 PolarHBondContact O-N 3.08Å; Y278-R282 PolarHBondContact O-NE 3.22Å; T279-R282 PolarHBondContact O-N 2.78Å; T279-R282 VanDerWaalsContact O-N 3.08Å; I280-R282 PolarHBondContact O-N 3.33Å; R282-V284 VanDerWaalsContact C-N 3.26Å; R282-V284 PolarHBondContact O-N 3.03Å; R282-I338 PolarHBondContact NH2-O 2.72Å; R282-G339 PolarHBondContact NH2-O 3.13Å; R282-G339 VanDerWaalsContact NH2-O 3.16Å; R282-Q341 PolarHBondContact NH1-O 2.93Å; R282-Q341 VanDerWaalsContact NH1-O 3.11Å
283S98Very high97.9Very high13 Ų1337.2 Ų37.29%0.09120%0.202CC..Hα-helixtrans-67.2-26.4178.4-67.70000113.2T279 I280 L281 P285 G351 Q352 S355T279-S283 PolarHBondContact O-N 3.03Å; T279-S283 PolarHBondContact O-OG 2.72Å; I280-S283 PolarHBondContact O-N 3.32Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.3Å; S283-P285 WeakPolarHBondContact O-CD 3.07Å; S283-G351 PolarHBondContact OG-O 3.23Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; S283-Q352 WeakPolarHBondContact O-CG 3.25Å; S283-Q352 PolarHBondContact O-NE2 2.9Å; S283-Q352 PolarHBondContact OG-N 2.84Å; S283-S355 WeakPolarHBondContact CB-OG 3.05Å; S283-S355 PolarHBondContact OG-OG 3.31Å
284V98Very high97.9Very high53 Ų5338.5 Ų38.532%0.32121%0.209SC..SBendtrans-92.6117.4-179.1-175.50000109.8R282 N286 A293R282-V284 VanDerWaalsContact C-N 3.26Å; R282-V284 PolarHBondContact O-N 3.03Å; V284-N286 HydrophobicContact CG1-CB 4.24Å; V284-N286 PolarHBondContact O-N 3.28Å; V284-A293 HydrophobicContact CG2-CB 3.87Å
285P96.1Very high97.8Very high128 Ų12841.3 Ų41.383%0.83123%0.225SC*.SBendtrans-78.544.5-178.934.7-37.2000112.2S283S283-P285 WeakPolarHBondContact O-CD 3.07Å
286N97.4Very high97.8Very high94 Ų9445 Ų4550%0.50324%0.244SC..SBendtrans-151.7129.8176.2-179.9-80.8000108.8V284 L288 G289 G290V284-N286 HydrophobicContact CG1-CB 4.24Å; V284-N286 PolarHBondContact O-N 3.28Å; N286-L288 PolarHBondContact O-N 2.82Å; N286-L288 PolarHBondContact OD1-N 2.96Å; N286-L288 VanDerWaalsContact OD1-N 3.08Å; N286-G289 PolarHBondContact O-N 3.35Å; N286-G289 PolarHBondContact OD1-N 2.88Å; N286-G290 PolarHBondContact O-N 3.46Å
287K94.4Very high97.8Very high101 Ų10144 Ų4444%0.43924%0.24SC..Hα-helixtrans-58.3-53-175.7-166.3-174.6180178.90112.1N148 S151 A152 G290 V291N148-K287 WeakPolarHBondContact O-CE 2.93Å; N148-K287 PolarHBondContact O-NZ 3.45Å; S151-K287 PolarHBondContact OG-NZ 3.16Å; A152-K287 HydrophobicContact CB-CB 4.46Å; A152-K287 HydrophobicContact CB-CD 3.96Å; A152-K287 HydrophobicContact CB-CG 3.88Å; K287-G290 PolarHBondContact O-N 3.12Å; K287-V291 VanDerWaalsContact O-CG2 3.3Å; K287-V291 WeakPolarHBondContact O-CG2 3.46Å; K287-V291 PolarHBondContact O-N 2.79Å; K287-V291 VanDerWaalsContact O-N 3.08Å
288L96.8Very high97.7Very high59 Ų5944.6 Ų44.631%0.30924%0.243SC..Hα-helixtrans-65.3-44.5179.717760000111.3A152 P154 N286 G290 V291 L292A152-L288 HydrophobicContact CB-CB 4.24Å; A152-L288 HydrophobicContact CB-CD1 4.38Å; P154-L288 HydrophobicContact CG-CD2 4.41Å; N286-L288 PolarHBondContact O-N 2.82Å; N286-L288 PolarHBondContact OD1-N 2.96Å; N286-L288 VanDerWaalsContact OD1-N 3.08Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.37Å; L288-V291 PolarHBondContact O-N 3.2Å; L288-L292 HydrophobicContact CD1-CD1 4.27Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.14Å; L288-L292 HydrophobicContact CG-CG 4.46Å; L288-L292 WeakPolarHBondContact O-CG 3.14Å; L288-L292 PolarHBondContact O-N 3.07Å
289G98.2Very high97.7Very high24 Ų2446.8 Ų46.825%0.24726%0.256CS..Hα-helixtrans-58.8-42.7177.700000112.8N286 L292 A293N286-G289 PolarHBondContact O-N 3.35Å; N286-G289 PolarHBondContact OD1-N 2.88Å; G289-L292 PolarHBondContact O-N 2.86Å; G289-A293 WeakPolarHBondContact O-CB 3.22Å; G289-A293 PolarHBondContact O-N 3.02Å
290G98Very high97.7Very high0 Ų047 Ų470%026%0.257CS..Hα-helixtrans-65.2-41.3175.300000112.5L281 N286 K287 L288 A293 L294L281-G290 WeakPolarHBondContact CD1-O 3.38Å; L281-G290 WeakPolarHBondContact O-CA 3.4Å; N286-G290 PolarHBondContact O-N 3.46Å; K287-G290 PolarHBondContact O-N 3.12Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.37Å; G290-A293 PolarHBondContact O-N 3.04Å; G290-L294 WeakPolarHBondContact O-CB 3.33Å; G290-L294 PolarHBondContact O-N 3.33Å
291V97.7Very high97.7Very high11 Ų1147.8 Ų47.87%0.06726%0.261CS..Hα-helixtrans-62.3-44.3175.6172.20000111.2L149 A152 L281 K287 L288 L294 L295L149-V291 HydrophobicContact CB-CG2 3.73Å; L149-V291 HydrophobicContact CD2-CG2 4.04Å; L149-V291 HydrophobicContact CG-CG2 4.31Å; A152-V291 HydrophobicContact CB-CG2 4.33Å; L281-V291 HydrophobicContact CD1-CG2 4.26Å; K287-V291 VanDerWaalsContact O-CG2 3.3Å; K287-V291 WeakPolarHBondContact O-CG2 3.46Å; K287-V291 PolarHBondContact O-N 2.79Å; K287-V291 VanDerWaalsContact O-N 3.08Å; L288-V291 PolarHBondContact O-N 3.2Å; V291-L294 PolarHBondContact O-N 2.68Å; V291-L295 HydrophobicContact CG1-CD1 4.33Å; V291-L295 WeakPolarHBondContact O-CG 3.33Å; V291-L295 PolarHBondContact O-N 3.13Å
292L98.2Very high97.7Very high89 Ų8948.9 Ų48.947%0.46627%0.272SS..Hα-helixtrans-63-42.4174.8-67.6174.9000111.5L288 G289 L294 L295 L296L288-L292 HydrophobicContact CD1-CD1 4.27Å; L288-L292 HydrophobicContact CD1-CG 4.18Å; L288-L292 HydrophobicContact CG-CD1 4.14Å; L288-L292 HydrophobicContact CG-CG 4.46Å; L288-L292 WeakPolarHBondContact O-CG 3.14Å; L288-L292 PolarHBondContact O-N 3.07Å; G289-L292 PolarHBondContact O-N 2.86Å; L292-L294 PolarHBondContact O-N 3.47Å; L292-L295 PolarHBondContact O-N 3.31Å; L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.48Å; L292-L296 WeakPolarHBondContact O-CG 3.48Å; L292-L296 PolarHBondContact O-N 2.88Å
293A98.4Very high97.7Very high14 Ų1449.8 Ų49.812%0.11628%0.28CS..Hα-helixtrans-63.3-41177.800000112.4I280 V284 G289 G290 L296 S297I280-A293 HydrophobicContact CG2-CB 3.79Å; V284-A293 HydrophobicContact CG2-CB 3.87Å; G289-A293 WeakPolarHBondContact O-CB 3.22Å; G289-A293 PolarHBondContact O-N 3.02Å; G290-A293 PolarHBondContact O-N 3.04Å; A293-L296 PolarHBondContact O-N 3.29Å; A293-S297 WeakPolarHBondContact O-CB 3.47Å; A293-S297 PolarHBondContact O-N 3.26Å
294L97.8Very high97.7Very high36 Ų3649.8 Ų49.819%0.18828%0.28CS..Hα-helixtrans-60.7-50.5173.5174.1126.2000111.2A277 L281 G290 V291 L292 L296 S297A277-L294 HydrophobicContact CB-CD1 3.96Å; A277-L294 HydrophobicContact CB-CG 4.33Å; L281-L294 HydrophobicContact CB-CB 4.16Å; L281-L294 HydrophobicContact CB-CD1 3.95Å; L281-L294 HydrophobicContact CD2-CD1 4.31Å; G290-L294 WeakPolarHBondContact O-CB 3.33Å; G290-L294 PolarHBondContact O-N 3.33Å; V291-L294 PolarHBondContact O-N 2.68Å; L292-L294 PolarHBondContact O-N 3.47Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 3.3Å; L294-S297 WeakPolarHBondContact O-CB 3.26Å; L294-S297 PolarHBondContact O-N 2.78Å; L294-S297 PolarHBondContact O-OG 2.78Å
295L97.3Very high97.7Very high86 Ų8648.9 Ų48.945%0.4527%0.274SS..Hα-helixtrans-59.6-45.2177.7-70.5173.9000111.6V291 L292 S297 I298 L299V291-L295 HydrophobicContact CG1-CD1 4.33Å; V291-L295 WeakPolarHBondContact O-CG 3.33Å; V291-L295 PolarHBondContact O-N 3.13Å; L292-L295 PolarHBondContact O-N 3.31Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 2.93Å; L295-I298 PolarHBondContact O-N 3.32Å; L295-L299 WeakPolarHBondContact O-CG 3.45Å; L295-L299 PolarHBondContact O-N 3.27Å
296L98.3Very high97.8Very high94 Ų9448.2 Ų48.249%0.49226%0.263SS..Hα-helixtrans-65.3-30.1178.5-71.7172.4000112.7L292 A293 L294 I298 L299 I300 F359L292-L296 VanDerWaalsContact O-CB 3.3Å; L292-L296 WeakPolarHBondContact O-CB 3.48Å; L292-L296 WeakPolarHBondContact O-CG 3.48Å; L292-L296 PolarHBondContact O-N 2.88Å; A293-L296 PolarHBondContact O-N 3.29Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 3.3Å; L296-I298 PolarHBondContact O-N 3.16Å; L296-I298 VanDerWaalsContact O-N 3.14Å; L296-L299 PolarHBondContact O-N 3.37Å; L296-I300 WeakPolarHBondContact O-CB 3.48Å; L296-I300 WeakPolarHBondContact O-CG2 2.9Å; L296-I300 PolarHBondContact O-N 2.81Å; L296-F359 HydrophobicContact CB-CE1 4.14Å; L296-F359 HydrophobicContact CB-CZ 4.29Å
