A0A087XFM8_POEFO Loading...

Anaphase promoting complex subunit 7

AlphaFold DB , UniProt , Accession A0A087XFM8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 565 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
1M55.3Low85.3Confident185 Ų18559.8 Ų59.891%0.91130%0.302SS*.  0119.80-116.4-177.6-88.500107.7D5M1-D5 HydrophobicContact CG-CB 4.43Å
2N79.8Confident85.8Confident58 Ų5862.1 Ų62.131%0.3134%0.337SS..  trans-83.2158.8-180-165-21.9000110.1V4 D5 H6 Q41N2-V4 PolarHBondContact O-N 3.4Å; N2-D5 WeakPolarHBondContact CB-OD2 3.49Å; N2-D5 PolarHBondContact N-OD2 3.29Å; N2-D5 WeakPolarHBondContact O-CB 3.42Å; N2-D5 PolarHBondContact O-N 3.49Å; N2-H6 PolarHBondContact O-N 3.24Å; N2-H6 PolarHBondContact O-ND1 3.1Å; N2-Q41 PolarHBondContact ND2-NE2 3.25Å
3V87.2Confident86.4Confident71 Ų7162.6 Ų62.643%0.4336%0.355SS..Hα-helixtrans-56.3-36.7174.7176.90000110.9D5 H6 V7 L26V3-D5 VanDerWaalsContact C-N 3.31Å; V3-D5 PolarHBondContact O-N 3.23Å; V3-H6 PolarHBondContact O-N 2.81Å; V3-V7 WeakPolarHBondContact O-CG2 3.46Å; V3-V7 PolarHBondContact O-N 3.07Å; V3-V7 VanDerWaalsContact O-N 3.11Å; V3-L26 HydrophobicContact CG1-CD1 3.69Å; V3-L26 HydrophobicContact CG1-CD2 3.82Å; V3-L26 HydrophobicContact CG1-CG 4.41Å
4V86.4Confident86.8Confident2 Ų260.6 Ų60.61%0.01236%0.355CS..Hα-helixtrans-67.8-29.7176.8-177.10000112.5N2 V7 R8 F37 Q41 Q44N2-V4 PolarHBondContact O-N 3.4Å; V4-V7 PolarHBondContact O-N 2.99Å; V4-R8 PolarHBondContact O-N 2.9Å; V4-F37 HydrophobicContact CG2-CD1 4.26Å; V4-F37 HydrophobicContact CG2-CE1 4.27Å; V4-Q41 HydrophobicContact CB-CG 4.4Å; V4-Q41 HydrophobicContact CG1-CG 4.47Å; V4-Q41 HydrophobicContact CG2-CB 4.09Å; V4-Q41 HydrophobicContact CG2-CG 4.14Å; V4-Q44 HydrophobicContact CG1-CB 3.97Å
5D86.9Confident87.3Confident44 Ų4462.1 Ų62.124%0.23536%0.36CS..Hα-helixtrans-66.3-41.5173.8-65.2-49.4000110.6M1 N2 V3 V7 R8 D9M1-D5 HydrophobicContact CG-CB 4.43Å; N2-D5 WeakPolarHBondContact CB-OD2 3.49Å; N2-D5 PolarHBondContact N-OD2 3.29Å; N2-D5 WeakPolarHBondContact O-CB 3.42Å; N2-D5 PolarHBondContact O-N 3.49Å; V3-D5 VanDerWaalsContact C-N 3.31Å; V3-D5 PolarHBondContact O-N 3.23Å; D5-V7 VanDerWaalsContact C-N 3.34Å; D5-V7 PolarHBondContact O-N 3Å; D5-R8 WeakPolarHBondContact O-CB 3.17Å; D5-R8 PolarHBondContact O-N 3.11Å; D5-R8 IonicContact OD1-CZ 3.08Å; D5-R8 IonicContact OD1-NH1 2.72Å; D5-R8 PolarHBondContact OD1-NH1 3.4Å; D5-R8 IonicContact OD1-NH2 2.69Å; D5-D9 PolarHBondContact O-N 3.36Å
6H89.4Confident87.6Confident94 Ų9462.6 Ų62.644%0.43536%0.355SS..Hα-helixtrans-64.8-38.3175.3-65.484.8000112N2 V3 R8 D9 M10N2-H6 PolarHBondContact O-N 3.24Å; N2-H6 PolarHBondContact O-ND1 3.1Å; V3-H6 PolarHBondContact O-N 2.81Å; H6-R8 VanDerWaalsContact C-N 3.33Å; H6-D9 PolarHBondContact O-N 3.26Å; H6-M10 WeakPolarHBondContact O-CG 3.38Å; H6-M10 PolarHBondContact O-N 3.48Å
7V90.9Very high88Confident0 Ų063.2 Ų63.20%036%0.364CS..Hα-helixtrans-61.4-43.6173.4176.50000110.8V3 V4 D5 M10 A11 V19 L22 L26 L45 Y48V3-V7 WeakPolarHBondContact O-CG2 3.46Å; V3-V7 PolarHBondContact O-N 3.07Å; V3-V7 VanDerWaalsContact O-N 3.11Å; V4-V7 PolarHBondContact O-N 2.99Å; D5-V7 VanDerWaalsContact C-N 3.34Å; D5-V7 PolarHBondContact O-N 3Å; V7-M10 HydrophobicContact CG2-CE 4.49Å; V7-M10 PolarHBondContact O-N 3.35Å; V7-A11 WeakPolarHBondContact O-CB 2.89Å; V7-A11 PolarHBondContact O-N 2.7Å; V7-V19 HydrophobicContact CG1-CG1 4.16Å; V7-L22 HydrophobicContact CG2-CD2 3.8Å; V7-L22 HydrophobicContact CG2-CG 4.27Å; V7-L26 HydrophobicContact CG2-CD1 3.66Å; V7-L45 HydrophobicContact CG1-CD1 4.37Å; V7-L45 HydrophobicContact CG2-CD1 4.48Å; V7-Y48 HydrophobicContact CG1-CD2 3.88Å; V7-Y48 HydrophobicContact CG1-CG 4.32Å
8R90.6Very high88.3Confident72 Ų7264.3 Ų64.327%0.27237%0.368SS..Hα-helixtrans-59.8-47.6174.5172.9-168.271.8-139.6-7.1110.9V4 D5 H6 M10 A11 A12 Y48V4-R8 PolarHBondContact O-N 2.9Å; D5-R8 WeakPolarHBondContact O-CB 3.17Å; D5-R8 PolarHBondContact O-N 3.11Å; D5-R8 IonicContact OD1-CZ 3.08Å; D5-R8 IonicContact OD1-NH1 2.72Å; D5-R8 PolarHBondContact OD1-NH1 3.4Å; D5-R8 IonicContact OD1-NH2 2.69Å; H6-R8 VanDerWaalsContact C-N 3.33Å; R8-M10 VanDerWaalsContact C-N 3.32Å; R8-M10 PolarHBondContact O-N 2.99Å; R8-A11 WeakPolarHBondContact O-CB 3.2Å; R8-A11 PolarHBondContact O-N 3.3Å; R8-A11 VanDerWaalsContact O-N 3.15Å; R8-A12 WeakPolarHBondContact O-CB 3.29Å; R8-A12 PolarHBondContact O-N 2.86Å; R8-Y48 HydrophobicContact CB-CE2 3.75Å; R8-Y48 HydrophobicContact CG-CE2 4.38Å; R8-Y48 WeakPolarHBondContact CG-OH 3.35Å
9D91.1Very high88.6Confident72 Ų7260.9 Ų60.939%0.38535%0.349SS..Hα-helixtrans-67.1-36.4-174.8-60-15.3000110.8D5 H6 A12 A13D5-D9 PolarHBondContact O-N 3.36Å; H6-D9 PolarHBondContact O-N 3.26Å; D9-A12 PolarHBondContact O-N 3.48Å; D9-A13 WeakPolarHBondContact O-CB 3.49Å; D9-A13 PolarHBondContact O-N 3.3Å
10M91.7Very high88.9Confident48 Ų4860.9 Ų60.924%0.23634%0.343CS..Hα-helixtrans-66.2-39.2170.4-71.2-169.1-61.200113.2H6 V7 R8 A12 A13 G14 L15 V19 L22H6-M10 WeakPolarHBondContact O-CG 3.38Å; H6-M10 PolarHBondContact O-N 3.48Å; V7-M10 HydrophobicContact CG2-CE 4.49Å; V7-M10 PolarHBondContact O-N 3.35Å; R8-M10 VanDerWaalsContact C-N 3.32Å; R8-M10 PolarHBondContact O-N 2.99Å; M10-A12 VanDerWaalsContact C-N 3.34Å; M10-A13 CarbonylContact O-C 3.52Å; M10-A13 PolarHBondContact O-N 3.22Å; M10-G14 PolarHBondContact O-N 3.32Å; M10-L15 PolarHBondContact O-N 3.33Å; M10-L15 VanDerWaalsContact O-N 3.08Å; M10-V19 HydrophobicContact CB-CG2 3.61Å; M10-V19 HydrophobicContact CE-CG2 4.43Å; M10-L22 HydrophobicContact CE-CB 4.45Å; M10-L22 HydrophobicContact CE-CD2 3.35Å; M10-L22 HydrophobicContact CE-CG 4.48Å
11A89.6Confident89.2Confident12 Ų1263.3 Ų63.310%0.09935%0.354CS..Hα-helixtrans-66.4-38.1175.400000111.3V7 R8 A13 G14 V19 Y48V7-A11 WeakPolarHBondContact O-CB 2.89Å; V7-A11 PolarHBondContact O-N 2.7Å; R8-A11 WeakPolarHBondContact O-CB 3.2Å; R8-A11 PolarHBondContact O-N 3.3Å; R8-A11 VanDerWaalsContact O-N 3.15Å; A11-A13 VanDerWaalsContact C-N 3.29Å; A11-A13 PolarHBondContact O-N 3.42Å; A11-G14 PolarHBondContact O-N 3.38Å; A11-G14 VanDerWaalsContact O-N 3.11Å; A11-V19 HydrophobicContact CB-CG2 4.19Å; A11-Y48 HydrophobicContact CB-CD1 3.86Å; A11-Y48 HydrophobicContact CB-CE1 4.33Å; A11-Y48 HydrophobicContact CB-CG 4.25Å
12A90.6Very high91Very high87 Ų8757.2 Ų57.272%0.71933%0.325SS*.Hα-helixtrans-65.7-32.3173.500000112.2R8 D9 M10 G14R8-A12 WeakPolarHBondContact O-CB 3.29Å; R8-A12 PolarHBondContact O-N 2.86Å; D9-A12 PolarHBondContact O-N 3.48Å; M10-A12 VanDerWaalsContact C-N 3.34Å; A12-G14 PolarHBondContact O-N 2.98Å
13A93.6Very high91.7Very high69 Ų6954.5 Ų54.557%0.5731%0.31SS*.THydrogen-bonded Turntrans-76.9-1.6172.700000114.2D9 M10 A11 L15D9-A13 WeakPolarHBondContact O-CB 3.49Å; D9-A13 PolarHBondContact O-N 3.3Å; M10-A13 CarbonylContact O-C 3.52Å; M10-A13 PolarHBondContact O-N 3.22Å; A11-A13 VanDerWaalsContact C-N 3.29Å; A11-A13 PolarHBondContact O-N 3.42Å; A13-L15 VanDerWaalsContact C-N 3.32Å; A13-L15 HydrophobicContact CB-CD1 4.31Å; A13-L15 HydrophobicContact CB-CG 4.26Å; A13-L15 PolarHBondContact O-N 2.67Å
14G91.9Very high92Very high35 Ų3553.7 Ų53.736%0.36131%0.308SS..THydrogen-bonded Turntrans74.115.8179.500000114.9M10 A11 A12 Y16M10-G14 PolarHBondContact O-N 3.32Å; A11-G14 PolarHBondContact O-N 3.38Å; A11-G14 VanDerWaalsContact O-N 3.11Å; A12-G14 PolarHBondContact O-N 2.98Å; G14-Y16 WeakPolarHBondContact O-CD2 3.4Å; G14-Y16 PolarHBondContact O-N 3.37Å
