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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 A0A023QLW1, 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
1M80.7Confident91.8Very high243 Ų243114.4 Ų114.4100%1.19759%0.591SS**  0131.90-72.3174.9172.100108.6
2T87.6Confident91.9Very high98 Ų98112.9 Ų112.960%0.60158%0.577SS**  trans-67131.1175.1-9.90000108.8I7T2-I7 WeakPolarHBondContact O-CD1 3.44Å
3P92.8Very high91.9Very high60 Ų60113.4 Ų113.439%0.3958%0.581SS.*  trans-68.4149.2-175.528.4-35.7000111.1R5 K6P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.08Å; P3-R5 PolarHBondContact O-N 3.34Å; P3-K6 HydrophobicContact CG-CB 4.44Å; P3-K6 HydrophobicContact CG-CD 4.03Å; P3-K6 HydrophobicContact CG-CG 4.03Å; P3-K6 PolarHBondContact O-N 2.97Å
4M93.3Very high92Very high155 Ų155112.1 Ų112.176%0.76457%0.574SS**Hα-helixtrans-52.8-34.1179.4-74.5-172.8172.800112.9K6 I7 N8M4-K6 PolarHBondContact O-N 3.5Å; M4-I7 PolarHBondContact O-N 3.27Å; M4-N8 PolarHBondContact O-N 2.9Å
5R94.5Very high92.2Very high99 Ų99104.7 Ų104.737%0.37454%0.536SS..Hα-helixtrans-58.7-19.5177.279.1-176.8-161.7-1632.8114.7P3 M11 K12 N15 D20P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.08Å; P3-R5 PolarHBondContact O-N 3.34Å; R5-M11 CarbonylContact O-C 3.37Å; R5-K12 VanDerWaalsContact O-CA 3.32Å; R5-K12 WeakPolarHBondContact O-CA 3.08Å; R5-K12 PolarHBondContact O-N 3.15Å; R5-N15 HydrophobicContact CB-CB 4.41Å; R5-N15 WeakPolarHBondContact CD-OD1 3.37Å; R5-N15 HydrophobicContact CG-CB 4.45Å; R5-N15 WeakPolarHBondContact CG-OD1 3.18Å; R5-N15 PolarHBondContact NE-OD1 3.2Å; R5-N15 VanDerWaalsContact O-CB 3.24Å; R5-N15 WeakPolarHBondContact O-CB 3.35Å; R5-D20 IonicContact CZ-OD1 3.61Å; R5-D20 IonicContact NE-OD2 3.94Å; R5-D20 IonicContact NH2-OD1 2.77Å; R5-D20 PolarHBondContact NH2-OD1 3.22Å; R5-D20 IonicContact NH2-OD2 3.55Å
6K93.4Very high92.3Very high93 Ų93104.5 Ų104.540%0.40453%0.532SS..Hα-helixtrans-100.9-14.8177.1-66.6-173.2178-169.50113.4P3 M4 D20P3-K6 HydrophobicContact CG-CB 4.44Å; P3-K6 HydrophobicContact CG-CD 4.03Å; P3-K6 HydrophobicContact CG-CG 4.03Å; P3-K6 PolarHBondContact O-N 2.97Å; M4-K6 PolarHBondContact O-N 3.5Å; K6-D20 WeakPolarHBondContact CE-OD2 3.17Å; K6-D20 IonicContact NZ-OD2 3.31Å; K6-D20 PolarHBondContact NZ-OD2 3.46Å
7I94.1Very high92.3Very high107 Ų10799.8 Ų99.855%0.54951%0.511SS..Hα-helixtrans-103.7-48.9-174-56.2173.9000110.9T2 M4T2-I7 WeakPolarHBondContact O-CD1 3.44Å; M4-I7 PolarHBondContact O-N 3.27Å
8N95.4Very high92.2Very high66 Ų66100.8 Ų100.835%0.35351%0.511SS..SBendtrans-64127.4-176.6175.4-79.4000110M4 L10 M11 K12M4-N8 PolarHBondContact O-N 2.9Å; N8-L10 VanDerWaalsContact C-N 3.3Å; N8-L10 PolarHBondContact O-N 3.29Å; N8-L10 PolarHBondContact OD1-N 2.93Å; N8-L10 VanDerWaalsContact OD1-N 3.08Å; N8-M11 HydrophobicContact CB-CB 4.06Å; N8-M11 HydrophobicContact CB-CG 4.11Å; N8-M11 HydrophobicContact CB-SD 4.24Å; N8-M11 PolarHBondContact O-N 3.05Å; N8-M11 PolarHBondContact OD1-N 2.86Å; N8-K12 WeakPolarHBondContact O-CB 3.38Å; N8-K12 PolarHBondContact O-N 3.37Å
9P93.4Very high92.4Very high109 Ų10997.8 Ų97.871%0.70850%0.496SS*.Hα-helixtrans-55.2-39-173.3-29.335.5000114.8
10L91.7Very high92.7Very high134 Ų13494.6 Ų94.670%0.70248%0.48SS*.Hα-helixtrans-75.6-48.7178.6-66.6175.4000111.5N8 K12 L13 I14N8-L10 VanDerWaalsContact C-N 3.3Å; N8-L10 PolarHBondContact O-N 3.29Å; N8-L10 PolarHBondContact OD1-N 2.93Å; N8-L10 VanDerWaalsContact OD1-N 3.08Å; L10-K12 PolarHBondContact O-N 3.21Å; L10-L13 WeakPolarHBondContact O-CB 3.43Å; L10-L13 PolarHBondContact O-N 3.08Å; L10-I14 PolarHBondContact O-N 3.11Å
11M92.8Very high92.9Very high94 Ų9491.3 Ų91.346%0.46346%0.464SS..Hα-helixtrans-64.9-28.9179.4-61.6-177172.100112R5 N8 I14 N15R5-M11 CarbonylContact O-C 3.37Å; N8-M11 HydrophobicContact CB-CB 4.06Å; N8-M11 HydrophobicContact CB-CG 4.11Å; N8-M11 HydrophobicContact CB-SD 4.24Å; N8-M11 PolarHBondContact O-N 3.05Å; N8-M11 PolarHBondContact OD1-N 2.86Å; M11-I14 PolarHBondContact O-N 3.42Å; M11-N15 VanDerWaalsContact O-CB 3.25Å; M11-N15 WeakPolarHBondContact O-CB 3.47Å; M11-N15 PolarHBondContact O-N 3.45Å
12K93.2Very high93.7Very high97 Ų9783.2 Ų83.242%0.42243%0.429SS..Hα-helixtrans-61.9-43.4175.6-177.7177.1-177.2-169.70111.2R5 N8 L10 N15 H16R5-K12 VanDerWaalsContact O-CA 3.32Å; R5-K12 WeakPolarHBondContact O-CA 3.08Å; R5-K12 PolarHBondContact O-N 3.15Å; N8-K12 WeakPolarHBondContact O-CB 3.38Å; N8-K12 PolarHBondContact O-N 3.37Å; L10-K12 PolarHBondContact O-N 3.21Å; K12-N15 PolarHBondContact O-N 3Å; K12-H16 WeakPolarHBondContact CE-NE2 3.49Å; K12-H16 VanDerWaalsContact CG-CD2 3.49Å; K12-H16 WeakPolarHBondContact CG-CD2 3.37Å; K12-H16 PolarHBondContact O-CD2 3.11Å; K12-H16 PolarHBondContact O-N 3.33Å
13L92.3Very high94.2Very high119 Ų11978.7 Ų78.762%0.62340%0.402SS*.Hα-helixtrans-60.2-47175.5-178.267.1000111.3L10 N15 H16 S17L10-L13 WeakPolarHBondContact O-CB 3.43Å; L10-L13 PolarHBondContact O-N 3.08Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 3.19Å; L13-H16 PolarHBondContact O-N 3.41Å; L13-S17 VanDerWaalsContact O-CB 3.24Å; L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 3.12Å; L13-S17 PolarHBondContact O-OG 3.43Å
14I93.1Very high94.4Very high96 Ų9675.9 Ų75.949%0.49238%0.383SS..Hα-helixtrans-62.2-44.2176.6-61.7171.3000110.3L10 M11 H16 S17 F18L10-I14 PolarHBondContact O-N 3.11Å; M11-I14 PolarHBondContact O-N 3.42Å; I14-H16 PolarHBondContact O-N 2.73Å; I14-S17 PolarHBondContact O-N 3.5Å; I14-F18 WeakPolarHBondContact O-CB 3.41Å; I14-F18 PolarHBondContact O-N 3.08Å
15N95.3Very high94.7Very high0 Ų070.4 Ų70.40%036%0.361CS..Iπ-helixtrans-61.7-46.6-178.7-176.280.1000111.8R5 M11 K12 L13 S17 I19 D20R5-N15 HydrophobicContact CB-CB 4.41Å; R5-N15 WeakPolarHBondContact CD-OD1 3.37Å; R5-N15 HydrophobicContact CG-CB 4.45Å; R5-N15 WeakPolarHBondContact CG-OD1 3.18Å; R5-N15 PolarHBondContact NE-OD1 3.2Å; R5-N15 VanDerWaalsContact O-CB 3.24Å; R5-N15 WeakPolarHBondContact O-CB 3.35Å; M11-N15 VanDerWaalsContact O-CB 3.25Å; M11-N15 WeakPolarHBondContact O-CB 3.47Å; M11-N15 PolarHBondContact O-N 3.45Å; K12-N15 PolarHBondContact O-N 3Å; L13-N15 VanDerWaalsContact C-N 3.35Å; L13-N15 PolarHBondContact O-N 3.19Å; N15-S17 VanDerWaalsContact C-N 3.32Å; N15-I19 PolarHBondContact O-N 2.98Å; N15-D20 PolarHBondContact ND2-OD2 3.13Å; N15-D20 PolarHBondContact O-N 2.66Å; N15-D20 PolarHBondContact OD1-OD2 3.13Å
16H93.6Very high94.8Very high102 Ų10268.4 Ų68.447%0.47236%0.357SS..Iπ-helixtrans-71-27.4179.1-73.8-66.6000113.5K12 L13 I14 L21K12-H16 WeakPolarHBondContact CE-NE2 3.49Å; K12-H16 VanDerWaalsContact CG-CD2 3.49Å; K12-H16 WeakPolarHBondContact CG-CD2 3.37Å; K12-H16 PolarHBondContact O-CD2 3.11Å; K12-H16 PolarHBondContact O-N 3.33Å; L13-H16 PolarHBondContact O-N 3.41Å; I14-H16 PolarHBondContact O-N 2.73Å; H16-L21 WeakPolarHBondContact O-CB 3.37Å
17S91.6Very high95.1Very high25 Ų2564.8 Ų64.818%0.17534%0.342CS..Iπ-helixtrans-92.3-23.7-176.5-56.50000114L13 I14 N15L13-S17 VanDerWaalsContact O-CB 3.24Å; L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 3.12Å; L13-S17 PolarHBondContact O-OG 3.43Å; I14-S17 PolarHBondContact O-N 3.5Å; N15-S17 VanDerWaalsContact C-N 3.32Å
18F91.6Very high95.3Very high118 Ų11861.4 Ų61.452%0.51833%0.328SS..Iπ-helixtrans-135.8-24.3-171.7-79.1-86000115.6I14 F220I14-F18 WeakPolarHBondContact O-CB 3.41Å; I14-F18 PolarHBondContact O-N 3.08Å; F18-F220 WeakPolarHBondContact O-CD1 3.48Å
19I96.1Very high95.4Very high43 Ų4361.6 Ų61.622%0.22134%0.338CS..Iπ-helixtrans-103.4-67.7-173.2-55.3178.1000110.4N15 L21 F220 H221N15-I19 PolarHBondContact O-N 2.98Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 2.79Å; I19-F220 PolarHBondContact O-N 3.32Å; I19-H221 HydrophobicContact CG2-CB 4.12Å; I19-H221 PolarHBondContact O-N 3.37Å
20D97.1Very high95.7Very high34 Ų3460.9 Ų60.918%0.18232%0.322CS..SBendtrans-91.612.9-176.5-66.8-13.3000111.7R5 K6 N15 P22R5-D20 IonicContact CZ-OD1 3.61Å; R5-D20 IonicContact NE-OD2 3.94Å; R5-D20 IonicContact NH2-OD1 2.77Å; R5-D20 PolarHBondContact NH2-OD1 3.22Å; R5-D20 IonicContact NH2-OD2 3.55Å; K6-D20 WeakPolarHBondContact CE-OD2 3.17Å; K6-D20 IonicContact NZ-OD2 3.31Å; K6-D20 PolarHBondContact NZ-OD2 3.46Å; N15-D20 PolarHBondContact ND2-OD2 3.13Å; N15-D20 PolarHBondContact O-N 2.66Å; N15-D20 PolarHBondContact OD1-OD2 3.13Å; D20-P22 WeakPolarHBondContact O-CD 3.36Å
21L97.2Very high96Very high26 Ų2655.5 Ų55.514%0.13629%0.292CS..  trans-60.2117.1179176.167.3000110.3H16 I19 T23 F220H16-L21 WeakPolarHBondContact O-CB 3.37Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 2.79Å; L21-T23 PolarHBondContact O-N 3.3Å; L21-T23 PolarHBondContact O-OG1 2.89Å; L21-F220 HydrophobicContact CB-CB 3.93Å; L21-F220 HydrophobicContact CD2-CD2 4.22Å; L21-F220 PolarHBondContact O-N 3.38Å
22P97.3Very high96.3Very high72 Ų7251.5 Ų51.547%0.46827%0.273SS..EExtended strand (participates in β ladder)trans-72.4113.5178.3-17.532.9000110.8D20 K217D20-P22 WeakPolarHBondContact O-CD 3.36Å; P22-K217 HydrophobicContact CB-CB 4.16Å; P22-K217 HydrophobicContact CB-CD 3.65Å
23T97.9Very high96.5Very high4 Ų448.5 Ų48.53%0.02526%0.26CS..EExtended strand (participates in β ladder)trans-118.9139.5-174.1-51.60000109.5L21 S25 I27 K217 I218 Y224L21-T23 PolarHBondContact O-N 3.3Å; L21-T23 PolarHBondContact O-OG1 2.89Å; T23-S25 PolarHBondContact O-N 2.94Å; T23-I27 HydrophobicContact CG2-CD1 3.55Å; T23-I27 HydrophobicContact CG2-CG1 4.32Å; T23-K217 WeakPolarHBondContact O-CA 3.32Å; T23-I218 PolarHBondContact N-O 3.02Å; T23-I218 PolarHBondContact O-N 2.69Å; T23-Y224 HydrophobicContact CG2-CD2 3.48Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.48Å; T23-Y224 HydrophobicContact CG2-CE2 3.28Å; T23-Y224 HydrophobicContact CG2-CG 4.32Å
24P98.3Very high96.8Very high0 Ų044.4 Ų44.40%025%0.246CC..EExtended strand (participates in β ladder)trans-52.8138.5175.9-18.125.6000110.7N26 I27 S205 N207 S213 Y224P24-N26 PolarHBondContact O-N 2.61Å; P24-I27 HydrophobicContact CB-CG2 4.01Å; P24-I27 HydrophobicContact CG-CG2 4.06Å; P24-S205 VanDerWaalsContact CG-O 3.24Å; P24-S205 WeakPolarHBondContact CG-O 3.41Å; P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.19Å; P24-S213 WeakPolarHBondContact CB-OG 3.19Å; P24-S213 WeakPolarHBondContact CG-OG 3.39Å; P24-Y224 PolarHBondContact O-OH 2.91Å
25S98.2Very high97.1Very high41 Ų4142 Ų4229%0.28724%0.238SC..THydrogen-bonded Turntrans-66.4-20.5-176.862.90000114.5T23 D216 Y224T23-S25 PolarHBondContact O-N 2.94Å; S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.43Å; S25-D216 PolarHBondContact N-O 3.42Å; S25-D216 PolarHBondContact OG-OD2 3.46Å; S25-Y224 VanDerWaalsContact C-OH 3.26Å; S25-Y224 PolarHBondContact O-OH 3.38Å
26N98.3Very high97.2Very high56 Ų5642.6 Ų42.630%0.29924%0.241SC..THydrogen-bonded Turntrans-111.117.4-167.469.7-29000114.6P24 S28 N207 P208 L209P24-N26 PolarHBondContact O-N 2.61Å; N26-S28 PolarHBondContact O-N 3.39Å; N26-N207 PolarHBondContact ND2-OD1 3.47Å; N26-N207 WeakPolarHBondContact OD1-CB 3.25Å; N26-P208 VanDerWaalsContact O-CD 3.24Å; N26-P208 WeakPolarHBondContact O-CD 3.39Å; N26-P208 WeakPolarHBondContact O-CG 3.43Å; N26-L209 WeakPolarHBondContact ND2-CD1 3.41Å
27I98.4Very high97.5Very high17 Ų1739 Ų399%0.08723%0.225CC..  trans-69126.9177.459.7170.1000111.1T23 P24 W31 N206 N207 Y224 K227T23-I27 HydrophobicContact CG2-CD1 3.55Å; T23-I27 HydrophobicContact CG2-CG1 4.32Å; P24-I27 HydrophobicContact CB-CG2 4.01Å; P24-I27 HydrophobicContact CG-CG2 4.06Å; I27-W31 HydrophobicContact CB-CB 4.05Å; I27-W31 HydrophobicContact CB-CD2 3.75Å; I27-W31 HydrophobicContact CB-CE3 4.23Å; I27-W31 HydrophobicContact CB-CG 3.64Å; I27-W31 HydrophobicContact CD1-CB 3.81Å; I27-W31 HydrophobicContact CD1-CG 3.9Å; I27-W31 HydrophobicContact CG1-CB 4.29Å; I27-W31 HydrophobicContact CG1-CG 4.27Å; I27-W31 HydrophobicContact CG2-CD2 3.91Å; I27-W31 HydrophobicContact CG2-CG 3.95Å; I27-W31 HydrophobicContact CG2-CZ2 4.41Å; I27-N206 WeakPolarHBondContact CG2-O 3.46Å; I27-N207 HydrophobicContact CG2-CB 4.14Å; I27-Y224 HydrophobicContact CD1-CD1 3.83Å; I27-Y224 HydrophobicContact CD1-CD2 4.47Å; I27-Y224 HydrophobicContact CD1-CE1 3.54Å; I27-Y224 HydrophobicContact CD1-CE2 4.17Å; I27-Y224 HydrophobicContact CD1-CG 4.32Å; I27-Y224 HydrophobicContact CG1-CD1 4.02Å; I27-Y224 HydrophobicContact CG1-CE1 3.21Å; I27-Y224 HydrophobicContact CG1-CE2 4.17Å; I27-Y224 VanDerWaalsContact CG1-OH 3.25Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.31Å; I27-K227 PolarHBondContact O-NZ 2.85Å
28S98.4Very high97.8Very high36 Ų3639.3 Ų39.325%0.25223%0.233SC..  trans-79-179.7-176.965.90000112.8N26 W30 W31 K227N26-S28 PolarHBondContact O-N 3.39Å; S28-W30 PolarHBondContact O-N 3.15Å; S28-W30 VanDerWaalsContact O-N 3.11Å; S28-W30 VanDerWaalsContact OG-CD1 3.3Å; S28-W31 PolarHBondContact O-N 3.5Å; S28-W31 VanDerWaalsContact O-N 3.11Å; S28-K227 PolarHBondContact O-NZ 3Å
29A98.4Very high98.2Very high70 Ų7034.9 Ų34.958%0.57922%0.218SC*.G310 helixtrans-56.4-24.4176.900000113.6W31 N32A29-W31 PolarHBondContact O-N 2.76Å; A29-W31 VanDerWaalsContact O-N 3.12Å; A29-N32 WeakPolarHBondContact CA-OD1 3.39Å; A29-N32 VanDerWaalsContact O-CB 3.25Å; A29-N32 WeakPolarHBondContact O-CB 3.37Å; A29-N32 PolarHBondContact O-N 3.39Å; A29-N32 PolarHBondContact O-OD1 2.73Å
30W98.7Very high98.3Very high94 Ų9432.9 Ų32.936%0.35621%0.208SC..G310 helixtrans-61.1-21.7177.1-60.2114.3000113.8S28 N32 F33 L96 R100 Y104S28-W30 PolarHBondContact O-N 3.15Å; S28-W30 VanDerWaalsContact O-N 3.11Å; S28-W30 VanDerWaalsContact OG-CD1 3.3Å; W30-N32 VanDerWaalsContact C-N 3.33Å; W30-F33 HydrophobicContact CE3-CD2 4.17Å; W30-F33 AromaticContact CE3-CE2 3.61Å; W30-F33 HydrophobicContact CE3-CE2 3.61Å; W30-F33 AromaticContact CZ3-CE2 3.93Å; W30-F33 HydrophobicContact CZ3-CE2 3.93Å; W30-F33 WeakPolarHBondContact O-CD2 3.35Å; W30-L96 HydrophobicContact CZ3-CB 4.48Å; W30-L96 HydrophobicContact CZ3-CD2 4.07Å; W30-R100 HydrophobicContact CB-CB 4.09Å; W30-R100 HydrophobicContact CB-CG 3.55Å; W30-Y104 HydrophobicContact CB-CE2 4.23Å; W30-Y104 AromaticContact CD1-CE2 3.83Å; W30-Y104 HydrophobicContact CG-CE2 4.16Å
31W98.7Very high98.4Very high21 Ų2132 Ų328%0.0820%0.203CC..G310 helixtrans-77.1-17.9175.6-86.3-113.8000113.7I27 S28 A29 F33 G34 R100 Y104 N206 P208I27-W31 HydrophobicContact CB-CB 4.05Å; I27-W31 HydrophobicContact CB-CD2 3.75Å; I27-W31 HydrophobicContact CB-CE3 4.23Å; I27-W31 HydrophobicContact CB-CG 3.64Å; I27-W31 HydrophobicContact CD1-CB 3.81Å; I27-W31 HydrophobicContact CD1-CG 3.9Å; I27-W31 HydrophobicContact CG1-CB 4.29Å; I27-W31 HydrophobicContact CG1-CG 4.27Å; I27-W31 HydrophobicContact CG2-CD2 3.91Å; I27-W31 HydrophobicContact CG2-CG 3.95Å; I27-W31 HydrophobicContact CG2-CZ2 4.41Å; S28-W31 PolarHBondContact O-N 3.5Å; S28-W31 VanDerWaalsContact O-N 3.11Å; A29-W31 PolarHBondContact O-N 2.76Å; A29-W31 VanDerWaalsContact O-N 3.12Å; W31-F33 PolarHBondContact O-N 2.98Å; W31-G34 PolarHBondContact O-N 3.21Å; W31-R100 VanDerWaalsContact CE2-NH1 3.27Å; W31-R100 HydrophobicContact CE3-CG 4.33Å; W31-R100 HydrophobicContact CZ3-CG 4.24Å; W31-Y104 HydrophobicContact CH2-CD1 4.15Å; W31-Y104 AromaticContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CE2 4.03Å; W31-Y104 AromaticContact CH2-CG 3.63Å; W31-Y104 HydrophobicContact CH2-CG 3.63Å; W31-Y104 AromaticContact CZ3-CD2 3.65Å; W31-Y104 HydrophobicContact CZ3-CD2 3.65Å; W31-Y104 AromaticContact CZ3-CE2 3.63Å; W31-Y104 HydrophobicContact CZ3-CE2 3.63Å; W31-Y104 HydrophobicContact CZ3-CG 4.12Å; W31-N206 VanDerWaalsContact CE2-O 3.26Å; W31-N206 HydrophobicContact CZ2-CB 4.31Å; W31-N206 VanDerWaalsContact CZ2-O 3.26Å; W31-N206 WeakPolarHBondContact CZ2-O 3.46Å; W31-N206 PolarHBondContact NE1-O 2.95Å; W31-P208 HydrophobicContact CH2-CG 4.08Å; W31-P208 HydrophobicContact CZ3-CG 3.85Å
32N98.6Very high98.5Very high11 Ų1136.2 Ų36.26%0.05922%0.224CC..G310 helixtrans-66.6-23.2178.8-68.167.4000112.6A29 W30 G34 S35 L36 K227 D228A29-N32 WeakPolarHBondContact CA-OD1 3.39Å; A29-N32 VanDerWaalsContact O-CB 3.25Å; A29-N32 WeakPolarHBondContact O-CB 3.37Å; A29-N32 PolarHBondContact O-N 3.39Å; A29-N32 PolarHBondContact O-OD1 2.73Å; W30-N32 VanDerWaalsContact C-N 3.33Å; N32-G34 PolarHBondContact O-N 3.28Å; N32-G34 VanDerWaalsContact O-N 3.11Å; N32-S35 PolarHBondContact O-N 3.47Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3Å; N32-L36 WeakPolarHBondContact O-CG 3.41Å; N32-L36 PolarHBondContact O-N 2.69Å; N32-K227 PolarHBondContact ND2-O 3Å; N32-K227 VanDerWaalsContact ND2-O 3.13Å; N32-K227 WeakPolarHBondContact OD1-CE 3.48Å; N32-K227 PolarHBondContact OD1-NZ 3.38Å; N32-D228 PolarHBondContact ND2-OD1 2.89Å; N32-D228 VanDerWaalsContact ND2-OD1 3.1Å
33F98.8Very high98.5Very high33 Ų3334.2 Ų34.215%0.14521%0.209CC..Hα-helixtrans-61.9-22.5180-69.9-68.3000113W30 W31 L36 L37 C93 L96 H97W30-F33 HydrophobicContact CE3-CD2 4.17Å; W30-F33 AromaticContact CE3-CE2 3.61Å; W30-F33 HydrophobicContact CE3-CE2 3.61Å; W30-F33 AromaticContact CZ3-CE2 3.93Å; W30-F33 HydrophobicContact CZ3-CE2 3.93Å; W30-F33 WeakPolarHBondContact O-CD2 3.35Å; W31-F33 PolarHBondContact O-N 2.98Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.11Å; F33-L37 WeakPolarHBondContact O-CB 3.38Å; F33-L37 WeakPolarHBondContact O-CD1 3.13Å; F33-L37 WeakPolarHBondContact O-CG 3.4Å; F33-L37 PolarHBondContact O-N 2.71Å; F33-C93 HydrophobicContact CD1-CB 4.09Å; F33-L96 HydrophobicContact CD1-CB 4.08Å; F33-L96 HydrophobicContact CD1-CD1 4.38Å; F33-L96 HydrophobicContact CD2-CB 3.91Å; F33-L96 HydrophobicContact CE1-CB 3.93Å; F33-L96 HydrophobicContact CE1-CD1 3.48Å; F33-L96 VanDerWaalsContact CE1-CD1 3.48Å; F33-L96 HydrophobicContact CE1-CG 4.35Å; F33-L96 HydrophobicContact CE2-CB 3.76Å; F33-L96 HydrophobicContact CE2-CD1 4.11Å; F33-L96 HydrophobicContact CG-CB 4.09Å; F33-L96 HydrophobicContact CZ-CB 3.79Å; F33-L96 HydrophobicContact CZ-CD1 3.33Å; F33-L96 HydrophobicContact CZ-CG 4.16Å; F33-H97 HydrophobicContact CB-CB 3.92Å
34G98.2Very high98.6Very high33 Ų3335 Ų3534%0.3421%0.213SC..Hα-helixtrans-63-49.8171.900000112.9W31 N32 L37 G38 H97W31-G34 PolarHBondContact O-N 3.21Å; N32-G34 PolarHBondContact O-N 3.28Å; N32-G34 VanDerWaalsContact O-N 3.11Å; G34-L37 PolarHBondContact O-N 3.49Å; G34-G38 PolarHBondContact O-N 3.4Å; G34-H97 PolarHBondContact N-ND1 3.29Å
35S98.2Very high98.6Very high45 Ų4537 Ų3732%0.31522%0.223SC..Hα-helixtrans-71.3-34.5177.9460000112.5N32 L37 G38 A39 D228N32-S35 PolarHBondContact O-N 3.47Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 3Å; S35-L37 PolarHBondContact O-N 3.32Å; S35-G38 PolarHBondContact O-N 3.45Å; S35-A39 PolarHBondContact O-N 3.15Å; S35-D228 WeakPolarHBondContact CB-OD2 3.14Å; S35-D228 PolarHBondContact OG-OD2 2.94Å
36L98.8Very high98.7Very high14 Ų1438.1 Ų38.17%0.07323%0.228CC..Hα-helixtrans-63.4-37.7173.4-65.7-178.8000112.9N32 F33 G38 A39 C40 L232 F235N32-L36 WeakPolarHBondContact O-CG 3.41Å; N32-L36 PolarHBondContact O-N 2.69Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.11Å; L36-G38 VanDerWaalsContact C-N 3.33Å; L36-A39 PolarHBondContact O-N 3.24Å; L36-C40 PolarHBondContact O-N 3.35Å; L36-C40 PolarHBondContact O-SG 3.45Å; L36-L232 HydrophobicContact CD2-CB 4.49Å; L36-F235 HydrophobicContact CD1-CB 4.45Å; L36-F235 HydrophobicContact CD2-CB 3.66Å; L36-F235 HydrophobicContact CD2-CD2 4.4Å; L36-F235 HydrophobicContact CD2-CG 4.04Å
37L98.9Very high98.7Very high25 Ų2535.9 Ų35.913%0.13122%0.217CC..Hα-helixtrans-63.3-39.5173.2-72.5171.1000111.9F33 G34 S35 C40 L41 F90 C93 L94 H97F33-L37 WeakPolarHBondContact O-CB 3.38Å; F33-L37 WeakPolarHBondContact O-CD1 3.13Å; F33-L37 WeakPolarHBondContact O-CG 3.4Å; F33-L37 PolarHBondContact O-N 2.71Å; G34-L37 PolarHBondContact O-N 3.49Å; S35-L37 PolarHBondContact O-N 3.32Å; L37-C40 PolarHBondContact O-N 3.29Å; L37-L41 PolarHBondContact O-N 2.89Å; L37-F90 HydrophobicContact CB-CE1 4.26Å; L37-F90 HydrophobicContact CD2-CD1 3.49Å; L37-F90 VanDerWaalsContact CD2-CD1 3.49Å; L37-F90 HydrophobicContact CD2-CE1 3.5Å; L37-F90 HydrophobicContact CG-CE1 4.49Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 4.12Å; L37-L94 HydrophobicContact CD1-CD2 4Å; L37-L94 HydrophobicContact CD2-CB 4.26Å; L37-L94 HydrophobicContact CD2-CD2 3.69Å; L37-L94 HydrophobicContact CD2-CG 3.56Å; L37-H97 HydrophobicContact CD1-CB 3.79Å
38G98.7Very high98.7Very high33 Ų3335.9 Ų35.934%0.3422%0.221SC..Hα-helixtrans-61.1-43.7171.800000112.4G34 S35 L36 L41 I42G34-G38 PolarHBondContact O-N 3.4Å; S35-G38 PolarHBondContact O-N 3.45Å; L36-G38 VanDerWaalsContact C-N 3.33Å; G38-L41 PolarHBondContact O-N 3.4Å; G38-I42 WeakPolarHBondContact O-CG1 3.37Å; G38-I42 PolarHBondContact O-N 3.14Å; G38-I42 VanDerWaalsContact O-N 3.07Å
39A98.8Very high98.7Very high25 Ų2537.8 Ų37.821%0.20723%0.228CC..Hα-helixtrans-63.6-41.2175.200000112.4S35 L36 I42 L43 L232S35-A39 PolarHBondContact O-N 3.15Å; L36-A39 PolarHBondContact O-N 3.24Å; A39-I42 PolarHBondContact O-N 2.96Å; A39-L43 WeakPolarHBondContact O-CB 3.47Å; A39-L43 PolarHBondContact O-N 2.88Å; A39-L232 HydrophobicContact CB-CD1 3.74Å
40C98.9Very high98.7Very high0 Ų039.9 Ų39.90%022%0.224CC..Hα-helixtrans-59.1-47.2173.7-67.20000111L36 L37 I42 L43 Q44 F90 F235L36-C40 PolarHBondContact O-N 3.35Å; L36-C40 PolarHBondContact O-SG 3.45Å; L37-C40 PolarHBondContact O-N 3.29Å; C40-I42 PolarHBondContact O-N 3.48Å; C40-L43 WeakPolarHBondContact O-CB 3.49Å; C40-L43 PolarHBondContact O-N 3.04Å; C40-Q44 WeakPolarHBondContact O-CG 3.3Å; C40-Q44 PolarHBondContact O-N 3.38Å; C40-F90 HydrophobicContact CB-CB 3.98Å; C40-F90 HydrophobicContact CB-CD1 3.54Å; C40-F90 HydrophobicContact CB-CD2 4.26Å; C40-F90 HydrophobicContact CB-CE1 3.99Å; C40-F90 HydrophobicContact CB-CG 3.68Å; C40-F235 WeakPolarHBondContact SG-CE2 3.43Å; C40-F235 WeakPolarHBondContact SG-CZ 3.43Å
41L98.9Very high98.8Very high17 Ų1736.5 Ų36.59%0.08921%0.213CC..Hα-helixtrans-61-44.3-180-177.561.2000111.9L37 G38 Q44 I45 F90 P186 I189 A190L37-L41 PolarHBondContact O-N 2.89Å; G38-L41 PolarHBondContact O-N 3.4Å; L41-Q44 PolarHBondContact O-N 2.96Å; L41-I45 HydrophobicContact CD1-CD1 3.95Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.32Å; L41-I45 WeakPolarHBondContact O-CG1 3.39Å; L41-I45 PolarHBondContact O-N 3.29Å; L41-F90 HydrophobicContact CB-CZ 4.22Å; L41-F90 HydrophobicContact CD1-CE2 4.44Å; L41-F90 HydrophobicContact CD1-CZ 4.47Å; L41-P186 HydrophobicContact CD1-CB 4.49Å; L41-I189 HydrophobicContact CD1-CB 4.34Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L41-A190 HydrophobicContact CD2-CB 3.94Å
42I98.8Very high98.8Very high113 Ų11336.6 Ų36.658%0.57922%0.218SC*.Hα-helixtrans-62.7-45.4176-66.8167.7000110.7G38 A39 C40 Q44 I45 T46G38-I42 WeakPolarHBondContact O-CG1 3.37Å; G38-I42 PolarHBondContact O-N 3.14Å; G38-I42 VanDerWaalsContact O-N 3.07Å; A39-I42 PolarHBondContact O-N 2.96Å; C40-I42 PolarHBondContact O-N 3.48Å; I42-Q44 PolarHBondContact O-N 2.83Å; I42-I45 PolarHBondContact O-N 3Å; I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.48Å; I42-T46 VanDerWaalsContact O-CG2 3.28Å; I42-T46 WeakPolarHBondContact O-CG2 3.32Å; I42-T46 PolarHBondContact O-N 3.39Å; I42-T46 PolarHBondContact O-OG1 3.31Å
43L98.9Very high98.8Very high30 Ų3041.7 Ų41.716%0.15724%0.243CC..Hα-helixtrans-57.1-47.5175.5177.973000111.4A39 C40 T46 T47 L239A39-L43 WeakPolarHBondContact O-CB 3.47Å; A39-L43 PolarHBondContact O-N 2.88Å; C40-L43 WeakPolarHBondContact O-CB 3.49Å; C40-L43 PolarHBondContact O-N 3.04Å; L43-T46 WeakPolarHBondContact CA-OG1 3.25Å; L43-T46 PolarHBondContact O-N 3.26Å; L43-T46 PolarHBondContact O-OG1 3.44Å; L43-T47 HydrophobicContact CD1-CG2 3.99Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.29Å; L43-T47 WeakPolarHBondContact O-CG2 3.28Å; L43-T47 PolarHBondContact O-N 2.88Å; L43-T47 PolarHBondContact O-OG1 2.86Å; L43-L239 HydrophobicContact CD2-CD2 3.42Å; L43-L239 VanDerWaalsContact CD2-CD2 3.42Å
44Q98.9Very high98.7Very high21 Ų2144 Ų4410%0.09825%0.254CS..Hα-helixtrans-66.5-43.2-178.9-67.4-48.9107.700112.2C40 L41 I42 T47 G48 H83 G86 F90C40-Q44 WeakPolarHBondContact O-CG 3.3Å; C40-Q44 PolarHBondContact O-N 3.38Å; L41-Q44 PolarHBondContact O-N 2.96Å; I42-Q44 PolarHBondContact O-N 2.83Å; Q44-T47 PolarHBondContact O-OG1 3.11Å; Q44-G48 WeakPolarHBondContact O-CA 3.41Å; Q44-G48 PolarHBondContact O-N 3.35Å; Q44-H83 PolarHBondContact NE2-O 2.73Å; Q44-H83 PolarHBondContact O-CE1 3.47Å; Q44-H83 VanDerWaalsContact O-CE1 3.27Å; Q44-H83 PolarHBondContact O-ND1 3.48Å; Q44-H83 PolarHBondContact OE1-O 2.82Å; Q44-G86 VanDerWaalsContact OE1-CA 3.3Å; Q44-F90 HydrophobicContact CG-CD2 4.2Å
45I98.9Very high98.8Very high41 Ų4143.6 Ų43.621%0.2124%0.242CC..Hα-helixtrans-63.4-46.6177.6-69.8169.6000110.4L41 I42 L49 P186 F187L41-I45 HydrophobicContact CD1-CD1 3.95Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.32Å; L41-I45 WeakPolarHBondContact O-CG1 3.39Å; L41-I45 PolarHBondContact O-N 3.29Å; I42-I45 PolarHBondContact O-N 3Å; I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.22Å; I45-L49 PolarHBondContact O-N 2.91Å; I45-P186 HydrophobicContact CD1-CB 4.2Å; I45-P186 HydrophobicContact CG1-CB 3.68Å; I45-F187 HydrophobicContact CG2-CE1 4.03Å; I45-F187 HydrophobicContact CG2-CZ 4.22Å
46T98.9Very high98.8Very high65 Ų6543.7 Ų43.740%0.39924%0.243SC..Hα-helixtrans-65.6-55.6-178.250.90000111.5I42 L43 G48 L49 F50I42-T46 HydrophobicContact CG2-CG2 4.26Å; I42-T46 WeakPolarHBondContact O-CB 3.48Å; I42-T46 VanDerWaalsContact O-CG2 3.28Å; I42-T46 WeakPolarHBondContact O-CG2 3.32Å; I42-T46 PolarHBondContact O-N 3.39Å; I42-T46 PolarHBondContact O-OG1 3.31Å; L43-T46 WeakPolarHBondContact CA-OG1 3.25Å; L43-T46 PolarHBondContact O-N 3.26Å; L43-T46 PolarHBondContact O-OG1 3.44Å; T46-G48 VanDerWaalsContact C-N 3.32Å; T46-G48 PolarHBondContact O-N 2.7Å; T46-L49 PolarHBondContact O-N 3.48Å; T46-F50 VanDerWaalsContact O-CD2 3.3Å; T46-F50 WeakPolarHBondContact O-CD2 3.44Å; T46-F50 PolarHBondContact O-N 3.47Å
47T98.9Very high98.7Very high10 Ų1044.7 Ų44.76%0.06125%0.25CS..Hα-helixtrans-61-41.5178.354.50000111.8L43 Q44 L49 F50 L51 I79 L82 H83L43-T47 HydrophobicContact CD1-CG2 3.99Å; L43-T47 HydrophobicContact CG-CG2 4.47Å; L43-T47 WeakPolarHBondContact O-CB 3.29Å; L43-T47 WeakPolarHBondContact O-CG2 3.28Å; L43-T47 PolarHBondContact O-N 2.88Å; L43-T47 PolarHBondContact O-OG1 2.86Å; Q44-T47 PolarHBondContact O-OG1 3.11Å; T47-L49 PolarHBondContact O-N 3.44Å; T47-F50 PolarHBondContact O-N 2.87Å; T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.27Å; T47-L51 PolarHBondContact O-N 3.49Å; T47-I79 HydrophobicContact CG2-CG2 4.3Å; T47-L82 HydrophobicContact CG2-CB 4.08Å; T47-H83 PolarHBondContact OG1-ND1 3.43Å
48G98.8Very high98.6Very high16 Ų1646.1 Ų46.117%0.16526%0.258CS..Hα-helixtrans-62.7-40178.400000112.9Q44 T46 L51 A52 H83Q44-G48 WeakPolarHBondContact O-CA 3.41Å; Q44-G48 PolarHBondContact O-N 3.35Å; T46-G48 VanDerWaalsContact C-N 3.32Å; T46-G48 PolarHBondContact O-N 2.7Å; G48-L51 PolarHBondContact O-N 2.82Å; G48-A52 VanDerWaalsContact O-CB 3.31Å; G48-A52 WeakPolarHBondContact O-CB 3.32Å; G48-A52 PolarHBondContact O-N 3.14Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.4Å; G48-H83 PolarHBondContact N-ND1 2.68Å
49L98.8Very high98.5Very high77 Ų7745.6 Ų45.640%0.40325%0.25SS..Hα-helixtrans-62-45.3175.1-178.765.4000111.6I45 T46 T47 A52 M53 F183I45-L49 VanDerWaalsContact O-CB 3.27Å; I45-L49 WeakPolarHBondContact O-CB 3.22Å; I45-L49 PolarHBondContact O-N 2.91Å; T46-L49 PolarHBondContact O-N 3.48Å; T47-L49 PolarHBondContact O-N 3.44Å; L49-A52 PolarHBondContact O-N 2.94Å; L49-M53 HydrophobicContact CD2-CE 4.46Å; L49-M53 HydrophobicContact CG-CE 4.03Å; L49-M53 WeakPolarHBondContact O-CG 3.36Å; L49-M53 PolarHBondContact O-N 3.04Å; L49-F183 HydrophobicContact CD1-CE2 4.24Å; L49-F183 HydrophobicContact CD1-CZ 4.05Å
50F98.8Very high98.4Very high113 Ų11349 Ų4950%0.49627%0.273SS..Hα-helixtrans-64.9-38.7176.7-82.3-80.6000112.3T46 T47 M53 H54 I79T46-F50 VanDerWaalsContact O-CD2 3.3Å; T46-F50 WeakPolarHBondContact O-CD2 3.44Å; T46-F50 PolarHBondContact O-N 3.47Å; T47-F50 PolarHBondContact O-N 2.87Å; F50-M53 HydrophobicContact CD1-SD 4.47Å; F50-M53 PolarHBondContact O-N 2.89Å; F50-H54 PolarHBondContact O-CD2 2.9Å; F50-I79 HydrophobicContact CB-CD1 4.37Å; F50-I79 HydrophobicContact CB-CG2 4.22Å
51L98.9Very high98.4Very high23 Ų2351.2 Ų51.212%0.1229%0.287CS..Hα-helixtrans-64.4-41.9174.4-67.5170.2000111.8T47 G48 M53 H54 Y55 I69 I79 R80 H83T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.27Å; T47-L51 PolarHBondContact O-N 3.49Å; G48-L51 PolarHBondContact O-N 2.82Å; L51-M53 PolarHBondContact O-N 2.9Å; L51-H54 PolarHBondContact O-N 3.08Å; L51-Y55 PolarHBondContact O-N 3.39Å; L51-Y55 VanDerWaalsContact O-N 3.12Å; L51-I69 HydrophobicContact CD2-CD1 4.31Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; L51-I79 HydrophobicContact CD1-CG2 4.49Å; L51-I79 HydrophobicContact CD2-CG2 3.96Å; L51-I79 HydrophobicContact CG-CG2 3.87Å; L51-R80 HydrophobicContact CD2-CB 4.09Å; L51-H83 HydrophobicContact CD1-CB 3.5Å; L51-H83 VanDerWaalsContact CD1-CB 3.5Å
52A98.7Very high98.4Very high23 Ų2350.4 Ų50.419%0.1928%0.282CS..Hα-helixtrans-61.8-27.3-179.600000113.2G48 L49 H54 F179 F183G48-A52 VanDerWaalsContact O-CB 3.31Å; G48-A52 WeakPolarHBondContact O-CB 3.32Å; G48-A52 PolarHBondContact O-N 3.14Å; L49-A52 PolarHBondContact O-N 2.94Å; A52-H54 PolarHBondContact O-N 3.4Å; A52-F179 HydrophobicContact CB-CE2 4.23Å; A52-F179 HydrophobicContact CB-CZ 4.13Å; A52-F183 HydrophobicContact CB-CD2 4.28Å; A52-F183 HydrophobicContact CB-CE2 3.99Å
53M98.7Very high98.4Very high118 Ų11847.7 Ų47.758%0.58127%0.267SS*.THydrogen-bonded Turntrans-65.1-17.5175-63.4-179.2-168.100113.5L49 F50 L51L49-M53 HydrophobicContact CD2-CE 4.46Å; L49-M53 HydrophobicContact CG-CE 4.03Å; L49-M53 WeakPolarHBondContact O-CG 3.36Å; L49-M53 PolarHBondContact O-N 3.04Å; F50-M53 HydrophobicContact CD1-SD 4.47Å; F50-M53 PolarHBondContact O-N 2.89Å; L51-M53 PolarHBondContact O-N 2.9Å
