14338_ORYSJ Loading...

Putative 14-3-3-like protein GF14-H

Is associated with a DNA binding complex that binds to the G box, a well-characterized cis-acting DNA regulatory element found in plant genes.

AlphaFold DB , UniProt , Accession Q2R1D5, Species ORYSJ (Oryza sativa subsp. japonica, Rice), Gene GF14H, Length 230 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
1M63.4Low91.6Very high190 Ų19088.6 Ų88.694%0.93640%0.396SS*.  0-56.30-157.7169.8-97.600112.2E3 R4 E5M1-E3 VanDerWaalsContact C-N 3.35Å; M1-E3 PolarHBondContact O-N 2.95Å; M1-R4 PolarHBondContact O-N 3.1Å; M1-E5 WeakPolarHBondContact CG-OE1 3.23Å; M1-E5 PolarHBondContact O-N 3.21Å; M1-E5 VanDerWaalsContact O-N 3.12Å
2K86Confident92Very high186 Ų18686.6 Ų86.681%0.80939%0.386SS*.Hα-helixtrans-54.8-40.5179.6-66.5-174.7179.7-179.60115.1K6K2-K6 WeakPolarHBondContact O-CB 3.21Å; K2-K6 PolarHBondContact O-N 3.4Å; K2-K6 VanDerWaalsContact O-N 3.1Å
3E91.7Very high92.5Very high97 Ų9787.9 Ų87.945%0.45340%0.399SS..Hα-helixtrans-71.9-41-180-16360.1-152.300112.4M1 E5 K6 V7 M33M1-E3 VanDerWaalsContact C-N 3.35Å; M1-E3 PolarHBondContact O-N 2.95Å; E3-E5 PolarHBondContact O-N 3.13Å; E3-K6 WeakPolarHBondContact O-CB 3.4Å; E3-K6 PolarHBondContact O-N 3.36Å; E3-K6 IonicContact OE1-NZ 2.63Å; E3-K6 PolarHBondContact OE1-NZ 3.13Å; E3-K6 VanDerWaalsContact OE1-NZ 3.13Å; E3-K6 IonicContact OE2-NZ 3.44Å; E3-V7 WeakPolarHBondContact O-CG2 3.25Å; E3-V7 PolarHBondContact O-N 3.12Å; E3-M33 HydrophobicContact CB-CE 4.24Å; E3-M33 HydrophobicContact CG-CE 3.77Å
4R93.4Very high92.8Very high66 Ų6682.1 Ų82.125%0.24937%0.374CS..Hα-helixtrans-57.1-48.9174.5-178.4176.1176.3171.22.2111M1 K6 V7 V8 L30 M33 D36 E41M1-R4 PolarHBondContact O-N 3.1Å; R4-K6 VanDerWaalsContact C-N 3.32Å; R4-K6 PolarHBondContact O-N 3.32Å; R4-V7 PolarHBondContact O-N 3.21Å; R4-V8 WeakPolarHBondContact O-CG2 3.49Å; R4-V8 PolarHBondContact O-N 2.86Å; R4-L30 HydrophobicContact CG-CD1 4.42Å; R4-M33 HydrophobicContact CB-SD 3.96Å; R4-D36 PolarHBondContact NH2-O 3.34Å; R4-E41 IonicContact CZ-OE1 2.71Å; R4-E41 IonicContact CZ-OE2 3.4Å; R4-E41 IonicContact NE-OE1 3.97Å; R4-E41 PolarHBondContact NE-OE1 3.48Å; R4-E41 IonicContact NE-OE2 3.32Å; R4-E41 PolarHBondContact NE-OE2 3.46Å; R4-E41 IonicContact NH2-OE1 3.74Å; R4-E41 PolarHBondContact NH2-OE1 2.83Å; R4-E41 IonicContact NH2-OE2 2.7Å; R4-E41 PolarHBondContact NH2-OE2 2.86Å
5E94.1Very high93Very high87 Ų8781.4 Ų81.441%0.40737%0.371SS..Hα-helixtrans-60.3-40.9176.8-71.4174.9-154.300112.7M1 E3 V8 R9M1-E5 WeakPolarHBondContact CG-OE1 3.23Å; M1-E5 PolarHBondContact O-N 3.21Å; M1-E5 VanDerWaalsContact O-N 3.12Å; E3-E5 PolarHBondContact O-N 3.13Å; E5-V8 PolarHBondContact O-N 3Å; E5-R9 WeakPolarHBondContact O-CB 3.32Å; E5-R9 VanDerWaalsContact O-CG 3.25Å; E5-R9 WeakPolarHBondContact O-CG 3.49Å; E5-R9 PolarHBondContact O-N 2.9Å; E5-R9 IonicContact OE2-NH2 3.75Å
6K95.6Very high93.2Very high109 Ų10986.1 Ų86.147%0.47439%0.394SS..Hα-helixtrans-63.7-45.1176.9179.4-174.9162.7-147.90111.3K2 E3 R4 R9 L10K2-K6 WeakPolarHBondContact O-CB 3.21Å; K2-K6 PolarHBondContact O-N 3.4Å; K2-K6 VanDerWaalsContact O-N 3.1Å; E3-K6 WeakPolarHBondContact O-CB 3.4Å; E3-K6 PolarHBondContact O-N 3.36Å; E3-K6 IonicContact OE1-NZ 2.63Å; E3-K6 PolarHBondContact OE1-NZ 3.13Å; E3-K6 VanDerWaalsContact OE1-NZ 3.13Å; E3-K6 IonicContact OE2-NZ 3.44Å; R4-K6 VanDerWaalsContact C-N 3.32Å; R4-K6 PolarHBondContact O-N 3.32Å; K6-R9 PolarHBondContact O-N 2.91Å; K6-L10 HydrophobicContact CG-CD1 4.19Å; K6-L10 WeakPolarHBondContact O-CG 3.47Å; K6-L10 PolarHBondContact O-N 2.89Å
7V96.3Very high93.4Very high4 Ų484.8 Ų84.82%0.02440%0.401CS..Hα-helixtrans-62.6-43.7177.1172.30000111.3E3 R4 R9 L10 A11 F26 T29 L30 M33E3-V7 WeakPolarHBondContact O-CG2 3.25Å; E3-V7 PolarHBondContact O-N 3.12Å; R4-V7 PolarHBondContact O-N 3.21Å; V7-R9 PolarHBondContact O-N 3.38Å; V7-L10 PolarHBondContact O-N 3.42Å; V7-A11 WeakPolarHBondContact O-CB 3.44Å; V7-A11 PolarHBondContact O-N 3.48Å; V7-F26 HydrophobicContact CG1-CB 4.02Å; V7-F26 WeakPolarHBondContact CG1-O 3.48Å; V7-T29 HydrophobicContact CG2-CG2 4.17Å; V7-L30 HydrophobicContact CG1-CB 3.88Å; V7-L30 HydrophobicContact CG1-CD1 4.42Å; V7-M33 HydrophobicContact CB-CE 4.32Å; V7-M33 HydrophobicContact CG2-CE 3.64Å
8V96.2Very high93.5Very high13 Ų1388 Ų888%0.07942%0.416CS..Hα-helixtrans-61.3-43175.1173.50000111.5R4 E5 L10 A11 K12 L30 E41 L44R4-V8 WeakPolarHBondContact O-CG2 3.49Å; R4-V8 PolarHBondContact O-N 2.86Å; E5-V8 PolarHBondContact O-N 3Å; V8-L10 VanDerWaalsContact C-N 3.35Å; V8-L10 PolarHBondContact O-N 3.28Å; V8-A11 PolarHBondContact O-N 3.47Å; V8-K12 HydrophobicContact CG1-CD 4.33Å; V8-K12 WeakPolarHBondContact O-CG 3.34Å; V8-K12 PolarHBondContact O-N 3.18Å; V8-L30 HydrophobicContact CG2-CD1 3.38Å; V8-E41 HydrophobicContact CG2-CG 3.76Å; V8-L44 HydrophobicContact CG1-CD1 3.98Å
9R96.3Very high93.7Very high164 Ų16491 Ų9162%0.61942%0.423SS*.Hα-helixtrans-61.8-42.8175.7-72.6174.9-163.5-167.97.5111.7E5 K6 V7 K12 L13E5-R9 WeakPolarHBondContact O-CB 3.32Å; E5-R9 VanDerWaalsContact O-CG 3.25Å; E5-R9 WeakPolarHBondContact O-CG 3.49Å; E5-R9 PolarHBondContact O-N 2.9Å; E5-R9 IonicContact OE2-NH2 3.75Å; K6-R9 PolarHBondContact O-N 2.91Å; V7-R9 PolarHBondContact O-N 3.38Å; R9-K12 PolarHBondContact O-N 3.13Å; R9-L13 WeakPolarHBondContact O-CG 3.48Å; R9-L13 PolarHBondContact O-N 3.02Å
10L97.3Very high93.8Very high59 Ų5988.9 Ų88.931%0.30941%0.411SS..Hα-helixtrans-64.8-41176.8-72169.5000112K6 V7 V8 K12 L13 A14 F26K6-L10 HydrophobicContact CG-CD1 4.19Å; K6-L10 WeakPolarHBondContact O-CG 3.47Å; K6-L10 PolarHBondContact O-N 2.89Å; V7-L10 PolarHBondContact O-N 3.42Å; V8-L10 VanDerWaalsContact C-N 3.35Å; V8-L10 PolarHBondContact O-N 3.28Å; L10-K12 PolarHBondContact O-N 3.35Å; L10-L13 PolarHBondContact O-N 3.5Å; L10-A14 WeakPolarHBondContact O-CB 3.4Å; L10-A14 PolarHBondContact O-N 3.4Å; L10-F26 HydrophobicContact CB-CD1 3.9Å; L10-F26 HydrophobicContact CB-CD2 3.83Å; L10-F26 HydrophobicContact CB-CE1 3.87Å; L10-F26 HydrophobicContact CB-CE2 3.79Å; L10-F26 HydrophobicContact CB-CG 3.9Å; L10-F26 HydrophobicContact CB-CZ 3.82Å; L10-F26 HydrophobicContact CD1-CD1 4.13Å; L10-F26 HydrophobicContact CD1-CE1 3.73Å; L10-F26 HydrophobicContact CD1-CZ 4.2Å; L10-F26 HydrophobicContact CD2-CZ 4.36Å; L10-F26 HydrophobicContact CG-CE1 4.3Å; L10-F26 HydrophobicContact CG-CZ 4.35Å
11A97.3Very high93.9Very high0 Ų088.4 Ų88.40%041%0.412CS..Hα-helixtrans-61.3-42.1175.100000112.1V7 V8 A14 E15 M23 F26 M27V7-A11 WeakPolarHBondContact O-CB 3.44Å; V7-A11 PolarHBondContact O-N 3.48Å; V8-A11 PolarHBondContact O-N 3.47Å; A11-A14 PolarHBondContact O-N 2.87Å; A11-E15 WeakPolarHBondContact O-CB 3.43Å; A11-E15 PolarHBondContact O-N 3.41Å; A11-M23 HydrophobicContact CB-CG 4.3Å; A11-F26 HydrophobicContact CB-CB 4.07Å; A11-M27 HydrophobicContact CB-CG 4.24Å; A11-M27 HydrophobicContact CB-SD 3.62Å
12K96.9Very high95.4Very high64 Ų6481.8 Ų81.828%0.27838%0.38SS..Hα-helixtrans-64.1-40.8174.7-71.5175.2178-179.50112.5V8 R9 L10 E15 Q16 E40 L44V8-K12 HydrophobicContact CG1-CD 4.33Å; V8-K12 WeakPolarHBondContact O-CG 3.34Å; V8-K12 PolarHBondContact O-N 3.18Å; R9-K12 PolarHBondContact O-N 3.13Å; L10-K12 PolarHBondContact O-N 3.35Å; K12-E15 PolarHBondContact O-N 3.36Å; K12-Q16 WeakPolarHBondContact O-CG 3.45Å; K12-Q16 PolarHBondContact O-N 2.87Å; K12-E40 VanDerWaalsContact CE-CD 3.5Å; K12-E40 WeakPolarHBondContact CE-OE1 3.5Å; K12-E40 IonicContact NZ-OE1 2.62Å; K12-E40 PolarHBondContact NZ-OE1 3.12Å; K12-E40 IonicContact NZ-OE2 3.04Å; K12-E40 PolarHBondContact NZ-OE2 3.47Å; K12-L44 HydrophobicContact CG-CD1 4.01Å; K12-L44 HydrophobicContact CG-CD2 4.08Å
13L97.6Very high95.9Very high104 Ų10472.9 Ų72.955%0.54534%0.342SS..Hα-helixtrans-64.9-41.1174.8-71.1170.9000111.5R9 L10 Q16 A17R9-L13 WeakPolarHBondContact O-CG 3.48Å; R9-L13 PolarHBondContact O-N 3.02Å; L10-L13 PolarHBondContact O-N 3.5Å; L13-Q16 PolarHBondContact O-N 3.11Å; L13-A17 WeakPolarHBondContact O-CB 3.38Å; L13-A17 PolarHBondContact O-N 3.11Å
14A97.4Very high96.1Very high7 Ų768.6 Ų68.66%0.05832%0.322CS..Hα-helixtrans-64.6-39.7176.200000112.1L10 A11 A17 E18 R19 D22 M23 F26L10-A14 WeakPolarHBondContact O-CB 3.4Å; L10-A14 PolarHBondContact O-N 3.4Å; A11-A14 PolarHBondContact O-N 2.87Å; A14-A17 CarbonylContact O-C 3.49Å; A14-A17 PolarHBondContact O-N 2.73Å; A14-E18 PolarHBondContact O-N 2.64Å; A14-E18 VanDerWaalsContact O-N 3.12Å; A14-R19 PolarHBondContact O-N 3.14Å; A14-D22 HydrophobicContact CB-CB 4.19Å; A14-M23 HydrophobicContact CB-CB 3.82Å; A14-M23 HydrophobicContact CB-CG 4.5Å; A14-F26 HydrophobicContact CB-CD2 4.16Å; A14-F26 HydrophobicContact CB-CE2 4.13Å
15E96.3Very high96.3Very high71 Ų7169.8 Ų69.833%0.33233%0.331SS..Hα-helixtrans-59.7-49.2172.8-177.6-178-15800111.6A11 K12 A17 E18 M23 L44A11-E15 WeakPolarHBondContact O-CB 3.43Å; A11-E15 PolarHBondContact O-N 3.41Å; K12-E15 PolarHBondContact O-N 3.36Å; E15-A17 VanDerWaalsContact C-N 3.27Å; E15-A17 PolarHBondContact O-N 3.15Å; E15-E18 PolarHBondContact O-N 3.48Å; E15-M23 HydrophobicContact CB-CE 3.92Å; E15-M23 HydrophobicContact CB-SD 3.93Å; E15-M23 HydrophobicContact CG-CE 4.28Å; E15-M23 HydrophobicContact CG-SD 4.43Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.49Å
16Q95.9Very high96.4Very high157 Ų15768.2 Ų68.273%0.73432%0.322SS*.Hα-helixtrans-64-31.7178.7-72.1177.47.500113K12 L13 E18K12-Q16 WeakPolarHBondContact O-CG 3.45Å; K12-Q16 PolarHBondContact O-N 2.87Å; L13-Q16 PolarHBondContact O-N 3.11Å; Q16-E18 VanDerWaalsContact C-N 3.28Å
17A96.9Very high96.4Very high63 Ų6363 Ų6352%0.52130%0.3SS..THydrogen-bonded Turntrans-85.53.8175.700000113.4L13 A14 E15 R19L13-A17 WeakPolarHBondContact O-CB 3.38Å; L13-A17 PolarHBondContact O-N 3.11Å; A14-A17 CarbonylContact O-C 3.49Å; A14-A17 PolarHBondContact O-N 2.73Å; E15-A17 VanDerWaalsContact C-N 3.27Å; E15-A17 PolarHBondContact O-N 3.15Å; A17-R19 HydrophobicContact CB-CG 4.19Å; A17-R19 PolarHBondContact O-N 3.36Å; A17-R19 VanDerWaalsContact O-N 3.08Å
18E95.2Very high96.4Very high143 Ų14363.2 Ų63.267%0.66830%0.3SS*.THydrogen-bonded Turntrans53.824-174.1-57.2-170.5166.800114.3A14 E15 Q16 Y20A14-E18 PolarHBondContact O-N 2.64Å; A14-E18 VanDerWaalsContact O-N 3.12Å; E15-E18 PolarHBondContact O-N 3.48Å; Q16-E18 VanDerWaalsContact C-N 3.28Å; E18-Y20 VanDerWaalsContact C-N 3.32Å; E18-Y20 HydrophobicContact CB-CE2 4.15Å; E18-Y20 WeakPolarHBondContact O-CD2 3.22Å; E18-Y20 PolarHBondContact O-N 2.89Å; E18-Y20 VanDerWaalsContact O-N 3.16Å
19R97Very high96.3Very high145 Ų14565.5 Ų65.555%0.54732%0.315SS..  trans-89.868.4176.1-66.4-161.464.1-178.4-10.2110.3A14 A17 D21 D22 M23A14-R19 PolarHBondContact O-N 3.14Å; A17-R19 HydrophobicContact CB-CG 4.19Å; A17-R19 PolarHBondContact O-N 3.36Å; A17-R19 VanDerWaalsContact O-N 3.08Å; R19-D21 VanDerWaalsContact C-N 3.29Å; R19-D21 PolarHBondContact O-N 3.47Å; R19-D22 HydrophobicContact CB-CB 4.16Å; R19-D22 IonicContact CZ-OD1 3.81Å; R19-D22 IonicContact CZ-OD2 2.8Å; R19-D22 IonicContact NE-OD1 3.82Å; R19-D22 IonicContact NE-OD2 3.45Å; R19-D22 PolarHBondContact NE-OD2 3.06Å; R19-D22 IonicContact NH1-OD2 3.87Å; R19-D22 PolarHBondContact NH1-OD2 3.34Å; R19-D22 VanDerWaalsContact NH2-CG 3.26Å; R19-D22 IonicContact NH2-OD1 2.74Å; R19-D22 PolarHBondContact NH2-OD1 3.14Å; R19-D22 IonicContact NH2-OD2 2.87Å; R19-D22 PolarHBondContact NH2-OD2 3.22Å; R19-D22 WeakPolarHBondContact O-CB 3.35Å; R19-D22 PolarHBondContact O-N 3.05Å; R19-D22 VanDerWaalsContact O-N 3.16Å; R19-M23 PolarHBondContact O-N 3.27Å
20Y95.9Very high96.3Very high48 Ų4857.7 Ų57.719%0.18829%0.285CS..Hα-helixtrans-64.1-30.1-174.1-57.3-62.8000113.9E18 M23 V24 K51E18-Y20 VanDerWaalsContact C-N 3.32Å; E18-Y20 HydrophobicContact CB-CE2 4.15Å; E18-Y20 WeakPolarHBondContact O-CD2 3.22Å; E18-Y20 PolarHBondContact O-N 2.89Å; E18-Y20 VanDerWaalsContact O-N 3.16Å; Y20-M23 HydrophobicContact CD1-SD 4.24Å; Y20-M23 WeakPolarHBondContact O-CB 3.36Å; Y20-M23 PolarHBondContact O-N 3.49Å; Y20-V24 WeakPolarHBondContact O-CB 3.44Å; Y20-V24 WeakPolarHBondContact O-CG2 3.5Å; Y20-V24 PolarHBondContact O-N 2.9Å; Y20-K51 HydrophobicContact CD1-CB 3.58Å; Y20-K51 HydrophobicContact CD1-CG 3.76Å; Y20-K51 HydrophobicContact CD2-CB 3.59Å; Y20-K51 HydrophobicContact CD2-CD 4.45Å; Y20-K51 HydrophobicContact CD2-CG 4.21Å; Y20-K51 HydrophobicContact CE1-CB 3.96Å; Y20-K51 HydrophobicContact CE1-CD 4.1Å; Y20-K51 HydrophobicContact CE1-CG 3.63Å; Y20-K51 HydrophobicContact CE2-CB 3.92Å; Y20-K51 HydrophobicContact CE2-CD 3.9Å; Y20-K51 HydrophobicContact CE2-CG 4.05Å; Y20-K51 HydrophobicContact CG-CB 3.38Å; Y20-K51 HydrophobicContact CG-CG 4.05Å
21D94.7Very high96.1Very high80 Ų8055 Ų5543%0.42827%0.271SS..Hα-helixtrans-65.8-40.8175.1-69.5-13.7000111.3R19 V24 E25 T52 R56R19-D21 VanDerWaalsContact C-N 3.29Å; R19-D21 PolarHBondContact O-N 3.47Å; D21-V24 PolarHBondContact O-N 2.78Å; D21-E25 PolarHBondContact O-N 3.4Å; D21-T52 WeakPolarHBondContact OD1-CG2 3.15Å; D21-T52 PolarHBondContact OD1-OG1 3.08Å; D21-T52 VanDerWaalsContact OD1-OG1 3.05Å; D21-R56 IonicContact OD1-NH1 2.78Å; D21-R56 IonicContact OD1-NH2 2.73Å; D21-R56 IonicContact OD2-NH2 2.64Å
22D96.5Very high95.9Very high50 Ų5061 Ų6127%0.26729%0.293SS..Hα-helixtrans-65.4-42.1172.4-63.315.1000111A14 R19 V24 E25 F26A14-D22 HydrophobicContact CB-CB 4.19Å; R19-D22 HydrophobicContact CB-CB 4.16Å; R19-D22 IonicContact CZ-OD1 3.81Å; R19-D22 IonicContact CZ-OD2 2.8Å; R19-D22 IonicContact NE-OD1 3.82Å; R19-D22 IonicContact NE-OD2 3.45Å; R19-D22 PolarHBondContact NE-OD2 3.06Å; R19-D22 IonicContact NH1-OD2 3.87Å; R19-D22 PolarHBondContact NH1-OD2 3.34Å; R19-D22 VanDerWaalsContact NH2-CG 3.26Å; R19-D22 IonicContact NH2-OD1 2.74Å; R19-D22 PolarHBondContact NH2-OD1 3.14Å; R19-D22 IonicContact NH2-OD2 2.87Å; R19-D22 PolarHBondContact NH2-OD2 3.22Å; R19-D22 WeakPolarHBondContact O-CB 3.35Å; R19-D22 PolarHBondContact O-N 3.05Å; R19-D22 VanDerWaalsContact O-N 3.16Å; D22-V24 VanDerWaalsContact C-N 3.27Å; D22-V24 PolarHBondContact O-N 3Å; D22-E25 PolarHBondContact O-N 3.42Å; D22-E25 VanDerWaalsContact O-N 3.13Å; D22-F26 HydrophobicContact CB-CE2 4.05Å; D22-F26 WeakPolarHBondContact O-CD2 3.26Å; D22-F26 WeakPolarHBondContact O-CG 3.35Å; D22-F26 PolarHBondContact O-N 3.5Å
23M95.9Very high95.7Very high0 Ų060.6 Ų60.60%029%0.294CS..Hα-helixtrans-57.2-43.1176.6-170.7-172.5-172.800111A11 A14 E15 R19 Y20 F26 M27 L44 V47 G48A11-M23 HydrophobicContact CB-CG 4.3Å; A14-M23 HydrophobicContact CB-CB 3.82Å; A14-M23 HydrophobicContact CB-CG 4.5Å; E15-M23 HydrophobicContact CB-CE 3.92Å; E15-M23 HydrophobicContact CB-SD 3.93Å; E15-M23 HydrophobicContact CG-CE 4.28Å; E15-M23 HydrophobicContact CG-SD 4.43Å; R19-M23 PolarHBondContact O-N 3.27Å; Y20-M23 HydrophobicContact CD1-SD 4.24Å; Y20-M23 WeakPolarHBondContact O-CB 3.36Å; Y20-M23 PolarHBondContact O-N 3.49Å; M23-F26 PolarHBondContact O-N 3.33Å; M23-M27 HydrophobicContact CG-CG 4.47Å; M23-M27 WeakPolarHBondContact O-CB 3.46Å; M23-M27 VanDerWaalsContact O-CG 3.28Å; M23-M27 WeakPolarHBondContact O-CG 3.47Å; M23-M27 PolarHBondContact O-N 2.91Å; M23-L44 HydrophobicContact CE-CB 3.82Å; M23-L44 HydrophobicContact CE-CD2 3.47Å; M23-L44 VanDerWaalsContact CE-CD2 3.47Å; M23-L44 HydrophobicContact CE-CG 4.26Å; M23-L44 WeakPolarHBondContact CE-O 3.29Å; M23-V47 HydrophobicContact CE-CB 4.14Å; M23-V47 HydrophobicContact CE-CG1 4.11Å; M23-V47 HydrophobicContact SD-CG1 4.23Å; M23-G48 VanDerWaalsContact SD-CA 3.54Å
24V96.1Very high95.2Very high6 Ų660 Ų604%0.03629%0.291CS..Hα-helixtrans-60-45.6175.4163.40000110.8Y20 D21 D22 F26 M27 K28 F49Y20-V24 WeakPolarHBondContact O-CB 3.44Å; Y20-V24 WeakPolarHBondContact O-CG2 3.5Å; Y20-V24 PolarHBondContact O-N 2.9Å; D21-V24 PolarHBondContact O-N 2.78Å; D22-V24 VanDerWaalsContact C-N 3.27Å; D22-V24 PolarHBondContact O-N 3Å; V24-F26 PolarHBondContact O-N 3.4Å; V24-M27 PolarHBondContact O-N 3.48Å; V24-K28 HydrophobicContact CG1-CD 4.05Å; V24-K28 HydrophobicContact CG1-CG 4.32Å; V24-K28 WeakPolarHBondContact O-CB 3.36Å; V24-K28 WeakPolarHBondContact O-CG 3.38Å; V24-K28 PolarHBondContact O-N 3.45Å; V24-F49 HydrophobicContact CG1-CD1 4.06Å; V24-F49 HydrophobicContact CG1-CE1 3.64Å; V24-F49 HydrophobicContact CG1-CE2 4.3Å; V24-F49 HydrophobicContact CG1-CZ 3.78Å; V24-F49 HydrophobicContact CG2-CD1 4.14Å; V24-F49 HydrophobicContact CG2-CD2 4.36Å; V24-F49 HydrophobicContact CG2-CG 4.06Å
25E96.7Very high94.7Very high92 Ų9261.4 Ų61.443%0.4330%0.299SS..Hα-helixtrans-61.6-40.2176.7-67.8-52.3127.600113.4D21 D22 K28 T29D21-E25 PolarHBondContact O-N 3.4Å; D22-E25 PolarHBondContact O-N 3.42Å; D22-E25 VanDerWaalsContact O-N 3.13Å; E25-K28 IonicContact OE1-NZ 3.02Å; E25-K28 PolarHBondContact OE1-NZ 3.34Å; E25-T29 PolarHBondContact O-N 3.47Å; E25-T29 PolarHBondContact O-OG1 3.28Å
26F96.7Very high94.4Very high53 Ų5360.2 Ų60.223%0.23229%0.294CS..Hα-helixtrans-64.2-45.3173.6-62.8-47.5000111.5V7 L10 A11 A14 D22 M23 V24 K28 T29 L30V7-F26 HydrophobicContact CG1-CB 4.02Å; V7-F26 WeakPolarHBondContact CG1-O 3.48Å; L10-F26 HydrophobicContact CB-CD1 3.9Å; L10-F26 HydrophobicContact CB-CD2 3.83Å; L10-F26 HydrophobicContact CB-CE1 3.87Å; L10-F26 HydrophobicContact CB-CE2 3.79Å; L10-F26 HydrophobicContact CB-CG 3.9Å; L10-F26 HydrophobicContact CB-CZ 3.82Å; L10-F26 HydrophobicContact CD1-CD1 4.13Å; L10-F26 HydrophobicContact CD1-CE1 3.73Å; L10-F26 HydrophobicContact CD1-CZ 4.2Å; L10-F26 HydrophobicContact CD2-CZ 4.36Å; L10-F26 HydrophobicContact CG-CE1 4.3Å; L10-F26 HydrophobicContact CG-CZ 4.35Å; A11-F26 HydrophobicContact CB-CB 4.07Å; A14-F26 HydrophobicContact CB-CD2 4.16Å; A14-F26 HydrophobicContact CB-CE2 4.13Å; D22-F26 HydrophobicContact CB-CE2 4.05Å; D22-F26 WeakPolarHBondContact O-CD2 3.26Å; D22-F26 WeakPolarHBondContact O-CG 3.35Å; D22-F26 PolarHBondContact O-N 3.5Å; M23-F26 PolarHBondContact O-N 3.33Å; V24-F26 PolarHBondContact O-N 3.4Å; F26-K28 PolarHBondContact O-N 2.63Å; F26-T29 WeakPolarHBondContact O-CB 3.46Å; F26-T29 PolarHBondContact O-N 3.04Å; F26-T29 VanDerWaalsContact O-N 3.13Å; F26-L30 PolarHBondContact O-N 3.43Å