15L94.6Very high92.4Very high82 Ų8258.4 Ų58.443%0.42933%0.332SS..  trans-82.157.6-178.7-64.3173.3000112M10 A13 S17 N18 V19M10-L15 PolarHBondContact O-N 3.33Å; M10-L15 VanDerWaalsContact O-N 3.08Å; A13-L15 VanDerWaalsContact C-N 3.32Å; A13-L15 HydrophobicContact CB-CD1 4.31Å; A13-L15 HydrophobicContact CB-CG 4.26Å; A13-L15 PolarHBondContact O-N 2.67Å; L15-S17 PolarHBondContact O-N 3.41Å; L15-N18 HydrophobicContact CB-CB 4.43Å; L15-N18 PolarHBondContact O-N 2.62Å; L15-V19 WeakPolarHBondContact O-CG2 3.24Å; L15-V19 PolarHBondContact O-N 2.92Å
16Y92.4Very high92.7Very high71 Ų7157.3 Ų57.328%0.27833%0.327SS..Hα-helixtrans-60.6-37.9-169.4-61.6-66000114.2G14 N18 V19 R20 A52 H55G14-Y16 WeakPolarHBondContact O-CD2 3.4Å; G14-Y16 PolarHBondContact O-N 3.37Å; Y16-N18 PolarHBondContact O-N 3.46Å; Y16-V19 PolarHBondContact O-N 3.46Å; Y16-R20 PolarHBondContact O-N 3.33Å; Y16-A52 WeakPolarHBondContact O-CB 3.49Å; Y16-H55 AromaticContact CD1-CD2 3.33Å; Y16-H55 WeakPolarHBondContact CD1-CD2 3.4Å; Y16-H55 AromaticContact CD1-NE2 3.93Å; Y16-H55 HydrophobicContact CD2-CB 4.1Å; Y16-H55 AromaticContact CD2-CD2 3.53Å; Y16-H55 AromaticContact CD2-CG 3.58Å; Y16-H55 AromaticContact CD2-ND1 3.93Å; Y16-H55 AromaticContact CD2-NE2 3.91Å; Y16-H55 AromaticContact CE1-CD2 3.34Å; Y16-H55 WeakPolarHBondContact CE1-CD2 3.3Å; Y16-H55 AromaticContact CE1-NE2 3.41Å; Y16-H55 WeakPolarHBondContact CE1-NE2 3.35Å; Y16-H55 AromaticContact CE2-CD2 3.53Å; Y16-H55 AromaticContact CE2-CE1 3.55Å; Y16-H55 AromaticContact CE2-CG 3.84Å; Y16-H55 AromaticContact CE2-ND1 3.83Å; Y16-H55 AromaticContact CE2-NE2 3.39Å; Y16-H55 WeakPolarHBondContact CE2-NE2 3.38Å; Y16-H55 HydrophobicContact CG-CB 4.01Å; Y16-H55 AromaticContact CG-CD2 3.43Å; Y16-H55 VanDerWaalsContact CG-CD2 3.43Å; Y16-H55 AromaticContact CG-CG 3.73Å; Y16-H55 AromaticContact CZ-CD2 3.44Å; Y16-H55 VanDerWaalsContact CZ-CD2 3.44Å; Y16-H55 AromaticContact CZ-CE1 3.71Å; Y16-H55 AromaticContact CZ-NE2 3.1Å; Y16-H55 PolarHBondContact OH-NE2 2.98Å
17S93.5Very high92.8Very high72 Ų7253.5 Ų53.550%0.50331%0.309SS..Hα-helixtrans-61.3-43.7177.254.80000112.6L15 R20 I21L15-S17 PolarHBondContact O-N 3.41Å; S17-R20 PolarHBondContact O-N 3.11Å; S17-I21 PolarHBondContact O-N 3.36Å
18N94.3Very high92.9Very high83 Ų8356.9 Ų56.944%0.44433%0.33SS..Hα-helixtrans-69.2-42.3176.9-65.7-57.4000111.5L15 Y16 R20 I21 L22L15-N18 HydrophobicContact CB-CB 4.43Å; L15-N18 PolarHBondContact O-N 2.62Å; Y16-N18 PolarHBondContact O-N 3.46Å; N18-R20 VanDerWaalsContact C-N 3.29Å; N18-R20 PolarHBondContact O-N 3.11Å; N18-I21 PolarHBondContact O-N 3.23Å; N18-L22 PolarHBondContact O-N 3.34Å
19V94.2Very high93Very high0 Ų058 Ų580%034%0.339CS..Hα-helixtrans-60.2-40.3175.9171.70000110.6V7 M10 A11 L15 Y16 I21 S23 A52V7-V19 HydrophobicContact CG1-CG1 4.16Å; M10-V19 HydrophobicContact CB-CG2 3.61Å; M10-V19 HydrophobicContact CE-CG2 4.43Å; A11-V19 HydrophobicContact CB-CG2 4.19Å; L15-V19 WeakPolarHBondContact O-CG2 3.24Å; L15-V19 PolarHBondContact O-N 2.92Å; Y16-V19 PolarHBondContact O-N 3.46Å; V19-I21 PolarHBondContact O-N 2.95Å; V19-S23 WeakPolarHBondContact O-CA 3.49Å; V19-S23 WeakPolarHBondContact O-CB 3.26Å; V19-S23 PolarHBondContact O-N 3.16Å; V19-S23 PolarHBondContact O-OG 3.46Å; V19-A52 HydrophobicContact CB-CB 4.49Å; V19-A52 HydrophobicContact CG1-CB 4.29Å
20R94.1Very high93Very high61 Ų6154.8 Ų54.823%0.2332%0.323CS..Hα-helixtrans-57.4-50.9177.5-178168.9171.6152.10.3112Y16 S17 N18 S23 S24 A52 D56 E58Y16-R20 PolarHBondContact O-N 3.33Å; S17-R20 PolarHBondContact O-N 3.11Å; N18-R20 VanDerWaalsContact C-N 3.29Å; N18-R20 PolarHBondContact O-N 3.11Å; R20-S23 PolarHBondContact O-OG 3.23Å; R20-S24 WeakPolarHBondContact O-CB 3.36Å; R20-S24 PolarHBondContact O-N 3.1Å; R20-A52 HydrophobicContact CB-CB 3.78Å; R20-D56 WeakPolarHBondContact CD-OD2 3.49Å; R20-D56 IonicContact CZ-OD2 3.48Å; R20-D56 IonicContact NE-OD2 2.84Å; R20-D56 IonicContact NH1-OD2 3.53Å; R20-D56 PolarHBondContact NH1-OD2 3.04Å; R20-E58 IonicContact CZ-OE1 2.72Å; R20-E58 VanDerWaalsContact CZ-OE1 3.27Å; R20-E58 IonicContact CZ-OE2 3.38Å; R20-E58 IonicContact NH1-OE1 2.68Å; R20-E58 PolarHBondContact NH1-OE1 3.04Å; R20-E58 IonicContact NH1-OE2 2.79Å; R20-E58 VanDerWaalsContact NH2-CD 3.35Å; R20-E58 IonicContact NH2-OE1 3.42Å; R20-E58 PolarHBondContact NH2-OE1 3.11Å; R20-E58 IonicContact NH2-OE2 3.99Å; R20-E58 PolarHBondContact NH2-OE2 3.29Å
21I94.8Very high92.9Very high111 Ų11157.8 Ų57.857%0.56934%0.34SS*.Hα-helixtrans-63.6-53.2-178-62.5169.6000109.7S17 N18 V19 S23 S24 L25S17-I21 PolarHBondContact O-N 3.36Å; N18-I21 PolarHBondContact O-N 3.23Å; V19-I21 PolarHBondContact O-N 2.95Å; I21-S23 PolarHBondContact O-N 3.4Å; I21-S24 PolarHBondContact O-N 3.21Å; I21-L25 HydrophobicContact CG2-CD1 4.45Å; I21-L25 WeakPolarHBondContact O-CG 3.45Å; I21-L25 PolarHBondContact O-N 2.92Å; I21-L25 VanDerWaalsContact O-N 3.15Å
22L93.9Very high93Very high58 Ų5863.3 Ų63.330%0.30437%0.367SS..Hα-helixtrans-64.2-44.2-176.9-175.261.9000111.7V7 M10 N18 S24 L25 L26V7-L22 HydrophobicContact CG2-CD2 3.8Å; V7-L22 HydrophobicContact CG2-CG 4.27Å; M10-L22 HydrophobicContact CE-CB 4.45Å; M10-L22 HydrophobicContact CE-CD2 3.35Å; M10-L22 HydrophobicContact CE-CG 4.48Å; N18-L22 PolarHBondContact O-N 3.34Å; L22-S24 VanDerWaalsContact C-N 3.34Å; L22-S24 PolarHBondContact O-N 3.09Å; L22-L25 PolarHBondContact O-N 3.36Å; L22-L26 HydrophobicContact CD1-CD1 4.29Å; L22-L26 HydrophobicContact CD1-CG 4.38Å; L22-L26 HydrophobicContact CD2-CD1 4.46Å; L22-L26 HydrophobicContact CG-CD1 3.89Å; L22-L26 HydrophobicContact CG-CG 4.41Å; L22-L26 VanDerWaalsContact O-CG 3.24Å; L22-L26 WeakPolarHBondContact O-CG 3.16Å; L22-L26 PolarHBondContact O-N 3.21Å
23S93.2Very high92.9Very high0 Ų063.4 Ų63.40%036%0.356CS..Hα-helixtrans-67.1-34.2179.163.30000112.7V19 R20 I21 L26 L27 H49V19-S23 WeakPolarHBondContact O-CA 3.49Å; V19-S23 WeakPolarHBondContact O-CB 3.26Å; V19-S23 PolarHBondContact O-N 3.16Å; V19-S23 PolarHBondContact O-OG 3.46Å; R20-S23 PolarHBondContact O-OG 3.23Å; I21-S23 PolarHBondContact O-N 3.4Å; S23-L26 PolarHBondContact O-N 2.96Å; S23-L27 WeakPolarHBondContact O-CB 3.37Å; S23-L27 WeakPolarHBondContact O-CG 3.49Å; S23-L27 PolarHBondContact O-N 3.16Å; S23-H49 WeakPolarHBondContact OG-CA 3.43Å; S23-H49 WeakPolarHBondContact OG-CB 3.49Å; S23-H49 PolarHBondContact OG-ND1 3.5Å
24S94.8Very high92.4Very high54 Ų5464.1 Ų64.138%0.37836%0.355SS..Hα-helixtrans-60.6-48.7173.6-174.40000111.2R20 I21 L22 L26 L27 T28R20-S24 WeakPolarHBondContact O-CB 3.36Å; R20-S24 PolarHBondContact O-N 3.1Å; I21-S24 PolarHBondContact O-N 3.21Å; L22-S24 VanDerWaalsContact C-N 3.34Å; L22-S24 PolarHBondContact O-N 3.09Å; S24-L26 PolarHBondContact O-N 3.28Å; S24-L27 PolarHBondContact O-N 3.44Å; S24-T28 WeakPolarHBondContact O-CG2 3.45Å; S24-T28 PolarHBondContact O-N 2.92Å
25L94.4Very high92Very high101 Ų10171.6 Ų71.653%0.52938%0.38SS..Hα-helixtrans-59.8-48.4176.2-65.9173.5000111.3I21 L22 L27 T28 M29I21-L25 HydrophobicContact CG2-CD1 4.45Å; I21-L25 WeakPolarHBondContact O-CG 3.45Å; I21-L25 PolarHBondContact O-N 2.92Å; I21-L25 VanDerWaalsContact O-N 3.15Å; L22-L25 PolarHBondContact O-N 3.36Å; L25-L27 VanDerWaalsContact C-N 3.3Å; L25-L27 PolarHBondContact O-N 3.24Å; L25-T28 PolarHBondContact O-N 2.95Å; L25-T28 PolarHBondContact O-OG1 3.11Å; L25-M29 WeakPolarHBondContact O-CG 3.3Å; L25-M29 PolarHBondContact O-N 2.92Å