297S98.4Very high97.8Very high2 Ų245.4 Ų45.41%0.01425%0.247CC..Hα-helixtrans-62.5-19.1175.875.20000114I280 A293 L294 L295 Y358I280-S297 VanDerWaalsContact CD1-CB 3.5Å; A293-S297 WeakPolarHBondContact O-CB 3.47Å; A293-S297 PolarHBondContact O-N 3.26Å; L294-S297 WeakPolarHBondContact O-CB 3.26Å; L294-S297 PolarHBondContact O-N 2.78Å; L294-S297 PolarHBondContact O-OG 2.78Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 2.93Å; S297-Y358 PolarHBondContact O-OH 3.33Å
298I98.3Very high98Very high15 Ų1542.5 Ų42.58%0.07724%0.236CC..Hα-helixtrans-102.4-47.2175.3-54.5161.2000109.4L120 L121 M124 L295 L296 I300 L301L120-I298 HydrophobicContact CD2-CG2 3.89Å; L121-I298 HydrophobicContact CD2-CG2 3.79Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; M124-I298 HydrophobicContact CE-CD1 3.41Å; M124-I298 VanDerWaalsContact CE-CD1 3.41Å; M124-I298 HydrophobicContact CE-CG1 4.15Å; M124-I298 HydrophobicContact SD-CD1 3.87Å; M124-I298 HydrophobicContact SD-CG1 4.44Å; M124-I298 HydrophobicContact SD-CG2 4.4Å; L295-I298 PolarHBondContact O-N 3.32Å; L296-I298 PolarHBondContact O-N 3.16Å; L296-I298 VanDerWaalsContact O-N 3.14Å; I298-I300 PolarHBondContact O-N 3.07Å; I298-L301 WeakPolarHBondContact O-CB 3.16Å; I298-L301 WeakPolarHBondContact O-CG 3.36Å; I298-L301 PolarHBondContact O-N 3.24Å; I298-L301 VanDerWaalsContact O-N 3.16Å
299L98.2Very high98Very high77 Ų7743.8 Ų43.840%0.40324%0.241SC..Hα-helixtrans-67.5-17.1-177.6-65.6179.8000113.6L121 L295 L296 L301 A302L121-L299 HydrophobicContact CD1-CD2 4.21Å; L295-L299 WeakPolarHBondContact O-CG 3.45Å; L295-L299 PolarHBondContact O-N 3.27Å; L296-L299 PolarHBondContact O-N 3.37Å; L299-L301 PolarHBondContact O-N 3.02Å; L299-L301 VanDerWaalsContact O-N 3.13Å; L299-A302 WeakPolarHBondContact O-CB 3.24Å; L299-A302 PolarHBondContact O-N 3.1Å
300I98.5Very high98Very high7 Ų743.1 Ų43.14%0.03623%0.233CC..G310 helixtrans-57.3-25.1171.9-163.6172.4000112.5L296 I298 A302 M303 I304 Y358 F359 I362 L363L296-I300 WeakPolarHBondContact O-CB 3.48Å; L296-I300 WeakPolarHBondContact O-CG2 2.9Å; L296-I300 PolarHBondContact O-N 2.81Å; I298-I300 PolarHBondContact O-N 3.07Å; I300-A302 PolarHBondContact O-N 2.9Å; I300-M303 WeakPolarHBondContact O-CB 3.47Å; I300-M303 PolarHBondContact O-N 3.1Å; I300-I304 PolarHBondContact O-N 3.19Å; I300-Y358 HydrophobicContact CD1-CE1 4.49Å; I300-Y358 HydrophobicContact CG2-CE1 4.15Å; I300-Y358 VanDerWaalsContact CG2-OH 3.27Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.35Å; I300-F359 HydrophobicContact CD1-CD1 3.74Å; I300-F359 HydrophobicContact CD1-CE1 4.11Å; I300-I362 HydrophobicContact CD1-CB 3.75Å; I300-I362 HydrophobicContact CD1-CD1 3.92Å; I300-I362 HydrophobicContact CD1-CG1 4.45Å; I300-I362 HydrophobicContact CD1-CG2 3.47Å; I300-I362 VanDerWaalsContact CD1-CG2 3.47Å; I300-I362 HydrophobicContact CG1-CG2 3.75Å; I300-I362 HydrophobicContact CG2-CD1 4.27Å; I300-L363 HydrophobicContact CD1-CD2 3.84Å; I300-L363 HydrophobicContact CD1-CG 3.96Å; I300-L363 HydrophobicContact CG1-CD2 4.06Å
301L98.6Very high98Very high17 Ų1749.6 Ų49.69%0.08926%0.261CS..G310 helixtrans-57.4-32173.3-67.8176000112.3I98 L102 W113 I117 L120 I298 L299 M303 I304I98-L301 HydrophobicContact CG2-CD1 4.37Å; I98-L301 HydrophobicContact CG2-CD2 4.15Å; L102-L301 HydrophobicContact CD2-CD2 4.4Å; W113-L301 HydrophobicContact CH2-CD2 4.4Å; W113-L301 HydrophobicContact CZ2-CB 4.14Å; W113-L301 HydrophobicContact CZ2-CD2 4Å; W113-L301 PolarHBondContact NE1-O 3.15Å; I117-L301 HydrophobicContact CD1-CB 3.84Å; I117-L301 HydrophobicContact CG1-CB 3.98Å; L120-L301 HydrophobicContact CD2-CD1 3.77Å; I298-L301 WeakPolarHBondContact O-CB 3.16Å; I298-L301 WeakPolarHBondContact O-CG 3.36Å; I298-L301 PolarHBondContact O-N 3.24Å; I298-L301 VanDerWaalsContact O-N 3.16Å; L299-L301 PolarHBondContact O-N 3.02Å; L299-L301 VanDerWaalsContact O-N 3.13Å; L301-M303 PolarHBondContact O-N 3.09Å; L301-I304 WeakPolarHBondContact O-CB 3.32Å; L301-I304 WeakPolarHBondContact O-CG1 3.3Å; L301-I304 PolarHBondContact O-N 3.39Å
302A98.2Very high98Very high40 Ų4051.1 Ų51.133%0.33127%0.267SS..G310 helixtrans-69.9-22.217700000112.6I117 L299 I300I117-A302 HydrophobicContact CD1-CB 3.9Å; L299-A302 WeakPolarHBondContact O-CB 3.24Å; L299-A302 PolarHBondContact O-N 3.1Å; I300-A302 PolarHBondContact O-N 2.9Å
303M97.6Very high98Very high85 Ų8548.9 Ų48.942%0.41925%0.254SS..G310 helixtrans-81.5-20.3176.8-60.6-60.4-65.800112.6I300 L301 I306 L307I300-M303 WeakPolarHBondContact O-CB 3.47Å; I300-M303 PolarHBondContact O-N 3.1Å; L301-M303 PolarHBondContact O-N 3.09Å; M303-I306 HydrophobicContact CE-CD1 4.49Å; M303-I306 WeakPolarHBondContact O-CB 3.18Å; M303-I306 PolarHBondContact O-N 3.04Å; M303-I306 HydrophobicContact SD-CD1 4.43Å; M303-L307 HydrophobicContact CB-CD1 3.88Å; M303-L307 HydrophobicContact CB-CG 4.38Å; M303-L307 VanDerWaalsContact O-CG 3.3Å; M303-L307 WeakPolarHBondContact O-CG 3.46Å; M303-L307 PolarHBondContact O-N 3.35Å
304I98.2Very high98Very high14 Ų1448.3 Ų48.37%0.07225%0.249CC..THydrogen-bonded Turntrans-55-46-173.8-60.3-68.8000113.4L102 F107 I300 L301 I306 L307 H308 I362L102-I304 HydrophobicContact CD2-CB 4.46Å; L102-I304 HydrophobicContact CD2-CD1 4.21Å; L102-I304 HydrophobicContact CD2-CG1 4Å; L102-I304 HydrophobicContact CD2-CG2 3.86Å; F107-I304 HydrophobicContact CB-CG2 4.32Å; F107-I304 HydrophobicContact CD1-CG2 3.46Å; F107-I304 VanDerWaalsContact CD1-CG2 3.46Å; F107-I304 HydrophobicContact CD2-CG2 3.8Å; F107-I304 HydrophobicContact CE1-CG2 3.55Å; F107-I304 HydrophobicContact CE2-CG2 3.92Å; F107-I304 HydrophobicContact CG-CG2 3.58Å; F107-I304 HydrophobicContact CZ-CG2 3.79Å; I300-I304 PolarHBondContact O-N 3.19Å; L301-I304 WeakPolarHBondContact O-CB 3.32Å; L301-I304 WeakPolarHBondContact O-CG1 3.3Å; L301-I304 PolarHBondContact O-N 3.39Å; I304-I306 VanDerWaalsContact C-N 3.26Å; I304-I306 PolarHBondContact O-N 3Å; I304-L307 PolarHBondContact O-N 2.67Å; I304-H308 PolarHBondContact O-N 3.44Å; I304-I362 HydrophobicContact CD1-CG2 3.45Å; I304-I362 VanDerWaalsContact CD1-CG2 3.45Å
305P97.7Very high98Very high33 Ų3347.4 Ų47.421%0.21424%0.244CC..THydrogen-bonded Turntrans-60.3-36177.9-22.934.4000113.1F107 H308F107-P305 HydrophobicContact CB-CG 4.3Å; F107-P305 HydrophobicContact CD2-CB 4.28Å; F107-P305 HydrophobicContact CD2-CG 4.19Å; F107-P305 WeakPolarHBondContact O-CG 3.42Å; P305-H308 WeakPolarHBondContact O-CB 3.38Å; P305-H308 PolarHBondContact O-N 3.17Å
306I97.2Very high98.1Very high115 Ų11547 Ų4759%0.5924%0.241SC*.THydrogen-bonded Turntrans-73.9-32.6-179.4-54.8170.3000110.8M303 I304 H308M303-I306 HydrophobicContact CE-CD1 4.49Å; M303-I306 WeakPolarHBondContact O-CB 3.18Å; M303-I306 PolarHBondContact O-N 3.04Å; M303-I306 HydrophobicContact SD-CD1 4.43Å; I304-I306 VanDerWaalsContact C-N 3.26Å; I304-I306 PolarHBondContact O-N 3Å; I306-H308 PolarHBondContact O-N 3.43Å
307L97.7Very high98Very high34 Ų3447.8 Ų47.818%0.17824%0.241CC..THydrogen-bonded Turntrans-79.1-4.4179.4-67.8172000113.2M303 I304 M309 I362 L363 P367M303-L307 HydrophobicContact CB-CD1 3.88Å; M303-L307 HydrophobicContact CB-CG 4.38Å; M303-L307 VanDerWaalsContact O-CG 3.3Å; M303-L307 WeakPolarHBondContact O-CG 3.46Å; M303-L307 PolarHBondContact O-N 3.35Å; I304-L307 PolarHBondContact O-N 2.67Å; L307-M309 PolarHBondContact O-N 2.98Å; L307-M309 VanDerWaalsContact O-N 3.15Å; L307-I362 HydrophobicContact CD1-CG2 4.19Å; L307-L363 HydrophobicContact CD1-CD2 3.84Å; L307-P367 HydrophobicContact CB-CG 4.03Å; L307-P367 HydrophobicContact CD2-CG 4.07Å