54H98.6Very high98.3Very high82 Ų8249.3 Ų49.338%0.3828%0.28SS..THydrogen-bonded Turntrans-122.9-3.3-175-61.6-68.8000113.6F50 L51 A52 I69 V73F50-H54 PolarHBondContact O-CD2 2.9Å; L51-H54 PolarHBondContact O-N 3.08Å; A52-H54 PolarHBondContact O-N 3.4Å; H54-I69 HydrophobicContact CB-CD1 3.91Å; H54-I69 HydrophobicContact CB-CG1 3.5Å; H54-V73 HydrophobicContact CB-CG2 4.34Å
55Y98.8Very high98.3Very high24 Ų2448.8 Ų48.89%0.09428%0.279CS..  trans-92.3144.6-177.2175.5-108.4000111.8L51 P57 A62 S65 I66 L133 F179L51-Y55 PolarHBondContact O-N 3.39Å; L51-Y55 VanDerWaalsContact O-N 3.12Å; Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.71Å; Y55-A62 HydrophobicContact CE2-CB 3.99Å; Y55-S65 VanDerWaalsContact CD2-OG 3.24Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.43Å; Y55-I66 HydrophobicContact CD2-CD1 3.78Å; Y55-I66 HydrophobicContact CD2-CG1 4.16Å; Y55-I66 HydrophobicContact CE2-CD1 4.19Å; Y55-I66 HydrophobicContact CE2-CG1 4.24Å; Y55-L133 HydrophobicContact CE1-CB 4.45Å; Y55-L133 HydrophobicContact CE2-CB 4.43Å; Y55-L133 WeakPolarHBondContact CE2-O 3.44Å; Y55-L133 PolarHBondContact OH-O 2.85Å; Y55-F179 AromaticContact CD1-CD2 3.65Å; Y55-F179 HydrophobicContact CD1-CD2 3.65Å; 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 4.34Å; 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 4.02Å
56S98.3Very high98.3Very high48 Ų4848 Ų4834%0.33628%0.275SS..  trans-119.9113.4177.2-172.20000110.5D58 T61 A62 S65S56-D58 PolarHBondContact O-N 2.88Å; S56-T61 WeakPolarHBondContact CB-OG1 3.47Å; S56-T61 PolarHBondContact OG-OG1 3.07Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.34Å; S56-S65 PolarHBondContact N-OG 3.27Å
57P97Very high98.3Very high34 Ų3446.7 Ų46.722%0.22127%0.27CS..  trans-85.152.7-173.636.3-38.4000113.3Y55 T176 F179Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.71Å; P57-T176 PolarHBondContact O-OG1 3.43Å; P57-F179 HydrophobicContact CB-CB 3.81Å; P57-F179 HydrophobicContact CB-CD1 3.94Å; P57-F179 HydrophobicContact CB-CG 3.91Å; P57-F179 HydrophobicContact CG-CD1 3.92Å; P57-F179 HydrophobicContact CG-CE1 4.41Å; P57-F179 HydrophobicContact CG-CG 4.39Å
58D96.9Very high98.3Very high56 Ų5649.9 Ų49.930%0.29929%0.285SS..SBendtrans-125.9140.8173.2178.7-96.5000110.7S56 S60 T61 A62 S172S56-D58 PolarHBondContact O-N 2.88Å; D58-S60 PolarHBondContact O-N 2.93Å; D58-S60 VanDerWaalsContact O-N 3.1Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.45Å; D58-S60 PolarHBondContact OD1-N 3.48Å; D58-S60 PolarHBondContact OD1-OG 2.84Å; D58-T61 PolarHBondContact O-N 3.26Å; D58-A62 WeakPolarHBondContact O-CB 3.43Å; D58-A62 PolarHBondContact O-N 3.49Å; D58-S172 PolarHBondContact OD2-OG 2.89Å
59A95.9Very high98.3Very high21 Ų2149.2 Ų49.217%0.17428%0.277CS..THydrogen-bonded Turntrans-59.2-26.6-174.600000113.5W135 S172A59-W135 HydrophobicContact CB-CZ2 3.75Å; A59-S172 WeakPolarHBondContact CB-OG 3.31Å; A59-S172 PolarHBondContact N-OG 3.23Å
60S97.5Very high98.3Very high98 Ų9847.1 Ų47.169%0.68527%0.268SS*.THydrogen-bonded Turntrans-79.4-24.5178.172.60000113.8D58D58-S60 PolarHBondContact O-N 2.93Å; D58-S60 VanDerWaalsContact O-N 3.1Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.45Å; D58-S60 PolarHBondContact OD1-N 3.48Å; D58-S60 PolarHBondContact OD1-OG 2.84Å
61T98.3Very high98.3Very high46 Ų4651.8 Ų51.828%0.28228%0.282SS..THydrogen-bonded Turntrans-120.7-12.8-17356.10000114.6S56 D58 F63 S64 S65S56-T61 WeakPolarHBondContact CB-OG1 3.47Å; S56-T61 PolarHBondContact OG-OG1 3.07Å; D58-T61 PolarHBondContact O-N 3.26Å; T61-F63 PolarHBondContact O-N 3.01Å; T61-S64 WeakPolarHBondContact CA-OG 3.36Å; T61-S64 PolarHBondContact O-N 3.31Å; T61-S64 PolarHBondContact O-OG 3.04Å; T61-S65 VanDerWaalsContact O-CB 3.27Å; T61-S65 WeakPolarHBondContact O-CB 3.28Å; T61-S65 PolarHBondContact O-N 2.86Å; T61-S65 PolarHBondContact O-OG 3.29Å
62A98.5Very high98.3Very high0 Ų056 Ų560%031%0.305CS..Hα-helixtrans-60.1-53.5-174.300000112.4Y55 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 3.34Å; D58-A62 WeakPolarHBondContact O-CB 3.43Å; D58-A62 PolarHBondContact O-N 3.49Å; A62-S64 PolarHBondContact O-N 3.32Å; A62-S65 PolarHBondContact O-N 3.15Å; A62-S65 PolarHBondContact O-OG 3.21Å; A62-I66 PolarHBondContact O-N 3.35Å; A62-I66 VanDerWaalsContact O-N 3.14Å; A62-W135 HydrophobicContact CB-CB 3.84Å; A62-W135 HydrophobicContact CB-CG 4.36Å; A62-L175 HydrophobicContact CB-CD2 3.54Å
63F98.6Very high98.3Very high56 Ų5656.2 Ų56.225%0.24630%0.303CS..Hα-helixtrans-60.2-44.3179-173.6-91.4000112.3T61 I66 A67 P134 W135 Y256 L258T61-F63 PolarHBondContact O-N 3.01Å; F63-I66 PolarHBondContact O-N 3.44Å; F63-A67 PolarHBondContact O-N 3.02Å; F63-A67 VanDerWaalsContact O-N 3.11Å; F63-P134 WeakPolarHBondContact CA-O 3.37Å; F63-P134 WeakPolarHBondContact CD2-O 3.5Å; F63-W135 HydrophobicContact CB-CB 4.46Å; F63-Y256 WeakPolarHBondContact CZ-O 3.47Å; F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.22Å; F63-L258 HydrophobicContact CD1-CD1 4.13Å; F63-L258 HydrophobicContact CD2-CB 4.49Å; F63-L258 HydrophobicContact CD2-CD1 4.24Å; F63-L258 HydrophobicContact CE1-CB 4.35Å; F63-L258 HydrophobicContact CG-CB 4.3Å; F63-L258 HydrophobicContact CG-CD1 3.69Å
64S98.6Very high98.3Very high64 Ų6457.4 Ų57.445%0.44831%0.312SS..Hα-helixtrans-70.1-31.9178.958.30000112.5T61 A62 I66 A67 H68T61-S64 WeakPolarHBondContact CA-OG 3.36Å; T61-S64 PolarHBondContact O-N 3.31Å; T61-S64 PolarHBondContact O-OG 3.04Å; A62-S64 PolarHBondContact O-N 3.32Å; S64-I66 VanDerWaalsContact C-N 3.35Å; S64-A67 WeakPolarHBondContact O-CB 3.42Å; S64-A67 PolarHBondContact O-N 3.43Å; S64-H68 WeakPolarHBondContact O-CB 3.46Å; S64-H68 PolarHBondContact O-N 3.42Å
65S98.7Very high98.3Very high10 Ų1061.8 Ų61.87%0.0733%0.327CS..Hα-helixtrans-66.4-35.5174.475.50000112.3Y55 S56 T61 A62 H68 I69Y55-S65 VanDerWaalsContact CD2-OG 3.24Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.43Å; S56-S65 PolarHBondContact N-OG 3.27Å; T61-S65 VanDerWaalsContact O-CB 3.27Å; T61-S65 WeakPolarHBondContact O-CB 3.28Å; T61-S65 PolarHBondContact O-N 2.86Å; T61-S65 PolarHBondContact O-OG 3.29Å; A62-S65 PolarHBondContact O-N 3.15Å; A62-S65 PolarHBondContact O-OG 3.21Å; S65-H68 WeakPolarHBondContact O-CB 3.31Å; S65-H68 PolarHBondContact O-N 3.49Å; S65-I69 WeakPolarHBondContact O-CG1 3.34Å; S65-I69 PolarHBondContact O-N 3.09Å
66I98.6Very high98.3Very high25 Ų2560.8 Ų60.813%0.12832%0.323CS..Hα-helixtrans-67.7-39.6171.5-65-63.7000111.5Y55 A62 F63 S64 I69 T70 R80Y55-I66 HydrophobicContact CD2-CD1 3.78Å; Y55-I66 HydrophobicContact CD2-CG1 4.16Å; Y55-I66 HydrophobicContact CE2-CD1 4.19Å; Y55-I66 HydrophobicContact CE2-CG1 4.24Å; A62-I66 PolarHBondContact O-N 3.35Å; A62-I66 VanDerWaalsContact O-N 3.14Å; F63-I66 PolarHBondContact O-N 3.44Å; S64-I66 VanDerWaalsContact C-N 3.35Å; I66-I69 HydrophobicContact CD1-CD1 4.19Å; I66-I69 PolarHBondContact O-N 3.43Å; I66-T70 PolarHBondContact O-N 2.79Å; I66-T70 PolarHBondContact O-OG1 2.85Å; I66-R80 VanDerWaalsContact CG2-NE 3.28Å
67A98.4Very high98.3Very high36 Ų3663.5 Ų63.530%0.29833%0.326SS..Hα-helixtrans-62.5-43.6173.500000111.5F63 S64 T70 R71F63-A67 PolarHBondContact O-N 3.02Å; F63-A67 VanDerWaalsContact O-N 3.11Å; S64-A67 WeakPolarHBondContact O-CB 3.42Å; S64-A67 PolarHBondContact O-N 3.43Å; A67-T70 PolarHBondContact O-N 3.13Å; A67-T70 VanDerWaalsContact O-N 3.15Å; A67-R71 WeakPolarHBondContact O-CB 3.47Å; A67-R71 WeakPolarHBondContact O-CG 3.3Å; A67-R71 PolarHBondContact O-N 2.89Å
68H98.8Very high98.3Very high78 Ų7863.3 Ų63.336%0.36132%0.323SS..Hα-helixtrans-59.8-46.5174.2165.2-92.2000112.1S64 S65 T70 R71 D72 V73S64-H68 WeakPolarHBondContact O-CB 3.46Å; S64-H68 PolarHBondContact O-N 3.42Å; S65-H68 WeakPolarHBondContact O-CB 3.31Å; S65-H68 PolarHBondContact O-N 3.49Å; H68-T70 PolarHBondContact O-N 3.38Å; H68-R71 PolarHBondContact O-N 3.35Å; H68-D72 IonicContact CD2-OD2 3.33Å; H68-D72 PolarHBondContact CD2-OD2 3.18Å; H68-D72 IonicContact CG-OD2 3.92Å; H68-D72 WeakPolarHBondContact O-CB 3.37Å; H68-D72 PolarHBondContact O-N 2.95Å; H68-V73 PolarHBondContact O-N 3.3Å
69I98.8Very high98.4Very high2 Ų262.5 Ų62.51%0.0132%0.318CS..Hα-helixtrans-54.2-44.4173-75.3163.7000110.8L51 H54 S65 I66 G76 R80L51-I69 HydrophobicContact CD2-CD1 4.31Å; L51-I69 HydrophobicContact CD2-CG2 3.55Å; H54-I69 HydrophobicContact CB-CD1 3.91Å; H54-I69 HydrophobicContact CB-CG1 3.5Å; S65-I69 WeakPolarHBondContact O-CG1 3.34Å; S65-I69 PolarHBondContact O-N 3.09Å; I66-I69 HydrophobicContact CD1-CD1 4.19Å; I66-I69 PolarHBondContact O-N 3.43Å; I69-G76 CarbonylContact O-C 3.34Å; I69-G76 WeakPolarHBondContact O-CA 3.37Å; I69-R80 HydrophobicContact CG2-CB 4.37Å
70T98.5Very high98.6Very high33 Ų3363.5 Ų63.520%0.20232%0.318CS..Hα-helixtrans-73-33.6-174.9-51.10000112.1I66 A67 H68 W77 R80I66-T70 PolarHBondContact O-N 2.79Å; I66-T70 PolarHBondContact O-OG1 2.85Å; A67-T70 PolarHBondContact O-N 3.13Å; A67-T70 VanDerWaalsContact O-N 3.15Å; H68-T70 PolarHBondContact O-N 3.38Å; T70-W77 HydrophobicContact CG2-CB 3.94Å; T70-W77 WeakPolarHBondContact O-CB 3.38Å; T70-R80 WeakPolarHBondContact OG1-CD 3.47Å
71R98.6Very high98.6Very high210 Ų21060.2 Ų60.279%0.79229%0.29SS*.Hα-helixtrans-104.2-35-168.3-66.3178.5175.4-139.1-1.1114.3A67 H68A67-R71 WeakPolarHBondContact O-CB 3.47Å; A67-R71 WeakPolarHBondContact O-CG 3.3Å; A67-R71 PolarHBondContact O-N 2.89Å; H68-R71 PolarHBondContact O-N 3.35Å
72D98.7Very high98.7Very high113 Ų11359.4 Ų59.460%0.60428%0.284SS*.THydrogen-bonded Turntrans-115-27.1-165.7-52.5-41.4000112.6H68H68-D72 IonicContact CD2-OD2 3.33Å; H68-D72 PolarHBondContact CD2-OD2 3.18Å; H68-D72 IonicContact CG-OD2 3.92Å; H68-D72 WeakPolarHBondContact O-CB 3.37Å; H68-D72 PolarHBondContact O-N 2.95Å
73V98.8Very high98.7Very high26 Ų2661 Ų6116%0.15829%0.291CS..SBendtrans-79.1129.7176.8179.50000110.2H54 H68 Y75 G76H54-V73 HydrophobicContact CB-CG2 4.34Å; H68-V73 PolarHBondContact O-N 3.3Å; V73-Y75 PolarHBondContact O-N 2.9Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; V73-G76 PolarHBondContact O-N 3.48Å
74N98.6Very high98.7Very high144 Ų14460.7 Ų60.777%0.7730%0.3SS*.THydrogen-bonded Turntrans-54.7120.4176-69-40.9000111G76N74-G76 PolarHBondContact O-N 3.41Å; N74-G76 VanDerWaalsContact O-N 3.09Å
75Y98.5Very high98.7Very high174 Ų17457.9 Ų57.968%0.68228%0.28SS*.THydrogen-bonded Turntrans57.314.9-174.4-56.3-79.3000114.7V73 W77 I78 I79V73-Y75 PolarHBondContact O-N 2.9Å; V73-Y75 VanDerWaalsContact O-N 3.15Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 3.38Å; Y75-I78 HydrophobicContact CD1-CG2 4.26Å; Y75-I78 WeakPolarHBondContact O-CG2 3.32Å; Y75-I78 PolarHBondContact O-N 3.47Å; Y75-I79 WeakPolarHBondContact O-CG1 3.43Å; Y75-I79 PolarHBondContact O-N 3.04Å; Y75-I79 VanDerWaalsContact O-N 3.15Å
76G98.8Very high98.7Very high2 Ų257.4 Ų57.42%0.02128%0.276CS..Hα-helixtrans-65.5-33.1-178.900000112.8I69 V73 N74 I78 I79 R80I69-G76 CarbonylContact O-C 3.34Å; I69-G76 WeakPolarHBondContact O-CA 3.37Å; V73-G76 PolarHBondContact O-N 3.48Å; N74-G76 PolarHBondContact O-N 3.41Å; N74-G76 VanDerWaalsContact O-N 3.09Å; G76-I78 PolarHBondContact O-N 2.97Å; G76-I79 PolarHBondContact O-N 2.95Å; G76-R80 WeakPolarHBondContact O-CB 3.37Å; G76-R80 PolarHBondContact O-N 3.49Å
77W98.6Very high98.7Very high106 Ų10657.1 Ų57.140%0.40228%0.278SS..Hα-helixtrans-57.9-47.417369.4-90.3000112.6T70 Y75 R80 Y81 L244T70-W77 HydrophobicContact CG2-CB 3.94Å; T70-W77 WeakPolarHBondContact O-CB 3.38Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 3.38Å; W77-R80 PolarHBondContact O-N 3.37Å; W77-Y81 HydrophobicContact CE3-CD2 4.05Å; W77-Y81 HydrophobicContact CE3-CE2 4.49Å; W77-Y81 WeakPolarHBondContact O-CD2 3.47Å; W77-Y81 PolarHBondContact O-N 3.09Å; W77-L244 HydrophobicContact CH2-CD2 3.9Å; W77-L244 HydrophobicContact CZ3-CD2 4.26Å
78I98.7Very high98.7Very high30 Ų3055.6 Ų55.615%0.15427%0.265CS..Hα-helixtrans-71.8-37.3-177.5-173.6168.9000110.6Y75 G76 R80 Y81 L82 M240 T243 L244Y75-I78 HydrophobicContact CD1-CG2 4.26Å; Y75-I78 WeakPolarHBondContact O-CG2 3.32Å; Y75-I78 PolarHBondContact O-N 3.47Å; G76-I78 PolarHBondContact O-N 2.97Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 2.79Å; I78-Y81 PolarHBondContact O-N 3.33Å; I78-L82 HydrophobicContact CG1-CD1 4.09Å; I78-L82 HydrophobicContact CG1-CG 4.21Å; I78-L82 VanDerWaalsContact O-CB 3.28Å; I78-L82 WeakPolarHBondContact O-CB 3.49Å; I78-L82 VanDerWaalsContact O-CG 3.22Å; I78-L82 WeakPolarHBondContact O-CG 3.42Å; I78-L82 PolarHBondContact O-N 2.92Å; I78-M240 HydrophobicContact CD1-CE 4.23Å; I78-T243 HydrophobicContact CG1-CG2 4.25Å; I78-L244 HydrophobicContact CD1-CD2 4.03Å
79I98.8Very high98.7Very high39 Ų3952.8 Ų52.820%0.225%0.252CS..Hα-helixtrans-62.2-44174.2-62.2170.1000110.2T47 F50 L51 Y75 G76 L82 H83T47-I79 HydrophobicContact CG2-CG2 4.3Å; F50-I79 HydrophobicContact CB-CD1 4.37Å; F50-I79 HydrophobicContact CB-CG2 4.22Å; L51-I79 HydrophobicContact CD1-CG2 4.49Å; L51-I79 HydrophobicContact CD2-CG2 3.96Å; L51-I79 HydrophobicContact CG-CG2 3.87Å; Y75-I79 WeakPolarHBondContact O-CG1 3.43Å; Y75-I79 PolarHBondContact O-N 3.04Å; Y75-I79 VanDerWaalsContact O-N 3.15Å; G76-I79 PolarHBondContact O-N 2.95Å; I79-L82 PolarHBondContact O-N 3.27Å; I79-H83 WeakPolarHBondContact O-CB 3.35Å; I79-H83 PolarHBondContact O-N 3.47Å
80R98.8Very high98.7Very high41 Ų4153.5 Ų53.516%0.15526%0.255CS..Hα-helixtrans-59.5-49.7176.3179.1-176.3175-102.61.7111.4L51 I66 I69 T70 G76 W77 I78 H83 A84 Y256L51-R80 HydrophobicContact CD2-CB 4.09Å; I66-R80 VanDerWaalsContact CG2-NE 3.28Å; I69-R80 HydrophobicContact CG2-CB 4.37Å; T70-R80 WeakPolarHBondContact OG1-CD 3.47Å; G76-R80 WeakPolarHBondContact O-CB 3.37Å; G76-R80 PolarHBondContact O-N 3.49Å; W77-R80 PolarHBondContact O-N 3.37Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 2.79Å; R80-H83 WeakPolarHBondContact O-CB 3.38Å; R80-H83 PolarHBondContact O-N 3.39Å; R80-A84 WeakPolarHBondContact O-CB 3.44Å; R80-A84 PolarHBondContact O-N 3.18Å; R80-Y256 PolarHBondContact NH1-OH 2.94Å
81Y98.8Very high98.8Very high30 Ų3052 Ų5212%0.11825%0.246CC..Hα-helixtrans-72.5-31.6-178.3-70-59.5000113.2W77 I78 H83 A84 N85 P247 Y256W77-Y81 HydrophobicContact CE3-CD2 4.05Å; W77-Y81 HydrophobicContact CE3-CE2 4.49Å; W77-Y81 WeakPolarHBondContact O-CD2 3.47Å; W77-Y81 PolarHBondContact O-N 3.09Å; I78-Y81 PolarHBondContact O-N 3.33Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-A84 PolarHBondContact O-N 2.67Å; Y81-N85 VanDerWaalsContact O-CB 3.23Å; Y81-N85 WeakPolarHBondContact O-CB 3.38Å; Y81-N85 PolarHBondContact O-N 3.38Å; Y81-N85 PolarHBondContact O-ND2 2.86Å; Y81-P247 HydrophobicContact CD1-CB 3.56Å; Y81-P247 HydrophobicContact CD2-CB 4.03Å; Y81-P247 HydrophobicContact CE1-CB 3.78Å; Y81-P247 HydrophobicContact CE2-CB 4.23Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; Y81-Y256 PolarHBondContact OH-OH 2.95Å
82L98.9Very high98.8Very high29 Ų2944.8 Ų44.815%0.15222%0.222CC..Hα-helixtrans-61.4-41.1168.8-77.6172.7000111.1T47 I78 I79 G86 L239 M240 T243T47-L82 HydrophobicContact CG2-CB 4.08Å; I78-L82 HydrophobicContact CG1-CD1 4.09Å; I78-L82 HydrophobicContact CG1-CG 4.21Å; I78-L82 VanDerWaalsContact O-CB 3.28Å; I78-L82 WeakPolarHBondContact O-CB 3.49Å; I78-L82 VanDerWaalsContact O-CG 3.22Å; I78-L82 WeakPolarHBondContact O-CG 3.42Å; I78-L82 PolarHBondContact O-N 2.92Å; I79-L82 PolarHBondContact O-N 3.27Å; L82-G86 WeakPolarHBondContact O-CA 3.46Å; L82-G86 PolarHBondContact O-N 2.82Å; L82-L239 HydrophobicContact CD2-CD2 3.93Å; L82-L239 HydrophobicContact CD2-CG 4.06Å; L82-M240 HydrophobicContact CD2-SD 3.85Å; L82-T243 HydrophobicContact CD2-CG2 4.19Å; L82-T243 HydrophobicContact CG-CG2 4.19Å
83H98.9Very high98.8Very high32 Ų3239.6 Ų39.615%0.14820%0.195CC..Hα-helixtrans-68.3-44177.7-16581.4000112.2Q44 T47 G48 L51 I79 R80 Y81 A87 H182Q44-H83 PolarHBondContact NE2-O 2.73Å; Q44-H83 PolarHBondContact O-CE1 3.47Å; Q44-H83 VanDerWaalsContact O-CE1 3.27Å; Q44-H83 PolarHBondContact O-ND1 3.48Å; Q44-H83 PolarHBondContact OE1-O 2.82Å; T47-H83 PolarHBondContact OG1-ND1 3.43Å; G48-H83 VanDerWaalsContact CA-CE1 3.45Å; G48-H83 WeakPolarHBondContact CA-CE1 3.4Å; G48-H83 PolarHBondContact N-ND1 2.68Å; L51-H83 HydrophobicContact CD1-CB 3.5Å; L51-H83 VanDerWaalsContact CD1-CB 3.5Å; I79-H83 WeakPolarHBondContact O-CB 3.35Å; I79-H83 PolarHBondContact O-N 3.47Å; R80-H83 WeakPolarHBondContact O-CB 3.38Å; R80-H83 PolarHBondContact O-N 3.39Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; H83-A87 PolarHBondContact O-N 3.43Å; H83-A87 VanDerWaalsContact O-N 3.14Å; H83-H182 AromaticContact NE2-NE2 3.96Å
84A98.8Very high98.8Very high51 Ų5139 Ų3942%0.42119%0.191SC..Hα-helixtrans-68.9-51.9-179.900000112.2R80 Y81 G86 A87 S88R80-A84 WeakPolarHBondContact O-CB 3.44Å; R80-A84 PolarHBondContact O-N 3.18Å; Y81-A84 PolarHBondContact O-N 2.67Å; A84-G86 VanDerWaalsContact C-N 3.34Å; A84-A87 WeakPolarHBondContact O-CB 3.48Å; A84-A87 PolarHBondContact O-N 2.99Å; A84-S88 PolarHBondContact O-N 3.36Å
85N98.9Very high98.8Very high5 Ų535.3 Ų35.33%0.02717%0.168CC..Hα-helixtrans-71.7-31.2178.1-70.8-52000112Y81 A87 S88 M89 L239 L242 P247Y81-N85 VanDerWaalsContact O-CB 3.23Å; Y81-N85 WeakPolarHBondContact O-CB 3.38Å; Y81-N85 PolarHBondContact O-N 3.38Å; Y81-N85 PolarHBondContact O-ND2 2.86Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 2.87Å; N85-S88 WeakPolarHBondContact O-CB 3.46Å; N85-S88 PolarHBondContact O-N 3.05Å; N85-S88 VanDerWaalsContact O-N 3.15Å; N85-M89 WeakPolarHBondContact O-CG 3.47Å; N85-M89 PolarHBondContact O-N 3.37Å; N85-L239 HydrophobicContact CB-CD1 3.9Å; N85-L242 HydrophobicContact CB-CD2 3.78Å; N85-L242 HydrophobicContact CB-CG 4.21Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.27Å; N85-P247 PolarHBondContact ND2-O 3.44Å; N85-P247 PolarHBondContact OD1-O 2.98Å
86G98.9Very high98.8Very high0 Ų030 Ų300%015%0.151CC..Hα-helixtrans-60.4-36.6172.200000112.5Q44 L82 A84 M89 F90Q44-G86 VanDerWaalsContact OE1-CA 3.3Å; L82-G86 WeakPolarHBondContact O-CA 3.46Å; L82-G86 PolarHBondContact O-N 2.82Å; A84-G86 VanDerWaalsContact C-N 3.34Å; G86-M89 PolarHBondContact O-N 3.48Å; G86-F90 WeakPolarHBondContact O-CB 3.37Å; G86-F90 PolarHBondContact O-N 3.46Å
87A98.8Very high98.8Very high19 Ų1931.6 Ų31.616%0.15716%0.158CC..Hα-helixtrans-62.2-43.5172.300000112H83 A84 N85 F90 F91H83-A87 PolarHBondContact O-N 3.43Å; H83-A87 VanDerWaalsContact O-N 3.14Å; A84-A87 WeakPolarHBondContact O-CB 3.48Å; A84-A87 PolarHBondContact O-N 2.99Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 2.87Å; A87-F90 VanDerWaalsContact O-CB 3.29Å; A87-F90 WeakPolarHBondContact O-CB 3.29Å; A87-F90 PolarHBondContact O-N 2.83Å; A87-F91 WeakPolarHBondContact O-CD2 3.46Å; A87-F91 PolarHBondContact O-N 3.41Å; A87-F91 VanDerWaalsContact O-N 3.16Å
88S98.8Very high98.8Very high4 Ų428 Ų283%0.02815%0.146CC..Hα-helixtrans-62-45.6173.9-73.90000112A84 N85 F90 F91 I92 W272A84-S88 PolarHBondContact O-N 3.36Å; N85-S88 WeakPolarHBondContact O-CB 3.46Å; N85-S88 PolarHBondContact O-N 3.05Å; N85-S88 VanDerWaalsContact O-N 3.15Å; S88-F90 PolarHBondContact O-N 3.1Å; S88-F91 PolarHBondContact O-N 3.14Å; S88-F91 VanDerWaalsContact O-N 3.14Å; S88-I92 WeakPolarHBondContact O-CG1 3.36Å; S88-I92 PolarHBondContact O-N 3.2Å; S88-W272 WeakPolarHBondContact O-CZ2 3.31Å; S88-W272 PolarHBondContact OG-NE1 2.92Å
89M98.8Very high98.8Very high19 Ų1927 Ų279%0.09414%0.143CC..Hα-helixtrans-61.8-32.7176.4-67.8-58-64.700112.3N85 G86 I92 C93 F235 S238 L239N85-M89 WeakPolarHBondContact O-CG 3.47Å; N85-M89 PolarHBondContact O-N 3.37Å; G86-M89 PolarHBondContact O-N 3.48Å; M89-I92 PolarHBondContact O-N 2.88Å; M89-I92 HydrophobicContact SD-CD1 3.94Å; M89-C93 WeakPolarHBondContact O-CB 3.39Å; M89-C93 PolarHBondContact O-N 2.87Å; M89-C93 PolarHBondContact O-SG 3.09Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.07Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.96Å; M89-F235 HydrophobicContact CG-CE2 4.41Å; M89-S238 WeakPolarHBondContact CE-OG 3.43Å; M89-L239 HydrophobicContact CG-CB 4.35Å; M89-L239 HydrophobicContact CG-CD1 3.9Å
90F98.9Very high98.9Very high17 Ų1726.2 Ų26.28%0.07514%0.138CC..Hα-helixtrans-62.2-46.8173.9-158.61.4000111.1L37 C40 L41 Q44 G86 A87 S88 C93 L94 T123L37-F90 HydrophobicContact CB-CE1 4.26Å; L37-F90 HydrophobicContact CD2-CD1 3.49Å; L37-F90 VanDerWaalsContact CD2-CD1 3.49Å; L37-F90 HydrophobicContact CD2-CE1 3.5Å; L37-F90 HydrophobicContact CG-CE1 4.49Å; C40-F90 HydrophobicContact CB-CB 3.98Å; C40-F90 HydrophobicContact CB-CD1 3.54Å; C40-F90 HydrophobicContact CB-CD2 4.26Å; C40-F90 HydrophobicContact CB-CE1 3.99Å; C40-F90 HydrophobicContact CB-CG 3.68Å; L41-F90 HydrophobicContact CB-CZ 4.22Å; L41-F90 HydrophobicContact CD1-CE2 4.44Å; L41-F90 HydrophobicContact CD1-CZ 4.47Å; Q44-F90 HydrophobicContact CG-CD2 4.2Å; G86-F90 WeakPolarHBondContact O-CB 3.37Å; G86-F90 PolarHBondContact O-N 3.46Å; A87-F90 VanDerWaalsContact O-CB 3.29Å; A87-F90 WeakPolarHBondContact O-CB 3.29Å; A87-F90 PolarHBondContact O-N 2.83Å; S88-F90 PolarHBondContact O-N 3.1Å; F90-C93 PolarHBondContact O-N 3.47Å; F90-L94 HydrophobicContact CD1-CD1 4.37Å; F90-L94 HydrophobicContact CD1-CG 4.27Å; F90-L94 HydrophobicContact CE1-CG 4.46Å; F90-L94 WeakPolarHBondContact O-CB 3.36Å; F90-L94 WeakPolarHBondContact O-CG 3.36Å; F90-L94 PolarHBondContact O-N 3.49Å; F90-T123 HydrophobicContact CD2-CG2 3.96Å; F90-T123 HydrophobicContact CE2-CG2 3.78Å; F90-T123 HydrophobicContact CG-CG2 4.49Å; F90-T123 HydrophobicContact CZ-CG2 4.18Å
91F98.9Very high98.9Very high1 Ų124.3 Ų24.30%0.00413%0.131CC..Hα-helixtrans-68.5-37.1176.8-82.6-81000113.6A87 S88 C93 L94 F95 T123 M124 A127 W272 Y273A87-F91 WeakPolarHBondContact O-CD2 3.46Å; A87-F91 PolarHBondContact O-N 3.41Å; A87-F91 VanDerWaalsContact O-N 3.16Å; S88-F91 PolarHBondContact O-N 3.14Å; S88-F91 VanDerWaalsContact O-N 3.14Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 2.86Å; F91-L94 HydrophobicContact CD1-CD1 4.16Å; F91-L94 HydrophobicContact CE1-CD1 4.25Å; F91-L94 PolarHBondContact O-N 2.9Å; F91-F95 HydrophobicContact CB-CD2 4.47Å; F91-F95 HydrophobicContact CB-CE2 4.02Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.29Å; F91-F95 HydrophobicContact CD1-CE2 4.23Å; F91-F95 AromaticContact CD1-CZ 3.79Å; F91-F95 HydrophobicContact CD1-CZ 3.79Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 VanDerWaalsContact O-CG 3.29Å; F91-F95 WeakPolarHBondContact O-CG 3.35Å; F91-F95 PolarHBondContact O-N 2.86Å; F91-T123 HydrophobicContact CE2-CG2 4.38Å; F91-T123 HydrophobicContact CZ-CG2 4.14Å; F91-M124 HydrophobicContact CE1-CG 3.81Å; F91-M124 HydrophobicContact CZ-CG 4.15Å; F91-A127 HydrophobicContact CE2-CB 3.48Å; F91-A127 VanDerWaalsContact CE2-CB 3.48Å; F91-A127 HydrophobicContact CZ-CB 3.86Å; F91-W272 HydrophobicContact CB-CH2 4.12Å; F91-W272 HydrophobicContact CB-CZ2 4.15Å; F91-Y273 HydrophobicContact CB-CD1 4.23Å; F91-Y273 HydrophobicContact CB-CG 3.95Å; 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 3.51Å; F91-Y273 HydrophobicContact CD2-CD2 3.51Å; F91-Y273 HydrophobicContact CD2-CE1 4.09Å; F91-Y273 AromaticContact CD2-CE2 3.77Å; F91-Y273 HydrophobicContact CD2-CE2 3.77Å; F91-Y273 AromaticContact CD2-CG 3.51Å; F91-Y273 HydrophobicContact CD2-CG 3.51Å; F91-Y273 AromaticContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CG 4.43Å; F91-Y273 HydrophobicContact CE2-CD1 4.44Å; 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 4.48Å; F91-Y273 AromaticContact CE2-CE2 3.44Å; F91-Y273 HydrophobicContact CE2-CE2 3.44Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.44Å; F91-Y273 AromaticContact CE2-CG 4Å; F91-Y273 HydrophobicContact CE2-CG 4Å; F91-Y273 HydrophobicContact CG-CD1 4.08Å; F91-Y273 AromaticContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CE2 4.48Å; F91-Y273 AromaticContact CG-CG 3.52Å; F91-Y273 HydrophobicContact CG-CG 3.52Å; F91-Y273 AromaticContact CZ-CD2 3.68Å; F91-Y273 HydrophobicContact CZ-CD2 3.68Å; F91-Y273 AromaticContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CG 4.43Å
92I98.9Very high98.9Very high59 Ų5924.2 Ų24.230%0.30313%0.133SC..Hα-helixtrans-57.2-50171.6-67.4168.8000109.5S88 M89 L94 F95 L96 W272S88-I92 WeakPolarHBondContact O-CG1 3.36Å; S88-I92 PolarHBondContact O-N 3.2Å; M89-I92 PolarHBondContact O-N 2.88Å; M89-I92 HydrophobicContact SD-CD1 3.94Å; I92-L94 VanDerWaalsContact C-N 3.32Å; I92-L94 PolarHBondContact O-N 3.26Å; I92-F95 PolarHBondContact O-N 3.41Å; I92-L96 HydrophobicContact CG2-CD1 3.82Å; I92-L96 VanDerWaalsContact O-CG 3.25Å; I92-L96 WeakPolarHBondContact O-CG 3.22Å; I92-L96 PolarHBondContact O-N 3.28Å; I92-L96 VanDerWaalsContact O-N 3.07Å; I92-W272 HydrophobicContact CD1-CH2 4.48Å; I92-W272 HydrophobicContact CD1-CZ2 4.27Å; I92-W272 HydrophobicContact CG1-CH2 3.54Å; I92-W272 HydrophobicContact CG1-CZ2 3.69Å
93C98.9Very high98.9Very high3 Ų324.4 Ų24.42%0.0213%0.131CC..Hα-helixtrans-62.3-38.6177.7-70.80000112.1F33 L37 M89 F90 F91 H97F33-C93 HydrophobicContact CD1-CB 4.09Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 4.12Å; M89-C93 WeakPolarHBondContact O-CB 3.39Å; M89-C93 PolarHBondContact O-N 2.87Å; M89-C93 PolarHBondContact O-SG 3.09Å; F90-C93 PolarHBondContact O-N 3.47Å; F91-C93 VanDerWaalsContact C-N 3.32Å; F91-C93 PolarHBondContact O-N 2.86Å; C93-H97 WeakPolarHBondContact O-CB 3.37Å; C93-H97 PolarHBondContact O-N 3.17Å
94L98.8Very high98.9Very high15 Ų1524 Ų248%0.07913%0.129CC..Hα-helixtrans-64.1-50.1178.5-83.4171.7000111.1L37 F90 F91 I92 L96 H97 I98 L120 T123L37-L94 HydrophobicContact CD1-CD2 4Å; L37-L94 HydrophobicContact CD2-CB 4.26Å; L37-L94 HydrophobicContact CD2-CD2 3.69Å; L37-L94 HydrophobicContact CD2-CG 3.56Å; F90-L94 HydrophobicContact CD1-CD1 4.37Å; F90-L94 HydrophobicContact CD1-CG 4.27Å; F90-L94 HydrophobicContact CE1-CG 4.46Å; F90-L94 WeakPolarHBondContact O-CB 3.36Å; F90-L94 WeakPolarHBondContact O-CG 3.36Å; F90-L94 PolarHBondContact O-N 3.49Å; F91-L94 HydrophobicContact CD1-CD1 4.16Å; F91-L94 HydrophobicContact CE1-CD1 4.25Å; F91-L94 PolarHBondContact O-N 2.9Å; I92-L94 VanDerWaalsContact C-N 3.32Å; I92-L94 PolarHBondContact O-N 3.26Å; L94-L96 VanDerWaalsContact C-N 3.34Å; L94-L96 PolarHBondContact O-N 2.9Å; L94-H97 WeakPolarHBondContact O-CB 3.29Å; L94-H97 PolarHBondContact O-N 3.37Å; L94-I98 VanDerWaalsContact O-CG1 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.2Å; L94-I98 PolarHBondContact O-N 3.45Å; L94-L120 HydrophobicContact CD1-CD1 4.39Å; L94-T123 HydrophobicContact CD1-CG2 3.74Å
95F98.9Very high98.8Very high65 Ų6521.7 Ų21.729%0.28511%0.109SC..Hα-helixtrans-64.1-39.1-179-62.3-37.9000111.9F91 I92 I98 G99 W272 Y273 F276F91-F95 HydrophobicContact CB-CD2 4.47Å; F91-F95 HydrophobicContact CB-CE2 4.02Å; F91-F95 HydrophobicContact CB-CZ 4.43Å; F91-F95 HydrophobicContact CD1-CE1 4.29Å; F91-F95 HydrophobicContact CD1-CE2 4.23Å; F91-F95 AromaticContact CD1-CZ 3.79Å; F91-F95 HydrophobicContact CD1-CZ 3.79Å; F91-F95 WeakPolarHBondContact O-CD2 3.48Å; F91-F95 VanDerWaalsContact O-CG 3.29Å; F91-F95 WeakPolarHBondContact O-CG 3.35Å; F91-F95 PolarHBondContact O-N 2.86Å; I92-F95 PolarHBondContact O-N 3.41Å; F95-I98 PolarHBondContact O-N 3.19Å; F95-G99 PolarHBondContact O-N 3.21Å; F95-W272 HydrophobicContact CD2-CH2 4.19Å; F95-W272 HydrophobicContact CD2-CZ3 4.14Å; F95-W272 HydrophobicContact CE2-CH2 4.03Å; F95-W272 AromaticContact CE2-CZ3 3.84Å; F95-W272 HydrophobicContact CE2-CZ3 3.84Å; F95-Y273 WeakPolarHBondContact CZ-O 3.4Å; F95-F276 HydrophobicContact CE1-CE1 4.42Å; F95-F276 HydrophobicContact CZ-CE1 4.3Å
96L98.9Very high98.8Very high62 Ų6222.3 Ų22.333%0.32511%0.114SC..Hα-helixtrans-69.1-36.2175-62.2172.3000111.9W30 F33 I92 L94 G99 R100W30-L96 HydrophobicContact CZ3-CB 4.48Å; W30-L96 HydrophobicContact CZ3-CD2 4.07Å; F33-L96 HydrophobicContact CD1-CB 4.08Å; F33-L96 HydrophobicContact CD1-CD1 4.38Å; F33-L96 HydrophobicContact CD2-CB 3.91Å; F33-L96 HydrophobicContact CE1-CB 3.93Å; F33-L96 HydrophobicContact CE1-CD1 3.48Å; F33-L96 VanDerWaalsContact CE1-CD1 3.48Å; F33-L96 HydrophobicContact CE1-CG 4.35Å; F33-L96 HydrophobicContact CE2-CB 3.76Å; F33-L96 HydrophobicContact CE2-CD1 4.11Å; F33-L96 HydrophobicContact CG-CB 4.09Å; F33-L96 HydrophobicContact CZ-CB 3.79Å; F33-L96 HydrophobicContact CZ-CD1 3.33Å; F33-L96 HydrophobicContact CZ-CG 4.16Å; I92-L96 HydrophobicContact CG2-CD1 3.82Å; I92-L96 VanDerWaalsContact O-CG 3.25Å; I92-L96 WeakPolarHBondContact O-CG 3.22Å; I92-L96 PolarHBondContact O-N 3.28Å; I92-L96 VanDerWaalsContact O-N 3.07Å; L94-L96 VanDerWaalsContact C-N 3.34Å; L94-L96 PolarHBondContact O-N 2.9Å; L96-G99 PolarHBondContact O-N 2.83Å; L96-R100 WeakPolarHBondContact O-CB 3.46Å; L96-R100 PolarHBondContact O-N 3.41Å
97H98.9Very high98.8Very high37 Ų3722.8 Ų22.817%0.17112%0.116CC..Hα-helixtrans-64.9-42.9174.6-168100.4000112.3F33 G34 L37 C93 L94 R100 G101F33-H97 HydrophobicContact CB-CB 3.92Å; G34-H97 PolarHBondContact N-ND1 3.29Å; L37-H97 HydrophobicContact CD1-CB 3.79Å; C93-H97 WeakPolarHBondContact O-CB 3.37Å; C93-H97 PolarHBondContact O-N 3.17Å; L94-H97 WeakPolarHBondContact O-CB 3.29Å; L94-H97 PolarHBondContact O-N 3.37Å; H97-R100 PolarHBondContact CE1-NH2 3.39Å; H97-R100 PolarHBondContact ND1-NH2 3.42Å; H97-R100 PolarHBondContact NE2-NH2 2.94Å; H97-G101 PolarHBondContact O-N 3.44Å; H97-G101 VanDerWaalsContact O-N 3.09Å
98I98.9Very high98.8Very high29 Ų2925 Ų2515%0.14913%0.125CC..Hα-helixtrans-65.5-47.8174.9-67.2163.5000109.8L94 F95 R100 G101 L102 W113 L120 L301L94-I98 VanDerWaalsContact O-CG1 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.2Å; L94-I98 PolarHBondContact O-N 3.45Å; F95-I98 PolarHBondContact O-N 3.19Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 3.14Å; I98-G101 CarbonylContact O-C 3.59Å; I98-G101 WeakPolarHBondContact O-CA 3.45Å; I98-G101 PolarHBondContact O-N 3.11Å; I98-L102 HydrophobicContact CG2-CD1 4.16Å; I98-L102 HydrophobicContact CG2-CG 4.37Å; I98-L102 WeakPolarHBondContact O-CG 3.49Å; I98-L102 PolarHBondContact O-N 2.96Å; I98-W113 HydrophobicContact CG2-CH2 4.16Å; I98-L120 HydrophobicContact CD1-CD1 4.1Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.44Å; I98-L301 HydrophobicContact CG2-CD1 4.4Å; I98-L301 HydrophobicContact CG2-CD2 4.17Å