26L93.1Very high91.6Very high22 Ų2271.8 Ų71.812%0.11538%0.381CS..Hα-helixtrans-64.2-33179.5-65.9171.2000112.7V3 V7 L22 S23 S24 M29 S30 F37 L45V3-L26 HydrophobicContact CG1-CD1 3.69Å; V3-L26 HydrophobicContact CG1-CD2 3.82Å; V3-L26 HydrophobicContact CG1-CG 4.41Å; V7-L26 HydrophobicContact CG2-CD1 3.66Å; L22-L26 HydrophobicContact CD1-CD1 4.29Å; L22-L26 HydrophobicContact CD1-CG 4.38Å; L22-L26 HydrophobicContact CD2-CD1 4.46Å; L22-L26 HydrophobicContact CG-CD1 3.89Å; L22-L26 HydrophobicContact CG-CG 4.41Å; L22-L26 VanDerWaalsContact O-CG 3.24Å; L22-L26 WeakPolarHBondContact O-CG 3.16Å; L22-L26 PolarHBondContact O-N 3.21Å; S23-L26 PolarHBondContact O-N 2.96Å; S24-L26 PolarHBondContact O-N 3.28Å; L26-M29 PolarHBondContact O-N 3.07Å; L26-S30 WeakPolarHBondContact O-CB 3.48Å; L26-S30 PolarHBondContact O-N 2.9Å; L26-F37 HydrophobicContact CD2-CZ 4.04Å; L26-L45 HydrophobicContact CB-CD1 3.91Å; L26-L45 HydrophobicContact CB-CD2 3.59Å; L26-L45 HydrophobicContact CB-CG 4.36Å; L26-L45 HydrophobicContact CD1-CD1 3.9Å
27L92.3Very high91.3Very high14 Ų1469.4 Ų69.47%0.07337%0.372CS..Hα-helixtrans-69-40.3174.9-76.9170.5000111.4S23 S24 L25 M29 S30 N31 L45 L46 H49S23-L27 WeakPolarHBondContact O-CB 3.37Å; S23-L27 WeakPolarHBondContact O-CG 3.49Å; S23-L27 PolarHBondContact O-N 3.16Å; S24-L27 PolarHBondContact O-N 3.44Å; L25-L27 VanDerWaalsContact C-N 3.3Å; L25-L27 PolarHBondContact O-N 3.24Å; L27-M29 VanDerWaalsContact C-N 3.35Å; L27-S30 WeakPolarHBondContact O-CB 3.29Å; L27-S30 PolarHBondContact O-N 3.48Å; L27-N31 WeakPolarHBondContact O-CB 3.3Å; L27-N31 PolarHBondContact O-N 3.03Å; L27-N31 PolarHBondContact O-ND2 3.01Å; L27-L45 HydrophobicContact CB-CD2 4.48Å; L27-L45 HydrophobicContact CD2-CB 4.41Å; L27-L45 HydrophobicContact CD2-CD2 3.67Å; L27-L45 HydrophobicContact CD2-CG 3.91Å; L27-L45 HydrophobicContact CG-CD2 3.74Å; L27-L45 HydrophobicContact CG-CG 3.91Å; L27-L46 HydrophobicContact CD1-CD2 4.14Å; L27-L46 HydrophobicContact CD2-CD2 3.58Å; L27-L46 HydrophobicContact CD2-CG 3.83Å; L27-H49 HydrophobicContact CD1-CB 3.68Å; L27-H49 WeakPolarHBondContact CD1-CD2 3.37Å; L27-H49 VanDerWaalsContact CD1-CG 3.46Å
28T93.1Very high91Very high70 Ų7068.3 Ų68.343%0.42937%0.365SS..Hα-helixtrans-62.8-42.8173.962.60000111.5S24 L25 S30 N31 N32S24-T28 WeakPolarHBondContact O-CG2 3.45Å; S24-T28 PolarHBondContact O-N 2.92Å; L25-T28 PolarHBondContact O-N 2.95Å; L25-T28 PolarHBondContact O-OG1 3.11Å; T28-S30 VanDerWaalsContact C-N 3.32Å; T28-S30 PolarHBondContact O-N 2.81Å; T28-N31 PolarHBondContact O-N 3.23Å; T28-N32 PolarHBondContact O-N 2.99Å
29M91.3Very high90.7Very high95 Ų9566.8 Ų66.847%0.46836%0.36SS..Hα-helixtrans-58.3-43.7172.7-68.9-70.8-72.300111.6L25 L26 L27 N31 N33 L36L25-M29 WeakPolarHBondContact O-CG 3.3Å; L25-M29 PolarHBondContact O-N 2.92Å; L26-M29 PolarHBondContact O-N 3.07Å; L27-M29 VanDerWaalsContact C-N 3.35Å; M29-N31 VanDerWaalsContact C-N 3.34Å; M29-N31 PolarHBondContact O-N 3.47Å; M29-N33 PolarHBondContact O-N 2.95Å; M29-L36 HydrophobicContact CB-CD2 3.92Å; M29-L36 HydrophobicContact CE-CD2 4.29Å
30S91.2Very high90.3Very high6 Ų667.8 Ų67.84%0.04237%0.367CS..Hα-helixtrans-67.3-30177.6-173.80000114L26 L27 T28 N33 K42L26-S30 WeakPolarHBondContact O-CB 3.48Å; L26-S30 PolarHBondContact O-N 2.9Å; L27-S30 WeakPolarHBondContact O-CB 3.29Å; L27-S30 PolarHBondContact O-N 3.48Å; T28-S30 VanDerWaalsContact C-N 3.32Å; T28-S30 PolarHBondContact O-N 2.81Å; S30-N33 CarbonylContact O-C 3.5Å; S30-K42 VanDerWaalsContact OG-CE 3.24Å; S30-K42 WeakPolarHBondContact OG-CE 3.38Å
31N89.3Confident90.1Very high111 Ų11167 Ų6759%0.59437%0.367SS*.Hα-helixtrans-79-40.4-179.8-72.2-16.9000110.9L27 T28 M29L27-N31 WeakPolarHBondContact O-CB 3.3Å; L27-N31 PolarHBondContact O-N 3.03Å; L27-N31 PolarHBondContact O-ND2 3.01Å; T28-N31 PolarHBondContact O-N 3.23Å; M29-N31 VanDerWaalsContact C-N 3.34Å; M29-N31 PolarHBondContact O-N 3.47Å
32N92.1Very high89.8Confident127 Ų12763.6 Ų63.668%0.67935%0.347SS*.Hα-helixtrans-72.4-35.6177.4-67.4-8.4000111.8T28T28-N32 PolarHBondContact O-N 2.99Å
33N89.6Confident89.8Confident90 Ų9060.8 Ų60.848%0.48133%0.333SS..SBendtrans-12189.9178.2-66.1-33.8000110.7M29 S30 E35 L36M29-N33 PolarHBondContact O-N 2.95Å; S30-N33 CarbonylContact O-C 3.5Å; N33-E35 PolarHBondContact O-N 3.18Å; N33-E35 VanDerWaalsContact O-N 3.12Å; N33-L36 HydrophobicContact CB-CB 4.08Å; N33-L36 VanDerWaalsContact O-CB 3.31Å; N33-L36 WeakPolarHBondContact O-CB 3.45Å; N33-L36 PolarHBondContact O-N 3.38Å; N33-L36 VanDerWaalsContact O-N 3.16Å
34P81.6Confident89.7Confident84 Ų8461.5 Ų61.555%0.54534%0.336SS..THydrogen-bonded Turntrans-61.7-23-173.4-25.735000115.1K42P34-K42 WeakPolarHBondContact O-CE 3.44Å; P34-K42 PolarHBondContact O-NZ 3.08Å
35E84.4Confident89.6Confident192 Ų19258.9 Ų58.990%0.89732%0.318SS*.THydrogen-bonded Turntrans-89.6-8.1-177.9-61.2-174.3167.200113.6N33 F37N33-E35 PolarHBondContact O-N 3.18Å; N33-E35 VanDerWaalsContact O-N 3.12Å; E35-F37 VanDerWaalsContact C-N 3.33Å; E35-F37 PolarHBondContact O-N 3.33Å
36L85.8Confident89.6Confident85 Ų8554.9 Ų54.945%0.44530%0.297SS..SBendtrans-63.8-34.3-172.2-175.165.4000113.8M29 N33M29-L36 HydrophobicContact CB-CD2 3.92Å; M29-L36 HydrophobicContact CE-CD2 4.29Å; N33-L36 HydrophobicContact CB-CB 4.08Å; N33-L36 VanDerWaalsContact O-CB 3.31Å; N33-L36 WeakPolarHBondContact O-CB 3.45Å; N33-L36 PolarHBondContact O-N 3.38Å; N33-L36 VanDerWaalsContact O-N 3.16Å
37F86.1Confident89.7Confident21 Ų2154 Ų549%0.09229%0.293CS..SBendtrans-124.9142.1-178.7-62.7-69.9000111.1V4 L26 E35 Q41 K42V4-F37 HydrophobicContact CG2-CD1 4.26Å; V4-F37 HydrophobicContact CG2-CE1 4.27Å; L26-F37 HydrophobicContact CD2-CZ 4.04Å; E35-F37 VanDerWaalsContact C-N 3.33Å; E35-F37 PolarHBondContact O-N 3.33Å; F37-Q41 HydrophobicContact CB-CB 4.14Å; F37-K42 HydrophobicContact CB-CG 3.79Å; F37-K42 WeakPolarHBondContact O-CE 3.35Å
38S87.7Confident89.8Confident49 Ų4954.4 Ų54.434%0.34329%0.294SS..  trans-63.5153.5173.673.70000111.1A40 Q41 K42S38-A40 PolarHBondContact O-N 3.11Å; S38-Q41 WeakPolarHBondContact O-CB 3.45Å; S38-Q41 PolarHBondContact O-N 2.62Å; S38-Q41 VanDerWaalsContact OG-CD 3.24Å; S38-Q41 WeakPolarHBondContact OG-CG 3.32Å; S38-Q41 PolarHBondContact OG-N 3.18Å; S38-Q41 PolarHBondContact OG-OE1 3.46Å; S38-K42 WeakPolarHBondContact O-CG 3.41Å; S38-K42 PolarHBondContact O-N 3.42Å
39P87.1Confident89.9Confident52 Ų5251.7 Ų51.734%0.33828%0.276SS..Hα-helixtrans-54.5-30.7178-29.336.3000114.5Y43 Q72 L76P39-Y43 PolarHBondContact O-N 3.19Å; P39-Q72 PolarHBondContact O-NE2 3.12Å; P39-L76 HydrophobicContact CB-CD1 4.11Å
40A87.2Confident90.1Very high20 Ų2047.1 Ų47.117%0.16525%0.253CS..Hα-helixtrans-71.8-41.7175.900000112.6S38 Y43 Q44 L76 L98S38-A40 PolarHBondContact O-N 3.11Å; A40-Y43 WeakPolarHBondContact O-CB 3.32Å; A40-Y43 PolarHBondContact O-N 2.97Å; A40-Q44 PolarHBondContact O-N 2.57Å; A40-L76 HydrophobicContact CB-CD1 4.08Å; A40-L76 HydrophobicContact CB-CD2 4.4Å; A40-L98 HydrophobicContact CB-CD2 4.15Å