27M95.8Very high94.2Very high0 Ų053.1 Ų53.10%026%0.261CS..Hα-helixtrans-70.3-30-179.4-66.7-47.5-55.200113.1A11 M23 V24 L30 A31 E41 L44 F45A11-M27 HydrophobicContact CB-CG 4.24Å; A11-M27 HydrophobicContact CB-SD 3.62Å; M23-M27 HydrophobicContact CG-CG 4.47Å; M23-M27 WeakPolarHBondContact O-CB 3.46Å; M23-M27 VanDerWaalsContact O-CG 3.28Å; M23-M27 WeakPolarHBondContact O-CG 3.47Å; M23-M27 PolarHBondContact O-N 2.91Å; V24-M27 PolarHBondContact O-N 3.48Å; M27-L30 HydrophobicContact CE-CB 4.31Å; M27-L30 HydrophobicContact CE-CD1 4.06Å; M27-L30 HydrophobicContact CE-CD2 4.18Å; M27-L30 HydrophobicContact CE-CG 4.42Å; M27-L30 PolarHBondContact O-N 2.78Å; M27-A31 PolarHBondContact O-N 2.87Å; M27-E41 HydrophobicContact CE-CB 4.45Å; M27-E41 WeakPolarHBondContact CE-O 3.46Å; M27-L44 HydrophobicContact CE-CB 4.05Å; M27-L44 HydrophobicContact CG-CB 4.43Å; M27-L44 HydrophobicContact SD-CB 3.75Å; M27-F45 HydrophobicContact CB-CD2 3.9Å; M27-F45 HydrophobicContact CE-CB 3.78Å; M27-F45 HydrophobicContact CE-CD2 4.39Å
28K95.4Very high94Very high8 Ų852.4 Ų52.44%0.03525%0.253CS..Hα-helixtrans-62.2-45.2167.2-72.6172.4-179.2175.60111.4V24 E25 F26 L30 A31 R32 F49 E97 I101V24-K28 HydrophobicContact CG1-CD 4.05Å; V24-K28 HydrophobicContact CG1-CG 4.32Å; V24-K28 WeakPolarHBondContact O-CB 3.36Å; V24-K28 WeakPolarHBondContact O-CG 3.38Å; V24-K28 PolarHBondContact O-N 3.45Å; E25-K28 IonicContact OE1-NZ 3.02Å; E25-K28 PolarHBondContact OE1-NZ 3.34Å; F26-K28 PolarHBondContact O-N 2.63Å; K28-L30 VanDerWaalsContact C-N 3.3Å; K28-L30 PolarHBondContact O-N 3.13Å; K28-A31 PolarHBondContact O-N 3.48Å; K28-R32 WeakPolarHBondContact O-CG 3.33Å; K28-R32 PolarHBondContact O-N 3.2Å; K28-F49 HydrophobicContact CG-CE2 4.48Å; K28-F49 HydrophobicContact CG-CZ 3.83Å; K28-E97 WeakPolarHBondContact CE-OE1 3.45Å; K28-E97 WeakPolarHBondContact CE-OE2 3.36Å; K28-E97 IonicContact NZ-OE1 2.81Å; K28-E97 PolarHBondContact NZ-OE1 2.93Å; K28-E97 IonicContact NZ-OE2 3.54Å; K28-E97 PolarHBondContact NZ-OE2 3.46Å; K28-I101 HydrophobicContact CB-CD1 4.4Å; K28-I101 HydrophobicContact CD-CD1 4.41Å; K28-I101 HydrophobicContact CG-CD1 3.66Å
29T95.1Very high93.8Very high62 Ų6248.5 Ų48.538%0.3825%0.245SC..Hα-helixtrans-61.2-42.6177.5-56.30000110.4V7 E25 F26 R32 M33V7-T29 HydrophobicContact CG2-CG2 4.17Å; E25-T29 PolarHBondContact O-N 3.47Å; E25-T29 PolarHBondContact O-OG1 3.28Å; F26-T29 WeakPolarHBondContact O-CB 3.46Å; F26-T29 PolarHBondContact O-N 3.04Å; F26-T29 VanDerWaalsContact O-N 3.13Å; T29-R32 PolarHBondContact O-N 2.95Å; T29-M33 HydrophobicContact CG2-CE 4.11Å; T29-M33 WeakPolarHBondContact O-CG 3.47Å; T29-M33 PolarHBondContact O-N 2.92Å
30L95Very high93.6Very high0 Ų046.3 Ų46.30%024%0.241CC..Hα-helixtrans-61.8-46.4175.6-170.6146.4000112.2R4 V7 V8 F26 M27 K28 R32 M33 M37 E41R4-L30 HydrophobicContact CG-CD1 4.42Å; V7-L30 HydrophobicContact CG1-CB 3.88Å; V7-L30 HydrophobicContact CG1-CD1 4.42Å; V8-L30 HydrophobicContact CG2-CD1 3.38Å; F26-L30 PolarHBondContact O-N 3.43Å; M27-L30 HydrophobicContact CE-CB 4.31Å; M27-L30 HydrophobicContact CE-CD1 4.06Å; M27-L30 HydrophobicContact CE-CD2 4.18Å; M27-L30 HydrophobicContact CE-CG 4.42Å; M27-L30 PolarHBondContact O-N 2.78Å; K28-L30 VanDerWaalsContact C-N 3.3Å; K28-L30 PolarHBondContact O-N 3.13Å; L30-R32 VanDerWaalsContact C-N 3.31Å; L30-R32 PolarHBondContact O-N 3.47Å; L30-M33 WeakPolarHBondContact O-CB 3.37Å; L30-M33 PolarHBondContact O-N 2.91Å; L30-M33 VanDerWaalsContact O-N 3.11Å; L30-M37 HydrophobicContact CD2-CE 3.86Å; L30-M37 HydrophobicContact CD2-CG 3.88Å; L30-M37 HydrophobicContact CD2-SD 4.06Å; L30-E41 HydrophobicContact CD1-CB 4.33Å; L30-E41 HydrophobicContact CD1-CG 3.93Å; L30-E41 HydrophobicContact CD2-CB 4.29Å
31A93.8Very high93.6Very high1 Ų144.7 Ų44.71%0.00824%0.235CC..Hα-helixtrans-60-41.9178.400000111.8M27 K28 M33 D34 M37 F45 I101 H105M27-A31 PolarHBondContact O-N 2.87Å; K28-A31 PolarHBondContact O-N 3.48Å; A31-M33 PolarHBondContact O-N 3.47Å; A31-M33 VanDerWaalsContact O-N 3.16Å; A31-D34 PolarHBondContact O-N 3.46Å; A31-M37 HydrophobicContact CB-CE 3.55Å; A31-F45 HydrophobicContact CB-CE2 4.11Å; A31-I101 HydrophobicContact CB-CG2 3.46Å; A31-I101 VanDerWaalsContact CB-CG2 3.46Å; A31-H105 HydrophobicContact CB-CB 4.46Å; A31-H105 WeakPolarHBondContact O-CB 3.33Å
32R93.1Very high93.6Very high126 Ų12642.3 Ų42.348%0.47522%0.22SC..THydrogen-bonded Turntrans-72.1-0.5177.6-67.8174-176.3152.33.8114.6K28 T29 L30 D34K28-R32 WeakPolarHBondContact O-CG 3.33Å; K28-R32 PolarHBondContact O-N 3.2Å; T29-R32 PolarHBondContact O-N 2.95Å; L30-R32 VanDerWaalsContact C-N 3.31Å; L30-R32 PolarHBondContact O-N 3.47Å; R32-D34 PolarHBondContact O-N 3.38Å
33M92.3Very high93.4Very high57 Ų5745 Ų4528%0.28123%0.234SC..THydrogen-bonded Turntrans-79.40.4168.9-61.4-173.8-176.300112.5E3 R4 V7 T29 L30 A31 V35E3-M33 HydrophobicContact CB-CE 4.24Å; E3-M33 HydrophobicContact CG-CE 3.77Å; R4-M33 HydrophobicContact CB-SD 3.96Å; V7-M33 HydrophobicContact CB-CE 4.32Å; V7-M33 HydrophobicContact CG2-CE 3.64Å; T29-M33 HydrophobicContact CG2-CE 4.11Å; T29-M33 WeakPolarHBondContact O-CG 3.47Å; T29-M33 PolarHBondContact O-N 2.92Å; L30-M33 WeakPolarHBondContact O-CB 3.37Å; L30-M33 PolarHBondContact O-N 2.91Å; L30-M33 VanDerWaalsContact O-N 3.11Å; A31-M33 PolarHBondContact O-N 3.47Å; A31-M33 VanDerWaalsContact O-N 3.16Å; M33-V35 HydrophobicContact CB-CG1 4.47Å; M33-V35 HydrophobicContact CB-CG2 4.29Å; M33-V35 PolarHBondContact O-N 2.83Å
34D86.7Confident93.4Very high90 Ų9045.3 Ų45.348%0.48124%0.236SC..  trans5056.3-179.7-64.7-32.2000111.9A31 R32 H105 L109A31-D34 PolarHBondContact O-N 3.46Å; R32-D34 PolarHBondContact O-N 3.38Å; D34-H105 IonicContact OD1-CE1 3.68Å; D34-H105 IonicContact OD1-CG 3.45Å; D34-H105 IonicContact OD1-ND1 3.57Å; D34-H105 PolarHBondContact OD1-ND1 3.44Å; D34-L109 HydrophobicContact CB-CD1 3.62Å; D34-L109 WeakPolarHBondContact O-CD1 3.4Å
35V87.8Confident93.3Very high38 Ų3845 Ų4523%0.2323%0.234CC..  trans-123.3146.8177.1-69.50000111.7M33 M37M33-V35 HydrophobicContact CB-CG1 4.47Å; M33-V35 HydrophobicContact CB-CG2 4.29Å; M33-V35 PolarHBondContact O-N 2.83Å; V35-M37 PolarHBondContact O-N 3.06Å
36D90.2Very high93.2Very high45 Ų4542.1 Ų42.124%0.24122%0.224CC..PPolyproline II helixtrans-66.9122.2167.6-161.910.6000109.7R4 L109 N111 N115R4-D36 PolarHBondContact NH2-O 3.34Å; D36-L109 WeakPolarHBondContact CB-O 3.42Å; D36-N111 WeakPolarHBondContact OD2-CB 3.14Å; D36-N111 PolarHBondContact OD2-N 2.95Å; D36-N111 VanDerWaalsContact OD2-N 3.13Å; D36-N111 PolarHBondContact OD2-ND2 2.77Å; D36-N115 PolarHBondContact OD1-ND2 2.89Å
37M91.9Very high93Very high8 Ų841.1 Ų41.14%0.03922%0.222CC..PPolyproline II helixtrans-74.3137.5-174.6-68.7-168.6-168.300110.6L30 A31 V35 E41 R42 F45 N115 F119L30-M37 HydrophobicContact CD2-CE 3.86Å; L30-M37 HydrophobicContact CD2-CG 3.88Å; L30-M37 HydrophobicContact CD2-SD 4.06Å; A31-M37 HydrophobicContact CB-CE 3.55Å; V35-M37 PolarHBondContact O-N 3.06Å; M37-E41 WeakPolarHBondContact CA-OE2 3.45Å; M37-E41 HydrophobicContact CB-CB 4.22Å; M37-R42 HydrophobicContact CB-CB 4.32Å; M37-F45 HydrophobicContact CE-CD2 3.81Å; M37-F45 HydrophobicContact CE-CE2 4.16Å; M37-F45 HydrophobicContact CE-CG 4.37Å; M37-F45 HydrophobicContact SD-CB 4.22Å; M37-F45 HydrophobicContact SD-CD2 4.32Å; M37-F45 HydrophobicContact SD-CG 4.33Å; M37-N115 PolarHBondContact O-ND2 3.36Å; M37-N115 PolarHBondContact O-OD1 3.35Å; M37-F119 HydrophobicContact CB-CZ 4.41Å; M37-F119 HydrophobicContact CE-CZ 4.4Å; M37-F119 HydrophobicContact CG-CZ 4.28Å; M37-F119 HydrophobicContact SD-CE1 4.31Å; M37-F119 HydrophobicContact SD-CZ 3.76Å
38S93.1Very high93Very high49 Ų4941.1 Ų41.134%0.34322%0.222SC..PPolyproline II helixtrans-70.6163.4168.677.30000110.5E40 E41 R42S38-E40 PolarHBondContact O-N 3.38Å; S38-E40 PolarHBondContact OG-N 3.33Å; S38-E41 PolarHBondContact N-OE2 2.84Å; S38-E41 PolarHBondContact O-N 3.24Å; S38-E41 WeakPolarHBondContact OG-CG 3.24Å; S38-E41 PolarHBondContact OG-N 3.06Å; S38-E41 PolarHBondContact OG-OE2 3.42Å; S38-R42 WeakPolarHBondContact O-CB 3.47Å; S38-R42 PolarHBondContact O-N 3.3Å
39A90.6Very high93Very high60 Ų6040.7 Ų40.750%0.49622%0.22SC..Hα-helixtrans-55.6-35.7175.700000112.8L43A39-L43 WeakPolarHBondContact O-CB 3.38Å; A39-L43 PolarHBondContact O-N 2.87Å; A39-L43 VanDerWaalsContact O-N 3.07Å
40E93.5Very high92.9Very high100 Ų10044.1 Ų44.147%0.46723%0.229SC..Hα-helixtrans-69.2-46.2177.1-178.9174.9-133.100112K12 S38 R42 L43 L44K12-E40 VanDerWaalsContact CE-CD 3.5Å; K12-E40 WeakPolarHBondContact CE-OE1 3.5Å; K12-E40 IonicContact NZ-OE1 2.62Å; K12-E40 PolarHBondContact NZ-OE1 3.12Å; K12-E40 IonicContact NZ-OE2 3.04Å; K12-E40 PolarHBondContact NZ-OE2 3.47Å; S38-E40 PolarHBondContact O-N 3.38Å; S38-E40 PolarHBondContact OG-N 3.33Å; E40-R42 VanDerWaalsContact C-N 3.35Å; E40-L43 WeakPolarHBondContact O-CB 3.43Å; E40-L43 PolarHBondContact O-N 3.23Å; E40-L44 HydrophobicContact CG-CD1 4.4Å; E40-L44 WeakPolarHBondContact O-CG 3.29Å; E40-L44 PolarHBondContact O-N 3.48Å
41E95.5Very high92.8Very high14 Ų1449 Ų497%0.06525%0.251CS..Hα-helixtrans-66.5-40.7179.9-68.2165.6165.100111.6R4 V8 M27 L30 M37 S38 L43 L44 F45R4-E41 IonicContact CZ-OE1 2.71Å; R4-E41 IonicContact CZ-OE2 3.4Å; R4-E41 IonicContact NE-OE1 3.97Å; R4-E41 PolarHBondContact NE-OE1 3.48Å; R4-E41 IonicContact NE-OE2 3.32Å; R4-E41 PolarHBondContact NE-OE2 3.46Å; R4-E41 IonicContact NH2-OE1 3.74Å; R4-E41 PolarHBondContact NH2-OE1 2.83Å; R4-E41 IonicContact NH2-OE2 2.7Å; R4-E41 PolarHBondContact NH2-OE2 2.86Å; V8-E41 HydrophobicContact CG2-CG 3.76Å; M27-E41 HydrophobicContact CE-CB 4.45Å; M27-E41 WeakPolarHBondContact CE-O 3.46Å; L30-E41 HydrophobicContact CD1-CB 4.33Å; L30-E41 HydrophobicContact CD1-CG 3.93Å; L30-E41 HydrophobicContact CD2-CB 4.29Å; M37-E41 WeakPolarHBondContact CA-OE2 3.45Å; M37-E41 HydrophobicContact CB-CB 4.22Å; S38-E41 PolarHBondContact N-OE2 2.84Å; S38-E41 PolarHBondContact O-N 3.24Å; S38-E41 WeakPolarHBondContact OG-CG 3.24Å; S38-E41 PolarHBondContact OG-N 3.06Å; S38-E41 PolarHBondContact OG-OE2 3.42Å; E41-L43 VanDerWaalsContact C-N 3.29Å; E41-L43 PolarHBondContact O-N 3.47Å; E41-L44 PolarHBondContact O-N 2.95Å; E41-F45 WeakPolarHBondContact O-CB 3.37Å; E41-F45 PolarHBondContact O-N 3.43Å
42R93.5Very high92.8Very high29 Ų2949.3 Ų49.311%0.10925%0.252CS..Hα-helixtrans-59.3-41.3174.1-176.8175.475.8-156.40.2111.5M37 S38 E40 F45 S46 E114 N115 F118M37-R42 HydrophobicContact CB-CB 4.32Å; S38-R42 WeakPolarHBondContact O-CB 3.47Å; S38-R42 PolarHBondContact O-N 3.3Å; E40-R42 VanDerWaalsContact C-N 3.35Å; R42-F45 PolarHBondContact O-N 3.24Å; R42-S46 PolarHBondContact O-N 3.05Å; R42-S46 VanDerWaalsContact O-N 3.08Å; R42-E114 IonicContact CZ-OE2 3.9Å; R42-E114 IonicContact NH1-OE2 3.63Å; R42-E114 IonicContact NH2-OE2 3.12Å; R42-E114 PolarHBondContact NH2-OE2 3.45Å; R42-E114 VanDerWaalsContact NH2-OE2 3.12Å; R42-N115 WeakPolarHBondContact CD-OD1 3.43Å; R42-N115 PolarHBondContact NH1-OD1 2.68Å; R42-F118 HydrophobicContact CB-CE1 4.45Å; R42-F118 VanDerWaalsContact CD-CD1 3.48Å; R42-F118 HydrophobicContact CG-CB 4.38Å; R42-F118 HydrophobicContact CG-CD1 3.24Å; R42-F118 HydrophobicContact CG-CD2 3.78Å; R42-F118 HydrophobicContact CG-CE1 3.17Å; R42-F118 HydrophobicContact CG-CE2 3.7Å; R42-F118 HydrophobicContact CG-CG 3.54Å; R42-F118 HydrophobicContact CG-CZ 3.37Å; R42-F118 VanDerWaalsContact O-CZ 3.28Å; R42-F118 WeakPolarHBondContact O-CZ 3.5Å
43L92.2Very high92.7Very high107 Ų10743.3 Ų43.356%0.5623%0.23SC*.Hα-helixtrans-62.7-50.2174.1178.962.7000111.4A39 E40 E41 F45 S46 V47A39-L43 WeakPolarHBondContact O-CB 3.38Å; A39-L43 PolarHBondContact O-N 2.87Å; A39-L43 VanDerWaalsContact O-N 3.07Å; E40-L43 WeakPolarHBondContact O-CB 3.43Å; E40-L43 PolarHBondContact O-N 3.23Å; E41-L43 VanDerWaalsContact C-N 3.29Å; E41-L43 PolarHBondContact O-N 3.47Å; L43-F45 VanDerWaalsContact C-N 3.29Å; L43-F45 PolarHBondContact O-N 3.18Å; L43-S46 PolarHBondContact O-N 3.24Å; L43-V47 HydrophobicContact CD1-CG2 4.15Å; L43-V47 HydrophobicContact CG-CG2 4.4Å; L43-V47 WeakPolarHBondContact O-CG2 3.48Å; L43-V47 PolarHBondContact O-N 2.92Å
44L95.5Very high92.7Very high7 Ų742 Ų424%0.03723%0.231CC..Hα-helixtrans-57.8-42.7177-68.7168.6000111.5V8 K12 E15 M23 M27 E40 E41 S46 V47 G48V8-L44 HydrophobicContact CG1-CD1 3.98Å; K12-L44 HydrophobicContact CG-CD1 4.01Å; K12-L44 HydrophobicContact CG-CD2 4.08Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.49Å; M23-L44 HydrophobicContact CE-CB 3.82Å; M23-L44 HydrophobicContact CE-CD2 3.47Å; M23-L44 VanDerWaalsContact CE-CD2 3.47Å; M23-L44 HydrophobicContact CE-CG 4.26Å; M23-L44 WeakPolarHBondContact CE-O 3.29Å; M27-L44 HydrophobicContact CE-CB 4.05Å; M27-L44 HydrophobicContact CG-CB 4.43Å; M27-L44 HydrophobicContact SD-CB 3.75Å; E40-L44 HydrophobicContact CG-CD1 4.4Å; E40-L44 WeakPolarHBondContact O-CG 3.29Å; E40-L44 PolarHBondContact O-N 3.48Å; E41-L44 PolarHBondContact O-N 2.95Å; L44-S46 PolarHBondContact O-N 3.32Å; L44-V47 PolarHBondContact O-N 3.31Å; L44-G48 PolarHBondContact O-N 3.22Å
45F95.5Very high93Very high0 Ų040.6 Ų40.60%023%0.232CC..Hα-helixtrans-56.7-51.4177.1-173.4-90.5000110.7M27 A31 M37 E41 R42 L43 F49 V98 I101 I102 F119 M122M27-F45 HydrophobicContact CB-CD2 3.9Å; M27-F45 HydrophobicContact CE-CB 3.78Å; M27-F45 HydrophobicContact CE-CD2 4.39Å; A31-F45 HydrophobicContact CB-CE2 4.11Å; M37-F45 HydrophobicContact CE-CD2 3.81Å; M37-F45 HydrophobicContact CE-CE2 4.16Å; M37-F45 HydrophobicContact CE-CG 4.37Å; M37-F45 HydrophobicContact SD-CB 4.22Å; M37-F45 HydrophobicContact SD-CD2 4.32Å; M37-F45 HydrophobicContact SD-CG 4.33Å; E41-F45 WeakPolarHBondContact O-CB 3.37Å; E41-F45 PolarHBondContact O-N 3.43Å; R42-F45 PolarHBondContact O-N 3.24Å; L43-F45 VanDerWaalsContact C-N 3.29Å; L43-F45 PolarHBondContact O-N 3.18Å; F45-F49 HydrophobicContact CD1-CD2 4.2Å; F45-F49 HydrophobicContact CD1-CE2 4.48Å; F45-F49 HydrophobicContact CD2-CD2 4.37Å; F45-F49 HydrophobicContact CD2-CE2 4.02Å; F45-F49 AromaticContact CE1-CD2 3.95Å; F45-F49 HydrophobicContact CE1-CD2 3.95Å; F45-F49 HydrophobicContact CE1-CE2 4Å; F45-F49 HydrophobicContact CE2-CD2 4.13Å; F45-F49 AromaticContact CE2-CE2 3.47Å; F45-F49 HydrophobicContact CE2-CE2 3.47Å; F45-F49 VanDerWaalsContact CE2-CE2 3.47Å; F45-F49 HydrophobicContact CE2-CZ 4.39Å; F45-F49 HydrophobicContact CG-CD2 4.39Å; F45-F49 HydrophobicContact CG-CE2 4.47Å; F45-F49 AromaticContact CZ-CD2 3.91Å; F45-F49 HydrophobicContact CZ-CD2 3.91Å; F45-F49 AromaticContact CZ-CE2 3.46Å; F45-F49 HydrophobicContact CZ-CE2 3.46Å; F45-F49 VanDerWaalsContact CZ-CE2 3.46Å; F45-F49 HydrophobicContact CZ-CZ 4.26Å; F45-F49 WeakPolarHBondContact O-CD2 3.45Å; F45-F49 PolarHBondContact O-N 3.48Å; F45-V98 HydrophobicContact CE1-CG2 3.95Å; F45-V98 HydrophobicContact CZ-CG2 4.03Å; F45-I101 HydrophobicContact CE2-CG2 3.99Å; F45-I101 HydrophobicContact CZ-CG2 3.89Å; F45-I102 HydrophobicContact CE1-CG1 4.36Å; F45-F119 HydrophobicContact CD1-CE1 4.4Å; F45-M122 HydrophobicContact CD1-CE 3.5Å; F45-M122 VanDerWaalsContact CD1-CE 3.5Å; F45-M122 HydrophobicContact CD1-SD 3.58Å; F45-M122 VanDerWaalsContact CD1-SD 3.58Å; F45-M122 HydrophobicContact CE1-CE 3.42Å; F45-M122 VanDerWaalsContact CE1-CE 3.42Å; F45-M122 HydrophobicContact CE1-SD 3.56Å; F45-M122 VanDerWaalsContact CE1-SD 3.56Å
46S93.4Very high93.3Very high31 Ų3141.3 Ų41.322%0.21723%0.23CC..Hα-helixtrans-64.3-43.3177.9160.20000112.7R42 L43 L44 G48 K50 F118R42-S46 PolarHBondContact O-N 3.05Å; R42-S46 VanDerWaalsContact O-N 3.08Å; L43-S46 PolarHBondContact O-N 3.24Å; L44-S46 PolarHBondContact O-N 3.32Å; S46-G48 PolarHBondContact O-N 3.48Å; S46-K50 WeakPolarHBondContact O-CB 3.09Å; S46-K50 PolarHBondContact O-N 3Å; S46-F118 VanDerWaalsContact CB-CZ 3.48Å
47V93.9Very high93.4Very high31 Ų3140.9 Ų40.919%0.18823%0.225CC..Hα-helixtrans-59.6-49.4-178.9169.60000111M23 L43 L44 K50 K51M23-V47 HydrophobicContact CE-CB 4.14Å; M23-V47 HydrophobicContact CE-CG1 4.11Å; M23-V47 HydrophobicContact SD-CG1 4.23Å; L43-V47 HydrophobicContact CD1-CG2 4.15Å; L43-V47 HydrophobicContact CG-CG2 4.4Å; L43-V47 WeakPolarHBondContact O-CG2 3.48Å; L43-V47 PolarHBondContact O-N 2.92Å; L44-V47 PolarHBondContact O-N 3.31Å; V47-K50 PolarHBondContact O-N 3.48Å; V47-K51 HydrophobicContact CG1-CG 4.33Å; V47-K51 WeakPolarHBondContact O-CB 3.1Å; V47-K51 WeakPolarHBondContact O-CG 3.28Å; V47-K51 PolarHBondContact O-N 2.92Å
48G95.1Very high93.5Very high0 Ų042.8 Ų42.80%024%0.242CC..Hα-helixtrans-56.6-58.718000000111.8M23 L44 S46 K50 K51 T52M23-G48 VanDerWaalsContact SD-CA 3.54Å; L44-G48 PolarHBondContact O-N 3.22Å; S46-G48 PolarHBondContact O-N 3.48Å; G48-K50 PolarHBondContact O-N 3.41Å; G48-K51 PolarHBondContact O-N 3.31Å; G48-T52 PolarHBondContact O-N 2.67Å; G48-T52 PolarHBondContact O-OG1 2.97Å
49F95Very high93.6Very high0 Ų043.1 Ų43.10%025%0.245CC..Hα-helixtrans-64.8-37.8-178-77-83000112.6V24 K28 F45 K51 T52 I53 V94 V98 I101 M122 Y126V24-F49 HydrophobicContact CG1-CD1 4.06Å; V24-F49 HydrophobicContact CG1-CE1 3.64Å; V24-F49 HydrophobicContact CG1-CE2 4.3Å; V24-F49 HydrophobicContact CG1-CZ 3.78Å; V24-F49 HydrophobicContact CG2-CD1 4.14Å; V24-F49 HydrophobicContact CG2-CD2 4.36Å; V24-F49 HydrophobicContact CG2-CG 4.06Å; K28-F49 HydrophobicContact CG-CE2 4.48Å; K28-F49 HydrophobicContact CG-CZ 3.83Å; F45-F49 HydrophobicContact CD1-CD2 4.2Å; F45-F49 HydrophobicContact CD1-CE2 4.48Å; F45-F49 HydrophobicContact CD2-CD2 4.37Å; F45-F49 HydrophobicContact CD2-CE2 4.02Å; F45-F49 AromaticContact CE1-CD2 3.95Å; F45-F49 HydrophobicContact CE1-CD2 3.95Å; F45-F49 HydrophobicContact CE1-CE2 4Å; F45-F49 HydrophobicContact CE2-CD2 4.13Å; F45-F49 AromaticContact CE2-CE2 3.47Å; F45-F49 HydrophobicContact CE2-CE2 3.47Å; F45-F49 VanDerWaalsContact CE2-CE2 3.47Å; F45-F49 HydrophobicContact CE2-CZ 4.39Å; F45-F49 HydrophobicContact CG-CD2 4.39Å; F45-F49 HydrophobicContact CG-CE2 4.47Å; F45-F49 AromaticContact CZ-CD2 3.91Å; F45-F49 HydrophobicContact CZ-CD2 3.91Å; F45-F49 AromaticContact CZ-CE2 3.46Å; F45-F49 HydrophobicContact CZ-CE2 3.46Å; F45-F49 VanDerWaalsContact CZ-CE2 3.46Å; F45-F49 HydrophobicContact CZ-CZ 4.26Å; F45-F49 WeakPolarHBondContact O-CD2 3.45Å; F45-F49 PolarHBondContact O-N 3.48Å; F49-K51 VanDerWaalsContact C-N 3.33Å; F49-K51 PolarHBondContact O-N 2.91Å; F49-T52 PolarHBondContact O-N 3.44Å; F49-I53 WeakPolarHBondContact O-CB 3.4Å; F49-I53 VanDerWaalsContact O-CG2 3.28Å; F49-I53 WeakPolarHBondContact O-CG2 3.26Å; F49-I53 PolarHBondContact O-N 3.45Å; F49-V94 HydrophobicContact CD1-CG1 4.39Å; F49-V98 HydrophobicContact CB-CG2 4.49Å; F49-V98 HydrophobicContact CD1-CB 3.81Å; F49-V98 HydrophobicContact CD1-CG2 3.84Å; F49-V98 HydrophobicContact CD2-CG2 4.01Å; F49-V98 HydrophobicContact CE1-CB 3.7Å; F49-V98 HydrophobicContact CE1-CG2 3.92Å; F49-V98 HydrophobicContact CE2-CG2 4.11Å; F49-V98 HydrophobicContact CG-CB 4.37Å; F49-V98 HydrophobicContact CG-CG2 3.88Å; F49-V98 HydrophobicContact CZ-CB 4.18Å; F49-V98 HydrophobicContact CZ-CG2 4.05Å; F49-I101 HydrophobicContact CZ-CD1 4.02Å; F49-M122 HydrophobicContact CB-CE 3.93Å; F49-M122 HydrophobicContact CD2-CE 4.24Å; F49-M122 HydrophobicContact CG-CE 4.35Å; F49-Y126 VanDerWaalsContact C-OH 3.28Å; F49-Y126 WeakPolarHBondContact CB-OH 3.2Å; F49-Y126 PolarHBondContact O-OH 3.13Å