99G98.9Very high98.7Very high9 Ų927.2 Ų27.29%0.09313%0.133CC..Hα-helixtrans-57-44.2177.700000112.3F95 L96 G101 L102 Y103 Y325F95-G99 PolarHBondContact O-N 3.21Å; L96-G99 PolarHBondContact O-N 2.83Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G99-G101 PolarHBondContact O-N 3.4Å; G99-L102 PolarHBondContact O-N 2.98Å; G99-Y103 WeakPolarHBondContact O-CB 3.44Å; G99-Y103 PolarHBondContact O-N 3.08Å; G99-Y325 WeakPolarHBondContact O-CE2 3.5Å; G99-Y325 PolarHBondContact O-OH 3.45Å
100R98.9Very high98.6Very high23 Ų2329 Ų299%0.08715%0.148CC..Hα-helixtrans-54.5-48.4169.6178.2-77.2-67.2-97-4.8111W30 W31 L96 H97 I98 L102 Y103 Y104W30-R100 HydrophobicContact CB-CB 4.09Å; W30-R100 HydrophobicContact CB-CG 3.55Å; W31-R100 VanDerWaalsContact CE2-NH1 3.27Å; W31-R100 HydrophobicContact CE3-CG 4.33Å; W31-R100 HydrophobicContact CZ3-CG 4.24Å; L96-R100 WeakPolarHBondContact O-CB 3.46Å; L96-R100 PolarHBondContact O-N 3.41Å; H97-R100 PolarHBondContact CE1-NH2 3.39Å; H97-R100 PolarHBondContact ND1-NH2 3.42Å; H97-R100 PolarHBondContact NE2-NH2 2.94Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 3.14Å; R100-L102 VanDerWaalsContact C-N 3.32Å; R100-L102 PolarHBondContact O-N 2.95Å; R100-Y103 PolarHBondContact O-N 3.32Å; R100-Y104 HydrophobicContact CG-CD2 3.78Å; R100-Y104 HydrophobicContact CG-CE2 4.15Å; R100-Y104 WeakPolarHBondContact O-CD2 3.41Å; R100-Y104 PolarHBondContact O-N 2.86Å
101G98.8Very high98.6Very high2 Ų233.3 Ų33.32%0.02117%0.168CC..Hα-helixtrans-61.5-39.1-179.200000113.1H97 I98 G99 G105 S106 F107H97-G101 PolarHBondContact O-N 3.44Å; H97-G101 VanDerWaalsContact O-N 3.09Å; I98-G101 CarbonylContact O-C 3.59Å; I98-G101 WeakPolarHBondContact O-CA 3.45Å; I98-G101 PolarHBondContact O-N 3.11Å; G99-G101 VanDerWaalsContact C-N 3.31Å; G99-G101 PolarHBondContact O-N 3.4Å; G101-G105 CarbonylContact O-C 3.59Å; G101-G105 PolarHBondContact O-N 2.98Å; G101-S106 PolarHBondContact O-N 3.42Å; G101-F107 WeakPolarHBondContact O-CD1 3.35Å
102L98.8Very high98.6Very high28 Ų2833.9 Ų33.915%0.14717%0.172CC..Hα-helixtrans-67.2-49.6174.4-65.6174.9000111.8I98 G99 R100 G105 F107 W113 L301 I304 Y325I98-L102 HydrophobicContact CG2-CD1 4.16Å; I98-L102 HydrophobicContact CG2-CG 4.37Å; I98-L102 WeakPolarHBondContact O-CG 3.49Å; I98-L102 PolarHBondContact O-N 2.96Å; G99-L102 PolarHBondContact O-N 2.98Å; R100-L102 VanDerWaalsContact C-N 3.32Å; R100-L102 PolarHBondContact O-N 2.95Å; L102-G105 PolarHBondContact O-N 2.95Å; L102-F107 HydrophobicContact CD2-CD1 4.28Å; L102-W113 HydrophobicContact CD2-CH2 3.88Å; L102-W113 HydrophobicContact CD2-CZ2 3.95Å; L102-W113 HydrophobicContact CG-CH2 4.15Å; L102-L301 HydrophobicContact CD2-CD2 4.38Å; L102-I304 HydrophobicContact CD2-CB 4.49Å; L102-I304 HydrophobicContact CD2-CD1 4.26Å; L102-I304 HydrophobicContact CD2-CG1 4.01Å; L102-I304 HydrophobicContact CD2-CG2 3.91Å; L102-Y325 HydrophobicContact CB-CE2 4.24Å
103Y98.9Very high98.6Very high33 Ų3332.2 Ų32.213%0.12916%0.162CC..Hα-helixtrans-66-42.6-175.3-171.5-90.2000112.9G99 R100 M315 Q322 Y325G99-Y103 WeakPolarHBondContact O-CB 3.44Å; G99-Y103 PolarHBondContact O-N 3.08Å; R100-Y103 PolarHBondContact O-N 3.32Å; Y103-M315 HydrophobicContact CD2-CB 4.27Å; Y103-M315 HydrophobicContact CD2-SD 4.31Å; Y103-M315 HydrophobicContact CE1-CB 4.45Å; Y103-M315 HydrophobicContact CE2-CB 4.18Å; Y103-M315 HydrophobicContact CG-CB 4.48Å; Y103-M315 VanDerWaalsContact O-CB 3.29Å; Y103-M315 WeakPolarHBondContact O-CB 3.43Å; Y103-M315 WeakPolarHBondContact O-CG 3.42Å; Y103-M315 PolarHBondContact O-N 3.4Å; Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 VanDerWaalsContact OH-CD 3.24Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.4Å; Y103-Q322 PolarHBondContact OH-OE1 3.04Å; Y103-Y325 AromaticContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.66Å; Y103-Y325 HydrophobicContact CD2-CG 3.66Å; Y103-Y325 HydrophobicContact CE2-CD1 4.04Å; Y103-Y325 HydrophobicContact CE2-CE1 4.47Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å; Y103-Y325 HydrophobicContact CG-CE1 4.49Å
104Y98.8Very high98.6Very high24 Ų2435.7 Ų35.79%0.09418%0.179CC..THydrogen-bonded Turntrans-94.34.5-177.1-63.6-69.3000113.6W30 W31 R100 S106 N206 P208 S314W30-Y104 HydrophobicContact CB-CE2 4.23Å; W30-Y104 AromaticContact CD1-CE2 3.83Å; W30-Y104 HydrophobicContact CG-CE2 4.16Å; W31-Y104 HydrophobicContact CH2-CD1 4.15Å; W31-Y104 AromaticContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CD2 3.59Å; W31-Y104 HydrophobicContact CH2-CE2 4.03Å; W31-Y104 AromaticContact CH2-CG 3.63Å; W31-Y104 HydrophobicContact CH2-CG 3.63Å; W31-Y104 AromaticContact CZ3-CD2 3.65Å; W31-Y104 HydrophobicContact CZ3-CD2 3.65Å; W31-Y104 AromaticContact CZ3-CE2 3.63Å; W31-Y104 HydrophobicContact CZ3-CE2 3.63Å; W31-Y104 HydrophobicContact CZ3-CG 4.12Å; R100-Y104 HydrophobicContact CG-CD2 3.78Å; R100-Y104 HydrophobicContact CG-CE2 4.15Å; R100-Y104 WeakPolarHBondContact O-CD2 3.41Å; R100-Y104 PolarHBondContact O-N 2.86Å; Y104-S106 VanDerWaalsContact C-N 3.33Å; Y104-S106 PolarHBondContact O-N 3.45Å; Y104-N206 PolarHBondContact O-ND2 2.89Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.2Å; Y104-P208 WeakPolarHBondContact CD1-O 3.48Å; Y104-P208 VanDerWaalsContact CE1-CA 3.49Å; Y104-P208 HydrophobicContact CE1-CB 3.66Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.45Å
105G98.6Very high98.6Very high1 Ų135.9 Ų35.91%0.0118%0.18CC..THydrogen-bonded Turntrans66.431.2179.300000113.8G101 L102 F107 L108 Q313G101-G105 CarbonylContact O-C 3.59Å; G101-G105 PolarHBondContact O-N 2.98Å; L102-G105 PolarHBondContact O-N 2.95Å; G105-F107 PolarHBondContact O-N 2.98Å; G105-L108 PolarHBondContact O-N 3.27Å; G105-Q313 PolarHBondContact O-NE2 2.9Å
106S98.6Very high98.6Very high19 Ų1933.9 Ų33.913%0.13318%0.178CC..G310 helixtrans-72.1-16.4176.8-51.50000112.8G101 Y104 L108 Y109G101-S106 PolarHBondContact O-N 3.42Å; Y104-S106 VanDerWaalsContact C-N 3.33Å; Y104-S106 PolarHBondContact O-N 3.45Å; S106-L108 PolarHBondContact O-N 3.31Å; S106-L108 VanDerWaalsContact O-N 3.14Å; S106-Y109 PolarHBondContact O-N 3.21Å; S106-Y109 VanDerWaalsContact O-N 3.11Å
107F98.5Very high98.6Very high10 Ų1031.5 Ų31.54%0.04417%0.165CC..G310 helixtrans-62.1-15173.557.2-107.2000113.6G101 L102 G105 Y109 W113 I304 P305 H308G101-F107 WeakPolarHBondContact O-CD1 3.35Å; L102-F107 HydrophobicContact CD2-CD1 4.28Å; G105-F107 PolarHBondContact O-N 2.98Å; F107-Y109 PolarHBondContact O-N 2.85Å; F107-W113 HydrophobicContact CB-CB 4.45Å; F107-W113 HydrophobicContact CB-CD2 3.36Å; F107-W113 VanDerWaalsContact CB-CE2 3.47Å; F107-W113 HydrophobicContact CB-CE3 3.7Å; F107-W113 HydrophobicContact CB-CG 3.71Å; F107-W113 HydrophobicContact CB-CH2 4.2Å; F107-W113 HydrophobicContact CB-CZ2 3.9Å; F107-W113 HydrophobicContact CB-CZ3 4.11Å; F107-I304 HydrophobicContact CB-CG2 4.3Å; F107-I304 HydrophobicContact CD1-CG2 3.45Å; F107-I304 VanDerWaalsContact CD1-CG2 3.45Å; F107-I304 HydrophobicContact CD2-CG2 3.78Å; F107-I304 HydrophobicContact CE1-CG2 3.53Å; F107-I304 HydrophobicContact CE2-CG2 3.9Å; F107-I304 HydrophobicContact CG-CB 4.49Å; F107-I304 HydrophobicContact CG-CG2 3.56Å; F107-I304 HydrophobicContact CZ-CG2 3.77Å; F107-P305 HydrophobicContact CB-CG 4.29Å; F107-P305 HydrophobicContact CD2-CB 4.29Å; F107-P305 HydrophobicContact CD2-CG 4.19Å; F107-P305 WeakPolarHBondContact O-CG 3.18Å; F107-H308 HydrophobicContact CE2-CB 3.85Å; F107-H308 AromaticContact CE2-CG 3.95Å; F107-H308 AromaticContact CE2-ND1 3.81Å; F107-H308 HydrophobicContact CZ-CB 4.35Å; F107-H308 AromaticContact CZ-ND1 3.62Å
108L98.3Very high98.6Very high66 Ų6633.1 Ų33.135%0.34618%0.175SC..G310 helixtrans-66.8-17.7173.4-65.8-177.5000112.9G105 S106 S110 H308 Q313G105-L108 PolarHBondContact O-N 3.27Å; S106-L108 PolarHBondContact O-N 3.31Å; S106-L108 VanDerWaalsContact O-N 3.14Å; L108-S110 VanDerWaalsContact C-N 3.27Å; L108-S110 PolarHBondContact O-N 2.91Å; L108-S110 VanDerWaalsContact O-N 3.08Å; L108-H308 HydrophobicContact CD2-CB 4.24Å; L108-Q313 HydrophobicContact CD1-CB 4.16Å; L108-Q313 HydrophobicContact CD1-CG 3.74Å
109Y98Very high98.6Very high50 Ų5032.8 Ų32.820%0.19617%0.173CC..SBendtrans-80.680.9165.3-54-43.4000108.7S106 F107 E111 T112 W113 T203 N206S106-Y109 PolarHBondContact O-N 3.21Å; S106-Y109 VanDerWaalsContact O-N 3.11Å; F107-Y109 PolarHBondContact O-N 2.85Å; Y109-E111 PolarHBondContact O-N 2.85Å; Y109-T112 PolarHBondContact O-N 3.17Å; Y109-W113 WeakPolarHBondContact O-CB 3.28Å; Y109-W113 PolarHBondContact O-N 3.36Å; Y109-T203 HydrophobicContact CD1-CG2 4.14Å; Y109-T203 HydrophobicContact CE1-CG2 4.45Å; Y109-N206 HydrophobicContact CE2-CB 3.67Å
110S96.5Very high98.6Very high57 Ų5732.8 Ų32.840%0.39917%0.171SC..Hα-helixtrans-51.5-48.5-167.6320000113.8L108 W113 I114L108-S110 VanDerWaalsContact C-N 3.27Å; L108-S110 PolarHBondContact O-N 2.91Å; L108-S110 VanDerWaalsContact O-N 3.08Å; S110-W113 PolarHBondContact O-N 3.17Å; S110-I114 WeakPolarHBondContact O-CB 3.47Å; S110-I114 VanDerWaalsContact O-CG1 3.29Å; S110-I114 WeakPolarHBondContact O-CG1 3.46Å; S110-I114 PolarHBondContact O-N 3.21Å
111E98.1Very high98.6Very high106 Ų10634.6 Ų34.650%0.49518%0.182SC..Hα-helixtrans-66.3-49.5-175.8-66.283.216500110.1Y109 W113 I114 I115 F199Y109-E111 PolarHBondContact O-N 2.85Å; E111-W113 VanDerWaalsContact C-N 3.29Å; E111-W113 PolarHBondContact O-N 3.44Å; E111-I114 PolarHBondContact O-N 3.4Å; E111-I115 WeakPolarHBondContact O-CG1 3.48Å; E111-I115 PolarHBondContact O-N 3.27Å; E111-F199 HydrophobicContact CB-CB 4.09Å; E111-F199 HydrophobicContact CB-CD1 3.62Å; E111-F199 HydrophobicContact CB-CD2 4.04Å; E111-F199 HydrophobicContact CB-CE1 3.98Å; E111-F199 HydrophobicContact CB-CE2 4.35Å; E111-F199 HydrophobicContact CB-CG 3.66Å; E111-F199 HydrophobicContact CB-CZ 4.32Å; E111-F199 HydrophobicContact CG-CD1 4.08Å; E111-F199 HydrophobicContact CG-CE1 4.06Å
112T98.6Very high98.6Very high13 Ų1335.1 Ų35.18%0.0819%0.186CC..Hα-helixtrans-57.2-44.2174.1-54.80000110.8Y109 G116 H196 F199 L200Y109-T112 PolarHBondContact O-N 3.17Å; T112-G116 PolarHBondContact O-N 3.31Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.34Å; T112-H196 PolarHBondContact O-CE1 3.01Å; T112-H196 PolarHBondContact O-ND1 3.12Å; T112-F199 WeakPolarHBondContact OG1-CB 3.49Å; T112-L200 HydrophobicContact CG2-CB 4.22Å; T112-L200 PolarHBondContact OG1-N 3.34Å
113W98.8Very high98.6Very high25 Ų2534.1 Ų34.110%0.09518%0.181CC..Hα-helixtrans-65.4-47.6-179.6-173.5-110.1000112.9I98 L102 F107 Y109 S110 E111 G116 I117 L301I98-W113 HydrophobicContact CG2-CH2 4.16Å; L102-W113 HydrophobicContact CD2-CH2 3.88Å; L102-W113 HydrophobicContact CD2-CZ2 3.95Å; L102-W113 HydrophobicContact CG-CH2 4.15Å; F107-W113 HydrophobicContact CB-CB 4.45Å; F107-W113 HydrophobicContact CB-CD2 3.36Å; F107-W113 VanDerWaalsContact CB-CE2 3.47Å; F107-W113 HydrophobicContact CB-CE3 3.7Å; F107-W113 HydrophobicContact CB-CG 3.71Å; F107-W113 HydrophobicContact CB-CH2 4.2Å; F107-W113 HydrophobicContact CB-CZ2 3.9Å; F107-W113 HydrophobicContact CB-CZ3 4.11Å; Y109-W113 WeakPolarHBondContact O-CB 3.28Å; Y109-W113 PolarHBondContact O-N 3.36Å; S110-W113 PolarHBondContact O-N 3.17Å; E111-W113 VanDerWaalsContact C-N 3.29Å; E111-W113 PolarHBondContact O-N 3.44Å; W113-G116 CarbonylContact O-C 3.56Å; W113-G116 WeakPolarHBondContact O-CA 3.47Å; W113-G116 PolarHBondContact O-N 3.3Å; W113-I117 WeakPolarHBondContact O-CG1 3.36Å; W113-I117 PolarHBondContact O-N 2.65Å; W113-L301 HydrophobicContact CZ2-CB 4.25Å; W113-L301 HydrophobicContact CZ2-CD2 4.07Å; W113-L301 PolarHBondContact NE1-O 3.08Å
114I98.6Very high98.6Very high76 Ų7633.5 Ų33.539%0.3918%0.179SC..Hα-helixtrans-63-44.3178.3-67.6-58.4000110.9S110 E111 G116 I117 I118 A302S110-I114 WeakPolarHBondContact O-CB 3.47Å; S110-I114 VanDerWaalsContact O-CG1 3.29Å; S110-I114 WeakPolarHBondContact O-CG1 3.46Å; S110-I114 PolarHBondContact O-N 3.21Å; E111-I114 PolarHBondContact O-N 3.4Å; I114-G116 PolarHBondContact O-N 2.9Å; I114-I117 HydrophobicContact CD1-CD1 4.17Å; I114-I117 PolarHBondContact O-N 3.37Å; I114-I117 VanDerWaalsContact O-N 3.12Å; I114-I118 HydrophobicContact CG2-CD1 4.31Å; I114-I118 WeakPolarHBondContact O-CG1 3.45Å; I114-I118 PolarHBondContact O-N 3.28Å; I114-A302 HydrophobicContact CD1-CB 4.25Å
115I98.8Very high98.5Very high19 Ų1934.2 Ų34.210%0.09719%0.191CC..Hα-helixtrans-61.6-35.9172.8-62.3-57.7000110.7E111 I117 I118 L119 L195 H196 F199E111-I115 WeakPolarHBondContact O-CG1 3.48Å; E111-I115 PolarHBondContact O-N 3.27Å; I115-I117 VanDerWaalsContact C-N 3.35Å; I115-I117 PolarHBondContact O-N 2.94Å; I115-I118 HydrophobicContact CD1-CD1 4.2Å; I115-I118 PolarHBondContact O-N 2.75Å; I115-L119 HydrophobicContact CG2-CD1 4.21Å; I115-L119 HydrophobicContact CG2-CG 4.44Å; I115-L119 WeakPolarHBondContact O-CB 3.42Å; I115-L119 WeakPolarHBondContact O-CG 2.99Å; I115-L119 PolarHBondContact O-N 3.35Å; I115-L195 HydrophobicContact CD1-CD2 3.81Å; I115-L195 HydrophobicContact CD1-CG 4.39Å; I115-L195 HydrophobicContact CG1-CD2 4.38Å; I115-L195 HydrophobicContact CG1-CG 4.44Å; I115-H196 HydrophobicContact CB-CB 4.47Å; I115-H196 HydrophobicContact CG2-CB 3.68Å; I115-F199 HydrophobicContact CG1-CD2 3.98Å; I115-F199 HydrophobicContact CG1-CE2 4.03Å
116G98.8Very high98.6Very high23 Ų2334.8 Ų34.824%0.23719%0.194CC..Hα-helixtrans-59.5-40.4172.800000113.4T112 W113 I114 L119 L120 H196T112-G116 PolarHBondContact O-N 3.31Å; W113-G116 CarbonylContact O-C 3.56Å; W113-G116 WeakPolarHBondContact O-CA 3.47Å; W113-G116 PolarHBondContact O-N 3.3Å; I114-G116 PolarHBondContact O-N 2.9Å; G116-L119 WeakPolarHBondContact O-CB 3.4Å; G116-L119 PolarHBondContact O-N 3.17Å; G116-L120 PolarHBondContact O-N 3.12Å; G116-H196 PolarHBondContact N-ND1 3.45Å
117I98.8Very high98.6Very high11 Ų1134.6 Ų34.66%0.05619%0.193CC..Hα-helixtrans-66.4-41.3174.5-62.3169.9000110.7W113 I114 I115 L119 L120 L121 L301 A302W113-I117 WeakPolarHBondContact O-CG1 3.36Å; W113-I117 PolarHBondContact O-N 2.65Å; I114-I117 HydrophobicContact CD1-CD1 4.17Å; I114-I117 PolarHBondContact O-N 3.37Å; I114-I117 VanDerWaalsContact O-N 3.12Å; I115-I117 VanDerWaalsContact C-N 3.35Å; I115-I117 PolarHBondContact O-N 2.94Å; I117-L119 VanDerWaalsContact C-N 3.34Å; I117-L119 PolarHBondContact O-N 2.91Å; I117-L120 WeakPolarHBondContact O-CB 3.46Å; I117-L120 PolarHBondContact O-N 2.96Å; I117-L121 HydrophobicContact CG2-CD1 4.25Å; I117-L121 WeakPolarHBondContact O-CG 3.36Å; I117-L121 PolarHBondContact O-N 2.89Å; I117-L301 HydrophobicContact CD1-CB 3.76Å; I117-L301 HydrophobicContact CG1-CB 3.96Å; I117-A302 HydrophobicContact CD1-CB 3.88Å
118I98.9Very high98.6Very high72 Ų7236 Ų3637%0.36920%0.199SC..Hα-helixtrans-63.6-41.7176.1-63170.6000110.5I114 I115 L120 L121 A122 L192I114-I118 HydrophobicContact CG2-CD1 4.31Å; I114-I118 WeakPolarHBondContact O-CG1 3.45Å; I114-I118 PolarHBondContact O-N 3.28Å; I115-I118 HydrophobicContact CD1-CD1 4.2Å; I115-I118 PolarHBondContact O-N 2.75Å; I118-L120 PolarHBondContact O-N 3.21Å; I118-L121 PolarHBondContact O-N 2.92Å; I118-A122 WeakPolarHBondContact O-CB 3.24Å; I118-A122 PolarHBondContact O-N 3.38Å; I118-L192 HydrophobicContact CG2-CD1 3.88Å; I118-L192 HydrophobicContact CG2-CD2 4.27Å
119L98.9Very high98.6Very high21 Ų2133.7 Ų33.711%0.1119%0.187CC..Hα-helixtrans-60.2-43173.8-80.5167.4000112.1I115 G116 I117 A122 T123 I189 L192 A193 H196I115-L119 HydrophobicContact CG2-CD1 4.21Å; I115-L119 HydrophobicContact CG2-CG 4.44Å; I115-L119 WeakPolarHBondContact O-CB 3.42Å; I115-L119 WeakPolarHBondContact O-CG 2.99Å; I115-L119 PolarHBondContact O-N 3.35Å; G116-L119 WeakPolarHBondContact O-CB 3.4Å; G116-L119 PolarHBondContact O-N 3.17Å; I117-L119 VanDerWaalsContact C-N 3.34Å; I117-L119 PolarHBondContact O-N 2.91Å; L119-A122 PolarHBondContact O-N 3.38Å; L119-T123 WeakPolarHBondContact O-CB 3.36Å; L119-T123 PolarHBondContact O-N 3.4Å; L119-T123 PolarHBondContact O-OG1 3.29Å; L119-I189 HydrophobicContact CD2-CG2 3.82Å; L119-L192 HydrophobicContact CD2-CB 3.54Å; L119-L192 HydrophobicContact CG-CB 4.05Å; L119-A193 HydrophobicContact CD2-CB 4.37Å; L119-H196 HydrophobicContact CD1-CB 3.79Å
120L98.9Very high98.6Very high9 Ų932.1 Ų32.15%0.04719%0.186CC..Hα-helixtrans-58.9-51.8174.8173.864000110.8L94 I98 G116 I117 I118 A122 T123 M124 I298 L301L94-L120 HydrophobicContact CD1-CD1 4.39Å; I98-L120 HydrophobicContact CD1-CD1 4.1Å; I98-L120 HydrophobicContact CD1-CD2 3.85Å; I98-L120 HydrophobicContact CD1-CG 4.44Å; G116-L120 PolarHBondContact O-N 3.12Å; I117-L120 WeakPolarHBondContact O-CB 3.46Å; I117-L120 PolarHBondContact O-N 2.96Å; I118-L120 PolarHBondContact O-N 3.21Å; L120-A122 PolarHBondContact O-N 2.83Å; L120-T123 PolarHBondContact O-N 2.83Å; L120-M124 HydrophobicContact CD1-CG 4.15Å; L120-M124 HydrophobicContact CD1-SD 3.95Å; L120-M124 HydrophobicContact CG-CG 4.48Å; L120-M124 HydrophobicContact CG-SD 3.9Å; L120-M124 WeakPolarHBondContact O-CB 3.34Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.18Å; L120-M124 PolarHBondContact O-N 3.48Å; L120-I298 HydrophobicContact CD2-CG2 3.92Å; L120-L301 HydrophobicContact CD2-CD1 3.79Å
121L98.8Very high98.7Very high61 Ų6131.2 Ų31.232%0.31917%0.174SC..Hα-helixtrans-61.6-42.6-179.9-70.7170.3000112.3I117 I118 M124 A125 I298 L299I117-L121 HydrophobicContact CG2-CD1 4.25Å; I117-L121 WeakPolarHBondContact O-CG 3.36Å; I117-L121 PolarHBondContact O-N 2.89Å; I118-L121 PolarHBondContact O-N 2.92Å; L121-M124 PolarHBondContact O-N 2.77Å; L121-A125 WeakPolarHBondContact O-CB 3.28Å; L121-A125 PolarHBondContact O-N 3.06Å; L121-I298 HydrophobicContact CD2-CD1 4.45Å; L121-I298 HydrophobicContact CD2-CG2 3.8Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; L121-L299 HydrophobicContact CD1-CD2 4.18Å
122A98.9Very high98.8Very high14 Ų1426.3 Ų26.312%0.11615%0.151CC..Hα-helixtrans-64-40.6176.400000111.8I118 L119 L120 A125 T126 I189 L192I118-A122 WeakPolarHBondContact O-CB 3.24Å; I118-A122 PolarHBondContact O-N 3.38Å; L119-A122 PolarHBondContact O-N 3.38Å; L120-A122 PolarHBondContact O-N 2.83Å; A122-A125 PolarHBondContact O-N 3Å; A122-T126 WeakPolarHBondContact O-CB 3.33Å; A122-T126 PolarHBondContact O-N 3.44Å; A122-T126 PolarHBondContact O-OG1 3.26Å; A122-I189 HydrophobicContact CB-CD1 4.17Å; A122-I189 HydrophobicContact CB-CG1 3.73Å; A122-L192 HydrophobicContact CB-CD1 4.5Å
123T98.9Very high98.8Very high6 Ų626.4 Ų26.44%0.03715%0.151CC..Hα-helixtrans-68.2-40.1177.4-52.20000111.4F90 F91 L94 L119 L120 T126 A127F90-T123 HydrophobicContact CD2-CG2 3.96Å; F90-T123 HydrophobicContact CE2-CG2 3.78Å; F90-T123 HydrophobicContact CG-CG2 4.49Å; F90-T123 HydrophobicContact CZ-CG2 4.18Å; F91-T123 HydrophobicContact CE2-CG2 4.38Å; F91-T123 HydrophobicContact CZ-CG2 4.14Å; L94-T123 HydrophobicContact CD1-CG2 3.74Å; L119-T123 WeakPolarHBondContact O-CB 3.36Å; L119-T123 PolarHBondContact O-N 3.4Å; L119-T123 PolarHBondContact O-OG1 3.29Å; L120-T123 PolarHBondContact O-N 2.83Å; T123-T126 PolarHBondContact O-N 3.09Å; T123-A127 WeakPolarHBondContact O-CB 3.26Å; T123-A127 PolarHBondContact O-N 2.9Å
124M98.8Very high98.7Very high20 Ų2026.6 Ų26.610%0.09916%0.155CC..Hα-helixtrans-59-49.2172.3-73177.485.500111.8F91 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 4.15Å; L120-M124 HydrophobicContact CD1-SD 3.95Å; L120-M124 HydrophobicContact CG-CG 4.48Å; L120-M124 HydrophobicContact CG-SD 3.9Å; L120-M124 WeakPolarHBondContact O-CB 3.34Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.18Å; L120-M124 PolarHBondContact O-N 3.48Å; L121-M124 PolarHBondContact O-N 2.77Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 2.56Å; M124-A127 PolarHBondContact O-N 2.74Å; M124-F128 WeakPolarHBondContact O-CB 3.46Å; M124-F128 PolarHBondContact O-N 2.94Å; M124-F274 HydrophobicContact CB-CE1 3.83Å; M124-F274 HydrophobicContact CB-CZ 4.26Å; M124-F274 HydrophobicContact CE-CD1 3.64Å; M124-F274 HydrophobicContact CE-CE1 3.5Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.33Å; M124-I298 HydrophobicContact CE-CD1 3.43Å; M124-I298 VanDerWaalsContact CE-CD1 3.43Å; M124-I298 HydrophobicContact CE-CG1 4.19Å; M124-I298 HydrophobicContact SD-CD1 3.85Å; M124-I298 HydrophobicContact SD-CG1 4.45Å; M124-I298 HydrophobicContact SD-CG2 4.47Å
125A98.7Very high98.7Very high40 Ų4023.6 Ų23.633%0.33114%0.139SC..Hα-helixtrans-59.5-45.5175.900000111.7L121 A122 F128 M129 L185L121-A125 WeakPolarHBondContact O-CB 3.28Å; L121-A125 PolarHBondContact O-N 3.06Å; A122-A125 PolarHBondContact O-N 3Å; A125-F128 PolarHBondContact O-N 3.11Å; A125-M129 HydrophobicContact CB-CE 4.1Å; A125-M129 WeakPolarHBondContact O-CE 3.24Å; A125-M129 PolarHBondContact O-N 3.01Å; A125-L185 HydrophobicContact CB-CD1 4.34Å
126T98.9Very high98.7Very high13 Ų1322.7 Ų22.78%0.0814%0.135CC..Hα-helixtrans-59.7-49.1179.1-570000111.5A122 T123 M124 M129 G130 H182 L185 P186 I189A122-T126 WeakPolarHBondContact O-CB 3.33Å; A122-T126 PolarHBondContact O-N 3.44Å; A122-T126 PolarHBondContact O-OG1 3.26Å; T123-T126 PolarHBondContact O-N 3.09Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 2.56Å; T126-M129 PolarHBondContact O-N 3.19Å; T126-G130 PolarHBondContact O-N 3.44Å; T126-H182 PolarHBondContact O-CE1 3.14Å; T126-H182 PolarHBondContact O-ND1 3.23Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 VanDerWaalsContact OG1-CB 3.23Å; T126-L185 WeakPolarHBondContact OG1-CB 3.27Å; T126-P186 HydrophobicContact CG2-CG 3.89Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.43Å
127A98.8Very high98.7Very high14 Ų1422 Ų2212%0.11613%0.125CC..Hα-helixtrans-67.3-41-178.800000112.6F91 T123 M124 G130 Y131 Y273F91-A127 HydrophobicContact CE2-CB 3.48Å; F91-A127 VanDerWaalsContact CE2-CB 3.48Å; F91-A127 HydrophobicContact CZ-CB 3.86Å; T123-A127 WeakPolarHBondContact O-CB 3.26Å; T123-A127 PolarHBondContact O-N 2.9Å; M124-A127 PolarHBondContact O-N 2.74Å; A127-G130 PolarHBondContact O-N 3.04Å; A127-Y131 WeakPolarHBondContact O-CB 3.26Å; A127-Y131 PolarHBondContact O-N 3.22Å; A127-Y273 HydrophobicContact CB-CE2 3.95Å
128F98.7Very high98.6Very high40 Ų4021.6 Ų21.618%0.17512%0.123CC..Hα-helixtrans-56.9-51.7174.2170.3-104.6000111.3M124 A125 G130 Y131 V132 I146 T147 F178 F274M124-F128 WeakPolarHBondContact O-CB 3.46Å; M124-F128 PolarHBondContact O-N 2.94Å; A125-F128 PolarHBondContact O-N 3.11Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 3.11Å; F128-Y131 PolarHBondContact O-N 3.37Å; F128-V132 WeakPolarHBondContact O-CG2 3.32Å; F128-V132 PolarHBondContact O-N 3.41Å; F128-I146 HydrophobicContact CD2-CG2 4.39Å; F128-I146 HydrophobicContact CE2-CB 3.73Å; F128-I146 HydrophobicContact CE2-CG1 4.05Å; F128-I146 HydrophobicContact CE2-CG2 3.73Å; F128-I146 HydrophobicContact CZ-CB 3.92Å; F128-I146 HydrophobicContact CZ-CG2 3.84Å; F128-T147 HydrophobicContact CE1-CG2 4.24Å; F128-T147 HydrophobicContact CZ-CG2 4.15Å; F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.22Å; F128-F274 HydrophobicContact CB-CE2 4.28Å; F128-F274 HydrophobicContact CB-CZ 4.18Å
129M98.6Very high98.5Very high18 Ų1818.2 Ų18.29%0.08911%0.106CC..Hα-helixtrans-65.6-37.4179.2-72.2179.9-78.600112.5A125 T126 Y131 V132 L133 F178 F181 H182 L185A125-M129 HydrophobicContact CB-CE 4.1Å; A125-M129 WeakPolarHBondContact O-CE 3.24Å; A125-M129 PolarHBondContact O-N 3.01Å; T126-M129 PolarHBondContact O-N 3.19Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.12Å; M129-V132 WeakPolarHBondContact O-CB 3.4Å; M129-V132 PolarHBondContact O-N 2.84Å; M129-V132 VanDerWaalsContact O-N 3.11Å; M129-L133 WeakPolarHBondContact O-CG 3.41Å; M129-F178 HydrophobicContact CB-CB 4.28Å; M129-F178 HydrophobicContact CB-CD2 4.38Å; M129-F178 HydrophobicContact CB-CG 4.35Å; M129-F178 HydrophobicContact CG-CB 4.3Å; M129-F178 HydrophobicContact CG-CD1 4.16Å; M129-F178 HydrophobicContact CG-CD2 3.97Å; M129-F178 HydrophobicContact CG-CE2 4.32Å; M129-F178 HydrophobicContact CG-CG 3.89Å; M129-F178 HydrophobicContact SD-CD1 4.16Å; M129-F178 HydrophobicContact SD-CG 4.36Å; M129-F181 HydrophobicContact CE-CB 3.97Å; M129-F181 HydrophobicContact SD-CB 3.46Å; M129-F181 WeakPolarHBondContact SD-CB 3.44Å; M129-F181 HydrophobicContact SD-CG 4.33Å; M129-H182 HydrophobicContact CB-CB 4.09Å; M129-L185 HydrophobicContact CE-CD1 3.23Å
130G98.6Very high98.5Very high16 Ų1617.8 Ų17.817%0.16510%0.103CC..Hα-helixtrans-60.3-39.1174.900000112.5T126 A127 F128 V132 L133 P134 H182T126-G130 PolarHBondContact O-N 3.44Å; A127-G130 PolarHBondContact O-N 3.04Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 3.11Å; G130-V132 PolarHBondContact O-N 2.93Å; G130-L133 WeakPolarHBondContact O-CB 3.49Å; G130-L133 WeakPolarHBondContact O-CG 3.32Å; G130-L133 PolarHBondContact O-N 3.03Å; G130-P134 WeakPolarHBondContact O-CD 3.5Å; G130-H182 WeakPolarHBondContact CA-CE1 3.39Å; G130-H182 VanDerWaalsContact CA-ND1 3.27Å; G130-H182 WeakPolarHBondContact CA-ND1 3.35Å; G130-H182 PolarHBondContact N-ND1 3.07Å
131Y98.6Very high98.4Very high39 Ų3919 Ų1915%0.15311%0.107CC..Hα-helixtrans-68.5-18.2177.2-168.8-105000113.6A127 F128 M129 P134 M138 S139 E271A127-Y131 WeakPolarHBondContact O-CB 3.26Å; A127-Y131 PolarHBondContact O-N 3.22Å; F128-Y131 PolarHBondContact O-N 3.37Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.12Å; Y131-P134 WeakPolarHBondContact O-CD 3.26Å; Y131-M138 HydrophobicContact CE1-CB 4.15Å; Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.31Å; Y131-S139 PolarHBondContact O-OG 3.35Å; Y131-E271 HydrophobicContact CD1-CG 4.21Å; Y131-E271 HydrophobicContact CD2-CG 3.44Å; Y131-E271 VanDerWaalsContact CD2-CG 3.44Å; Y131-E271 HydrophobicContact CE1-CG 4.16Å; Y131-E271 HydrophobicContact CE2-CG 3.37Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.46Å; Y131-E271 HydrophobicContact CG-CG 3.85Å; Y131-E271 PolarHBondContact OH-OE1 3.03Å
132V98.6Very high98.3Very high2 Ų216.5 Ų16.51%0.01210%0.096CC..Hα-helixtrans-79.3-27.8174.8-1780000111.8F128 M129 G130 P134 W135 A143 L175 F178F128-V132 WeakPolarHBondContact O-CG2 3.32Å; F128-V132 PolarHBondContact O-N 3.41Å; M129-V132 WeakPolarHBondContact O-CB 3.4Å; M129-V132 PolarHBondContact O-N 2.84Å; M129-V132 VanDerWaalsContact O-N 3.11Å; G130-V132 PolarHBondContact O-N 2.93Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; V132-W135 HydrophobicContact CG1-CE3 4.16Å; V132-W135 HydrophobicContact CG1-CZ3 3.95Å; V132-W135 PolarHBondContact O-N 3.37Å; V132-A143 HydrophobicContact CG1-CB 4.05Å; V132-A143 HydrophobicContact CG2-CB 3.75Å; V132-L175 HydrophobicContact CG1-CD1 4.39Å; V132-F178 HydrophobicContact CB-CD2 3.92Å; V132-F178 HydrophobicContact CG1-CD2 3.96Å; V132-F178 HydrophobicContact CG2-CD2 3.87Å; V132-F178 HydrophobicContact CG2-CE2 4.03Å
133L98.8Very high98.2Very high16 Ų1615.9 Ų15.98%0.0849%0.091CC..THydrogen-bonded Turntrans-60.2-34.4-172.2-53.6-175000115.1Y55 M129 G130 W135 L175 F178 F179 H182Y55-L133 HydrophobicContact CE1-CB 4.45Å; Y55-L133 HydrophobicContact CE2-CB 4.43Å; Y55-L133 WeakPolarHBondContact CE2-O 3.44Å; Y55-L133 PolarHBondContact OH-O 2.85Å; M129-L133 WeakPolarHBondContact O-CG 3.41Å; G130-L133 WeakPolarHBondContact O-CB 3.49Å; G130-L133 WeakPolarHBondContact O-CG 3.32Å; G130-L133 PolarHBondContact O-N 3.03Å; L133-W135 PolarHBondContact O-N 3.29Å; L133-W135 VanDerWaalsContact O-N 3.14Å; L133-L175 HydrophobicContact CD2-CD1 4Å; L133-F178 HydrophobicContact CD2-CB 4.5Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L133-H182 HydrophobicContact CD1-CB 4.31Å
134P98.4Very high98.1Very high28 Ų2817 Ų1718%0.18210%0.098CC..THydrogen-bonded Turntrans-62.4-18.9175.2-25.836.1000115.2F63 G130 Y131 V132 G136F63-P134 WeakPolarHBondContact CA-O 3.37Å; F63-P134 WeakPolarHBondContact CD2-O 3.5Å; G130-P134 WeakPolarHBondContact O-CD 3.5Å; Y131-P134 WeakPolarHBondContact O-CD 3.26Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; P134-G136 PolarHBondContact O-N 3.3Å
135W98.4Very high98Very high13 Ų1318.7 Ų18.75%0.04911%0.109CC..  trans55.935.3178-150.5-111.4000114.3A59 A62 F63 V132 L133 F140 V170 L175 A259A59-W135 HydrophobicContact CB-CZ2 3.75Å; A62-W135 HydrophobicContact CB-CB 3.84Å; A62-W135 HydrophobicContact CB-CG 4.36Å; F63-W135 HydrophobicContact CB-CB 4.46Å; V132-W135 HydrophobicContact CG1-CE3 4.16Å; V132-W135 HydrophobicContact CG1-CZ3 3.95Å; V132-W135 PolarHBondContact O-N 3.37Å; L133-W135 PolarHBondContact O-N 3.29Å; L133-W135 VanDerWaalsContact O-N 3.14Å; W135-F140 HydrophobicContact CH2-CD2 4.11Å; W135-F140 AromaticContact CZ2-CD2 3.95Å; W135-F140 HydrophobicContact CZ2-CD2 3.95Å; W135-F140 HydrophobicContact CZ2-CE2 4.35Å; W135-V170 HydrophobicContact CH2-CG1 3.71Å; W135-V170 HydrophobicContact CZ3-CG1 4.05Å; W135-L175 HydrophobicContact CD2-CD2 3.83Å; W135-L175 HydrophobicContact CE3-CB 4.26Å; W135-L175 HydrophobicContact CE3-CD1 3.64Å; W135-L175 HydrophobicContact CE3-CD2 3.68Å; W135-L175 HydrophobicContact CE3-CG 4.06Å; W135-L175 HydrophobicContact CG-CD2 4.26Å; W135-L175 HydrophobicContact CH2-CB 4.12Å; W135-L175 HydrophobicContact CZ3-CB 3.79Å; W135-L175 HydrophobicContact CZ3-CD1 3.84Å; W135-L175 HydrophobicContact CZ3-CD2 4.04Å; W135-L175 HydrophobicContact CZ3-CG 4.11Å; W135-A259 HydrophobicContact CG-CB 4.44Å; W135-A259 WeakPolarHBondContact O-CB 3.24Å; W135-A259 PolarHBondContact O-N 3.47Å; W135-A259 VanDerWaalsContact O-N 3.12Å
136G98.2Very high97.9Very high0 Ų019.1 Ų19.10%011%0.106CC..BIsolated β-bridgetrans-85.4-179.316900000112.7P134 M138 S139 F140 N255 T257P134-G136 PolarHBondContact O-N 3.3Å; G136-M138 PolarHBondContact O-N 3.28Å; G136-S139 WeakPolarHBondContact O-CB 3.29Å; G136-S139 PolarHBondContact O-N 3.39Å; G136-F140 PolarHBondContact O-N 3.49Å; G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.31Å; G136-T257 CarbonylContact C-O 3.54Å; G136-T257 WeakPolarHBondContact CA-O 3.33Å