308H98Very high98Very high41 Ų4148 Ų4819%0.1924%0.241CC..  trans-76.2102.4-179.4-172.978.2000112.1F107 L108 I304 P305 I306 S310 Q312F107-H308 HydrophobicContact CE2-CB 3.82Å; F107-H308 AromaticContact CE2-CG 3.94Å; F107-H308 AromaticContact CE2-ND1 3.82Å; F107-H308 HydrophobicContact CZ-CB 4.31Å; F107-H308 AromaticContact CZ-ND1 3.6Å; L108-H308 HydrophobicContact CD2-CB 4.28Å; I304-H308 PolarHBondContact O-N 3.44Å; P305-H308 WeakPolarHBondContact O-CB 3.38Å; P305-H308 PolarHBondContact O-N 3.17Å; I306-H308 PolarHBondContact O-N 3.43Å; H308-S310 PolarHBondContact NE2-O 3.4Å; H308-Q312 PolarHBondContact CE1-O 2.69Å
309M97.8Very high98Very high86 Ų8651.4 Ų51.442%0.42427%0.265SS..  trans-103.7-2.7-178.8-61.2-63.6169.600114L307 P367 L371 N374L307-M309 PolarHBondContact O-N 2.98Å; L307-M309 VanDerWaalsContact O-N 3.15Å; M309-P367 HydrophobicContact CG-CB 4.08Å; M309-L371 HydrophobicContact CB-CD2 3.83Å; M309-L371 HydrophobicContact CB-CG 3.87Å; M309-L371 HydrophobicContact CG-CD2 4.47Å; M309-L371 HydrophobicContact CG-CG 4.39Å; M309-N374 PolarHBondContact O-ND2 2.91Å
310S98.1Very high98.1Very high10 Ų1050.8 Ų50.87%0.0726%0.261CS..  trans-77147.1-178.5172.40000111.3H308 Q312 R318H308-S310 PolarHBondContact NE2-O 3.4Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.45Å; S310-Q312 PolarHBondContact OG-N 3.31Å; S310-Q312 PolarHBondContact OG-O 2.91Å; S310-R318 WeakPolarHBondContact OG-CD 3.16Å; S310-R318 VanDerWaalsContact OG-CZ 3.31Å; S310-R318 PolarHBondContact OG-NE 3.31Å; S310-R318 PolarHBondContact OG-NH1 3.04Å
311K97.8Very high98.1Very high136 Ų13650.5 Ų50.559%0.59126%0.26SS*.SBendtrans-82.7-12.5168.9-54.8-71-173.1173.70112.6N374 W379 A380K311-N374 PolarHBondContact N-OD1 2.93Å; K311-W379 HydrophobicContact CB-CD2 4.01Å; K311-W379 HydrophobicContact CB-CE3 3.46Å; K311-W379 VanDerWaalsContact CB-CE3 3.46Å; K311-W379 HydrophobicContact CB-CH2 4.44Å; K311-W379 HydrophobicContact CB-CZ3 3.71Å; K311-W379 HydrophobicContact CG-CB 4.2Å; K311-W379 HydrophobicContact CG-CD2 4.21Å; K311-W379 HydrophobicContact CG-CE3 3.88Å; K311-W379 HydrophobicContact CG-CG 4.41Å; K311-A380 VanDerWaalsContact CE-O 3.22Å; K311-A380 WeakPolarHBondContact CE-O 3.46Å; K311-A380 PolarHBondContact NZ-O 3.14Å
312Q98.1Very high98.1Very high43 Ų4352.3 Ų52.320%0.20127%0.268CS..SBendtrans-99.4130.6170.2-79161.1-26.900110.7H308 S310 R318 W379H308-Q312 PolarHBondContact CE1-O 2.69Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.45Å; S310-Q312 PolarHBondContact OG-N 3.31Å; S310-Q312 PolarHBondContact OG-O 2.91Å; Q312-R318 HydrophobicContact CB-CG 4.44Å; Q312-R318 VanDerWaalsContact OE1-CG 3.23Å; Q312-W379 HydrophobicContact CB-CZ3 4.44Å; Q312-W379 HydrophobicContact CG-CH2 3.43Å; Q312-W379 VanDerWaalsContact CG-CH2 3.43Å; Q312-W379 HydrophobicContact CG-CZ3 3.57Å
313Q97.8Very high98.1Very high42 Ų4253.7 Ų53.720%0.19628%0.275CS..SBendtrans-66.1-55.2178175.4168.65.100112.2G105 L108 N206G105-Q313 PolarHBondContact O-NE2 2.94Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å; N206-Q313 PolarHBondContact ND2-NE2 3.5Å
314S98.3Very high98.1Very high2 Ų250.4 Ų50.41%0.01426%0.259CS..SBendtrans-83.1148.3-177.1174.90000112.5Y104 P208 M316 R318Y104-S314 WeakPolarHBondContact CD1-OG 3.33Å; P208-S314 WeakPolarHBondContact O-CB 3.17Å; P208-S314 PolarHBondContact O-OG 3.03Å; S314-M316 PolarHBondContact O-N 2.93Å; S314-M316 WeakPolarHBondContact OG-CB 3.38Å; S314-M316 PolarHBondContact OG-N 2.98Å; S314-R318 WeakPolarHBondContact O-CD 3.24Å
315M98.6Very high98.2Very high16 Ų1651.1 Ų51.18%0.07926%0.261CS..G310 helixtrans-75.6-5.6170-64.3-175.7-17500113.5Y103 F317 R318 Q322 Y325 M366Y103-M315 HydrophobicContact CD2-CB 4.28Å; Y103-M315 HydrophobicContact CD2-SD 4.32Å; Y103-M315 HydrophobicContact CE1-CB 4.45Å; Y103-M315 HydrophobicContact CE2-CB 4.21Å; Y103-M315 HydrophobicContact CG-CB 4.47Å; Y103-M315 VanDerWaalsContact O-CB 3.27Å; Y103-M315 WeakPolarHBondContact O-CB 3.43Å; Y103-M315 VanDerWaalsContact O-CG 3.31Å; Y103-M315 WeakPolarHBondContact O-CG 3.03Å; Y103-M315 PolarHBondContact O-N 3.19Å; M315-F317 PolarHBondContact O-N 2.98Å; M315-R318 PolarHBondContact O-N 3.48Å; M315-Q322 HydrophobicContact CB-CG 4.19Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.22Å; M315-Q322 PolarHBondContact O-NE2 2.86Å; M315-Y325 HydrophobicContact SD-CD2 4.47Å; M315-Y325 HydrophobicContact SD-CG 4.42Å; M315-M366 HydrophobicContact CE-CE 4.49Å
316M97.9Very high98.2Very high78 Ų7856.4 Ų56.438%0.38428%0.277SS..G310 helixtrans-52.9-32.5-175.8-178165.9178.100114.3P208 L209 S314 Q322P208-M316 HydrophobicContact CB-SD 4.27Å; L209-M316 HydrophobicContact CD2-CE 3.84Å; L209-M316 HydrophobicContact CD2-SD 3.7Å; S314-M316 PolarHBondContact O-N 2.93Å; S314-M316 WeakPolarHBondContact OG-CB 3.38Å; S314-M316 PolarHBondContact OG-N 2.98Å; M316-Q322 PolarHBondContact O-NE2 2.94Å
317F98Very high98.3Very high111 Ų11154.3 Ų54.349%0.48727%0.267SS..G310 helixtrans-109.720.1179.2-56.2-62.1000113.6L209 M315L209-F317 HydrophobicContact CD2-CE2 3.99Å; L209-F317 HydrophobicContact CD2-CZ 3.65Å; M315-F317 PolarHBondContact O-N 2.98Å
318R98.4Very high98.3Very high5 Ų553.1 Ų53.12%0.01926%0.261CS..  trans-12777.6-171.3-69.417656.6-165-0110.9S310 Q312 S314 M315 L320 S321 Q322 S370 E373S310-R318 WeakPolarHBondContact OG-CD 3.16Å; S310-R318 VanDerWaalsContact OG-CZ 3.31Å; S310-R318 PolarHBondContact OG-NE 3.31Å; S310-R318 PolarHBondContact OG-NH1 3.04Å; Q312-R318 HydrophobicContact CB-CG 4.44Å; Q312-R318 VanDerWaalsContact OE1-CG 3.23Å; S314-R318 WeakPolarHBondContact O-CD 3.24Å; M315-R318 PolarHBondContact O-N 3.48Å; R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.42Å; R318-S321 PolarHBondContact NE-OG 3.39Å; R318-S321 PolarHBondContact NH2-OG 2.92Å; R318-S321 PolarHBondContact O-N 2.85Å; R318-S321 VanDerWaalsContact O-N 3.14Å; R318-Q322 WeakPolarHBondContact O-CG 3.31Å; R318-Q322 PolarHBondContact O-N 2.89Å; R318-S370 PolarHBondContact NH2-OG 3.26Å; R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.3Å; R318-E373 WeakPolarHBondContact CB-OE1 3.36Å; R318-E373 WeakPolarHBondContact CB-OE2 3.46Å; R318-E373 IonicContact CZ-OE2 2.9Å; R318-E373 IonicContact NE-OE2 3.28Å; R318-E373 PolarHBondContact NE-OE2 3.03Å; R318-E373 IonicContact NH2-OE2 3.38Å; R318-E373 PolarHBondContact NH2-OE2 3.16Å
319P98.3Very high98.4Very high88 Ų8852.6 Ų52.657%0.57126%0.263SS*.Hα-helixtrans-62.6-34-167.724.1-34.3000113.5Q322 S323P319-Q322 PolarHBondContact O-N 2.83Å; P319-S323 PolarHBondContact O-N 3.26Å; P319-S323 VanDerWaalsContact O-N 3.12Å
320L98.5Very high98.4Very high64 Ų6450.6 Ų50.634%0.33526%0.26SS..Hα-helixtrans-69.9-42.5177.4-60.2178000109.9R318 Q322 S323 L324 I369 I372 E373 M376R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.42Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.4Å; L320-S323 PolarHBondContact O-N 3.15Å; L320-S323 PolarHBondContact O-OG 3.43Å; L320-L324 PolarHBondContact O-N 2.87Å; L320-L324 VanDerWaalsContact O-N 3.11Å; L320-I369 HydrophobicContact CB-CD1 4.43Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.32Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L320-I372 HydrophobicContact CD1-CG2 4.41Å; L320-E373 HydrophobicContact CB-CG 4.25Å; L320-E373 WeakPolarHBondContact CB-OE1 3.44Å; L320-E373 HydrophobicContact CD1-CG 4.21Å; L320-E373 PolarHBondContact N-OE1 3.24Å; L320-M376 HydrophobicContact CD1-SD 4.06Å
321S98.6Very high98.5Very high1 Ų150.3 Ų50.31%0.00726%0.258CS..Hα-helixtrans-64.7-35.6175-63.30000113.1R318 S323 L324 Y325 E373R318-S321 PolarHBondContact NE-OG 3.39Å; R318-S321 PolarHBondContact NH2-OG 2.92Å; R318-S321 PolarHBondContact O-N 2.85Å; R318-S321 VanDerWaalsContact O-N 3.14Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.04Å; S321-L324 PolarHBondContact O-N 3.21Å; S321-Y325 PolarHBondContact O-N 2.86Å; S321-E373 PolarHBondContact N-OE1 2.77Å; S321-E373 PolarHBondContact OG-OE1 3.13Å; S321-E373 PolarHBondContact OG-OE2 3.41Å