50K92.3Very high93.8Very high133 Ų13341.7 Ų41.758%0.57823%0.226SC*.Hα-helixtrans-62.3-39.4178-178.4176.1178.9173.10111.9S46 V47 G48 G54S46-K50 WeakPolarHBondContact O-CB 3.09Å; S46-K50 PolarHBondContact O-N 3Å; V47-K50 PolarHBondContact O-N 3.48Å; G48-K50 PolarHBondContact O-N 3.41Å; K50-G54 WeakPolarHBondContact O-CA 3.35Å; K50-G54 PolarHBondContact O-N 3.48Å
51K93.3Very high93.7Very high103 Ų10342.5 Ų42.545%0.44823%0.225SC..Hα-helixtrans-71.7-45.5178.6-70.1-78.2-172.9160.90111.2Y20 V47 G48 F49 G54 A55Y20-K51 HydrophobicContact CD1-CB 3.58Å; Y20-K51 HydrophobicContact CD1-CG 3.76Å; Y20-K51 HydrophobicContact CD2-CB 3.59Å; Y20-K51 HydrophobicContact CD2-CD 4.45Å; Y20-K51 HydrophobicContact CD2-CG 4.21Å; Y20-K51 HydrophobicContact CE1-CB 3.96Å; Y20-K51 HydrophobicContact CE1-CD 4.1Å; Y20-K51 HydrophobicContact CE1-CG 3.63Å; Y20-K51 HydrophobicContact CE2-CB 3.92Å; Y20-K51 HydrophobicContact CE2-CD 3.9Å; Y20-K51 HydrophobicContact CE2-CG 4.05Å; Y20-K51 HydrophobicContact CG-CB 3.38Å; Y20-K51 HydrophobicContact CG-CG 4.05Å; V47-K51 HydrophobicContact CG1-CG 4.33Å; V47-K51 WeakPolarHBondContact O-CB 3.1Å; V47-K51 WeakPolarHBondContact O-CG 3.28Å; V47-K51 PolarHBondContact O-N 2.92Å; G48-K51 PolarHBondContact O-N 3.31Å; F49-K51 VanDerWaalsContact C-N 3.33Å; F49-K51 PolarHBondContact O-N 2.91Å; K51-G54 PolarHBondContact O-N 2.95Å; K51-A55 PolarHBondContact O-N 3.35Å; K51-A55 VanDerWaalsContact O-N 3.14Å
52T93.6Very high93.7Very high7 Ų746.9 Ų46.94%0.04325%0.248CC..Hα-helixtrans-59.6-47176.4-700000112.7D21 G48 F49 R56 V94D21-T52 WeakPolarHBondContact OD1-CG2 3.15Å; D21-T52 PolarHBondContact OD1-OG1 3.08Å; D21-T52 VanDerWaalsContact OD1-OG1 3.05Å; G48-T52 PolarHBondContact O-N 2.67Å; G48-T52 PolarHBondContact O-OG1 2.97Å; F49-T52 PolarHBondContact O-N 3.44Å; T52-R56 VanDerWaalsContact CG2-NH1 3.29Å; T52-R56 PolarHBondContact O-NH1 3.26Å; T52-R56 VanDerWaalsContact O-NH1 3.11Å; T52-V94 HydrophobicContact CG2-CG1 4.36Å; T52-V94 HydrophobicContact CG2-CG2 4.43Å
53I92.1Very high93.7Very high1 Ų146.3 Ų46.31%0.00525%0.247CC..Hα-helixtrans-73.2-34.2177.9-159.879.2000111.7F49 A55 R56 R57 L91 V94 Y126 Y129F49-I53 WeakPolarHBondContact O-CB 3.4Å; F49-I53 VanDerWaalsContact O-CG2 3.28Å; F49-I53 WeakPolarHBondContact O-CG2 3.26Å; F49-I53 PolarHBondContact O-N 3.45Å; I53-A55 PolarHBondContact O-N 2.95Å; I53-R56 PolarHBondContact O-N 3.41Å; I53-R57 HydrophobicContact CG1-CG 4.34Å; I53-R57 WeakPolarHBondContact O-CB 3.28Å; I53-R57 WeakPolarHBondContact O-CG 3.46Å; I53-R57 PolarHBondContact O-N 3.46Å; I53-L91 HydrophobicContact CD1-CD2 3.54Å; I53-L91 HydrophobicContact CG1-CD2 3.99Å; I53-V94 HydrophobicContact CB-CG1 4.49Å; I53-V94 HydrophobicContact CD1-CB 3.89Å; I53-V94 HydrophobicContact CD1-CG1 3.7Å; I53-Y126 HydrophobicContact CB-CE1 4.2Å; I53-Y126 HydrophobicContact CD1-CE1 4.41Å; I53-Y126 HydrophobicContact CG1-CE1 4.18Å; I53-Y126 HydrophobicContact CG2-CE1 4.12Å; I53-Y129 HydrophobicContact CG1-CD2 4.12Å; I53-Y129 HydrophobicContact CG2-CD2 4.28Å; I53-Y129 HydrophobicContact CG2-CE2 4.04Å
54G91Very high93.6Very high30 Ų3043.7 Ų43.731%0.30923%0.232SC..Hα-helixtrans-61-44179.700000112.7K50 K51 R57 A58K50-G54 WeakPolarHBondContact O-CA 3.35Å; K50-G54 PolarHBondContact O-N 3.48Å; K51-G54 PolarHBondContact O-N 2.95Å; G54-R57 PolarHBondContact O-N 3.38Å; G54-A58 PolarHBondContact O-N 3.07Å
55A93.9Very high93.5Very high59 Ų5945.8 Ų45.849%0.48825%0.247SC..Hα-helixtrans-60.3-47.9175.600000111.8K51 I53 A58 S59K51-A55 PolarHBondContact O-N 3.35Å; K51-A55 VanDerWaalsContact O-N 3.14Å; I53-A55 PolarHBondContact O-N 2.95Å; A55-A58 WeakPolarHBondContact O-CB 3.37Å; A55-A58 PolarHBondContact O-N 3.47Å; A55-S59 PolarHBondContact O-N 3.05Å; A55-S59 PolarHBondContact O-OG 2.72Å
56R93.5Very high93.3Very high53 Ų5349.2 Ų49.220%0.227%0.265CS..Hα-helixtrans-65.8-39.6179.7-70.9168.7175.576.5-3.1112.6D21 T52 I53 A58 S59 W60 E90 L91D21-R56 IonicContact OD1-NH1 2.78Å; D21-R56 IonicContact OD1-NH2 2.73Å; D21-R56 IonicContact OD2-NH2 2.64Å; T52-R56 VanDerWaalsContact CG2-NH1 3.29Å; T52-R56 PolarHBondContact O-NH1 3.26Å; T52-R56 VanDerWaalsContact O-NH1 3.11Å; I53-R56 PolarHBondContact O-N 3.41Å; R56-A58 VanDerWaalsContact C-N 3.32Å; R56-A58 PolarHBondContact O-N 3.47Å; R56-S59 WeakPolarHBondContact O-CB 3.32Å; R56-S59 PolarHBondContact O-N 2.9Å; R56-W60 PolarHBondContact O-N 2.89Å; R56-E90 IonicContact NE-OE2 2.78Å; R56-L91 HydrophobicContact CB-CD2 3.43Å; R56-L91 VanDerWaalsContact CB-CD2 3.43Å; R56-L91 HydrophobicContact CB-CG 3.92Å
57R92.7Very high93.2Very high37 Ų3750 Ų5014%0.1427%0.265CS..Hα-helixtrans-64.3-36.5174.6-75.3176.466.4-139.18.4111.9I53 G54 W60 R61 L91 E132I53-R57 HydrophobicContact CG1-CG 4.34Å; I53-R57 WeakPolarHBondContact O-CB 3.28Å; I53-R57 WeakPolarHBondContact O-CG 3.46Å; I53-R57 PolarHBondContact O-N 3.46Å; G54-R57 PolarHBondContact O-N 3.38Å; R57-W60 PolarHBondContact O-N 2.65Å; R57-R61 WeakPolarHBondContact O-CG 3.39Å; R57-R61 PolarHBondContact O-N 3.48Å; R57-R61 VanDerWaalsContact O-N 3.07Å; R57-L91 HydrophobicContact CG-CD2 3.73Å; R57-E132 IonicContact CZ-OE1 3.72Å; R57-E132 IonicContact CZ-OE2 2.85Å; R57-E132 IonicContact NE-OE1 2.98Å; R57-E132 IonicContact NE-OE2 3.46Å; R57-E132 PolarHBondContact NE-OE2 3.36Å; R57-E132 IonicContact NH2-OE1 3.7Å; R57-E132 PolarHBondContact NH2-OE1 2.93Å; R57-E132 IonicContact NH2-OE2 2.93Å; R57-E132 PolarHBondContact NH2-OE2 3.02Å
58A93.9Very high92.8Very high48 Ų4855.3 Ų55.340%0.39729%0.288SS..Hα-helixtrans-64.8-45173.900000111.2G54 A55 R56 W60 R61 I62G54-A58 PolarHBondContact O-N 3.07Å; A55-A58 WeakPolarHBondContact O-CB 3.37Å; A55-A58 PolarHBondContact O-N 3.47Å; R56-A58 VanDerWaalsContact C-N 3.32Å; R56-A58 PolarHBondContact O-N 3.47Å; A58-W60 PolarHBondContact O-N 2.71Å; A58-R61 PolarHBondContact O-N 2.66Å; A58-I62 WeakPolarHBondContact O-CG1 3.45Å; A58-I62 PolarHBondContact O-N 3.5Å
59S95.3Very high92.6Very high56 Ų5662.9 Ų62.939%0.39232%0.321SS..Hα-helixtrans-58.2-46.3173.8-56.20000112.1A55 R56 R61 I62 L63A55-S59 PolarHBondContact O-N 3.05Å; A55-S59 PolarHBondContact O-OG 2.72Å; R56-S59 WeakPolarHBondContact O-CB 3.32Å; R56-S59 PolarHBondContact O-N 2.9Å; S59-R61 PolarHBondContact O-N 3.18Å; S59-I62 PolarHBondContact O-N 3.24Å; S59-L63 WeakPolarHBondContact O-CG 3.16Å; S59-L63 PolarHBondContact O-N 3.02Å
60W94.6Very high92.2Very high30 Ų3065 Ų6511%0.11433%0.334CS..Hα-helixtrans-60.3-45.1178.718079.8000112.5R56 R57 A58 I62 L63 E64 V87 E88 L91 E132 F133R56-W60 PolarHBondContact O-N 2.89Å; R57-W60 PolarHBondContact O-N 2.65Å; A58-W60 PolarHBondContact O-N 2.71Å; W60-I62 VanDerWaalsContact C-N 3.3Å; W60-I62 PolarHBondContact O-N 3.11Å; W60-L63 PolarHBondContact O-N 3.2Å; W60-L63 VanDerWaalsContact O-N 3.12Å; W60-E64 WeakPolarHBondContact O-CB 3.13Å; W60-E64 PolarHBondContact O-N 3.09Å; W60-V87 HydrophobicContact CB-CG1 3.9Å; W60-E88 VanDerWaalsContact CD1-CG 3.5Å; W60-E88 PolarHBondContact NE1-OE1 2.9Å; W60-L91 HydrophobicContact CB-CD1 3.82Å; W60-L91 HydrophobicContact CG-CD1 4.08Å; W60-E132 WeakPolarHBondContact CH2-O 3.48Å; W60-F133 HydrophobicContact CD2-CB 4.2Å; W60-F133 VanDerWaalsContact CE2-CB 3.5Å; W60-F133 HydrophobicContact CH2-CB 4.06Å; W60-F133 HydrophobicContact CZ2-CB 3.43Å; W60-F133 VanDerWaalsContact CZ2-CB 3.43Å
61R92.1Very high91.5Very high116 Ų11663.3 Ų63.344%0.43834%0.335SS..Hα-helixtrans-60.4-37.2176.5-73.8-176.3-176.798.94.2113.3R57 A58 S59 S65 E132R57-R61 WeakPolarHBondContact O-CG 3.39Å; R57-R61 PolarHBondContact O-N 3.48Å; R57-R61 VanDerWaalsContact O-N 3.07Å; A58-R61 PolarHBondContact O-N 2.66Å; S59-R61 PolarHBondContact O-N 3.18Å; R61-S65 WeakPolarHBondContact O-CB 3.34Å; R61-S65 PolarHBondContact O-N 3.44Å; R61-E132 IonicContact NH2-OE2 3.53Å
62I94.9Very high90.4Very high106 Ų10663.5 Ų63.554%0.54436%0.355SS..Hα-helixtrans-65-45.2175.8-66.8165.8000109.7A58 S59 W60 S65 L66A58-I62 WeakPolarHBondContact O-CG1 3.45Å; A58-I62 PolarHBondContact O-N 3.5Å; S59-I62 PolarHBondContact O-N 3.24Å; W60-I62 VanDerWaalsContact C-N 3.3Å; W60-I62 PolarHBondContact O-N 3.11Å; I62-S65 PolarHBondContact O-N 2.88Å; I62-L66 HydrophobicContact CG2-CD1 4.06Å; I62-L66 HydrophobicContact CG2-CG 4.46Å; I62-L66 WeakPolarHBondContact O-CG 3.03Å; I62-L66 PolarHBondContact O-N 3.27Å
63L93.9Very high89.2Confident17 Ų1766.3 Ų66.39%0.08939%0.386CS..Hα-helixtrans-65.2-41.5179.5-65.7170.5000112.3S59 W60 S65 L66 E67 Y83 K84 V87S59-L63 WeakPolarHBondContact O-CG 3.16Å; S59-L63 PolarHBondContact O-N 3.02Å; W60-L63 PolarHBondContact O-N 3.2Å; W60-L63 VanDerWaalsContact O-N 3.12Å; L63-S65 VanDerWaalsContact C-N 3.34Å; L63-S65 PolarHBondContact O-N 3.42Å; L63-L66 PolarHBondContact O-N 3.23Å; L63-E67 WeakPolarHBondContact O-CB 3.32Å; L63-E67 PolarHBondContact O-N 2.91Å; L63-Y83 HydrophobicContact CD1-CD1 3.54Å; L63-Y83 HydrophobicContact CD1-CE1 3.93Å; L63-Y83 HydrophobicContact CD2-CD1 3.68Å; L63-Y83 HydrophobicContact CD2-CE1 4.26Å; L63-Y83 HydrophobicContact CG-CD1 4.26Å; L63-K84 HydrophobicContact CB-CB 4.25Å; L63-K84 HydrophobicContact CB-CG 4.13Å; L63-V87 HydrophobicContact CD1-CB 4.21Å; L63-V87 HydrophobicContact CD1-CG2 3.64Å
64E90.4Very high88.7Confident52 Ų5270.1 Ų70.124%0.24341%0.406CS..Hα-helixtrans-59.1-44.6173.3-174.963.6-154.900111.2W60 L66 E67 Q68 K84W60-E64 WeakPolarHBondContact O-CB 3.13Å; W60-E64 PolarHBondContact O-N 3.09Å; E64-L66 VanDerWaalsContact C-N 3.33Å; E64-L66 PolarHBondContact O-N 2.88Å; E64-E67 PolarHBondContact O-N 2.98Å; E64-Q68 WeakPolarHBondContact O-CG 3.42Å; E64-Q68 PolarHBondContact O-N 3.43Å; E64-Q68 VanDerWaalsContact O-N 3.14Å; E64-K84 WeakPolarHBondContact OE2-CD 3.36Å; E64-K84 IonicContact OE2-NZ 3.92Å; E64-K84 PolarHBondContact OE2-NZ 2.96Å
65S92.5Very high88.4Confident51 Ų5175.4 Ų75.436%0.35742%0.423SS..Hα-helixtrans-66.5-32176.5-178.10000113.4R61 I62 L63 K69R61-S65 WeakPolarHBondContact O-CB 3.34Å; R61-S65 PolarHBondContact O-N 3.44Å; I62-S65 PolarHBondContact O-N 2.88Å; L63-S65 VanDerWaalsContact C-N 3.34Å; L63-S65 PolarHBondContact O-N 3.42Å; S65-K69 WeakPolarHBondContact O-CG 3.4Å
66L92.4Very high88.1Confident73 Ų7376 Ų7638%0.38242%0.422SS..Hα-helixtrans-74-39175.5-72173.4000111.6I62 L63 E64 Q68 K69 I80I62-L66 HydrophobicContact CG2-CD1 4.06Å; I62-L66 HydrophobicContact CG2-CG 4.46Å; I62-L66 WeakPolarHBondContact O-CG 3.03Å; I62-L66 PolarHBondContact O-N 3.27Å; L63-L66 PolarHBondContact O-N 3.23Å; E64-L66 VanDerWaalsContact C-N 3.33Å; E64-L66 PolarHBondContact O-N 2.88Å; L66-Q68 VanDerWaalsContact C-N 3.33Å; L66-Q68 PolarHBondContact O-N 3.29Å; L66-K69 PolarHBondContact O-N 2.98Å; L66-K69 VanDerWaalsContact O-N 3.15Å; L66-I80 HydrophobicContact CB-CD1 4.23Å; L66-I80 HydrophobicContact CB-CG2 4.45Å
67E89.5Confident87.8Confident46 Ų4674 Ų7422%0.21542%0.418CS..Hα-helixtrans-62.2-41.5177.1-170.3177.6-145.400111.4L63 E64 K69 V70 I80 K84L63-E67 WeakPolarHBondContact O-CB 3.32Å; L63-E67 PolarHBondContact O-N 2.91Å; E64-E67 PolarHBondContact O-N 2.98Å; E67-K69 PolarHBondContact O-N 3.09Å; E67-K69 VanDerWaalsContact O-N 3.11Å; E67-V70 PolarHBondContact O-N 3.04Å; E67-V70 VanDerWaalsContact O-N 3.11Å; E67-I80 HydrophobicContact CB-CG2 3.89Å; E67-K84 WeakPolarHBondContact OE2-CE 3.33Å; E67-K84 IonicContact OE2-NZ 3.13Å; E67-K84 PolarHBondContact OE2-NZ 3.33Å
68Q87.3Confident87.6Confident144 Ų14476.3 Ų76.367%0.67344%0.436SS*.THydrogen-bonded Turntrans-61.3-19.4176.1-71.6173.85.200114.2E64 L66E64-Q68 WeakPolarHBondContact O-CG 3.42Å; E64-Q68 PolarHBondContact O-N 3.43Å; E64-Q68 VanDerWaalsContact O-N 3.14Å; L66-Q68 VanDerWaalsContact C-N 3.33Å; L66-Q68 PolarHBondContact O-N 3.29Å
69K89.7Confident87.5Confident159 Ų15978.1 Ų78.169%0.69144%0.442SS*.THydrogen-bonded Turntrans-92.4-8.4179.7-68.6174.2-174.7174.40113.5S65 L66 E67S65-K69 WeakPolarHBondContact O-CG 3.4Å; L66-K69 PolarHBondContact O-N 2.98Å; L66-K69 VanDerWaalsContact O-N 3.15Å; E67-K69 PolarHBondContact O-N 3.09Å; E67-K69 VanDerWaalsContact O-N 3.11Å
70V86.5Confident87.3Confident43 Ų4376.9 Ų76.926%0.26143%0.431SS..SBendtrans-108.4141.1-177.2-178.70000109.8E67 A72 D74 P76 I80E67-V70 PolarHBondContact O-N 3.04Å; E67-V70 VanDerWaalsContact O-N 3.11Å; V70-A72 PolarHBondContact O-N 3.35Å; V70-D74 HydrophobicContact CG1-CB 4.22Å; V70-P76 HydrophobicContact CG1-CB 4.21Å; V70-I80 HydrophobicContact CG2-CD1 3.76Å
71T77.4Confident87.2Confident98 Ų9879.1 Ų79.160%0.60145%0.445SS*.  trans-62.5131.7174.1-280000109.8G73 D74T71-G73 PolarHBondContact O-N 3.4Å; T71-G73 VanDerWaalsContact O-N 3.1Å; T71-D74 WeakPolarHBondContact CB-OD2 3.4Å; T71-D74 PolarHBondContact O-N 3.29Å; T71-D74 PolarHBondContact OG1-OD2 3.43Å
72A70.9Confident87.2Confident107 Ų10775.9 Ų75.988%0.88445%0.447SS*.THydrogen-bonded Turntrans-57119.4173.800000109.9V70V70-A72 PolarHBondContact O-N 3.35Å
73G69.1Low87.2Confident67 Ų6777.1 Ų77.169%0.69145%0.446SS*.THydrogen-bonded Turntrans106.5-12.317800000115.9T71T71-G73 PolarHBondContact O-N 3.4Å; T71-G73 VanDerWaalsContact O-N 3.1Å
74D80.8Confident87.2Confident80 Ų8077.5 Ų77.543%0.42845%0.447SS..SBendtrans-73148.9173.2-70.3-28.5000110.9V70 T71 P76 G77 V78V70-D74 HydrophobicContact CG1-CB 4.22Å; T71-D74 WeakPolarHBondContact CB-OD2 3.4Å; T71-D74 PolarHBondContact O-N 3.29Å; T71-D74 PolarHBondContact OG1-OD2 3.43Å; D74-P76 VanDerWaalsContact C-N 3.29Å; D74-P76 VanDerWaalsContact O-N 3.16Å; D74-G77 WeakPolarHBondContact O-CA 3.07Å; D74-G77 PolarHBondContact O-N 2.92Å; D74-V78 PolarHBondContact O-N 2.87Å; D74-V78 VanDerWaalsContact O-N 3.13Å
75Q85.8Confident87.3Confident142 Ų14280.8 Ų80.866%0.66446%0.461SS*.Hα-helixtrans-50.6-39179.7-171.163.627.400114.2G77 T79Q75-G77 VanDerWaalsContact C-N 3.32Å; Q75-G77 PolarHBondContact O-N 3.37Å; Q75-T79 PolarHBondContact O-N 3.11Å; Q75-T79 VanDerWaalsContact O-N 3.13Å; Q75-T79 PolarHBondContact O-OG1 2.69Å
76P86.5Confident87.5Confident72 Ų7283.8 Ų83.847%0.46847%0.467SS..Hα-helixtrans-63-37.1173.3-21.334.9000112.7V70 D74 T79 I80V70-P76 HydrophobicContact CG1-CB 4.21Å; D74-P76 VanDerWaalsContact C-N 3.29Å; D74-P76 VanDerWaalsContact O-N 3.16Å; P76-T79 PolarHBondContact O-N 3.49Å; P76-I80 WeakPolarHBondContact O-CD1 3.25Å; P76-I80 VanDerWaalsContact O-CG1 3.23Å; P76-I80 WeakPolarHBondContact O-CG1 3.39Å; P76-I80 PolarHBondContact O-N 3.45Å
77G87.2Confident87.7Confident10 Ų1080.6 Ų80.610%0.10345%0.451CS..Hα-helixtrans-66.9-42.7179.600000111.8D74 Q75 T79 I80 N81D74-G77 WeakPolarHBondContact O-CA 3.07Å; D74-G77 PolarHBondContact O-N 2.92Å; Q75-G77 VanDerWaalsContact C-N 3.32Å; Q75-G77 PolarHBondContact O-N 3.37Å; G77-T79 VanDerWaalsContact C-N 3.3Å; G77-T79 PolarHBondContact O-N 2.91Å; G77-I80 PolarHBondContact O-N 3.33Å; G77-N81 WeakPolarHBondContact O-CB 3.18Å; G77-N81 PolarHBondContact O-N 2.98Å
78V88.6Confident87.9Confident85 Ų8579.8 Ų79.852%0.51545%0.447SS..Hα-helixtrans-60.9-41.2173.7179.80000111.2D74 G82D74-V78 PolarHBondContact O-N 2.87Å; D74-V78 VanDerWaalsContact O-N 3.13Å; V78-G82 PolarHBondContact O-N 2.95Å
79T91.2Very high88.3Confident86 Ų8676.8 Ų76.853%0.52844%0.435SS..Hα-helixtrans-67.3-44.3179.3-53.60000111.7Q75 P76 G77 G82 Y83Q75-T79 PolarHBondContact O-N 3.11Å; Q75-T79 VanDerWaalsContact O-N 3.13Å; Q75-T79 PolarHBondContact O-OG1 2.69Å; P76-T79 PolarHBondContact O-N 3.49Å; G77-T79 VanDerWaalsContact C-N 3.3Å; G77-T79 PolarHBondContact O-N 2.91Å; T79-G82 PolarHBondContact O-N 2.78Å; T79-Y83 PolarHBondContact O-N 2.86Å; T79-Y83 VanDerWaalsContact O-N 3.12Å
80I92.8Very high88.6Confident31 Ų3172.7 Ų72.716%0.15942%0.419CS..Hα-helixtrans-63.5-47.3177.5-68.6162.6000110.4L66 E67 V70 P76 G77 G82 Y83 K84L66-I80 HydrophobicContact CB-CD1 4.23Å; L66-I80 HydrophobicContact CB-CG2 4.45Å; E67-I80 HydrophobicContact CB-CG2 3.89Å; V70-I80 HydrophobicContact CG2-CD1 3.76Å; P76-I80 WeakPolarHBondContact O-CD1 3.25Å; P76-I80 VanDerWaalsContact O-CG1 3.23Å; P76-I80 WeakPolarHBondContact O-CG1 3.39Å; P76-I80 PolarHBondContact O-N 3.45Å; G77-I80 PolarHBondContact O-N 3.33Å; I80-G82 PolarHBondContact O-N 2.81Å; I80-Y83 PolarHBondContact O-N 3.23Å; I80-K84 WeakPolarHBondContact O-CB 3.39Å; I80-K84 PolarHBondContact O-N 3.33Å
81N90.7Very high89Confident77 Ų7770.7 Ų70.741%0.41241%0.406SS..Hα-helixtrans-61.2-44.6179.1-173.9-13.9000111.4G77 Y83 K84 K85G77-N81 WeakPolarHBondContact O-CB 3.18Å; G77-N81 PolarHBondContact O-N 2.98Å; N81-Y83 VanDerWaalsContact C-N 3.3Å; N81-Y83 PolarHBondContact O-N 2.9Å; N81-K84 WeakPolarHBondContact O-CB 3.36Å; N81-K84 PolarHBondContact O-N 3.47Å; N81-K85 PolarHBondContact O-N 3.44Å
82G92.9Very high89.8Confident47 Ų4768.4 Ų68.449%0.48539%0.387SS..Hα-helixtrans-57.2-41.6175.200000113.2V78 T79 I80 K86V78-G82 PolarHBondContact O-N 2.95Å; T79-G82 PolarHBondContact O-N 2.78Å; I80-G82 PolarHBondContact O-N 2.81Å; G82-K86 PolarHBondContact O-N 2.75Å