137Q97.9Very high97.8Very high10 Ų1019 Ų195%0.04711%0.105CC..Hα-helixtrans-59.4-48.6-178.7-73.6-78.659.300112.8F140 W141 D254 T257 N263 P265Q137-F140 PolarHBondContact O-N 3.44Å; Q137-W141 WeakPolarHBondContact O-CB 3.41Å; Q137-W141 PolarHBondContact O-N 3.27Å; Q137-D254 HydrophobicContact CB-CB 4.44Å; Q137-D254 WeakPolarHBondContact CB-O 3.47Å; Q137-T257 HydrophobicContact CG-CG2 4.04Å; Q137-T257 PolarHBondContact N-O 2.73Å; Q137-N263 PolarHBondContact NE2-O 2.91Å; Q137-P265 HydrophobicContact CB-CG 3.89Å
138M97.1Very high97.7Very high2 Ų221.3 Ų21.31%0.0112%0.115CC..Hα-helixtrans-68.2-36.5179.5-70.6-63164.100112.1Y131 G136 G142 D252 D254 N255 P265Y131-M138 HydrophobicContact CE1-CB 4.15Å; G136-M138 PolarHBondContact O-N 3.28Å; M138-G142 WeakPolarHBondContact O-CA 3.42Å; M138-G142 PolarHBondContact O-N 3.2Å; M138-D252 HydrophobicContact CG-CB 4.09Å; M138-D254 HydrophobicContact CE-CB 3.53Å; M138-D254 WeakPolarHBondContact CE-OD2 3.49Å; M138-D254 HydrophobicContact CG-CB 3.81Å; M138-N255 HydrophobicContact CB-CB 4.17Å; M138-N255 PolarHBondContact N-OD1 3.28Å; M138-P265 HydrophobicContact CE-CB 3.5Å; M138-P265 VanDerWaalsContact CE-CB 3.5Å; M138-P265 HydrophobicContact CE-CG 4.01Å
139S97.3Very high97.6Very high0 Ų020.4 Ų20.40%011%0.112CC..Hα-helixtrans-55.6-54.4172.3-66.20000111.9Y131 G136 A143 N255Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.31Å; Y131-S139 PolarHBondContact O-OG 3.35Å; G136-S139 WeakPolarHBondContact O-CB 3.29Å; G136-S139 PolarHBondContact O-N 3.39Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.34Å; S139-A143 PolarHBondContact O-N 2.99Å; S139-N255 PolarHBondContact N-OD1 3.06Å; S139-N255 PolarHBondContact OG-ND2 3.44Å; S139-N255 PolarHBondContact OG-OD1 3.24Å
140F98Very high97.4Very high12 Ų1222.1 Ų22.15%0.05312%0.121CC..Hα-helixtrans-68.4-49.5-175.5175.6-90.9000112.6W135 G136 Q137 A143 T144 V170 A259 P261W135-F140 HydrophobicContact CH2-CD2 4.11Å; W135-F140 AromaticContact CZ2-CD2 3.95Å; W135-F140 HydrophobicContact CZ2-CD2 3.95Å; W135-F140 HydrophobicContact CZ2-CE2 4.35Å; G136-F140 PolarHBondContact O-N 3.49Å; Q137-F140 PolarHBondContact O-N 3.44Å; F140-A143 PolarHBondContact O-N 3.23Å; F140-T144 WeakPolarHBondContact O-CB 3.25Å; F140-T144 PolarHBondContact O-N 3.1Å; F140-T144 PolarHBondContact O-OG1 3.07Å; 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 3.28Å; F140-V170 WeakPolarHBondContact CE2-O 3.42Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.27Å; F140-A259 HydrophobicContact CG-CB 3.94Å; F140-P261 HydrophobicContact CE1-CB 4.1Å; F140-P261 HydrophobicContact CE1-CG 4.25Å; F140-P261 HydrophobicContact CE2-CG 4.22Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.78Å
141W98.3Very high97.3Very high34 Ų3422.9 Ų22.913%0.12912%0.124CC..Hα-helixtrans-72.2-35.6-177.7-73.9106.2000112Q137 T144 V145 N260 P261 N263 T264 P265 I268Q137-W141 WeakPolarHBondContact O-CB 3.41Å; Q137-W141 PolarHBondContact O-N 3.27Å; W141-T144 PolarHBondContact O-N 3.28Å; W141-V145 WeakPolarHBondContact O-CB 3.49Å; W141-V145 WeakPolarHBondContact O-CG2 3.44Å; W141-V145 PolarHBondContact O-N 3.26Å; W141-N260 PolarHBondContact NE1-O 2.98Å; W141-P261 WeakPolarHBondContact CH2-O 3.39Å; W141-P261 WeakPolarHBondContact CZ2-O 3.34Å; W141-N263 PolarHBondContact NE1-O 3.46Å; W141-N263 VanDerWaalsContact NE1-O 3.08Å; W141-T264 HydrophobicContact CD2-CG2 4.21Å; W141-T264 HydrophobicContact CE3-CG2 4.21Å; W141-T264 HydrophobicContact CH2-CG2 4.5Å; W141-T264 VanDerWaalsContact CH2-OG1 3.27Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.46Å; W141-T264 HydrophobicContact CZ2-CG2 4.49Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.36Å; W141-T264 HydrophobicContact CZ3-CG2 4.37Å; W141-P265 HydrophobicContact CG-CG 4.39Å; W141-I268 HydrophobicContact CB-CD1 3.71Å; W141-I268 HydrophobicContact CB-CG1 3.89Å; W141-I268 HydrophobicContact CB-CG2 4.12Å; W141-I268 HydrophobicContact CD2-CD1 4.26Å; W141-I268 HydrophobicContact CE3-CD1 4.19Å; W141-I268 HydrophobicContact CG-CD1 4.1Å; W141-I268 HydrophobicContact CG-CG1 4.49Å
142G95.9Very high97.2Very high9 Ų921.9 Ų21.99%0.09312%0.124CC..Hα-helixtrans-59.4-47.8170.100000111.6M138 T144 V145 I146M138-G142 WeakPolarHBondContact O-CA 3.42Å; M138-G142 PolarHBondContact O-N 3.2Å; G142-T144 PolarHBondContact O-N 3.1Å; G142-V145 PolarHBondContact O-N 3.43Å; G142-I146 WeakPolarHBondContact O-CB 3.48Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.49Å; G142-I146 PolarHBondContact O-N 3.11Å
143A96.9Very high97.1Very high1 Ų124.6 Ų24.61%0.00814%0.137CC..Hα-helixtrans-57.5-48.6175.200000111.6V132 S139 F140 T147 V170V132-A143 HydrophobicContact CG1-CB 4.05Å; V132-A143 HydrophobicContact CG2-CB 3.75Å; S139-A143 VanDerWaalsContact O-CB 3.31Å; S139-A143 WeakPolarHBondContact O-CB 3.34Å; S139-A143 PolarHBondContact O-N 2.99Å; F140-A143 PolarHBondContact O-N 3.23Å; A143-T147 WeakPolarHBondContact O-CB 3.41Å; A143-T147 WeakPolarHBondContact O-CG2 3.15Å; A143-T147 PolarHBondContact O-N 3.09Å; A143-T147 PolarHBondContact O-OG1 3.44Å; A143-V170 HydrophobicContact CB-CG1 4.17Å; A143-V170 HydrophobicContact CB-CG2 4.25Å
144T97.4Very high97Very high29 Ų2927.2 Ų27.218%0.17816%0.156CC..Hα-helixtrans-59.8-49.7-178.7-60.40000111.8F140 W141 G142 N148F140-T144 WeakPolarHBondContact O-CB 3.25Å; F140-T144 PolarHBondContact O-N 3.1Å; F140-T144 PolarHBondContact O-OG1 3.07Å; W141-T144 PolarHBondContact O-N 3.28Å; G142-T144 PolarHBondContact O-N 3.1Å; T144-N148 WeakPolarHBondContact O-CB 3.29Å; T144-N148 PolarHBondContact O-N 3.18Å
145V96.6Very high96.9Very high57 Ų5736.6 Ų36.635%0.34519%0.189SC..Hα-helixtrans-67.4-49.8-177.9171.60000111.3W141 G142 N148 L149 I268W141-V145 WeakPolarHBondContact O-CB 3.49Å; W141-V145 WeakPolarHBondContact O-CG2 3.44Å; W141-V145 PolarHBondContact O-N 3.26Å; G142-V145 PolarHBondContact O-N 3.43Å; V145-N148 PolarHBondContact O-N 3.11Å; V145-L149 PolarHBondContact O-N 2.77Å; V145-I268 HydrophobicContact CG2-CD1 4.27Å; V145-I268 HydrophobicContact CG2-CG2 4.3Å
146I95.8Very high96.8Very high49 Ų4941 Ų4125%0.25121%0.212SC..Hα-helixtrans-68.8-44.5-173.1-63.6-61.5000111.5F128 G142 N148 L149F128-I146 HydrophobicContact CD2-CG2 4.39Å; F128-I146 HydrophobicContact CE2-CB 3.73Å; F128-I146 HydrophobicContact CE2-CG1 4.05Å; F128-I146 HydrophobicContact CE2-CG2 3.73Å; F128-I146 HydrophobicContact CZ-CB 3.92Å; F128-I146 HydrophobicContact CZ-CG2 3.84Å; G142-I146 WeakPolarHBondContact O-CB 3.48Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.49Å; G142-I146 PolarHBondContact O-N 3.11Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 2.74Å; I146-L149 HydrophobicContact CD1-CD1 4.2Å; I146-L149 WeakPolarHBondContact O-CB 3.27Å; I146-L149 WeakPolarHBondContact O-CG 3.47Å; I146-L149 PolarHBondContact O-N 3.47Å
147T97.1Very high96.8Very high10 Ų1041 Ų416%0.06121%0.213CC..Hα-helixtrans-68-35.7178.755.20000112F128 A143 L149 L150 V161 I164 W165 F178F128-T147 HydrophobicContact CE1-CG2 4.24Å; F128-T147 HydrophobicContact CZ-CG2 4.15Å; A143-T147 WeakPolarHBondContact O-CB 3.41Å; A143-T147 WeakPolarHBondContact O-CG2 3.15Å; A143-T147 PolarHBondContact O-N 3.09Å; A143-T147 PolarHBondContact O-OG1 3.44Å; T147-L149 PolarHBondContact O-N 2.87Å; T147-L149 VanDerWaalsContact O-N 3.13Å; T147-L150 WeakPolarHBondContact O-CB 3.45Å; T147-L150 PolarHBondContact O-N 3.19Å; T147-L150 VanDerWaalsContact O-N 3.13Å; T147-V161 WeakPolarHBondContact O-CG2 3.45Å; T147-I164 HydrophobicContact CG2-CG2 4.38Å; T147-W165 PolarHBondContact OG1-NE1 3.26Å; T147-F178 HydrophobicContact CG2-CZ 4.02Å
148N97.1Very high96.8Very high62 Ų6244.4 Ų44.433%0.33223%0.234SC..G310 helixtrans-70-4.4175.9-167.933.2000113.7T144 V145 I146 L150 S151 W165 K287T144-N148 WeakPolarHBondContact O-CB 3.29Å; T144-N148 PolarHBondContact O-N 3.18Å; V145-N148 PolarHBondContact O-N 3.11Å; I146-N148 VanDerWaalsContact C-N 3.34Å; I146-N148 PolarHBondContact O-N 2.74Å; N148-L150 PolarHBondContact O-N 2.89Å; N148-S151 PolarHBondContact O-N 2.89Å; N148-S151 PolarHBondContact O-OG 3.29Å; N148-S151 PolarHBondContact OD1-OG 2.94Å; N148-W165 HydrophobicContact CB-CH2 4.27Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; N148-K287 WeakPolarHBondContact O-CE 3.48Å; N148-K287 PolarHBondContact O-NZ 2.83Å
149L95.2Very high96.8Very high21 Ų2149.2 Ų49.211%0.1126%0.26CS..G310 helixtrans-62.6-32.5167.4-67179.5000111.6V145 I146 T147 S151 A152 L281 V291 L294V145-L149 PolarHBondContact O-N 2.77Å; I146-L149 HydrophobicContact CD1-CD1 4.2Å; I146-L149 WeakPolarHBondContact O-CB 3.27Å; I146-L149 WeakPolarHBondContact O-CG 3.47Å; I146-L149 PolarHBondContact O-N 3.47Å; T147-L149 PolarHBondContact O-N 2.87Å; T147-L149 VanDerWaalsContact O-N 3.13Å; L149-S151 PolarHBondContact O-N 3.34Å; L149-A152 VanDerWaalsContact O-CB 3.26Å; L149-A152 WeakPolarHBondContact O-CB 3.11Å; L149-A152 PolarHBondContact O-N 3.32Å; L149-A152 VanDerWaalsContact O-N 3.07Å; L149-L281 HydrophobicContact CD1-CD1 4.36Å; L149-L281 HydrophobicContact CD1-CD2 3.65Å; L149-L281 HydrophobicContact CD2-CD1 4.24Å; L149-L281 HydrophobicContact CD2-CD2 4.16Å; L149-V291 HydrophobicContact CB-CG2 3.72Å; L149-V291 HydrophobicContact CD2-CG2 4.02Å; L149-V291 HydrophobicContact CG-CG2 4.29Å; L149-L294 HydrophobicContact CD1-CD2 4.44Å
150L94.8Very high96.9Very high55 Ų5551.9 Ų51.929%0.28827%0.274SS..G310 helixtrans-65.8-20.9179.7-64.5172.9000113.2T147 N148 A152 I153 G157 L160 V161 I164T147-L150 WeakPolarHBondContact O-CB 3.45Å; T147-L150 PolarHBondContact O-N 3.19Å; T147-L150 VanDerWaalsContact O-N 3.13Å; N148-L150 PolarHBondContact O-N 2.89Å; L150-A152 PolarHBondContact O-N 2.94Å; L150-A152 VanDerWaalsContact O-N 3.11Å; L150-I153 HydrophobicContact CD2-CD1 4.07Å; L150-I153 WeakPolarHBondContact O-CB 3.19Å; L150-I153 WeakPolarHBondContact O-CG1 3.35Å; L150-I153 PolarHBondContact O-N 3.15Å; L150-G157 VanDerWaalsContact O-CA 3.31Å; L150-G157 WeakPolarHBondContact O-CA 3.25Å; L150-L160 HydrophobicContact CB-CD2 4.29Å; L150-L160 HydrophobicContact CD1-CD2 4.23Å; L150-V161 HydrophobicContact CB-CG2 3.83Å; L150-I164 HydrophobicContact CD1-CD1 3.29Å
151S96.4Very high96.9Very high31 Ų3151.5 Ų51.522%0.21727%0.272CS..G310 helixtrans-68-7.5173.8650000113.6N148 L149 I153 K287N148-S151 PolarHBondContact O-N 2.89Å; N148-S151 PolarHBondContact O-OG 3.29Å; N148-S151 PolarHBondContact OD1-OG 2.94Å; L149-S151 PolarHBondContact O-N 3.34Å; S151-I153 VanDerWaalsContact C-N 3.25Å; S151-K287 PolarHBondContact OG-NZ 3.06Å
152A96.2Very high96.9Very high18 Ų1853.8 Ų53.815%0.14929%0.285CS..G310 helixtrans-72.9-16169.800000113.4L149 L150 P154 K287 L288 V291L149-A152 VanDerWaalsContact O-CB 3.26Å; L149-A152 WeakPolarHBondContact O-CB 3.11Å; L149-A152 PolarHBondContact O-N 3.32Å; L149-A152 VanDerWaalsContact O-N 3.07Å; L150-A152 PolarHBondContact O-N 2.94Å; L150-A152 VanDerWaalsContact O-N 3.11Å; A152-P154 WeakPolarHBondContact O-CD 3.34Å; A152-K287 HydrophobicContact CB-CB 4.47Å; A152-K287 HydrophobicContact CB-CD 3.96Å; A152-K287 HydrophobicContact CB-CG 3.9Å; A152-L288 HydrophobicContact CB-CB 4.25Å; A152-L288 HydrophobicContact CB-CD1 4.39Å; A152-V291 HydrophobicContact CB-CG2 4.38Å
153I96.8Very high97Very high59 Ų5962.4 Ų62.430%0.30331%0.314SS..SBendtrans-68.2122.6178.1-61.1171000108.8L150 S151 I156 G157 L160L150-I153 HydrophobicContact CD2-CD1 4.07Å; L150-I153 WeakPolarHBondContact O-CB 3.19Å; L150-I153 WeakPolarHBondContact O-CG1 3.35Å; L150-I153 PolarHBondContact O-N 3.15Å; S151-I153 VanDerWaalsContact C-N 3.25Å; I153-I156 HydrophobicContact CG2-CD1 4.16Å; I153-I156 HydrophobicContact CG2-CG1 3.68Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.2Å; I153-G157 PolarHBondContact O-N 3.25Å; I153-L160 HydrophobicContact CD1-CD2 4.09Å
154P96.4Very high97Very high72 Ų7263.9 Ų63.947%0.46832%0.322SS..THydrogen-bonded Turntrans-58.2144.5179.5-2534.9000112.5A152 I156 L288A152-P154 WeakPolarHBondContact O-CD 3.34Å; P154-I156 PolarHBondContact O-N 2.58Å; P154-L288 HydrophobicContact CG-CD2 4.42Å
155Y96.4Very high97Very high225 Ų22563.6 Ų63.688%0.88232%0.318SS*.THydrogen-bonded Turntrans68.9-51.5176.7-45.5-69000115.8
156I97.9Very high97.1Very high104 Ų10462.6 Ų62.653%0.53332%0.319SS..THydrogen-bonded Turntrans-105.4-7.1-170.962.5169.3000114.3I153 P154 T158 D159 L160I153-I156 HydrophobicContact CG2-CD1 4.16Å; I153-I156 HydrophobicContact CG2-CG1 3.68Å; P154-I156 PolarHBondContact O-N 2.58Å; I156-T158 PolarHBondContact O-N 3.41Å; I156-D159 PolarHBondContact O-N 3.19Å; I156-L160 WeakPolarHBondContact O-CB 3.25Å; I156-L160 PolarHBondContact O-N 2.99Å
157G97.4Very high97.1Very high1 Ų161.7 Ų61.71%0.0132%0.322CS..Hα-helixtrans-63.2-42.7-167.800000114.3L150 I153 L160 V161L150-G157 VanDerWaalsContact O-CA 3.31Å; L150-G157 WeakPolarHBondContact O-CA 3.25Å; I153-G157 VanDerWaalsContact O-CA 3.31Å; I153-G157 WeakPolarHBondContact O-CA 3.2Å; I153-G157 PolarHBondContact O-N 3.25Å; G157-L160 PolarHBondContact O-N 3.45Å; G157-V161 WeakPolarHBondContact O-CG2 3.44Å; G157-V161 PolarHBondContact O-N 3.48Å; G157-V161 VanDerWaalsContact O-N 3.1Å
158T97.2Very high97.1Very high81 Ų8170.6 Ų70.650%0.49736%0.356SS..Hα-helixtrans-65.1-44.1179.546.90000111.8I156 L160 V161 Q162I156-T158 PolarHBondContact O-N 3.41Å; T158-L160 VanDerWaalsContact C-N 3.33Å; T158-L160 PolarHBondContact O-N 3.29Å; T158-V161 PolarHBondContact O-N 3.37Å; T158-Q162 PolarHBondContact O-N 3.13Å
159D98.2Very high97.1Very high104 Ų10470.7 Ų70.756%0.55636%0.361SS*.Hα-helixtrans-66.6-39.1-179.7-61.1-8.2000110.4I156 V161 Q162 W163I156-D159 PolarHBondContact O-N 3.19Å; D159-V161 PolarHBondContact O-N 3.22Å; D159-Q162 PolarHBondContact O-N 3.44Å; D159-W163 WeakPolarHBondContact O-CB 3.37Å; D159-W163 PolarHBondContact O-N 2.85Å
160L97.9Very high97.2Very high55 Ų5569.8 Ų69.829%0.28836%0.357SS..Hα-helixtrans-62.2-42.8175.4-176.164.3000112L150 I153 I156 G157 T158 W163 I164L150-L160 HydrophobicContact CB-CD2 4.29Å; L150-L160 HydrophobicContact CD1-CD2 4.23Å; I153-L160 HydrophobicContact CD1-CD2 4.09Å; I156-L160 WeakPolarHBondContact O-CB 3.25Å; I156-L160 PolarHBondContact O-N 2.99Å; G157-L160 PolarHBondContact O-N 3.45Å; T158-L160 VanDerWaalsContact C-N 3.33Å; T158-L160 PolarHBondContact O-N 3.29Å; L160-W163 HydrophobicContact CD1-CE3 4.22Å; L160-W163 PolarHBondContact O-N 3.23Å; L160-I164 HydrophobicContact CD1-CD1 4.41Å; L160-I164 HydrophobicContact CG-CD1 4.15Å; L160-I164 VanDerWaalsContact O-CG1 3.28Å; L160-I164 WeakPolarHBondContact O-CG1 3.25Å; L160-I164 PolarHBondContact O-N 2.77Å
161V98.2Very high97.3Very high4 Ų471.1 Ų71.12%0.02436%0.364CS..Hα-helixtrans-64-49.1177.5170.40000111.1T147 L150 G157 T158 D159 W163 I164 W165T147-V161 WeakPolarHBondContact O-CG2 3.45Å; L150-V161 HydrophobicContact CB-CG2 3.83Å; G157-V161 WeakPolarHBondContact O-CG2 3.44Å; G157-V161 PolarHBondContact O-N 3.48Å; G157-V161 VanDerWaalsContact O-N 3.1Å; T158-V161 PolarHBondContact O-N 3.37Å; D159-V161 PolarHBondContact O-N 3.22Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 2.76Å; V161-I164 PolarHBondContact O-N 3.44Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.46Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.48Å; V161-W165 VanDerWaalsContact CG1-CH2 3.48Å; V161-W165 HydrophobicContact CG1-CZ2 3.4Å; V161-W165 VanDerWaalsContact CG1-CZ2 3.4Å; V161-W165 HydrophobicContact CG1-CZ3 3.6Å; V161-W165 PolarHBondContact O-N 3.34Å
162Q98.2Very high97.3Very high83 Ų8370.8 Ų70.839%0.38836%0.362SS..Hα-helixtrans-63.9-35.2178.1-69.6-178.9-1.600112T158 D159 W165 G166 G167T158-Q162 PolarHBondContact O-N 3.13Å; D159-Q162 PolarHBondContact O-N 3.44Å; Q162-W165 PolarHBondContact O-N 2.98Å; Q162-G166 WeakPolarHBondContact O-CA 3.45Å; Q162-G166 PolarHBondContact O-N 2.86Å; Q162-G167 WeakPolarHBondContact CA-O 3.33Å; Q162-G167 PolarHBondContact O-N 2.92Å
163W98.3Very high97.4Very high189 Ų18972.7 Ų72.772%0.71637%0.373SS*.Hα-helixtrans-63.9-44.8173.3-179.380.4000111.7D159 L160 V161 W165 G166 R177D159-W163 WeakPolarHBondContact O-CB 3.37Å; D159-W163 PolarHBondContact O-N 2.85Å; L160-W163 HydrophobicContact CD1-CE3 4.22Å; L160-W163 PolarHBondContact O-N 3.23Å; V161-W163 VanDerWaalsContact C-N 3.27Å; V161-W163 PolarHBondContact O-N 2.76Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.5Å; W163-G166 PolarHBondContact O-N 2.95Å; W163-R177 PolarHBondContact O-NH1 3.37Å
164I97.5Very high97.5Very high32 Ų3269.9 Ų69.916%0.16436%0.358CS..Hα-helixtrans-63.2-38.9175-71.6167.9000111.1T147 L150 L160 V161 R177 F178T147-I164 HydrophobicContact CG2-CG2 4.38Å; L150-I164 HydrophobicContact CD1-CD1 3.29Å; L160-I164 HydrophobicContact CD1-CD1 4.41Å; L160-I164 HydrophobicContact CG-CD1 4.15Å; L160-I164 VanDerWaalsContact O-CG1 3.28Å; L160-I164 WeakPolarHBondContact O-CG1 3.25Å; L160-I164 PolarHBondContact O-N 2.77Å; V161-I164 PolarHBondContact O-N 3.44Å; I164-R177 WeakPolarHBondContact O-CD 3.46Å; I164-R177 PolarHBondContact O-NE 3.13Å; I164-R177 PolarHBondContact O-NH1 3.4Å; I164-F178 HydrophobicContact CG2-CE1 4.21Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å
165W98.4Very high97.6Very high23 Ų2366.5 Ų66.59%0.08734%0.336CS..Hα-helixtrans-74.1-32.7178.1-66.6-16.4000112.7T147 N148 V161 Q162 W163 G167 Y168 S169 V170 T174T147-W165 PolarHBondContact OG1-NE1 3.26Å; N148-W165 HydrophobicContact CB-CH2 4.27Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.46Å; V161-W165 HydrophobicContact CG1-CE3 3.68Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.48Å; V161-W165 VanDerWaalsContact CG1-CH2 3.48Å; V161-W165 HydrophobicContact CG1-CZ2 3.4Å; V161-W165 VanDerWaalsContact CG1-CZ2 3.4Å; V161-W165 HydrophobicContact CG1-CZ3 3.6Å; V161-W165 PolarHBondContact O-N 3.34Å; Q162-W165 PolarHBondContact O-N 2.98Å; W163-W165 VanDerWaalsContact C-N 3.33Å; W163-W165 PolarHBondContact O-N 3.5Å; W165-G167 VanDerWaalsContact C-N 3.31Å; W165-Y168 VanDerWaalsContact CZ3-O 3.25Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.45Å; W165-S169 VanDerWaalsContact CE3-CA 3.49Å; W165-V170 HydrophobicContact CD2-CG2 4.4Å; W165-V170 HydrophobicContact CG-CG2 4.38Å; W165-V170 HydrophobicContact CZ2-CG2 4.3Å; W165-T174 WeakPolarHBondContact CA-OG1 3.47Å; W165-T174 PolarHBondContact O-N 3.5Å; W165-T174 PolarHBondContact O-OG1 2.94Å
166G97.5Very high97.7Very high37 Ų3758.6 Ų58.638%0.38131%0.312SS..THydrogen-bonded Turntrans73.327.3-168.800000112.9Q162 W163Q162-G166 WeakPolarHBondContact O-CA 3.45Å; Q162-G166 PolarHBondContact O-N 2.86Å; W163-G166 PolarHBondContact O-N 2.95Å
167G96.6Very high97.7Very high30 Ų3057 Ų5731%0.30930%0.299SS..SBendtrans171.9-165.7-171.700000110.9Q162 W165Q162-G167 WeakPolarHBondContact CA-O 3.33Å; Q162-G167 PolarHBondContact O-N 2.92Å; W165-G167 VanDerWaalsContact C-N 3.31Å
168Y97.3Very high97.7Very high196 Ų19657.4 Ų57.477%0.76930%0.301SS*.SBendtrans-90.7-10.8-176.3-59.4-71.3000114.2W165W165-Y168 VanDerWaalsContact CZ3-O 3.25Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.45Å
169S96.6Very high97.8Very high64 Ų6455.6 Ų55.645%0.44829%0.286SS..SBendtrans-150.1167.5177.656.60000109.9W165 D171W165-S169 VanDerWaalsContact CE3-CA 3.49Å; S169-D171 PolarHBondContact O-N 3.5Å
170V97.8Very high97.8Very high3 Ų354.4 Ų54.42%0.01828%0.283CS..SBendtrans-61.1123.1166.6175.50000108.7W135 F140 A143 W165 T174W135-V170 HydrophobicContact CH2-CG1 3.71Å; W135-V170 HydrophobicContact CZ3-CG1 4.05Å; 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 3.28Å; F140-V170 WeakPolarHBondContact CE2-O 3.42Å; A143-V170 HydrophobicContact CB-CG1 4.17Å; A143-V170 HydrophobicContact CB-CG2 4.25Å; W165-V170 HydrophobicContact CD2-CG2 4.4Å; W165-V170 HydrophobicContact CG-CG2 4.38Å; W165-V170 HydrophobicContact CZ2-CG2 4.3Å; V170-T174 HydrophobicContact CG1-CG2 4.2Å
171D96.9Very high97.9Very high82 Ų8257 Ų5744%0.43929%0.292SS..SBendtrans-158.4-170.6-178.3-161.3-0.1000110.7S169 P173 T174 L175S169-D171 PolarHBondContact O-N 3.5Å; D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; D171-T174 PolarHBondContact N-OG1 3.04Å; D171-T174 WeakPolarHBondContact O-CA 3.36Å; D171-T174 VanDerWaalsContact O-CB 3.24Å; D171-T174 WeakPolarHBondContact O-CB 3.48Å; D171-T174 PolarHBondContact O-N 2.89Å; D171-L175 PolarHBondContact O-N 2.88Å
172S96.8Very high97.9Very high24 Ų2458.1 Ų58.117%0.16830%0.297CS..Hα-helixtrans-43.6-47.4178.8-83.30000114D58 A59 T174 L175 T176D58-S172 PolarHBondContact OD2-OG 2.89Å; A59-S172 WeakPolarHBondContact CB-OG 3.31Å; A59-S172 PolarHBondContact N-OG 3.23Å; S172-T174 PolarHBondContact O-N 2.97Å; S172-L175 PolarHBondContact O-N 3.46Å; S172-L175 VanDerWaalsContact O-N 3.08Å; S172-T176 PolarHBondContact O-N 3.39Å; S172-T176 PolarHBondContact O-OG1 2.84Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å
173P98Very high97.9Very high59 Ų5958 Ų5838%0.38330%0.295SS..Hα-helixtrans-58.4-34.7177-2535.1000113.6D171 R177D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; P173-R177 WeakPolarHBondContact O-CG 3.32Å; P173-R177 PolarHBondContact O-N 3.47Å; P173-R177 PolarHBondContact O-NE 3.28Å
174T98.1Very high98Very high0 Ų052.7 Ų52.70%028%0.28CS..Hα-helixtrans-71.7-40.7175.6-45.20000111.3W165 V170 D171 S172 R177 F178W165-T174 WeakPolarHBondContact CA-OG1 3.47Å; W165-T174 PolarHBondContact O-N 3.5Å; W165-T174 PolarHBondContact O-OG1 2.94Å; V170-T174 HydrophobicContact CG1-CG2 4.2Å; D171-T174 PolarHBondContact N-OG1 3.04Å; D171-T174 WeakPolarHBondContact O-CA 3.36Å; D171-T174 VanDerWaalsContact O-CB 3.24Å; D171-T174 WeakPolarHBondContact O-CB 3.48Å; D171-T174 PolarHBondContact O-N 2.89Å; S172-T174 PolarHBondContact O-N 2.97Å; T174-R177 WeakPolarHBondContact O-CG 3.42Å; T174-F178 HydrophobicContact CG2-CD1 4.3Å; T174-F178 HydrophobicContact CG2-CD2 4.45Å; T174-F178 HydrophobicContact CG2-CE1 4.03Å; T174-F178 HydrophobicContact CG2-CE2 4.2Å; T174-F178 HydrophobicContact CG2-CG 4.49Å; T174-F178 HydrophobicContact CG2-CZ 3.98Å; T174-F178 WeakPolarHBondContact O-CB 3.49Å; T174-F178 WeakPolarHBondContact O-CG 3.31Å; T174-F178 PolarHBondContact O-N 3.05Å
175L98.1Very high98Very high0 Ų052.6 Ų52.60%028%0.279CS..Hα-helixtrans-66.6-45.1-179.7-174.655.5000111.9A62 V132 L133 W135 D171 S172 R177 F178 F179A62-L175 HydrophobicContact CB-CD2 3.54Å; V132-L175 HydrophobicContact CG1-CD1 4.39Å; L133-L175 HydrophobicContact CD2-CD1 4Å; W135-L175 HydrophobicContact CD2-CD2 3.83Å; W135-L175 HydrophobicContact CE3-CB 4.26Å; W135-L175 HydrophobicContact CE3-CD1 3.64Å; W135-L175 HydrophobicContact CE3-CD2 3.68Å; W135-L175 HydrophobicContact CE3-CG 4.06Å; W135-L175 HydrophobicContact CG-CD2 4.26Å; W135-L175 HydrophobicContact CH2-CB 4.12Å; W135-L175 HydrophobicContact CZ3-CB 3.79Å; W135-L175 HydrophobicContact CZ3-CD1 3.84Å; W135-L175 HydrophobicContact CZ3-CD2 4.04Å; W135-L175 HydrophobicContact CZ3-CG 4.11Å; D171-L175 PolarHBondContact O-N 2.88Å; S172-L175 PolarHBondContact O-N 3.46Å; S172-L175 VanDerWaalsContact O-N 3.08Å; L175-R177 PolarHBondContact O-N 3.07Å; L175-F178 PolarHBondContact O-N 3.29Å; L175-F179 PolarHBondContact O-N 3.5Å
176T98.4Very high98Very high60 Ų6052.3 Ų52.337%0.36828%0.281SS..Hα-helixtrans-60.8-46.3179.6-51.90000111.8P57 S172 F179 T180P57-T176 PolarHBondContact O-OG1 3.43Å; S172-T176 PolarHBondContact O-N 3.39Å; S172-T176 PolarHBondContact O-OG1 2.84Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å; T176-F179 WeakPolarHBondContact O-CB 3.48Å; T176-F179 PolarHBondContact O-N 3.49Å; T176-T180 PolarHBondContact O-N 3.41Å; T176-T180 PolarHBondContact O-OG1 2.79Å; T176-T180 VanDerWaalsContact O-OG1 3.1Å
177R98.2Very high98.1Very high69 Ų6955.1 Ų55.126%0.2628%0.282SS..Hα-helixtrans-67.2-38.517766.4-174.767.8-156.1-11.1112.4W163 I164 P173 T174 L175 F179 T180 F181W163-R177 PolarHBondContact O-NH1 3.37Å; I164-R177 WeakPolarHBondContact O-CD 3.46Å; I164-R177 PolarHBondContact O-NE 3.13Å; I164-R177 PolarHBondContact O-NH1 3.4Å; P173-R177 WeakPolarHBondContact O-CG 3.32Å; P173-R177 PolarHBondContact O-N 3.47Å; P173-R177 PolarHBondContact O-NE 3.28Å; T174-R177 WeakPolarHBondContact O-CG 3.42Å; L175-R177 PolarHBondContact O-N 3.07Å; R177-F179 VanDerWaalsContact C-N 3.29Å; R177-F179 PolarHBondContact O-N 3.43Å; R177-T180 PolarHBondContact O-N 3.47Å; R177-T180 VanDerWaalsContact O-N 3.17Å; R177-F181 HydrophobicContact CB-CD2 4.35Å; R177-F181 HydrophobicContact CB-CE2 4.28Å; R177-F181 WeakPolarHBondContact O-CD2 3.47Å; R177-F181 PolarHBondContact O-N 2.98Å
178F98.6Very high98.2Very high11 Ų1157.4 Ų57.45%0.04829%0.287CS..Hα-helixtrans-65.6-37.4178.5-83.616.8000110.5F128 M129 V132 L133 T147 I164 T174 L175 H182F128-F178 AromaticContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CE2 3.92Å; F128-F178 HydrophobicContact CE1-CZ 4.22Å; M129-F178 HydrophobicContact CB-CB 4.28Å; M129-F178 HydrophobicContact CB-CD2 4.38Å; M129-F178 HydrophobicContact CB-CG 4.35Å; M129-F178 HydrophobicContact CG-CB 4.3Å; M129-F178 HydrophobicContact CG-CD1 4.16Å; M129-F178 HydrophobicContact CG-CD2 3.97Å; M129-F178 HydrophobicContact CG-CE2 4.32Å; M129-F178 HydrophobicContact CG-CG 3.89Å; M129-F178 HydrophobicContact SD-CD1 4.16Å; M129-F178 HydrophobicContact SD-CG 4.36Å; V132-F178 HydrophobicContact CB-CD2 3.92Å; V132-F178 HydrophobicContact CG1-CD2 3.96Å; V132-F178 HydrophobicContact CG2-CD2 3.87Å; V132-F178 HydrophobicContact CG2-CE2 4.03Å; L133-F178 HydrophobicContact CD2-CB 4.5Å; T147-F178 HydrophobicContact CG2-CZ 4.02Å; I164-F178 HydrophobicContact CG2-CE1 4.21Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å; T174-F178 HydrophobicContact CG2-CD1 4.3Å; T174-F178 HydrophobicContact CG2-CD2 4.45Å; T174-F178 HydrophobicContact CG2-CE1 4.03Å; T174-F178 HydrophobicContact CG2-CE2 4.2Å; T174-F178 HydrophobicContact CG2-CG 4.49Å; T174-F178 HydrophobicContact CG2-CZ 3.98Å; T174-F178 WeakPolarHBondContact O-CB 3.49Å; T174-F178 WeakPolarHBondContact O-CG 3.31Å; T174-F178 PolarHBondContact O-N 3.05Å; L175-F178 PolarHBondContact O-N 3.29Å; F178-H182 WeakPolarHBondContact O-CB 2.85Å; F178-H182 PolarHBondContact O-N 3.26Å
179F98.8Very high98.3Very high42 Ų4248.3 Ų48.318%0.18425%0.252CS..Hα-helixtrans-59.8-48.8169.6174.7-109.4000111.7A52 Y55 P57 L133 L175 T176 R177 F181 H182 F183A52-F179 HydrophobicContact CB-CE2 4.23Å; A52-F179 HydrophobicContact CB-CZ 4.13Å; Y55-F179 AromaticContact CD1-CD2 3.65Å; Y55-F179 HydrophobicContact CD1-CD2 3.65Å; 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 4.34Å; 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 4.02Å; P57-F179 HydrophobicContact CB-CB 3.81Å; P57-F179 HydrophobicContact CB-CD1 3.94Å; P57-F179 HydrophobicContact CB-CG 3.91Å; P57-F179 HydrophobicContact CG-CD1 3.92Å; P57-F179 HydrophobicContact CG-CE1 4.41Å; P57-F179 HydrophobicContact CG-CG 4.39Å; L133-F179 HydrophobicContact CD1-CD2 4.04Å; L133-F179 HydrophobicContact CD2-CB 3.9Å; L175-F179 PolarHBondContact O-N 3.5Å; T176-F179 WeakPolarHBondContact O-CB 3.48Å; T176-F179 PolarHBondContact O-N 3.49Å; R177-F179 VanDerWaalsContact C-N 3.29Å; R177-F179 PolarHBondContact O-N 3.43Å; F179-F181 PolarHBondContact O-N 3.1Å; F179-H182 PolarHBondContact O-N 3.22Å; F179-F183 HydrophobicContact CZ-CD2 4.36Å; F179-F183 WeakPolarHBondContact O-CB 3.38Å; F179-F183 PolarHBondContact O-N 3.49Å
180T98.6Very high98.4Very high80 Ų8047.1 Ų47.149%0.49125%0.246SC..Hα-helixtrans-58.9-46.8178.1-53.60000112.4T176 R177 F183 I184T176-T180 PolarHBondContact O-N 3.41Å; T176-T180 PolarHBondContact O-OG1 2.79Å; T176-T180 VanDerWaalsContact O-OG1 3.1Å; R177-T180 PolarHBondContact O-N 3.47Å; R177-T180 VanDerWaalsContact O-N 3.17Å; T180-F183 PolarHBondContact O-N 2.9Å; T180-I184 WeakPolarHBondContact O-CG2 3.37Å; T180-I184 PolarHBondContact O-N 3.43Å; T180-I184 VanDerWaalsContact O-N 3.11Å
181F98.7Very high98.4Very high110 Ų11050.1 Ų50.148%0.48227%0.271SS..Hα-helixtrans-67.8-42178.5-74.8-58.2000112.5M129 R177 F179 F183 I184 L185M129-F181 HydrophobicContact CE-CB 3.97Å; M129-F181 HydrophobicContact SD-CB 3.46Å; M129-F181 WeakPolarHBondContact SD-CB 3.44Å; M129-F181 HydrophobicContact SD-CG 4.33Å; R177-F181 HydrophobicContact CB-CD2 4.35Å; R177-F181 HydrophobicContact CB-CE2 4.28Å; R177-F181 WeakPolarHBondContact O-CD2 3.47Å; R177-F181 PolarHBondContact O-N 2.98Å; F179-F181 PolarHBondContact O-N 3.1Å; F181-F183 PolarHBondContact O-N 3.28Å; F181-I184 WeakPolarHBondContact O-CG2 3.34Å; F181-I184 PolarHBondContact O-N 3.13Å; F181-L185 WeakPolarHBondContact O-CB 3.34Å; F181-L185 VanDerWaalsContact O-CG 3.31Å; F181-L185 WeakPolarHBondContact O-CG 3.42Å; F181-L185 PolarHBondContact O-N 3.41Å
182H98.8Very high98.5Very high27 Ų2747.8 Ų47.813%0.12526%0.258CS..Hα-helixtrans-61.3-34.4174.5-179.972.2000112H83 T126 M129 G130 L133 F178 F179 P186H83-H182 AromaticContact NE2-NE2 3.96Å; T126-H182 PolarHBondContact O-CE1 3.14Å; T126-H182 PolarHBondContact O-ND1 3.23Å; M129-H182 HydrophobicContact CB-CB 4.09Å; G130-H182 WeakPolarHBondContact CA-CE1 3.39Å; G130-H182 VanDerWaalsContact CA-ND1 3.27Å; G130-H182 WeakPolarHBondContact CA-ND1 3.35Å; G130-H182 PolarHBondContact N-ND1 3.07Å; L133-H182 HydrophobicContact CD1-CB 4.31Å; F178-H182 WeakPolarHBondContact O-CB 2.85Å; F178-H182 PolarHBondContact O-N 3.26Å; F179-H182 PolarHBondContact O-N 3.22Å; H182-P186 WeakPolarHBondContact O-CD 3.43Å; H182-P186 WeakPolarHBondContact O-CG 3.5Å
183F98.8Very high98.6Very high79 Ų7948 Ų4835%0.34626%0.261SS..Hα-helixtrans-72.1-43.2177.5-167.6-84.3000112.6L49 A52 F179 T180 F181 F187L49-F183 HydrophobicContact CD1-CE2 4.24Å; L49-F183 HydrophobicContact CD1-CZ 4.05Å; A52-F183 HydrophobicContact CB-CD2 4.28Å; A52-F183 HydrophobicContact CB-CE2 3.99Å; F179-F183 HydrophobicContact CZ-CD2 4.36Å; F179-F183 WeakPolarHBondContact O-CB 3.38Å; F179-F183 PolarHBondContact O-N 3.49Å; T180-F183 PolarHBondContact O-N 2.9Å; F181-F183 PolarHBondContact O-N 3.28Å; F183-F187 HydrophobicContact CD1-CE2 4.1Å; F183-F187 AromaticContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CZ 4.46Å; F183-F187 HydrophobicContact CZ-CE2 4.49Å; F183-F187 VanDerWaalsContact O-CD2 3.27Å; F183-F187 WeakPolarHBondContact O-CD2 3.1Å; F183-F187 VanDerWaalsContact O-CE2 3.26Å; F183-F187 WeakPolarHBondContact O-CE2 3.25Å