41Q88.8Confident90.3Very high45 Ų4547.7 Ų47.721%0.2126%0.256CS..Hα-helixtrans-65.9-40.2174.9-77.7159.70.100111.9N2 V4 F37 S38 Y43 Q44 L45N2-Q41 PolarHBondContact ND2-NE2 3.25Å; V4-Q41 HydrophobicContact CB-CG 4.4Å; V4-Q41 HydrophobicContact CG1-CG 4.47Å; V4-Q41 HydrophobicContact CG2-CB 4.09Å; V4-Q41 HydrophobicContact CG2-CG 4.14Å; F37-Q41 HydrophobicContact CB-CB 4.14Å; S38-Q41 WeakPolarHBondContact O-CB 3.45Å; S38-Q41 PolarHBondContact O-N 2.62Å; S38-Q41 VanDerWaalsContact OG-CD 3.24Å; S38-Q41 WeakPolarHBondContact OG-CG 3.32Å; S38-Q41 PolarHBondContact OG-N 3.18Å; S38-Q41 PolarHBondContact OG-OE1 3.46Å; Q41-Y43 VanDerWaalsContact C-N 3.3Å; Q41-Y43 PolarHBondContact O-N 2.94Å; Q41-Q44 PolarHBondContact O-N 3.26Å; Q41-L45 WeakPolarHBondContact O-CB 3.46Å; Q41-L45 PolarHBondContact O-N 3.38Å
42K89.9Confident90.6Very high39 Ų3942.4 Ų42.417%0.1723%0.227CC..Hα-helixtrans-60.3-41.3173.6-66.6-172.3-174.5-169.40112S30 P34 F37 S38 L45 L46 Q72S30-K42 VanDerWaalsContact OG-CE 3.24Å; S30-K42 WeakPolarHBondContact OG-CE 3.38Å; P34-K42 WeakPolarHBondContact O-CE 3.44Å; P34-K42 PolarHBondContact O-NZ 3.08Å; F37-K42 HydrophobicContact CB-CG 3.79Å; F37-K42 WeakPolarHBondContact O-CE 3.35Å; S38-K42 WeakPolarHBondContact O-CG 3.41Å; S38-K42 PolarHBondContact O-N 3.42Å; K42-L45 PolarHBondContact O-N 3.24Å; K42-L46 WeakPolarHBondContact O-CB 3.49Å; K42-L46 WeakPolarHBondContact O-CG 3.2Å; K42-L46 PolarHBondContact O-N 2.84Å; K42-Q72 HydrophobicContact CB-CG 4.25Å
43Y92.6Very high90.7Very high0 Ų036.4 Ų36.40%020%0.195CC..Hα-helixtrans-62-49.1175.1171.1-103.6000111.6P39 A40 Q41 L45 L46 V47 A69 K73 L98 P99P39-Y43 PolarHBondContact O-N 3.19Å; A40-Y43 WeakPolarHBondContact O-CB 3.32Å; A40-Y43 PolarHBondContact O-N 2.97Å; Q41-Y43 VanDerWaalsContact C-N 3.3Å; Q41-Y43 PolarHBondContact O-N 2.94Å; Y43-L45 VanDerWaalsContact C-N 3.34Å; Y43-L45 PolarHBondContact O-N 3.35Å; Y43-L46 PolarHBondContact O-N 3.07Å; Y43-V47 HydrophobicContact CD2-CG2 4.23Å; Y43-V47 HydrophobicContact CE1-CG2 4.25Å; Y43-V47 HydrophobicContact CE2-CG2 3.8Å; Y43-V47 WeakPolarHBondContact O-CG2 3.38Å; Y43-V47 PolarHBondContact O-N 2.99Å; Y43-A69 HydrophobicContact CD2-CB 4.1Å; Y43-A69 VanDerWaalsContact CD2-O 3.24Å; Y43-A69 WeakPolarHBondContact CD2-O 3.43Å; Y43-A69 HydrophobicContact CE2-CB 4.11Å; Y43-K73 HydrophobicContact CD2-CB 3.9Å; Y43-K73 HydrophobicContact CE1-CD 4.47Å; Y43-K73 HydrophobicContact CE2-CB 3.77Å; Y43-K73 HydrophobicContact CE2-CD 4.33Å; Y43-K73 HydrophobicContact CE2-CG 4.26Å; Y43-L98 HydrophobicContact CD1-CD2 4.13Å; Y43-P99 HydrophobicContact CE1-CB 4.19Å; Y43-P99 HydrophobicContact CE1-CG 4.46Å; Y43-P99 VanDerWaalsContact CE1-O 3.25Å; Y43-P99 WeakPolarHBondContact CE1-O 3.31Å; Y43-P99 PolarHBondContact OH-O 3.18Å
44Q91.4Very high90.9Very high14 Ų1433.9 Ų33.97%0.06518%0.18CC..Hα-helixtrans-56.6-48176.2-76.3171.9-36.500111.8V4 A40 Q41 L46 V47 Y48 S97 L98V4-Q44 HydrophobicContact CG1-CB 3.97Å; A40-Q44 PolarHBondContact O-N 2.57Å; Q41-Q44 PolarHBondContact O-N 3.26Å; Q44-L46 PolarHBondContact O-N 3.26Å; Q44-V47 PolarHBondContact O-N 3.45Å; Q44-Y48 HydrophobicContact CB-CD2 4.34Å; Q44-Y48 HydrophobicContact CB-CE2 3.87Å; Q44-Y48 HydrophobicContact CG-CE2 4.46Å; Q44-Y48 WeakPolarHBondContact O-CD2 3.31Å; Q44-Y48 PolarHBondContact O-N 2.9Å; Q44-S97 PolarHBondContact NE2-O 3.37Å; Q44-L98 HydrophobicContact CG-CD2 3.68Å
45L92.4Very high91.5Very high0 Ų033.9 Ų33.90%017%0.173CC..Hα-helixtrans-61.4-42.8-179.4-170.368000112.4V7 L26 L27 Q41 K42 Y43 H49V7-L45 HydrophobicContact CG1-CD1 4.37Å; V7-L45 HydrophobicContact CG2-CD1 4.48Å; L26-L45 HydrophobicContact CB-CD1 3.91Å; L26-L45 HydrophobicContact CB-CD2 3.59Å; L26-L45 HydrophobicContact CB-CG 4.36Å; L26-L45 HydrophobicContact CD1-CD1 3.9Å; L27-L45 HydrophobicContact CB-CD2 4.48Å; L27-L45 HydrophobicContact CD2-CB 4.41Å; L27-L45 HydrophobicContact CD2-CD2 3.67Å; L27-L45 HydrophobicContact CD2-CG 3.91Å; L27-L45 HydrophobicContact CG-CD2 3.74Å; L27-L45 HydrophobicContact CG-CG 3.91Å; Q41-L45 WeakPolarHBondContact O-CB 3.46Å; Q41-L45 PolarHBondContact O-N 3.38Å; K42-L45 PolarHBondContact O-N 3.24Å; Y43-L45 VanDerWaalsContact C-N 3.34Å; Y43-L45 PolarHBondContact O-N 3.35Å; L45-H49 VanDerWaalsContact O-CB 3.23Å; L45-H49 WeakPolarHBondContact O-CB 3.39Å; L45-H49 PolarHBondContact O-N 3.5Å
46L94.5Very high91.9Very high17 Ų1728 Ų289%0.08915%0.148CC..Hα-helixtrans-63.7-40.8175.7-77.7169.3000112.2L27 K42 Y43 Q44 A50 M68 A69 Q72L27-L46 HydrophobicContact CD1-CD2 4.14Å; L27-L46 HydrophobicContact CD2-CD2 3.58Å; L27-L46 HydrophobicContact CD2-CG 3.83Å; K42-L46 WeakPolarHBondContact O-CB 3.49Å; K42-L46 WeakPolarHBondContact O-CG 3.2Å; K42-L46 PolarHBondContact O-N 2.84Å; Y43-L46 PolarHBondContact O-N 3.07Å; Q44-L46 PolarHBondContact O-N 3.26Å; L46-A50 VanDerWaalsContact O-CB 3.27Å; L46-A50 WeakPolarHBondContact O-CB 3.38Å; L46-A50 PolarHBondContact O-N 2.92Å; L46-M68 HydrophobicContact CD1-CB 4.41Å; L46-M68 HydrophobicContact CD2-CB 4.48Å; L46-A69 HydrophobicContact CB-CB 3.88Å; L46-Q72 HydrophobicContact CD1-CB 4.21Å
47V95.2Very high92.3Very high4 Ų431.4 Ų31.42%0.02416%0.159CC..Hα-helixtrans-66.3-48.1177.9174.60000110.9Y43 Q44 H49 A50 D51 A69 P99 V104Y43-V47 HydrophobicContact CD2-CG2 4.23Å; Y43-V47 HydrophobicContact CE1-CG2 4.25Å; Y43-V47 HydrophobicContact CE2-CG2 3.8Å; Y43-V47 WeakPolarHBondContact O-CG2 3.38Å; Y43-V47 PolarHBondContact O-N 2.99Å; Q44-V47 PolarHBondContact O-N 3.45Å; V47-H49 VanDerWaalsContact C-N 3.32Å; V47-H49 PolarHBondContact O-N 3.3Å; V47-A50 PolarHBondContact O-N 2.94Å; V47-D51 WeakPolarHBondContact O-CB 3.43Å; V47-D51 VanDerWaalsContact O-CG 3.27Å; V47-D51 PolarHBondContact O-N 3.17Å; V47-A69 HydrophobicContact CG2-CB 3.84Å; V47-P99 HydrophobicContact CB-CB 4.4Å; V47-P99 HydrophobicContact CB-CG 4.29Å; V47-P99 HydrophobicContact CG1-CB 3.86Å; V47-P99 HydrophobicContact CG1-CG 4.04Å; V47-P99 HydrophobicContact CG2-CB 4.4Å; V47-V104 HydrophobicContact CG1-CG2 4.09Å; V47-V104 HydrophobicContact CG2-CG2 3.73Å
48Y94.8Very high92.7Very high22 Ų2234.1 Ų34.19%0.08617%0.172CC..Hα-helixtrans-65.7-35.1179.2-60.5-42.7000112.7V7 R8 A11 Q44 A52 P99V7-Y48 HydrophobicContact CG1-CD2 3.88Å; V7-Y48 HydrophobicContact CG1-CG 4.32Å; R8-Y48 HydrophobicContact CB-CE2 3.75Å; R8-Y48 HydrophobicContact CG-CE2 4.38Å; R8-Y48 WeakPolarHBondContact CG-OH 3.35Å; A11-Y48 HydrophobicContact CB-CD1 3.86Å; A11-Y48 HydrophobicContact CB-CE1 4.33Å; A11-Y48 HydrophobicContact CB-CG 4.25Å; Q44-Y48 HydrophobicContact CB-CD2 4.34Å; Q44-Y48 HydrophobicContact CB-CE2 3.87Å; Q44-Y48 HydrophobicContact CG-CE2 4.46Å; Q44-Y48 WeakPolarHBondContact O-CD2 3.31Å; Q44-Y48 PolarHBondContact O-N 2.9Å; Y48-A52 PolarHBondContact O-N 3.37Å; Y48-P99 HydrophobicContact CE1-CG 4.23Å
49H95.4Very high93.1Very high12 Ų1234.1 Ų34.16%0.05617%0.165CC..Hα-helixtrans-64.3-44.7172.5-174.162.7000111.9S23 L27 L45 V47 A52 I53S23-H49 WeakPolarHBondContact OG-CA 3.43Å; S23-H49 WeakPolarHBondContact OG-CB 3.49Å; S23-H49 PolarHBondContact OG-ND1 3.5Å; L27-H49 HydrophobicContact CD1-CB 3.68Å; L27-H49 WeakPolarHBondContact CD1-CD2 3.37Å; L27-H49 VanDerWaalsContact CD1-CG 3.46Å; L45-H49 VanDerWaalsContact O-CB 3.23Å; L45-H49 WeakPolarHBondContact O-CB 3.39Å; L45-H49 PolarHBondContact O-N 3.5Å; V47-H49 VanDerWaalsContact C-N 3.32Å; V47-H49 PolarHBondContact O-N 3.3Å; H49-A52 PolarHBondContact O-N 3.2Å; H49-I53 WeakPolarHBondContact NE2-CD1 3.26Å; H49-I53 WeakPolarHBondContact O-CG1 3.49Å; H49-I53 PolarHBondContact O-N 2.86Å; H49-I53 VanDerWaalsContact O-N 3.08Å