83Y94.4Very high91Very high133 Ų13366.1 Ų66.152%0.52237%0.368SS..Hα-helixtrans-74.8-35.9176.4-166-109.1000112.8L63 T79 I80 N81 K85 K86 V87L63-Y83 HydrophobicContact CD1-CD1 3.54Å; L63-Y83 HydrophobicContact CD1-CE1 3.93Å; L63-Y83 HydrophobicContact CD2-CD1 3.68Å; L63-Y83 HydrophobicContact CD2-CE1 4.26Å; L63-Y83 HydrophobicContact CG-CD1 4.26Å; T79-Y83 PolarHBondContact O-N 2.86Å; T79-Y83 VanDerWaalsContact O-N 3.12Å; I80-Y83 PolarHBondContact O-N 3.23Å; N81-Y83 VanDerWaalsContact C-N 3.3Å; N81-Y83 PolarHBondContact O-N 2.9Å; Y83-K85 PolarHBondContact O-N 3.48Å; Y83-K86 HydrophobicContact CD2-CD 4.48Å; Y83-K86 HydrophobicContact CE2-CD 4.41Å; Y83-K86 WeakPolarHBondContact O-CB 3.47Å; Y83-K86 PolarHBondContact O-N 3.47Å; Y83-V87 HydrophobicContact CE1-CG2 4.27Å; Y83-V87 PolarHBondContact O-N 3.4Å; Y83-V87 VanDerWaalsContact O-N 3.14Å
84K94Very high92.2Very high24 Ų2463.7 Ų63.710%0.10434%0.34CS..Hα-helixtrans-58.1-48173.8-167.6-178.984.4168.70110.8L63 E64 E67 I80 N81 K86 V87 E88L63-K84 HydrophobicContact CB-CB 4.25Å; L63-K84 HydrophobicContact CB-CG 4.13Å; E64-K84 WeakPolarHBondContact OE2-CD 3.36Å; E64-K84 IonicContact OE2-NZ 3.92Å; E64-K84 PolarHBondContact OE2-NZ 2.96Å; E67-K84 WeakPolarHBondContact OE2-CE 3.33Å; E67-K84 IonicContact OE2-NZ 3.13Å; E67-K84 PolarHBondContact OE2-NZ 3.33Å; I80-K84 WeakPolarHBondContact O-CB 3.39Å; I80-K84 PolarHBondContact O-N 3.33Å; N81-K84 WeakPolarHBondContact O-CB 3.36Å; N81-K84 PolarHBondContact O-N 3.47Å; K84-K86 VanDerWaalsContact C-N 3.29Å; K84-K86 PolarHBondContact O-N 3.03Å; K84-V87 PolarHBondContact O-N 3.31Å; K84-E88 VanDerWaalsContact CE-OE1 3.25Å; K84-E88 WeakPolarHBondContact CE-OE1 3.44Å; K84-E88 WeakPolarHBondContact O-CG 3.45Å; K84-E88 PolarHBondContact O-N 3.44Å
85K93.8Very high92.8Very high122 Ų12259.9 Ų59.953%0.5332%0.32SS..Hα-helixtrans-58.6-39.4176.9-171.5173.8-178.1176.70112.4N81 Y83 V87 E88 D89N81-K85 PolarHBondContact O-N 3.44Å; Y83-K85 PolarHBondContact O-N 3.48Å; K85-V87 PolarHBondContact O-N 3.47Å; K85-E88 WeakPolarHBondContact O-CB 3.43Å; K85-E88 PolarHBondContact O-N 3.33Å; K85-D89 VanDerWaalsContact O-CG 3.31Å; K85-D89 PolarHBondContact O-N 3.28Å
86K95.9Very high93.3Very high114 Ų11457.1 Ų57.150%0.49631%0.309SS..Hα-helixtrans-59.7-45.2173.8-175.8-175.7174.8-174.30111.8G82 Y83 K84 D89 E90G82-K86 PolarHBondContact O-N 2.75Å; Y83-K86 HydrophobicContact CD2-CD 4.48Å; Y83-K86 HydrophobicContact CE2-CD 4.41Å; Y83-K86 WeakPolarHBondContact O-CB 3.47Å; Y83-K86 PolarHBondContact O-N 3.47Å; K84-K86 VanDerWaalsContact C-N 3.29Å; K84-K86 PolarHBondContact O-N 3.03Å; K86-D89 PolarHBondContact O-N 3.05Å; K86-E90 WeakPolarHBondContact CE-OE1 3.12Å; K86-E90 WeakPolarHBondContact O-CG 3.41Å; K86-E90 PolarHBondContact O-N 3.41Å
87V95.9Very high93.6Very high6 Ų656.5 Ų56.54%0.03630%0.3CS..Hα-helixtrans-66.3-37.4177.11780000111.6W60 L63 Y83 K84 K85 E90 L91W60-V87 HydrophobicContact CB-CG1 3.9Å; L63-V87 HydrophobicContact CD1-CB 4.21Å; L63-V87 HydrophobicContact CD1-CG2 3.64Å; Y83-V87 HydrophobicContact CE1-CG2 4.27Å; Y83-V87 PolarHBondContact O-N 3.4Å; Y83-V87 VanDerWaalsContact O-N 3.14Å; K84-V87 PolarHBondContact O-N 3.31Å; K85-V87 PolarHBondContact O-N 3.47Å; V87-E90 PolarHBondContact O-N 3.42Å; V87-L91 HydrophobicContact CG1-CD1 4.23Å; V87-L91 HydrophobicContact CG1-CG 4.5Å; V87-L91 WeakPolarHBondContact O-CB 3.45Å; V87-L91 WeakPolarHBondContact O-CG 3.15Å; V87-L91 PolarHBondContact O-N 3.42Å
88E95.4Very high94Very high28 Ų2856 Ų5613%0.13130%0.295CS..Hα-helixtrans-63.2-41.5174-70.8173.3178.100112.3W60 K84 K85 L91 R92 F133W60-E88 VanDerWaalsContact CD1-CG 3.5Å; W60-E88 PolarHBondContact NE1-OE1 2.9Å; K84-E88 VanDerWaalsContact CE-OE1 3.25Å; K84-E88 WeakPolarHBondContact CE-OE1 3.44Å; K84-E88 WeakPolarHBondContact O-CG 3.45Å; K84-E88 PolarHBondContact O-N 3.44Å; K85-E88 WeakPolarHBondContact O-CB 3.43Å; K85-E88 PolarHBondContact O-N 3.33Å; E88-L91 PolarHBondContact O-N 3.14Å; E88-R92 VanDerWaalsContact O-CB 3.26Å; E88-R92 WeakPolarHBondContact O-CB 3.49Å; E88-R92 PolarHBondContact O-N 2.83Å; E88-F133 HydrophobicContact CB-CD2 4.07Å; E88-F133 HydrophobicContact CB-CE2 4.42Å; E88-F133 HydrophobicContact CG-CB 4.24Å; E88-F133 HydrophobicContact CG-CD2 4.04Å; E88-F133 HydrophobicContact CG-CG 4.36Å
89D95.6Very high94.3Very high81 Ų8152.5 Ų52.543%0.43327%0.273SS..Hα-helixtrans-64.7-40.2176.1-70.5-23.9000111.5K85 K86 R92 A93K85-D89 VanDerWaalsContact O-CG 3.31Å; K85-D89 PolarHBondContact O-N 3.28Å; K86-D89 PolarHBondContact O-N 3.05Å; D89-R92 PolarHBondContact O-N 3.03Å; D89-R92 IonicContact OD1-NH1 3.84Å; D89-R92 PolarHBondContact OD1-NH1 3.46Å; D89-A93 WeakPolarHBondContact O-CB 3.1Å; D89-A93 PolarHBondContact O-N 3.43Å
90E95.2Very high94.5Very high74 Ų7450.9 Ų50.935%0.34627%0.265SS..Hα-helixtrans-64-44.3172.8-71.1178-158.300112.2R56 K86 V87 A93 V94R56-E90 IonicContact NE-OE2 2.78Å; K86-E90 WeakPolarHBondContact CE-OE1 3.12Å; K86-E90 WeakPolarHBondContact O-CG 3.41Å; K86-E90 PolarHBondContact O-N 3.41Å; V87-E90 PolarHBondContact O-N 3.42Å; E90-A93 PolarHBondContact O-N 3.33Å; E90-V94 WeakPolarHBondContact O-CG2 3.32Å; E90-V94 PolarHBondContact O-N 3.05Å
91L94.7Very high94.6Very high0 Ų049.5 Ų49.50%026%0.258CS..Hα-helixtrans-60.2-46.8175.3-79.4170.4000111.4I53 R56 R57 W60 V87 E88 A93 V94 C95 F133I53-L91 HydrophobicContact CD1-CD2 3.54Å; I53-L91 HydrophobicContact CG1-CD2 3.99Å; R56-L91 HydrophobicContact CB-CD2 3.43Å; R56-L91 VanDerWaalsContact CB-CD2 3.43Å; R56-L91 HydrophobicContact CB-CG 3.92Å; R57-L91 HydrophobicContact CG-CD2 3.73Å; W60-L91 HydrophobicContact CB-CD1 3.82Å; W60-L91 HydrophobicContact CG-CD1 4.08Å; V87-L91 HydrophobicContact CG1-CD1 4.23Å; V87-L91 HydrophobicContact CG1-CG 4.5Å; V87-L91 WeakPolarHBondContact O-CB 3.45Å; V87-L91 WeakPolarHBondContact O-CG 3.15Å; V87-L91 PolarHBondContact O-N 3.42Å; E88-L91 PolarHBondContact O-N 3.14Å; L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 3.01Å; L91-V94 PolarHBondContact O-N 3.22Å; L91-C95 WeakPolarHBondContact O-CB 3.44Å; L91-C95 PolarHBondContact O-N 3.18Å; L91-C95 PolarHBondContact O-SG 3.01Å; L91-F133 HydrophobicContact CB-CD1 4.38Å; L91-F133 HydrophobicContact CB-CE1 3.66Å; L91-F133 HydrophobicContact CB-CE2 4.47Å; L91-F133 HydrophobicContact CB-CZ 3.7Å; L91-F133 HydrophobicContact CD1-CD1 4.06Å; L91-F133 HydrophobicContact CD1-CE1 4.14Å; L91-F133 HydrophobicContact CG-CE1 4.44Å
92R95.1Very high94.7Very high50 Ų5045.8 Ų45.819%0.18924%0.239CC..Hα-helixtrans-61.2-42.9178.4-173.2-179.3-70.9100.7-1.2111.2E88 D89 C95 N96 L130 F133 E138E88-R92 VanDerWaalsContact O-CB 3.26Å; E88-R92 WeakPolarHBondContact O-CB 3.49Å; E88-R92 PolarHBondContact O-N 2.83Å; D89-R92 PolarHBondContact O-N 3.03Å; D89-R92 IonicContact OD1-NH1 3.84Å; D89-R92 PolarHBondContact OD1-NH1 3.46Å; R92-C95 PolarHBondContact O-N 3.13Å; R92-N96 WeakPolarHBondContact O-CB 3.46Å; R92-N96 VanDerWaalsContact O-CG 3.3Å; R92-N96 PolarHBondContact O-N 2.82Å; R92-N96 PolarHBondContact O-ND2 3.31Å; R92-L130 HydrophobicContact CB-CD2 4.39Å; R92-L130 HydrophobicContact CG-CD2 4.11Å; R92-F133 HydrophobicContact CB-CE2 4.11Å; R92-F133 HydrophobicContact CB-CZ 4.14Å; R92-E138 IonicContact CZ-OE1 3.76Å; R92-E138 IonicContact CZ-OE2 3.11Å; R92-E138 IonicContact NE-OE1 2.69Å; R92-E138 PolarHBondContact NE-OE1 3.35Å; R92-E138 IonicContact NE-OE2 3.57Å; R92-E138 IonicContact NH2-OE1 3.2Å; R92-E138 PolarHBondContact NH2-OE1 3.41Å; R92-E138 IonicContact NH2-OE2 3.51Å; R92-E138 PolarHBondContact NH2-OE2 2.88Å; R92-E138 VanDerWaalsContact NH2-OE2 3.13Å
93A95.2Very high94.6Very high59 Ų5945.9 Ų45.949%0.48824%0.235SC..Hα-helixtrans-60.2-49.5176.600000111.8D89 E90 L91 C95 N96 E97D89-A93 WeakPolarHBondContact O-CB 3.1Å; D89-A93 PolarHBondContact O-N 3.43Å; E90-A93 PolarHBondContact O-N 3.33Å; L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 3.01Å; A93-C95 PolarHBondContact O-N 3.13Å; A93-N96 PolarHBondContact O-N 3.29Å; A93-E97 VanDerWaalsContact O-CB 3.28Å; A93-E97 WeakPolarHBondContact O-CB 3.35Å; A93-E97 PolarHBondContact O-N 3.16Å
94V94.3Very high94.5Very high17 Ų1744.7 Ų44.710%0.10324%0.236CC..Hα-helixtrans-62.5-44.5179.2175.40000111.4F49 T52 I53 E90 L91 E97 V98F49-V94 HydrophobicContact CD1-CG1 4.39Å; T52-V94 HydrophobicContact CG2-CG1 4.36Å; T52-V94 HydrophobicContact CG2-CG2 4.43Å; I53-V94 HydrophobicContact CB-CG1 4.49Å; I53-V94 HydrophobicContact CD1-CB 3.89Å; I53-V94 HydrophobicContact CD1-CG1 3.7Å; E90-V94 WeakPolarHBondContact O-CG2 3.32Å; E90-V94 PolarHBondContact O-N 3.05Å; L91-V94 PolarHBondContact O-N 3.22Å; V94-E97 PolarHBondContact O-N 3.16Å; V94-V98 WeakPolarHBondContact O-CG1 3.28Å; V94-V98 PolarHBondContact O-N 2.8Å; V94-V98 VanDerWaalsContact O-N 3.08Å
95C94.2Very high94.4Very high0 Ų045.3 Ų45.30%024%0.24CC..Hα-helixtrans-62.2-48.3177.6-71.90000112.2L91 R92 A93 E97 V98 L99 Y126 L130L91-C95 WeakPolarHBondContact O-CB 3.44Å; L91-C95 PolarHBondContact O-N 3.18Å; L91-C95 PolarHBondContact O-SG 3.01Å; R92-C95 PolarHBondContact O-N 3.13Å; A93-C95 PolarHBondContact O-N 3.13Å; C95-E97 VanDerWaalsContact C-N 3.29Å; C95-E97 PolarHBondContact O-N 3.36Å; C95-V98 VanDerWaalsContact O-CG1 3.28Å; C95-V98 WeakPolarHBondContact O-CG1 3.45Å; C95-V98 PolarHBondContact O-N 3.37Å; C95-L99 VanDerWaalsContact O-CB 3.29Å; C95-L99 WeakPolarHBondContact O-CB 3.38Å; C95-L99 WeakPolarHBondContact O-CD1 3.33Å; C95-L99 WeakPolarHBondContact O-CG 3.47Å; C95-L99 PolarHBondContact O-N 2.88Å; C95-Y126 HydrophobicContact CB-CD1 4.31Å; C95-L130 HydrophobicContact CB-CD1 3.96Å; C95-L130 HydrophobicContact CB-CD2 3.48Å; C95-L130 VanDerWaalsContact CB-CD2 3.48Å; C95-L130 HydrophobicContact CB-CG 3.5Å; C95-L130 VanDerWaalsContact CB-CG 3.5Å
96N94.9Very high94.3Very high84 Ų8439.8 Ų39.845%0.44922%0.216SC..Hα-helixtrans-64.5-37.4179.9-74.1-23.1000111.8R92 A93 S100R92-N96 WeakPolarHBondContact O-CB 3.46Å; R92-N96 VanDerWaalsContact O-CG 3.3Å; R92-N96 PolarHBondContact O-N 2.82Å; R92-N96 PolarHBondContact O-ND2 3.31Å; A93-N96 PolarHBondContact O-N 3.29Å; N96-S100 WeakPolarHBondContact O-CB 3.36Å; N96-S100 PolarHBondContact O-N 3.11Å; N96-S100 PolarHBondContact O-OG 3.48Å
97E94.8Very high93.9Very high59 Ų5935.7 Ų35.728%0.27620%0.2SC..Hα-helixtrans-64.1-50.6178.3-173.6173-15600111.8K28 A93 V94 C95 L99 S100 I101K28-E97 WeakPolarHBondContact CE-OE1 3.45Å; K28-E97 WeakPolarHBondContact CE-OE2 3.36Å; K28-E97 IonicContact NZ-OE1 2.81Å; K28-E97 PolarHBondContact NZ-OE1 2.93Å; K28-E97 IonicContact NZ-OE2 3.54Å; K28-E97 PolarHBondContact NZ-OE2 3.46Å; A93-E97 VanDerWaalsContact O-CB 3.28Å; A93-E97 WeakPolarHBondContact O-CB 3.35Å; A93-E97 PolarHBondContact O-N 3.16Å; V94-E97 PolarHBondContact O-N 3.16Å; C95-E97 VanDerWaalsContact C-N 3.29Å; C95-E97 PolarHBondContact O-N 3.36Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.02Å; E97-S100 PolarHBondContact O-N 3.45Å; E97-S100 PolarHBondContact O-OG 3.41Å; E97-I101 HydrophobicContact CG-CD1 3.99Å; E97-I101 WeakPolarHBondContact O-CG1 3.19Å; E97-I101 PolarHBondContact O-N 2.98Å
98V94.9Very high93.6Very high0 Ų039.5 Ų39.50%022%0.224CC..Hα-helixtrans-66.4-36.8179.371.30000112.1F45 F49 V94 C95 S100 I101 I102 M122 Y126F45-V98 HydrophobicContact CE1-CG2 3.95Å; F45-V98 HydrophobicContact CZ-CG2 4.03Å; F49-V98 HydrophobicContact CB-CG2 4.49Å; F49-V98 HydrophobicContact CD1-CB 3.81Å; F49-V98 HydrophobicContact CD1-CG2 3.84Å; F49-V98 HydrophobicContact CD2-CG2 4.01Å; F49-V98 HydrophobicContact CE1-CB 3.7Å; F49-V98 HydrophobicContact CE1-CG2 3.92Å; F49-V98 HydrophobicContact CE2-CG2 4.11Å; F49-V98 HydrophobicContact CG-CB 4.37Å; F49-V98 HydrophobicContact CG-CG2 3.88Å; F49-V98 HydrophobicContact CZ-CB 4.18Å; F49-V98 HydrophobicContact CZ-CG2 4.05Å; V94-V98 WeakPolarHBondContact O-CG1 3.28Å; V94-V98 PolarHBondContact O-N 2.8Å; V94-V98 VanDerWaalsContact O-N 3.08Å; C95-V98 VanDerWaalsContact O-CG1 3.28Å; C95-V98 WeakPolarHBondContact O-CG1 3.45Å; C95-V98 PolarHBondContact O-N 3.37Å; V98-S100 VanDerWaalsContact C-N 3.33Å; V98-S100 PolarHBondContact O-N 3.34Å; V98-I101 PolarHBondContact O-N 3.11Å; V98-I102 HydrophobicContact CG2-CD1 3.98Å; V98-I102 HydrophobicContact CG2-CG1 4.46Å; V98-I102 WeakPolarHBondContact O-CB 3.49Å; V98-I102 VanDerWaalsContact O-CG1 3.23Å; V98-I102 WeakPolarHBondContact O-CG1 3.39Å; V98-I102 PolarHBondContact O-N 2.92Å; V98-M122 HydrophobicContact CG2-CE 3.89Å; V98-Y126 HydrophobicContact CB-CD2 4.45Å; V98-Y126 HydrophobicContact CB-CE2 4.43Å; V98-Y126 HydrophobicContact CG1-CD1 3.32Å; V98-Y126 HydrophobicContact CG1-CD2 3.39Å; V98-Y126 HydrophobicContact CG1-CE1 3.58Å; V98-Y126 HydrophobicContact CG1-CE2 3.69Å; V98-Y126 HydrophobicContact CG1-CG 3.27Å; V98-Y126 HydrophobicContact CG2-CD2 4.18Å; V98-Y126 HydrophobicContact CG2-CE2 3.92Å
99L94.7Very high93.2Very high11 Ų1140.6 Ų40.66%0.05823%0.231CC..Hα-helixtrans-61.7-42174.1-73.1169.8000111.3C95 E97 I102 A103 K123 Y127 L130C95-L99 VanDerWaalsContact O-CB 3.29Å; C95-L99 WeakPolarHBondContact O-CB 3.38Å; C95-L99 WeakPolarHBondContact O-CD1 3.33Å; C95-L99 WeakPolarHBondContact O-CG 3.47Å; C95-L99 PolarHBondContact O-N 2.88Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.02Å; L99-I102 PolarHBondContact O-N 3.3Å; L99-A103 WeakPolarHBondContact O-CB 3.08Å; L99-A103 PolarHBondContact O-N 3.05Å; L99-K123 HydrophobicContact CD2-CB 4.28Å; L99-K123 HydrophobicContact CD2-CG 3.73Å; L99-Y127 HydrophobicContact CD1-CD1 3.81Å; L99-Y127 HydrophobicContact CD1-CD2 4.48Å; L99-Y127 HydrophobicContact CD1-CE1 3.56Å; L99-Y127 HydrophobicContact CD1-CE2 4.26Å; L99-Y127 HydrophobicContact CD1-CG 4.25Å; L99-Y127 HydrophobicContact CD2-CD2 3.8Å; L99-Y127 HydrophobicContact CD2-CE1 4.4Å; L99-Y127 HydrophobicContact CD2-CE2 3.58Å; L99-Y127 HydrophobicContact CD2-CG 4.27Å; L99-L130 HydrophobicContact CD1-CD1 3.57Å
100S95Very high92.7Very high51 Ų5137.5 Ų37.536%0.35722%0.216SC..Hα-helixtrans-64.9-42.6176.675.60000112N96 E97 V98 A103 I104N96-S100 WeakPolarHBondContact O-CB 3.36Å; N96-S100 PolarHBondContact O-N 3.11Å; N96-S100 PolarHBondContact O-OG 3.48Å; E97-S100 PolarHBondContact O-N 3.45Å; E97-S100 PolarHBondContact O-OG 3.41Å; V98-S100 VanDerWaalsContact C-N 3.33Å; V98-S100 PolarHBondContact O-N 3.34Å; S100-A103 PolarHBondContact O-N 3.1Å; S100-I104 WeakPolarHBondContact O-CB 3.44Å; S100-I104 VanDerWaalsContact O-CG1 3.26Å; S100-I104 WeakPolarHBondContact O-CG1 3.41Å; S100-I104 PolarHBondContact O-N 3.08Å
101I94.7Very high92Very high2 Ų240.2 Ų40.21%0.0123%0.233CC..Hα-helixtrans-64-45.1178-68.3161.5000110.4K28 A31 F45 F49 E97 V98 A103 I104 H105 C106K28-I101 HydrophobicContact CB-CD1 4.4Å; K28-I101 HydrophobicContact CD-CD1 4.41Å; K28-I101 HydrophobicContact CG-CD1 3.66Å; A31-I101 HydrophobicContact CB-CG2 3.46Å; A31-I101 VanDerWaalsContact CB-CG2 3.46Å; F45-I101 HydrophobicContact CE2-CG2 3.99Å; F45-I101 HydrophobicContact CZ-CG2 3.89Å; F49-I101 HydrophobicContact CZ-CD1 4.02Å; E97-I101 HydrophobicContact CG-CD1 3.99Å; E97-I101 WeakPolarHBondContact O-CG1 3.19Å; E97-I101 PolarHBondContact O-N 2.98Å; V98-I101 PolarHBondContact O-N 3.11Å; I101-A103 VanDerWaalsContact C-N 3.33Å; I101-A103 PolarHBondContact O-N 3.18Å; I101-I104 PolarHBondContact O-N 3.37Å; I101-H105 WeakPolarHBondContact O-CA 3.35Å; I101-H105 WeakPolarHBondContact O-CB 3.38Å; I101-H105 PolarHBondContact O-N 2.63Å; I101-C106 PolarHBondContact O-N 2.91Å
102I93.6Very high91.2Very high0 Ų041.9 Ų41.90%025%0.245CC..Iπ-helixtrans-60.3-45.8177.8-72.1166.2000110.7F45 V98 L99 C106 L107 F119 M122 K123F45-I102 HydrophobicContact CE1-CG1 4.36Å; V98-I102 HydrophobicContact CG2-CD1 3.98Å; V98-I102 HydrophobicContact CG2-CG1 4.46Å; V98-I102 WeakPolarHBondContact O-CB 3.49Å; V98-I102 VanDerWaalsContact O-CG1 3.23Å; V98-I102 WeakPolarHBondContact O-CG1 3.39Å; V98-I102 PolarHBondContact O-N 2.92Å; L99-I102 PolarHBondContact O-N 3.3Å; I102-C106 PolarHBondContact O-N 3.35Å; I102-L107 HydrophobicContact CG2-CD1 3.75Å; I102-L107 HydrophobicContact CG2-CG 3.86Å; I102-L107 WeakPolarHBondContact O-CB 3.38Å; I102-L107 PolarHBondContact O-N 3.13Å; I102-F119 HydrophobicContact CG1-CD1 4.2Å; I102-F119 HydrophobicContact CG2-CB 4Å; I102-M122 HydrophobicContact CD1-CB 3.82Å; I102-M122 HydrophobicContact CD1-CG 3.71Å; I102-M122 HydrophobicContact CD1-SD 4.12Å; I102-K123 HydrophobicContact CG2-CB 4.42Å
103A91.2Very high90.2Very high49 Ų4939.8 Ų39.841%0.40524%0.239SC..Iπ-helixtrans-70.4-37.2-177.300000113.5L99 S100 I101 P108L99-A103 WeakPolarHBondContact O-CB 3.08Å; L99-A103 PolarHBondContact O-N 3.05Å; S100-A103 PolarHBondContact O-N 3.1Å; I101-A103 VanDerWaalsContact C-N 3.33Å; I101-A103 PolarHBondContact O-N 3.18Å; A103-P108 WeakPolarHBondContact O-CD 3.47Å; A103-P108 WeakPolarHBondContact O-CG 3.47Å
104I92.4Very high89.4Confident107 Ų10742.9 Ų42.955%0.54924%0.243SC..Iπ-helixtrans-91.3-42.4-173.2-62.7168.9000111.8S100 I101 P108S100-I104 WeakPolarHBondContact O-CB 3.44Å; S100-I104 VanDerWaalsContact O-CG1 3.26Å; S100-I104 WeakPolarHBondContact O-CG1 3.41Å; S100-I104 PolarHBondContact O-N 3.08Å; I101-I104 PolarHBondContact O-N 3.37Å; I104-P108 WeakPolarHBondContact O-CG 3.4Å
105H91.6Very high88.9Confident38 Ų3842.3 Ų42.318%0.17624%0.24CC..Iπ-helixtrans-113.5-27.8-166.8-62.5-69.3000114A31 D34 I101 L109A31-H105 HydrophobicContact CB-CB 4.46Å; A31-H105 WeakPolarHBondContact O-CB 3.33Å; D34-H105 IonicContact OD1-CE1 3.68Å; D34-H105 IonicContact OD1-CG 3.45Å; D34-H105 IonicContact OD1-ND1 3.57Å; D34-H105 PolarHBondContact OD1-ND1 3.44Å; I101-H105 WeakPolarHBondContact O-CA 3.35Å; I101-H105 WeakPolarHBondContact O-CB 3.38Å; I101-H105 PolarHBondContact O-N 2.63Å; H105-L109 VanDerWaalsContact O-CD1 3.29Å; H105-L109 WeakPolarHBondContact O-CD1 3.25Å
106C90.8Very high88.4Confident5 Ų544.1 Ų44.13%0.03425%0.251CS..Iπ-helixtrans-95.7-58-175-55.60000112.9I101 I102 L109 A110 F119I101-C106 PolarHBondContact O-N 2.91Å; I102-C106 PolarHBondContact O-N 3.35Å; C106-L109 PolarHBondContact O-N 3.35Å; C106-A110 PolarHBondContact O-N 2.97Å; C106-A110 VanDerWaalsContact O-N 3.16Å; C106-F119 HydrophobicContact CB-CD1 3.73Å; C106-F119 HydrophobicContact CB-CD2 3.72Å; C106-F119 HydrophobicContact CB-CE1 3.65Å; C106-F119 HydrophobicContact CB-CE2 3.66Å; C106-F119 HydrophobicContact CB-CG 3.79Å; C106-F119 HydrophobicContact CB-CZ 3.63Å