184I98.8Very high98.6Very high79 Ų7948.1 Ų48.141%0.40527%0.267SS..Hα-helixtrans-78.7-35.1-175.7-170.259.5000113.4T180 F181 F187 I188T180-I184 WeakPolarHBondContact O-CG2 3.37Å; T180-I184 PolarHBondContact O-N 3.43Å; T180-I184 VanDerWaalsContact O-N 3.11Å; F181-I184 WeakPolarHBondContact O-CG2 3.34Å; F181-I184 PolarHBondContact O-N 3.13Å; I184-F187 WeakPolarHBondContact O-CB 3.5Å; I184-F187 PolarHBondContact O-N 2.97Å; I184-F187 VanDerWaalsContact O-N 3.11Å; I184-I188 HydrophobicContact CG1-CD1 4.21Å; I184-I188 PolarHBondContact O-N 3.32Å
185L98.7Very high98.6Very high29 Ų2951.2 Ų51.215%0.15228%0.283CS..Hα-helixtrans-60.4-39-173.7-81.9169.1000115A125 T126 M129 F181 F187 I188 I189A125-L185 HydrophobicContact CB-CD1 4.34Å; T126-L185 HydrophobicContact CG2-CB 4.47Å; T126-L185 VanDerWaalsContact OG1-CB 3.23Å; T126-L185 WeakPolarHBondContact OG1-CB 3.27Å; M129-L185 HydrophobicContact CE-CD1 3.23Å; F181-L185 WeakPolarHBondContact O-CB 3.34Å; F181-L185 VanDerWaalsContact O-CG 3.31Å; F181-L185 WeakPolarHBondContact O-CG 3.42Å; F181-L185 PolarHBondContact O-N 3.41Å; L185-F187 PolarHBondContact O-N 2.9Å; L185-I188 HydrophobicContact CD2-CD1 4.19Å; L185-I188 CarbonylContact O-C 3.25Å; L185-I188 WeakPolarHBondContact O-CA 3.34Å; L185-I188 WeakPolarHBondContact O-CB 3.38Å; L185-I188 PolarHBondContact O-N 3.05Å; L185-I189 WeakPolarHBondContact O-CG1 3.44Å; L185-I189 PolarHBondContact O-N 2.95Å
186P98.8Very high98.6Very high18 Ų1852.6 Ų52.612%0.11729%0.29CS..Hα-helixtrans-54-34.8173.8-29.235000113.9L41 I45 T126 H182 I189 A190L41-P186 HydrophobicContact CD1-CB 4.49Å; I45-P186 HydrophobicContact CD1-CB 4.2Å; I45-P186 HydrophobicContact CG1-CB 3.68Å; T126-P186 HydrophobicContact CG2-CG 3.89Å; H182-P186 WeakPolarHBondContact O-CD 3.43Å; H182-P186 WeakPolarHBondContact O-CG 3.5Å; P186-I189 PolarHBondContact O-N 2.96Å; P186-A190 PolarHBondContact O-N 3.47Å
187F98.7Very high98.6Very high95 Ų9553.3 Ų53.342%0.41729%0.291SS..Hα-helixtrans-74.3-35.8176.3-58.4-76.2000112.1I45 F183 I184 L185 I189 A190 A191I45-F187 HydrophobicContact CG2-CE1 4.03Å; I45-F187 HydrophobicContact CG2-CZ 4.22Å; F183-F187 HydrophobicContact CD1-CE2 4.1Å; F183-F187 AromaticContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CE2 3.84Å; F183-F187 HydrophobicContact CE1-CZ 4.46Å; F183-F187 HydrophobicContact CZ-CE2 4.49Å; F183-F187 VanDerWaalsContact O-CD2 3.27Å; F183-F187 WeakPolarHBondContact O-CD2 3.1Å; F183-F187 VanDerWaalsContact O-CE2 3.26Å; F183-F187 WeakPolarHBondContact O-CE2 3.25Å; I184-F187 WeakPolarHBondContact O-CB 3.5Å; I184-F187 PolarHBondContact O-N 2.97Å; I184-F187 VanDerWaalsContact O-N 3.11Å; L185-F187 PolarHBondContact O-N 2.9Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.11Å; F187-A190 PolarHBondContact O-N 3.44Å; F187-A191 PolarHBondContact O-N 3.25Å; F187-A191 VanDerWaalsContact O-N 3.09Å
188I98.8Very high98.6Very high79 Ų7954.7 Ų54.741%0.40530%0.303SS..Hα-helixtrans-64.3-42.2171.3-62.9171.2000110I184 L185 A190 A191 L192I184-I188 HydrophobicContact CG1-CD1 4.21Å; I184-I188 PolarHBondContact O-N 3.32Å; L185-I188 HydrophobicContact CD2-CD1 4.19Å; L185-I188 CarbonylContact O-C 3.25Å; L185-I188 WeakPolarHBondContact O-CA 3.34Å; L185-I188 WeakPolarHBondContact O-CB 3.38Å; L185-I188 PolarHBondContact O-N 3.05Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 3.15Å; I188-A191 PolarHBondContact O-N 3.1Å; I188-L192 HydrophobicContact CG2-CD1 4.06Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 3.48Å; I188-L192 PolarHBondContact O-N 3.12Å
189I98.9Very high98.6Very high5 Ų557.5 Ų57.53%0.02632%0.315CS..Hα-helixtrans-60.1-41.3174.3-68.6167.2000110.4L41 L119 A122 T126 L185 P186 F187 A191 L192 A193L41-I189 HydrophobicContact CD1-CB 4.34Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L119-I189 HydrophobicContact CD2-CG2 3.82Å; A122-I189 HydrophobicContact CB-CD1 4.17Å; A122-I189 HydrophobicContact CB-CG1 3.73Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.43Å; L185-I189 WeakPolarHBondContact O-CG1 3.44Å; L185-I189 PolarHBondContact O-N 2.95Å; P186-I189 PolarHBondContact O-N 2.96Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 3.46Å; I189-L192 PolarHBondContact O-N 3.41Å; I189-A193 VanDerWaalsContact O-CB 3.31Å; I189-A193 WeakPolarHBondContact O-CB 3.44Å; I189-A193 PolarHBondContact O-N 3.35Å
190A98.8Very high98.5Very high39 Ų3957.2 Ų57.232%0.32232%0.315SS..Hα-helixtrans-61.4-42.5175.600000112.4L41 P186 F187 I188 A193 A194L41-A190 HydrophobicContact CD2-CB 3.94Å; P186-A190 PolarHBondContact O-N 3.47Å; F187-A190 WeakPolarHBondContact O-CB 3.11Å; F187-A190 PolarHBondContact O-N 3.44Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 3.15Å; A190-A193 PolarHBondContact O-N 3.21Å; A190-A194 PolarHBondContact O-N 3.11Å
191A98.8Very high98.4Very high66 Ų6656.4 Ų56.455%0.54531%0.306SS..Hα-helixtrans-65-43.317500000112.2F187 I188 I189 A193 A194 L195F187-A191 PolarHBondContact O-N 3.25Å; F187-A191 VanDerWaalsContact O-N 3.09Å; I188-A191 PolarHBondContact O-N 3.1Å; I189-A191 PolarHBondContact O-N 3.46Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.16Å; A191-A194 PolarHBondContact O-N 3.13Å; A191-L195 PolarHBondContact O-N 3.01Å
192L98.8Very high98.3Very high32 Ų3258.4 Ų58.417%0.16832%0.317CS..Hα-helixtrans-63.8-35.5174.7-72.2170.5000112.2I118 L119 A122 I188 I189 L195 H196I118-L192 HydrophobicContact CG2-CD1 3.88Å; I118-L192 HydrophobicContact CG2-CD2 4.27Å; L119-L192 HydrophobicContact CD2-CB 3.54Å; L119-L192 HydrophobicContact CG-CB 4.05Å; A122-L192 HydrophobicContact CB-CD1 4.5Å; I188-L192 HydrophobicContact CG2-CD1 4.06Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 3.48Å; I188-L192 PolarHBondContact O-N 3.12Å; I189-L192 PolarHBondContact O-N 3.41Å; L192-L195 PolarHBondContact O-N 2.86Å; L192-H196 WeakPolarHBondContact O-CB 3.48Å; L192-H196 PolarHBondContact O-N 2.92Å
193A98.7Very high98Very high29 Ų2960.5 Ų60.524%0.2433%0.332CS..Hα-helixtrans-67.9-38.1176.200000111.6L119 I189 A190 A191 L195 H196 L197L119-A193 HydrophobicContact CD2-CB 4.37Å; I189-A193 VanDerWaalsContact O-CB 3.31Å; I189-A193 WeakPolarHBondContact O-CB 3.44Å; I189-A193 PolarHBondContact O-N 3.35Å; A190-A193 PolarHBondContact O-N 3.21Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 3.16Å; A193-L195 VanDerWaalsContact C-N 3.35Å; A193-H196 WeakPolarHBondContact O-CB 3.37Å; A193-H196 PolarHBondContact O-N 2.85Å; A193-L197 WeakPolarHBondContact O-CG 3.43Å; A193-L197 PolarHBondContact O-N 3.47Å
194A98.2Very high97.9Very high62 Ų6257.2 Ų57.251%0.51232%0.32SS..Hα-helixtrans-62.6-42.3171.300000111.5A190 A191 L197 L198A190-A194 PolarHBondContact O-N 3.11Å; A191-A194 PolarHBondContact O-N 3.13Å; A194-L197 PolarHBondContact O-N 3.22Å; A194-L198 PolarHBondContact O-N 3.38Å
195L98.4Very high97.8Very high64 Ų6454.9 Ų54.934%0.33531%0.311SS..Hα-helixtrans-64.7-39.1174.5-177.361.2000112.3I115 A191 L192 A193 L198 F199I115-L195 HydrophobicContact CD1-CD2 3.81Å; I115-L195 HydrophobicContact CD1-CG 4.39Å; I115-L195 HydrophobicContact CG1-CD2 4.38Å; I115-L195 HydrophobicContact CG1-CG 4.44Å; A191-L195 PolarHBondContact O-N 3.01Å; L192-L195 PolarHBondContact O-N 2.86Å; A193-L195 VanDerWaalsContact C-N 3.35Å; L195-L198 HydrophobicContact CD1-CD2 4.18Å; L195-L198 WeakPolarHBondContact O-CB 3.48Å; L195-L198 PolarHBondContact O-N 3.03Å; L195-F199 HydrophobicContact CD1-CD2 4.08Å; L195-F199 HydrophobicContact CD1-CE2 3.59Å; L195-F199 HydrophobicContact CD1-CZ 4.23Å; L195-F199 HydrophobicContact CD2-CE2 4.3Å; L195-F199 HydrophobicContact CG-CD2 4.09Å; L195-F199 HydrophobicContact CG-CE2 3.77Å; L195-F199 WeakPolarHBondContact O-CD2 3.39Å; L195-F199 PolarHBondContact O-N 3.28Å; L195-F199 VanDerWaalsContact O-N 3.13Å
196H98.6Very high97.7Very high30 Ų3053.8 Ų53.814%0.13931%0.305CS..Hα-helixtrans-60.1-45.7175.4-174.182000111.7T112 I115 G116 L119 L192 A193 L200T112-H196 WeakPolarHBondContact CG2-CE1 3.34Å; T112-H196 PolarHBondContact O-CE1 3.01Å; T112-H196 PolarHBondContact O-ND1 3.12Å; I115-H196 HydrophobicContact CB-CB 4.47Å; I115-H196 HydrophobicContact CG2-CB 3.68Å; G116-H196 PolarHBondContact N-ND1 3.45Å; L119-H196 HydrophobicContact CD1-CB 3.79Å; L192-H196 WeakPolarHBondContact O-CB 3.48Å; L192-H196 PolarHBondContact O-N 2.92Å; A193-H196 WeakPolarHBondContact O-CB 3.37Å; A193-H196 PolarHBondContact O-N 2.85Å; H196-L200 WeakPolarHBondContact O-CB 3.38Å; H196-L200 PolarHBondContact O-N 2.98Å
197L98.1Very high97.7Very high75 Ų7553.2 Ų53.239%0.39330%0.301SS..Hα-helixtrans-67.4-35.4176.2-70.5174.4000112.3A193 A194 L200 H201A193-L197 WeakPolarHBondContact O-CG 3.43Å; A193-L197 PolarHBondContact O-N 3.47Å; A194-L197 PolarHBondContact O-N 3.22Å; L197-L200 HydrophobicContact CD2-CD2 4.14Å; L197-L200 WeakPolarHBondContact O-CB 3.43Å; L197-L200 PolarHBondContact O-N 2.6Å; L197-H201 WeakPolarHBondContact O-CB 3.36Å; L197-H201 PolarHBondContact O-CD2 3.33Å; L197-H201 PolarHBondContact O-N 2.97Å
198L97.3Very high97.7Very high97 Ų9749.3 Ų49.351%0.50829%0.286SS..Hα-helixtrans-57.8-53.6174.7-177.869.3000110.8A194 L195 L200 H201 E202A194-L198 PolarHBondContact O-N 3.38Å; L195-L198 HydrophobicContact CD1-CD2 4.18Å; L195-L198 WeakPolarHBondContact O-CB 3.48Å; L195-L198 PolarHBondContact O-N 3.03Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.03Å; L198-H201 PolarHBondContact O-N 3.39Å; L198-E202 PolarHBondContact O-N 2.96Å
199F98.1Very high97.7Very high71 Ų7148.2 Ų48.231%0.31128%0.28SS..Hα-helixtrans-63-34.8177-73.4-59.4000112.9E111 T112 I115 L195 H201 E202E111-F199 HydrophobicContact CB-CB 4.09Å; E111-F199 HydrophobicContact CB-CD1 3.62Å; E111-F199 HydrophobicContact CB-CD2 4.04Å; E111-F199 HydrophobicContact CB-CE1 3.98Å; E111-F199 HydrophobicContact CB-CE2 4.35Å; E111-F199 HydrophobicContact CB-CG 3.66Å; E111-F199 HydrophobicContact CB-CZ 4.32Å; E111-F199 HydrophobicContact CG-CD1 4.08Å; E111-F199 HydrophobicContact CG-CE1 4.06Å; T112-F199 WeakPolarHBondContact OG1-CB 3.49Å; I115-F199 HydrophobicContact CG1-CD2 3.98Å; I115-F199 HydrophobicContact CG1-CE2 4.03Å; L195-F199 HydrophobicContact CD1-CD2 4.08Å; L195-F199 HydrophobicContact CD1-CE2 3.59Å; L195-F199 HydrophobicContact CD1-CZ 4.23Å; L195-F199 HydrophobicContact CD2-CE2 4.3Å; L195-F199 HydrophobicContact CG-CD2 4.09Å; L195-F199 HydrophobicContact CG-CE2 3.77Å; L195-F199 WeakPolarHBondContact O-CD2 3.39Å; L195-F199 PolarHBondContact O-N 3.28Å; L195-F199 VanDerWaalsContact O-N 3.13Å; F199-H201 VanDerWaalsContact C-N 3.3Å; F199-H201 PolarHBondContact O-N 2.89Å; F199-E202 PolarHBondContact O-N 3.44Å
200L97.7Very high97.6Very high35 Ų3548.6 Ų48.618%0.18329%0.285CS..Hα-helixtrans-63-37.8173.5178.864.6000111.7T112 H196 L197 L198 E202 T203 G204T112-L200 HydrophobicContact CG2-CB 4.22Å; T112-L200 PolarHBondContact OG1-N 3.34Å; H196-L200 WeakPolarHBondContact O-CB 3.38Å; H196-L200 PolarHBondContact O-N 2.98Å; L197-L200 HydrophobicContact CD2-CD2 4.14Å; L197-L200 WeakPolarHBondContact O-CB 3.43Å; L197-L200 PolarHBondContact O-N 2.6Å; L198-L200 VanDerWaalsContact C-N 3.29Å; L198-L200 PolarHBondContact O-N 3.03Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 3.35Å; L200-T203 PolarHBondContact O-N 3.42Å; L200-T203 PolarHBondContact O-OG1 3.31Å; L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.38Å; L200-G204 PolarHBondContact O-N 3.44Å
201H96.4Very high97.5Very high64 Ų6451.7 Ų51.730%0.29630%0.295SS..Hα-helixtrans-73.9-22.3-178.3-70.3177.4000113.4L197 L198 F199 T203L197-H201 WeakPolarHBondContact O-CB 3.36Å; L197-H201 PolarHBondContact O-CD2 3.33Å; L197-H201 PolarHBondContact O-N 2.97Å; L198-H201 PolarHBondContact O-N 3.39Å; F199-H201 VanDerWaalsContact C-N 3.3Å; F199-H201 PolarHBondContact O-N 2.89Å; H201-T203 VanDerWaalsContact C-N 3.32Å; H201-T203 PolarHBondContact O-N 2.74Å
202E95.8Very high97.4Very high151 Ų15153.2 Ų53.271%0.70630%0.298SS*.Hα-helixtrans-63.2-37.9172.2-67.1-59.513200112.2L198 F199 L200L198-E202 PolarHBondContact O-N 2.96Å; F199-E202 PolarHBondContact O-N 3.44Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 3.35Å
203T94.1Very high97.3Very high71 Ų7152.5 Ų52.544%0.43630%0.295SS..Hα-helixtrans-100.8-28.3-17854.30000113.1Y109 L200 H201Y109-T203 HydrophobicContact CD1-CG2 4.14Å; Y109-T203 HydrophobicContact CE1-CG2 4.45Å; L200-T203 PolarHBondContact O-N 3.42Å; L200-T203 PolarHBondContact O-OG1 3.31Å; H201-T203 VanDerWaalsContact C-N 3.32Å; H201-T203 PolarHBondContact O-N 2.74Å
204G95Very high97.1Very high11 Ų1158 Ų5811%0.11332%0.316CS..  trans79.1169.1-166.500000112.6L200L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.38Å; L200-G204 PolarHBondContact O-N 3.44Å
205S96.9Very high97Very high30 Ų3060.7 Ų60.721%0.2133%0.331CS..  trans-66.4140.1178.2-73.20000112.5P24P24-S205 VanDerWaalsContact CG-O 3.24Å; P24-S205 WeakPolarHBondContact CG-O 3.41Å
206N97.9Very high96.9Very high6 Ų661.7 Ų61.73%0.03234%0.337CS..  trans-65.6175.2159.7-171.223.7000110.1I27 W31 Y104 Y109 Q313I27-N206 WeakPolarHBondContact CG2-O 3.46Å; W31-N206 VanDerWaalsContact CE2-O 3.26Å; W31-N206 HydrophobicContact CZ2-CB 4.31Å; W31-N206 VanDerWaalsContact CZ2-O 3.26Å; W31-N206 WeakPolarHBondContact CZ2-O 3.46Å; W31-N206 PolarHBondContact NE1-O 2.95Å; Y104-N206 PolarHBondContact O-ND2 2.89Å; Y109-N206 HydrophobicContact CE2-CB 3.67Å; N206-Q313 PolarHBondContact ND2-NE2 3.4Å
207N98.6Very high96.9Very high5 Ų563.5 Ų63.53%0.02734%0.344CS..  trans-139.5167.8174.469.885.2000112.7P24 N26 I27 L209 G210 I211P24-N207 HydrophobicContact CB-CB 3.86Å; P24-N207 HydrophobicContact CG-CB 4.19Å; N26-N207 PolarHBondContact ND2-OD1 3.47Å; N26-N207 WeakPolarHBondContact OD1-CB 3.25Å; I27-N207 HydrophobicContact CG2-CB 4.14Å; N207-L209 PolarHBondContact O-N 2.76Å; N207-L209 VanDerWaalsContact O-N 3.14Å; N207-L209 WeakPolarHBondContact OD1-CB 3.36Å; N207-L209 PolarHBondContact OD1-N 2.77Å; N207-L209 VanDerWaalsContact OD1-N 3.1Å; N207-G210 PolarHBondContact O-N 3.44Å; N207-I211 PolarHBondContact ND2-O 2.94Å
208P98.6Very high96.9Very high14 Ų1461.9 Ų61.99%0.09134%0.336CS..THydrogen-bonded Turntrans-56.7-32.1-174.1-30.137.6000115.6N26 W31 Y104 G210 S314 M316N26-P208 VanDerWaalsContact O-CD 3.24Å; N26-P208 WeakPolarHBondContact O-CD 3.39Å; N26-P208 WeakPolarHBondContact O-CG 3.43Å; W31-P208 HydrophobicContact CH2-CG 4.08Å; W31-P208 HydrophobicContact CZ3-CG 3.85Å; Y104-P208 VanDerWaalsContact CD1-CA 3.49Å; Y104-P208 HydrophobicContact CD1-CB 4.2Å; Y104-P208 WeakPolarHBondContact CD1-O 3.48Å; Y104-P208 VanDerWaalsContact CE1-CA 3.49Å; Y104-P208 HydrophobicContact CE1-CB 3.66Å; Y104-P208 HydrophobicContact CE1-CG 4.39Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.45Å; P208-S314 WeakPolarHBondContact O-CB 3.38Å; P208-S314 PolarHBondContact O-OG 3.19Å; P208-M316 HydrophobicContact CB-SD 4.26Å
209L98.1Very high96.9Very high56 Ų5660.1 Ų60.129%0.29333%0.329SS..THydrogen-bonded Turntrans-75.2-19.9-178.3-59.9171.1000112.3N26 N207 I211 M316 F317N26-L209 WeakPolarHBondContact ND2-CD1 3.41Å; N207-L209 PolarHBondContact O-N 2.76Å; N207-L209 VanDerWaalsContact O-N 3.14Å; N207-L209 WeakPolarHBondContact OD1-CB 3.36Å; N207-L209 PolarHBondContact OD1-N 2.77Å; N207-L209 VanDerWaalsContact OD1-N 3.1Å; L209-I211 HydrophobicContact CB-CD1 4.22Å; L209-I211 HydrophobicContact CB-CG1 3.82Å; L209-I211 HydrophobicContact CD1-CD1 4.1Å; L209-I211 HydrophobicContact CD1-CG1 4.38Å; L209-I211 PolarHBondContact O-N 2.92Å; L209-M316 HydrophobicContact CD2-CE 3.81Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; L209-M316 HydrophobicContact CG-SD 4.5Å; L209-F317 HydrophobicContact CD2-CE2 4.02Å; L209-F317 HydrophobicContact CD2-CZ 3.65Å
210G97.1Very high96.9Very high12 Ų1258.1 Ų58.112%0.12432%0.32CS..  trans63.727.1-176.500000113.8N207 P208N207-G210 PolarHBondContact O-N 3.44Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 3.45Å
211I96.4Very high96.9Very high104 Ų10461 Ų6153%0.53333%0.332SS..SBendtrans-117.2162.5173.263.5176.9000109.5N207 L209 S213N207-I211 PolarHBondContact ND2-O 2.94Å; L209-I211 HydrophobicContact CB-CD1 4.22Å; L209-I211 HydrophobicContact CB-CG1 3.82Å; L209-I211 HydrophobicContact CD1-CD1 4.1Å; L209-I211 HydrophobicContact CD1-CG1 4.38Å; L209-I211 PolarHBondContact O-N 2.92Å; I211-S213 PolarHBondContact O-N 2.91Å
212T96.2Very high97Very high99 Ų9961 Ų6161%0.60734%0.338SS*.  trans-58.8134.8176.6179.70000111.8H214T212-H214 PolarHBondContact OG1-CD2 2.92Å; T212-H214 PolarHBondContact OG1-N 2.71Å
213S96.3Very high97.1Very high16 Ų1660.2 Ų60.211%0.11233%0.33CS..  trans-105.713.4178.379.90000112.7P24 I211 S215 D216 K217P24-S213 WeakPolarHBondContact CB-OG 3.19Å; P24-S213 WeakPolarHBondContact CG-OG 3.39Å; I211-S213 PolarHBondContact O-N 2.91Å; S213-S215 PolarHBondContact O-N 3.48Å; S213-D216 CarbonylContact O-C 3.56Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 2.79Å; S213-K217 VanDerWaalsContact O-CG 3.26Å; S213-K217 WeakPolarHBondContact O-CG 3.31Å
214H94.9Very high97.3Very high144 Ų14457.2 Ų57.267%0.66731%0.31SS*.THydrogen-bonded Turntrans-58.9-30.4-176.8-72.7-60.5000113.1T212 D216T212-H214 PolarHBondContact OG1-CD2 2.92Å; T212-H214 PolarHBondContact OG1-N 2.71Å; H214-D216 VanDerWaalsContact C-N 3.26Å; H214-D216 PolarHBondContact O-N 3.35Å
215S96.3Very high97.5Very high120 Ų12059 Ų5984%0.83932%0.319SS*.THydrogen-bonded Turntrans-70.3-20.5177.155.40000113.8S213S213-S215 PolarHBondContact O-N 3.48Å
216D97.3Very high97.5Very high84 Ų8463.1 Ų63.145%0.44934%0.338SS..SBendtrans-145.985.1-177.3-172.717.2000111.3S25 S213 H214S25-D216 VanDerWaalsContact CB-OD2 3.28Å; S25-D216 WeakPolarHBondContact CB-OD2 3.43Å; S25-D216 PolarHBondContact N-O 3.42Å; S25-D216 PolarHBondContact OG-OD2 3.46Å; S213-D216 CarbonylContact O-C 3.56Å; S213-D216 VanDerWaalsContact O-C 3.25Å; S213-D216 PolarHBondContact O-N 2.79Å; H214-D216 VanDerWaalsContact C-N 3.26Å; H214-D216 PolarHBondContact O-N 3.35Å
217K97.8Very high97.6Very high69 Ų6965.2 Ų65.230%0.335%0.347SS..EExtended strand (participates in β ladder)trans-115.5140.4170.7-64-165.1176.2-1710109.8P22 T23 S213P22-K217 HydrophobicContact CB-CB 4.16Å; P22-K217 HydrophobicContact CB-CD 3.65Å; T23-K217 WeakPolarHBondContact O-CA 3.32Å; S213-K217 VanDerWaalsContact O-CG 3.26Å; S213-K217 WeakPolarHBondContact O-CG 3.31Å
218I98.1Very high97.6Very high41 Ų4166.5 Ų66.521%0.2135%0.353CS..EExtended strand (participates in β ladder)trans-111.1158.1170.863.1-177.6000109.5T23 Y223 Y224T23-I218 PolarHBondContact N-O 3.02Å; T23-I218 PolarHBondContact O-N 2.69Å; I218-Y223 HydrophobicContact CB-CD2 4.02Å; I218-Y223 HydrophobicContact CB-CE2 4.18Å; I218-Y223 HydrophobicContact CD1-CD1 4.3Å; I218-Y223 HydrophobicContact CD1-CD2 3.8Å; I218-Y223 HydrophobicContact CD1-CE2 4.49Å; I218-Y223 HydrophobicContact CD1-CG 3.69Å; I218-Y223 HydrophobicContact CG1-CD2 4.14Å; I218-Y223 HydrophobicContact CG1-CG 4.49Å; I218-Y224 HydrophobicContact CD1-CD2 4.49Å; I218-Y224 HydrophobicContact CD1-CE2 3.68Å; I218-Y224 HydrophobicContact CG1-CD2 4.47Å; I218-Y224 HydrophobicContact CG1-CE2 3.72Å
219T97.4Very high97.6Very high60 Ų6068.3 Ų68.337%0.36837%0.37SS..EExtended strand (participates in β ladder)trans-68.7145172.350.80000110.3H221 Y223T219-H221 WeakPolarHBondContact CB-O 3.44Å; T219-H221 PolarHBondContact O-N 2.99Å; T219-H221 PolarHBondContact OG1-O 3.39Å; T219-Y223 WeakPolarHBondContact O-CD2 3.28Å
220F98.3Very high97.6Very high29 Ų2970.5 Ų70.513%0.12738%0.381CS..SBendtrans-60.4-44.7179.5-170.8-82.5000112.2F18 I19 L21 P222 Y223 Y224 T225F18-F220 WeakPolarHBondContact O-CD1 3.48Å; I19-F220 PolarHBondContact O-N 3.32Å; L21-F220 HydrophobicContact CB-CB 3.93Å; L21-F220 HydrophobicContact CD2-CD2 4.22Å; L21-F220 PolarHBondContact O-N 3.38Å; F220-P222 CarbonylContact O-C 2.92Å; F220-Y223 PolarHBondContact O-N 2.88Å; F220-Y224 VanDerWaalsContact CD2-CB 3.49Å; F220-Y224 HydrophobicContact CD2-CD2 4.18Å; F220-Y224 HydrophobicContact CD2-CG 4.16Å; F220-Y224 HydrophobicContact CE2-CG 4.23Å; F220-Y224 WeakPolarHBondContact O-CA 3.39Å; F220-Y224 PolarHBondContact O-N 3.49Å; F220-T225 HydrophobicContact CD1-CG2 3.67Å; F220-T225 HydrophobicContact CE1-CG2 3.67Å; F220-T225 PolarHBondContact O-N 3.42Å
221H97.9Very high97.7Very high94 Ų9470.5 Ų70.544%0.43538%0.382SS..THydrogen-bonded Turntrans-89.6134.1169.1-174.671.2000110.6I19 T219 T225I19-H221 HydrophobicContact CG2-CB 4.12Å; I19-H221 PolarHBondContact O-N 3.37Å; T219-H221 WeakPolarHBondContact CB-O 3.44Å; T219-H221 PolarHBondContact O-N 2.99Å; T219-H221 PolarHBondContact OG1-O 3.39Å; H221-T225 HydrophobicContact CB-CG2 3.96Å; H221-T225 PolarHBondContact ND1-OG1 2.8Å
222P97.9Very high97.8Very high66 Ų6668.8 Ų68.843%0.42937%0.373SS..THydrogen-bonded Turncis-88.7-15.52.135.2-35.3000114.8F220 Y224 T225 I226F220-P222 CarbonylContact O-C 2.92Å; P222-Y224 PolarHBondContact O-N 3.17Å; P222-T225 VanDerWaalsContact C-OG1 3.27Å; P222-T225 WeakPolarHBondContact CA-OG1 3.2Å; P222-T225 PolarHBondContact O-N 2.84Å; P222-T225 PolarHBondContact O-OG1 3.29Å; P222-I226 WeakPolarHBondContact O-CG2 3.31Å; P222-I226 PolarHBondContact O-N 3.45Å
223Y98.4Very high97.9Very high133 Ų13369.3 Ų69.352%0.52237%0.371SS..Hα-helixtrans-58.2-54.2-164-61.3-76.2000114.3I218 T219 F220 I226 K227I218-Y223 HydrophobicContact CB-CD2 4.02Å; I218-Y223 HydrophobicContact CB-CE2 4.18Å; I218-Y223 HydrophobicContact CD1-CD1 4.3Å; I218-Y223 HydrophobicContact CD1-CD2 3.8Å; I218-Y223 HydrophobicContact CD1-CE2 4.49Å; I218-Y223 HydrophobicContact CD1-CG 3.69Å; I218-Y223 HydrophobicContact CG1-CD2 4.14Å; I218-Y223 HydrophobicContact CG1-CG 4.49Å; T219-Y223 WeakPolarHBondContact O-CD2 3.28Å; F220-Y223 PolarHBondContact O-N 2.88Å; Y223-I226 VanDerWaalsContact O-CG2 3.27Å; Y223-I226 WeakPolarHBondContact O-CG2 3.02Å; Y223-K227 WeakPolarHBondContact O-CB 3.39Å; Y223-K227 PolarHBondContact O-N 2.89Å
224Y98.3Very high98Very high8 Ų873.4 Ų73.43%0.03139%0.392CS..Hα-helixtrans-83-25.6-179.6-66.5-60.5000112.3T23 P24 S25 I27 I218 F220 P222 I226 K227 D228T23-Y224 HydrophobicContact CG2-CD2 3.48Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.48Å; T23-Y224 HydrophobicContact CG2-CE2 3.28Å; T23-Y224 HydrophobicContact CG2-CG 4.32Å; P24-Y224 PolarHBondContact O-OH 2.91Å; S25-Y224 VanDerWaalsContact C-OH 3.26Å; S25-Y224 PolarHBondContact O-OH 3.38Å; I27-Y224 HydrophobicContact CD1-CD1 3.83Å; I27-Y224 HydrophobicContact CD1-CD2 4.47Å; I27-Y224 HydrophobicContact CD1-CE1 3.54Å; I27-Y224 HydrophobicContact CD1-CE2 4.17Å; I27-Y224 HydrophobicContact CD1-CG 4.32Å; I27-Y224 HydrophobicContact CG1-CD1 4.02Å; I27-Y224 HydrophobicContact CG1-CE1 3.21Å; I27-Y224 HydrophobicContact CG1-CE2 4.17Å; I27-Y224 VanDerWaalsContact CG1-OH 3.25Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.31Å; I218-Y224 HydrophobicContact CD1-CD2 4.49Å; I218-Y224 HydrophobicContact CD1-CE2 3.68Å; I218-Y224 HydrophobicContact CG1-CD2 4.47Å; I218-Y224 HydrophobicContact CG1-CE2 3.72Å; F220-Y224 VanDerWaalsContact CD2-CB 3.49Å; F220-Y224 HydrophobicContact CD2-CD2 4.18Å; F220-Y224 HydrophobicContact CD2-CG 4.16Å; F220-Y224 HydrophobicContact CE2-CG 4.23Å; F220-Y224 WeakPolarHBondContact O-CA 3.39Å; F220-Y224 PolarHBondContact O-N 3.49Å; P222-Y224 PolarHBondContact O-N 3.17Å; Y224-I226 PolarHBondContact O-N 2.8Å; Y224-K227 HydrophobicContact CD1-CD 3.78Å; Y224-K227 HydrophobicContact CE1-CD 3.96Å; Y224-K227 PolarHBondContact O-N 3.05Å; Y224-D228 WeakPolarHBondContact O-CB 3.43Å; Y224-D228 VanDerWaalsContact O-CG 3.3Å; Y224-D228 PolarHBondContact O-N 3.29Å
225T98.3Very high98.2Very high48 Ų4866.9 Ų66.929%0.29436%0.361SS..Hα-helixtrans-60.8-44170.353.30000112.5F220 H221 P222 A229F220-T225 HydrophobicContact CD1-CG2 3.67Å; F220-T225 HydrophobicContact CE1-CG2 3.67Å; F220-T225 PolarHBondContact O-N 3.42Å; H221-T225 HydrophobicContact CB-CG2 3.96Å; H221-T225 PolarHBondContact ND1-OG1 2.8Å; P222-T225 VanDerWaalsContact C-OG1 3.27Å; P222-T225 WeakPolarHBondContact CA-OG1 3.2Å; P222-T225 PolarHBondContact O-N 2.84Å; P222-T225 PolarHBondContact O-OG1 3.29Å; T225-A229 WeakPolarHBondContact O-CB 3.49Å; T225-A229 PolarHBondContact O-N 3.05Å
226I98.4Very high98.3Very high118 Ų11864.8 Ų64.861%0.60534%0.34SS*.Hα-helixtrans-74.1-36.7179.5-168.359.9000111.7P222 Y223 Y224 A229 L230P222-I226 WeakPolarHBondContact O-CG2 3.31Å; P222-I226 PolarHBondContact O-N 3.45Å; Y223-I226 VanDerWaalsContact O-CG2 3.27Å; Y223-I226 WeakPolarHBondContact O-CG2 3.02Å; Y224-I226 PolarHBondContact O-N 2.8Å; I226-A229 PolarHBondContact O-N 3.3Å; I226-L230 PolarHBondContact O-N 3Å
227K98.6Very high98.4Very high50 Ų5066 Ų6622%0.21735%0.346CS..Hα-helixtrans-64.1-41.7175.6-171-166.9172-156.40111.5I27 S28 N32 Y223 Y224 L230 G231I27-K227 PolarHBondContact O-NZ 2.85Å; S28-K227 PolarHBondContact O-NZ 3Å; N32-K227 PolarHBondContact ND2-O 3Å; N32-K227 VanDerWaalsContact ND2-O 3.13Å; N32-K227 WeakPolarHBondContact OD1-CE 3.48Å; N32-K227 PolarHBondContact OD1-NZ 3.38Å; Y223-K227 WeakPolarHBondContact O-CB 3.39Å; Y223-K227 PolarHBondContact O-N 2.89Å; Y224-K227 HydrophobicContact CD1-CD 3.78Å; Y224-K227 HydrophobicContact CE1-CD 3.96Å; Y224-K227 PolarHBondContact O-N 3.05Å; K227-L230 PolarHBondContact O-N 3.15Å; K227-G231 PolarHBondContact O-N 3.41Å
228D98.6Very high98.4Very high31 Ų3165 Ų6517%0.16635%0.348CS..Hα-helixtrans-69.5-36.9176.9-78.111.8000111.7N32 S35 Y224 L230 G231 L232N32-D228 PolarHBondContact ND2-OD1 2.89Å; N32-D228 VanDerWaalsContact ND2-OD1 3.1Å; S35-D228 WeakPolarHBondContact CB-OD2 3.14Å; S35-D228 PolarHBondContact OG-OD2 2.94Å; Y224-D228 WeakPolarHBondContact O-CB 3.43Å; Y224-D228 VanDerWaalsContact O-CG 3.3Å; Y224-D228 PolarHBondContact O-N 3.29Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 3.12Å; D228-G231 PolarHBondContact O-N 3.41Å; D228-L232 WeakPolarHBondContact O-CB 2.95Å; D228-L232 PolarHBondContact O-N 2.99Å
229A98.6Very high98.4Very high53 Ų5363.1 Ų63.144%0.43834%0.339SS..Hα-helixtrans-60.5-41171.700000112.2T225 I226 L232 L233T225-A229 WeakPolarHBondContact O-CB 3.49Å; T225-A229 PolarHBondContact O-N 3.05Å; I226-A229 PolarHBondContact O-N 3.3Å; A229-L232 PolarHBondContact O-N 2.92Å; A229-L233 PolarHBondContact O-N 3.49Å
230L98.7Very high98.5Very high101 Ų10163.2 Ų63.253%0.52934%0.336SS..Hα-helixtrans-63-45.2172.8176.662.8000111.7I226 K227 D228 L232 L233 L234I226-L230 PolarHBondContact O-N 3Å; K227-L230 PolarHBondContact O-N 3.15Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 3.12Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.08Å; L230-L233 WeakPolarHBondContact O-CB 3.46Å; L230-L233 PolarHBondContact O-N 2.69Å; L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 2.69Å; L230-L234 VanDerWaalsContact O-N 3.08Å
231G98.7Very high98.5Very high13 Ų1365 Ų6513%0.13435%0.349CS..Hα-helixtrans-57.7-44.6175.400000112.2K227 D228 L234 F235K227-G231 PolarHBondContact O-N 3.41Å; D228-G231 PolarHBondContact O-N 3.41Å; G231-L234 PolarHBondContact O-N 2.91Å; G231-F235 WeakPolarHBondContact O-CB 3.44Å; G231-F235 PolarHBondContact O-N 3.14Å
232L98.8Very high98.5Very high67 Ų6761.7 Ų61.735%0.35133%0.334SS..Hα-helixtrans-63.2-40.7176.5-178.962.3000112L36 A39 D228 A229 L230 F235 L236L36-L232 HydrophobicContact CD2-CB 4.49Å; A39-L232 HydrophobicContact CB-CD1 3.74Å; D228-L232 WeakPolarHBondContact O-CB 2.95Å; D228-L232 PolarHBondContact O-N 2.99Å; A229-L232 PolarHBondContact O-N 2.92Å; L230-L232 VanDerWaalsContact C-N 3.31Å; L230-L232 PolarHBondContact O-N 3.08Å; L232-F235 HydrophobicContact CD1-CD1 4.19Å; L232-F235 WeakPolarHBondContact O-CB 3.42Å; L232-F235 PolarHBondContact O-N 3.15Å; L232-L236 HydrophobicContact CD1-CD1 4.29Å; L232-L236 HydrophobicContact CD1-CG 4.17Å; L232-L236 HydrophobicContact CG-CD1 4.07Å; L232-L236 HydrophobicContact CG-CG 4.37Å; L232-L236 WeakPolarHBondContact O-CB 3.47Å; L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 3.27Å; L232-L236 PolarHBondContact O-N 3.49Å
233L98.8Very high98.6Very high110 Ų11058.5 Ų58.558%0.57631%0.314SS*.Hα-helixtrans-60.4-46.2176.3178.865000111.6A229 L230 L236 L237A229-L233 PolarHBondContact O-N 3.49Å; L230-L233 WeakPolarHBondContact O-CB 3.46Å; L230-L233 PolarHBondContact O-N 2.69Å; L233-L236 PolarHBondContact O-N 3.32Å; L233-L237 WeakPolarHBondContact O-CB 3.39Å; L233-L237 PolarHBondContact O-N 3.42Å
234L98.7Very high98.6Very high102 Ų10256 Ų5653%0.53431%0.309SS..Hα-helixtrans-65.5-40.4177.6-65.5176.4000111.8L230 G231 L237 S238L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 2.69Å; L230-L234 VanDerWaalsContact O-N 3.08Å; G231-L234 PolarHBondContact O-N 2.91Å; L234-L237 PolarHBondContact O-N 3.32Å; L234-S238 PolarHBondContact O-N 3.3Å; L234-S238 PolarHBondContact O-OG 3.43Å
235F98.6Very high98.6Very high8 Ų863.3 Ų63.34%0.03534%0.341CS..Hα-helixtrans-57.9-52.3173169-90.1000111.3L36 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 4.4Å; L36-F235 HydrophobicContact CD2-CG 4.04Å; C40-F235 WeakPolarHBondContact SG-CE2 3.43Å; C40-F235 WeakPolarHBondContact SG-CZ 3.43Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.07Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.96Å; M89-F235 HydrophobicContact CG-CE2 4.41Å; G231-F235 WeakPolarHBondContact O-CB 3.44Å; G231-F235 PolarHBondContact O-N 3.14Å; L232-F235 HydrophobicContact CD1-CD1 4.19Å; L232-F235 WeakPolarHBondContact O-CB 3.42Å; L232-F235 PolarHBondContact O-N 3.15Å; F235-L237 VanDerWaalsContact C-N 3.32Å; F235-L237 PolarHBondContact O-N 3.28Å; F235-S238 PolarHBondContact O-N 2.94Å; F235-S238 PolarHBondContact O-OG 3.4Å; F235-L239 HydrophobicContact CE1-CD2 4.08Å; F235-L239 HydrophobicContact CZ-CD2 4.34Å; F235-L239 PolarHBondContact O-N 2.83Å