322Q98.8Very high98.5Very high54 Ų5446.4 Ų46.425%0.25224%0.243SC..Hα-helixtrans-60.6-43.8172.5-69.5177.937.800111.6Y103 M315 M316 R318 P319 L320 L324 Y325 W326Y103-Q322 HydrophobicContact CE2-CB 4.49Å; Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 VanDerWaalsContact OH-CD 3.24Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.24Å; Y103-Q322 PolarHBondContact OH-OE1 3.12Å; M315-Q322 HydrophobicContact CB-CG 4.19Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.22Å; M315-Q322 PolarHBondContact O-NE2 2.86Å; M316-Q322 PolarHBondContact O-NE2 2.94Å; R318-Q322 WeakPolarHBondContact O-CG 3.31Å; R318-Q322 PolarHBondContact O-N 2.89Å; P319-Q322 PolarHBondContact O-N 2.83Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 3.4Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 3.28Å; Q322-Y325 PolarHBondContact O-N 2.85Å; Q322-W326 PolarHBondContact O-N 3.49Å
323S98.5Very high98.5Very high69 Ų6950.4 Ų50.448%0.48327%0.266SS..Hα-helixtrans-61.8-40.8177.4760000111.8P319 L320 S321 W326 L327P319-S323 PolarHBondContact O-N 3.26Å; P319-S323 VanDerWaalsContact O-N 3.12Å; L320-S323 PolarHBondContact O-N 3.15Å; L320-S323 PolarHBondContact O-OG 3.43Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.04Å; S323-W326 PolarHBondContact O-N 2.93Å; S323-L327 WeakPolarHBondContact O-CB 3.42Å; S323-L327 PolarHBondContact O-N 2.79Å
324L98.5Very high98.6Very high17 Ų1751.8 Ų51.89%0.08927%0.273CS..Hα-helixtrans-68.2-35.9175.6-73.6-172.9000113.1L320 S321 Q322 L327 L328 L365 M366 I369L320-L324 PolarHBondContact O-N 2.87Å; L320-L324 VanDerWaalsContact O-N 3.11Å; S321-L324 PolarHBondContact O-N 3.21Å; Q322-L324 VanDerWaalsContact C-N 3.32Å; Q322-L324 PolarHBondContact O-N 3.28Å; L324-L327 HydrophobicContact CD2-CD2 4.1Å; L324-L327 PolarHBondContact O-N 3.39Å; L324-L328 WeakPolarHBondContact O-CB 3.16Å; L324-L328 PolarHBondContact O-N 3.28Å; L324-L365 HydrophobicContact CD1-CB 3.76Å; L324-L365 HydrophobicContact CD2-CB 4.18Å; L324-L365 HydrophobicContact CD2-CD1 4.22Å; L324-M366 HydrophobicContact CB-CE 4.47Å; L324-M366 HydrophobicContact CB-CG 4.38Å; L324-M366 HydrophobicContact CD1-CG 4.16Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.57Å; L324-I369 HydrophobicContact CD1-CG2 4.29Å; L324-I369 HydrophobicContact CG-CG1 4.44Å
325Y98.8Very high98.6Very high29 Ų2951.7 Ų51.711%0.11427%0.273CS..Hα-helixtrans-61.4-46.7173.9171.6-91.7000111.4G99 L102 Y103 M315 S321 Q322 L327 L328 A329G99-Y325 WeakPolarHBondContact CA-OH 3.39Å; G99-Y325 WeakPolarHBondContact O-CE2 3.33Å; G99-Y325 PolarHBondContact O-OH 3.42Å; G99-Y325 VanDerWaalsContact O-OH 3.13Å; L102-Y325 HydrophobicContact CB-CE2 4.19Å; Y103-Y325 AromaticContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD2 4.04Å; Y103-Y325 AromaticContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE2 4.23Å; Y103-Y325 AromaticContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CD2-CG 3.68Å; Y103-Y325 HydrophobicContact CE2-CD1 4.06Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å; Y103-Y325 HydrophobicContact CG-CE1 4.49Å; M315-Y325 HydrophobicContact SD-CD2 4.47Å; M315-Y325 HydrophobicContact SD-CG 4.42Å; S321-Y325 PolarHBondContact O-N 2.86Å; Q322-Y325 PolarHBondContact O-N 2.85Å; Y325-L327 VanDerWaalsContact C-N 3.35Å; Y325-L328 WeakPolarHBondContact O-CB 3.45Å; Y325-L328 PolarHBondContact O-N 3.35Å; Y325-A329 PolarHBondContact O-N 3.49Å
326W98.8Very high98.6Very high143 Ų14352.6 Ų52.654%0.54228%0.279SS..Hα-helixtrans-70.9-31.6178.4-71.4116.9000112.7Q322 S323 A329 A330Q322-W326 PolarHBondContact O-N 3.49Å; S323-W326 PolarHBondContact O-N 2.93Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 2.66Å; W326-A330 WeakPolarHBondContact O-CB 3.49Å; W326-A330 PolarHBondContact O-N 2.95Å
327L98.7Very high98.7Very high71 Ų7155.1 Ų55.137%0.37229%0.285SS..Hα-helixtrans-60.1-46.8168.6-179.664.4000111S323 L324 Y325 A329 A330 D331 L357S323-L327 WeakPolarHBondContact O-CB 3.42Å; S323-L327 PolarHBondContact O-N 2.79Å; L324-L327 HydrophobicContact CD2-CD2 4.1Å; L324-L327 PolarHBondContact O-N 3.39Å; Y325-L327 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 2.87Å; L327-A330 PolarHBondContact O-N 3.28Å; L327-D331 WeakPolarHBondContact O-CB 3.45Å; L327-D331 PolarHBondContact O-N 2.94Å; L327-L357 HydrophobicContact CD1-CD2 4.28Å; L327-L357 HydrophobicContact CD2-CD1 4.33Å
328L98.8Very high98.7Very high10 Ų1050 Ų505%0.05226%0.263CS..Hα-helixtrans-62-41.9176.3179.163.2000111.9L324 Y325 D331 L332 Y358 T361 I362 M366L324-L328 WeakPolarHBondContact O-CB 3.16Å; L324-L328 PolarHBondContact O-N 3.28Å; Y325-L328 WeakPolarHBondContact O-CB 3.45Å; Y325-L328 PolarHBondContact O-N 3.35Å; L328-D331 PolarHBondContact O-N 3.46Å; L328-L332 HydrophobicContact CG-CD1 4.5Å; L328-L332 WeakPolarHBondContact O-CG 3.15Å; L328-L332 PolarHBondContact O-N 3Å; L328-Y358 HydrophobicContact CD1-CD2 3.63Å; L328-Y358 HydrophobicContact CD1-CE2 3.93Å; L328-T361 HydrophobicContact CB-CG2 4.11Å; L328-I362 HydrophobicContact CD1-CD1 4.07Å; L328-I362 HydrophobicContact CD1-CG1 4.13Å; L328-I362 HydrophobicContact CD2-CD1 4.14Å; L328-I362 HydrophobicContact CD2-CG1 3.9Å; L328-M366 HydrophobicContact CB-CE 4.35Å; L328-M366 HydrophobicContact CD2-CE 3.88Å
329A98.8Very high98.7Very high29 Ų2949.8 Ų49.824%0.2426%0.262CS..Hα-helixtrans-63.2-43.6176.600000111.7Y325 W326 L327 L332 L333Y325-A329 PolarHBondContact O-N 3.49Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 2.66Å; L327-A329 PolarHBondContact O-N 2.87Å; A329-L332 PolarHBondContact O-N 2.96Å; A329-L333 WeakPolarHBondContact O-CG 3.39Å; A329-L333 PolarHBondContact O-N 2.93Å; A329-L333 VanDerWaalsContact O-N 3.17Å
330A98.9Very high98.6Very high45 Ų4547 Ų4737%0.37225%0.249SC..Hα-helixtrans-64.7-40.3175.600000112W326 L327 L333 I334W326-A330 WeakPolarHBondContact O-CB 3.49Å; W326-A330 PolarHBondContact O-N 2.95Å; L327-A330 PolarHBondContact O-N 3.28Å; A330-L333 WeakPolarHBondContact O-CB 3.44Å; A330-L333 PolarHBondContact O-N 2.92Å; A330-I334 WeakPolarHBondContact O-CG1 3.4Å; A330-I334 PolarHBondContact O-N 2.76Å
331D98.9Very high98.6Very high3 Ų346.7 Ų46.72%0.01625%0.246CC..Hα-helixtrans-63.4-41.2176.7-173.255.4000111.9L327 L328 L333 I334 L335 A354 L357 Y358L327-D331 WeakPolarHBondContact O-CB 3.45Å; L327-D331 PolarHBondContact O-N 2.94Å; L328-D331 PolarHBondContact O-N 3.46Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.39Å; D331-I334 WeakPolarHBondContact O-CB 3.47Å; D331-I334 PolarHBondContact O-N 3.09Å; D331-I334 VanDerWaalsContact O-N 3.14Å; D331-L335 WeakPolarHBondContact O-CG 3.28Å; D331-L335 PolarHBondContact O-N 3.03Å; D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.41Å; D331-A354 WeakPolarHBondContact OD1-CB 3.06Å; D331-A354 VanDerWaalsContact OD2-O 3.08Å; D331-L357 HydrophobicContact CB-CD2 4.23Å; D331-Y358 VanDerWaalsContact OD2-CA 3.29Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.32Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.37Å; D331-Y358 PolarHBondContact OD2-N 3.1Å; D331-Y358 VanDerWaalsContact OD2-N 3.11Å
332L98.9Very high98.5Very high54 Ų5448.6 Ų48.628%0.28326%0.258SS..Hα-helixtrans-60.8-37.1172-78.6168.9000112.9F276 L328 A329 L335 T336 Y358F276-L332 HydrophobicContact CB-CD2 4.2Å; F276-L332 HydrophobicContact CD2-CD2 3.65Å; F276-L332 HydrophobicContact CE2-CD2 4.33Å; F276-L332 HydrophobicContact CG-CD2 4.04Å; L328-L332 HydrophobicContact CG-CD1 4.5Å; L328-L332 WeakPolarHBondContact O-CG 3.15Å; L328-L332 PolarHBondContact O-N 3Å; A329-L332 PolarHBondContact O-N 2.96Å; L332-L335 HydrophobicContact CD2-CD1 4.4Å; L332-T336 WeakPolarHBondContact O-CB 3.39Å; L332-T336 PolarHBondContact O-N 3.37Å; L332-T336 PolarHBondContact O-OG1 3.47Å; L332-Y358 HydrophobicContact CD2-CD2 4.02Å; L332-Y358 HydrophobicContact CD2-CE2 3.77Å; L332-Y358 HydrophobicContact CG-CD2 4.39Å; L332-Y358 HydrophobicContact CG-CE2 4.3Å