50A95.9Very high93.4Very high0 Ų041.6 Ų41.60%019%0.186CC..Hα-helixtrans-64.8-39.9177.600000112.1L46 V47 A52 I53 F54 K65 Y66L46-A50 VanDerWaalsContact O-CB 3.27Å; L46-A50 WeakPolarHBondContact O-CB 3.38Å; L46-A50 PolarHBondContact O-N 2.92Å; V47-A50 PolarHBondContact O-N 2.94Å; A50-A52 PolarHBondContact O-N 3.28Å; A50-I53 PolarHBondContact O-N 3.4Å; A50-F54 WeakPolarHBondContact O-CB 3.4Å; A50-F54 PolarHBondContact O-N 3.25Å; A50-K65 HydrophobicContact CB-CB 3.68Å; A50-Y66 HydrophobicContact CB-CD1 3.35Å; A50-Y66 HydrophobicContact CB-CD2 4.07Å; A50-Y66 HydrophobicContact CB-CE1 3.31Å; A50-Y66 HydrophobicContact CB-CE2 4.02Å; A50-Y66 HydrophobicContact CB-CG 3.73Å
51D94.9Very high93.8Very high17 Ų1743.2 Ų43.29%0.09119%0.192CC..Hα-helixtrans-58.4-46.6173.3-72.9-8.9000111.2V47 I53 F54 H55 Y66 K107V47-D51 WeakPolarHBondContact O-CB 3.43Å; V47-D51 VanDerWaalsContact O-CG 3.27Å; V47-D51 PolarHBondContact O-N 3.17Å; D51-I53 PolarHBondContact O-N 3.44Å; D51-F54 WeakPolarHBondContact O-CB 3.41Å; D51-F54 PolarHBondContact O-N 2.96Å; D51-H55 PolarHBondContact O-CD2 3.26Å; D51-H55 PolarHBondContact O-N 2.86Å; D51-Y66 VanDerWaalsContact CA-OH 3.3Å; D51-Y66 WeakPolarHBondContact CA-OH 3.44Å; D51-Y66 PolarHBondContact N-OH 3.04Å; D51-Y66 VanDerWaalsContact OD1-CE1 3.29Å; D51-Y66 WeakPolarHBondContact OD1-CE1 3.46Å; D51-Y66 PolarHBondContact OD1-OH 3.17Å; D51-K107 VanDerWaalsContact OD1-CD 3.29Å; D51-K107 WeakPolarHBondContact OD1-CD 3.46Å; D51-K107 IonicContact OD1-NZ 3.37Å; D51-K107 PolarHBondContact OD1-NZ 3.42Å; D51-K107 IonicContact OD2-NZ 2.72Å; D51-K107 PolarHBondContact OD2-NZ 2.84Å
52A94.8Very high94.1Very high0 Ų041.1 Ų41.10%018%0.182CC..Hα-helixtrans-62.1-42.6178.200000112.6Y16 V19 R20 Y48 H49 A50 F54 H55 D56Y16-A52 WeakPolarHBondContact O-CB 3.49Å; V19-A52 HydrophobicContact CB-CB 4.49Å; V19-A52 HydrophobicContact CG1-CB 4.29Å; R20-A52 HydrophobicContact CB-CB 3.78Å; Y48-A52 PolarHBondContact O-N 3.37Å; H49-A52 PolarHBondContact O-N 3.2Å; A50-A52 PolarHBondContact O-N 3.28Å; A52-F54 VanDerWaalsContact C-N 3.31Å; A52-F54 PolarHBondContact O-N 2.9Å; A52-H55 PolarHBondContact O-N 3.4Å; A52-D56 PolarHBondContact O-N 3.04Å; A52-D56 VanDerWaalsContact O-N 3.17Å
53I94.6Very high94.3Very high1 Ų139.4 Ų39.41%0.00518%0.176CC..Hα-helixtrans-64.4-36.2175.3-66.9166.6000111.5H49 A50 D51 D56 K57 E58 N61 A62 K65H49-I53 WeakPolarHBondContact NE2-CD1 3.26Å; H49-I53 WeakPolarHBondContact O-CG1 3.49Å; H49-I53 PolarHBondContact O-N 2.86Å; H49-I53 VanDerWaalsContact O-N 3.08Å; A50-I53 PolarHBondContact O-N 3.4Å; D51-I53 PolarHBondContact O-N 3.44Å; I53-D56 PolarHBondContact O-N 3.42Å; I53-K57 PolarHBondContact O-N 3.26Å; I53-E58 HydrophobicContact CG2-CB 3.53Å; I53-E58 WeakPolarHBondContact CG2-O 3.32Å; I53-E58 PolarHBondContact O-N 3.47Å; I53-N61 HydrophobicContact CG2-CB 3.75Å; I53-A62 HydrophobicContact CB-CB 4.32Å; I53-A62 HydrophobicContact CG2-CB 3.91Å; I53-K65 HydrophobicContact CD1-CG 3.92Å
54F94.8Very high94.4Very high37 Ų3742.7 Ų42.716%0.16220%0.197CC..Hα-helixtrans-61.9-43.5175.7178.5-96.4000111.6A50 D51 A52 D56 K57 Y59 A62 E110 C111 I114A50-F54 WeakPolarHBondContact O-CB 3.4Å; A50-F54 PolarHBondContact O-N 3.25Å; D51-F54 WeakPolarHBondContact O-CB 3.41Å; D51-F54 PolarHBondContact O-N 2.96Å; A52-F54 VanDerWaalsContact C-N 3.31Å; A52-F54 PolarHBondContact O-N 2.9Å; F54-D56 VanDerWaalsContact C-N 3.29Å; F54-D56 PolarHBondContact O-N 3.5Å; F54-K57 PolarHBondContact O-N 3.13Å; F54-Y59 AromaticContact CD2-CD1 3.84Å; F54-Y59 HydrophobicContact CD2-CD1 3.84Å; F54-Y59 HydrophobicContact CD2-CE1 4.04Å; F54-Y59 AromaticContact CE2-CD1 3.88Å; F54-Y59 HydrophobicContact CE2-CD1 3.88Å; F54-Y59 AromaticContact CE2-CE1 3.9Å; F54-Y59 HydrophobicContact CE2-CE1 3.9Å; F54-Y59 HydrophobicContact CZ-CE1 4.43Å; F54-A62 HydrophobicContact CB-CB 4.09Å; F54-E110 HydrophobicContact CE2-CB 4.24Å; F54-E110 HydrophobicContact CZ-CB 4.32Å; F54-C111 WeakPolarHBondContact CD2-SG 3.21Å; F54-I114 HydrophobicContact CE2-CD1 4.34Å; F54-I114 HydrophobicContact CZ-CD1 4.48Å
55H93.8Very high94.6Very high84 Ų8444.5 Ų44.539%0.38921%0.205SC..Hα-helixtrans-65.2-31175.9-76-72.7000113.1Y16 D51 A52 K57Y16-H55 AromaticContact CD1-CD2 3.33Å; Y16-H55 WeakPolarHBondContact CD1-CD2 3.4Å; Y16-H55 AromaticContact CD1-NE2 3.93Å; Y16-H55 HydrophobicContact CD2-CB 4.1Å; Y16-H55 AromaticContact CD2-CD2 3.53Å; Y16-H55 AromaticContact CD2-CG 3.58Å; Y16-H55 AromaticContact CD2-ND1 3.93Å; Y16-H55 AromaticContact CD2-NE2 3.91Å; Y16-H55 AromaticContact CE1-CD2 3.34Å; Y16-H55 WeakPolarHBondContact CE1-CD2 3.3Å; Y16-H55 AromaticContact CE1-NE2 3.41Å; Y16-H55 WeakPolarHBondContact CE1-NE2 3.35Å; Y16-H55 AromaticContact CE2-CD2 3.53Å; Y16-H55 AromaticContact CE2-CE1 3.55Å; Y16-H55 AromaticContact CE2-CG 3.84Å; Y16-H55 AromaticContact CE2-ND1 3.83Å; Y16-H55 AromaticContact CE2-NE2 3.39Å; Y16-H55 WeakPolarHBondContact CE2-NE2 3.38Å; Y16-H55 HydrophobicContact CG-CB 4.01Å; Y16-H55 AromaticContact CG-CD2 3.43Å; Y16-H55 VanDerWaalsContact CG-CD2 3.43Å; Y16-H55 AromaticContact CG-CG 3.73Å; Y16-H55 AromaticContact CZ-CD2 3.44Å; Y16-H55 VanDerWaalsContact CZ-CD2 3.44Å; Y16-H55 AromaticContact CZ-CE1 3.71Å; Y16-H55 AromaticContact CZ-NE2 3.1Å; Y16-H55 PolarHBondContact OH-NE2 2.98Å; D51-H55 PolarHBondContact O-CD2 3.26Å; D51-H55 PolarHBondContact O-N 2.86Å; A52-H55 PolarHBondContact O-N 3.4Å; H55-K57 PolarHBondContact O-N 3.37Å
56D93.3Very high94.8Very high70 Ų7044.5 Ų44.537%0.37421%0.205SC..THydrogen-bonded Turntrans-76.75.6173.3-66-20.3000113.6R20 A52 I53 F54 E58R20-D56 WeakPolarHBondContact CD-OD2 3.49Å; R20-D56 IonicContact CZ-OD2 3.48Å; R20-D56 IonicContact NE-OD2 2.84Å; R20-D56 IonicContact NH1-OD2 3.53Å; R20-D56 PolarHBondContact NH1-OD2 3.04Å; A52-D56 PolarHBondContact O-N 3.04Å; A52-D56 VanDerWaalsContact O-N 3.17Å; I53-D56 PolarHBondContact O-N 3.42Å; F54-D56 VanDerWaalsContact C-N 3.29Å; F54-D56 PolarHBondContact O-N 3.5Å; D56-E58 PolarHBondContact O-N 3.03Å
57K93.8Very high94.7Very high156 Ų15645.6 Ų45.668%0.67821%0.214SC*.THydrogen-bonded Turntrans64.518.2179.5-49.4-179-179.5176.70114.6I53 F54 H55 Y59I53-K57 PolarHBondContact O-N 3.26Å; F54-K57 PolarHBondContact O-N 3.13Å; H55-K57 PolarHBondContact O-N 3.37Å; K57-Y59 VanDerWaalsContact C-N 3.3Å; K57-Y59 HydrophobicContact CB-CE2 3.83Å; K57-Y59 WeakPolarHBondContact O-CD2 3.09Å; K57-Y59 VanDerWaalsContact O-CE2 3.3Å; K57-Y59 WeakPolarHBondContact O-CE2 3.44Å; K57-Y59 PolarHBondContact O-N 3.02Å; K57-Y59 VanDerWaalsContact O-N 3.13Å
58E94.9Very high94.7Very high78 Ų7848.7 Ų48.736%0.36423%0.229SC..  trans-87.662.8174.3-78.7-179.9-137.400111.5R20 I53 D56 R60 N61 A62R20-E58 IonicContact CZ-OE1 2.72Å; R20-E58 VanDerWaalsContact CZ-OE1 3.27Å; R20-E58 IonicContact CZ-OE2 3.38Å; R20-E58 IonicContact NH1-OE1 2.68Å; R20-E58 PolarHBondContact NH1-OE1 3.04Å; R20-E58 IonicContact NH1-OE2 2.79Å; R20-E58 VanDerWaalsContact NH2-CD 3.35Å; R20-E58 IonicContact NH2-OE1 3.42Å; R20-E58 PolarHBondContact NH2-OE1 3.11Å; R20-E58 IonicContact NH2-OE2 3.99Å; R20-E58 PolarHBondContact NH2-OE2 3.29Å; I53-E58 HydrophobicContact CG2-CB 3.53Å; I53-E58 WeakPolarHBondContact CG2-O 3.32Å; I53-E58 PolarHBondContact O-N 3.47Å; D56-E58 PolarHBondContact O-N 3.03Å; E58-R60 VanDerWaalsContact C-N 3.3Å; E58-R60 PolarHBondContact O-N 3.46Å; E58-R60 VanDerWaalsContact O-N 3.16Å; E58-N61 HydrophobicContact CB-CB 4.24Å; E58-N61 PolarHBondContact O-N 3.12Å; E58-N61 VanDerWaalsContact O-N 3.1Å; E58-N61 PolarHBondContact OE2-ND2 3.48Å; E58-A62 PolarHBondContact O-N 3.39Å