107L87.6Confident87.5Confident29 Ų2940.5 Ų40.515%0.15223%0.232CC..G310 helixtrans-61.8-41.9-175.9-77.1170.9000113.4I102 L109 A110 F119 Y120 K123I102-L107 HydrophobicContact CG2-CD1 3.75Å; I102-L107 HydrophobicContact CG2-CG 3.86Å; I102-L107 WeakPolarHBondContact O-CB 3.38Å; I102-L107 PolarHBondContact O-N 3.13Å; L107-L109 PolarHBondContact O-N 2.74Å; L107-A110 PolarHBondContact O-N 3.32Å; L107-F119 HydrophobicContact CD2-CB 3.65Å; L107-F119 HydrophobicContact CG-CB 4Å; L107-Y120 HydrophobicContact CD1-CD1 4.46Å; L107-Y120 HydrophobicContact CD1-CE1 4.07Å; L107-Y120 HydrophobicContact CD2-CD2 3.9Å; L107-Y120 HydrophobicContact CD2-CE2 3.77Å; L107-Y120 HydrophobicContact CD2-CG 4.33Å; L107-K123 HydrophobicContact CD1-CD 4.46Å
108P88.8Confident87Confident85 Ų8539.7 Ų39.755%0.55223%0.227SC*.G310 helixtrans-64.9-18.3179-25.437.8000114.6A103 I104A103-P108 WeakPolarHBondContact O-CD 3.47Å; A103-P108 WeakPolarHBondContact O-CG 3.47Å; I104-P108 WeakPolarHBondContact O-CG 3.4Å
109L88.2Confident86.8Confident52 Ų5239.8 Ų39.827%0.27223%0.228SC..G310 helixtrans-111.2-1.1-175-58.1-179.7000113.3D34 D36 H105 C106 L107 N111D34-L109 HydrophobicContact CB-CD1 3.62Å; D34-L109 WeakPolarHBondContact O-CD1 3.4Å; D36-L109 WeakPolarHBondContact CB-O 3.42Å; H105-L109 VanDerWaalsContact O-CD1 3.29Å; H105-L109 WeakPolarHBondContact O-CD1 3.25Å; C106-L109 PolarHBondContact O-N 3.35Å; L107-L109 PolarHBondContact O-N 2.74Å; L109-N111 PolarHBondContact O-N 3.08Å; L109-N111 VanDerWaalsContact O-N 3.1Å; L109-N111 PolarHBondContact O-ND2 3.16Å
110A85.3Confident86.4Confident15 Ų1542.4 Ų42.412%0.12424%0.237CC..  trans-72.1100.9-179.600000110.2C106 L107 N115 V116C106-A110 PolarHBondContact O-N 2.97Å; C106-A110 VanDerWaalsContact O-N 3.16Å; L107-A110 PolarHBondContact O-N 3.32Å; A110-N115 HydrophobicContact CB-CB 3.67Å; A110-V116 HydrophobicContact CB-CG2 3.67Å
111N80.2Confident85.7Confident131 Ų13144 Ų4470%0.70124%0.238SC*.  trans-91.3-13.2-178.6-56.4-51.4000112.9D36 L109D36-N111 WeakPolarHBondContact OD2-CB 3.14Å; D36-N111 PolarHBondContact OD2-N 2.95Å; D36-N111 VanDerWaalsContact OD2-N 3.13Å; D36-N111 PolarHBondContact OD2-ND2 2.77Å; L109-N111 PolarHBondContact O-N 3.08Å; L109-N111 VanDerWaalsContact O-N 3.1Å; L109-N111 PolarHBondContact O-ND2 3.16Å
112S77.1Confident85.5Confident36 Ų3644.4 Ų44.425%0.25224%0.239SC..SBendtrans-104.4143.6175.171.40000110.9E114 N115 V116S112-E114 PolarHBondContact O-N 3.22Å; S112-N115 PolarHBondContact O-N 3.24Å; S112-N115 WeakPolarHBondContact OG-CB 3.42Å; S112-N115 VanDerWaalsContact OG-CG 3.25Å; S112-N115 PolarHBondContact OG-N 3.09Å; S112-N115 PolarHBondContact OG-ND2 2.97Å; S112-N115 VanDerWaalsContact OG-ND2 3.14Å; S112-V116 WeakPolarHBondContact O-CG2 3.46Å; S112-V116 PolarHBondContact O-N 2.87Å
113G75.3Confident85.3Confident6 Ų646.4 Ų46.46%0.06225%0.248CC..Hα-helixtrans-47.9-44.816900000114.7N115 V116 V117G113-N115 VanDerWaalsContact C-N 3.31Å; G113-N115 PolarHBondContact O-N 3.43Å; G113-V116 PolarHBondContact O-N 3.46Å; G113-V117 WeakPolarHBondContact O-CB 3.37Å; G113-V117 WeakPolarHBondContact O-CG2 3.44Å; G113-V117 PolarHBondContact O-N 3.24Å
114E78.4Confident84.7Confident124 Ų12444.1 Ų44.158%0.57923%0.229SC*.Hα-helixtrans-59.8-41178.4-60.4-173.2172.700112.5R42 S112 F118R42-E114 IonicContact CZ-OE2 3.9Å; R42-E114 IonicContact NH1-OE2 3.63Å; R42-E114 IonicContact NH2-OE2 3.12Å; R42-E114 PolarHBondContact NH2-OE2 3.45Å; R42-E114 VanDerWaalsContact NH2-OE2 3.12Å; S112-E114 PolarHBondContact O-N 3.22Å; E114-F118 WeakPolarHBondContact O-CB 3.46Å; E114-F118 PolarHBondContact O-N 3.39Å
115N84.3Confident84.3Confident5 Ų540.1 Ų40.13%0.02721%0.209CC..Hα-helixtrans-66.2-47.1176.8-78.1-24.9000110.9D36 M37 R42 A110 S112 G113 V117 F118 F119D36-N115 PolarHBondContact OD1-ND2 2.89Å; M37-N115 PolarHBondContact O-ND2 3.36Å; M37-N115 PolarHBondContact O-OD1 3.35Å; R42-N115 WeakPolarHBondContact CD-OD1 3.43Å; R42-N115 PolarHBondContact NH1-OD1 2.68Å; A110-N115 HydrophobicContact CB-CB 3.67Å; S112-N115 PolarHBondContact O-N 3.24Å; S112-N115 WeakPolarHBondContact OG-CB 3.42Å; S112-N115 VanDerWaalsContact OG-CG 3.25Å; S112-N115 PolarHBondContact OG-N 3.09Å; S112-N115 PolarHBondContact OG-ND2 2.97Å; S112-N115 VanDerWaalsContact OG-ND2 3.14Å; G113-N115 VanDerWaalsContact C-N 3.31Å; G113-N115 PolarHBondContact O-N 3.43Å; N115-V117 PolarHBondContact O-N 3.4Å; N115-F118 PolarHBondContact O-N 2.91Å; N115-F119 HydrophobicContact CB-CD2 4.39Å; N115-F119 HydrophobicContact CB-CE2 4.22Å; N115-F119 WeakPolarHBondContact O-CD2 3.37Å; N115-F119 PolarHBondContact O-N 3.28Å
116V82.3Confident84.2Confident38 Ų3838.6 Ų38.623%0.2320%0.202CC..Hα-helixtrans-57.7-52.4178.9-179.80000110.1A110 S112 G113 F119 Y120 A156A110-V116 HydrophobicContact CB-CG2 3.67Å; S112-V116 WeakPolarHBondContact O-CG2 3.46Å; S112-V116 PolarHBondContact O-N 2.87Å; G113-V116 PolarHBondContact O-N 3.46Å; V116-F119 PolarHBondContact O-N 3.18Å; V116-Y120 HydrophobicContact CG1-CD2 3.71Å; V116-Y120 HydrophobicContact CG1-CE2 3.61Å; V116-Y120 WeakPolarHBondContact O-CD2 3.23Å; V116-Y120 PolarHBondContact O-N 2.87Å; V116-Y120 VanDerWaalsContact O-N 3.08Å; V116-A156 HydrophobicContact CG1-CB 3.67Å
117V76.8Confident84Confident8 Ų840.6 Ų40.65%0.04821%0.209CC..Hα-helixtrans-54.4-61177.11720000109.2G113 N115 F119 Y120 K121 W153 A156 Q157G113-V117 WeakPolarHBondContact O-CB 3.37Å; G113-V117 WeakPolarHBondContact O-CG2 3.44Å; G113-V117 PolarHBondContact O-N 3.24Å; N115-V117 PolarHBondContact O-N 3.4Å; V117-F119 VanDerWaalsContact C-N 3.29Å; V117-F119 PolarHBondContact O-N 2.88Å; V117-F119 VanDerWaalsContact O-N 3.15Å; V117-Y120 WeakPolarHBondContact O-CA 3.5Å; V117-Y120 WeakPolarHBondContact O-CB 3.46Å; V117-Y120 PolarHBondContact O-N 3.38Å; V117-K121 PolarHBondContact O-N 3.16Å; V117-W153 HydrophobicContact CB-CZ3 4.39Å; V117-W153 HydrophobicContact CG1-CD2 3.88Å; V117-W153 HydrophobicContact CG1-CE3 3.7Å; V117-W153 HydrophobicContact CG1-CH2 3.48Å; V117-W153 VanDerWaalsContact CG1-CH2 3.48Å; V117-W153 HydrophobicContact CG1-CZ2 3.71Å; V117-W153 HydrophobicContact CG1-CZ3 3.41Å; V117-W153 VanDerWaalsContact CG1-CZ3 3.41Å; V117-W153 WeakPolarHBondContact O-CZ3 3.49Å; V117-A156 HydrophobicContact CG2-CB 4.13Å; V117-Q157 HydrophobicContact CG1-CB 4.28Å; V117-Q157 HydrophobicContact CG1-CG 4.21Å; V117-Q157 HydrophobicContact CG2-CB 3.48Å; V117-Q157 VanDerWaalsContact CG2-CB 3.48Å; V117-Q157 HydrophobicContact CG2-CG 3.82Å; V117-Q157 VanDerWaalsContact CG2-N 3.34Å
118F84.5Confident83.9Confident42 Ų4242.9 Ų42.918%0.18422%0.216CC..Hα-helixtrans-49-47.7-176.4-179.3-86.1000113.5R42 S46 E114 N115 K121 M122R42-F118 HydrophobicContact CB-CE1 4.45Å; R42-F118 VanDerWaalsContact CD-CD1 3.48Å; R42-F118 HydrophobicContact CG-CB 4.38Å; R42-F118 HydrophobicContact CG-CD1 3.24Å; R42-F118 HydrophobicContact CG-CD2 3.78Å; R42-F118 HydrophobicContact CG-CE1 3.17Å; R42-F118 HydrophobicContact CG-CE2 3.7Å; R42-F118 HydrophobicContact CG-CG 3.54Å; R42-F118 HydrophobicContact CG-CZ 3.37Å; R42-F118 VanDerWaalsContact O-CZ 3.28Å; R42-F118 WeakPolarHBondContact O-CZ 3.5Å; S46-F118 VanDerWaalsContact CB-CZ 3.48Å; E114-F118 WeakPolarHBondContact O-CB 3.46Å; E114-F118 PolarHBondContact O-N 3.39Å; N115-F118 PolarHBondContact O-N 2.91Å; F118-K121 VanDerWaalsContact O-CB 3.31Å; F118-K121 WeakPolarHBondContact O-CB 3.43Å; F118-K121 PolarHBondContact O-N 3.43Å; F118-K121 VanDerWaalsContact O-N 3.17Å; F118-M122 HydrophobicContact CE1-SD 4.03Å; F118-M122 PolarHBondContact O-N 3.38Å; F118-M122 VanDerWaalsContact O-N 3.11Å
119F89.5Confident83.8Confident2 Ų239.9 Ų39.91%0.00919%0.193CC..Hα-helixtrans-71-32-178.6-71.9-54000112.7M37 F45 I102 C106 L107 N115 V116 V117 M122 K123M37-F119 HydrophobicContact CB-CZ 4.41Å; M37-F119 HydrophobicContact CE-CZ 4.4Å; M37-F119 HydrophobicContact CG-CZ 4.28Å; M37-F119 HydrophobicContact SD-CE1 4.31Å; M37-F119 HydrophobicContact SD-CZ 3.76Å; F45-F119 HydrophobicContact CD1-CE1 4.4Å; I102-F119 HydrophobicContact CG1-CD1 4.2Å; I102-F119 HydrophobicContact CG2-CB 4Å; C106-F119 HydrophobicContact CB-CD1 3.73Å; C106-F119 HydrophobicContact CB-CD2 3.72Å; C106-F119 HydrophobicContact CB-CE1 3.65Å; C106-F119 HydrophobicContact CB-CE2 3.66Å; C106-F119 HydrophobicContact CB-CG 3.79Å; C106-F119 HydrophobicContact CB-CZ 3.63Å; L107-F119 HydrophobicContact CD2-CB 3.65Å; L107-F119 HydrophobicContact CG-CB 4Å; N115-F119 HydrophobicContact CB-CD2 4.39Å; N115-F119 HydrophobicContact CB-CE2 4.22Å; N115-F119 WeakPolarHBondContact O-CD2 3.37Å; N115-F119 PolarHBondContact O-N 3.28Å; V116-F119 PolarHBondContact O-N 3.18Å; V117-F119 VanDerWaalsContact C-N 3.29Å; V117-F119 PolarHBondContact O-N 2.88Å; V117-F119 VanDerWaalsContact O-N 3.15Å; F119-M122 PolarHBondContact O-N 3.11Å; F119-K123 WeakPolarHBondContact O-CB 3.03Å; F119-K123 PolarHBondContact O-N 2.74Å
120Y85.9Confident83.7Confident65 Ų6537.8 Ų37.826%0.25518%0.182SC..Hα-helixtrans-65.5-34.7168.4-81-64.1000112.7L107 V116 V117 M122 K123 G124 A152 A156L107-Y120 HydrophobicContact CD1-CD1 4.46Å; L107-Y120 HydrophobicContact CD1-CE1 4.07Å; L107-Y120 HydrophobicContact CD2-CD2 3.9Å; L107-Y120 HydrophobicContact CD2-CE2 3.77Å; L107-Y120 HydrophobicContact CD2-CG 4.33Å; V116-Y120 HydrophobicContact CG1-CD2 3.71Å; V116-Y120 HydrophobicContact CG1-CE2 3.61Å; V116-Y120 WeakPolarHBondContact O-CD2 3.23Å; V116-Y120 PolarHBondContact O-N 2.87Å; V116-Y120 VanDerWaalsContact O-N 3.08Å; V117-Y120 WeakPolarHBondContact O-CA 3.5Å; V117-Y120 WeakPolarHBondContact O-CB 3.46Å; V117-Y120 PolarHBondContact O-N 3.38Å; Y120-M122 PolarHBondContact O-N 3.42Å; Y120-K123 HydrophobicContact CD1-CD 4.39Å; Y120-K123 PolarHBondContact O-N 3.49Å; Y120-G124 PolarHBondContact O-N 3.11Å; Y120-A152 HydrophobicContact CD1-CB 3.68Å; Y120-A152 HydrophobicContact CD2-CB 4.28Å; Y120-A152 HydrophobicContact CE1-CB 3.74Å; Y120-A152 HydrophobicContact CE2-CB 4.33Å; Y120-A152 HydrophobicContact CG-CB 3.99Å; Y120-A156 HydrophobicContact CD2-CB 4.22Å
121K81.8Confident83.6Confident86 Ų8637.6 Ų37.637%0.37418%0.181SC..Hα-helixtrans-55.9-51.9171.9-135.4-178.9152.5-79.60108.1V117 F118 K123 G124 D125 W153V117-K121 PolarHBondContact O-N 3.16Å; F118-K121 VanDerWaalsContact O-CB 3.31Å; F118-K121 WeakPolarHBondContact O-CB 3.43Å; F118-K121 PolarHBondContact O-N 3.43Å; F118-K121 VanDerWaalsContact O-N 3.17Å; K121-K123 VanDerWaalsContact C-N 3.27Å; K121-K123 PolarHBondContact O-N 3.22Å; K121-G124 CarbonylContact O-C 3.55Å; K121-G124 WeakPolarHBondContact O-CA 3.36Å; K121-G124 PolarHBondContact O-N 2.98Å; K121-G124 VanDerWaalsContact O-N 3.09Å; K121-D125 IonicContact NZ-OD1 3.13Å; K121-D125 IonicContact NZ-OD2 3.4Å; K121-D125 PolarHBondContact NZ-OD2 2.91Å; K121-D125 WeakPolarHBondContact O-CB 3.29Å; K121-D125 PolarHBondContact O-N 3.28Å; K121-W153 HydrophobicContact CB-CD2 4.45Å; K121-W153 HydrophobicContact CB-CE3 3.42Å; K121-W153 VanDerWaalsContact CB-CE3 3.42Å; K121-W153 HydrophobicContact CB-CH2 3.49Å; K121-W153 VanDerWaalsContact CB-CH2 3.49Å; K121-W153 HydrophobicContact CB-CZ2 4.48Å; K121-W153 HydrophobicContact CB-CZ3 2.89Å; K121-W153 HydrophobicContact CD-CH2 3.28Å; K121-W153 HydrophobicContact CD-CZ2 3.92Å; K121-W153 HydrophobicContact CD-CZ3 3.7Å; K121-W153 HydrophobicContact CG-CD2 4.21Å; K121-W153 HydrophobicContact CG-CE3 3.61Å; K121-W153 HydrophobicContact CG-CH2 3.24Å; K121-W153 HydrophobicContact CG-CZ2 3.85Å; K121-W153 HydrophobicContact CG-CZ3 3.14Å; K121-W153 VanDerWaalsContact N-CZ3 3.29Å
122M89.3Confident83.8Confident9 Ų934.2 Ų34.24%0.04416%0.161CC..Hα-helixtrans-67.2-42.7-165.4-164.5167.5-179.500107.5F45 F49 V98 I102 F118 F119 Y120 G124 D125 Y126F45-M122 HydrophobicContact CD1-CE 3.5Å; F45-M122 VanDerWaalsContact CD1-CE 3.5Å; F45-M122 HydrophobicContact CD1-SD 3.58Å; F45-M122 VanDerWaalsContact CD1-SD 3.58Å; F45-M122 HydrophobicContact CE1-CE 3.42Å; F45-M122 VanDerWaalsContact CE1-CE 3.42Å; F45-M122 HydrophobicContact CE1-SD 3.56Å; F45-M122 VanDerWaalsContact CE1-SD 3.56Å; F49-M122 HydrophobicContact CB-CE 3.93Å; F49-M122 HydrophobicContact CD2-CE 4.24Å; F49-M122 HydrophobicContact CG-CE 4.35Å; V98-M122 HydrophobicContact CG2-CE 3.89Å; I102-M122 HydrophobicContact CD1-CB 3.82Å; I102-M122 HydrophobicContact CD1-CG 3.71Å; I102-M122 HydrophobicContact CD1-SD 4.12Å; F118-M122 HydrophobicContact CE1-SD 4.03Å; F118-M122 PolarHBondContact O-N 3.38Å; F118-M122 VanDerWaalsContact O-N 3.11Å; F119-M122 PolarHBondContact O-N 3.11Å; Y120-M122 PolarHBondContact O-N 3.42Å; M122-G124 PolarHBondContact O-N 3.42Å; M122-D125 PolarHBondContact O-N 2.99Å; M122-Y126 HydrophobicContact CE-CE2 3.58Å; M122-Y126 HydrophobicContact CG-CD2 3.82Å; M122-Y126 HydrophobicContact CG-CE2 3.54Å; M122-Y126 WeakPolarHBondContact O-CD2 3.46Å; M122-Y126 PolarHBondContact O-N 2.9Å; M122-Y126 HydrophobicContact SD-CE2 4.43Å
123K89.6Confident84.2Confident43 Ų4333 Ų3319%0.18715%0.151CC..Hα-helixtrans-53.5-49.6169.8-170.4176.1176.9-179.70112.1L99 I102 L107 F119 Y120 K121 Y126 Y127 A149L99-K123 HydrophobicContact CD2-CB 4.28Å; L99-K123 HydrophobicContact CD2-CG 3.73Å; I102-K123 HydrophobicContact CG2-CB 4.42Å; L107-K123 HydrophobicContact CD1-CD 4.46Å; F119-K123 WeakPolarHBondContact O-CB 3.03Å; F119-K123 PolarHBondContact O-N 2.74Å; Y120-K123 HydrophobicContact CD1-CD 4.39Å; Y120-K123 PolarHBondContact O-N 3.49Å; K121-K123 VanDerWaalsContact C-N 3.27Å; K121-K123 PolarHBondContact O-N 3.22Å; K123-Y126 PolarHBondContact O-N 3.16Å; K123-Y127 HydrophobicContact CD-CE2 4.2Å; K123-Y127 HydrophobicContact CG-CD2 3.85Å; K123-Y127 HydrophobicContact CG-CE2 3.56Å; K123-Y127 WeakPolarHBondContact O-CD2 3.4Å; K123-Y127 PolarHBondContact O-N 3.27Å; K123-A149 HydrophobicContact CB-CB 4.06Å; K123-A149 HydrophobicContact CD-CB 4.16Å; K123-A149 HydrophobicContact CG-CB 3.88Å
124G79.9Confident84.7Confident0 Ų033 Ų330%015%0.15CC..Hα-helixtrans-59-47.5175.400000113Y120 K121 M122 Y126 Y127 R128 S146 Y150Y120-G124 PolarHBondContact O-N 3.11Å; K121-G124 CarbonylContact O-C 3.55Å; K121-G124 WeakPolarHBondContact O-CA 3.36Å; K121-G124 PolarHBondContact O-N 2.98Å; K121-G124 VanDerWaalsContact O-N 3.09Å; M122-G124 PolarHBondContact O-N 3.42Å; G124-Y126 VanDerWaalsContact C-N 3.34Å; G124-Y126 PolarHBondContact O-N 3.33Å; G124-Y127 PolarHBondContact O-N 3.47Å; G124-R128 WeakPolarHBondContact O-CB 3.37Å; G124-R128 PolarHBondContact O-N 3.08Å; G124-S146 PolarHBondContact O-OG 2.64Å; G124-S146 VanDerWaalsContact O-OG 3.09Å; G124-Y150 VanDerWaalsContact C-CZ 3.47Å
125D83.9Confident85Confident24 Ų2432.5 Ų32.513%0.12816%0.155CC..Hα-helixtrans-59.5-42179-77-35000112K121 M122 R128 Y129 Y150K121-D125 IonicContact NZ-OD1 3.13Å; K121-D125 IonicContact NZ-OD2 3.4Å; K121-D125 PolarHBondContact NZ-OD2 2.91Å; K121-D125 WeakPolarHBondContact O-CB 3.29Å; K121-D125 PolarHBondContact O-N 3.28Å; M122-D125 PolarHBondContact O-N 2.99Å; D125-R128 WeakPolarHBondContact O-CB 3Å; D125-R128 PolarHBondContact O-N 3.36Å; D125-R128 IonicContact OD1-CZ 3.65Å; D125-R128 IonicContact OD1-NE 2.65Å; D125-R128 IonicContact OD1-NH2 2.72Å; D125-R128 PolarHBondContact OD1-NH2 3.33Å; D125-Y129 HydrophobicContact CB-CE2 4.17Å; D125-Y129 WeakPolarHBondContact O-CD1 3.4Å; D125-Y129 WeakPolarHBondContact O-CD2 3.37Å; D125-Y129 WeakPolarHBondContact O-CE2 3.4Å; D125-Y129 PolarHBondContact O-N 3.05Å; D125-Y150 WeakPolarHBondContact CA-OH 3.34Å; D125-Y150 PolarHBondContact N-OH 3.01Å; D125-Y150 PolarHBondContact OD1-OH 3.25Å
126Y89.7Confident85.1Confident6 Ų635.3 Ų35.32%0.02419%0.186CC..Hα-helixtrans-74.3-36.1179.6-79.5-74.4000113.7F49 I53 C95 V98 M122 K123 G124 R128 Y129 L130F49-Y126 VanDerWaalsContact C-OH 3.28Å; F49-Y126 WeakPolarHBondContact CB-OH 3.2Å; F49-Y126 PolarHBondContact O-OH 3.13Å; I53-Y126 HydrophobicContact CB-CE1 4.2Å; I53-Y126 HydrophobicContact CD1-CE1 4.41Å; I53-Y126 HydrophobicContact CG1-CE1 4.18Å; I53-Y126 HydrophobicContact CG2-CE1 4.12Å; C95-Y126 HydrophobicContact CB-CD1 4.31Å; V98-Y126 HydrophobicContact CB-CD2 4.45Å; V98-Y126 HydrophobicContact CB-CE2 4.43Å; V98-Y126 HydrophobicContact CG1-CD1 3.32Å; V98-Y126 HydrophobicContact CG1-CD2 3.39Å; V98-Y126 HydrophobicContact CG1-CE1 3.58Å; V98-Y126 HydrophobicContact CG1-CE2 3.69Å; V98-Y126 HydrophobicContact CG1-CG 3.27Å; V98-Y126 HydrophobicContact CG2-CD2 4.18Å; V98-Y126 HydrophobicContact CG2-CE2 3.92Å; M122-Y126 HydrophobicContact CE-CE2 3.58Å; M122-Y126 HydrophobicContact CG-CD2 3.82Å; M122-Y126 HydrophobicContact CG-CE2 3.54Å; M122-Y126 WeakPolarHBondContact O-CD2 3.46Å; M122-Y126 PolarHBondContact O-N 2.9Å; M122-Y126 HydrophobicContact SD-CE2 4.43Å; K123-Y126 PolarHBondContact O-N 3.16Å; G124-Y126 VanDerWaalsContact C-N 3.34Å; G124-Y126 PolarHBondContact O-N 3.33Å; Y126-R128 VanDerWaalsContact C-N 3.32Å; Y126-Y129 AromaticContact CD1-CD2 3.69Å; Y126-Y129 HydrophobicContact CD1-CD2 3.69Å; Y126-Y129 HydrophobicContact CD1-CE2 4.2Å; Y126-Y129 AromaticContact CE1-CD2 3.9Å; Y126-Y129 HydrophobicContact CE1-CD2 3.9Å; Y126-Y129 HydrophobicContact CE1-CE2 4.1Å; Y126-Y129 HydrophobicContact CG-CD2 4.22Å; Y126-Y129 PolarHBondContact O-N 3.36Å; Y126-L130 WeakPolarHBondContact O-CG 3.36Å; Y126-L130 PolarHBondContact O-N 2.86Å
127Y85.6Confident85.3Confident46 Ų4639.6 Ų39.618%0.1821%0.212CC..Hα-helixtrans-66.1-37.4169.9-79.6-58.4000112L99 K123 G124 Y129 L130 A131 A142 Q145L99-Y127 HydrophobicContact CD1-CD1 3.81Å; L99-Y127 HydrophobicContact CD1-CD2 4.48Å; L99-Y127 HydrophobicContact CD1-CE1 3.56Å; L99-Y127 HydrophobicContact CD1-CE2 4.26Å; L99-Y127 HydrophobicContact CD1-CG 4.25Å; L99-Y127 HydrophobicContact CD2-CD2 3.8Å; L99-Y127 HydrophobicContact CD2-CE1 4.4Å; L99-Y127 HydrophobicContact CD2-CE2 3.58Å; L99-Y127 HydrophobicContact CD2-CG 4.27Å; K123-Y127 HydrophobicContact CD-CE2 4.2Å; K123-Y127 HydrophobicContact CG-CD2 3.85Å; K123-Y127 HydrophobicContact CG-CE2 3.56Å; K123-Y127 WeakPolarHBondContact O-CD2 3.4Å; K123-Y127 PolarHBondContact O-N 3.27Å; G124-Y127 PolarHBondContact O-N 3.47Å; Y127-Y129 VanDerWaalsContact C-N 3.34Å; Y127-Y129 PolarHBondContact O-N 2.87Å; Y127-L130 HydrophobicContact CD1-CD1 3.96Å; Y127-L130 HydrophobicContact CE1-CD1 4.35Å; Y127-L130 WeakPolarHBondContact O-CB 3.48Å; Y127-L130 PolarHBondContact O-N 2.86Å; Y127-A131 PolarHBondContact O-N 3.45Å; Y127-A142 WeakPolarHBondContact CB-O 3.48Å; Y127-Q145 HydrophobicContact CD1-CB 3.6Å; Y127-Q145 HydrophobicContact CD1-CG 4.44Å; Y127-Q145 HydrophobicContact CD2-CB 3.7Å; Y127-Q145 HydrophobicContact CE1-CB 3.62Å; Y127-Q145 HydrophobicContact CE1-CG 4.05Å; Y127-Q145 HydrophobicContact CE2-CB 3.71Å; Y127-Q145 HydrophobicContact CG-CB 3.66Å