236L98.6Very high98.6Very high75 Ų7563.7 Ų63.739%0.39335%0.346SS..Hα-helixtrans-62.4-40.3179.8-71.2174000111.3L232 L233 S238 L239 M240L232-L236 HydrophobicContact CD1-CD1 4.29Å; L232-L236 HydrophobicContact CD1-CG 4.17Å; L232-L236 HydrophobicContact CG-CD1 4.07Å; L232-L236 HydrophobicContact CG-CG 4.37Å; L232-L236 WeakPolarHBondContact O-CB 3.47Å; L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 3.27Å; L232-L236 PolarHBondContact O-N 3.49Å; L233-L236 PolarHBondContact O-N 3.32Å; L236-S238 VanDerWaalsContact C-N 3.34Å; L236-S238 PolarHBondContact O-N 3.34Å; L236-L239 PolarHBondContact O-N 3.21Å; L236-M240 VanDerWaalsContact O-CB 3.26Å; L236-M240 WeakPolarHBondContact O-CB 3.49Å; L236-M240 WeakPolarHBondContact O-CG 3.39Å; L236-M240 PolarHBondContact O-N 3.23Å
237L98.7Very high98.6Very high109 Ų10959.7 Ų59.757%0.57133%0.327SS*.Hα-helixtrans-58-47.1174.8-179.164.6000111.3L233 L234 F235 T241L233-L237 WeakPolarHBondContact O-CB 3.39Å; L233-L237 PolarHBondContact O-N 3.42Å; L234-L237 PolarHBondContact O-N 3.32Å; F235-L237 VanDerWaalsContact C-N 3.32Å; F235-L237 PolarHBondContact O-N 3.28Å; L237-T241 WeakPolarHBondContact O-CB 3.34Å; L237-T241 PolarHBondContact O-N 3.35Å; L237-T241 PolarHBondContact O-OG1 3.43Å
238S98.5Very high98.5Very high50 Ų5060.8 Ų60.835%0.3534%0.336SS..Hα-helixtrans-64.7-45.5178.668.10000112.6M89 L234 F235 L236 T241 L242M89-S238 WeakPolarHBondContact CE-OG 3.43Å; L234-S238 PolarHBondContact O-N 3.3Å; L234-S238 PolarHBondContact O-OG 3.43Å; F235-S238 PolarHBondContact O-N 2.94Å; F235-S238 PolarHBondContact O-OG 3.4Å; L236-S238 VanDerWaalsContact C-N 3.34Å; L236-S238 PolarHBondContact O-N 3.34Å; S238-T241 PolarHBondContact O-N 3.01Å; S238-L242 PolarHBondContact O-N 3.24Å
239L98.8Very high98.5Very high1 Ų165.3 Ų65.31%0.00536%0.359CS..Hα-helixtrans-63-44.8178.3173.964.2000111.6L43 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 3.93Å; L82-L239 HydrophobicContact CD2-CG 4.06Å; N85-L239 HydrophobicContact CB-CD1 3.9Å; M89-L239 HydrophobicContact CG-CB 4.35Å; M89-L239 HydrophobicContact CG-CD1 3.9Å; F235-L239 HydrophobicContact CE1-CD2 4.08Å; F235-L239 HydrophobicContact CZ-CD2 4.34Å; F235-L239 PolarHBondContact O-N 2.83Å; L236-L239 PolarHBondContact O-N 3.21Å; L239-L242 PolarHBondContact O-N 3.37Å; L239-T243 WeakPolarHBondContact O-CB 3.33Å; L239-T243 PolarHBondContact O-N 2.91Å; L239-T243 PolarHBondContact O-OG1 3Å
240M98.6Very high98.5Very high62 Ų6265.5 Ų65.531%0.30535%0.352SS..Hα-helixtrans-68.5-37.2178.8-68.5-56.5-59.700111.4I78 L82 L236 T243 L244I78-M240 HydrophobicContact CD1-CE 4.23Å; L82-M240 HydrophobicContact CD2-SD 3.85Å; L236-M240 VanDerWaalsContact O-CB 3.26Å; L236-M240 WeakPolarHBondContact O-CB 3.49Å; L236-M240 WeakPolarHBondContact O-CG 3.39Å; L236-M240 PolarHBondContact O-N 3.23Å; M240-T243 PolarHBondContact O-N 3.04Å; M240-L244 HydrophobicContact CE-CD1 3.69Å; M240-L244 HydrophobicContact CE-CD2 4.22Å; M240-L244 HydrophobicContact CE-CG 3.93Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.43Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.46Å; M240-L244 PolarHBondContact O-N 3.38Å
241T98.7Very high98.4Very high67 Ų6762.6 Ų62.641%0.41135%0.347SS..Hα-helixtrans-61.3-48.3175.1-57.70000110.4L237 S238 F245L237-T241 WeakPolarHBondContact O-CB 3.34Å; L237-T241 PolarHBondContact O-N 3.35Å; L237-T241 PolarHBondContact O-OG1 3.43Å; S238-T241 PolarHBondContact O-N 3.01Å; T241-F245 HydrophobicContact CG2-CD2 4.07Å; T241-F245 WeakPolarHBondContact O-CB 3.43Å; T241-F245 WeakPolarHBondContact O-CD2 3.31Å; T241-F245 PolarHBondContact O-N 3.46Å
242L98.4Very high98.3Very high23 Ų2363.1 Ų63.112%0.1235%0.347CS..Hα-helixtrans-60.4-50.1175.8-18062.7000111.2N85 S238 L239 L244 S246 P247 L249 L250N85-L242 HydrophobicContact CB-CD2 3.78Å; N85-L242 HydrophobicContact CB-CG 4.21Å; N85-L242 WeakPolarHBondContact OD1-CD2 3.27Å; S238-L242 PolarHBondContact O-N 3.24Å; L239-L242 PolarHBondContact O-N 3.37Å; L242-L244 PolarHBondContact O-N 3.09Å; L242-S246 WeakPolarHBondContact CD1-O 3.4Å; L242-S246 CarbonylContact O-C 3.46Å; L242-S246 WeakPolarHBondContact O-CA 3.29Å; L242-S246 PolarHBondContact O-N 3.01Å; L242-P247 WeakPolarHBondContact O-CA 3.17Å; L242-L249 HydrophobicContact CD1-CB 3.99Å; L242-L249 HydrophobicContact CD1-CD2 4.07Å; L242-L250 HydrophobicContact CD1-CG 4.45Å; L242-L250 HydrophobicContact CD2-CD1 3.68Å; L242-L250 HydrophobicContact CD2-CG 4.34Å
243T98.3Very high98.2Very high0 Ų064.5 Ų64.50%036%0.36CS..Hα-helixtrans-65.1-37.1-175.6-61.50000113.4I78 L82 L239 M240 P247I78-T243 HydrophobicContact CG1-CG2 4.25Å; L82-T243 HydrophobicContact CD2-CG2 4.19Å; L82-T243 HydrophobicContact CG-CG2 4.19Å; L239-T243 WeakPolarHBondContact O-CB 3.33Å; L239-T243 PolarHBondContact O-N 2.91Å; L239-T243 PolarHBondContact O-OG1 3Å; M240-T243 PolarHBondContact O-N 3.04Å; T243-P247 WeakPolarHBondContact O-CB 3.2Å
244L98.6Very high98.1Very high80 Ų8062 Ų6242%0.41935%0.347SS..Hα-helixtrans-90.9-33.9-174.9-64.1177.6000113.3W77 I78 M240 L242W77-L244 HydrophobicContact CH2-CD2 3.9Å; W77-L244 HydrophobicContact CZ3-CD2 4.26Å; I78-L244 HydrophobicContact CD1-CD2 4.03Å; M240-L244 HydrophobicContact CE-CD1 3.69Å; M240-L244 HydrophobicContact CE-CD2 4.22Å; M240-L244 HydrophobicContact CE-CG 3.93Å; M240-L244 VanDerWaalsContact O-CB 3.24Å; M240-L244 WeakPolarHBondContact O-CB 3.43Å; M240-L244 VanDerWaalsContact O-CG 3.24Å; M240-L244 WeakPolarHBondContact O-CG 3.46Å; M240-L244 PolarHBondContact O-N 3.38Å; L242-L244 PolarHBondContact O-N 3.09Å
245F98.5Very high98.1Very high161 Ų16158.1 Ų58.171%0.70633%0.327SS*.Hα-helixtrans-107-25.3-174-63.6-74.7000114T241T241-F245 HydrophobicContact CG2-CD2 4.07Å; T241-F245 WeakPolarHBondContact O-CB 3.43Å; T241-F245 WeakPolarHBondContact O-CD2 3.31Å; T241-F245 PolarHBondContact O-N 3.46Å
246S98.3Very high98Very high57 Ų5762.6 Ų62.640%0.39934%0.344SS..  trans-147.554.3-177-55.20000112.2L242 D248 L249L242-S246 WeakPolarHBondContact CD1-O 3.4Å; L242-S246 CarbonylContact O-C 3.46Å; L242-S246 WeakPolarHBondContact O-CA 3.29Å; L242-S246 PolarHBondContact O-N 3.01Å; S246-D248 PolarHBondContact O-N 3Å; S246-D248 VanDerWaalsContact O-N 3.07Å; S246-L249 VanDerWaalsContact O-CB 3.31Å; S246-L249 WeakPolarHBondContact O-CB 3.48Å; S246-L249 PolarHBondContact O-N 3.35Å; S246-L249 VanDerWaalsContact O-N 3.08Å
247P98.1Very high98Very high33 Ų3362.8 Ų62.821%0.21435%0.349CS..THydrogen-bonded Turntrans-60.1-25.9-167.921.1-33.2000114.6Y81 N85 L242 T243Y81-P247 HydrophobicContact CD1-CB 3.56Å; Y81-P247 HydrophobicContact CD2-CB 4.03Å; Y81-P247 HydrophobicContact CE1-CB 3.78Å; Y81-P247 HydrophobicContact CE2-CB 4.23Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; N85-P247 PolarHBondContact ND2-O 3.44Å; N85-P247 PolarHBondContact OD1-O 2.98Å; L242-P247 WeakPolarHBondContact O-CA 3.17Å; T243-P247 WeakPolarHBondContact O-CB 3.2Å
248D98.2Very high97.9Very high73 Ų7362 Ų6239%0.3934%0.344SS..THydrogen-bonded Turntrans-100.82-176.8-63.5-53.2000113.8S246 L250 G251 Y256S246-D248 PolarHBondContact O-N 3Å; S246-D248 VanDerWaalsContact O-N 3.07Å; D248-L250 PolarHBondContact O-N 2.58Å; D248-L250 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact O-N 3.23Å; D248-G251 VanDerWaalsContact O-N 3.15Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.13Å; D248-Y256 PolarHBondContact OD1-OH 2.93Å
249L98.5Very high97.8Very high126 Ų12660.2 Ų60.266%0.6633%0.333SS*.THydrogen-bonded Turntrans-56.6-33.7-173.3178.663.8000113.6L242 S246L242-L249 HydrophobicContact CD1-CB 3.99Å; L242-L249 HydrophobicContact CD1-CD2 4.07Å; S246-L249 VanDerWaalsContact O-CB 3.31Å; S246-L249 WeakPolarHBondContact O-CB 3.48Å; S246-L249 PolarHBondContact O-N 3.35Å; S246-L249 VanDerWaalsContact O-N 3.08Å
250L98Very high97.8Very high57 Ų5763.3 Ų63.330%0.29835%0.349SS..THydrogen-bonded Turntrans-100.1-5.1-175.7-58.7-177.3000113.7L242 D248L242-L250 HydrophobicContact CD1-CG 4.45Å; L242-L250 HydrophobicContact CD2-CD1 3.68Å; L242-L250 HydrophobicContact CD2-CG 4.34Å; D248-L250 PolarHBondContact O-N 2.58Å; D248-L250 VanDerWaalsContact O-N 3.12Å
251G95.8Very high97.6Very high41 Ų4164 Ų6442%0.42336%0.359SS..SBendtrans-97.7170.7-179.400000113D248D248-G251 PolarHBondContact O-N 3.23Å; D248-G251 VanDerWaalsContact O-N 3.15Å
252D97Very high97.5Very high23 Ų2368.6 Ų68.612%0.12338%0.38CS..  trans-101.1129.1175.4-161.9-71.8000111.7M138 D254 N255 K269M138-D252 HydrophobicContact CG-CB 4.09Å; D252-D254 PolarHBondContact O-N 3.35Å; D252-D254 WeakPolarHBondContact OD1-CB 3.33Å; D252-D254 PolarHBondContact OD1-N 2.85Å; D252-N255 WeakPolarHBondContact O-CB 3.48Å; D252-N255 PolarHBondContact O-N 3.48Å; D252-N255 VanDerWaalsContact O-N 3.1Å; D252-K269 WeakPolarHBondContact OD2-CE 3.23Å; D252-K269 IonicContact OD2-NZ 3.58Å; D252-K269 PolarHBondContact OD2-NZ 3.11Å
253P97.1Very high97.4Very high96 Ų9671.9 Ų71.962%0.62340%0.398SS*.G310 helixtrans-62-27-177.825.6-35.7000113.5N255 Y256P253-N255 PolarHBondContact O-N 3.14Å; P253-N255 VanDerWaalsContact O-N 3.14Å; P253-Y256 WeakPolarHBondContact O-CB 3.28Å; P253-Y256 PolarHBondContact O-N 3.15Å
254D96.8Very high97.2Very high57 Ų5775.4 Ų75.431%0.30542%0.419SS..G310 helixtrans-63.6-22.5178.9-76.9-10.7000111.4Q137 M138 D252 Y256 T257Q137-D254 HydrophobicContact CB-CB 4.44Å; Q137-D254 WeakPolarHBondContact CB-O 3.47Å; M138-D254 HydrophobicContact CE-CB 3.53Å; M138-D254 WeakPolarHBondContact CE-OD2 3.49Å; M138-D254 HydrophobicContact CG-CB 3.81Å; D252-D254 PolarHBondContact O-N 3.35Å; D252-D254 WeakPolarHBondContact OD1-CB 3.33Å; D252-D254 PolarHBondContact OD1-N 2.85Å; D254-Y256 PolarHBondContact O-N 2.83Å; D254-T257 PolarHBondContact O-N 3.2Å
255N97.4Very high96.9Very high21 Ų2172.1 Ų72.111%0.11240%0.402CS..G310 helixtrans-73.7-4.9176.7-139.832.6000114.2G136 M138 S139 D252 P253 T257G136-N255 VanDerWaalsContact C-OD1 3.28Å; G136-N255 VanDerWaalsContact CA-OD1 3.24Å; G136-N255 WeakPolarHBondContact CA-OD1 3.31Å; M138-N255 HydrophobicContact CB-CB 4.17Å; M138-N255 PolarHBondContact N-OD1 3.28Å; S139-N255 PolarHBondContact N-OD1 3.06Å; S139-N255 PolarHBondContact OG-ND2 3.44Å; S139-N255 PolarHBondContact OG-OD1 3.24Å; D252-N255 WeakPolarHBondContact O-CB 3.48Å; D252-N255 PolarHBondContact O-N 3.48Å; D252-N255 VanDerWaalsContact O-N 3.1Å; P253-N255 PolarHBondContact O-N 3.14Å; P253-N255 VanDerWaalsContact O-N 3.14Å; N255-T257 VanDerWaalsContact C-N 3.32Å
256Y97.6Very high96.6Very high103 Ų10370.8 Ų70.840%0.40441%0.41SS..G310 helixtrans-87.72167.4-74.6-72.2000113.6F63 R80 Y81 D248 P253 D254F63-Y256 WeakPolarHBondContact CZ-O 3.47Å; R80-Y256 PolarHBondContact NH1-OH 2.94Å; Y81-Y256 PolarHBondContact OH-OH 2.95Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.13Å; D248-Y256 PolarHBondContact OD1-OH 2.93Å; P253-Y256 WeakPolarHBondContact O-CB 3.28Å; P253-Y256 PolarHBondContact O-N 3.15Å; D254-Y256 PolarHBondContact O-N 2.83Å
257T97.8Very high96.3Very high79 Ų7970.3 Ų70.349%0.48540%0.401SS..SBendtrans-104.5133.1170.4-55.50000109.4G136 Q137 D254 N255 A259G136-T257 CarbonylContact C-O 3.54Å; G136-T257 WeakPolarHBondContact CA-O 3.33Å; Q137-T257 HydrophobicContact CG-CG2 4.04Å; Q137-T257 PolarHBondContact N-O 2.73Å; D254-T257 PolarHBondContact O-N 3.2Å; N255-T257 VanDerWaalsContact C-N 3.32Å; T257-A259 PolarHBondContact O-N 3.02Å
258L97.6Very high96Very high91 Ų9170.1 Ų70.148%0.47640%0.398SS..BIsolated β-bridgetrans-54137.8175.8175.965.3000110.7F63 N260F63-L258 HydrophobicContact CB-CD1 3.45Å; F63-L258 VanDerWaalsContact CB-CD1 3.45Å; F63-L258 HydrophobicContact CD1-CB 4.22Å; F63-L258 HydrophobicContact CD1-CD1 4.13Å; F63-L258 HydrophobicContact CD2-CB 4.49Å; F63-L258 HydrophobicContact CD2-CD1 4.24Å; F63-L258 HydrophobicContact CE1-CB 4.35Å; F63-L258 HydrophobicContact CG-CB 4.3Å; F63-L258 HydrophobicContact CG-CD1 3.69Å; L258-N260 PolarHBondContact O-N 2.82Å
259A97Very high95.9Very high14 Ų1469.5 Ų69.512%0.11639%0.392CS..  trans-53.2128.7176.600000112.2W135 F140 T257W135-A259 HydrophobicContact CG-CB 4.44Å; W135-A259 WeakPolarHBondContact O-CB 3.24Å; W135-A259 PolarHBondContact O-N 3.47Å; W135-A259 VanDerWaalsContact O-N 3.12Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.27Å; F140-A259 HydrophobicContact CG-CB 3.94Å; T257-A259 PolarHBondContact O-N 3.02Å
260N96.9Very high95.8Very high65 Ų6564.5 Ų64.535%0.34837%0.367SS..  trans-126.2108.6173.2-177.3-11.4000109.4W141 L258 L262 N263W141-N260 PolarHBondContact NE1-O 2.98Å; L258-N260 PolarHBondContact O-N 2.82Å; N260-L262 PolarHBondContact O-N 3.27Å; N260-L262 WeakPolarHBondContact OD1-CB 3.15Å; N260-L262 PolarHBondContact OD1-N 3.33Å; N260-N263 HydrophobicContact CB-CB 4.17Å; N260-N263 PolarHBondContact O-N 2.73Å; N260-N263 VanDerWaalsContact O-N 3.09Å
261P95.6Very high95.8Very high77 Ų7762.8 Ų62.850%0.536%0.358SS..THydrogen-bonded Turntrans-60.4-16.2178.9-2434000114.8F140 W141F140-P261 HydrophobicContact CE1-CB 4.1Å; F140-P261 HydrophobicContact CE1-CG 4.25Å; F140-P261 HydrophobicContact CE2-CG 4.22Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.78Å; W141-P261 WeakPolarHBondContact CH2-O 3.39Å; W141-P261 WeakPolarHBondContact CZ2-O 3.34Å
262L96.3Very high95.9Very high164 Ų16463.7 Ų63.786%0.85935%0.348SS*.THydrogen-bonded Turntrans-99.4-5.9-179.4-55.5179.4000113.5N260N260-L262 PolarHBondContact O-N 3.27Å; N260-L262 WeakPolarHBondContact OD1-CB 3.15Å; N260-L262 PolarHBondContact OD1-N 3.33Å
263N95.7Very high96Very high92 Ų9263 Ų6349%0.49234%0.344SS..  trans-128.599.8-179.3-174.313.9000111Q137 W141 N260Q137-N263 PolarHBondContact NE2-O 2.91Å; W141-N263 PolarHBondContact NE1-O 3.46Å; W141-N263 VanDerWaalsContact NE1-O 3.08Å; N260-N263 HydrophobicContact CB-CB 4.17Å; N260-N263 PolarHBondContact O-N 2.73Å; N260-N263 VanDerWaalsContact O-N 3.09Å
264T93.6Very high96Very high74 Ų7459.8 Ų59.845%0.45432%0.32SS..  trans-78127.6178.9-48.40000110.8W141 I268W141-T264 HydrophobicContact CD2-CG2 4.21Å; W141-T264 HydrophobicContact CE3-CG2 4.21Å; W141-T264 HydrophobicContact CH2-CG2 4.5Å; W141-T264 VanDerWaalsContact CH2-OG1 3.27Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.46Å; W141-T264 HydrophobicContact CZ2-CG2 4.49Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.36Å; W141-T264 HydrophobicContact CZ3-CG2 4.37Å; T264-I268 HydrophobicContact CG2-CD1 3.41Å; T264-I268 VanDerWaalsContact CG2-CD1 3.41Å; T264-I268 HydrophobicContact CG2-CG1 4.27Å
265P93.6Very high96.1Very high10 Ų1057.9 Ų57.97%0.06531%0.31CS..  trans-57150173.1-28.135.6000112.7Q137 M138 W141 H267 I268Q137-P265 HydrophobicContact CB-CG 3.89Å; M138-P265 HydrophobicContact CE-CB 3.5Å; M138-P265 VanDerWaalsContact CE-CB 3.5Å; M138-P265 HydrophobicContact CE-CG 4.01Å; W141-P265 HydrophobicContact CG-CG 4.39Å; P265-H267 VanDerWaalsContact C-N 3.26Å; P265-H267 PolarHBondContact O-N 2.78Å; P265-I268 HydrophobicContact CB-CG1 4.34Å; P265-I268 HydrophobicContact CG-CG1 4.48Å
266P90.8Very high96.2Very high133 Ų13357.9 Ų57.986%0.86431%0.309SS*.SBendtrans-57.6-35.4-179-25.733.9000114.2
267H92.1Very high96.2Very high47 Ų4753.1 Ų53.122%0.21829%0.291CS..SBendtrans-140.892.9179.3-173.1-144.7000111.7P265 K269 R282 G340 Q341P265-H267 VanDerWaalsContact C-N 3.26Å; P265-H267 PolarHBondContact O-N 2.78Å; H267-K269 PolarHBondContact O-N 3.24Å; H267-R282 PolarHBondContact NE2-NH1 2.9Å; H267-G340 PolarHBondContact CE1-O 3.33Å; H267-G340 VanDerWaalsContact CE1-O 3.23Å; H267-Q341 VanDerWaalsContact CE1-C 3.44Å; H267-Q341 PolarHBondContact CE1-O 3.28Å; H267-Q341 VanDerWaalsContact CE1-O 3.28Å; H267-Q341 PolarHBondContact NE2-O 3.3Å
268I93.6Very high96.3Very high30 Ų3050.8 Ų50.815%0.15427%0.274CS..  trans-74.1121.6175-58161.7000109.6W141 V145 T264 P265 Y278W141-I268 HydrophobicContact CB-CD1 3.71Å; W141-I268 HydrophobicContact CB-CG1 3.89Å; W141-I268 HydrophobicContact CB-CG2 4.12Å; W141-I268 HydrophobicContact CD2-CD1 4.26Å; W141-I268 HydrophobicContact CE3-CD1 4.19Å; W141-I268 HydrophobicContact CG-CD1 4.1Å; W141-I268 HydrophobicContact CG-CG1 4.49Å; V145-I268 HydrophobicContact CG2-CD1 4.27Å; V145-I268 HydrophobicContact CG2-CG2 4.3Å; T264-I268 HydrophobicContact CG2-CD1 3.41Å; T264-I268 VanDerWaalsContact CG2-CD1 3.41Å; T264-I268 HydrophobicContact CG2-CG1 4.27Å; P265-I268 HydrophobicContact CB-CG1 4.34Å; P265-I268 HydrophobicContact CG-CG1 4.48Å; I268-Y278 PolarHBondContact O-OH 3.44Å; I268-Y278 VanDerWaalsContact O-OH 3.1Å
269K94.4Very high96.3Very high59 Ų5946.6 Ų46.626%0.25725%0.252SS..  trans-143.4152.4177.462.4-173.8175.6-175.70109.6D252 H267 L275 Y278D252-K269 WeakPolarHBondContact OD2-CE 3.23Å; D252-K269 IonicContact OD2-NZ 3.58Å; D252-K269 PolarHBondContact OD2-NZ 3.11Å; H267-K269 PolarHBondContact O-N 3.24Å; K269-L275 HydrophobicContact CB-CD2 4.16Å; K269-Y278 HydrophobicContact CB-CE1 4.33Å
270P96.5Very high96.4Very high21 Ų2146 Ų4614%0.13625%0.247CC..  trans-77.7174.4171.435.9-36.8000110.9F274 L275 Y278P270-F274 HydrophobicContact CB-CB 3.8Å; P270-F274 HydrophobicContact CB-CD2 4.15Å; P270-F274 HydrophobicContact CB-CG 4.4Å; P270-F274 HydrophobicContact CG-CB 3.71Å; P270-L275 HydrophobicContact CG-CD2 4.13Å; P270-L275 WeakPolarHBondContact O-CD2 3.47Å; P270-Y278 HydrophobicContact CG-CD2 4.44Å; P270-Y278 HydrophobicContact CG-CG 4.08Å
271E97.7Very high96.5Very high22 Ų2243.8 Ų43.810%0.10324%0.235CC..  trans-57.6156.4171.9-68.9-68.6107.100112.8Y131 Y273 F274Y131-E271 HydrophobicContact CD1-CG 4.21Å; Y131-E271 HydrophobicContact CD2-CG 3.44Å; Y131-E271 VanDerWaalsContact CD2-CG 3.44Å; Y131-E271 HydrophobicContact CE1-CG 4.16Å; Y131-E271 HydrophobicContact CE2-CG 3.37Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.46Å; Y131-E271 HydrophobicContact CG-CG 3.85Å; Y131-E271 PolarHBondContact OH-OE1 3.03Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.57Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.3Å; E271-Y273 PolarHBondContact O-N 3.41Å; E271-F274 PolarHBondContact O-N 3.41Å
272W98.6Very high96.5Very high59 Ų5943 Ų4322%0.22322%0.222CC..G310 helixtrans-53.8-36.7-166.671.6-93.5000114.1S88 F91 I92 F95 F274 L275S88-W272 WeakPolarHBondContact O-CZ2 3.31Å; S88-W272 PolarHBondContact OG-NE1 2.92Å; F91-W272 HydrophobicContact CB-CH2 4.12Å; F91-W272 HydrophobicContact CB-CZ2 4.15Å; I92-W272 HydrophobicContact CD1-CH2 4.48Å; I92-W272 HydrophobicContact CD1-CZ2 4.27Å; I92-W272 HydrophobicContact CG1-CH2 3.54Å; I92-W272 HydrophobicContact CG1-CZ2 3.69Å; F95-W272 HydrophobicContact CD2-CH2 4.19Å; F95-W272 HydrophobicContact CD2-CZ3 4.14Å; F95-W272 HydrophobicContact CE2-CH2 4.03Å; F95-W272 AromaticContact CE2-CZ3 3.84Å; F95-W272 HydrophobicContact CE2-CZ3 3.84Å; W272-F274 PolarHBondContact O-N 3.24Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.44Å; W272-L275 PolarHBondContact O-N 3.45Å; W272-L275 VanDerWaalsContact O-N 3.1Å
273Y98.5Very high96.6Very high9 Ų935.8 Ų35.84%0.03519%0.185CC..G310 helixtrans-70.5-8.2-178.945.8-96.1000113.9F91 F95 A127 E271F91-Y273 HydrophobicContact CB-CD1 4.23Å; F91-Y273 HydrophobicContact CB-CG 3.95Å; 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 3.51Å; F91-Y273 HydrophobicContact CD2-CD2 3.51Å; F91-Y273 HydrophobicContact CD2-CE1 4.09Å; F91-Y273 AromaticContact CD2-CE2 3.77Å; F91-Y273 HydrophobicContact CD2-CE2 3.77Å; F91-Y273 AromaticContact CD2-CG 3.51Å; F91-Y273 HydrophobicContact CD2-CG 3.51Å; F91-Y273 AromaticContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CD2 3.91Å; F91-Y273 HydrophobicContact CE1-CG 4.43Å; F91-Y273 HydrophobicContact CE2-CD1 4.44Å; 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 4.48Å; F91-Y273 AromaticContact CE2-CE2 3.44Å; F91-Y273 HydrophobicContact CE2-CE2 3.44Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.44Å; F91-Y273 AromaticContact CE2-CG 4Å; F91-Y273 HydrophobicContact CE2-CG 4Å; F91-Y273 HydrophobicContact CG-CD1 4.08Å; F91-Y273 AromaticContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CE2 4.48Å; F91-Y273 AromaticContact CG-CG 3.52Å; F91-Y273 HydrophobicContact CG-CG 3.52Å; F91-Y273 AromaticContact CZ-CD2 3.68Å; F91-Y273 HydrophobicContact CZ-CD2 3.68Å; F91-Y273 AromaticContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CE2 3.89Å; F91-Y273 HydrophobicContact CZ-CG 4.43Å; F95-Y273 WeakPolarHBondContact CZ-O 3.4Å; A127-Y273 HydrophobicContact CB-CE2 3.95Å; E271-Y273 HydrophobicContact CB-CD1 4.19Å; E271-Y273 HydrophobicContact CB-CE1 3.57Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.3Å; E271-Y273 PolarHBondContact O-N 3.41Å
274F98.6Very high96.7Very high28 Ų2833.9 Ų33.912%0.12318%0.177CC..G310 helixtrans-103.6-9.5171.3-66.2-59000113.8M124 F128 P270 E271 W272 F276 A277 Y278M124-F274 HydrophobicContact CB-CE1 3.83Å; M124-F274 HydrophobicContact CB-CZ 4.26Å; M124-F274 HydrophobicContact CE-CD1 3.64Å; M124-F274 HydrophobicContact CE-CE1 3.5Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.33Å; F128-F274 HydrophobicContact CB-CE2 4.28Å; F128-F274 HydrophobicContact CB-CZ 4.18Å; P270-F274 HydrophobicContact CB-CB 3.8Å; P270-F274 HydrophobicContact CB-CD2 4.15Å; P270-F274 HydrophobicContact CB-CG 4.4Å; P270-F274 HydrophobicContact CG-CB 3.71Å; E271-F274 PolarHBondContact O-N 3.41Å; W272-F274 PolarHBondContact O-N 3.24Å; F274-F276 VanDerWaalsContact C-N 3.31Å; F274-F276 PolarHBondContact O-N 2.92Å; F274-A277 PolarHBondContact O-N 3.46Å; F274-Y278 WeakPolarHBondContact O-CB 3.46Å; F274-Y278 PolarHBondContact O-N 3.46Å
275L98.7Very high96.8Very high17 Ų1736.3 Ų36.39%0.08919%0.194CC..Hα-helixtrans-63-34.3-169.9-68.7179.1000113.3K269 P270 W272 A277 Y278 T279 T336K269-L275 HydrophobicContact CB-CD2 4.16Å; P270-L275 HydrophobicContact CG-CD2 4.13Å; P270-L275 WeakPolarHBondContact O-CD2 3.47Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.44Å; W272-L275 PolarHBondContact O-N 3.45Å; W272-L275 VanDerWaalsContact O-N 3.1Å; L275-A277 PolarHBondContact O-N 3.31Å; L275-Y278 HydrophobicContact CD2-CD1 4.33Å; L275-Y278 PolarHBondContact O-N 3.28Å; L275-T279 PolarHBondContact O-N 2.79Å; L275-T279 PolarHBondContact O-OG1 3.31Å; L275-T336 HydrophobicContact CB-CG2 4.07Å; L275-T336 WeakPolarHBondContact CB-O 3.5Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å
276F98.8Very high97Very high22 Ų2240.4 Ų40.410%0.09622%0.215CC..Hα-helixtrans-60.5-45.517880.9-83.3000111.8F95 F274 T279 I280 L332 L335F95-F276 HydrophobicContact CE1-CE1 4.42Å; F95-F276 HydrophobicContact CZ-CE1 4.3Å; F274-F276 VanDerWaalsContact C-N 3.31Å; F274-F276 PolarHBondContact O-N 2.92Å; F276-T279 PolarHBondContact O-N 2.96Å; F276-I280 PolarHBondContact O-N 3.06Å; F276-L332 HydrophobicContact CB-CD2 4.25Å; F276-L332 HydrophobicContact CD2-CD2 3.66Å; F276-L332 HydrophobicContact CE2-CD2 4.32Å; F276-L332 HydrophobicContact CG-CD2 4.1Å; F276-L335 HydrophobicContact CB-CB 3.93Å
277A98.6Very high97.2Very high3 Ų338.8 Ų38.83%0.02519%0.194CC..Hα-helixtrans-72.5-37.317900000110.6F274 L275 T279 I280 L281 L294F274-A277 PolarHBondContact O-N 3.46Å; L275-A277 PolarHBondContact O-N 3.31Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.32Å; A277-I280 PolarHBondContact O-N 3.33Å; A277-I280 VanDerWaalsContact O-N 3.12Å; A277-L281 PolarHBondContact O-N 3.37Å; A277-L294 HydrophobicContact CB-CD1 3.63Å; A277-L294 WeakPolarHBondContact O-CD1 3.48Å
278Y98.4Very high97.4Very high30 Ų3039.4 Ų39.412%0.11820%0.199CC..Hα-helixtrans-60.1-36.2173.8179.3-115.3000112.6I268 K269 P270 F274 L275 L281 R282I268-Y278 PolarHBondContact O-OH 3.44Å; I268-Y278 VanDerWaalsContact O-OH 3.1Å; K269-Y278 HydrophobicContact CB-CE1 4.33Å; P270-Y278 HydrophobicContact CG-CD2 4.44Å; P270-Y278 HydrophobicContact CG-CG 4.08Å; F274-Y278 WeakPolarHBondContact O-CB 3.46Å; F274-Y278 PolarHBondContact O-N 3.46Å; L275-Y278 HydrophobicContact CD2-CD1 4.33Å; L275-Y278 PolarHBondContact O-N 3.28Å; Y278-L281 HydrophobicContact CD2-CD2 4.15Å; Y278-L281 WeakPolarHBondContact O-CB 3.24Å; Y278-R282 HydrophobicContact CE2-CG 4.16Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.35Å; Y278-R282 PolarHBondContact O-N 3.39Å; Y278-R282 VanDerWaalsContact O-N 3.17Å; Y278-R282 WeakPolarHBondContact OH-CD 2.89Å
279T98.7Very high97.6Very high2 Ų239 Ų391%0.01220%0.203CC..Hα-helixtrans-62.9-48.8170.7-64.90000111.5L275 F276 A277 L281 R282 S283 L335 I338 G339L275-T279 PolarHBondContact O-N 2.79Å; L275-T279 PolarHBondContact O-OG1 3.31Å; F276-T279 PolarHBondContact O-N 2.96Å; A277-T279 VanDerWaalsContact C-N 3.28Å; A277-T279 PolarHBondContact O-N 3.32Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.06Å; T279-R282 PolarHBondContact O-N 3.47Å; T279-R282 VanDerWaalsContact O-N 3.09Å; T279-S283 PolarHBondContact O-N 2.96Å; T279-S283 PolarHBondContact O-OG 3.03Å; T279-L335 WeakPolarHBondContact CB-O 3.07Å; T279-L335 HydrophobicContact CG2-CD2 3.52Å; T279-L335 PolarHBondContact OG1-O 2.82Å; T279-I338 HydrophobicContact CG2-CB 4.04Å; T279-I338 HydrophobicContact CG2-CG2 3.63Å; T279-G339 WeakPolarHBondContact OG1-CA 3.35Å; T279-G339 PolarHBondContact OG1-N 3.07Å
280I98.8Very high97.8Very high2 Ų236.3 Ų36.31%0.0119%0.191CC..Hα-helixtrans-58.2-41.7179-66.9170.8000111.4F276 A277 R282 S283 A293 S297 L335 Y358 F359F276-I280 PolarHBondContact O-N 3.06Å; A277-I280 PolarHBondContact O-N 3.33Å; A277-I280 VanDerWaalsContact O-N 3.12Å; I280-R282 PolarHBondContact O-N 2.74Å; I280-S283 PolarHBondContact O-N 3.2Å; I280-A293 HydrophobicContact CG2-CB 3.8Å; I280-S297 VanDerWaalsContact CD1-CB 3.45Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.22Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; I280-Y358 HydrophobicContact CD1-CD1 3.88Å; I280-Y358 HydrophobicContact CD1-CE1 4.19Å; I280-Y358 HydrophobicContact CD1-CG 4.28Å; I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.31Å
281L98.3Very high97.8Very high19 Ų1936.3 Ų36.310%0.09919%0.191CC..Hα-helixtrans-54.7-51.1173.3169.565.2000111.8L149 A277 Y278 T279 S283 G290 V291 L294L149-L281 HydrophobicContact CD1-CD1 4.36Å; L149-L281 HydrophobicContact CD1-CD2 3.65Å; L149-L281 HydrophobicContact CD2-CD1 4.24Å; L149-L281 HydrophobicContact CD2-CD2 4.16Å; A277-L281 PolarHBondContact O-N 3.37Å; Y278-L281 HydrophobicContact CD2-CD2 4.15Å; Y278-L281 WeakPolarHBondContact O-CB 3.24Å; T279-L281 VanDerWaalsContact C-N 3.29Å; T279-L281 PolarHBondContact O-N 3.06Å; L281-S283 VanDerWaalsContact C-N 3.33Å; L281-S283 PolarHBondContact O-N 2.8Å; L281-G290 WeakPolarHBondContact CD1-O 3.25Å; L281-G290 WeakPolarHBondContact O-CA 3.15Å; L281-V291 HydrophobicContact CD1-CG2 4.23Å; L281-L294 HydrophobicContact CB-CB 4.22Å; L281-L294 HydrophobicContact CB-CD1 4.05Å
282R97.1Very high97.8Very high60 Ų6039.5 Ų39.523%0.22621%0.208CC..Hα-helixtrans-74.7-20.6-175.8-67.7-170.7-60.317312.4113.7H267 Y278 T279 I280 V284 I338 G339 Q341H267-R282 PolarHBondContact NE2-NH1 2.9Å; Y278-R282 HydrophobicContact CE2-CG 4.16Å; Y278-R282 VanDerWaalsContact CZ-CD 3.43Å; Y278-R282 WeakPolarHBondContact O-CG 3.35Å; Y278-R282 PolarHBondContact O-N 3.39Å; Y278-R282 VanDerWaalsContact O-N 3.17Å; Y278-R282 WeakPolarHBondContact OH-CD 2.89Å; T279-R282 PolarHBondContact O-N 3.47Å; T279-R282 VanDerWaalsContact O-N 3.09Å; I280-R282 PolarHBondContact O-N 2.74Å; R282-V284 PolarHBondContact O-N 3.03Å; R282-I338 PolarHBondContact NH2-O 3.34Å; R282-G339 PolarHBondContact NH2-O 3.45Å; R282-Q341 PolarHBondContact NH1-O 3.36Å; R282-Q341 PolarHBondContact NH2-O 2.8Å
283S97.9Very high97.8Very high12 Ų1237.4 Ų37.48%0.08420%0.203CC..Hα-helixtrans-66.2-25.7178.6-67.90000113.2T279 I280 L281 P285 G351 Q352 S355T279-S283 PolarHBondContact O-N 2.96Å; T279-S283 PolarHBondContact O-OG 3.03Å; I280-S283 PolarHBondContact O-N 3.2Å; L281-S283 VanDerWaalsContact C-N 3.33Å; L281-S283 PolarHBondContact O-N 2.8Å; S283-P285 WeakPolarHBondContact O-CD 3.33Å; S283-G351 PolarHBondContact OG-O 3.43Å; S283-G351 VanDerWaalsContact OG-O 3.04Å; S283-Q352 WeakPolarHBondContact O-CG 3.1Å; S283-Q352 PolarHBondContact O-NE2 2.89Å; S283-Q352 PolarHBondContact OG-N 3.24Å; S283-S355 WeakPolarHBondContact CB-OG 3.02Å; S283-S355 PolarHBondContact OG-OG 3.3Å
284V97.9Very high97.8Very high52 Ų5239.1 Ų39.132%0.31521%0.213SC..SBendtrans-93.2117.1-179.1-178.10000109.9R282 N286 A293R282-V284 PolarHBondContact O-N 3.03Å; V284-N286 HydrophobicContact CG1-CB 4.22Å; V284-N286 PolarHBondContact O-N 3.47Å; V284-A293 HydrophobicContact CG2-CB 3.9Å
285P95.8Very high97.8Very high126 Ų12641.9 Ų41.982%0.81823%0.228SC*.SBendtrans-78.344.5-17934.6-37.3000112.4S283S283-P285 WeakPolarHBondContact O-CD 3.33Å
286N97.3Very high97.7Very high95 Ų9545.6 Ų45.651%0.50825%0.248SC..SBendtrans-151.8130176179.8-81000108.8V284 L288 G289 G290V284-N286 HydrophobicContact CG1-CB 4.22Å; V284-N286 PolarHBondContact O-N 3.47Å; N286-L288 PolarHBondContact O-N 2.93Å; N286-L288 PolarHBondContact OD1-N 2.86Å; N286-G289 PolarHBondContact O-N 3.3Å; N286-G289 PolarHBondContact OD1-N 3.28Å; N286-G290 PolarHBondContact O-N 3.31Å
287K94.4Very high97.7Very high99 Ų9944.6 Ų44.643%0.4324%0.244SC..Hα-helixtrans-58.7-52.7-175.6-166.5-174.6176179.60112.2N148 S151 A152 G290 V291N148-K287 WeakPolarHBondContact O-CE 3.48Å; N148-K287 PolarHBondContact O-NZ 2.83Å; S151-K287 PolarHBondContact OG-NZ 3.06Å; A152-K287 HydrophobicContact CB-CB 4.47Å; A152-K287 HydrophobicContact CB-CD 3.96Å; A152-K287 HydrophobicContact CB-CG 3.9Å; K287-G290 PolarHBondContact O-N 3.06Å; K287-V291 VanDerWaalsContact O-CG2 3.29Å; K287-V291 WeakPolarHBondContact O-CG2 3.15Å; K287-V291 PolarHBondContact O-N 3.47Å; K287-V291 VanDerWaalsContact O-N 3.09Å
288L96.7Very high97.7Very high60 Ų6045.3 Ų45.331%0.31425%0.247SC..Hα-helixtrans-65.2-44.7179.7176.959.9000111.3A152 P154 N286 G290 V291 L292A152-L288 HydrophobicContact CB-CB 4.25Å; A152-L288 HydrophobicContact CB-CD1 4.39Å; P154-L288 HydrophobicContact CG-CD2 4.42Å; N286-L288 PolarHBondContact O-N 2.93Å; N286-L288 PolarHBondContact OD1-N 2.86Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 2.89Å; L288-V291 PolarHBondContact O-N 2.68Å; L288-L292 HydrophobicContact CD1-CD1 4.29Å; L288-L292 HydrophobicContact CD1-CG 4.19Å; L288-L292 HydrophobicContact CG-CD1 4.15Å; L288-L292 HydrophobicContact CG-CG 4.48Å; L288-L292 WeakPolarHBondContact O-CG 3.43Å; L288-L292 PolarHBondContact O-N 3.42Å
289G98.1Very high97.7Very high23 Ų2347 Ų4724%0.23726%0.258CS..Hα-helixtrans-58.6-42.9177.700000112.7N286 L292 A293N286-G289 PolarHBondContact O-N 3.3Å; N286-G289 PolarHBondContact OD1-N 3.28Å; G289-L292 PolarHBondContact O-N 2.79Å; G289-A293 WeakPolarHBondContact O-CB 3.49Å; G289-A293 PolarHBondContact O-N 3.31Å