59Y94.8Very high94.7Very high49 Ų4947.7 Ų47.719%0.19223%0.225CC..Hα-helixtrans-59.6-33.8-168.1-54.3-67.3000114.8F54 K57 A62 A63 I114F54-Y59 AromaticContact CD2-CD1 3.84Å; F54-Y59 HydrophobicContact CD2-CD1 3.84Å; F54-Y59 HydrophobicContact CD2-CE1 4.04Å; F54-Y59 AromaticContact CE2-CD1 3.88Å; F54-Y59 HydrophobicContact CE2-CD1 3.88Å; F54-Y59 AromaticContact CE2-CE1 3.9Å; F54-Y59 HydrophobicContact CE2-CE1 3.9Å; F54-Y59 HydrophobicContact CZ-CE1 4.43Å; K57-Y59 VanDerWaalsContact C-N 3.3Å; K57-Y59 HydrophobicContact CB-CE2 3.83Å; K57-Y59 WeakPolarHBondContact O-CD2 3.09Å; K57-Y59 VanDerWaalsContact O-CE2 3.3Å; K57-Y59 WeakPolarHBondContact O-CE2 3.44Å; K57-Y59 PolarHBondContact O-N 3.02Å; K57-Y59 VanDerWaalsContact O-N 3.13Å; Y59-A62 PolarHBondContact O-N 2.85Å; Y59-A63 WeakPolarHBondContact O-CB 3.44Å; Y59-A63 PolarHBondContact O-N 2.98Å; Y59-I114 HydrophobicContact CD1-CD1 3.83Å; Y59-I114 HydrophobicContact CD1-CG2 4.46Å; Y59-I114 HydrophobicContact CD2-CB 4.32Å; Y59-I114 HydrophobicContact CD2-CG2 3.55Å; Y59-I114 HydrophobicContact CE1-CD1 3.41Å; Y59-I114 VanDerWaalsContact CE1-CD1 3.41Å; Y59-I114 HydrophobicContact CE1-CG2 4.36Å; Y59-I114 HydrophobicContact CE2-CB 4.43Å; Y59-I114 HydrophobicContact CE2-CD1 4.4Å; Y59-I114 HydrophobicContact CE2-CG2 3.42Å; Y59-I114 VanDerWaalsContact CE2-CG2 3.42Å; Y59-I114 HydrophobicContact CG-CB 4.38Å; Y59-I114 HydrophobicContact CG-CD1 4.48Å; Y59-I114 HydrophobicContact CG-CG2 4.08Å
60R94.3Very high94.6Very high209 Ų20948.4 Ų48.479%0.78923%0.23SC*.Hα-helixtrans-69.2-39.1178.9-168.4173.6-174171.81.7112E58 C64 L115E58-R60 VanDerWaalsContact C-N 3.3Å; E58-R60 PolarHBondContact O-N 3.46Å; E58-R60 VanDerWaalsContact O-N 3.16Å; R60-C64 PolarHBondContact O-N 3.4Å; R60-L115 HydrophobicContact CB-CD1 4.25Å
61N94.4Very high94.4Very high54 Ų5454.6 Ų54.629%0.28926%0.258SS..Hα-helixtrans-70.4-44.1176.2-173.813.1000109.9I53 E58 A63 C64 K65I53-N61 HydrophobicContact CG2-CB 3.75Å; E58-N61 HydrophobicContact CB-CB 4.24Å; E58-N61 PolarHBondContact O-N 3.12Å; E58-N61 VanDerWaalsContact O-N 3.1Å; E58-N61 PolarHBondContact OE2-ND2 3.48Å; N61-A63 PolarHBondContact O-N 3Å; N61-C64 WeakPolarHBondContact O-CB 3.3Å; N61-C64 PolarHBondContact O-N 2.9Å; N61-C64 VanDerWaalsContact O-N 3.16Å; N61-K65 WeakPolarHBondContact O-CG 3.27Å; N61-K65 PolarHBondContact O-N 3.34Å
62A95Very high94.2Very high0 Ų055.7 Ų55.70%026%0.263CS..Hα-helixtrans-56-50.7175.800000111.8I53 F54 E58 Y59 C64 K65 Y66I53-A62 HydrophobicContact CB-CB 4.32Å; I53-A62 HydrophobicContact CG2-CB 3.91Å; F54-A62 HydrophobicContact CB-CB 4.09Å; E58-A62 PolarHBondContact O-N 3.39Å; Y59-A62 PolarHBondContact O-N 2.85Å; A62-C64 VanDerWaalsContact C-N 3.29Å; A62-C64 PolarHBondContact O-N 3.1Å; A62-K65 PolarHBondContact O-N 3.35Å; A62-K65 VanDerWaalsContact O-N 3.14Å; A62-Y66 HydrophobicContact CB-CD2 4.37Å; A62-Y66 HydrophobicContact CB-CE2 4.07Å; A62-Y66 WeakPolarHBondContact O-CD2 3.26Å; A62-Y66 PolarHBondContact O-N 3.2Å
63A94.1Very high93.9Very high4 Ų457.2 Ų57.23%0.03327%0.27CS..Hα-helixtrans-57.8-38.5177.800000113.1Y59 N61 S67 C111 Y112Y59-A63 WeakPolarHBondContact O-CB 3.44Å; Y59-A63 PolarHBondContact O-N 2.98Å; N61-A63 PolarHBondContact O-N 3Å; A63-S67 WeakPolarHBondContact O-CB 3.43Å; A63-S67 PolarHBondContact O-N 3.44Å; A63-S67 PolarHBondContact O-OG 3.29Å; A63-C111 HydrophobicContact CB-CB 4.03Å; A63-Y112 HydrophobicContact CB-CE1 3.93Å
64C95.1Very high93.6Very high68 Ų6863.7 Ų63.746%0.45930%0.298SS..Hα-helixtrans-64.2-49.1175-176.60000111.5R60 N61 A62 Y66 S67 M68R60-C64 PolarHBondContact O-N 3.4Å; N61-C64 WeakPolarHBondContact O-CB 3.3Å; N61-C64 PolarHBondContact O-N 2.9Å; N61-C64 VanDerWaalsContact O-N 3.16Å; A62-C64 VanDerWaalsContact C-N 3.29Å; A62-C64 PolarHBondContact O-N 3.1Å; C64-Y66 PolarHBondContact O-N 3.13Å; C64-S67 WeakPolarHBondContact O-CB 3.43Å; C64-S67 PolarHBondContact O-N 3.07Å; C64-S67 VanDerWaalsContact O-N 3.14Å; C64-M68 WeakPolarHBondContact O-CG 3.5Å; C64-M68 PolarHBondContact O-N 3.23Å
65K95.4Very high93.2Very high52 Ų5265.2 Ų65.223%0.22631%0.31CS..Hα-helixtrans-64.6-39179.1-62.7-56.1-176.9-175.30112.5A50 I53 N61 A62 S67 M68 A69A50-K65 HydrophobicContact CB-CB 3.68Å; I53-K65 HydrophobicContact CD1-CG 3.92Å; N61-K65 WeakPolarHBondContact O-CG 3.27Å; N61-K65 PolarHBondContact O-N 3.34Å; A62-K65 PolarHBondContact O-N 3.35Å; A62-K65 VanDerWaalsContact O-N 3.14Å; K65-S67 VanDerWaalsContact C-N 3.35Å; K65-M68 HydrophobicContact CD-SD 4.06Å; K65-M68 WeakPolarHBondContact O-CB 3.36Å; K65-M68 PolarHBondContact O-N 3.37Å; K65-A69 PolarHBondContact O-N 2.86Å
66Y96.2Very high92.8Very high0 Ų062.5 Ų62.50%030%0.298CS..Hα-helixtrans-63.7-39.2171.9-71.8-53.3000112.4A50 D51 A62 C64 M68 A69 L70 V104 K107 I108A50-Y66 HydrophobicContact CB-CD1 3.35Å; A50-Y66 HydrophobicContact CB-CD2 4.07Å; A50-Y66 HydrophobicContact CB-CE1 3.31Å; A50-Y66 HydrophobicContact CB-CE2 4.02Å; A50-Y66 HydrophobicContact CB-CG 3.73Å; D51-Y66 VanDerWaalsContact CA-OH 3.3Å; D51-Y66 WeakPolarHBondContact CA-OH 3.44Å; D51-Y66 PolarHBondContact N-OH 3.04Å; D51-Y66 VanDerWaalsContact OD1-CE1 3.29Å; D51-Y66 WeakPolarHBondContact OD1-CE1 3.46Å; D51-Y66 PolarHBondContact OD1-OH 3.17Å; A62-Y66 HydrophobicContact CB-CD2 4.37Å; A62-Y66 HydrophobicContact CB-CE2 4.07Å; A62-Y66 WeakPolarHBondContact O-CD2 3.26Å; A62-Y66 PolarHBondContact O-N 3.2Å; C64-Y66 PolarHBondContact O-N 3.13Å; Y66-M68 VanDerWaalsContact C-N 3.33Å; Y66-M68 PolarHBondContact O-N 3.32Å; Y66-A69 WeakPolarHBondContact O-CA 3.31Å; Y66-A69 WeakPolarHBondContact O-CB 3.46Å; Y66-A69 PolarHBondContact O-N 3.04Å; Y66-A69 VanDerWaalsContact O-N 3.12Å; Y66-L70 PolarHBondContact O-N 3.36Å; Y66-V104 HydrophobicContact CD1-CG1 3.76Å; Y66-V104 HydrophobicContact CG-CG1 4.19Å; Y66-K107 HydrophobicContact CD2-CB 4.47Å; Y66-K107 HydrophobicContact CE1-CB 4.31Å; Y66-K107 HydrophobicContact CE1-CD 4.14Å; Y66-K107 HydrophobicContact CE2-CB 3.85Å; Y66-K107 WeakPolarHBondContact OH-CD 3.29Å; Y66-I108 HydrophobicContact CD2-CG1 4.05Å; Y66-I108 HydrophobicContact CG-CG1 3.93Å
67S94.4Very high92.2Very high40 Ų4062 Ų6228%0.2830%0.296SS..Hα-helixtrans-63.3-40.4175.7-62.80000111.7A63 C64 K65 A69 L70 Q71A63-S67 WeakPolarHBondContact O-CB 3.43Å; A63-S67 PolarHBondContact O-N 3.44Å; A63-S67 PolarHBondContact O-OG 3.29Å; C64-S67 WeakPolarHBondContact O-CB 3.43Å; C64-S67 PolarHBondContact O-N 3.07Å; C64-S67 VanDerWaalsContact O-N 3.14Å; K65-S67 VanDerWaalsContact C-N 3.35Å; S67-A69 VanDerWaalsContact C-N 3.33Å; S67-L70 PolarHBondContact O-N 3.17Å; S67-Q71 WeakPolarHBondContact O-CG 3.49Å; S67-Q71 PolarHBondContact O-N 3.43Å