128R84.7Confident85.7Confident78 Ų7842.8 Ų42.829%0.29423%0.227SC..Hα-helixtrans-60.4-43.8171.4-173.9177.549.857.17.8111.1G124 D125 Y126 A131 E132 Y150G124-R128 WeakPolarHBondContact O-CB 3.37Å; G124-R128 PolarHBondContact O-N 3.08Å; D125-R128 WeakPolarHBondContact O-CB 3Å; D125-R128 PolarHBondContact O-N 3.36Å; D125-R128 IonicContact OD1-CZ 3.65Å; D125-R128 IonicContact OD1-NE 2.65Å; D125-R128 IonicContact OD1-NH2 2.72Å; D125-R128 PolarHBondContact OD1-NH2 3.33Å; Y126-R128 VanDerWaalsContact C-N 3.32Å; R128-A131 PolarHBondContact O-N 2.95Å; R128-E132 IonicContact NH1-OE1 2.75Å; R128-E132 PolarHBondContact NH1-OE1 2.96Å; R128-E132 VanDerWaalsContact NH1-OE1 3.11Å; R128-E132 WeakPolarHBondContact O-CG 3.28Å; R128-E132 PolarHBondContact O-N 3.12Å; R128-Y150 PolarHBondContact NE-OH 3.44Å
129Y86.7Confident85.6Confident21 Ų2145.8 Ų45.88%0.08224%0.24CC..Hα-helixtrans-62.5-40.7174.6-57.7-33.7000112.6I53 D125 Y126 Y127 A131 E132 F133I53-Y129 HydrophobicContact CG1-CD2 4.12Å; I53-Y129 HydrophobicContact CG2-CD2 4.28Å; I53-Y129 HydrophobicContact CG2-CE2 4.04Å; D125-Y129 HydrophobicContact CB-CE2 4.17Å; D125-Y129 WeakPolarHBondContact O-CD1 3.4Å; D125-Y129 WeakPolarHBondContact O-CD2 3.37Å; D125-Y129 WeakPolarHBondContact O-CE2 3.4Å; D125-Y129 PolarHBondContact O-N 3.05Å; Y126-Y129 AromaticContact CD1-CD2 3.69Å; Y126-Y129 HydrophobicContact CD1-CD2 3.69Å; Y126-Y129 HydrophobicContact CD1-CE2 4.2Å; Y126-Y129 AromaticContact CE1-CD2 3.9Å; Y126-Y129 HydrophobicContact CE1-CD2 3.9Å; Y126-Y129 HydrophobicContact CE1-CE2 4.1Å; Y126-Y129 HydrophobicContact CG-CD2 4.22Å; Y126-Y129 PolarHBondContact O-N 3.36Å; Y127-Y129 VanDerWaalsContact C-N 3.34Å; Y127-Y129 PolarHBondContact O-N 2.87Å; Y129-A131 VanDerWaalsContact C-N 3.33Å; Y129-A131 PolarHBondContact O-N 3.23Å; Y129-E132 WeakPolarHBondContact O-CB 3.48Å; Y129-E132 PolarHBondContact O-N 3.35Å; Y129-F133 WeakPolarHBondContact O-CD1 3.49Å; Y129-F133 WeakPolarHBondContact O-CE1 3.42Å
130L87.6Confident85.1Confident9 Ų952.5 Ų52.55%0.04727%0.269CS..Hα-helixtrans-59.1-43.9173-76.4170.4000111.5R92 C95 L99 Y126 Y127 E132 F133 S134 A142R92-L130 HydrophobicContact CB-CD2 4.39Å; R92-L130 HydrophobicContact CG-CD2 4.11Å; C95-L130 HydrophobicContact CB-CD1 3.96Å; C95-L130 HydrophobicContact CB-CD2 3.48Å; C95-L130 VanDerWaalsContact CB-CD2 3.48Å; C95-L130 HydrophobicContact CB-CG 3.5Å; C95-L130 VanDerWaalsContact CB-CG 3.5Å; L99-L130 HydrophobicContact CD1-CD1 3.57Å; Y126-L130 WeakPolarHBondContact O-CG 3.36Å; Y126-L130 PolarHBondContact O-N 2.86Å; Y127-L130 HydrophobicContact CD1-CD1 3.96Å; Y127-L130 HydrophobicContact CE1-CD1 4.35Å; Y127-L130 WeakPolarHBondContact O-CB 3.48Å; Y127-L130 PolarHBondContact O-N 2.86Å; L130-E132 VanDerWaalsContact C-N 3.26Å; L130-E132 PolarHBondContact O-N 3.19Å; L130-F133 HydrophobicContact CD2-CZ 3.85Å; L130-S134 WeakPolarHBondContact O-CB 3.46Å; L130-S134 PolarHBondContact O-N 3.35Å; L130-S134 VanDerWaalsContact O-N 3.13Å; L130-S134 PolarHBondContact O-OG 3.35Å; L130-A142 HydrophobicContact CB-CB 3.97Å
131A83.6Confident84.9Confident11 Ų1152 Ų529%0.09128%0.278CS..Hα-helixtrans-66.9-23-179.100000114Y127 R128 Y129 F133 A142Y127-A131 PolarHBondContact O-N 3.45Å; R128-A131 PolarHBondContact O-N 2.95Å; Y129-A131 VanDerWaalsContact C-N 3.33Å; Y129-A131 PolarHBondContact O-N 3.23Å; A131-F133 PolarHBondContact O-N 3.19Å; A131-A142 HydrophobicContact CB-CB 3.88Å
132E84.3Confident84.7Confident59 Ų5948.2 Ų48.228%0.27626%0.263SS..Hα-helixtrans-63-39.1-179.3-77.7171.5-158.900112.9R57 W60 R61 R128 Y129 L130R57-E132 IonicContact CZ-OE1 3.72Å; R57-E132 IonicContact CZ-OE2 2.85Å; R57-E132 IonicContact NE-OE1 2.98Å; R57-E132 IonicContact NE-OE2 3.46Å; R57-E132 PolarHBondContact NE-OE2 3.36Å; R57-E132 IonicContact NH2-OE1 3.7Å; R57-E132 PolarHBondContact NH2-OE1 2.93Å; R57-E132 IonicContact NH2-OE2 2.93Å; R57-E132 PolarHBondContact NH2-OE2 3.02Å; W60-E132 WeakPolarHBondContact CH2-O 3.48Å; R61-E132 IonicContact NH2-OE2 3.53Å; R128-E132 IonicContact NH1-OE1 2.75Å; R128-E132 PolarHBondContact NH1-OE1 2.96Å; R128-E132 VanDerWaalsContact NH1-OE1 3.11Å; R128-E132 WeakPolarHBondContact O-CG 3.28Å; R128-E132 PolarHBondContact O-N 3.12Å; Y129-E132 WeakPolarHBondContact O-CB 3.48Å; Y129-E132 PolarHBondContact O-N 3.35Å; L130-E132 VanDerWaalsContact C-N 3.26Å; L130-E132 PolarHBondContact O-N 3.19Å
133F85.3Confident83.9Confident11 Ų1151 Ų515%0.04828%0.281CS..Hα-helixtrans-113-9.3-176.862-95.1000113.7W60 E88 L91 R92 Y129 L130 A131W60-F133 HydrophobicContact CD2-CB 4.2Å; W60-F133 VanDerWaalsContact CE2-CB 3.5Å; W60-F133 HydrophobicContact CH2-CB 4.06Å; W60-F133 HydrophobicContact CZ2-CB 3.43Å; W60-F133 VanDerWaalsContact CZ2-CB 3.43Å; E88-F133 HydrophobicContact CB-CD2 4.07Å; E88-F133 HydrophobicContact CB-CE2 4.42Å; E88-F133 HydrophobicContact CG-CB 4.24Å; E88-F133 HydrophobicContact CG-CD2 4.04Å; E88-F133 HydrophobicContact CG-CG 4.36Å; L91-F133 HydrophobicContact CB-CD1 4.38Å; L91-F133 HydrophobicContact CB-CE1 3.66Å; L91-F133 HydrophobicContact CB-CE2 4.47Å; L91-F133 HydrophobicContact CB-CZ 3.7Å; L91-F133 HydrophobicContact CD1-CD1 4.06Å; L91-F133 HydrophobicContact CD1-CE1 4.14Å; L91-F133 HydrophobicContact CG-CE1 4.44Å; R92-F133 HydrophobicContact CB-CE2 4.11Å; R92-F133 HydrophobicContact CB-CZ 4.14Å; Y129-F133 WeakPolarHBondContact O-CD1 3.49Å; Y129-F133 WeakPolarHBondContact O-CE1 3.42Å; L130-F133 HydrophobicContact CD2-CZ 3.85Å; A131-F133 PolarHBondContact O-N 3.19Å
134S85.7Confident83.3Confident5 Ų552.3 Ų52.34%0.03529%0.289CS..  trans-73.1155.4175.3-63.60000111.7L130L130-S134 WeakPolarHBondContact O-CB 3.46Å; L130-S134 PolarHBondContact O-N 3.35Å; L130-S134 VanDerWaalsContact O-N 3.13Å; L130-S134 PolarHBondContact O-OG 3.35Å
135T84.8Confident83.2Confident114 Ų11455.6 Ų55.670%0.69931%0.305SS*.  trans-128.8162.6176.359.50000111.4T137 E138 K139T135-T137 PolarHBondContact O-N 2.88Å; T135-E138 PolarHBondContact O-N 2.96Å; T135-K139 PolarHBondContact O-N 3.44Å
136G85.9Confident82.6Confident64 Ų6455 Ų5566%0.6630%0.302SS*.Hα-helixtrans57.6-131175.700000114.1E138 K139 K140G136-E138 PolarHBondContact O-N 3.24Å; G136-K139 PolarHBondContact O-N 3.29Å; G136-K140 PolarHBondContact O-N 3.49Å
137T87.3Confident81.7Confident129 Ų12957.6 Ų57.679%0.79132%0.316SS*.Hα-helixtrans-67.8-32.2-17752.60000113.1T135 K140 A141T135-T137 PolarHBondContact O-N 2.88Å; T137-K140 PolarHBondContact O-N 3.42Å; T137-A141 WeakPolarHBondContact O-CB 3.04Å; T137-A141 PolarHBondContact O-N 3.41Å
138E84.1Confident81.2Confident75 Ų7560.4 Ų60.435%0.3533%0.332SS..Hα-helixtrans-64.2-43.1177.1-171.6-177.6-162.900110.4R92 T135 G136 K140 A141 A142R92-E138 IonicContact CZ-OE1 3.76Å; R92-E138 IonicContact CZ-OE2 3.11Å; R92-E138 IonicContact NE-OE1 2.69Å; R92-E138 PolarHBondContact NE-OE1 3.35Å; R92-E138 IonicContact NE-OE2 3.57Å; R92-E138 IonicContact NH2-OE1 3.2Å; R92-E138 PolarHBondContact NH2-OE1 3.41Å; R92-E138 IonicContact NH2-OE2 3.51Å; R92-E138 PolarHBondContact NH2-OE2 2.88Å; R92-E138 VanDerWaalsContact NH2-OE2 3.13Å; T135-E138 PolarHBondContact O-N 2.96Å; G136-E138 PolarHBondContact O-N 3.24Å; E138-K140 PolarHBondContact O-N 3.4Å; E138-A141 PolarHBondContact O-N 2.89Å; E138-A142 WeakPolarHBondContact O-CB 3.28Å; E138-A142 PolarHBondContact O-N 3.01Å
139K82.3Confident80.6Confident105 Ų10556.8 Ų56.846%0.45732%0.319SS..Hα-helixtrans-59.7-49.1176.1-172.4173.9-175.3172.10111.5T135 G136 A141 A142 T143T135-K139 PolarHBondContact O-N 3.44Å; G136-K139 PolarHBondContact O-N 3.29Å; K139-A141 PolarHBondContact O-N 3.44Å; K139-A142 PolarHBondContact O-N 3.05Å; K139-T143 WeakPolarHBondContact O-CB 3.25Å; K139-T143 PolarHBondContact O-N 2.99Å; K139-T143 PolarHBondContact O-OG1 2.87Å; K139-T143 VanDerWaalsContact O-OG1 3.05Å
140K79Confident79.5Confident143 Ų14359.1 Ų59.162%0.62233%0.328SS*.Hα-helixtrans-59.4-48.5179.3-174.4176.5179.1179.10111.3G136 T137 E138 A142 T143 D144G136-K140 PolarHBondContact O-N 3.49Å; T137-K140 PolarHBondContact O-N 3.42Å; E138-K140 PolarHBondContact O-N 3.4Å; K140-A142 VanDerWaalsContact C-N 3.35Å; K140-A142 PolarHBondContact O-N 3Å; K140-T143 PolarHBondContact O-N 2.78Å; K140-D144 WeakPolarHBondContact O-CB 3.06Å; K140-D144 PolarHBondContact O-N 3.47Å
141A82.3Confident78.4Confident54 Ų5462.8 Ų62.845%0.44635%0.345SS..Hα-helixtrans-60.5-43178.200000112.3T137 E138 K139 D144 Q145T137-A141 WeakPolarHBondContact O-CB 3.04Å; T137-A141 PolarHBondContact O-N 3.41Å; E138-A141 PolarHBondContact O-N 2.89Å; K139-A141 PolarHBondContact O-N 3.44Å; A141-D144 PolarHBondContact O-N 3.45Å; A141-Q145 WeakPolarHBondContact O-CB 3.27Å; A141-Q145 VanDerWaalsContact O-CG 3.24Å; A141-Q145 WeakPolarHBondContact O-CG 3.41Å; A141-Q145 PolarHBondContact O-N 3.17Å
142A77.2Confident77.4Confident7 Ų763.6 Ų63.66%0.05835%0.352CS..Hα-helixtrans-65.2-41.3176.600000112Y127 L130 A131 E138 K139 K140 Q145 S146Y127-A142 WeakPolarHBondContact CB-O 3.48Å; L130-A142 HydrophobicContact CB-CB 3.97Å; A131-A142 HydrophobicContact CB-CB 3.88Å; E138-A142 WeakPolarHBondContact O-CB 3.28Å; E138-A142 PolarHBondContact O-N 3.01Å; K139-A142 PolarHBondContact O-N 3.05Å; K140-A142 VanDerWaalsContact C-N 3.35Å; K140-A142 PolarHBondContact O-N 3Å; A142-Q145 PolarHBondContact O-N 3.07Å; A142-S146 VanDerWaalsContact O-CB 3.29Å; A142-S146 WeakPolarHBondContact O-CB 3.28Å; A142-S146 PolarHBondContact O-N 3.15Å
143T73.3Confident75.9Confident68 Ų6863.1 Ų63.142%0.41735%0.347SS..Hα-helixtrans-62.4-47.2174.6-62.40000111.6K139 K140 Q145 S146 L147K139-T143 WeakPolarHBondContact O-CB 3.25Å; K139-T143 PolarHBondContact O-N 2.99Å; K139-T143 PolarHBondContact O-OG1 2.87Å; K139-T143 VanDerWaalsContact O-OG1 3.05Å; K140-T143 PolarHBondContact O-N 2.78Å; T143-Q145 VanDerWaalsContact C-N 3.34Å; T143-Q145 PolarHBondContact O-N 2.99Å; T143-S146 WeakPolarHBondContact O-CB 3.49Å; T143-S146 PolarHBondContact O-N 2.9Å; T143-L147 WeakPolarHBondContact O-CB 3.05Å; T143-L147 PolarHBondContact O-N 3.08Å
144D75.9Confident74.3Confident69 Ų6963.4 Ų63.437%0.36935%0.35SS..Hα-helixtrans-61.8-42.5178.9-66.1-15.6000111K140 A141 L147 M148K140-D144 WeakPolarHBondContact O-CB 3.06Å; K140-D144 PolarHBondContact O-N 3.47Å; A141-D144 PolarHBondContact O-N 3.45Å; D144-L147 WeakPolarHBondContact O-CB 3.1Å; D144-L147 PolarHBondContact O-N 3.46Å; D144-M148 WeakPolarHBondContact O-CG 3.31Å; D144-M148 PolarHBondContact O-N 2.63Å
145Q79Confident72.7Confident70 Ų7065.9 Ų65.933%0.32737%0.367SS..Hα-helixtrans-69.6-37.9177-71.7-61.6-36.600113.2Y127 A141 A142 T143 L147 M148 A149Y127-Q145 HydrophobicContact CD1-CB 3.6Å; Y127-Q145 HydrophobicContact CD1-CG 4.44Å; Y127-Q145 HydrophobicContact CD2-CB 3.7Å; Y127-Q145 HydrophobicContact CE1-CB 3.62Å; Y127-Q145 HydrophobicContact CE1-CG 4.05Å; Y127-Q145 HydrophobicContact CE2-CB 3.71Å; Y127-Q145 HydrophobicContact CG-CB 3.66Å; A141-Q145 WeakPolarHBondContact O-CB 3.27Å; A141-Q145 VanDerWaalsContact O-CG 3.24Å; A141-Q145 WeakPolarHBondContact O-CG 3.41Å; A141-Q145 PolarHBondContact O-N 3.17Å; A142-Q145 PolarHBondContact O-N 3.07Å; T143-Q145 VanDerWaalsContact C-N 3.34Å; T143-Q145 PolarHBondContact O-N 2.99Å; Q145-L147 PolarHBondContact O-N 2.89Å; Q145-M148 PolarHBondContact O-N 3.44Å; Q145-A149 WeakPolarHBondContact O-CB 2.82Å; Q145-A149 PolarHBondContact O-N 3.37Å
146S71Confident71.2Confident10 Ų1061.1 Ų61.17%0.0734%0.339CS..Hα-helixtrans-57.4-44.2171.3-174.90000109.9G124 A142 T143 A149 Y150G124-S146 PolarHBondContact O-OG 2.64Å; G124-S146 VanDerWaalsContact O-OG 3.09Å; A142-S146 VanDerWaalsContact O-CB 3.29Å; A142-S146 WeakPolarHBondContact O-CB 3.28Å; A142-S146 PolarHBondContact O-N 3.15Å; T143-S146 WeakPolarHBondContact O-CB 3.49Å; T143-S146 PolarHBondContact O-N 2.9Å; S146-A149 PolarHBondContact O-N 3.31Å; S146-Y150 WeakPolarHBondContact O-CD2 3.19Å; S146-Y150 PolarHBondContact O-N 3.32Å; S146-Y150 VanDerWaalsContact OG-CE2 3.25Å; S146-Y150 WeakPolarHBondContact OG-CE2 2.87Å
147L70.2Confident69.4Low61 Ų6160.2 Ų60.232%0.31932%0.318SS..Hα-helixtrans-66.6-47.9-179.7-164.970.5000111.9T143 D144 Q145 A149 Y150 Q151 M200T143-L147 WeakPolarHBondContact O-CB 3.05Å; T143-L147 PolarHBondContact O-N 3.08Å; D144-L147 WeakPolarHBondContact O-CB 3.1Å; D144-L147 PolarHBondContact O-N 3.46Å; Q145-L147 PolarHBondContact O-N 2.89Å; L147-A149 VanDerWaalsContact C-N 3.27Å; L147-A149 PolarHBondContact O-N 2.88Å; L147-Y150 CarbonylContact O-C 3.56Å; L147-Y150 PolarHBondContact O-N 2.84Å; L147-Y150 VanDerWaalsContact O-N 3.16Å; L147-Q151 HydrophobicContact CG-CG 4.44Å; L147-Q151 WeakPolarHBondContact O-CB 3.19Å; L147-Q151 VanDerWaalsContact O-CG 3.25Å; L147-Q151 WeakPolarHBondContact O-CG 3.46Å; L147-Q151 PolarHBondContact O-N 3.46Å; L147-M200 HydrophobicContact CD1-CE 3.36Å; L147-M200 HydrophobicContact CD1-SD 3.4Å; L147-M200 WeakPolarHBondContact CD1-SD 3.22Å; L147-M200 HydrophobicContact CD2-CE 4.08Å; L147-M200 HydrophobicContact CD2-SD 3.67Å; L147-M200 HydrophobicContact CG-CE 4.2Å; L147-M200 HydrophobicContact CG-SD 3.7Å
148M75.7Confident67.6Low105 Ų10554.4 Ų54.452%0.51728%0.282SS..Hα-helixtrans-57.4-40.8175.8-72.1177.5178.900112D144 Q145 Q151 A152D144-M148 WeakPolarHBondContact O-CG 3.31Å; D144-M148 PolarHBondContact O-N 2.63Å; Q145-M148 PolarHBondContact O-N 3.44Å; M148-Q151 PolarHBondContact O-N 3.49Å; M148-A152 WeakPolarHBondContact O-CB 3.14Å; M148-A152 PolarHBondContact O-N 3.37Å
149A72.4Confident65.9Low2 Ų256.4 Ų56.42%0.01729%0.289CS..Hα-helixtrans-67-41.5177.100000112.3K123 Q145 S146 L147 Q151 A152 W153K123-A149 HydrophobicContact CB-CB 4.06Å; K123-A149 HydrophobicContact CD-CB 4.16Å; K123-A149 HydrophobicContact CG-CB 3.88Å; Q145-A149 WeakPolarHBondContact O-CB 2.82Å; Q145-A149 PolarHBondContact O-N 3.37Å; S146-A149 PolarHBondContact O-N 3.31Å; L147-A149 VanDerWaalsContact C-N 3.27Å; L147-A149 PolarHBondContact O-N 2.88Å; A149-Q151 VanDerWaalsContact C-N 3.35Å; A149-A152 PolarHBondContact O-N 3.3Å; A149-W153 PolarHBondContact O-N 2.89Å; A149-W153 VanDerWaalsContact O-N 3.13Å
150Y63.7Low64.3Low71 Ų7152 Ų5228%0.27827%0.272SS..Hα-helixtrans-74.1-21.3174.1-70-53.7000113.5G124 D125 R128 S146 L147 W153 P154G124-Y150 VanDerWaalsContact C-CZ 3.47Å; D125-Y150 WeakPolarHBondContact CA-OH 3.34Å; D125-Y150 PolarHBondContact N-OH 3.01Å; D125-Y150 PolarHBondContact OD1-OH 3.25Å; R128-Y150 PolarHBondContact NE-OH 3.44Å; S146-Y150 WeakPolarHBondContact O-CD2 3.19Å; S146-Y150 PolarHBondContact O-N 3.32Å; S146-Y150 VanDerWaalsContact OG-CE2 3.25Å; S146-Y150 WeakPolarHBondContact OG-CE2 2.87Å; L147-Y150 CarbonylContact O-C 3.56Å; L147-Y150 PolarHBondContact O-N 2.84Å; L147-Y150 VanDerWaalsContact O-N 3.16Å; Y150-W153 WeakPolarHBondContact O-CB 3.21Å; Y150-W153 PolarHBondContact O-N 2.99Å; Y150-P154 WeakPolarHBondContact O-CD 3.34Å
151Q63.6Low62.8Low86 Ų8645.9 Ų45.940%0.40225%0.246SC..Hα-helixtrans-75-38.4170.9-75.8171-13.300111.1L147 M148 A149 W153 P154 C155 M200L147-Q151 HydrophobicContact CG-CG 4.44Å; L147-Q151 WeakPolarHBondContact O-CB 3.19Å; L147-Q151 VanDerWaalsContact O-CG 3.25Å; L147-Q151 WeakPolarHBondContact O-CG 3.46Å; L147-Q151 PolarHBondContact O-N 3.46Å; M148-Q151 PolarHBondContact O-N 3.49Å; A149-Q151 VanDerWaalsContact C-N 3.35Å; Q151-W153 PolarHBondContact O-N 3.23Å; Q151-P154 WeakPolarHBondContact O-CD 3.28Å; Q151-C155 PolarHBondContact O-SG 3.07Å; Q151-C155 VanDerWaalsContact O-SG 3.35Å; Q151-M200 HydrophobicContact CG-SD 4.29Å; Q151-M200 PolarHBondContact NE2-SD 3.44Å
152A61.5Low61.1Low27 Ų2745.8 Ų45.822%0.22324%0.238CC..Hα-helixtrans-65.3-23.3171.400000112Y120 M148 A149 A156Y120-A152 HydrophobicContact CD1-CB 3.68Å; Y120-A152 HydrophobicContact CD2-CB 4.28Å; Y120-A152 HydrophobicContact CE1-CB 3.74Å; Y120-A152 HydrophobicContact CE2-CB 4.33Å; Y120-A152 HydrophobicContact CG-CB 3.99Å; M148-A152 WeakPolarHBondContact O-CB 3.14Å; M148-A152 PolarHBondContact O-N 3.37Å; A149-A152 PolarHBondContact O-N 3.3Å; A152-A156 WeakPolarHBondContact O-CB 3.38Å; A152-A156 PolarHBondContact O-N 2.7Å
153W54.6Low59.4Low50 Ų5051.9 Ų51.919%0.18927%0.265CS..Hα-helixtrans-62.5-59.1-179.9170.3-72.9000113.5V117 K121 A149 Y150 Q151 C155 A156 Q157V117-W153 HydrophobicContact CB-CZ3 4.39Å; V117-W153 HydrophobicContact CG1-CD2 3.88Å; V117-W153 HydrophobicContact CG1-CE3 3.7Å; V117-W153 HydrophobicContact CG1-CH2 3.48Å; V117-W153 VanDerWaalsContact CG1-CH2 3.48Å; V117-W153 HydrophobicContact CG1-CZ2 3.71Å; V117-W153 HydrophobicContact CG1-CZ3 3.41Å; V117-W153 VanDerWaalsContact CG1-CZ3 3.41Å; V117-W153 WeakPolarHBondContact O-CZ3 3.49Å; K121-W153 HydrophobicContact CB-CD2 4.45Å; K121-W153 HydrophobicContact CB-CE3 3.42Å; K121-W153 VanDerWaalsContact CB-CE3 3.42Å; K121-W153 HydrophobicContact CB-CH2 3.49Å; K121-W153 VanDerWaalsContact CB-CH2 3.49Å; K121-W153 HydrophobicContact CB-CZ2 4.48Å; K121-W153 HydrophobicContact CB-CZ3 2.89Å; K121-W153 HydrophobicContact CD-CH2 3.28Å; K121-W153 HydrophobicContact CD-CZ2 3.92Å; K121-W153 HydrophobicContact CD-CZ3 3.7Å; K121-W153 HydrophobicContact CG-CD2 4.21Å; K121-W153 HydrophobicContact CG-CE3 3.61Å; K121-W153 HydrophobicContact CG-CH2 3.24Å; K121-W153 HydrophobicContact CG-CZ2 3.85Å; K121-W153 HydrophobicContact CG-CZ3 3.14Å; K121-W153 VanDerWaalsContact N-CZ3 3.29Å; A149-W153 PolarHBondContact O-N 2.89Å; A149-W153 VanDerWaalsContact O-N 3.13Å; Y150-W153 WeakPolarHBondContact O-CB 3.21Å; Y150-W153 PolarHBondContact O-N 2.99Å; Q151-W153 PolarHBondContact O-N 3.23Å; W153-C155 VanDerWaalsContact C-N 3.31Å; W153-C155 PolarHBondContact O-N 3.25Å; W153-A156 PolarHBondContact O-N 3.26Å; W153-Q157 VanDerWaalsContact O-CB 3.27Å; W153-Q157 WeakPolarHBondContact O-CB 3.32Å; W153-Q157 PolarHBondContact O-N 2.89Å