333L98.8Very high98.3Very high128 Ų12851 Ų5167%0.6728%0.276SS*.Hα-helixtrans-66.9-39.8173.6-67.3173.5000111.5A329 A330 D331 T336 W337A329-L333 WeakPolarHBondContact O-CG 3.39Å; A329-L333 PolarHBondContact O-N 2.93Å; A329-L333 VanDerWaalsContact O-N 3.17Å; A330-L333 WeakPolarHBondContact O-CB 3.44Å; A330-L333 PolarHBondContact O-N 2.92Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.39Å; L333-T336 PolarHBondContact O-N 3.36Å; L333-W337 WeakPolarHBondContact O-CB 3.49Å; L333-W337 PolarHBondContact O-N 3.43Å
334I98.9Very high98.1Very high70 Ų7050 Ų5036%0.35927%0.27SS..Hα-helixtrans-63.4-48.2174-68.1167.9000110.3A330 D331 T336 W337 I338 I350 A354A330-I334 WeakPolarHBondContact O-CG1 3.4Å; A330-I334 PolarHBondContact O-N 2.76Å; D331-I334 WeakPolarHBondContact O-CB 3.47Å; D331-I334 PolarHBondContact O-N 3.09Å; D331-I334 VanDerWaalsContact O-N 3.14Å; I334-T336 VanDerWaalsContact C-N 3.26Å; I334-T336 PolarHBondContact O-N 2.95Å; I334-W337 HydrophobicContact CG2-CE3 4.44Å; I334-W337 PolarHBondContact O-N 2.88Å; I334-W337 VanDerWaalsContact O-N 3.16Å; I334-I338 HydrophobicContact CG2-CG1 4.15Å; I334-I338 WeakPolarHBondContact O-CB 3.32Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.25Å; I334-I338 PolarHBondContact O-N 3.11Å; I334-I350 HydrophobicContact CG2-CG2 3.97Å; I334-A354 HydrophobicContact CG2-CB 4.08Å
335L98.9Very high98Very high0 Ų059 Ų590%030%0.304CS..Hα-helixtrans-57.4-40.7176.3-73.3170.9000111.7F276 T279 I280 D331 L332 G339 A354 Y358F276-L335 HydrophobicContact CB-CB 3.91Å; T279-L335 WeakPolarHBondContact CB-O 3.38Å; T279-L335 HydrophobicContact CG2-CD2 3.53Å; T279-L335 PolarHBondContact OG1-O 3.39Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.22Å; I280-L335 HydrophobicContact CG1-CD2 4.12Å; D331-L335 WeakPolarHBondContact O-CG 3.28Å; D331-L335 PolarHBondContact O-N 3.03Å; L332-L335 HydrophobicContact CD2-CD1 4.4Å; L335-G339 PolarHBondContact O-N 3.46Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.95Å; L335-Y358 HydrophobicContact CD1-CD2 4.24Å; L335-Y358 HydrophobicContact CD1-CG 4.3Å
336T98.8Very high98Very high36 Ų3660.1 Ų60.122%0.22132%0.315CS..Hα-helixtrans-64-48175.7-57.90000111.1L275 L332 L333 I334 G339 G340L275-T336 HydrophobicContact CB-CG2 4.04Å; L275-T336 WeakPolarHBondContact CB-O 3.34Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å; L332-T336 WeakPolarHBondContact O-CB 3.39Å; L332-T336 PolarHBondContact O-N 3.37Å; L332-T336 PolarHBondContact O-OG1 3.47Å; L333-T336 PolarHBondContact O-N 3.36Å; I334-T336 VanDerWaalsContact C-N 3.26Å; I334-T336 PolarHBondContact O-N 2.95Å; T336-G339 WeakPolarHBondContact O-CA 3.26Å; T336-G339 PolarHBondContact O-N 3.24Å; T336-G339 VanDerWaalsContact O-N 3.14Å; T336-G340 PolarHBondContact O-N 3.07Å
337W98.7Very high98Very high130 Ų13055.4 Ų55.449%0.49230%0.298SS..Hα-helixtrans-59.3-49.9177.6166.157.4000112.1L333 I334 G339 G340 Q341 F347 I350L333-W337 WeakPolarHBondContact O-CB 3.49Å; L333-W337 PolarHBondContact O-N 3.43Å; I334-W337 HydrophobicContact CG2-CE3 4.44Å; I334-W337 PolarHBondContact O-N 2.88Å; I334-W337 VanDerWaalsContact O-N 3.16Å; W337-G339 PolarHBondContact O-N 3.1Å; W337-G340 PolarHBondContact O-N 3.07Å; W337-G340 VanDerWaalsContact O-N 3.1Å; W337-Q341 WeakPolarHBondContact O-CG 3.35Å; W337-F347 HydrophobicContact CH2-CD1 4.38Å; W337-F347 HydrophobicContact CH2-CE1 4.03Å; W337-F347 HydrophobicContact CZ2-CD1 4.39Å; W337-F347 AromaticContact CZ2-CE1 3.75Å; W337-F347 HydrophobicContact CZ2-CE1 3.75Å; W337-I350 HydrophobicContact CH2-CD1 4.49Å
338I98.7Very high97.9Very high5 Ų554.5 Ų54.53%0.02630%0.295CS..Hα-helixtrans-61.6-30.2176.8-63.9-61000111.5T279 R282 I334 G340 Q341 F347 I350T279-I338 HydrophobicContact CG2-CB 4.03Å; T279-I338 HydrophobicContact CG2-CG2 3.64Å; R282-I338 PolarHBondContact NH2-O 2.72Å; I334-I338 HydrophobicContact CG2-CG1 4.15Å; I334-I338 WeakPolarHBondContact O-CB 3.32Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.25Å; I334-I338 PolarHBondContact O-N 3.11Å; I338-G340 PolarHBondContact O-N 3.03Å; I338-Q341 PolarHBondContact O-N 3Å; I338-F347 HydrophobicContact CD1-CB 4.24Å; I338-F347 HydrophobicContact CD1-CD1 3.72Å; I338-F347 HydrophobicContact CD1-CG 4.43Å; I338-I350 HydrophobicContact CD1-CB 3.89Å; I338-I350 HydrophobicContact CD1-CD1 4.37Å; I338-I350 HydrophobicContact CD1-CG2 3.67Å; I338-I350 HydrophobicContact CG1-CB 4.37Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å
339G98Very high97.9Very high0 Ų058 Ų580%031%0.313CS..Hα-helixtrans-55.7-38.9175.300000112.4T279 R282 L335 T336 W337T279-G339 WeakPolarHBondContact OG1-CA 3.38Å; T279-G339 PolarHBondContact OG1-N 2.93Å; R282-G339 PolarHBondContact NH2-O 3.13Å; R282-G339 VanDerWaalsContact NH2-O 3.16Å; L335-G339 PolarHBondContact O-N 3.46Å; T336-G339 WeakPolarHBondContact O-CA 3.26Å; T336-G339 PolarHBondContact O-N 3.24Å; T336-G339 VanDerWaalsContact O-N 3.14Å; W337-G339 PolarHBondContact O-N 3.1Å
340G96.9Very high97.9Very high30 Ų3059.2 Ų59.231%0.30932%0.315SS..THydrogen-bonded Turntrans-83-5.1178.100000115.1T336 W337 I338T336-G340 PolarHBondContact O-N 3.07Å; W337-G340 PolarHBondContact O-N 3.07Å; W337-G340 VanDerWaalsContact O-N 3.1Å; I338-G340 PolarHBondContact O-N 3.03Å
341Q97.8Very high97.9Very high56 Ų5657.1 Ų57.126%0.26230%0.298SS..SBendtrans-92.8154.4-179.3-58.8-50.4-43.400112.5R282 W337 I338 F347R282-Q341 PolarHBondContact NH1-O 2.93Å; R282-Q341 VanDerWaalsContact NH1-O 3.11Å; W337-Q341 WeakPolarHBondContact O-CG 3.35Å; I338-Q341 PolarHBondContact O-N 3Å; Q341-F347 HydrophobicContact CB-CB 4.07Å; Q341-F347 HydrophobicContact CB-CD1 3.95Å; Q341-F347 HydrophobicContact CB-CD2 3.73Å; Q341-F347 HydrophobicContact CB-CE1 4.3Å; Q341-F347 HydrophobicContact CB-CE2 4.09Å; Q341-F347 HydrophobicContact CB-CG 3.64Å; Q341-F347 HydrophobicContact CB-CZ 4.36Å; Q341-F347 HydrophobicContact CG-CD1 3.79Å; Q341-F347 HydrophobicContact CG-CD2 4.28Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.29Å; Q341-F347 HydrophobicContact CG-CG 4.03Å; Q341-F347 HydrophobicContact CG-CZ 4.05Å
342P95.8Very high97.9Very high41 Ų4160.3 Ų60.327%0.26631%0.313SS..  trans-65.3153.4173.127.6-35.6000112S344 F347P342-S344 VanDerWaalsContact C-N 3.3Å; P342-S344 PolarHBondContact O-N 3.06Å; P342-F347 HydrophobicContact CG-CD2 4.3Å; P342-F347 HydrophobicContact CG-CE2 4.38Å
343V95Very high97.9Very high105 Ų10562 Ų6264%0.63633%0.325SS*.SBendtrans-7683.9175.4-172.90000109.4
344S95.8Very high97.9Very high49 Ų4956.1 Ų56.134%0.34330%0.295SS..  trans-151.9163.4-178.258.40000110.6P342 F347 T348P342-S344 VanDerWaalsContact C-N 3.3Å; P342-S344 PolarHBondContact O-N 3.06Å; S344-F347 WeakPolarHBondContact O-CA 3.42Å; S344-F347 WeakPolarHBondContact O-CB 3.39Å; S344-F347 PolarHBondContact O-N 3.02Å; S344-T348 PolarHBondContact N-OG1 3.38Å; S344-T348 PolarHBondContact O-N 3.48Å; S344-T348 PolarHBondContact O-OG1 3.19Å
345Y96.2Very high97.9Very high206 Ų20653.2 Ų53.281%0.80828%0.281SS*.THydrogen-bonded Turntrans-67.3136171.6-179.2-90.8000110.3I349Y345-I349 HydrophobicContact CD2-CG2 4.47Å; Y345-I349 HydrophobicContact CE2-CG2 4.33Å
346P97.4Very high97.9Very high52 Ų5257.7 Ų57.734%0.33831%0.308SS..THydrogen-bonded Turncis-930.83.336.8-35.7000114.7T348 I349 I350P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 2.86Å; P346-I349 HydrophobicContact CB-CG2 4.47Å; P346-I349 WeakPolarHBondContact O-CG2 3.44Å; P346-I349 PolarHBondContact O-N 2.97Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.5Å; P346-I350 PolarHBondContact O-N 3.02Å; P346-I350 VanDerWaalsContact O-N 3.16Å