290G97.9Very high97.7Very high1 Ų147.2 Ų47.21%0.0126%0.259CS..Hα-helixtrans-65-41.1175.200000112.7L281 N286 K287 L288 A293 L294L281-G290 WeakPolarHBondContact CD1-O 3.25Å; L281-G290 WeakPolarHBondContact O-CA 3.15Å; N286-G290 PolarHBondContact O-N 3.31Å; K287-G290 PolarHBondContact O-N 3.06Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 2.89Å; G290-A293 PolarHBondContact O-N 2.77Å; G290-L294 WeakPolarHBondContact O-CB 3.24Å; G290-L294 PolarHBondContact O-N 2.72Å
291V97.7Very high97.7Very high21 Ų2148 Ų4813%0.12726%0.263CS..Hα-helixtrans-63.6-41.9175.8172.60000111.5L149 A152 L281 K287 L288 L294 L295L149-V291 HydrophobicContact CB-CG2 3.72Å; L149-V291 HydrophobicContact CD2-CG2 4.02Å; L149-V291 HydrophobicContact CG-CG2 4.29Å; A152-V291 HydrophobicContact CB-CG2 4.38Å; L281-V291 HydrophobicContact CD1-CG2 4.23Å; K287-V291 VanDerWaalsContact O-CG2 3.29Å; K287-V291 WeakPolarHBondContact O-CG2 3.15Å; K287-V291 PolarHBondContact O-N 3.47Å; K287-V291 VanDerWaalsContact O-N 3.09Å; L288-V291 PolarHBondContact O-N 2.68Å; V291-L294 PolarHBondContact O-N 3.09Å; V291-L295 PolarHBondContact O-N 3.34Å
292L98.2Very high97.7Very high89 Ų8948.8 Ų48.847%0.46627%0.272SS..Hα-helixtrans-64.5-42.4174-67.8174.9000111.3L288 G289 L295 L296L288-L292 HydrophobicContact CD1-CD1 4.29Å; L288-L292 HydrophobicContact CD1-CG 4.19Å; L288-L292 HydrophobicContact CG-CD1 4.15Å; L288-L292 HydrophobicContact CG-CG 4.48Å; L288-L292 WeakPolarHBondContact O-CG 3.43Å; L288-L292 PolarHBondContact O-N 3.42Å; G289-L292 PolarHBondContact O-N 2.79Å; L292-L295 PolarHBondContact O-N 3.33Å; L292-L296 VanDerWaalsContact O-CB 3.29Å; L292-L296 WeakPolarHBondContact O-CB 3.48Å; L292-L296 WeakPolarHBondContact O-CG 3.17Å; L292-L296 PolarHBondContact O-N 2.83Å
293A98.4Very high97.7Very high15 Ų1550 Ų5012%0.12428%0.281CS..Hα-helixtrans-63.3-41.3177.900000112.5I280 V284 G289 G290 L296 S297I280-A293 HydrophobicContact CG2-CB 3.8Å; V284-A293 HydrophobicContact CG2-CB 3.9Å; G289-A293 WeakPolarHBondContact O-CB 3.49Å; G289-A293 PolarHBondContact O-N 3.31Å; G290-A293 PolarHBondContact O-N 2.77Å; A293-L296 PolarHBondContact O-N 3.5Å; A293-S297 WeakPolarHBondContact O-CB 3.43Å; A293-S297 PolarHBondContact O-N 3.21Å
294L97.9Very high97.7Very high45 Ų4550.2 Ų50.224%0.23628%0.282CS..Hα-helixtrans-57.8-50.1171.717893.2000111.4L149 A277 L281 G290 V291 S297L149-L294 HydrophobicContact CD1-CD2 4.44Å; A277-L294 HydrophobicContact CB-CD1 3.63Å; A277-L294 WeakPolarHBondContact O-CD1 3.48Å; L281-L294 HydrophobicContact CB-CB 4.22Å; L281-L294 HydrophobicContact CB-CD1 4.05Å; G290-L294 WeakPolarHBondContact O-CB 3.24Å; G290-L294 PolarHBondContact O-N 2.72Å; V291-L294 PolarHBondContact O-N 3.09Å; L294-S297 PolarHBondContact O-N 3.11Å; L294-S297 PolarHBondContact O-OG 3.29Å
295L97.5Very high97.7Very high86 Ų8649.4 Ų49.445%0.4528%0.277SS..Hα-helixtrans-63.8-45.4-178.9-176.666.6000110.8V291 L292 S297 I298 L299V291-L295 PolarHBondContact O-N 3.34Å; L292-L295 PolarHBondContact O-N 3.33Å; L295-S297 VanDerWaalsContact C-N 3.27Å; L295-S297 PolarHBondContact O-N 2.96Å; L295-I298 PolarHBondContact O-N 2.77Å; L295-L299 HydrophobicContact CD1-CD1 4.01Å; L295-L299 HydrophobicContact CD1-CG 4.26Å; L295-L299 HydrophobicContact CD2-CD1 4.06Å; L295-L299 HydrophobicContact CG-CD1 3.7Å; L295-L299 HydrophobicContact CG-CG 4.2Å; L295-L299 WeakPolarHBondContact O-CG 3.39Å; L295-L299 PolarHBondContact O-N 2.95Å
296L98.3Very high97.8Very high95 Ų9549 Ų4950%0.49727%0.267SS..Hα-helixtrans-65.7-28178.3-70.6172.7000112.4L292 A293 I298 L299 I300 F359L292-L296 VanDerWaalsContact O-CB 3.29Å; L292-L296 WeakPolarHBondContact O-CB 3.48Å; L292-L296 WeakPolarHBondContact O-CG 3.17Å; L292-L296 PolarHBondContact O-N 2.83Å; A293-L296 PolarHBondContact O-N 3.5Å; L296-I298 PolarHBondContact O-N 3.5Å; L296-L299 PolarHBondContact O-N 3.19Å; L296-I300 VanDerWaalsContact O-CB 3.22Å; L296-I300 WeakPolarHBondContact O-CB 3.38Å; L296-I300 WeakPolarHBondContact O-CG2 3.32Å; L296-I300 PolarHBondContact O-N 3.02Å; L296-F359 HydrophobicContact CB-CE1 4.22Å; L296-F359 HydrophobicContact CB-CZ 4.35Å
297S98.4Very high97.8Very high1 Ų146.1 Ų46.11%0.00725%0.251CS..Hα-helixtrans-64.1-23.3177.775.60000112.8I280 A293 L294 L295 I300 Y358I280-S297 VanDerWaalsContact CD1-CB 3.45Å; A293-S297 WeakPolarHBondContact O-CB 3.43Å; A293-S297 PolarHBondContact O-N 3.21Å; L294-S297 PolarHBondContact O-N 3.11Å; L294-S297 PolarHBondContact O-OG 3.29Å; L295-S297 VanDerWaalsContact C-N 3.27Å; L295-S297 PolarHBondContact O-N 2.96Å; S297-I300 WeakPolarHBondContact O-CG2 3.44Å; S297-Y358 PolarHBondContact O-OH 3.23Å
298I98.4Very high98Very high18 Ų1843.3 Ų43.39%0.09224%0.24CC..Hα-helixtrans-96.4-47.6174.7-54.5160.9000110.1L120 L121 M124 L295 L296 I300 L301L120-I298 HydrophobicContact CD2-CG2 3.92Å; L121-I298 HydrophobicContact CD2-CD1 4.45Å; L121-I298 HydrophobicContact CD2-CG2 3.8Å; L121-I298 HydrophobicContact CG-CG2 4.45Å; M124-I298 HydrophobicContact CE-CD1 3.43Å; M124-I298 VanDerWaalsContact CE-CD1 3.43Å; M124-I298 HydrophobicContact CE-CG1 4.19Å; M124-I298 HydrophobicContact SD-CD1 3.85Å; M124-I298 HydrophobicContact SD-CG1 4.45Å; M124-I298 HydrophobicContact SD-CG2 4.47Å; L295-I298 PolarHBondContact O-N 2.77Å; L296-I298 PolarHBondContact O-N 3.5Å; I298-I300 PolarHBondContact O-N 2.68Å; I298-I300 VanDerWaalsContact O-N 3.17Å; I298-L301 WeakPolarHBondContact O-CB 3.36Å; I298-L301 WeakPolarHBondContact O-CG 3.21Å; I298-L301 PolarHBondContact O-N 3.14Å; I298-L301 VanDerWaalsContact O-N 3.14Å
299L98.3Very high98Very high66 Ų6644.5 Ų44.535%0.34625%0.245SC..Hα-helixtrans-66.6-17.2-177.1-66.6-174.3000113.7L121 L295 L296 L301 A302L121-L299 HydrophobicContact CD1-CD2 4.18Å; L295-L299 HydrophobicContact CD1-CD1 4.01Å; L295-L299 HydrophobicContact CD1-CG 4.26Å; L295-L299 HydrophobicContact CD2-CD1 4.06Å; L295-L299 HydrophobicContact CG-CD1 3.7Å; L295-L299 HydrophobicContact CG-CG 4.2Å; L295-L299 WeakPolarHBondContact O-CG 3.39Å; L295-L299 PolarHBondContact O-N 2.95Å; L296-L299 PolarHBondContact O-N 3.19Å; L299-L301 PolarHBondContact O-N 2.53Å; L299-L301 VanDerWaalsContact O-N 3.11Å; L299-A302 WeakPolarHBondContact O-CB 3.17Å; L299-A302 PolarHBondContact O-N 3.37Å
300I98.5Very high98Very high7 Ų743.9 Ų43.94%0.03624%0.237CC..G310 helixtrans-56.5-25.3171.8-166.4164.8000112.7L296 S297 I298 A302 M303 Y358 F359 I362 L363L296-I300 VanDerWaalsContact O-CB 3.22Å; L296-I300 WeakPolarHBondContact O-CB 3.38Å; L296-I300 WeakPolarHBondContact O-CG2 3.32Å; L296-I300 PolarHBondContact O-N 3.02Å; S297-I300 WeakPolarHBondContact O-CG2 3.44Å; I298-I300 PolarHBondContact O-N 2.68Å; I298-I300 VanDerWaalsContact O-N 3.17Å; I300-A302 PolarHBondContact O-N 3.24Å; I300-M303 WeakPolarHBondContact O-CB 3.39Å; I300-M303 PolarHBondContact O-N 3.01Å; I300-Y358 HydrophobicContact CG2-CE1 4.12Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.39Å; I300-F359 HydrophobicContact CD1-CD1 3.71Å; I300-F359 HydrophobicContact CD1-CE1 4.11Å; I300-I362 HydrophobicContact CD1-CB 3.81Å; I300-I362 HydrophobicContact CD1-CD1 4Å; I300-I362 HydrophobicContact CD1-CG2 3.57Å; I300-I362 HydrophobicContact CG1-CG2 3.75Å; I300-I362 HydrophobicContact CG2-CD1 4.24Å; I300-L363 HydrophobicContact CD1-CD1 4.39Å; I300-L363 HydrophobicContact CD1-CD2 3.71Å; I300-L363 HydrophobicContact CD1-CG 3.85Å; I300-L363 HydrophobicContact CG1-CD2 4.09Å
301L98.6Very high98Very high17 Ų1750.2 Ų50.29%0.08926%0.264CS..G310 helixtrans-57.5-31.8173.4-67.3175.8000112.3I98 L102 W113 I117 L120 I298 L299 M303 I304I98-L301 HydrophobicContact CG2-CD1 4.4Å; I98-L301 HydrophobicContact CG2-CD2 4.17Å; L102-L301 HydrophobicContact CD2-CD2 4.38Å; W113-L301 HydrophobicContact CZ2-CB 4.25Å; W113-L301 HydrophobicContact CZ2-CD2 4.07Å; W113-L301 PolarHBondContact NE1-O 3.08Å; I117-L301 HydrophobicContact CD1-CB 3.76Å; I117-L301 HydrophobicContact CG1-CB 3.96Å; L120-L301 HydrophobicContact CD2-CD1 3.79Å; I298-L301 WeakPolarHBondContact O-CB 3.36Å; I298-L301 WeakPolarHBondContact O-CG 3.21Å; I298-L301 PolarHBondContact O-N 3.14Å; I298-L301 VanDerWaalsContact O-N 3.14Å; L299-L301 PolarHBondContact O-N 2.53Å; L299-L301 VanDerWaalsContact O-N 3.11Å; L301-M303 VanDerWaalsContact C-N 3.25Å; L301-M303 PolarHBondContact O-N 3.07Å; L301-I304 WeakPolarHBondContact O-CB 3.26Å; L301-I304 WeakPolarHBondContact O-CG1 3.38Å; L301-I304 PolarHBondContact O-N 3.06Å
302A98.3Very high98.1Very high36 Ų3651.3 Ų51.330%0.29827%0.268SS..G310 helixtrans-71.2-21.4177.300000112.7I114 I117 L299 I300 P305I114-A302 HydrophobicContact CD1-CB 4.25Å; I117-A302 HydrophobicContact CD1-CB 3.88Å; L299-A302 WeakPolarHBondContact O-CB 3.17Å; L299-A302 PolarHBondContact O-N 3.37Å; I300-A302 PolarHBondContact O-N 3.24Å; A302-P305 WeakPolarHBondContact O-CD 3.44Å
303M97.7Very high98Very high86 Ų8649 Ų4942%0.42426%0.255SS..G310 helixtrans-80.9-20.8176.4-61.1-59.9-64.900112.5I300 L301 I306 L307I300-M303 WeakPolarHBondContact O-CB 3.39Å; I300-M303 PolarHBondContact O-N 3.01Å; L301-M303 VanDerWaalsContact C-N 3.25Å; L301-M303 PolarHBondContact O-N 3.07Å; M303-I306 HydrophobicContact CE-CD1 4.45Å; M303-I306 WeakPolarHBondContact O-CB 3.45Å; M303-I306 PolarHBondContact O-N 3.4Å; M303-I306 HydrophobicContact SD-CD1 4.42Å; M303-L307 HydrophobicContact CB-CD1 3.89Å; M303-L307 HydrophobicContact CB-CG 4.38Å; M303-L307 VanDerWaalsContact O-CG 3.31Å; M303-L307 WeakPolarHBondContact O-CG 3.5Å; M303-L307 PolarHBondContact O-N 3.42Å
304I98.1Very high98Very high17 Ų1748.4 Ų48.49%0.08725%0.249CC..THydrogen-bonded Turntrans-54.8-45.7-173.7-60.2-68.2000113.6L102 F107 L301 I306 L307 H308 I362L102-I304 HydrophobicContact CD2-CB 4.49Å; L102-I304 HydrophobicContact CD2-CD1 4.26Å; L102-I304 HydrophobicContact CD2-CG1 4.01Å; L102-I304 HydrophobicContact CD2-CG2 3.91Å; F107-I304 HydrophobicContact CB-CG2 4.3Å; F107-I304 HydrophobicContact CD1-CG2 3.45Å; F107-I304 VanDerWaalsContact CD1-CG2 3.45Å; F107-I304 HydrophobicContact CD2-CG2 3.78Å; F107-I304 HydrophobicContact CE1-CG2 3.53Å; F107-I304 HydrophobicContact CE2-CG2 3.9Å; F107-I304 HydrophobicContact CG-CB 4.49Å; F107-I304 HydrophobicContact CG-CG2 3.56Å; F107-I304 HydrophobicContact CZ-CG2 3.77Å; L301-I304 WeakPolarHBondContact O-CB 3.26Å; L301-I304 WeakPolarHBondContact O-CG1 3.38Å; L301-I304 PolarHBondContact O-N 3.06Å; I304-I306 VanDerWaalsContact C-N 3.26Å; I304-I306 PolarHBondContact O-N 2.85Å; I304-L307 PolarHBondContact O-N 3.44Å; I304-H308 PolarHBondContact O-N 2.76Å; I304-I362 HydrophobicContact CD1-CG2 3.41Å; I304-I362 VanDerWaalsContact CD1-CG2 3.41Å
305P97.7Very high98.1Very high35 Ų3547 Ų4723%0.22724%0.242CC..THydrogen-bonded Turntrans-60.8-35.7178.1-22.734.3000113F107 A302 H308F107-P305 HydrophobicContact CB-CG 4.29Å; F107-P305 HydrophobicContact CD2-CB 4.29Å; F107-P305 HydrophobicContact CD2-CG 4.19Å; F107-P305 WeakPolarHBondContact O-CG 3.18Å; A302-P305 WeakPolarHBondContact O-CD 3.44Å; P305-H308 WeakPolarHBondContact O-CB 3.23Å; P305-H308 PolarHBondContact O-N 3.34Å
306I97.3Very high98.1Very high117 Ų11746.6 Ų46.660%0.624%0.239SC*.THydrogen-bonded Turntrans-73.9-33-179.7-53.8171.1000110.8M303 I304 H308M303-I306 HydrophobicContact CE-CD1 4.45Å; M303-I306 WeakPolarHBondContact O-CB 3.45Å; M303-I306 PolarHBondContact O-N 3.4Å; M303-I306 HydrophobicContact SD-CD1 4.42Å; I304-I306 VanDerWaalsContact C-N 3.26Å; I304-I306 PolarHBondContact O-N 2.85Å; I306-H308 PolarHBondContact O-N 2.91Å
307L97.8Very high98.1Very high34 Ų3447.4 Ų47.418%0.17824%0.238CC..THydrogen-bonded Turntrans-78.9-4.1179.1-67.6172.3000113.2M303 I304 M309 I362 L363 P367M303-L307 HydrophobicContact CB-CD1 3.89Å; M303-L307 HydrophobicContact CB-CG 4.38Å; M303-L307 VanDerWaalsContact O-CG 3.31Å; M303-L307 WeakPolarHBondContact O-CG 3.5Å; M303-L307 PolarHBondContact O-N 3.42Å; I304-L307 PolarHBondContact O-N 3.44Å; L307-M309 PolarHBondContact O-N 3Å; L307-M309 VanDerWaalsContact O-N 3.15Å; L307-I362 HydrophobicContact CD1-CG2 4.2Å; L307-L363 HydrophobicContact CD1-CD2 3.82Å; L307-P367 HydrophobicContact CB-CG 4.04Å; L307-P367 HydrophobicContact CD2-CG 4.1Å
308H98Very high98.1Very high41 Ų4147.6 Ų47.619%0.1924%0.239CC..  trans-75.9103.1-179.3-172.777.7000112F107 L108 I304 P305 I306 S310 Q312F107-H308 HydrophobicContact CE2-CB 3.85Å; F107-H308 AromaticContact CE2-CG 3.95Å; F107-H308 AromaticContact CE2-ND1 3.81Å; F107-H308 HydrophobicContact CZ-CB 4.35Å; F107-H308 AromaticContact CZ-ND1 3.62Å; L108-H308 HydrophobicContact CD2-CB 4.24Å; I304-H308 PolarHBondContact O-N 2.76Å; P305-H308 WeakPolarHBondContact O-CB 3.23Å; P305-H308 PolarHBondContact O-N 3.34Å; I306-H308 PolarHBondContact O-N 2.91Å; H308-S310 PolarHBondContact NE2-O 2.83Å; H308-Q312 PolarHBondContact CE1-O 3.17Å
309M97.8Very high98.1Very high84 Ų8451.1 Ų51.141%0.41426%0.263SS..  trans-104.3-4.1-178.5-61.3-64.8170.100114L307 P367 L371 N374L307-M309 PolarHBondContact O-N 3Å; L307-M309 VanDerWaalsContact O-N 3.15Å; M309-P367 HydrophobicContact CG-CB 4.05Å; M309-L371 HydrophobicContact CB-CD2 3.84Å; M309-L371 HydrophobicContact CB-CG 3.88Å; M309-L371 HydrophobicContact CG-CD2 4.49Å; M309-L371 HydrophobicContact CG-CG 4.39Å; M309-N374 PolarHBondContact O-ND2 3.02Å
310S98.1Very high98.1Very high10 Ų1051 Ų517%0.0726%0.262CS..  trans-76.5147.5-178.51730000111.4H308 Q312 R318H308-S310 PolarHBondContact NE2-O 2.83Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.45Å; S310-Q312 PolarHBondContact OG-N 3.44Å; S310-Q312 PolarHBondContact OG-O 3.38Å; S310-R318 WeakPolarHBondContact OG-CD 3.31Å; S310-R318 VanDerWaalsContact OG-CZ 3.29Å; S310-R318 PolarHBondContact OG-NE 3.48Å; S310-R318 PolarHBondContact OG-NH1 2.92Å
311K97.8Very high98.1Very high135 Ų13550.7 Ų50.759%0.58726%0.261SS*.SBendtrans-83.1-12.4168.6-53.8-70.2-173.2172.10112.7N374 W379 A380K311-N374 PolarHBondContact N-OD1 3.33Å; K311-W379 HydrophobicContact CB-CD2 4.01Å; K311-W379 HydrophobicContact CB-CE3 3.47Å; K311-W379 VanDerWaalsContact CB-CE3 3.47Å; K311-W379 HydrophobicContact CB-CH2 4.48Å; K311-W379 HydrophobicContact CB-CZ3 3.74Å; K311-W379 HydrophobicContact CG-CB 4.17Å; K311-W379 HydrophobicContact CG-CD2 4.21Å; K311-W379 HydrophobicContact CG-CE3 3.88Å; K311-W379 HydrophobicContact CG-CG 4.39Å; K311-A380 WeakPolarHBondContact CE-O 3.47Å; K311-A380 PolarHBondContact NZ-O 3.3Å
312Q98.1Very high98.1Very high43 Ų4352.4 Ų52.420%0.20127%0.268CS..SBendtrans-99.6129.7170.3-80.4161.5-26.200110.6H308 S310 R318 W379H308-Q312 PolarHBondContact CE1-O 3.17Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.45Å; S310-Q312 PolarHBondContact OG-N 3.44Å; S310-Q312 PolarHBondContact OG-O 3.38Å; Q312-R318 HydrophobicContact CB-CG 4.42Å; Q312-R318 PolarHBondContact O-NH1 3.04Å; Q312-R318 VanDerWaalsContact OE1-CG 3.23Å; Q312-W379 HydrophobicContact CB-CZ3 4.41Å; Q312-W379 HydrophobicContact CG-CH2 3.41Å; Q312-W379 VanDerWaalsContact CG-CH2 3.41Å; Q312-W379 HydrophobicContact CG-CZ3 3.57Å
313Q97.8Very high98.1Very high42 Ų4254 Ų5420%0.19628%0.277CS..SBendtrans-65.8-54.5178.1175.2169.54.300112.3G105 L108 N206G105-Q313 PolarHBondContact O-NE2 2.9Å; L108-Q313 HydrophobicContact CD1-CB 4.16Å; L108-Q313 HydrophobicContact CD1-CG 3.74Å; N206-Q313 PolarHBondContact ND2-NE2 3.4Å
314S98.3Very high98.1Very high2 Ų250.8 Ų50.81%0.01426%0.261CS..SBendtrans-84148.3-177.2175.10000112.4Y104 P208 M316 R318Y104-S314 WeakPolarHBondContact CD1-OG 3.45Å; P208-S314 WeakPolarHBondContact O-CB 3.38Å; P208-S314 PolarHBondContact O-OG 3.19Å; S314-M316 PolarHBondContact O-N 3.08Å; S314-M316 WeakPolarHBondContact OG-CB 3.34Å; S314-M316 PolarHBondContact OG-N 3.37Å; S314-M316 VanDerWaalsContact OG-N 3.08Å; S314-R318 WeakPolarHBondContact O-CD 3.4Å
315M98.6Very high98.2Very high14 Ų1451.4 Ų51.47%0.06926%0.263CS..G310 helixtrans-75.5-5.3170.3-64.7-174.8-175.400113.6Y103 F317 R318 Q322 Y325Y103-M315 HydrophobicContact CD2-CB 4.27Å; Y103-M315 HydrophobicContact CD2-SD 4.31Å; Y103-M315 HydrophobicContact CE1-CB 4.45Å; Y103-M315 HydrophobicContact CE2-CB 4.18Å; Y103-M315 HydrophobicContact CG-CB 4.48Å; Y103-M315 VanDerWaalsContact O-CB 3.29Å; Y103-M315 WeakPolarHBondContact O-CB 3.43Å; Y103-M315 WeakPolarHBondContact O-CG 3.42Å; Y103-M315 PolarHBondContact O-N 3.4Å; M315-F317 PolarHBondContact O-N 3.33Å; M315-R318 PolarHBondContact O-N 2.93Å; M315-Q322 HydrophobicContact CB-CG 4.18Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.15Å; M315-Q322 PolarHBondContact O-NE2 3.25Å; M315-Y325 HydrophobicContact SD-CG 4.42Å
316M98Very high98.2Very high79 Ų7956.7 Ų56.739%0.38928%0.278SS..G310 helixtrans-52.8-33.1-176-178.2165.8177.600114.3P208 L209 S314 Q322P208-M316 HydrophobicContact CB-SD 4.26Å; L209-M316 HydrophobicContact CD2-CE 3.81Å; L209-M316 HydrophobicContact CD2-SD 3.69Å; L209-M316 HydrophobicContact CG-SD 4.5Å; S314-M316 PolarHBondContact O-N 3.08Å; S314-M316 WeakPolarHBondContact OG-CB 3.34Å; S314-M316 PolarHBondContact OG-N 3.37Å; S314-M316 VanDerWaalsContact OG-N 3.08Å; M316-Q322 PolarHBondContact O-NE2 3.14Å
317F98.1Very high98.3Very high111 Ų11154.4 Ų54.449%0.48727%0.267SS..G310 helixtrans-108.919.2179.4-56.4-62.3000113.7L209 M315L209-F317 HydrophobicContact CD2-CE2 4.02Å; L209-F317 HydrophobicContact CD2-CZ 3.65Å; M315-F317 PolarHBondContact O-N 3.33Å
318R98.4Very high98.3Very high6 Ų653.3 Ų53.32%0.02326%0.261CS..  trans-126.977.7-170.6-69.317656.4-165.1-0.1111S310 Q312 S314 M315 L320 S321 Q322 S370 E373S310-R318 WeakPolarHBondContact OG-CD 3.31Å; S310-R318 VanDerWaalsContact OG-CZ 3.29Å; S310-R318 PolarHBondContact OG-NE 3.48Å; S310-R318 PolarHBondContact OG-NH1 2.92Å; Q312-R318 HydrophobicContact CB-CG 4.42Å; Q312-R318 PolarHBondContact O-NH1 3.04Å; Q312-R318 VanDerWaalsContact OE1-CG 3.23Å; S314-R318 WeakPolarHBondContact O-CD 3.4Å; M315-R318 PolarHBondContact O-N 2.93Å; R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.1Å; R318-S321 PolarHBondContact NE-OG 2.85Å; R318-S321 PolarHBondContact NH2-OG 2.94Å; R318-S321 PolarHBondContact O-N 3.47Å; R318-S321 VanDerWaalsContact O-N 3.15Å; R318-Q322 WeakPolarHBondContact O-CG 3.36Å; R318-Q322 PolarHBondContact O-N 3.12Å; R318-S370 PolarHBondContact NH2-OG 3.23Å; R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.2Å; R318-E373 WeakPolarHBondContact CB-OE1 3.27Å; R318-E373 WeakPolarHBondContact CB-OE2 3.37Å; R318-E373 IonicContact CZ-OE2 3.39Å; R318-E373 IonicContact NE-OE2 2.9Å; R318-E373 PolarHBondContact NE-OE2 3.24Å; R318-E373 IonicContact NH2-OE2 2.85Å; R318-E373 PolarHBondContact NH2-OE2 3.12Å
319P98.2Very high98.4Very high91 Ų9152.7 Ų52.759%0.59126%0.264SS*.Hα-helixtrans-62.9-34-167.524.1-34.1000113.5Q322 S323P319-Q322 PolarHBondContact O-N 3.22Å; P319-S323 PolarHBondContact O-N 2.93Å; P319-S323 VanDerWaalsContact O-N 3.14Å
320L98.4Very high98.4Very high65 Ų6550.9 Ų50.934%0.3426%0.262SS..Hα-helixtrans-69.8-42.5177.6-59.8178.2000109.8R318 Q322 S323 L324 I369 I372 E373 M376R318-L320 VanDerWaalsContact C-N 3.31Å; R318-L320 PolarHBondContact O-N 3.1Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 2.85Å; L320-S323 PolarHBondContact O-N 3.32Å; L320-S323 PolarHBondContact O-OG 3.4Å; L320-L324 PolarHBondContact O-N 2.79Å; L320-L324 VanDerWaalsContact O-N 3.13Å; L320-I369 HydrophobicContact CB-CD1 4.45Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.35Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L320-I372 HydrophobicContact CD1-CG2 4.39Å; L320-E373 HydrophobicContact CB-CG 4.23Å; L320-E373 WeakPolarHBondContact CB-OE1 3.24Å; L320-E373 HydrophobicContact CD1-CG 4.18Å; L320-E373 HydrophobicContact CG-CG 4.47Å; L320-E373 PolarHBondContact N-OE1 3.22Å; L320-M376 HydrophobicContact CD1-SD 4.08Å
321S98.5Very high98.4Very high0 Ų050.6 Ų50.60%026%0.26CS..Hα-helixtrans-64.7-35.8175.1-63.20000113.1R318 S323 L324 Y325 E373R318-S321 PolarHBondContact NE-OG 2.85Å; R318-S321 PolarHBondContact NH2-OG 2.94Å; R318-S321 PolarHBondContact O-N 3.47Å; R318-S321 VanDerWaalsContact O-N 3.15Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.44Å; S321-L324 PolarHBondContact O-N 3.21Å; S321-Y325 PolarHBondContact O-N 3.28Å; S321-E373 PolarHBondContact N-OE1 2.55Å; S321-E373 PolarHBondContact OG-OE1 3.35Å; S321-E373 PolarHBondContact OG-OE2 3.21Å
322Q98.8Very high98.5Very high52 Ų5246.8 Ų46.824%0.24325%0.245CC..Hα-helixtrans-60-43.8172.5-69.4178.537.800111.8Y103 M315 M316 R318 P319 L320 L324 Y325 W326Y103-Q322 HydrophobicContact CE2-CG 3.95Å; Y103-Q322 VanDerWaalsContact OH-CD 3.24Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.4Å; Y103-Q322 PolarHBondContact OH-OE1 3.04Å; M315-Q322 HydrophobicContact CB-CG 4.18Å; M315-Q322 VanDerWaalsContact O-CG 3.25Å; M315-Q322 WeakPolarHBondContact O-CG 3.15Å; M315-Q322 PolarHBondContact O-NE2 3.25Å; M316-Q322 PolarHBondContact O-NE2 3.14Å; R318-Q322 WeakPolarHBondContact O-CG 3.36Å; R318-Q322 PolarHBondContact O-N 3.12Å; P319-Q322 PolarHBondContact O-N 3.22Å; L320-Q322 VanDerWaalsContact C-N 3.34Å; L320-Q322 PolarHBondContact O-N 2.85Å; Q322-L324 VanDerWaalsContact C-N 3.33Å; Q322-L324 PolarHBondContact O-N 3.27Å; Q322-Y325 PolarHBondContact O-N 2.97Å; Q322-W326 PolarHBondContact O-N 2.99Å
323S98.4Very high98.5Very high70 Ų7050.8 Ų50.849%0.4927%0.268SS..Hα-helixtrans-61.9-41177.575.90000111.9P319 L320 S321 W326 L327P319-S323 PolarHBondContact O-N 2.93Å; P319-S323 VanDerWaalsContact O-N 3.14Å; L320-S323 PolarHBondContact O-N 3.32Å; L320-S323 PolarHBondContact O-OG 3.4Å; S321-S323 VanDerWaalsContact C-N 3.34Å; S321-S323 PolarHBondContact O-N 3.44Å; S323-W326 PolarHBondContact O-N 2.88Å; S323-L327 WeakPolarHBondContact O-CB 3.44Å; S323-L327 PolarHBondContact O-N 2.91Å
324L98.5Very high98.6Very high18 Ų1852.1 Ų52.19%0.09428%0.275CS..Hα-helixtrans-68.1-36.1175.5-74.1-172.9000113.1L320 S321 Q322 L327 L328 L365 M366 I369L320-L324 PolarHBondContact O-N 2.79Å; L320-L324 VanDerWaalsContact O-N 3.13Å; S321-L324 PolarHBondContact O-N 3.21Å; Q322-L324 VanDerWaalsContact C-N 3.33Å; Q322-L324 PolarHBondContact O-N 3.27Å; L324-L327 HydrophobicContact CD2-CD2 4.08Å; L324-L327 PolarHBondContact O-N 2.85Å; L324-L328 WeakPolarHBondContact O-CB 3.45Å; L324-L328 PolarHBondContact O-N 3.39Å; L324-L365 HydrophobicContact CD1-CB 3.77Å; L324-L365 HydrophobicContact CD2-CB 4.2Å; L324-L365 HydrophobicContact CD2-CD1 4.25Å; L324-M366 HydrophobicContact CB-CG 4.36Å; L324-M366 HydrophobicContact CD1-CG 4.17Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.55Å; L324-I369 HydrophobicContact CD1-CG2 4.3Å; L324-I369 HydrophobicContact CG-CG1 4.42Å
325Y98.8Very high98.6Very high31 Ų3152 Ų5212%0.12228%0.275CS..Hα-helixtrans-61.4-46.2173.9170.7-91.6000111.3G99 L102 Y103 M315 S321 Q322 L328 A329G99-Y325 WeakPolarHBondContact O-CE2 3.5Å; G99-Y325 PolarHBondContact O-OH 3.45Å; L102-Y325 HydrophobicContact CB-CE2 4.24Å; Y103-Y325 AromaticContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD1 3.5Å; Y103-Y325 HydrophobicContact CD2-CD2 4.05Å; Y103-Y325 AromaticContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE1 3.74Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.66Å; Y103-Y325 HydrophobicContact CD2-CG 3.66Å; Y103-Y325 HydrophobicContact CE2-CD1 4.04Å; Y103-Y325 HydrophobicContact CE2-CE1 4.47Å; Y103-Y325 HydrophobicContact CE2-CG 4.4Å; Y103-Y325 HydrophobicContact CG-CE1 4.49Å; M315-Y325 HydrophobicContact SD-CG 4.42Å; S321-Y325 PolarHBondContact O-N 3.28Å; Q322-Y325 PolarHBondContact O-N 2.97Å; Y325-L328 WeakPolarHBondContact O-CB 3.36Å; Y325-L328 PolarHBondContact O-N 3.35Å; Y325-A329 PolarHBondContact O-N 2.85Å
326W98.8Very high98.6Very high145 Ų14553 Ų5355%0.54928%0.282SS..Hα-helixtrans-71.2-31.6178.3-71.4116.8000112.8Q322 S323 A329 A330Q322-W326 PolarHBondContact O-N 2.99Å; S323-W326 PolarHBondContact O-N 2.88Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 2.95Å; W326-A330 WeakPolarHBondContact O-CB 3.45Å; W326-A330 PolarHBondContact O-N 3.43Å
327L98.7Very high98.7Very high70 Ų7055.5 Ų55.537%0.36629%0.287SS..Hα-helixtrans-59.9-47.2168.6-179.665.1000111S323 L324 A329 A330 D331 L357S323-L327 WeakPolarHBondContact O-CB 3.44Å; S323-L327 PolarHBondContact O-N 2.91Å; L324-L327 HydrophobicContact CD2-CD2 4.08Å; L324-L327 PolarHBondContact O-N 2.85Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.47Å; L327-A330 PolarHBondContact O-N 3.07Å; L327-D331 WeakPolarHBondContact O-CB 3.37Å; L327-D331 PolarHBondContact O-N 3.22Å; L327-L357 HydrophobicContact CD1-CD2 4.3Å; L327-L357 HydrophobicContact CD2-CD1 4.35Å
328L98.8Very high98.7Very high10 Ų1050.4 Ų50.45%0.05227%0.265CS..Hα-helixtrans-61.5-42.5176.3178.963.4000111.8L324 Y325 D331 L332 Y358 T361 I362 M366L324-L328 WeakPolarHBondContact O-CB 3.45Å; L324-L328 PolarHBondContact O-N 3.39Å; Y325-L328 WeakPolarHBondContact O-CB 3.36Å; Y325-L328 PolarHBondContact O-N 3.35Å; L328-D331 PolarHBondContact O-N 2.84Å; L328-L332 HydrophobicContact CG-CD1 4.48Å; L328-L332 WeakPolarHBondContact O-CG 3.27Å; L328-L332 PolarHBondContact O-N 3.28Å; L328-Y358 HydrophobicContact CD1-CD2 3.59Å; L328-Y358 HydrophobicContact CD1-CE2 3.9Å; L328-T361 HydrophobicContact CB-CG2 4.12Å; L328-I362 HydrophobicContact CD1-CD1 4.11Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.23Å; L328-I362 HydrophobicContact CD2-CG1 3.95Å; L328-M366 HydrophobicContact CB-CE 4.28Å; L328-M366 HydrophobicContact CD2-CE 3.77Å
329A98.8Very high98.7Very high29 Ų2950.1 Ų50.124%0.2426%0.263CS..Hα-helixtrans-62.9-43.4176.600000111.8Y325 W326 L327 L332 L333Y325-A329 PolarHBondContact O-N 2.85Å; W326-A329 HydrophobicContact CE3-CB 4.11Å; W326-A329 PolarHBondContact O-N 2.95Å; L327-A329 VanDerWaalsContact C-N 3.35Å; L327-A329 PolarHBondContact O-N 3.47Å; A329-L332 PolarHBondContact O-N 3.24Å; A329-L333 WeakPolarHBondContact O-CG 3.4Å; A329-L333 PolarHBondContact O-N 3.47Å
330A98.9Very high98.6Very high46 Ų4646.8 Ų46.838%0.3825%0.246SC..Hα-helixtrans-64.8-40.5175.600000112W326 L327 L333 I334W326-A330 WeakPolarHBondContact O-CB 3.45Å; W326-A330 PolarHBondContact O-N 3.43Å; L327-A330 PolarHBondContact O-N 3.07Å; A330-L333 WeakPolarHBondContact O-CB 3.33Å; A330-L333 PolarHBondContact O-N 3.08Å; A330-I334 WeakPolarHBondContact O-CG1 3.06Å; A330-I334 PolarHBondContact O-N 3.04Å
331D98.9Very high98.6Very high4 Ų446.2 Ų46.22%0.02124%0.241CC..Hα-helixtrans-63.3-41.3176.7-17354.6000111.9L327 L328 L333 I334 L335 A354 L357 Y358L327-D331 WeakPolarHBondContact O-CB 3.37Å; L327-D331 PolarHBondContact O-N 3.22Å; L328-D331 PolarHBondContact O-N 2.84Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.31Å; D331-I334 CarbonylContact O-C 3.5Å; D331-I334 WeakPolarHBondContact O-CB 3.38Å; D331-I334 PolarHBondContact O-N 3.1Å; D331-I334 VanDerWaalsContact O-N 3.13Å; D331-L335 WeakPolarHBondContact O-CG 3.49Å; D331-L335 PolarHBondContact O-N 2.95Å; D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.32Å; D331-A354 VanDerWaalsContact OD1-CB 3.31Å; D331-A354 WeakPolarHBondContact OD1-CB 3.22Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; D331-L357 HydrophobicContact CB-CD2 4.23Å; D331-Y358 VanDerWaalsContact OD2-CA 3.3Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.29Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.39Å; D331-Y358 PolarHBondContact OD2-N 3.4Å; D331-Y358 VanDerWaalsContact OD2-N 3.11Å
332L98.9Very high98.4Very high54 Ų5449 Ų4928%0.28326%0.259SS..Hα-helixtrans-61-36.9172.3-77.6169000112.9F276 L328 A329 L335 T336 Y358F276-L332 HydrophobicContact CB-CD2 4.25Å; F276-L332 HydrophobicContact CD2-CD2 3.66Å; F276-L332 HydrophobicContact CE2-CD2 4.32Å; F276-L332 HydrophobicContact CG-CD2 4.1Å; L328-L332 HydrophobicContact CG-CD1 4.48Å; L328-L332 WeakPolarHBondContact O-CG 3.27Å; L328-L332 PolarHBondContact O-N 3.28Å; A329-L332 PolarHBondContact O-N 3.24Å; L332-L335 HydrophobicContact CD2-CD1 4.39Å; L332-T336 WeakPolarHBondContact O-CB 3.34Å; L332-T336 PolarHBondContact O-N 3.44Å; L332-T336 PolarHBondContact O-OG1 3Å; L332-Y358 HydrophobicContact CD2-CD2 4.02Å; L332-Y358 HydrophobicContact CD2-CE2 3.76Å; L332-Y358 HydrophobicContact CG-CD2 4.4Å; L332-Y358 HydrophobicContact CG-CE2 4.31Å
333L98.8Very high98.3Very high128 Ų12851.4 Ų51.467%0.6728%0.277SS*.Hα-helixtrans-67-40173.3-67.3173.8000111.5A329 A330 D331 T336 W337A329-L333 WeakPolarHBondContact O-CG 3.4Å; A329-L333 PolarHBondContact O-N 3.47Å; A330-L333 WeakPolarHBondContact O-CB 3.33Å; A330-L333 PolarHBondContact O-N 3.08Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.31Å; L333-T336 PolarHBondContact O-N 2.93Å; L333-W337 WeakPolarHBondContact O-CB 3.26Å; L333-W337 PolarHBondContact O-N 2.88Å
334I98.9Very high98.1Very high70 Ų7050.3 Ų50.336%0.35927%0.27SS..Hα-helixtrans-63.3-47.9174.2-68.1168.4000110.3A330 D331 T336 W337 I338 I350 A354A330-I334 WeakPolarHBondContact O-CG1 3.06Å; A330-I334 PolarHBondContact O-N 3.04Å; D331-I334 CarbonylContact O-C 3.5Å; D331-I334 WeakPolarHBondContact O-CB 3.38Å; D331-I334 PolarHBondContact O-N 3.1Å; D331-I334 VanDerWaalsContact O-N 3.13Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.36Å; I334-W337 HydrophobicContact CG2-CE3 4.44Å; I334-W337 PolarHBondContact O-N 3.47Å; I334-I338 HydrophobicContact CG2-CG1 4.14Å; I334-I338 WeakPolarHBondContact O-CB 3.27Å; I334-I338 VanDerWaalsContact O-CG1 3.28Å; I334-I338 WeakPolarHBondContact O-CG1 2.92Å; I334-I338 PolarHBondContact O-N 3.4Å; I334-I350 HydrophobicContact CG2-CG2 4Å; I334-A354 HydrophobicContact CG2-CB 4.11Å
335L98.9Very high98Very high0 Ų059.1 Ų59.10%030%0.303CS..Hα-helixtrans-57.7-41.3176.3-73.2170.7000111.5F276 T279 I280 D331 L332 G339 A354 Y358F276-L335 HydrophobicContact CB-CB 3.93Å; T279-L335 WeakPolarHBondContact CB-O 3.07Å; T279-L335 HydrophobicContact CG2-CD2 3.52Å; T279-L335 PolarHBondContact OG1-O 2.82Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.22Å; I280-L335 HydrophobicContact CG1-CD2 4.13Å; D331-L335 WeakPolarHBondContact O-CG 3.49Å; D331-L335 PolarHBondContact O-N 2.95Å; L332-L335 HydrophobicContact CD2-CD1 4.39Å; L335-G339 PolarHBondContact O-N 2.85Å; L335-A354 HydrophobicContact CD2-CB 3.59Å; L335-A354 HydrophobicContact CG-CB 3.96Å; L335-Y358 HydrophobicContact CD1-CD2 4.33Å; L335-Y358 HydrophobicContact CD1-CG 4.33Å