154P51.8Low58.2Low17 Ų1753.4 Ų53.411%0.1127%0.27CS..Hα-helixtrans-62.2-37.7175.6-22.431000112.4Y150 Q151 Q157 L158 L204Y150-P154 WeakPolarHBondContact O-CD 3.34Å; Q151-P154 WeakPolarHBondContact O-CD 3.28Å; P154-Q157 PolarHBondContact O-N 3.24Å; P154-L158 WeakPolarHBondContact O-CB 3.39Å; P154-L158 PolarHBondContact O-N 3.39Å; P154-L204 HydrophobicContact CB-CD2 3.9Å; P154-L204 HydrophobicContact CG-CD2 4.06Å
155C52.1Low56.7Low57 Ų5753.8 Ų53.839%0.38527%0.27SS..Hα-helixtrans-67.2-42.4179.7-63.10000111.7Q151 W153 F159Q151-C155 PolarHBondContact O-SG 3.07Å; Q151-C155 VanDerWaalsContact O-SG 3.35Å; W153-C155 VanDerWaalsContact C-N 3.31Å; W153-C155 PolarHBondContact O-N 3.25Å; C155-F159 WeakPolarHBondContact O-CB 3.33Å; C155-F159 PolarHBondContact O-N 3.19Å
156A51.8Low55.4Low13 Ų1357.3 Ų57.311%0.10729%0.291CS..Hα-helixtrans-68.2-38.6174.900000111.7V116 V117 Y120 A152 W153 S160V116-A156 HydrophobicContact CG1-CB 3.67Å; V117-A156 HydrophobicContact CG2-CB 4.13Å; Y120-A156 HydrophobicContact CD2-CB 4.22Å; A152-A156 WeakPolarHBondContact O-CB 3.38Å; A152-A156 PolarHBondContact O-N 2.7Å; W153-A156 PolarHBondContact O-N 3.26Å; A156-S160 VanDerWaalsContact O-CB 3.27Å; A156-S160 WeakPolarHBondContact O-CB 3.5Å; A156-S160 PolarHBondContact O-N 3.1Å; A156-S160 PolarHBondContact O-OG 3.12Å
157Q49.5Very low54.7Low46 Ų4658.6 Ų58.622%0.21530%0.3CS..Hα-helixtrans-66.6-44179-159.8159.322.100110.4V117 W153 P154 S160 L161 V174V117-Q157 HydrophobicContact CG1-CB 4.28Å; V117-Q157 HydrophobicContact CG1-CG 4.21Å; V117-Q157 HydrophobicContact CG2-CB 3.48Å; V117-Q157 VanDerWaalsContact CG2-CB 3.48Å; V117-Q157 HydrophobicContact CG2-CG 3.82Å; V117-Q157 VanDerWaalsContact CG2-N 3.34Å; W153-Q157 VanDerWaalsContact O-CB 3.27Å; W153-Q157 WeakPolarHBondContact O-CB 3.32Å; W153-Q157 PolarHBondContact O-N 2.89Å; P154-Q157 PolarHBondContact O-N 3.24Å; Q157-S160 PolarHBondContact O-N 3.45Å; Q157-S160 PolarHBondContact O-OG 3.25Å; Q157-L161 HydrophobicContact CG-CD1 3.92Å; Q157-L161 WeakPolarHBondContact O-CB 3.49Å; Q157-L161 VanDerWaalsContact O-CD1 3.27Å; Q157-L161 WeakPolarHBondContact O-CD1 3.42Å; Q157-L161 WeakPolarHBondContact O-CG 3.46Å; Q157-L161 PolarHBondContact O-N 2.9Å; Q157-V174 HydrophobicContact CG-CG1 3.54Å; Q157-V174 VanDerWaalsContact NE2-CG1 3.32Å
158L49Very low54.1Low7 Ų757 Ų574%0.03729%0.293CS..Hα-helixtrans-70.4-43.6176.1-173.4119.9000112.8P154 S160 L161 L162 A171 A175 W211P154-L158 WeakPolarHBondContact O-CB 3.39Å; P154-L158 PolarHBondContact O-N 3.39Å; L158-S160 PolarHBondContact O-N 2.93Å; L158-L161 PolarHBondContact O-N 3.49Å; L158-L161 VanDerWaalsContact O-N 3.14Å; L158-L162 HydrophobicContact CD2-CD1 3.49Å; L158-L162 VanDerWaalsContact CD2-CD1 3.49Å; L158-L162 HydrophobicContact CD2-CG 4.22Å; L158-L162 HydrophobicContact CG-CD1 4.11Å; L158-L162 HydrophobicContact CG-CG 4.31Å; L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 WeakPolarHBondContact O-CG 3.36Å; L158-L162 PolarHBondContact O-N 3.24Å; L158-A171 HydrophobicContact CD1-CB 4.09Å; L158-A171 HydrophobicContact CG-CB 4.36Å; L158-A175 HydrophobicContact CD1-CB 4.05Å; L158-W211 HydrophobicContact CB-CH2 4.45Å; L158-W211 HydrophobicContact CB-CZ3 4.1Å; L158-W211 HydrophobicContact CD1-CD2 4.09Å; L158-W211 HydrophobicContact CD1-CE3 3.26Å; L158-W211 HydrophobicContact CD1-CZ3 3.54Å; L158-W211 HydrophobicContact CD2-CD2 3.25Å; L158-W211 VanDerWaalsContact CD2-CE2 3.47Å; L158-W211 HydrophobicContact CD2-CE3 3.15Å; L158-W211 HydrophobicContact CD2-CG 4Å; L158-W211 HydrophobicContact CD2-CH2 3.47Å; L158-W211 VanDerWaalsContact CD2-CH2 3.47Å; L158-W211 HydrophobicContact CD2-CZ2 3.57Å; L158-W211 HydrophobicContact CD2-CZ3 3.27Å; L158-W211 HydrophobicContact CG-CD2 4.25Å; L158-W211 HydrophobicContact CG-CE3 3.72Å; L158-W211 HydrophobicContact CG-CH2 4.32Å; L158-W211 HydrophobicContact CG-CZ3 3.77Å
159F48.6Very low53.4Low116 Ų11658.2 Ų58.251%0.50930%0.298SS..Hα-helixtrans-55.8-43.5173.7-178-101.9000111C155 L162 E163C155-F159 WeakPolarHBondContact O-CB 3.33Å; C155-F159 PolarHBondContact O-N 3.19Å; F159-L162 PolarHBondContact O-N 2.93Å; F159-E163 HydrophobicContact CD2-CG 4.41Å; F159-E163 HydrophobicContact CE1-CG 4.32Å; F159-E163 WeakPolarHBondContact CE1-OE2 3.35Å; F159-E163 VanDerWaalsContact CE2-CD 3.49Å; F159-E163 HydrophobicContact CE2-CG 4.01Å; F159-E163 WeakPolarHBondContact CE2-OE1 3.34Å; F159-E163 HydrophobicContact CZ-CG 3.98Å; F159-E163 WeakPolarHBondContact CZ-OE1 3.46Å; F159-E163 WeakPolarHBondContact CZ-OE2 3.44Å; F159-E163 WeakPolarHBondContact O-CB 3.36Å; F159-E163 PolarHBondContact O-N 3.46Å
160S48.5Very low52.7Low14 Ų1464.9 Ų64.910%0.09832%0.322CS..Hα-helixtrans-69.3-36.4176.372.90000115A156 Q157 L158 L162 I164A156-S160 VanDerWaalsContact O-CB 3.27Å; A156-S160 WeakPolarHBondContact O-CB 3.5Å; A156-S160 PolarHBondContact O-N 3.1Å; A156-S160 PolarHBondContact O-OG 3.12Å; Q157-S160 PolarHBondContact O-N 3.45Å; Q157-S160 PolarHBondContact O-OG 3.25Å; L158-S160 PolarHBondContact O-N 2.93Å; S160-L162 VanDerWaalsContact C-N 3.3Å; S160-I164 WeakPolarHBondContact O-CB 3.47Å; S160-I164 PolarHBondContact O-N 3.29Å
161L47.2Very low52.2Low13 Ų1361.6 Ų61.67%0.06831%0.31CS..Hα-helixtrans-71.1-30.1178-72.2161.9000111.1Q157 L158 M165 R170 A171 V174Q157-L161 HydrophobicContact CG-CD1 3.92Å; Q157-L161 WeakPolarHBondContact O-CB 3.49Å; Q157-L161 VanDerWaalsContact O-CD1 3.27Å; Q157-L161 WeakPolarHBondContact O-CD1 3.42Å; Q157-L161 WeakPolarHBondContact O-CG 3.46Å; Q157-L161 PolarHBondContact O-N 2.9Å; L158-L161 PolarHBondContact O-N 3.49Å; L158-L161 VanDerWaalsContact O-N 3.14Å; L161-M165 HydrophobicContact CD2-CE 4.39Å; L161-M165 HydrophobicContact CD2-CG 4.43Å; L161-M165 HydrophobicContact CD2-SD 3.45Å; L161-M165 WeakPolarHBondContact CD2-SD 3.25Å; L161-R170 HydrophobicContact CD2-CG 4.4Å; L161-A171 HydrophobicContact CB-CB 3.53Å; L161-A171 HydrophobicContact CD1-CB 4.46Å; L161-V174 HydrophobicContact CD1-CB 3.62Å; L161-V174 HydrophobicContact CD1-CG1 3.87Å; L161-V174 HydrophobicContact CD1-CG2 3.79Å
162L47Very low51.9Low53 Ų5359.1 Ų59.128%0.27730%0.302SS..Hα-helixtrans-76.6-53.5173.4-70.5177.5000112.4L158 F159 S160 A171 L215L158-L162 HydrophobicContact CD2-CD1 3.49Å; L158-L162 VanDerWaalsContact CD2-CD1 3.49Å; L158-L162 HydrophobicContact CD2-CG 4.22Å; L158-L162 HydrophobicContact CG-CD1 4.11Å; L158-L162 HydrophobicContact CG-CG 4.31Å; L158-L162 WeakPolarHBondContact O-CB 3.49Å; L158-L162 WeakPolarHBondContact O-CG 3.36Å; L158-L162 PolarHBondContact O-N 3.24Å; F159-L162 PolarHBondContact O-N 2.93Å; S160-L162 VanDerWaalsContact C-N 3.3Å; L162-A171 HydrophobicContact CD2-CB 4.32Å; L162-A171 HydrophobicContact CG-CB 4.45Å; L162-L215 HydrophobicContact CD2-CD1 3.76Å; L162-L215 HydrophobicContact CD2-CD2 4.04Å; L162-L215 HydrophobicContact CD2-CG 4.39Å
163E41.9Very low52.1Low134 Ų13464.2 Ų64.263%0.62632%0.321SS*.Hα-helixtrans-75.4-37.6-174.9-79.2-161.3157.600113.8F159F159-E163 HydrophobicContact CD2-CG 4.41Å; F159-E163 HydrophobicContact CE1-CG 4.32Å; F159-E163 WeakPolarHBondContact CE1-OE2 3.35Å; F159-E163 VanDerWaalsContact CE2-CD 3.49Å; F159-E163 HydrophobicContact CE2-CG 4.01Å; F159-E163 WeakPolarHBondContact CE2-OE1 3.34Å; F159-E163 HydrophobicContact CZ-CG 3.98Å; F159-E163 WeakPolarHBondContact CZ-OE1 3.46Å; F159-E163 WeakPolarHBondContact CZ-OE2 3.44Å; F159-E163 WeakPolarHBondContact O-CB 3.36Å; F159-E163 PolarHBondContact O-N 3.46Å
164I46.1Very low52.3Low101 Ų10163.2 Ų63.252%0.51832%0.32SS..THydrogen-bonded Turntrans-97.9-37.9-169.7-55176.5000111.6S160S160-I164 WeakPolarHBondContact O-CB 3.47Å; S160-I164 PolarHBondContact O-N 3.29Å
165M45.2Very low52.6Low76 Ų7663.1 Ų63.137%0.37432%0.322SS..THydrogen-bonded Turntrans-99.3-10.4-171.8-65.2-171.157.300114.2L161 S167L161-M165 HydrophobicContact CD2-CE 4.39Å; L161-M165 HydrophobicContact CD2-CG 4.43Å; L161-M165 HydrophobicContact CD2-SD 3.45Å; L161-M165 WeakPolarHBondContact CD2-SD 3.25Å; M165-S167 WeakPolarHBondContact O-CB 3.28Å; M165-S167 PolarHBondContact O-N 2.95Å; M165-S167 PolarHBondContact O-OG 3.02Å
166N51.9Low53.1Low145 Ų14566.1 Ų66.178%0.77533%0.328SS*.  trans40.937.7-173.6-159.529000112.2P168N166-P168 WeakPolarHBondContact O-CD 3.35Å
167S56.3Low53.9Low36 Ų3670.8 Ų70.825%0.25235%0.348SS..  trans-125.975.5-168.9-69.10000108.3M165 E169 R170 A171M165-S167 WeakPolarHBondContact O-CB 3.28Å; M165-S167 PolarHBondContact O-N 2.95Å; M165-S167 PolarHBondContact O-OG 3.02Å; S167-E169 PolarHBondContact O-N 2.88Å; S167-R170 PolarHBondContact O-N 3.02Å; S167-A171 PolarHBondContact O-N 3.38Å
168P57.9Low54.4Low27 Ų2769.5 Ų69.518%0.17534%0.344CS..Hα-helixtrans-59.1-33.6-175.222.8-32.3000113.2N166 R170 A171 S172 L215N166-P168 WeakPolarHBondContact O-CD 3.35Å; P168-R170 VanDerWaalsContact C-N 3.32Å; P168-R170 PolarHBondContact O-N 3.34Å; P168-A171 WeakPolarHBondContact O-CB 3.2Å; P168-A171 PolarHBondContact O-N 3.47Å; P168-S172 WeakPolarHBondContact O-CB 3.37Å; P168-S172 PolarHBondContact O-N 2.96Å; P168-L215 HydrophobicContact CB-CB 3.86Å; P168-L215 HydrophobicContact CB-CD1 3.18Å; P168-L215 HydrophobicContact CB-CD2 3.5Å; P168-L215 HydrophobicContact CB-CG 3.63Å; P168-L215 HydrophobicContact CG-CD2 4.19Å
169E60.2Low54.9Low131 Ų13169.9 Ų69.961%0.61235%0.347SS*.Hα-helixtrans-64.7-39.7177.5-58.875.3-163.300111.1S167 S172 Q173S167-E169 PolarHBondContact O-N 2.88Å; E169-S172 PolarHBondContact O-N 3.37Å; E169-Q173 VanDerWaalsContact O-CG 3.3Å; E169-Q173 WeakPolarHBondContact O-CG 3.42Å; E169-Q173 PolarHBondContact O-N 2.9Å
170R57.9Low55.8Low143 Ų14368.7 Ų68.754%0.5435%0.345SS..Hα-helixtrans-74-37179.3-156.1175.8-172.1157.7-1111.2L161 S167 P168 S172 Q173 V174L161-R170 HydrophobicContact CD2-CG 4.4Å; S167-R170 PolarHBondContact O-N 3.02Å; P168-R170 VanDerWaalsContact C-N 3.32Å; P168-R170 PolarHBondContact O-N 3.34Å; R170-S172 VanDerWaalsContact C-N 3.33Å; R170-Q173 PolarHBondContact O-N 3.3Å; R170-V174 WeakPolarHBondContact O-CB 3.1Å; R170-V174 VanDerWaalsContact O-CG2 3.27Å; R170-V174 WeakPolarHBondContact O-CG2 3.4Å; R170-V174 PolarHBondContact O-N 2.91Å
171A53.1Low56.6Low1 Ų173.2 Ų73.21%0.00837%0.365CS..Hα-helixtrans-55.6-49.5169.900000111.2L158 L161 L162 S167 P168 V174 A175L158-A171 HydrophobicContact CD1-CB 4.09Å; L158-A171 HydrophobicContact CG-CB 4.36Å; L161-A171 HydrophobicContact CB-CB 3.53Å; L161-A171 HydrophobicContact CD1-CB 4.46Å; L162-A171 HydrophobicContact CD2-CB 4.32Å; L162-A171 HydrophobicContact CG-CB 4.45Å; S167-A171 PolarHBondContact O-N 3.38Å; P168-A171 WeakPolarHBondContact O-CB 3.2Å; P168-A171 PolarHBondContact O-N 3.47Å; A171-V174 PolarHBondContact O-N 2.89Å; A171-A175 WeakPolarHBondContact O-CB 3.11Å; A171-A175 PolarHBondContact O-N 3.37Å
172S58.7Low57.2Low35 Ų3574.2 Ų74.225%0.24538%0.376CS..Hα-helixtrans-63.2-44.5178.7-1730000112.4P168 E169 R170 V174 A175 K176P168-S172 WeakPolarHBondContact O-CB 3.37Å; P168-S172 PolarHBondContact O-N 2.96Å; E169-S172 PolarHBondContact O-N 3.37Å; R170-S172 VanDerWaalsContact C-N 3.33Å; S172-V174 PolarHBondContact O-N 3.04Å; S172-A175 PolarHBondContact O-N 3.43Å; S172-K176 VanDerWaalsContact O-CB 3.31Å; S172-K176 WeakPolarHBondContact O-CB 3Å; S172-K176 PolarHBondContact O-N 2.93Å
173Q64.2Low57.9Low133 Ų13373.1 Ų73.162%0.62137%0.371SS*.Hα-helixtrans-61-45.3177.6-76.9174.2800112.7E169 R170 K176 Q177E169-Q173 VanDerWaalsContact O-CG 3.3Å; E169-Q173 WeakPolarHBondContact O-CG 3.42Å; E169-Q173 PolarHBondContact O-N 2.9Å; R170-Q173 PolarHBondContact O-N 3.3Å; Q173-K176 PolarHBondContact O-N 3.4Å; Q173-Q177 WeakPolarHBondContact O-CB 3.04Å; Q173-Q177 PolarHBondContact O-N 3.37Å
174V60.5Low59.2Low29 Ų2969.7 Ų69.718%0.17637%0.366CS..Hα-helixtrans-69-41.4-179173.40000111Q157 L161 R170 A171 S172 K176 Q177 A178Q157-V174 HydrophobicContact CG-CG1 3.54Å; Q157-V174 VanDerWaalsContact NE2-CG1 3.32Å; L161-V174 HydrophobicContact CD1-CB 3.62Å; L161-V174 HydrophobicContact CD1-CG1 3.87Å; L161-V174 HydrophobicContact CD1-CG2 3.79Å; R170-V174 WeakPolarHBondContact O-CB 3.1Å; R170-V174 VanDerWaalsContact O-CG2 3.27Å; R170-V174 WeakPolarHBondContact O-CG2 3.4Å; R170-V174 PolarHBondContact O-N 2.91Å; A171-V174 PolarHBondContact O-N 2.89Å; S172-V174 PolarHBondContact O-N 3.04Å; V174-K176 VanDerWaalsContact C-N 3.3Å; V174-K176 PolarHBondContact O-N 2.99Å; V174-Q177 PolarHBondContact O-N 3.43Å; V174-A178 WeakPolarHBondContact O-CB 3.4Å; V174-A178 PolarHBondContact O-N 3.19Å
175A57.3Low59.9Low16 Ų1671.7 Ų71.713%0.13237%0.373CS..Hα-helixtrans-61.9-39.5174.100000111.7L158 A171 S172 L179 L208L158-A175 HydrophobicContact CD1-CB 4.05Å; A171-A175 WeakPolarHBondContact O-CB 3.11Å; A171-A175 PolarHBondContact O-N 3.37Å; S172-A175 PolarHBondContact O-N 3.43Å; A175-L179 WeakPolarHBondContact O-CB 3.27Å; A175-L179 PolarHBondContact O-N 2.91Å; A175-L208 HydrophobicContact CB-CD1 3.34Å
176K63Low60.5Low119 Ų11969.3 Ų69.352%0.51736%0.361SS..Hα-helixtrans-64.9-45.1174.3-172.6175.5-178.71780112.2S172 Q173 V174 L179 D180S172-K176 VanDerWaalsContact O-CB 3.31Å; S172-K176 WeakPolarHBondContact O-CB 3Å; S172-K176 PolarHBondContact O-N 2.93Å; Q173-K176 PolarHBondContact O-N 3.4Å; V174-K176 VanDerWaalsContact C-N 3.3Å; V174-K176 PolarHBondContact O-N 2.99Å; K176-L179 WeakPolarHBondContact O-CB 3.39Å; K176-L179 PolarHBondContact O-N 3.47Å; K176-D180 VanDerWaalsContact O-CG 3.29Å; K176-D180 PolarHBondContact O-N 2.88Å
177Q67.8Low60.9Low112 Ų11268 Ų6852%0.52335%0.354SS..Hα-helixtrans-61.9-45.6177-177-179.3-9.400111.4Q173 V174 L179 D180 E181Q173-Q177 WeakPolarHBondContact O-CB 3.04Å; Q173-Q177 PolarHBondContact O-N 3.37Å; V174-Q177 PolarHBondContact O-N 3.43Å; Q177-L179 VanDerWaalsContact C-N 3.26Å; Q177-L179 PolarHBondContact O-N 2.65Å; Q177-D180 PolarHBondContact O-N 3.32Å; Q177-E181 HydrophobicContact CG-CG 4.45Å; Q177-E181 WeakPolarHBondContact CG-OE1 3.34Å; Q177-E181 PolarHBondContact NE2-OE1 3.46Å; Q177-E181 WeakPolarHBondContact O-CB 3.27Å; Q177-E181 WeakPolarHBondContact O-CG 3.11Å; Q177-E181 PolarHBondContact O-N 2.87Å
178A59.9Low61.2Low18 Ų1871 Ų7115%0.14938%0.375CS..Hα-helixtrans-60.8-37.5176.500000111.7V174 A182V174-A178 WeakPolarHBondContact O-CB 3.4Å; V174-A178 PolarHBondContact O-N 3.19Å; A178-A182 VanDerWaalsContact O-CB 3.28Å; A178-A182 WeakPolarHBondContact O-CB 3.16Å; A178-A182 PolarHBondContact O-N 2.81Å
179L59.7Low61.1Low16 Ų1672.4 Ų72.48%0.08439%0.389CS..Hα-helixtrans-66.2-44.1174.3-175.369.6000111.9A175 K176 Q177 A182 T183 M201 L204 K205A175-L179 WeakPolarHBondContact O-CB 3.27Å; A175-L179 PolarHBondContact O-N 2.91Å; K176-L179 WeakPolarHBondContact O-CB 3.39Å; K176-L179 PolarHBondContact O-N 3.47Å; Q177-L179 VanDerWaalsContact C-N 3.26Å; Q177-L179 PolarHBondContact O-N 2.65Å; L179-A182 PolarHBondContact O-N 3.22Å; L179-T183 WeakPolarHBondContact O-CB 3.47Å; L179-T183 PolarHBondContact O-N 2.82Å; L179-T183 PolarHBondContact O-OG1 3.37Å; L179-M201 HydrophobicContact CD1-CB 4.36Å; L179-M201 HydrophobicContact CD1-CG 4.24Å; L179-L204 HydrophobicContact CD1-CB 3.72Å; L179-L204 HydrophobicContact CD1-CD1 3.77Å; L179-L204 HydrophobicContact CD1-CG 4.42Å; L179-K205 HydrophobicContact CD2-CG 3.73Å
180D66.8Low60.9Low90 Ų9069 Ų6948%0.48139%0.39SS..Hα-helixtrans-65.6-42.1179.9-70.5-21000111.2K176 Q177 T183 A184K176-D180 VanDerWaalsContact O-CG 3.29Å; K176-D180 PolarHBondContact O-N 2.88Å; Q177-D180 PolarHBondContact O-N 3.32Å; D180-T183 PolarHBondContact O-N 2.92Å; D180-A184 PolarHBondContact O-N 2.9Å
181E66.1Low60.8Low109 Ų10968.7 Ų68.751%0.50940%0.403SS..Hα-helixtrans-64-47175.4-73.2175.9-167.800111.6Q177 T183 A184 E185Q177-E181 HydrophobicContact CG-CG 4.45Å; Q177-E181 WeakPolarHBondContact CG-OE1 3.34Å; Q177-E181 PolarHBondContact NE2-OE1 3.46Å; Q177-E181 WeakPolarHBondContact O-CB 3.27Å; Q177-E181 WeakPolarHBondContact O-CG 3.11Å; Q177-E181 PolarHBondContact O-N 2.87Å; E181-T183 VanDerWaalsContact C-N 3.31Å; E181-T183 PolarHBondContact O-N 2.79Å; E181-A184 PolarHBondContact O-N 2.89Å; E181-E185 PolarHBondContact O-N 3.27Å
182A59.6Low60.9Low35 Ų3577.8 Ų77.829%0.28945%0.446SS..Hα-helixtrans-59.4-43.6174.900000111.2A178 L179 A184 E185 I186A178-A182 VanDerWaalsContact O-CB 3.28Å; A178-A182 WeakPolarHBondContact O-CB 3.16Å; A178-A182 PolarHBondContact O-N 2.81Å; L179-A182 PolarHBondContact O-N 3.22Å; A182-A184 VanDerWaalsContact C-N 3.34Å; A182-A184 PolarHBondContact O-N 3.39Å; A182-E185 PolarHBondContact O-N 3.17Å; A182-I186 HydrophobicContact CB-CD1 4.47Å; A182-I186 WeakPolarHBondContact O-CB 3.36Å; A182-I186 VanDerWaalsContact O-CD1 3.25Å; A182-I186 WeakPolarHBondContact O-CD1 3.21Å; A182-I186 WeakPolarHBondContact O-CG1 3.39Å; A182-I186 PolarHBondContact O-N 3.13Å
183T61.1Low60.6Low30 Ų3077.7 Ų77.718%0.18445%0.45CS..Hα-helixtrans-60.4-42.9178-56.10000111.7L179 D180 E181 I186 N187 M201L179-T183 WeakPolarHBondContact O-CB 3.47Å; L179-T183 PolarHBondContact O-N 2.82Å; L179-T183 PolarHBondContact O-OG1 3.37Å; D180-T183 PolarHBondContact O-N 2.92Å; E181-T183 VanDerWaalsContact C-N 3.31Å; E181-T183 PolarHBondContact O-N 2.79Å; T183-I186 PolarHBondContact O-N 3.1Å; T183-N187 PolarHBondContact O-N 3.39Å; T183-N187 PolarHBondContact O-ND2 3.18Å; T183-M201 HydrophobicContact CG2-CE 3.63Å; T183-M201 HydrophobicContact CG2-SD 4.02Å; T183-M201 WeakPolarHBondContact OG1-CE 3.32Å
184A69.5Low60Low62 Ų6276.6 Ų76.651%0.51244%0.441SS..Hα-helixtrans-64.2-42.4178.400000111.9D180 E181 A182 N187 S188D180-A184 PolarHBondContact O-N 2.9Å; E181-A184 PolarHBondContact O-N 2.89Å; A182-A184 VanDerWaalsContact C-N 3.34Å; A182-A184 PolarHBondContact O-N 3.39Å; A184-N187 PolarHBondContact O-N 3.14Å; A184-S188 PolarHBondContact O-N 3.02Å
185E62.2Low59.9Low142 Ų14283.1 Ų83.166%0.66447%0.467SS*.Hα-helixtrans-69.5-37.6177.3-73.6-171.8171.700112.1E181 A182 S188 A189E181-E185 PolarHBondContact O-N 3.27Å; A182-E185 PolarHBondContact O-N 3.17Å; E185-S188 WeakPolarHBondContact O-CB 3.36Å; E185-S188 PolarHBondContact O-N 3.24Å; E185-S188 VanDerWaalsContact O-N 3.08Å; E185-S188 PolarHBondContact O-OG 2.82Å; E185-A189 PolarHBondContact O-N 3.41Å; E185-A189 VanDerWaalsContact O-N 3.1Å