347F98.4Very high97.9Very high44 Ų4458.4 Ų58.419%0.19331%0.31CS..Hα-helixtrans-62.8-34.7-173.3-56.5-55.1000113.9W337 I338 Q341 P342 S344 I349 I350 G351W337-F347 HydrophobicContact CH2-CD1 4.38Å; W337-F347 HydrophobicContact CH2-CE1 4.03Å; W337-F347 HydrophobicContact CZ2-CD1 4.39Å; W337-F347 AromaticContact CZ2-CE1 3.75Å; W337-F347 HydrophobicContact CZ2-CE1 3.75Å; I338-F347 HydrophobicContact CD1-CB 4.24Å; I338-F347 HydrophobicContact CD1-CD1 3.72Å; I338-F347 HydrophobicContact CD1-CG 4.43Å; Q341-F347 HydrophobicContact CB-CB 4.07Å; Q341-F347 HydrophobicContact CB-CD1 3.95Å; Q341-F347 HydrophobicContact CB-CD2 3.73Å; Q341-F347 HydrophobicContact CB-CE1 4.3Å; Q341-F347 HydrophobicContact CB-CE2 4.09Å; Q341-F347 HydrophobicContact CB-CG 3.64Å; Q341-F347 HydrophobicContact CB-CZ 4.36Å; Q341-F347 HydrophobicContact CG-CD1 3.79Å; Q341-F347 HydrophobicContact CG-CD2 4.28Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.29Å; Q341-F347 HydrophobicContact CG-CG 4.03Å; Q341-F347 HydrophobicContact CG-CZ 4.05Å; P342-F347 HydrophobicContact CG-CD2 4.3Å; P342-F347 HydrophobicContact CG-CE2 4.38Å; S344-F347 WeakPolarHBondContact O-CA 3.42Å; S344-F347 WeakPolarHBondContact O-CB 3.39Å; S344-F347 PolarHBondContact O-N 3.02Å; F347-I349 PolarHBondContact O-N 3.4Å; F347-I350 PolarHBondContact O-N 2.5Å; F347-G351 PolarHBondContact O-N 3.39Å
348T97.9Very high97.9Very high52 Ų5252.8 Ų52.832%0.31929%0.289SS..Hα-helixtrans-59.4-47.8176.8-54.70000111.9S344 P346 G351 Q352S344-T348 PolarHBondContact N-OG1 3.38Å; S344-T348 PolarHBondContact O-N 3.48Å; S344-T348 PolarHBondContact O-OG1 3.19Å; P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 2.86Å; T348-G351 PolarHBondContact O-N 2.97Å; T348-Q352 WeakPolarHBondContact O-CG 3.24Å; T348-Q352 PolarHBondContact O-N 2.85Å; T348-Q352 VanDerWaalsContact O-N 3.09Å
349I98.5Very high97.9Very high83 Ų8354.7 Ų54.743%0.42630%0.297SS..Hα-helixtrans-72.1-36.3-178.6-173.361.4000111.5Y345 P346 F347 G351 Q352 V353Y345-I349 HydrophobicContact CD2-CG2 4.47Å; Y345-I349 HydrophobicContact CE2-CG2 4.33Å; P346-I349 HydrophobicContact CB-CG2 4.47Å; P346-I349 WeakPolarHBondContact O-CG2 3.44Å; P346-I349 PolarHBondContact O-N 2.97Å; F347-I349 PolarHBondContact O-N 3.4Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 3.46Å; I349-Q352 PolarHBondContact O-N 2.83Å; I349-V353 HydrophobicContact CD1-CG2 4.35Å; I349-V353 HydrophobicContact CG1-CG2 4.43Å; I349-V353 WeakPolarHBondContact O-CG2 3.25Å; I349-V353 PolarHBondContact O-N 3.5Å
350I98.8Very high97.9Very high55 Ų5557 Ų5728%0.28231%0.311SS..Hα-helixtrans-62-45.4174.6-61.4165.8000110I334 W337 I338 P346 F347 Q352 V353 A354I334-I350 HydrophobicContact CG2-CG2 3.97Å; W337-I350 HydrophobicContact CH2-CD1 4.49Å; I338-I350 HydrophobicContact CD1-CB 3.89Å; I338-I350 HydrophobicContact CD1-CD1 4.37Å; I338-I350 HydrophobicContact CD1-CG2 3.67Å; I338-I350 HydrophobicContact CG1-CB 4.37Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.5Å; P346-I350 PolarHBondContact O-N 3.02Å; P346-I350 VanDerWaalsContact O-N 3.16Å; F347-I350 PolarHBondContact O-N 2.5Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.46Å; I350-V353 PolarHBondContact O-N 3.24Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.47Å; I350-A354 PolarHBondContact O-N 2.89Å
351G98.7Very high98Very high1 Ų155.5 Ų55.51%0.0130%0.296CS..Hα-helixtrans-59-42.9176.800000112.8S283 F347 T348 I349 S355S283-G351 PolarHBondContact OG-O 3.23Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; F347-G351 PolarHBondContact O-N 3.39Å; T348-G351 PolarHBondContact O-N 2.97Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 3.46Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.37Å; G351-S355 PolarHBondContact O-N 3.37Å; G351-S355 PolarHBondContact O-OG 2.78Å
352Q98.8Very high98.1Very high69 Ų6953.1 Ų53.132%0.32229%0.285SS..Hα-helixtrans-63.3-48.4176.7-74.3173.5-2300112.3S283 T348 I349 I350 S355 V356S283-Q352 WeakPolarHBondContact O-CG 3.25Å; S283-Q352 PolarHBondContact O-NE2 2.9Å; S283-Q352 PolarHBondContact OG-N 2.84Å; T348-Q352 WeakPolarHBondContact O-CG 3.24Å; T348-Q352 PolarHBondContact O-N 2.85Å; T348-Q352 VanDerWaalsContact O-N 3.09Å; I349-Q352 PolarHBondContact O-N 2.83Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.46Å; Q352-S355 PolarHBondContact O-N 3.12Å; Q352-V356 WeakPolarHBondContact O-CG2 3.38Å; Q352-V356 PolarHBondContact O-N 2.72Å
353V98.8Very high98.2Very high90 Ų9054.8 Ų54.855%0.54529%0.291SS..Hα-helixtrans-62.6-45.8178.7172.30000110.9I349 I350 S355 V356 L357I349-V353 HydrophobicContact CD1-CG2 4.35Å; I349-V353 HydrophobicContact CG1-CG2 4.43Å; I349-V353 WeakPolarHBondContact O-CG2 3.25Å; I349-V353 PolarHBondContact O-N 3.5Å; I350-V353 PolarHBondContact O-N 3.24Å; V353-S355 VanDerWaalsContact C-N 3.34Å; V353-S355 PolarHBondContact O-N 3.05Å; V353-V356 PolarHBondContact O-N 3.14Å; V353-L357 WeakPolarHBondContact O-CB 3.37Å; V353-L357 PolarHBondContact O-N 3.27Å
354A98.9Very high98.4Very high4 Ų454.2 Ų54.23%0.03328%0.284CS..Hα-helixtrans-61.7-41.9176.600000111.6D331 I334 L335 I350 V356 L357 Y358D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.41Å; D331-A354 WeakPolarHBondContact OD1-CB 3.06Å; D331-A354 VanDerWaalsContact OD2-O 3.08Å; I334-A354 HydrophobicContact CG2-CB 4.08Å; L335-A354 HydrophobicContact CD2-CB 3.6Å; L335-A354 HydrophobicContact CG-CB 3.95Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.47Å; I350-A354 PolarHBondContact O-N 2.89Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.39Å; A354-L357 WeakPolarHBondContact O-CB 3.49Å; A354-L357 PolarHBondContact O-N 3.45Å; A354-L357 VanDerWaalsContact O-N 3.15Å; A354-Y358 PolarHBondContact O-N 2.94Å
355S98.8Very high98.5Very high9 Ų954.6 Ų54.66%0.06328%0.282CS..Hα-helixtrans-63.3-40.4177.6-56.40000111.8S283 G351 Q352 V353 F359S283-S355 WeakPolarHBondContact CB-OG 3.05Å; S283-S355 PolarHBondContact OG-OG 3.31Å; G351-S355 VanDerWaalsContact O-CB 3.32Å; G351-S355 WeakPolarHBondContact O-CB 3.37Å; G351-S355 PolarHBondContact O-N 3.37Å; G351-S355 PolarHBondContact O-OG 2.78Å; Q352-S355 PolarHBondContact O-N 3.12Å; V353-S355 VanDerWaalsContact C-N 3.34Å; V353-S355 PolarHBondContact O-N 3.05Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.22Å; S355-F359 PolarHBondContact O-N 2.95Å
356V98.8Very high98.6Very high94 Ų9446 Ų4657%0.5725%0.249SC*.Hα-helixtrans-65.2-42.8173.9171.40000110.7Q352 V353 A354 Y358 T360Q352-V356 WeakPolarHBondContact O-CG2 3.38Å; Q352-V356 PolarHBondContact O-N 2.72Å; V353-V356 PolarHBondContact O-N 3.14Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3.39Å; V356-Y358 PolarHBondContact O-N 2.96Å; V356-T360 WeakPolarHBondContact O-CB 3.21Å; V356-T360 PolarHBondContact O-N 2.54Å; V356-T360 PolarHBondContact O-OG1 2.88Å
357L98.8Very high98.6Very high52 Ų5244.2 Ų44.227%0.27224%0.238SC..Hα-helixtrans-61.6-42.5178.8-176.959.9000111.7L327 D331 V353 A354 T360 T361L327-L357 HydrophobicContact CD1-CD2 4.28Å; L327-L357 HydrophobicContact CD2-CD1 4.33Å; D331-L357 HydrophobicContact CB-CD2 4.23Å; V353-L357 WeakPolarHBondContact O-CB 3.37Å; V353-L357 PolarHBondContact O-N 3.27Å; A354-L357 WeakPolarHBondContact O-CB 3.49Å; A354-L357 PolarHBondContact O-N 3.45Å; A354-L357 VanDerWaalsContact O-N 3.15Å; L357-T360 PolarHBondContact O-N 3.02Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.2Å; L357-T361 PolarHBondContact O-N 3.33Å; L357-T361 PolarHBondContact O-OG1 3.22Å