68M93.9Very high91.5Very high70 Ų7062.1 Ų62.135%0.34530%0.296SS..Hα-helixtrans-61.7-41171.1-65.3175.670.100111.5L46 C64 K65 Y66 L70 Q71 Q72L46-M68 HydrophobicContact CD1-CB 4.41Å; L46-M68 HydrophobicContact CD2-CB 4.48Å; C64-M68 WeakPolarHBondContact O-CG 3.5Å; C64-M68 PolarHBondContact O-N 3.23Å; K65-M68 HydrophobicContact CD-SD 4.06Å; K65-M68 WeakPolarHBondContact O-CB 3.36Å; K65-M68 PolarHBondContact O-N 3.37Å; Y66-M68 VanDerWaalsContact C-N 3.33Å; Y66-M68 PolarHBondContact O-N 3.32Å; M68-L70 VanDerWaalsContact C-N 3.35Å; M68-L70 PolarHBondContact O-N 3.33Å; M68-Q71 WeakPolarHBondContact O-CB 3.48Å; M68-Q71 PolarHBondContact O-N 2.9Å; M68-Q72 PolarHBondContact O-N 2.99Å
69A94.4Very high90.2Very high0 Ų061.5 Ų61.50%030%0.298CS..Hα-helixtrans-60.7-42.6175.100000111.7Y43 L46 V47 K65 Y66 S67 Q71 Q72 K73Y43-A69 HydrophobicContact CD2-CB 4.1Å; Y43-A69 VanDerWaalsContact CD2-O 3.24Å; Y43-A69 WeakPolarHBondContact CD2-O 3.43Å; Y43-A69 HydrophobicContact CE2-CB 4.11Å; L46-A69 HydrophobicContact CB-CB 3.88Å; V47-A69 HydrophobicContact CG2-CB 3.84Å; K65-A69 PolarHBondContact O-N 2.86Å; Y66-A69 WeakPolarHBondContact O-CA 3.31Å; Y66-A69 WeakPolarHBondContact O-CB 3.46Å; Y66-A69 PolarHBondContact O-N 3.04Å; Y66-A69 VanDerWaalsContact O-N 3.12Å; S67-A69 VanDerWaalsContact C-N 3.33Å; A69-Q71 PolarHBondContact O-N 3.49Å; A69-Q72 WeakPolarHBondContact O-CB 3.33Å; A69-Q72 PolarHBondContact O-N 3.44Å; A69-K73 PolarHBondContact O-N 3.24Å
70L93.1Very high88.5Confident28 Ų2862 Ų6215%0.14731%0.308CS..Hα-helixtrans-64.6-37.6175.9-68.4-176.5000112.7Y66 S67 M68 K73 K74 E101 V104 K105 I108Y66-L70 PolarHBondContact O-N 3.36Å; S67-L70 PolarHBondContact O-N 3.17Å; M68-L70 VanDerWaalsContact C-N 3.35Å; M68-L70 PolarHBondContact O-N 3.33Å; L70-K73 PolarHBondContact O-N 3.24Å; L70-K74 WeakPolarHBondContact O-CG 3.37Å; L70-K74 PolarHBondContact O-N 3.05Å; L70-E101 HydrophobicContact CD2-CG 3.65Å; L70-V104 HydrophobicContact CD2-CB 4.2Å; L70-V104 HydrophobicContact CD2-CG1 3.83Å; L70-V104 HydrophobicContact CG-CG1 4Å; L70-K105 HydrophobicContact CD1-CG 3.89Å; L70-K105 HydrophobicContact CD2-CG 4.27Å; L70-I108 HydrophobicContact CD1-CD1 3.44Å; L70-I108 VanDerWaalsContact CD1-CD1 3.44Å; L70-I108 HydrophobicContact CG-CD1 4.15Å
71Q92.6Very high86.3Confident129 Ų12960 Ų6060%0.60331%0.306SS*.Hα-helixtrans-62.1-45.1172.7-69.1174.8400110.9S67 M68 A69 K73 K74 V75S67-Q71 WeakPolarHBondContact O-CG 3.49Å; S67-Q71 PolarHBondContact O-N 3.43Å; M68-Q71 WeakPolarHBondContact O-CB 3.48Å; M68-Q71 PolarHBondContact O-N 2.9Å; A69-Q71 PolarHBondContact O-N 3.49Å; Q71-K73 VanDerWaalsContact C-N 3.3Å; Q71-K73 PolarHBondContact O-N 3.45Å; Q71-K74 WeakPolarHBondContact O-CB 3.36Å; Q71-K74 PolarHBondContact O-N 3.28Å; Q71-V75 PolarHBondContact O-N 3.45Å
72Q90.4Very high84.1Confident41 Ų4163.1 Ų63.119%0.19233%0.326CS..Hα-helixtrans-62.5-37.1176.6-172.760.614.500112.2P39 K42 L46 M68 A69 V75 L76P39-Q72 PolarHBondContact O-NE2 3.12Å; K42-Q72 HydrophobicContact CB-CG 4.25Å; L46-Q72 HydrophobicContact CD1-CB 4.21Å; M68-Q72 PolarHBondContact O-N 2.99Å; A69-Q72 WeakPolarHBondContact O-CB 3.33Å; A69-Q72 PolarHBondContact O-N 3.44Å; Q72-V75 WeakPolarHBondContact O-CB 3.27Å; Q72-V75 PolarHBondContact O-N 2.87Å; Q72-L76 PolarHBondContact O-N 3.18Å
73K89.4Confident81.7Confident32 Ų3273.1 Ų73.114%0.13936%0.364CS..Hα-helixtrans-64.6-38.2175-174.157.9174.9175.80112.4Y43 A69 L70 Q71 V75 L76 N77Y43-K73 HydrophobicContact CD2-CB 3.9Å; Y43-K73 HydrophobicContact CE1-CD 4.47Å; Y43-K73 HydrophobicContact CE2-CB 3.77Å; Y43-K73 HydrophobicContact CE2-CD 4.33Å; Y43-K73 HydrophobicContact CE2-CG 4.26Å; A69-K73 PolarHBondContact O-N 3.24Å; L70-K73 PolarHBondContact O-N 3.24Å; Q71-K73 VanDerWaalsContact C-N 3.3Å; Q71-K73 PolarHBondContact O-N 3.45Å; K73-V75 VanDerWaalsContact C-N 3.32Å; K73-V75 PolarHBondContact O-N 3.38Å; K73-L76 HydrophobicContact CD-CD2 4.05Å; K73-L76 WeakPolarHBondContact O-CB 3.43Å; K73-L76 PolarHBondContact O-N 3.44Å; K73-N77 VanDerWaalsContact O-CG 3.32Å; K73-N77 PolarHBondContact O-N 3.28Å
74K88.8Confident79Confident137 Ų13778.8 Ų78.860%0.59640%0.398SS*.Hα-helixtrans-62.2-40.1173.5-70.3176.1-176.8179.80111.6L70 Q71 N77 K78L70-K74 WeakPolarHBondContact O-CG 3.37Å; L70-K74 PolarHBondContact O-N 3.05Å; Q71-K74 WeakPolarHBondContact O-CB 3.36Å; Q71-K74 PolarHBondContact O-N 3.28Å; K74-N77 PolarHBondContact O-N 3.26Å; K74-K78 WeakPolarHBondContact O-CG 3.45Å; K74-K78 PolarHBondContact O-N 2.71Å; K74-K78 VanDerWaalsContact O-N 3.11Å
75V86.1Confident76.4Confident69 Ų6980.6 Ų80.642%0.41841%0.411SS..Hα-helixtrans-63.1-47.2174.9177.70000110.4Q71 Q72 K73 N77 K78 T79Q71-V75 PolarHBondContact O-N 3.45Å; Q72-V75 WeakPolarHBondContact O-CB 3.27Å; Q72-V75 PolarHBondContact O-N 2.87Å; K73-V75 VanDerWaalsContact C-N 3.32Å; K73-V75 PolarHBondContact O-N 3.38Å; V75-N77 VanDerWaalsContact C-N 3.33Å; V75-N77 PolarHBondContact O-N 2.99Å; V75-K78 WeakPolarHBondContact O-CB 3.33Å; V75-K78 PolarHBondContact O-N 3.38Å; V75-K78 VanDerWaalsContact O-N 3.1Å; V75-T79 HydrophobicContact CG1-CG2 4.45Å; V75-T79 PolarHBondContact O-N 3.17Å; V75-T79 PolarHBondContact O-OG1 3.23Å
76L84.1Confident73.7Confident26 Ų2684.1 Ų84.114%0.13644%0.437CS..Hα-helixtrans-54.8-47.7176.4-177.170.5000111.8P39 A40 Q72 K73 K78 T79 S80 L98P39-L76 HydrophobicContact CB-CD1 4.11Å; A40-L76 HydrophobicContact CB-CD1 4.08Å; A40-L76 HydrophobicContact CB-CD2 4.4Å; Q72-L76 PolarHBondContact O-N 3.18Å; K73-L76 HydrophobicContact CD-CD2 4.05Å; K73-L76 WeakPolarHBondContact O-CB 3.43Å; K73-L76 PolarHBondContact O-N 3.44Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.26Å; L76-T79 WeakPolarHBondContact CA-OG1 3.45Å; L76-T79 PolarHBondContact O-N 2.99Å; L76-T79 PolarHBondContact O-OG1 3.05Å; L76-S80 PolarHBondContact O-N 3.3Å; L76-S80 PolarHBondContact O-OG 3.4Å; L76-L98 HydrophobicContact CD2-CD1 4.34Å
77N81.8Confident70.8Confident61 Ų6187.7 Ų87.733%0.32647%0.474SS..Hα-helixtrans-66.1-28.9179.9-68.7-10.9000113.1K73 K74 V75 S80 K81K73-N77 VanDerWaalsContact O-CG 3.32Å; K73-N77 PolarHBondContact O-N 3.28Å; K74-N77 PolarHBondContact O-N 3.26Å; V75-N77 VanDerWaalsContact C-N 3.33Å; V75-N77 PolarHBondContact O-N 2.99Å; N77-S80 PolarHBondContact O-OG 2.89Å; N77-K81 WeakPolarHBondContact O-CG 3.34Å
78K78.9Confident68.4Low157 Ų15789.4 Ų89.468%0.68350%0.498SS*.Hα-helixtrans-72.4-43.2172.3-72.9178.1179.3-174.80111.1K74 V75 L76K74-K78 WeakPolarHBondContact O-CG 3.45Å; K74-K78 PolarHBondContact O-N 2.71Å; K74-K78 VanDerWaalsContact O-N 3.11Å; V75-K78 WeakPolarHBondContact O-CB 3.33Å; V75-K78 PolarHBondContact O-N 3.38Å; V75-K78 VanDerWaalsContact O-N 3.1Å; L76-K78 VanDerWaalsContact C-N 3.29Å; L76-K78 PolarHBondContact O-N 3.26Å
79T66.8Low65.6Low66 Ų6690.1 Ų90.141%0.40552%0.515SS..Hα-helixtrans-69.9-30179.3550000113.6V75 L76V75-T79 HydrophobicContact CG1-CG2 4.45Å; V75-T79 PolarHBondContact O-N 3.17Å; V75-T79 PolarHBondContact O-OG1 3.23Å; L76-T79 WeakPolarHBondContact CA-OG1 3.45Å; L76-T79 PolarHBondContact O-N 2.99Å; L76-T79 PolarHBondContact O-OG1 3.05Å
80S59.5Low62.8Low58 Ų5893.8 Ų93.841%0.40655%0.546SS..Hα-helixtrans-72.7-37.5177.2670000112.7L76 N77 V82 R83L76-S80 PolarHBondContact O-N 3.3Å; L76-S80 PolarHBondContact O-OG 3.4Å; N77-S80 PolarHBondContact O-OG 2.89Å; S80-V82 PolarHBondContact O-N 2.92Å; S80-R83 PolarHBondContact O-N 3.08Å; S80-R83 VanDerWaalsContact O-N 3.11Å
81K48.8Very low60.2Low169 Ų16995.7 Ų95.774%0.73557%0.566SS**Hα-helixtrans-62.8-22.7175.4-76.1-178178-172.30113.9N77 T84N77-K81 WeakPolarHBondContact O-CG 3.34Å; K81-T84 PolarHBondContact O-OG1 3.02Å