186I56.9Low59.7Low27 Ų2787.9 Ų87.914%0.13849%0.49CS..Hα-helixtrans-63.5-42.1175.3-69.3158000111.1A182 T183 S188 A189 S197 M201A182-I186 HydrophobicContact CB-CD1 4.47Å; A182-I186 WeakPolarHBondContact O-CB 3.36Å; A182-I186 VanDerWaalsContact O-CD1 3.25Å; A182-I186 WeakPolarHBondContact O-CD1 3.21Å; A182-I186 WeakPolarHBondContact O-CG1 3.39Å; A182-I186 PolarHBondContact O-N 3.13Å; T183-I186 PolarHBondContact O-N 3.1Å; I186-S188 PolarHBondContact O-N 3.32Å; I186-A189 PolarHBondContact O-N 2.66Å; I186-S197 VanDerWaalsContact CG2-CB 3.45Å; I186-M201 HydrophobicContact CD1-CG 4.19Å; I186-M201 HydrophobicContact CD1-SD 4.23Å
187N59.9Low59.2Low116 Ų11683.1 Ų83.162%0.6247%0.472SS*.Hα-helixtrans-64-21.1176-73.2-32.6000112.7T183 A184T183-N187 PolarHBondContact O-N 3.39Å; T183-N187 PolarHBondContact O-ND2 3.18Å; A184-N187 PolarHBondContact O-N 3.14Å
188S63.8Low58.8Low99 Ų9981.5 Ų81.569%0.69247%0.466SS*.Hα-helixtrans-86.2-22.317481.90000113.6A184 E185 I186A184-S188 PolarHBondContact O-N 3.02Å; E185-S188 WeakPolarHBondContact O-CB 3.36Å; E185-S188 PolarHBondContact O-N 3.24Å; E185-S188 VanDerWaalsContact O-N 3.08Å; E185-S188 PolarHBondContact O-OG 2.82Å; I186-S188 PolarHBondContact O-N 3.32Å
189A54.1Low58.8Low57 Ų5786.2 Ų86.247%0.47149%0.488SS..SBendtrans-91.5115.2178.800000109.7E185 I186E185-A189 PolarHBondContact O-N 3.41Å; E185-A189 VanDerWaalsContact O-N 3.1Å; I186-A189 PolarHBondContact O-N 2.66Å
190G57.2Low58.4Low61 Ų6187.2 Ų87.263%0.62949%0.492SS*.  trans-52.4172.2-172.400000117.2E192 G193G190-E192 PolarHBondContact O-N 3Å; G190-G193 PolarHBondContact O-N 3.32Å; G190-G193 VanDerWaalsContact O-N 3.09Å
191V55.2Low58.1Low135 Ų13584.5 Ų84.582%0.81848%0.477SS*.G310 helixtrans-48.9-24.5-161.3-171.20000116.8Y194V191-Y194 WeakPolarHBondContact O-CB 3.41Å; V191-Y194 PolarHBondContact O-N 3.48Å
192E55.5Low57.8Low193 Ų19385 Ų8590%0.90248%0.48SS*.G310 helixtrans-79-21.6-179.2-76.7-174.8150.200114.3G190 Y194G190-E192 PolarHBondContact O-N 3Å; E192-Y194 VanDerWaalsContact C-N 3.34Å
193G53.1Low57.9Low33 Ų3387.4 Ų87.434%0.3449%0.487SS..G310 helixtrans-84.2-8.3172.600000114.1G190 S197G190-G193 PolarHBondContact O-N 3.32Å; G190-G193 VanDerWaalsContact O-N 3.09Å; G193-S197 WeakPolarHBondContact O-CB 3.37Å; G193-S197 PolarHBondContact O-N 3.24Å; G193-S197 PolarHBondContact O-OG 3.18Å
194Y51.9Low57.7Low110 Ų11088.3 Ų88.343%0.43149%0.49SS..Hα-helixtrans-71.3-37.4-163.9-171.4-104.4000114.1V191 E192 M198V191-Y194 WeakPolarHBondContact O-CB 3.41Å; V191-Y194 PolarHBondContact O-N 3.48Å; E192-Y194 VanDerWaalsContact C-N 3.34Å; Y194-M198 HydrophobicContact CD1-CE 3.51Å; Y194-M198 HydrophobicContact CD1-CG 4.31Å; Y194-M198 HydrophobicContact CD1-SD 4Å; Y194-M198 HydrophobicContact CE1-CE 3.37Å; Y194-M198 HydrophobicContact CE1-CG 4Å; Y194-M198 HydrophobicContact CE1-SD 3.33Å; Y194-M198 WeakPolarHBondContact CE1-SD 3.49Å; Y194-M198 WeakPolarHBondContact O-CB 3.42Å; Y194-M198 WeakPolarHBondContact O-CG 3.07Å; Y194-M198 PolarHBondContact O-N 2.67Å
195K56.6Low57.4Low165 Ų16591 Ų9172%0.71749%0.49SS*.Hα-helixtrans-71.5-46.8-176.6-77.4-174.9-179.9-179.10113S197 M198 L199K195-S197 VanDerWaalsContact C-N 3.28Å; K195-S197 PolarHBondContact O-N 3.2Å; K195-M198 HydrophobicContact CG-CE 4.41Å; K195-M198 PolarHBondContact O-N 3.04Å; K195-L199 PolarHBondContact O-N 3.32Å; K195-L199 VanDerWaalsContact O-N 3.11Å
196D53.5Low57.7Low116 Ų11689 Ų8962%0.6248%0.481SS*.Hα-helixtrans-67.8-36.6178.8-64.8-17.9000110.5L199 M200D196-L199 PolarHBondContact O-N 2.93Å; D196-M200 WeakPolarHBondContact O-CG 3.37Å; D196-M200 PolarHBondContact O-N 2.91Å; D196-M200 VanDerWaalsContact O-N 3.11Å
197S53.5Low57.9Low20 Ų2090.4 Ų90.414%0.1449%0.489CS..Hα-helixtrans-66.1-39.1174.9-62.40000113.3I186 G193 K195 M200 M201I186-S197 VanDerWaalsContact CG2-CB 3.45Å; G193-S197 WeakPolarHBondContact O-CB 3.37Å; G193-S197 PolarHBondContact O-N 3.24Å; G193-S197 PolarHBondContact O-OG 3.18Å; K195-S197 VanDerWaalsContact C-N 3.28Å; K195-S197 PolarHBondContact O-N 3.2Å; S197-M200 PolarHBondContact O-N 2.67Å; S197-M201 WeakPolarHBondContact O-CG 3.44Å; S197-M201 PolarHBondContact O-N 2.62Å
198M59.2Low57.9Low78 Ų7886.5 Ų86.538%0.38447%0.468SS..Hα-helixtrans-64.8-44.5173.7-85.6-166.2-57.900112.5Y194 K195 M200 M201 Q202Y194-M198 HydrophobicContact CD1-CE 3.51Å; Y194-M198 HydrophobicContact CD1-CG 4.31Å; Y194-M198 HydrophobicContact CD1-SD 4Å; Y194-M198 HydrophobicContact CE1-CE 3.37Å; Y194-M198 HydrophobicContact CE1-CG 4Å; Y194-M198 HydrophobicContact CE1-SD 3.33Å; Y194-M198 WeakPolarHBondContact CE1-SD 3.49Å; Y194-M198 WeakPolarHBondContact O-CB 3.42Å; Y194-M198 WeakPolarHBondContact O-CG 3.07Å; Y194-M198 PolarHBondContact O-N 2.67Å; K195-M198 HydrophobicContact CG-CE 4.41Å; K195-M198 PolarHBondContact O-N 3.04Å; M198-M200 PolarHBondContact O-N 2.98Å; M198-M201 PolarHBondContact O-N 3.1Å; M198-Q202 WeakPolarHBondContact O-CB 3.33Å; M198-Q202 PolarHBondContact O-N 3.42Å
199L59Low58Low117 Ų11784.7 Ų84.761%0.61346%0.459SS*.Hα-helixtrans-58.9-41177.6-163.592.2000110.5K195 D196 Q202 L203K195-L199 PolarHBondContact O-N 3.32Å; K195-L199 VanDerWaalsContact O-N 3.11Å; D196-L199 PolarHBondContact O-N 2.93Å; L199-Q202 PolarHBondContact O-N 3.4Å; L199-L203 WeakPolarHBondContact O-CG 3.49Å; L199-L203 PolarHBondContact O-N 3.07Å
200M52Low58.5Low37 Ų3786 Ų8618%0.18246%0.458CS..Hα-helixtrans-67.9-41.3176.2-75-166.7-65.700113.7L147 Q151 D196 S197 M198 Q202 L203 L204L147-M200 HydrophobicContact CD1-CE 3.36Å; L147-M200 HydrophobicContact CD1-SD 3.4Å; L147-M200 WeakPolarHBondContact CD1-SD 3.22Å; L147-M200 HydrophobicContact CD2-CE 4.08Å; L147-M200 HydrophobicContact CD2-SD 3.67Å; L147-M200 HydrophobicContact CG-CE 4.2Å; L147-M200 HydrophobicContact CG-SD 3.7Å; Q151-M200 HydrophobicContact CG-SD 4.29Å; Q151-M200 PolarHBondContact NE2-SD 3.44Å; D196-M200 WeakPolarHBondContact O-CG 3.37Å; D196-M200 PolarHBondContact O-N 2.91Å; D196-M200 VanDerWaalsContact O-N 3.11Å; S197-M200 PolarHBondContact O-N 2.67Å; M198-M200 PolarHBondContact O-N 2.98Å; M200-Q202 PolarHBondContact O-N 2.94Å; M200-L203 PolarHBondContact O-N 3.47Å; M200-L204 WeakPolarHBondContact O-CG 3.42Å; M200-L204 PolarHBondContact O-N 3.42Å
201M59.2Low58.7Low33 Ų3385.6 Ų85.616%0.16344%0.437CS..Hα-helixtrans-60.2-36.1173.1-77.6-177.16100111.6L179 T183 I186 S197 M198 K205L179-M201 HydrophobicContact CD1-CB 4.36Å; L179-M201 HydrophobicContact CD1-CG 4.24Å; T183-M201 HydrophobicContact CG2-CE 3.63Å; T183-M201 HydrophobicContact CG2-SD 4.02Å; T183-M201 WeakPolarHBondContact OG1-CE 3.32Å; I186-M201 HydrophobicContact CD1-CG 4.19Å; I186-M201 HydrophobicContact CD1-SD 4.23Å; S197-M201 WeakPolarHBondContact O-CG 3.44Å; S197-M201 PolarHBondContact O-N 2.62Å; M198-M201 PolarHBondContact O-N 3.1Å; M201-K205 WeakPolarHBondContact O-CB 3.27Å; M201-K205 VanDerWaalsContact O-CG 3.28Å; M201-K205 WeakPolarHBondContact O-CG 3.11Å; M201-K205 PolarHBondContact O-N 2.89Å
202Q61.9Low58.9Low120 Ų12081.8 Ų81.856%0.56141%0.414SS*.Hα-helixtrans-69.6-44.7178.6-168.6142.8-7.300111.7M198 L199 M200 L204 K205 E206M198-Q202 WeakPolarHBondContact O-CB 3.33Å; M198-Q202 PolarHBondContact O-N 3.42Å; L199-Q202 PolarHBondContact O-N 3.4Å; M200-Q202 PolarHBondContact O-N 2.94Å; Q202-L204 PolarHBondContact O-N 3.45Å; Q202-K205 WeakPolarHBondContact O-CB 3.34Å; Q202-K205 PolarHBondContact O-N 3.34Å; Q202-E206 WeakPolarHBondContact CG-OE1 3.48Å; Q202-E206 WeakPolarHBondContact O-CG 3.31Å; Q202-E206 PolarHBondContact O-N 3.44Å
203L60.1Low59.3Low85 Ų8575.5 Ų75.545%0.44539%0.392SS..Hα-helixtrans-61.7-41.2174.6-71.4168.2000112.6L199 M200 K205 E206 N207L199-L203 WeakPolarHBondContact O-CG 3.49Å; L199-L203 PolarHBondContact O-N 3.07Å; M200-L203 PolarHBondContact O-N 3.47Å; L203-K205 VanDerWaalsContact C-N 3.35Å; L203-E206 PolarHBondContact O-N 2.99Å; L203-N207 WeakPolarHBondContact O-CB 3.43Å; L203-N207 PolarHBondContact O-N 2.85Å
204L57.5Low59.7Low48 Ų4880.3 Ų80.325%0.25141%0.405SS..Hα-helixtrans-63.9-40.2174.9-76.2170.1000111.9P154 L179 M200 Q202 L208P154-L204 HydrophobicContact CB-CD2 3.9Å; P154-L204 HydrophobicContact CG-CD2 4.06Å; L179-L204 HydrophobicContact CD1-CB 3.72Å; L179-L204 HydrophobicContact CD1-CD1 3.77Å; L179-L204 HydrophobicContact CD1-CG 4.42Å; M200-L204 WeakPolarHBondContact O-CG 3.42Å; M200-L204 PolarHBondContact O-N 3.42Å; Q202-L204 PolarHBondContact O-N 3.45Å; L204-L208 VanDerWaalsContact O-CB 3.28Å; L204-L208 WeakPolarHBondContact O-CB 3.42Å; L204-L208 PolarHBondContact O-N 2.96Å
205K62.6Low59.8Low118 Ų11878.8 Ų78.851%0.51340%0.404SS..Hα-helixtrans-64.9-42.8174.7-77.9176.8179.5-179.20112.1L179 M201 Q202 L203 L208 A209L179-K205 HydrophobicContact CD2-CG 3.73Å; M201-K205 WeakPolarHBondContact O-CB 3.27Å; M201-K205 VanDerWaalsContact O-CG 3.28Å; M201-K205 WeakPolarHBondContact O-CG 3.11Å; M201-K205 PolarHBondContact O-N 2.89Å; Q202-K205 WeakPolarHBondContact O-CB 3.34Å; Q202-K205 PolarHBondContact O-N 3.34Å; L203-K205 VanDerWaalsContact C-N 3.35Å; K205-L208 PolarHBondContact O-N 2.86Å; K205-A209 WeakPolarHBondContact O-CB 3.49Å; K205-A209 PolarHBondContact O-N 3.14Å
206E68.3Low59.5Low101 Ų10175.6 Ų75.647%0.47240%0.398SS..Hα-helixtrans-63.1-45.7177.6-75.1170.8-16700111.2Q202 L203 A209 L210Q202-E206 WeakPolarHBondContact CG-OE1 3.48Å; Q202-E206 WeakPolarHBondContact O-CG 3.31Å; Q202-E206 PolarHBondContact O-N 3.44Å; L203-E206 PolarHBondContact O-N 2.99Å; E206-A209 PolarHBondContact O-N 3.45Å; E206-L210 WeakPolarHBondContact O-CB 3.44Å; E206-L210 PolarHBondContact O-N 3.31Å
207N61.7Low58.9Low57 Ų5772.5 Ų72.531%0.30539%0.394SS..Hα-helixtrans-64.4-43.8175.7-73.1-14.6000112L203 A209 L210 W211L203-N207 WeakPolarHBondContact O-CB 3.43Å; L203-N207 PolarHBondContact O-N 2.85Å; N207-A209 VanDerWaalsContact C-N 3.3Å; N207-A209 PolarHBondContact O-N 3.02Å; N207-L210 PolarHBondContact O-N 3.49Å; N207-W211 HydrophobicContact CB-CD2 4.33Å; N207-W211 HydrophobicContact CB-CE3 4.07Å; N207-W211 HydrophobicContact CB-CH2 3.71Å; N207-W211 HydrophobicContact CB-CZ2 3.95Å; N207-W211 HydrophobicContact CB-CZ3 3.75Å; N207-W211 WeakPolarHBondContact O-CB 3.41Å; N207-W211 VanDerWaalsContact O-CE3 3.26Å; N207-W211 PolarHBondContact O-N 2.87Å
208L60.2Low58.2Low34 Ų3475 Ų7518%0.17842%0.423CS..Hα-helixtrans-58.8-43.2175.1-169.792.1000111.2A175 L204 K205 T212A175-L208 HydrophobicContact CB-CD1 3.34Å; L204-L208 VanDerWaalsContact O-CB 3.28Å; L204-L208 WeakPolarHBondContact O-CB 3.42Å; L204-L208 PolarHBondContact O-N 2.96Å; K205-L208 PolarHBondContact O-N 2.86Å; L208-T212 VanDerWaalsContact O-CB 3.32Å; L208-T212 WeakPolarHBondContact O-CB 3.21Å; L208-T212 PolarHBondContact O-N 3.25Å; L208-T212 PolarHBondContact O-OG1 3.12Å
209A66.2Low56.8Low60 Ų6080.3 Ų80.350%0.49645%0.447SS..Hα-helixtrans-65.2-45.1178.500000111.7K205 E206 N207 T212 S213K205-A209 WeakPolarHBondContact O-CB 3.49Å; K205-A209 PolarHBondContact O-N 3.14Å; E206-A209 PolarHBondContact O-N 3.45Å; N207-A209 VanDerWaalsContact C-N 3.3Å; N207-A209 PolarHBondContact O-N 3.02Å; A209-T212 PolarHBondContact O-N 3.4Å; A209-S213 WeakPolarHBondContact O-CB 3.45Å; A209-S213 PolarHBondContact O-N 3.44Å
210L63.9Low55.6Low86 Ų8680.8 Ų80.845%0.4546%0.455SS..Hα-helixtrans-58.1-52.8176.4-17670.8000110.7E206 N207 T212 S213 E214E206-L210 WeakPolarHBondContact O-CB 3.44Å; E206-L210 PolarHBondContact O-N 3.31Å; N207-L210 PolarHBondContact O-N 3.49Å; L210-T212 PolarHBondContact O-N 2.98Å; L210-S213 PolarHBondContact O-N 3.43Å; L210-S213 VanDerWaalsContact O-N 3.1Å; L210-S213 PolarHBondContact O-OG 3.41Å; L210-E214 WeakPolarHBondContact O-CG 3.39Å; L210-E214 PolarHBondContact O-N 2.94Å
211W61Low54.7Low52 Ų5284 Ų8420%0.19748%0.481CS..Hα-helixtrans-64.8-38.8-179-60-34.8000112.4L158 N207 S213 E214 L215L158-W211 HydrophobicContact CB-CH2 4.45Å; L158-W211 HydrophobicContact CB-CZ3 4.1Å; L158-W211 HydrophobicContact CD1-CD2 4.09Å; L158-W211 HydrophobicContact CD1-CE3 3.26Å; L158-W211 HydrophobicContact CD1-CZ3 3.54Å; L158-W211 HydrophobicContact CD2-CD2 3.25Å; L158-W211 VanDerWaalsContact CD2-CE2 3.47Å; L158-W211 HydrophobicContact CD2-CE3 3.15Å; L158-W211 HydrophobicContact CD2-CG 4Å; L158-W211 HydrophobicContact CD2-CH2 3.47Å; L158-W211 VanDerWaalsContact CD2-CH2 3.47Å; L158-W211 HydrophobicContact CD2-CZ2 3.57Å; L158-W211 HydrophobicContact CD2-CZ3 3.27Å; L158-W211 HydrophobicContact CG-CD2 4.25Å; L158-W211 HydrophobicContact CG-CE3 3.72Å; L158-W211 HydrophobicContact CG-CH2 4.32Å; L158-W211 HydrophobicContact CG-CZ3 3.77Å; N207-W211 HydrophobicContact CB-CD2 4.33Å; N207-W211 HydrophobicContact CB-CE3 4.07Å; N207-W211 HydrophobicContact CB-CH2 3.71Å; N207-W211 HydrophobicContact CB-CZ2 3.95Å; N207-W211 HydrophobicContact CB-CZ3 3.75Å; N207-W211 WeakPolarHBondContact O-CB 3.41Å; N207-W211 VanDerWaalsContact O-CE3 3.26Å; N207-W211 PolarHBondContact O-N 2.87Å; W211-S213 VanDerWaalsContact C-N 3.29Å; W211-S213 PolarHBondContact O-N 3.36Å; W211-E214 PolarHBondContact O-N 2.93Å; W211-L215 WeakPolarHBondContact O-CB 3.45Å; W211-L215 VanDerWaalsContact O-CD1 3.22Å; W211-L215 WeakPolarHBondContact O-CD1 3.3Å; W211-L215 WeakPolarHBondContact O-CG 3.45Å; W211-L215 PolarHBondContact O-N 3.3Å; W211-L215 VanDerWaalsContact O-N 3.07Å
212T59Low53.3Low54 Ų5492.1 Ų92.133%0.33152%0.515SS..Hα-helixtrans-62.2-40.8174.4-53.10000110.6L208 A209 L210 L215 T216L208-T212 VanDerWaalsContact O-CB 3.32Å; L208-T212 WeakPolarHBondContact O-CB 3.21Å; L208-T212 PolarHBondContact O-N 3.25Å; L208-T212 PolarHBondContact O-OG1 3.12Å; A209-T212 PolarHBondContact O-N 3.4Å; L210-T212 PolarHBondContact O-N 2.98Å; T212-L215 PolarHBondContact O-N 3.03Å; T212-T216 HydrophobicContact CG2-CG2 4.33Å; T212-T216 WeakPolarHBondContact O-CG2 3.4Å; T212-T216 PolarHBondContact O-N 3.07Å; T212-T216 PolarHBondContact O-OG1 3.29Å
213S65.6Low51.9Low62 Ų6293.3 Ų93.343%0.43453%0.526SS..Hα-helixtrans-67-37.7179.276.70000113.5A209 L210 W211 L215 T216 G217A209-S213 WeakPolarHBondContact O-CB 3.45Å; A209-S213 PolarHBondContact O-N 3.44Å; L210-S213 PolarHBondContact O-N 3.43Å; L210-S213 VanDerWaalsContact O-N 3.1Å; L210-S213 PolarHBondContact O-OG 3.41Å; W211-S213 VanDerWaalsContact C-N 3.29Å; W211-S213 PolarHBondContact O-N 3.36Å; S213-L215 VanDerWaalsContact C-N 3.31Å; S213-T216 PolarHBondContact O-OG1 3.44Å; S213-G217 PolarHBondContact O-N 2.94Å
214E60.8Low50.6Low133 Ų13396.4 Ų96.462%0.62154%0.543SS*.Hα-helixtrans-67.9-33.2175.7-71.4179.5162.300111.5L210 W211L210-E214 WeakPolarHBondContact O-CG 3.39Å; L210-E214 PolarHBondContact O-N 2.94Å; W211-E214 PolarHBondContact O-N 2.93Å
215L53.3Low49.7Very low79 Ų79102.3 Ų102.341%0.41457%0.574SS.*Hα-helixtrans-81.8-30.2-179.8-67.8165.4000113.4L162 P168 W211 T212 S213 G217L162-L215 HydrophobicContact CD2-CD1 3.76Å; L162-L215 HydrophobicContact CD2-CD2 4.04Å; L162-L215 HydrophobicContact CD2-CG 4.39Å; P168-L215 HydrophobicContact CB-CB 3.86Å; P168-L215 HydrophobicContact CB-CD1 3.18Å; P168-L215 HydrophobicContact CB-CD2 3.5Å; P168-L215 HydrophobicContact CB-CG 3.63Å; P168-L215 HydrophobicContact CG-CD2 4.19Å; W211-L215 WeakPolarHBondContact O-CB 3.45Å; W211-L215 VanDerWaalsContact O-CD1 3.22Å; W211-L215 WeakPolarHBondContact O-CD1 3.3Å; W211-L215 WeakPolarHBondContact O-CG 3.45Å; W211-L215 PolarHBondContact O-N 3.3Å; W211-L215 VanDerWaalsContact O-N 3.07Å; T212-L215 PolarHBondContact O-N 3.03Å; S213-L215 VanDerWaalsContact C-N 3.31Å; L215-G217 VanDerWaalsContact C-N 3.29Å
216T51.5Low48.5Very low97 Ų97102.7 Ų102.760%0.59559%0.586SS**THydrogen-bonded Turntrans-85.84.117655.40000114T212 S213 G218T212-T216 HydrophobicContact CG2-CG2 4.33Å; T212-T216 WeakPolarHBondContact O-CG2 3.4Å; T212-T216 PolarHBondContact O-N 3.07Å; T212-T216 PolarHBondContact O-OG1 3.29Å; S213-T216 PolarHBondContact O-OG1 3.44Å; T216-G218 PolarHBondContact O-N 2.83Å
217G40.7Very low47.1Very low52 Ų52104.3 Ų104.354%0.53660%0.603SS.*THydrogen-bonded Turntrans49.468.3167.500000115S213 L215 E219S213-G217 PolarHBondContact O-N 2.94Å; L215-G217 VanDerWaalsContact C-N 3.29Å; G217-E219 VanDerWaalsContact C-N 3.26Å; G217-E219 PolarHBondContact O-N 3.5Å
218G37.7Very low45.9Very low72 Ų72109.8 Ų109.874%0.74263%0.629SS**THydrogen-bonded Turntrans52.823.115200000119.5T216 T220T216-G218 PolarHBondContact O-N 2.83Å; G218-T220 VanDerWaalsContact C-N 3.34Å; G218-T220 PolarHBondContact O-N 2.71Å
219E31Very low45Very low189 Ų189118 Ų11888%0.88367%0.666SS**  trans-91.166.8169.7-72.8-171.4163.800110.7G217G217-E219 VanDerWaalsContact C-N 3.26Å; G217-E219 PolarHBondContact O-N 3.5Å
220T34Very low44.2Very low128 Ų128122.6 Ų122.679%0.78572%0.72SS**  trans-89100.9157.746.40000108.9G218G218-T220 VanDerWaalsContact C-N 3.34Å; G218-T220 PolarHBondContact O-N 2.71Å
221S33.3Very low43.2Very low104 Ų104124.5 Ų124.573%0.72773%0.733SS**  trans51.591.9145.3620000117.6
222K28.6Very low42.2Very low204 Ų204128.3 Ų128.389%0.88776%0.761SS**  trans-89.699.1135.5-78.9-177.5178.2175.60106.5
223D32Very low41.3Very low145 Ų145132.4 Ų132.478%0.77579%0.785SS**  trans-174.4143.6145.7-91.1-22000108.3
224D33.3Very low39.9Very low150 Ų150136.5 Ų136.580%0.80281%0.806SS**  trans8286.3175.5-53.5-24.6000117.4
225D38.6Very low38.6Very low171 Ų171136.8 Ų136.891%0.91482%0.817SS**  -156.6122.9118.6-100.1-30.1000113.3
226V37.5Very low37.6Very low126 Ų126140.6 Ų140.676%0.76484%0.844SS**  trans-51135.6172.4170.80000112.9
227V39.9Very low36.6Very low136 Ų136143.7 Ų143.782%0.82486%0.862SS**  -160.3121.2126.8179.60000109.4
228M36.5Very low36.3Very low172 Ų172150.8 Ų150.885%0.84789%0.887SS**  trans-77129.8167.7-67.6-94.9-74.600110.1
229E40.6Very low36.2Very low206 Ų206157.3 Ų157.396%0.96390%0.899SS**  trans-169.6118.2147.5-108.9176.9-155.200110
230G48.5Very low36.6Very low157 Ų157154.5 Ų154.5100%1.61990%0.901SS**  trans159.50-179.100000112.4

Retrieved 230 of 230 residues in 458.6 ms (Link to these results)

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