358Y98.9Very high98.6Very high12 Ų1245 Ų455%0.04725%0.246CC..Hα-helixtrans-53.2-58.7175.8176.3-97.5000112.1I280 S297 I300 L328 D331 L332 L335 A354 V356 T361 I362I280-Y358 HydrophobicContact CD1-CD1 3.93Å; I280-Y358 HydrophobicContact CD1-CE1 4.27Å; I280-Y358 HydrophobicContact CD1-CG 4.26Å; S297-Y358 PolarHBondContact O-OH 3.33Å; I300-Y358 HydrophobicContact CD1-CE1 4.49Å; I300-Y358 HydrophobicContact CG2-CE1 4.15Å; I300-Y358 VanDerWaalsContact CG2-OH 3.27Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.35Å; L328-Y358 HydrophobicContact CD1-CD2 3.63Å; L328-Y358 HydrophobicContact CD1-CE2 3.93Å; D331-Y358 VanDerWaalsContact OD2-CA 3.29Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.32Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.37Å; D331-Y358 PolarHBondContact OD2-N 3.1Å; D331-Y358 VanDerWaalsContact OD2-N 3.11Å; L332-Y358 HydrophobicContact CD2-CD2 4.02Å; L332-Y358 HydrophobicContact CD2-CE2 3.77Å; L332-Y358 HydrophobicContact CG-CD2 4.39Å; L332-Y358 HydrophobicContact CG-CE2 4.3Å; L335-Y358 HydrophobicContact CD1-CD2 4.24Å; L335-Y358 HydrophobicContact CD1-CG 4.3Å; A354-Y358 PolarHBondContact O-N 2.94Å; V356-Y358 PolarHBondContact O-N 2.96Å; Y358-T361 PolarHBondContact O-N 3.28Å; Y358-I362 HydrophobicContact CD1-CD1 4.48Å; Y358-I362 HydrophobicContact CD2-CD1 4.25Å; Y358-I362 HydrophobicContact CE1-CD1 3.95Å; Y358-I362 HydrophobicContact CE2-CD1 3.69Å; Y358-I362 PolarHBondContact O-N 2.8Å
359F98.8Very high98.7Very high45 Ų4544.1 Ų44.120%0.19724%0.239CC..Hα-helixtrans-67.1-40.2-178.8-74.4-73.2000112I280 L296 I300 S355 T361 I362 L363I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.31Å; L296-F359 HydrophobicContact CB-CE1 4.14Å; L296-F359 HydrophobicContact CB-CZ 4.29Å; I300-F359 HydrophobicContact CD1-CD1 3.74Å; I300-F359 HydrophobicContact CD1-CE1 4.11Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.22Å; S355-F359 PolarHBondContact O-N 2.95Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 2.96Å; F359-I362 PolarHBondContact O-N 3.36Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.42Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.44Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 2.76Å
360T98.8Very high98.6Very high47 Ų4740.5 Ų40.529%0.28822%0.221SC..Hα-helixtrans-64.6-40.4179.8-57.90000111.3V356 L357 I364 L365V356-T360 WeakPolarHBondContact O-CB 3.21Å; V356-T360 PolarHBondContact O-N 2.54Å; V356-T360 PolarHBondContact O-OG1 2.88Å; L357-T360 PolarHBondContact O-N 3.02Å; T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.42Å; T360-I364 WeakPolarHBondContact O-CA 3.26Å; T360-I364 WeakPolarHBondContact O-CB 3.21Å; T360-I364 PolarHBondContact O-N 2.9Å; T360-L365 HydrophobicContact CG2-CD1 4.39Å; T360-L365 HydrophobicContact CG2-CG 4.15Å; T360-L365 PolarHBondContact O-N 3.26Å
361T98.8Very high98.6Very high0 Ų041.9 Ų41.90%023%0.228CC..Iπ-helixtrans-62-47.1179-59.80000111L328 L357 Y358 F359 L365 M366L328-T361 HydrophobicContact CB-CG2 4.11Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.2Å; L357-T361 PolarHBondContact O-N 3.33Å; L357-T361 PolarHBondContact O-OG1 3.22Å; Y358-T361 PolarHBondContact O-N 3.28Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 2.96Å; T361-L365 PolarHBondContact O-N 3.48Å; T361-M366 HydrophobicContact CG2-CE 4.23Å; T361-M366 HydrophobicContact CG2-CG 4.43Å; T361-M366 WeakPolarHBondContact O-CB 3.27Å; T361-M366 WeakPolarHBondContact O-CG 3.39Å; T361-M366 PolarHBondContact O-N 3.23Å
362I98.7Very high98.6Very high5 Ų545.6 Ų45.63%0.02625%0.247CC..Iπ-helixtrans-73.8-49.6-177.3-65.2167.9000111.9I300 I304 L307 L328 Y358 F359 P367I300-I362 HydrophobicContact CD1-CB 3.75Å; I300-I362 HydrophobicContact CD1-CD1 3.92Å; I300-I362 HydrophobicContact CD1-CG1 4.45Å; I300-I362 HydrophobicContact CD1-CG2 3.47Å; I300-I362 VanDerWaalsContact CD1-CG2 3.47Å; I300-I362 HydrophobicContact CG1-CG2 3.75Å; I300-I362 HydrophobicContact CG2-CD1 4.27Å; I304-I362 HydrophobicContact CD1-CG2 3.45Å; I304-I362 VanDerWaalsContact CD1-CG2 3.45Å; L307-I362 HydrophobicContact CD1-CG2 4.19Å; L328-I362 HydrophobicContact CD1-CD1 4.07Å; L328-I362 HydrophobicContact CD1-CG1 4.13Å; L328-I362 HydrophobicContact CD2-CD1 4.14Å; L328-I362 HydrophobicContact CD2-CG1 3.9Å; Y358-I362 HydrophobicContact CD1-CD1 4.48Å; Y358-I362 HydrophobicContact CD2-CD1 4.25Å; Y358-I362 HydrophobicContact CE1-CD1 3.95Å; Y358-I362 HydrophobicContact CE2-CD1 3.69Å; Y358-I362 PolarHBondContact O-N 2.8Å; F359-I362 PolarHBondContact O-N 3.36Å; I362-P367 WeakPolarHBondContact O-CD 3.48Å
363L98.6Very high98.6Very high76 Ų7642.8 Ų42.840%0.39823%0.234SC..Iπ-helixtrans-80.5-29-170.9-61.7178000113.5I300 L307 F359I300-L363 HydrophobicContact CD1-CD2 3.84Å; I300-L363 HydrophobicContact CD1-CG 3.96Å; I300-L363 HydrophobicContact CG1-CD2 4.06Å; L307-L363 HydrophobicContact CD1-CD2 3.84Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.42Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.44Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 2.76Å
364I98.6Very high98.6Very high94 Ų9439 Ų3948%0.48221%0.211SC..Iπ-helixtrans-121.7-57.5-169.5-55.7177.1000111.2T360 P367 T368T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.42Å; T360-I364 WeakPolarHBondContact O-CA 3.26Å; T360-I364 WeakPolarHBondContact O-CB 3.21Å; T360-I364 PolarHBondContact O-N 2.9Å; I364-P367 WeakPolarHBondContact O-CD 3.29Å; I364-T368 HydrophobicContact CG2-CG2 4.41Å; I364-T368 WeakPolarHBondContact O-CB 3.07Å; I364-T368 WeakPolarHBondContact O-CG2 3.45Å; I364-T368 PolarHBondContact O-N 3.12Å; I364-T368 VanDerWaalsContact O-N 3.12Å; I364-T368 PolarHBondContact O-OG1 3.38Å
365L98.6Very high98.5Very high56 Ų5646.5 Ų46.529%0.29324%0.243SC..Iπ-helixtrans-68.4-44.6-170.8-57.4179000112.4L324 T360 T361 T368 I369L324-L365 HydrophobicContact CD1-CB 3.76Å; L324-L365 HydrophobicContact CD2-CB 4.18Å; L324-L365 HydrophobicContact CD2-CD1 4.22Å; T360-L365 HydrophobicContact CG2-CD1 4.39Å; T360-L365 HydrophobicContact CG2-CG 4.15Å; T360-L365 PolarHBondContact O-N 3.26Å; T361-L365 PolarHBondContact O-N 3.48Å; L365-T368 WeakPolarHBondContact CA-OG1 3.43Å; L365-T368 PolarHBondContact O-N 2.83Å; L365-T368 PolarHBondContact O-OG1 3.44Å; L365-I369 VanDerWaalsContact O-CB 3.3Å; L365-I369 WeakPolarHBondContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CG1 3.39Å; L365-I369 PolarHBondContact O-N 3.05Å
366M98.3Very high98.5Very high26 Ų2652.3 Ų52.313%0.12827%0.271CS..Hα-helixtrans-62.4-48.6179.9-80.1-179.5173.300113M315 L324 L328 T361 S370M315-M366 HydrophobicContact CE-CE 4.49Å; L324-M366 HydrophobicContact CB-CE 4.47Å; L324-M366 HydrophobicContact CB-CG 4.38Å; L324-M366 HydrophobicContact CD1-CG 4.16Å; L328-M366 HydrophobicContact CB-CE 4.35Å; L328-M366 HydrophobicContact CD2-CE 3.88Å; T361-M366 HydrophobicContact CG2-CE 4.23Å; T361-M366 HydrophobicContact CG2-CG 4.43Å; T361-M366 WeakPolarHBondContact O-CB 3.27Å; T361-M366 WeakPolarHBondContact O-CG 3.39Å; T361-M366 PolarHBondContact O-N 3.23Å; M366-S370 WeakPolarHBondContact O-CB 3.09Å; M366-S370 PolarHBondContact O-N 3.1Å; M366-S370 PolarHBondContact O-OG 3.34Å
367P98.3Very high98.4Very high15 Ų1552 Ų5210%0.09727%0.265CS..Hα-helixtrans-62.2-42.8175.4-25.434.4000113.1L307 M309 I362 I364 S370 L371L307-P367 HydrophobicContact CB-CG 4.03Å; L307-P367 HydrophobicContact CD2-CG 4.07Å; M309-P367 HydrophobicContact CG-CB 4.08Å; I362-P367 WeakPolarHBondContact O-CD 3.48Å; I364-P367 WeakPolarHBondContact O-CD 3.29Å; P367-S370 WeakPolarHBondContact O-CB 3.5Å; P367-S370 PolarHBondContact O-N 3.15Å; P367-L371 WeakPolarHBondContact O-CG 3.26Å; P367-L371 PolarHBondContact O-N 3.36Å; P367-L371 VanDerWaalsContact O-N 3.1Å
368T98.5Very high98.3Very high60 Ų6058.8 Ų58.837%0.36829%0.292SS..Hα-helixtrans-66.1-44.8-179.252.50000112I364 L365 S370 L371 I372I364-T368 HydrophobicContact CG2-CG2 4.41Å; I364-T368 WeakPolarHBondContact O-CB 3.07Å; I364-T368 WeakPolarHBondContact O-CG2 3.45Å; I364-T368 PolarHBondContact O-N 3.12Å; I364-T368 VanDerWaalsContact O-N 3.12Å; I364-T368 PolarHBondContact O-OG1 3.38Å; L365-T368 WeakPolarHBondContact CA-OG1 3.43Å; L365-T368 PolarHBondContact O-N 2.83Å; L365-T368 PolarHBondContact O-OG1 3.44Å; T368-S370 VanDerWaalsContact C-N 3.32Å; T368-S370 PolarHBondContact O-N 3.1Å; T368-L371 PolarHBondContact O-N 3.42Å; T368-I372 WeakPolarHBondContact O-CG1 3.5Å; T368-I372 PolarHBondContact O-N 2.73Å