336T98.8Very high97.9Very high35 Ų3560 Ų6022%0.21531%0.313CS..Hα-helixtrans-63.2-48.1175.7-58.20000111L275 L332 L333 I334 G339 G340L275-T336 HydrophobicContact CB-CG2 4.07Å; L275-T336 WeakPolarHBondContact CB-O 3.5Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å; L332-T336 WeakPolarHBondContact O-CB 3.34Å; L332-T336 PolarHBondContact O-N 3.44Å; L332-T336 PolarHBondContact O-OG1 3Å; L333-T336 PolarHBondContact O-N 2.93Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 3.36Å; T336-G339 PolarHBondContact O-N 3.17Å; T336-G340 PolarHBondContact O-N 3.11Å
337W98.7Very high97.9Very high131 Ų13155.2 Ų55.250%0.49630%0.296SS..Hα-helixtrans-59.6-49.3177.6166.258.6000112L333 I334 G339 G340 Q341 F347L333-W337 WeakPolarHBondContact O-CB 3.26Å; L333-W337 PolarHBondContact O-N 2.88Å; I334-W337 HydrophobicContact CG2-CE3 4.44Å; I334-W337 PolarHBondContact O-N 3.47Å; W337-G339 PolarHBondContact O-N 3.11Å; W337-G340 PolarHBondContact O-N 3.34Å; W337-G340 VanDerWaalsContact O-N 3.09Å; W337-Q341 WeakPolarHBondContact O-CG 3.5Å; W337-F347 HydrophobicContact CH2-CD1 4.34Å; W337-F347 AromaticContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CZ2-CD1 4.39Å; W337-F347 AromaticContact CZ2-CE1 3.74Å; W337-F347 HydrophobicContact CZ2-CE1 3.74Å
338I98.6Very high97.9Very high4 Ų454.5 Ų54.52%0.02130%0.295CS..Hα-helixtrans-61.8-31.8178.1-65.4-62.1000111.6T279 R282 I334 G340 Q341 F347 I350T279-I338 HydrophobicContact CG2-CB 4.04Å; T279-I338 HydrophobicContact CG2-CG2 3.63Å; R282-I338 PolarHBondContact NH2-O 3.34Å; I334-I338 HydrophobicContact CG2-CG1 4.14Å; I334-I338 WeakPolarHBondContact O-CB 3.27Å; I334-I338 VanDerWaalsContact O-CG1 3.28Å; I334-I338 WeakPolarHBondContact O-CG1 2.92Å; I334-I338 PolarHBondContact O-N 3.4Å; I338-G340 PolarHBondContact O-N 3.46Å; I338-Q341 WeakPolarHBondContact O-CB 3.45Å; I338-Q341 PolarHBondContact O-N 3.1Å; I338-F347 HydrophobicContact CD1-CB 4.25Å; I338-F347 HydrophobicContact CD1-CD1 3.73Å; I338-F347 HydrophobicContact CD1-CG 4.44Å; I338-I350 HydrophobicContact CD1-CB 3.88Å; I338-I350 HydrophobicContact CD1-CD1 4.37Å; I338-I350 HydrophobicContact CD1-CG2 3.65Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.84Å
339G97.9Very high97.9Very high0 Ų058 Ų580%031%0.312CS..Hα-helixtrans-61.4-33177.400000112T279 R282 L335 T336 W337 Q341T279-G339 WeakPolarHBondContact OG1-CA 3.35Å; T279-G339 PolarHBondContact OG1-N 3.07Å; R282-G339 PolarHBondContact NH2-O 3.45Å; L335-G339 PolarHBondContact O-N 2.85Å; T336-G339 PolarHBondContact O-N 3.17Å; W337-G339 PolarHBondContact O-N 3.11Å; G339-Q341 VanDerWaalsContact C-N 3.33Å
340G97Very high97.9Very high21 Ų2159.2 Ų59.222%0.21631%0.314CS..THydrogen-bonded Turntrans-80.2-7.6175.200000114.8H267 T336 W337 I338H267-G340 PolarHBondContact CE1-O 3.33Å; H267-G340 VanDerWaalsContact CE1-O 3.23Å; T336-G340 PolarHBondContact O-N 3.11Å; W337-G340 PolarHBondContact O-N 3.34Å; W337-G340 VanDerWaalsContact O-N 3.09Å; I338-G340 PolarHBondContact O-N 3.46Å
341Q97.8Very high97.8Very high52 Ų5257.1 Ų57.124%0.24330%0.297CS..SBendtrans-94.7152.5-179.9-57.5-50-4400112.5H267 R282 W337 I338 G339 F347H267-Q341 VanDerWaalsContact CE1-C 3.44Å; H267-Q341 PolarHBondContact CE1-O 3.28Å; H267-Q341 VanDerWaalsContact CE1-O 3.28Å; H267-Q341 PolarHBondContact NE2-O 3.3Å; R282-Q341 PolarHBondContact NH1-O 3.36Å; R282-Q341 PolarHBondContact NH2-O 2.8Å; W337-Q341 WeakPolarHBondContact O-CG 3.5Å; I338-Q341 WeakPolarHBondContact O-CB 3.45Å; I338-Q341 PolarHBondContact O-N 3.1Å; G339-Q341 VanDerWaalsContact C-N 3.33Å; Q341-F347 HydrophobicContact CB-CB 4.09Å; Q341-F347 HydrophobicContact CB-CD1 3.94Å; Q341-F347 HydrophobicContact CB-CD2 3.72Å; Q341-F347 HydrophobicContact CB-CE1 4.29Å; Q341-F347 HydrophobicContact CB-CE2 4.07Å; Q341-F347 HydrophobicContact CB-CG 3.64Å; Q341-F347 HydrophobicContact CB-CZ 4.34Å; Q341-F347 HydrophobicContact CG-CD1 3.8Å; Q341-F347 HydrophobicContact CG-CD2 4.3Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.29Å; Q341-F347 HydrophobicContact CG-CG 4.05Å; Q341-F347 HydrophobicContact CG-CZ 4.05Å
342P95.6Very high97.8Very high59 Ų5960.1 Ų60.138%0.38331%0.311SS..  trans-66154.2174.828.5-35.9000111.8S344 F347P342-S344 VanDerWaalsContact C-N 3.32Å; P342-S344 PolarHBondContact O-N 3.02Å; P342-S344 PolarHBondContact O-OG 3.06Å; P342-F347 HydrophobicContact CG-CD2 4.42Å
343V94.9Very high97.8Very high102 Ų10261.9 Ų61.962%0.61832%0.324SS*.SBendtrans-74.885.8176.3-172.60000109.6
344S95.8Very high97.8Very high48 Ų4856 Ų5634%0.33629%0.294SS..  trans-152.6163.9-178.357.80000110.6P342 P346 F347 T348P342-S344 VanDerWaalsContact C-N 3.32Å; P342-S344 PolarHBondContact O-N 3.02Å; P342-S344 PolarHBondContact O-OG 3.06Å; S344-P346 CarbonylContact O-C 3.57Å; S344-F347 WeakPolarHBondContact O-CA 3.32Å; S344-F347 WeakPolarHBondContact O-CB 3.42Å; S344-F347 PolarHBondContact O-N 2.91Å; S344-T348 PolarHBondContact N-OG1 3.2Å; S344-T348 PolarHBondContact O-N 3.24Å; S344-T348 PolarHBondContact O-OG1 3.33Å
345Y96Very high97.8Very high202 Ų20253.1 Ų53.179%0.79228%0.28SS*.THydrogen-bonded Turntrans-67.8136.2171-179.1-91000110.4I349Y345-I349 HydrophobicContact CD2-CG2 4.49Å; Y345-I349 HydrophobicContact CE2-CG2 4.34Å
346P97.3Very high97.8Very high51 Ų5157.7 Ų57.733%0.33131%0.307SS..THydrogen-bonded Turncis-92.60.62.836.8-35.7000114.7S344 T348 I349 I350S344-P346 CarbonylContact O-C 3.57Å; P346-T348 VanDerWaalsContact C-N 3.31Å; P346-T348 PolarHBondContact O-N 2.92Å; P346-I349 HydrophobicContact CB-CG2 4.48Å; P346-I349 WeakPolarHBondContact O-CG2 3.4Å; P346-I349 PolarHBondContact O-N 3.07Å; P346-I350 HydrophobicContact CB-CD1 4.2Å; P346-I350 HydrophobicContact CG-CD1 4.22Å; P346-I350 WeakPolarHBondContact O-CG1 3.48Å; P346-I350 PolarHBondContact O-N 3Å; P346-I350 VanDerWaalsContact O-N 3.15Å
347F98.3Very high97.8Very high44 Ų4458.6 Ų58.619%0.19331%0.311CS..Hα-helixtrans-62.2-34.5-173.3-56.2-55000113.9W337 I338 Q341 P342 S344 I349 I350 G351W337-F347 HydrophobicContact CH2-CD1 4.34Å; W337-F347 AromaticContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CH2-CE1 3.99Å; W337-F347 HydrophobicContact CZ2-CD1 4.39Å; W337-F347 AromaticContact CZ2-CE1 3.74Å; W337-F347 HydrophobicContact CZ2-CE1 3.74Å; I338-F347 HydrophobicContact CD1-CB 4.25Å; I338-F347 HydrophobicContact CD1-CD1 3.73Å; I338-F347 HydrophobicContact CD1-CG 4.44Å; Q341-F347 HydrophobicContact CB-CB 4.09Å; Q341-F347 HydrophobicContact CB-CD1 3.94Å; Q341-F347 HydrophobicContact CB-CD2 3.72Å; Q341-F347 HydrophobicContact CB-CE1 4.29Å; Q341-F347 HydrophobicContact CB-CE2 4.07Å; Q341-F347 HydrophobicContact CB-CG 3.64Å; Q341-F347 HydrophobicContact CB-CZ 4.34Å; Q341-F347 HydrophobicContact CG-CD1 3.8Å; Q341-F347 HydrophobicContact CG-CD2 4.3Å; Q341-F347 HydrophobicContact CG-CE1 3.81Å; Q341-F347 HydrophobicContact CG-CE2 4.29Å; Q341-F347 HydrophobicContact CG-CG 4.05Å; Q341-F347 HydrophobicContact CG-CZ 4.05Å; P342-F347 HydrophobicContact CG-CD2 4.42Å; S344-F347 WeakPolarHBondContact O-CA 3.32Å; S344-F347 WeakPolarHBondContact O-CB 3.42Å; S344-F347 PolarHBondContact O-N 2.91Å; F347-I349 PolarHBondContact O-N 2.87Å; F347-I350 PolarHBondContact O-N 2.82Å; F347-G351 PolarHBondContact O-N 3.49Å
348T97.8Very high97.8Very high55 Ų5552.9 Ų52.934%0.33729%0.289SS..Hα-helixtrans-59.1-48.4176.7-54.80000111.9S344 P346 G351 Q352S344-T348 PolarHBondContact N-OG1 3.2Å; S344-T348 PolarHBondContact O-N 3.24Å; S344-T348 PolarHBondContact O-OG1 3.33Å; P346-T348 VanDerWaalsContact C-N 3.31Å; P346-T348 PolarHBondContact O-N 2.92Å; T348-G351 PolarHBondContact O-N 3.5Å; T348-Q352 WeakPolarHBondContact O-CG 3.24Å; T348-Q352 PolarHBondContact O-N 3.08Å; T348-Q352 VanDerWaalsContact O-N 3.09Å
349I98.5Very high97.9Very high82 Ų8254.7 Ų54.742%0.42130%0.297SS..Hα-helixtrans-72.1-36.1-178.5-173.461.1000111.5Y345 P346 F347 G351 Q352 V353Y345-I349 HydrophobicContact CD2-CG2 4.49Å; Y345-I349 HydrophobicContact CE2-CG2 4.34Å; P346-I349 HydrophobicContact CB-CG2 4.48Å; P346-I349 WeakPolarHBondContact O-CG2 3.4Å; P346-I349 PolarHBondContact O-N 3.07Å; F347-I349 PolarHBondContact O-N 2.87Å; I349-G351 VanDerWaalsContact C-N 3.35Å; I349-G351 PolarHBondContact O-N 3.2Å; I349-Q352 PolarHBondContact O-N 2.97Å; I349-V353 HydrophobicContact CD1-CG2 4.32Å; I349-V353 HydrophobicContact CG1-CG2 4.4Å; I349-V353 WeakPolarHBondContact O-CG2 3.24Å; I349-V353 PolarHBondContact O-N 3.39Å
350I98.7Very high97.9Very high55 Ų5557 Ų5728%0.28231%0.311SS..Hα-helixtrans-62.1-45.4174.9-61.2165.7000110.1I334 I338 P346 F347 Q352 V353 A354I334-I350 HydrophobicContact CG2-CG2 4Å; I338-I350 HydrophobicContact CD1-CB 3.88Å; I338-I350 HydrophobicContact CD1-CD1 4.37Å; I338-I350 HydrophobicContact CD1-CG2 3.65Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.84Å; P346-I350 HydrophobicContact CB-CD1 4.2Å; P346-I350 HydrophobicContact CG-CD1 4.22Å; P346-I350 WeakPolarHBondContact O-CG1 3.48Å; P346-I350 PolarHBondContact O-N 3Å; P346-I350 VanDerWaalsContact O-N 3.15Å; F347-I350 PolarHBondContact O-N 2.82Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.46Å; I350-V353 PolarHBondContact O-N 2.97Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.28Å; I350-A354 PolarHBondContact O-N 2.86Å
351G98.6Very high98Very high2 Ų256 Ų562%0.02130%0.3CS..Hα-helixtrans-59.2-42.9176.700000112.8S283 F347 T348 I349 S355S283-G351 PolarHBondContact OG-O 3.43Å; S283-G351 VanDerWaalsContact OG-O 3.04Å; F347-G351 PolarHBondContact O-N 3.49Å; T348-G351 PolarHBondContact O-N 3.5Å; I349-G351 VanDerWaalsContact C-N 3.35Å; I349-G351 PolarHBondContact O-N 3.2Å; G351-S355 WeakPolarHBondContact O-CB 3.38Å; G351-S355 PolarHBondContact O-N 3.43Å; G351-S355 PolarHBondContact O-OG 3.04Å
352Q98.8Very high98Very high68 Ų6853.8 Ų53.832%0.31829%0.29SS..Hα-helixtrans-62.9-48.4176.5-74.3173.8-23.400112.3S283 T348 I349 I350 S355 V356S283-Q352 WeakPolarHBondContact O-CG 3.1Å; S283-Q352 PolarHBondContact O-NE2 2.89Å; S283-Q352 PolarHBondContact OG-N 3.24Å; T348-Q352 WeakPolarHBondContact O-CG 3.24Å; T348-Q352 PolarHBondContact O-N 3.08Å; T348-Q352 VanDerWaalsContact O-N 3.09Å; I349-Q352 PolarHBondContact O-N 2.97Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.46Å; Q352-S355 PolarHBondContact O-N 3.1Å; Q352-V356 WeakPolarHBondContact O-CG2 3.49Å; Q352-V356 PolarHBondContact O-N 2.95Å
353V98.8Very high98.2Very high90 Ų9054.6 Ų54.655%0.54529%0.291SS..Hα-helixtrans-62.9-45.8178.8172.40000111I349 I350 S355 V356 L357I349-V353 HydrophobicContact CD1-CG2 4.32Å; I349-V353 HydrophobicContact CG1-CG2 4.4Å; I349-V353 WeakPolarHBondContact O-CG2 3.24Å; I349-V353 PolarHBondContact O-N 3.39Å; I350-V353 PolarHBondContact O-N 2.97Å; V353-S355 VanDerWaalsContact C-N 3.34Å; V353-S355 PolarHBondContact O-N 2.9Å; V353-V356 PolarHBondContact O-N 2.75Å; V353-L357 WeakPolarHBondContact O-CB 3.05Å; V353-L357 PolarHBondContact O-N 2.67Å
354A98.9Very high98.3Very high5 Ų554.2 Ų54.24%0.04129%0.285CS..Hα-helixtrans-61.6-41.8176.500000111.6D331 I334 L335 I350 V356 L357 Y358D331-A354 VanDerWaalsContact OD1-CA 3.3Å; D331-A354 WeakPolarHBondContact OD1-CA 3.32Å; D331-A354 VanDerWaalsContact OD1-CB 3.31Å; D331-A354 WeakPolarHBondContact OD1-CB 3.22Å; D331-A354 VanDerWaalsContact OD2-O 3.07Å; I334-A354 HydrophobicContact CG2-CB 4.11Å; L335-A354 HydrophobicContact CD2-CB 3.59Å; L335-A354 HydrophobicContact CG-CB 3.96Å; I350-A354 VanDerWaalsContact O-CB 3.28Å; I350-A354 WeakPolarHBondContact O-CB 3.28Å; I350-A354 PolarHBondContact O-N 2.86Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3Å; A354-L357 WeakPolarHBondContact O-CB 3.44Å; A354-L357 PolarHBondContact O-N 3.34Å; A354-L357 VanDerWaalsContact O-N 3.14Å; A354-Y358 PolarHBondContact O-N 3.27Å
355S98.8Very high98.5Very high10 Ų1054.6 Ų54.67%0.0728%0.283CS..Hα-helixtrans-63.4-40.6177.5-56.40000111.9S283 G351 Q352 V353 F359S283-S355 WeakPolarHBondContact CB-OG 3.02Å; S283-S355 PolarHBondContact OG-OG 3.3Å; G351-S355 WeakPolarHBondContact O-CB 3.38Å; G351-S355 PolarHBondContact O-N 3.43Å; G351-S355 PolarHBondContact O-OG 3.04Å; Q352-S355 PolarHBondContact O-N 3.1Å; V353-S355 VanDerWaalsContact C-N 3.34Å; V353-S355 PolarHBondContact O-N 2.9Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.42Å; S355-F359 PolarHBondContact O-N 2.78Å
356V98.8Very high98.6Very high95 Ų9546.2 Ų46.258%0.57625%0.251SS*.Hα-helixtrans-64.9-42.8173.5171.30000110.6Q352 V353 A354 Y358 T360Q352-V356 WeakPolarHBondContact O-CG2 3.49Å; Q352-V356 PolarHBondContact O-N 2.95Å; V353-V356 PolarHBondContact O-N 2.75Å; A354-V356 VanDerWaalsContact C-N 3.34Å; A354-V356 PolarHBondContact O-N 3Å; V356-Y358 PolarHBondContact O-N 2.96Å; V356-T360 WeakPolarHBondContact O-CB 3.39Å; V356-T360 PolarHBondContact O-N 2.87Å; V356-T360 PolarHBondContact O-OG1 2.76Å
357L98.8Very high98.6Very high54 Ų5444.5 Ų44.528%0.28324%0.24SC..Hα-helixtrans-61.8-42.4178.9-17660.4000111.6L327 D331 V353 A354 T360 T361L327-L357 HydrophobicContact CD1-CD2 4.3Å; L327-L357 HydrophobicContact CD2-CD1 4.35Å; D331-L357 HydrophobicContact CB-CD2 4.23Å; V353-L357 WeakPolarHBondContact O-CB 3.05Å; V353-L357 PolarHBondContact O-N 2.67Å; A354-L357 WeakPolarHBondContact O-CB 3.44Å; A354-L357 PolarHBondContact O-N 3.34Å; A354-L357 VanDerWaalsContact O-N 3.14Å; L357-T360 PolarHBondContact O-N 3.46Å; L357-T361 WeakPolarHBondContact O-CB 3.35Å; L357-T361 PolarHBondContact O-N 3.29Å; L357-T361 PolarHBondContact O-OG1 2.94Å
358Y98.9Very high98.6Very high12 Ų1245.3 Ų45.35%0.04725%0.249CC..Hα-helixtrans-53.5-58.7175.7176.7-102.1000112.1I280 S297 I300 L328 D331 L332 L335 A354 V356 T361 I362I280-Y358 HydrophobicContact CD1-CD1 3.88Å; I280-Y358 HydrophobicContact CD1-CE1 4.19Å; I280-Y358 HydrophobicContact CD1-CG 4.28Å; S297-Y358 PolarHBondContact O-OH 3.23Å; I300-Y358 HydrophobicContact CG2-CE1 4.12Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.39Å; L328-Y358 HydrophobicContact CD1-CD2 3.59Å; L328-Y358 HydrophobicContact CD1-CE2 3.9Å; D331-Y358 VanDerWaalsContact OD2-CA 3.3Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.29Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.39Å; D331-Y358 PolarHBondContact OD2-N 3.4Å; D331-Y358 VanDerWaalsContact OD2-N 3.11Å; L332-Y358 HydrophobicContact CD2-CD2 4.02Å; L332-Y358 HydrophobicContact CD2-CE2 3.76Å; L332-Y358 HydrophobicContact CG-CD2 4.4Å; L332-Y358 HydrophobicContact CG-CE2 4.31Å; L335-Y358 HydrophobicContact CD1-CD2 4.33Å; L335-Y358 HydrophobicContact CD1-CG 4.33Å; A354-Y358 PolarHBondContact O-N 3.27Å; V356-Y358 PolarHBondContact O-N 2.96Å; Y358-T361 PolarHBondContact O-N 2.95Å; Y358-I362 HydrophobicContact CD1-CD1 4.5Å; Y358-I362 HydrophobicContact CD2-CD1 4.17Å; Y358-I362 HydrophobicContact CE1-CD1 4.02Å; Y358-I362 HydrophobicContact CE2-CD1 3.63Å; Y358-I362 PolarHBondContact O-N 2.95Å
359F98.8Very high98.7Very high42 Ų4244.3 Ų44.318%0.18424%0.241CC..Hα-helixtrans-66.9-40.4-178.7-74.2-72.1000112I280 L296 I300 S355 T361 I362 L363I280-F359 HydrophobicContact CG2-CE2 3.85Å; I280-F359 HydrophobicContact CG2-CZ 4.31Å; L296-F359 HydrophobicContact CB-CE1 4.22Å; L296-F359 HydrophobicContact CB-CZ 4.35Å; I300-F359 HydrophobicContact CD1-CD1 3.71Å; I300-F359 HydrophobicContact CD1-CE1 4.11Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.42Å; S355-F359 PolarHBondContact O-N 2.78Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 2.96Å; F359-I362 PolarHBondContact O-N 2.99Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.43Å; F359-L363 VanDerWaalsContact O-CB 3.27Å; F359-L363 WeakPolarHBondContact O-CB 3.21Å; F359-L363 VanDerWaalsContact O-CG 3.32Å; F359-L363 WeakPolarHBondContact O-CG 3.22Å; F359-L363 PolarHBondContact O-N 3.5Å
360T98.8Very high98.6Very high47 Ų4740.6 Ų40.629%0.28822%0.222SC..Hα-helixtrans-64.4-40.5179.4-580000111.4V356 L357 I364 L365V356-T360 WeakPolarHBondContact O-CB 3.39Å; V356-T360 PolarHBondContact O-N 2.87Å; V356-T360 PolarHBondContact O-OG1 2.76Å; L357-T360 PolarHBondContact O-N 3.46Å; T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.43Å; T360-I364 WeakPolarHBondContact O-CA 3.31Å; T360-I364 WeakPolarHBondContact O-CB 3.3Å; T360-I364 PolarHBondContact O-N 2.78Å; T360-L365 HydrophobicContact CG2-CD1 4.39Å; T360-L365 HydrophobicContact CG2-CG 4.15Å; T360-L365 PolarHBondContact O-N 2.92Å
361T98.8Very high98.6Very high0 Ų042 Ų420%023%0.23CC..Iπ-helixtrans-62.2-47.3179.3-60.30000110.8L328 L357 Y358 F359 L365 M366L328-T361 HydrophobicContact CB-CG2 4.12Å; L357-T361 WeakPolarHBondContact O-CB 3.35Å; L357-T361 PolarHBondContact O-N 3.29Å; L357-T361 PolarHBondContact O-OG1 2.94Å; Y358-T361 PolarHBondContact O-N 2.95Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 2.96Å; T361-L365 PolarHBondContact O-N 2.81Å; T361-M366 HydrophobicContact CG2-CE 4.22Å; T361-M366 HydrophobicContact CG2-CG 4.4Å; T361-M366 WeakPolarHBondContact O-CB 3.26Å; T361-M366 WeakPolarHBondContact O-CG 3.24Å; T361-M366 PolarHBondContact O-N 2.93Å
362I98.7Very high98.6Very high6 Ų645.7 Ų45.73%0.03125%0.248CC..Iπ-helixtrans-73.5-49.4-177.5-63.6168.9000111.9I300 I304 L307 L328 Y358 F359 P367I300-I362 HydrophobicContact CD1-CB 3.81Å; I300-I362 HydrophobicContact CD1-CD1 4Å; I300-I362 HydrophobicContact CD1-CG2 3.57Å; I300-I362 HydrophobicContact CG1-CG2 3.75Å; I300-I362 HydrophobicContact CG2-CD1 4.24Å; I304-I362 HydrophobicContact CD1-CG2 3.41Å; I304-I362 VanDerWaalsContact CD1-CG2 3.41Å; L307-I362 HydrophobicContact CD1-CG2 4.2Å; L328-I362 HydrophobicContact CD1-CD1 4.11Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.23Å; L328-I362 HydrophobicContact CD2-CG1 3.95Å; Y358-I362 HydrophobicContact CD1-CD1 4.5Å; Y358-I362 HydrophobicContact CD2-CD1 4.17Å; Y358-I362 HydrophobicContact CE1-CD1 4.02Å; Y358-I362 HydrophobicContact CE2-CD1 3.63Å; Y358-I362 PolarHBondContact O-N 2.95Å; F359-I362 PolarHBondContact O-N 2.99Å; I362-P367 WeakPolarHBondContact O-CD 3.37Å
363L98.6Very high98.6Very high76 Ų7643 Ų4340%0.39824%0.235SC..Iπ-helixtrans-80.5-28.7-170.6-61.8178.1000113.5I300 L307 F359I300-L363 HydrophobicContact CD1-CD1 4.39Å; I300-L363 HydrophobicContact CD1-CD2 3.71Å; I300-L363 HydrophobicContact CD1-CG 3.85Å; I300-L363 HydrophobicContact CG1-CD2 4.09Å; L307-L363 HydrophobicContact CD1-CD2 3.82Å; F359-L363 HydrophobicContact CB-CD1 4.43Å; F359-L363 HydrophobicContact CD1-CD1 4.43Å; F359-L363 VanDerWaalsContact O-CB 3.27Å; F359-L363 WeakPolarHBondContact O-CB 3.21Å; F359-L363 VanDerWaalsContact O-CG 3.32Å; F359-L363 WeakPolarHBondContact O-CG 3.22Å; F359-L363 PolarHBondContact O-N 3.5Å
364I98.6Very high98.6Very high94 Ų9439.1 Ų39.148%0.48221%0.212SC..Iπ-helixtrans-121.8-57.3-169.6-54.3179.2000111.1T360 P367 T368T360-I364 HydrophobicContact CG2-CB 4.43Å; T360-I364 HydrophobicContact CG2-CD1 4.43Å; T360-I364 WeakPolarHBondContact O-CA 3.31Å; T360-I364 WeakPolarHBondContact O-CB 3.3Å; T360-I364 PolarHBondContact O-N 2.78Å; I364-P367 WeakPolarHBondContact O-CD 3.27Å; I364-T368 HydrophobicContact CG2-CG2 4.44Å; I364-T368 WeakPolarHBondContact O-CB 3.48Å; I364-T368 WeakPolarHBondContact O-CG2 3.06Å; I364-T368 PolarHBondContact O-N 3.15Å; I364-T368 VanDerWaalsContact O-N 3.13Å; I364-T368 PolarHBondContact O-OG1 3.4Å
365L98.6Very high98.5Very high56 Ų5646.6 Ų46.629%0.29324%0.244SC..Iπ-helixtrans-68.8-44.8-170.6-57.4179.3000112.4L324 T360 T361 T368 I369L324-L365 HydrophobicContact CD1-CB 3.77Å; L324-L365 HydrophobicContact CD2-CB 4.2Å; L324-L365 HydrophobicContact CD2-CD1 4.25Å; T360-L365 HydrophobicContact CG2-CD1 4.39Å; T360-L365 HydrophobicContact CG2-CG 4.15Å; T360-L365 PolarHBondContact O-N 2.92Å; T361-L365 PolarHBondContact O-N 2.81Å; L365-T368 WeakPolarHBondContact CA-OG1 3.28Å; L365-T368 PolarHBondContact O-N 3.15Å; L365-T368 PolarHBondContact O-OG1 3.27Å; L365-I369 VanDerWaalsContact O-CB 3.32Å; L365-I369 WeakPolarHBondContact O-CB 3.39Å; L365-I369 WeakPolarHBondContact O-CG1 3.43Å; L365-I369 PolarHBondContact O-N 3.04Å
366M98.3Very high98.5Very high27 Ų2752.4 Ų52.413%0.13327%0.271CS..Hα-helixtrans-62.5-48.5-179.8-79.1-175.5175.400112.9L324 L328 T361 S370L324-M366 HydrophobicContact CB-CG 4.36Å; L324-M366 HydrophobicContact CD1-CG 4.17Å; L328-M366 HydrophobicContact CB-CE 4.28Å; L328-M366 HydrophobicContact CD2-CE 3.77Å; T361-M366 HydrophobicContact CG2-CE 4.22Å; T361-M366 HydrophobicContact CG2-CG 4.4Å; T361-M366 WeakPolarHBondContact O-CB 3.26Å; T361-M366 WeakPolarHBondContact O-CG 3.24Å; T361-M366 PolarHBondContact O-N 2.93Å; M366-S370 WeakPolarHBondContact O-CB 3.39Å; M366-S370 PolarHBondContact O-N 3.47Å; M366-S370 PolarHBondContact O-OG 3.26Å
367P98.3Very high98.4Very high14 Ų1452 Ų529%0.09127%0.265CS..Hα-helixtrans-61.9-42.7175.2-25.634.6000113.2L307 M309 I362 I364 S370 L371L307-P367 HydrophobicContact CB-CG 4.04Å; L307-P367 HydrophobicContact CD2-CG 4.1Å; M309-P367 HydrophobicContact CG-CB 4.05Å; I362-P367 WeakPolarHBondContact O-CD 3.37Å; I364-P367 WeakPolarHBondContact O-CD 3.27Å; P367-S370 WeakPolarHBondContact O-CB 3.46Å; P367-S370 PolarHBondContact O-N 3.36Å; P367-L371 WeakPolarHBondContact O-CG 3.35Å; P367-L371 PolarHBondContact O-N 3.36Å; P367-L371 VanDerWaalsContact O-N 3.11Å
368T98.5Very high98.3Very high62 Ų6258.7 Ų58.738%0.3829%0.292SS..Hα-helixtrans-66.7-44.7-178.952.40000112.1I364 L365 S370 L371 I372I364-T368 HydrophobicContact CG2-CG2 4.44Å; I364-T368 WeakPolarHBondContact O-CB 3.48Å; I364-T368 WeakPolarHBondContact O-CG2 3.06Å; I364-T368 PolarHBondContact O-N 3.15Å; I364-T368 VanDerWaalsContact O-N 3.13Å; I364-T368 PolarHBondContact O-OG1 3.4Å; L365-T368 WeakPolarHBondContact CA-OG1 3.28Å; L365-T368 PolarHBondContact O-N 3.15Å; L365-T368 PolarHBondContact O-OG1 3.27Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.41Å; T368-L371 PolarHBondContact O-N 3.02Å; T368-I372 WeakPolarHBondContact O-CG1 3.33Å; T368-I372 PolarHBondContact O-N 2.84Å
369I98.3Very high98.1Very high33 Ų3363 Ų6317%0.16931%0.308CS..Hα-helixtrans-63.1-38.6174.6-72.8-63.3000111.3L320 L324 L365 L371 I372 E373L320-I369 HydrophobicContact CB-CD1 4.45Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.35Å; L320-I369 HydrophobicContact CD1-CG2 4.46Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.55Å; L324-I369 HydrophobicContact CD1-CG2 4.3Å; L324-I369 HydrophobicContact CG-CG1 4.42Å; L365-I369 VanDerWaalsContact O-CB 3.32Å; L365-I369 WeakPolarHBondContact O-CB 3.39Å; L365-I369 WeakPolarHBondContact O-CG1 3.43Å; L365-I369 PolarHBondContact O-N 3.04Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.23Å; I369-I372 HydrophobicContact CD1-CD1 4.08Å; I369-I372 PolarHBondContact O-N 3.11Å; I369-I372 VanDerWaalsContact O-N 3.15Å; I369-E373 HydrophobicContact CG2-CG 4.26Å; I369-E373 WeakPolarHBondContact O-CG 3.49Å; I369-E373 PolarHBondContact O-N 2.89Å
370S97.8Very high96.8Very high5 Ų568 Ų684%0.03536%0.357CS..Hα-helixtrans-57-43.7174.1-57.60000111.9R318 M366 P367 T368 N374R318-S370 PolarHBondContact NH2-OG 3.23Å; M366-S370 WeakPolarHBondContact O-CB 3.39Å; M366-S370 PolarHBondContact O-N 3.47Å; M366-S370 PolarHBondContact O-OG 3.26Å; P367-S370 WeakPolarHBondContact O-CB 3.46Å; P367-S370 PolarHBondContact O-N 3.36Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.41Å; S370-N374 PolarHBondContact O-N 3.36Å; S370-N374 VanDerWaalsContact O-N 3.08Å; S370-N374 PolarHBondContact O-ND2 3.14Å; S370-N374 PolarHBondContact O-OD1 2.79Å
371L98.3Very high96.7Very high84 Ų8469.1 Ų69.144%0.4436%0.361SS..Hα-helixtrans-67.5-37.3176.5-68.8172.7000112.5M309 P367 T368 I369 K375M309-L371 HydrophobicContact CB-CD2 3.84Å; M309-L371 HydrophobicContact CB-CG 3.88Å; M309-L371 HydrophobicContact CG-CD2 4.49Å; M309-L371 HydrophobicContact CG-CG 4.39Å; P367-L371 WeakPolarHBondContact O-CG 3.35Å; P367-L371 PolarHBondContact O-N 3.36Å; P367-L371 VanDerWaalsContact O-N 3.11Å; T368-L371 PolarHBondContact O-N 3.02Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.23Å; L371-K375 WeakPolarHBondContact O-CG 3.27Å; L371-K375 PolarHBondContact O-N 3.38Å; L371-K375 VanDerWaalsContact O-N 3.12Å
372I98.3Very high96.5Very high80 Ų8072.7 Ų72.741%0.4138%0.38SS..Hα-helixtrans-64.2-47.8175.9-69.8163.6000110.3L320 T368 I369 N374 K375 M376L320-I372 HydrophobicContact CD1-CG2 4.39Å; T368-I372 WeakPolarHBondContact O-CG1 3.33Å; T368-I372 PolarHBondContact O-N 2.84Å; I369-I372 HydrophobicContact CD1-CD1 4.08Å; I369-I372 PolarHBondContact O-N 3.11Å; I369-I372 VanDerWaalsContact O-N 3.15Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.41Å; I372-K375 PolarHBondContact O-N 3.42Å; I372-K375 VanDerWaalsContact O-N 3.11Å; I372-M376 HydrophobicContact CG2-CG 4.36Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.44Å; I372-M376 PolarHBondContact O-N 3.43Å
373E98.4Very high96.4Very high10 Ų1076.4 Ų76.45%0.04740%0.399CS..Hα-helixtrans-59.9-42.2177.8-73177.1146.200111.6R318 L320 S321 I369 K375 M376 L377R318-E373 VanDerWaalsContact CA-OE1 3.31Å; R318-E373 WeakPolarHBondContact CA-OE1 3.2Å; R318-E373 WeakPolarHBondContact CB-OE1 3.27Å; R318-E373 WeakPolarHBondContact CB-OE2 3.37Å; R318-E373 IonicContact CZ-OE2 3.39Å; R318-E373 IonicContact NE-OE2 2.9Å; R318-E373 PolarHBondContact NE-OE2 3.24Å; R318-E373 IonicContact NH2-OE2 2.85Å; R318-E373 PolarHBondContact NH2-OE2 3.12Å; L320-E373 HydrophobicContact CB-CG 4.23Å; L320-E373 WeakPolarHBondContact CB-OE1 3.24Å; L320-E373 HydrophobicContact CD1-CG 4.18Å; L320-E373 HydrophobicContact CG-CG 4.47Å; L320-E373 PolarHBondContact N-OE1 3.22Å; S321-E373 PolarHBondContact N-OE1 2.55Å; S321-E373 PolarHBondContact OG-OE1 3.35Å; S321-E373 PolarHBondContact OG-OE2 3.21Å; I369-E373 HydrophobicContact CG2-CG 4.26Å; I369-E373 WeakPolarHBondContact O-CG 3.49Å; I369-E373 PolarHBondContact O-N 2.89Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 2.89Å; E373-M376 PolarHBondContact O-N 3.32Å; E373-L377 WeakPolarHBondContact O-CG 3.5Å; E373-L377 PolarHBondContact O-N 3.26Å; E373-L377 VanDerWaalsContact O-N 3.08Å
374N98.4Very high96.3Very high9 Ų976.4 Ų76.45%0.04840%0.399CS..Hα-helixtrans-57-46.8173.2-69.1-20.3000111.6M309 K311 S370 I372 L377 K378 W379M309-N374 PolarHBondContact O-ND2 3.02Å; K311-N374 PolarHBondContact N-OD1 3.33Å; S370-N374 PolarHBondContact O-N 3.36Å; S370-N374 VanDerWaalsContact O-N 3.08Å; S370-N374 PolarHBondContact O-ND2 3.14Å; S370-N374 PolarHBondContact O-OD1 2.79Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.41Å; N374-L377 CarbonylContact O-C 3.52Å; N374-L377 PolarHBondContact O-N 2.86Å; N374-K378 PolarHBondContact O-N 3.09Å; N374-W379 HydrophobicContact CB-CB 4.32Å; N374-W379 PolarHBondContact O-N 3.15Å
375K97.8Very high96.2Very high163 Ų16375.3 Ų75.371%0.70939%0.394SS*.Hα-helixtrans-64.7-39.2178.7-73.5-178.6179.8-176.90112.4L371 I372 E373 L377 K378L371-K375 WeakPolarHBondContact O-CG 3.27Å; L371-K375 PolarHBondContact O-N 3.38Å; L371-K375 VanDerWaalsContact O-N 3.12Å; I372-K375 PolarHBondContact O-N 3.42Å; I372-K375 VanDerWaalsContact O-N 3.11Å; E373-K375 VanDerWaalsContact C-N 3.34Å; E373-K375 PolarHBondContact O-N 2.89Å; K375-L377 PolarHBondContact O-N 3.23Å; K375-K378 PolarHBondContact O-N 3.38Å
376M97.8Very high96Very high131 Ų13176.6 Ų76.665%0.64540%0.401SS*.Hα-helixtrans-60.2-34.3175-70.1172.765.800111.9L320 I372 E373 K378L320-M376 HydrophobicContact CD1-SD 4.08Å; I372-M376 HydrophobicContact CG2-CG 4.36Å; I372-M376 HydrophobicContact CG2-SD 3.97Å; I372-M376 WeakPolarHBondContact O-CG 3.44Å; I372-M376 PolarHBondContact O-N 3.43Å; E373-M376 PolarHBondContact O-N 3.32Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 2.83Å
377L97.8Very high95.8Very high87 Ų8780.1 Ų80.146%0.45542%0.42SS..THydrogen-bonded Turntrans-84.94.9175-64.4176.3000113.9E373 N374 K375 W379E373-L377 WeakPolarHBondContact O-CG 3.5Å; E373-L377 PolarHBondContact O-N 3.26Å; E373-L377 VanDerWaalsContact O-N 3.08Å; N374-L377 CarbonylContact O-C 3.52Å; N374-L377 PolarHBondContact O-N 2.86Å; K375-L377 PolarHBondContact O-N 3.23Å; L377-W379 HydrophobicContact CB-CD2 4.17Å; L377-W379 HydrophobicContact CB-CE3 4.18Å; L377-W379 HydrophobicContact CD1-CE3 3.89Å; L377-W379 HydrophobicContact CD1-CH2 3.9Å; L377-W379 HydrophobicContact CD1-CZ3 3.55Å; L377-W379 PolarHBondContact O-N 3.33Å
378K96.6Very high95.6Very high194 Ų19485.2 Ų85.284%0.84345%0.445SS*.THydrogen-bonded Turntrans5731.5-176.3-52.5177.8-178177.10113.1N374 K375 M376N374-K378 PolarHBondContact O-N 3.09Å; K375-K378 PolarHBondContact O-N 3.38Å; M376-K378 VanDerWaalsContact C-N 3.28Å; M376-K378 PolarHBondContact O-N 2.83Å
379W93.9Very high95.4Very high103 Ų10387.2 Ų87.239%0.3945%0.451SS..  trans-82.1136.6169.6-74.7-24.8000111.2K311 Q312 N374 L377K311-W379 HydrophobicContact CB-CD2 4.01Å; K311-W379 HydrophobicContact CB-CE3 3.47Å; K311-W379 VanDerWaalsContact CB-CE3 3.47Å; K311-W379 HydrophobicContact CB-CH2 4.48Å; K311-W379 HydrophobicContact CB-CZ3 3.74Å; K311-W379 HydrophobicContact CG-CB 4.17Å; K311-W379 HydrophobicContact CG-CD2 4.21Å; K311-W379 HydrophobicContact CG-CE3 3.88Å; K311-W379 HydrophobicContact CG-CG 4.39Å; Q312-W379 HydrophobicContact CB-CZ3 4.41Å; Q312-W379 HydrophobicContact CG-CH2 3.41Å; Q312-W379 VanDerWaalsContact CG-CH2 3.41Å; Q312-W379 HydrophobicContact CG-CZ3 3.57Å; N374-W379 HydrophobicContact CB-CB 4.32Å; N374-W379 PolarHBondContact O-N 3.15Å; L377-W379 HydrophobicContact CB-CD2 4.17Å; L377-W379 HydrophobicContact CB-CE3 4.18Å; L377-W379 HydrophobicContact CD1-CE3 3.89Å; L377-W379 HydrophobicContact CD1-CH2 3.9Å; L377-W379 HydrophobicContact CD1-CZ3 3.55Å; L377-W379 PolarHBondContact O-N 3.33Å
380A71.3Confident95.1Very high147 Ų14792.1 Ų92.1100%1.21548%0.476SS*.  trans-730-179.400000113.2K311K311-A380 WeakPolarHBondContact CE-O 3.47Å; K311-A380 PolarHBondContact NZ-O 3.3Å

Retrieved 380 of 380 residues in 96.6 ms (Link to these results)