369I98.3Very high98.1Very high34 Ų3463.1 Ų63.117%0.17431%0.309CS..Hα-helixtrans-63.7-38.3175-72.3-65000111.4L320 L324 L365 L371 I372 E373L320-I369 HydrophobicContact CB-CD1 4.43Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.32Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.57Å; L324-I369 HydrophobicContact CD1-CG2 4.29Å; L324-I369 HydrophobicContact CG-CG1 4.44Å; L365-I369 VanDerWaalsContact O-CB 3.3Å; L365-I369 WeakPolarHBondContact O-CB 3.31Å; L365-I369 WeakPolarHBondContact O-CG1 3.39Å; L365-I369 PolarHBondContact O-N 3.05Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.15Å; I369-I372 HydrophobicContact CD1-CD1 4.1Å; I369-I372 PolarHBondContact O-N 3.27Å; I369-I372 VanDerWaalsContact O-N 3.16Å; I369-E373 HydrophobicContact CG2-CG 4.26Å; I369-E373 WeakPolarHBondContact O-CG 3.2Å; I369-E373 PolarHBondContact O-N 3.27Å
370S97.9Very high96.8Very high6 Ų668 Ų684%0.04236%0.357CS..Hα-helixtrans-57-43.9173.7-57.50000112R318 M366 P367 T368 N374R318-S370 PolarHBondContact NH2-OG 3.26Å; M366-S370 WeakPolarHBondContact O-CB 3.09Å; M366-S370 PolarHBondContact O-N 3.1Å; M366-S370 PolarHBondContact O-OG 3.34Å; P367-S370 WeakPolarHBondContact O-CB 3.5Å; P367-S370 PolarHBondContact O-N 3.15Å; T368-S370 VanDerWaalsContact C-N 3.32Å; T368-S370 PolarHBondContact O-N 3.1Å; S370-N374 VanDerWaalsContact O-CG 3.23Å; S370-N374 PolarHBondContact O-N 3.42Å; S370-N374 VanDerWaalsContact O-N 3.07Å; S370-N374 PolarHBondContact O-ND2 2.9Å
371L98.3Very high96.6Very high84 Ų8469 Ų6944%0.4436%0.361SS..Hα-helixtrans-67.7-37.2176.8-68.9172.8000112.4M309 P367 T368 I369 K375M309-L371 HydrophobicContact CB-CD2 3.83Å; M309-L371 HydrophobicContact CB-CG 3.87Å; M309-L371 HydrophobicContact CG-CD2 4.47Å; M309-L371 HydrophobicContact CG-CG 4.39Å; P367-L371 WeakPolarHBondContact O-CG 3.26Å; P367-L371 PolarHBondContact O-N 3.36Å; P367-L371 VanDerWaalsContact O-N 3.1Å; T368-L371 PolarHBondContact O-N 3.42Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.15Å; L371-K375 WeakPolarHBondContact O-CG 3.35Å; L371-K375 PolarHBondContact O-N 3.2Å; L371-K375 VanDerWaalsContact O-N 3.14Å
372I98.3Very high96.5Very high80 Ų8072.6 Ų72.641%0.4138%0.38SS..Hα-helixtrans-64.3-47.6175.7-69.5164.3000110.3L320 T368 I369 N374 K375 M376L320-I372 HydrophobicContact CD1-CG2 4.41Å; T368-I372 WeakPolarHBondContact O-CG1 3.5Å; T368-I372 PolarHBondContact O-N 2.73Å; I369-I372 HydrophobicContact CD1-CD1 4.1Å; I369-I372 PolarHBondContact O-N 3.27Å; I369-I372 VanDerWaalsContact O-N 3.16Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.35Å; I372-K375 PolarHBondContact O-N 3.31Å; I372-K375 VanDerWaalsContact O-N 3.11Å; I372-M376 HydrophobicContact CG2-CG 4.34Å; I372-M376 HydrophobicContact CG2-SD 3.96Å; I372-M376 WeakPolarHBondContact O-CG 3.39Å; I372-M376 PolarHBondContact O-N 2.82Å
373E98.4Very high96.4Very high10 Ų1076.4 Ų76.45%0.04740%0.399CS..Hα-helixtrans-60.2-41.4177.9-73.1176.7146.400111.8R318 L320 S321 I369 K375 M376 L377R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.3Å; R318-E373 WeakPolarHBondContact CB-OE1 3.36Å; R318-E373 WeakPolarHBondContact CB-OE2 3.46Å; R318-E373 IonicContact CZ-OE2 2.9Å; R318-E373 IonicContact NE-OE2 3.28Å; R318-E373 PolarHBondContact NE-OE2 3.03Å; R318-E373 IonicContact NH2-OE2 3.38Å; R318-E373 PolarHBondContact NH2-OE2 3.16Å; L320-E373 HydrophobicContact CB-CG 4.25Å; L320-E373 WeakPolarHBondContact CB-OE1 3.44Å; L320-E373 HydrophobicContact CD1-CG 4.21Å; L320-E373 PolarHBondContact N-OE1 3.24Å; S321-E373 PolarHBondContact N-OE1 2.77Å; S321-E373 PolarHBondContact OG-OE1 3.13Å; S321-E373 PolarHBondContact OG-OE2 3.41Å; I369-E373 HydrophobicContact CG2-CG 4.26Å; I369-E373 WeakPolarHBondContact O-CG 3.2Å; I369-E373 PolarHBondContact O-N 3.27Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.26Å; E373-M376 PolarHBondContact O-N 3.31Å; E373-L377 WeakPolarHBondContact O-CG 3.3Å; E373-L377 PolarHBondContact O-N 2.79Å; E373-L377 VanDerWaalsContact O-N 3.1Å
374N98.4Very high96.3Very high9 Ų976.4 Ų76.45%0.04840%0.399CS..Hα-helixtrans-57.2-47.2172.9-68.9-20.8000111.6M309 K311 S370 I372 M376 L377 K378 W379M309-N374 PolarHBondContact O-ND2 2.91Å; K311-N374 PolarHBondContact N-OD1 2.93Å; S370-N374 VanDerWaalsContact O-CG 3.23Å; S370-N374 PolarHBondContact O-N 3.42Å; S370-N374 VanDerWaalsContact O-N 3.07Å; S370-N374 PolarHBondContact O-ND2 2.9Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.35Å; N374-M376 PolarHBondContact O-N 3.4Å; N374-L377 CarbonylContact O-C 3.25Å; N374-L377 PolarHBondContact O-N 3.4Å; N374-K378 PolarHBondContact O-N 3.1Å; N374-W379 HydrophobicContact CB-CB 4.33Å; N374-W379 PolarHBondContact O-N 3.45Å
375K97.9Very high96.1Very high163 Ų16375.3 Ų75.371%0.70939%0.394SS*.Hα-helixtrans-65-38.5179-73-178.5-179.5-177.10112.3L371 I372 E373 L377 K378L371-K375 WeakPolarHBondContact O-CG 3.35Å; L371-K375 PolarHBondContact O-N 3.2Å; L371-K375 VanDerWaalsContact O-N 3.14Å; I372-K375 PolarHBondContact O-N 3.31Å; I372-K375 VanDerWaalsContact O-N 3.11Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 3.26Å; K375-L377 PolarHBondContact O-N 2.93Å; K375-K378 PolarHBondContact O-N 3.3Å
376M97.9Very high96Very high131 Ų13176.6 Ų76.665%0.64540%0.401SS*.Hα-helixtrans-60.1-34.1174.9-70.3172.765.700111.8L320 I372 E373 N374 K378L320-M376 HydrophobicContact CD1-SD 4.06Å; I372-M376 HydrophobicContact CG2-CG 4.34Å; I372-M376 HydrophobicContact CG2-SD 3.96Å; I372-M376 WeakPolarHBondContact O-CG 3.39Å; I372-M376 PolarHBondContact O-N 2.82Å; E373-M376 PolarHBondContact O-N 3.31Å; N374-M376 PolarHBondContact O-N 3.4Å; M376-K378 VanDerWaalsContact C-N 3.28Å
377L97.8Very high95.8Very high86 Ų8680.2 Ų80.245%0.4542%0.42SS..THydrogen-bonded Turntrans-85.45.3174.9-64.1176.5000113.8E373 N374 K375 W379E373-L377 WeakPolarHBondContact O-CG 3.3Å; E373-L377 PolarHBondContact O-N 2.79Å; E373-L377 VanDerWaalsContact O-N 3.1Å; N374-L377 CarbonylContact O-C 3.25Å; N374-L377 PolarHBondContact O-N 3.4Å; K375-L377 PolarHBondContact O-N 2.93Å; L377-W379 HydrophobicContact CB-CD2 4.19Å; L377-W379 HydrophobicContact CB-CE3 4.18Å; L377-W379 HydrophobicContact CD1-CE3 3.9Å; L377-W379 HydrophobicContact CD1-CH2 3.93Å; L377-W379 HydrophobicContact CD1-CZ3 3.56Å; L377-W379 PolarHBondContact O-N 2.86Å
378K96.7Very high95.6Very high195 Ų19585.2 Ų85.285%0.84845%0.445SS*.THydrogen-bonded Turntrans56.930.8-176.2-52.9177.2-178.6176.80113.1N374 K375 M376N374-K378 PolarHBondContact O-N 3.1Å; K375-K378 PolarHBondContact O-N 3.3Å; M376-K378 VanDerWaalsContact C-N 3.28Å
379W94Very high95.4Very high103 Ų10387.3 Ų87.339%0.3945%0.452SS..  trans-81134.9169.1-74.9-25.8000110.8K311 Q312 N374 L377K311-W379 HydrophobicContact CB-CD2 4.01Å; K311-W379 HydrophobicContact CB-CE3 3.46Å; K311-W379 VanDerWaalsContact CB-CE3 3.46Å; K311-W379 HydrophobicContact CB-CH2 4.44Å; K311-W379 HydrophobicContact CB-CZ3 3.71Å; K311-W379 HydrophobicContact CG-CB 4.2Å; K311-W379 HydrophobicContact CG-CD2 4.21Å; K311-W379 HydrophobicContact CG-CE3 3.88Å; K311-W379 HydrophobicContact CG-CG 4.41Å; Q312-W379 HydrophobicContact CB-CZ3 4.44Å; Q312-W379 HydrophobicContact CG-CH2 3.43Å; Q312-W379 VanDerWaalsContact CG-CH2 3.43Å; Q312-W379 HydrophobicContact CG-CZ3 3.57Å; N374-W379 HydrophobicContact CB-CB 4.33Å; N374-W379 PolarHBondContact O-N 3.45Å; L377-W379 HydrophobicContact CB-CD2 4.19Å; L377-W379 HydrophobicContact CB-CE3 4.18Å; L377-W379 HydrophobicContact CD1-CE3 3.9Å; L377-W379 HydrophobicContact CD1-CH2 3.93Å; L377-W379 HydrophobicContact CD1-CZ3 3.56Å; L377-W379 PolarHBondContact O-N 2.86Å
380A70.8Confident95.1Very high147 Ų14792.2 Ų92.2100%1.21548%0.477SS*.  trans-71.50-179.800000112.9K311K311-A380 VanDerWaalsContact CE-O 3.22Å; K311-A380 WeakPolarHBondContact CE-O 3.46Å; K311-A380 PolarHBondContact NZ-O 3.14Å

Retrieved 380 of 380 residues in 273.9 ms (Link to these results)