82V47.7Very low57.5Low119 Ų11995.6 Ų95.672%0.72157%0.569SS**Hα-helixtrans-82.2-21.6177.1177.70000111.9S80S80-V82 PolarHBondContact O-N 2.92Å
83R44.7Very low55.1Low209 Ų20999.7 Ų99.779%0.78959%0.591SS**SBendtrans-96.8-2-176.1-79.4-176.1174.3177.7-1.8115.2S80 S85S80-R83 PolarHBondContact O-N 3.08Å; S80-R83 VanDerWaalsContact O-N 3.11Å; R83-S85 PolarHBondContact O-N 3.29Å
84T37.5Very low53Low123 Ų123104.8 Ų104.876%0.75562%0.616SS**THydrogen-bonded Turntrans-75.417.7-176.3460000115.6K81K81-T84 PolarHBondContact O-OG1 3.02Å
85S40.5Very low50.8Low106 Ų106101.2 Ų101.274%0.74161%0.611SS**THydrogen-bonded Turntrans-95.3-10.5172.460.60000114.7R83R83-S85 PolarHBondContact O-N 3.29Å
86T37.3Very low49Very low126 Ų126106.3 Ų106.377%0.77363%0.631SS**SBendtrans-153120.8175.837.70000112.9
87G35.3Very low47.9Very low75 Ų75107.4 Ų107.477%0.77364%0.64SS**  trans108.991.2160.800000116.9
88G44.6Very low47.7Very low76 Ų76106.2 Ų106.278%0.78463%0.634SS**  trans-82.9159.8166.900000113.2
89A36.1Very low48Very low85 Ų85100 Ų10070%0.70261%0.61SS**SBendtrans99.2-55.7176.900000117.3A91A89-A91 PolarHBondContact O-N 3.34Å
90A35.9Very low49.1Very low77 Ų77100 Ų10064%0.63661%0.612SS**Hα-helixtrans-73.7-25.6-175.700000114.8N92A90-N92 VanDerWaalsContact C-N 3.27Å; A90-N92 PolarHBondContact O-N 2.83Å
91A37.4Very low50.6Low69 Ų69100 Ų10057%0.5761%0.606SS**Hα-helixtrans-68.9-23179.100000113.6A89 A95A89-A91 PolarHBondContact O-N 3.34Å; A91-A95 PolarHBondContact O-N 3.45Å
92N36.9Very low52.7Low126 Ų12693.8 Ų93.867%0.67458%0.58SS**Hα-helixtrans-77.9-29-176.8-117.22000113A90A90-N92 VanDerWaalsContact C-N 3.27Å; A90-N92 PolarHBondContact O-N 2.83Å
93I38.5Very low54.8Low128 Ų12891.2 Ų91.266%0.65656%0.56SS**Hα-helixtrans-77.3-37.4179.5-61.4172.7000110.9A95 Q96I93-A95 VanDerWaalsContact C-N 3.32Å; I93-A95 PolarHBondContact O-N 2.92Å; I93-Q96 PolarHBondContact O-N 3.49Å
94Q45.2Very low57.2Low139 Ų13981.4 Ų81.465%0.6552%0.523SS*.Hα-helixtrans-68.2-31.1174.9-78179.9-8.600112.6Q96 S97 L98Q94-Q96 PolarHBondContact O-N 3.38Å; Q94-S97 PolarHBondContact O-N 3.1Å; Q94-S97 PolarHBondContact O-OG 3.18Å; Q94-L98 WeakPolarHBondContact O-CG 3.43Å
95A44.3Very low59.9Low61 Ų6177.1 Ų77.150%0.50449%0.494SS..Hα-helixtrans-66.9-31.5178.400000113.7A91 I93 S97A91-A95 PolarHBondContact O-N 3.45Å; I93-A95 VanDerWaalsContact C-N 3.32Å; I93-A95 PolarHBondContact O-N 2.92Å; A95-S97 VanDerWaalsContact C-N 3.33Å; A95-S97 PolarHBondContact O-N 3Å
96Q47Very low62.6Low176 Ų17673.9 Ų73.982%0.82247%0.466SS*.Hα-helixtrans-74.6-19178.2-76.1-179.4-19.300113.8I93 Q94I93-Q96 PolarHBondContact O-N 3.49Å; Q94-Q96 PolarHBondContact O-N 3.38Å
97S60.3Low65.3Low49 Ų4969.7 Ų69.734%0.34344%0.437SS..THydrogen-bonded Turntrans-93.8-1.1-177.272.30000115Q44 Q94 A95Q44-S97 PolarHBondContact NE2-O 3.37Å; Q94-S97 PolarHBondContact O-N 3.1Å; Q94-S97 PolarHBondContact O-OG 3.18Å; A95-S97 VanDerWaalsContact C-N 3.33Å; A95-S97 PolarHBondContact O-N 3Å
98L79.1Confident68.2Low36 Ų3666.2 Ų66.219%0.18840%0.401CS..SBendtrans-95.6133.2-173.5-72.1166.2000111.4A40 Y43 Q44 L76 Q94 S100A40-L98 HydrophobicContact CB-CD2 4.15Å; Y43-L98 HydrophobicContact CD1-CD2 4.13Å; Q44-L98 HydrophobicContact CG-CD2 3.68Å; L76-L98 HydrophobicContact CD2-CD1 4.34Å; Q94-L98 WeakPolarHBondContact O-CG 3.43Å; L98-S100 PolarHBondContact O-N 3.16Å
99P84.2Confident70.6Confident28 Ų2862.6 Ų62.618%0.18236%0.364CS..PPolyproline II helixtrans-53.8131.3172.5-26.834.1000111.9Y43 V47 Y48 E101Y43-P99 HydrophobicContact CE1-CB 4.19Å; Y43-P99 HydrophobicContact CE1-CG 4.46Å; Y43-P99 VanDerWaalsContact CE1-O 3.25Å; Y43-P99 WeakPolarHBondContact CE1-O 3.31Å; Y43-P99 PolarHBondContact OH-O 3.18Å; V47-P99 HydrophobicContact CB-CB 4.4Å; V47-P99 HydrophobicContact CB-CG 4.29Å; V47-P99 HydrophobicContact CG1-CB 3.86Å; V47-P99 HydrophobicContact CG1-CG 4.04Å; V47-P99 HydrophobicContact CG2-CB 4.4Å; Y48-P99 HydrophobicContact CE1-CG 4.23Å; P99-E101 PolarHBondContact O-N 3.49Å
100S90.4Very high73.5Confident64 Ų6460.8 Ų60.845%0.44834%0.341SS..PPolyproline II helixtrans-63.2134.6-178179.60000111.4L98 I102 E103 V104L98-S100 PolarHBondContact O-N 3.16Å; S100-I102 PolarHBondContact O-N 3.48Å; S100-I102 PolarHBondContact OG-N 3.47Å; S100-E103 WeakPolarHBondContact O-CB 3.37Å; S100-E103 PolarHBondContact O-N 3.29Å; S100-E103 VanDerWaalsContact O-N 3.13Å; S100-V104 PolarHBondContact O-N 2.98Å; S100-V104 VanDerWaalsContact O-N 3.16Å
101E90.5Very high76.3Confident60 Ų6057.1 Ų57.128%0.2831%0.31SS..Hα-helixtrans-59-35.7175.9-174.5-172.614500111.5L70 P99 E103 V104 K105L70-E101 HydrophobicContact CD2-CG 3.65Å; P99-E101 PolarHBondContact O-N 3.49Å; E101-E103 VanDerWaalsContact C-N 3.3Å; E101-E103 PolarHBondContact O-N 3.33Å; E101-V104 PolarHBondContact O-N 3.02Å; E101-K105 PolarHBondContact O-N 3.03Å; E101-K105 WeakPolarHBondContact OE1-CE 3.22Å; E101-K105 IonicContact OE1-NZ 2.66Å; E101-K105 PolarHBondContact OE1-NZ 3.03Å
102I92.6Very high79.1Confident38 Ų3856 Ų5620%0.19529%0.292CS..Hα-helixtrans-65-39-179.8-62161000110S100 K105 Y106 I128 Q132 I137S100-I102 PolarHBondContact O-N 3.48Å; S100-I102 PolarHBondContact OG-N 3.47Å; I102-K105 PolarHBondContact O-N 2.82Å; I102-Y106 PolarHBondContact O-N 3Å; I102-I128 HydrophobicContact CG2-CD1 4.42Å; I102-Q132 HydrophobicContact CD1-CB 4.06Å; I102-I137 HydrophobicContact CG2-CD1 3.15Å
103E92.3Very high81.8Confident65 Ų6552 Ų5230%0.30427%0.272SS..Hα-helixtrans-66.8-43.1176.7-167.362.4-159.300111.6S100 E101 K105 Y106 K107 K136S100-E103 WeakPolarHBondContact O-CB 3.37Å; S100-E103 PolarHBondContact O-N 3.29Å; S100-E103 VanDerWaalsContact O-N 3.13Å; E101-E103 VanDerWaalsContact C-N 3.3Å; E101-E103 PolarHBondContact O-N 3.33Å; E103-K105 VanDerWaalsContact C-N 3.33Å; E103-K105 PolarHBondContact O-N 3.45Å; E103-Y106 WeakPolarHBondContact O-CB 3.37Å; E103-Y106 PolarHBondContact O-N 3.01Å; E103-K107 WeakPolarHBondContact O-CG 3.39Å; E103-K107 PolarHBondContact O-N 3.39Å; E103-K136 IonicContact OE1-NZ 3.17Å; E103-K136 PolarHBondContact OE1-NZ 2.88Å; E103-K136 VanDerWaalsContact OE2-CE 3.28Å; E103-K136 WeakPolarHBondContact OE2-CE 3.28Å; E103-K136 IonicContact OE2-NZ 3.85Å; E103-K136 PolarHBondContact OE2-NZ 2.9Å
104V94.3Very high84.3Confident2 Ų249.8 Ų49.81%0.01226%0.261CS..Hα-helixtrans-61.5-42.9176.31750000111V47 Y66 L70 S100 E101 Y106 K107 I108V47-V104 HydrophobicContact CG1-CG2 4.09Å; V47-V104 HydrophobicContact CG2-CG2 3.73Å; Y66-V104 HydrophobicContact CD1-CG1 3.76Å; Y66-V104 HydrophobicContact CG-CG1 4.19Å; L70-V104 HydrophobicContact CD2-CB 4.2Å; L70-V104 HydrophobicContact CD2-CG1 3.83Å; L70-V104 HydrophobicContact CG-CG1 4Å; S100-V104 PolarHBondContact O-N 2.98Å; S100-V104 VanDerWaalsContact O-N 3.16Å; E101-V104 PolarHBondContact O-N 3.02Å; V104-Y106 VanDerWaalsContact C-N 3.33Å; V104-Y106 PolarHBondContact O-N 3.1Å; V104-K107 PolarHBondContact O-N 3.25Å; V104-I108 HydrophobicContact CG1-CD1 4.25Å; V104-I108 WeakPolarHBondContact O-CG1 3.33Å; V104-I108 PolarHBondContact O-N 3.19Å
105K95.4Very high86.6Confident33 Ų3346.3 Ų46.314%0.14325%0.246CC..Hα-helixtrans-63.7-37.6175.1-74.6179.5-175.5166.50112.6L70 E101 I102 E103 I108 A109 V124 I128L70-K105 HydrophobicContact CD1-CG 3.89Å; L70-K105 HydrophobicContact CD2-CG 4.27Å; E101-K105 PolarHBondContact O-N 3.03Å; E101-K105 WeakPolarHBondContact OE1-CE 3.22Å; E101-K105 IonicContact OE1-NZ 2.66Å; E101-K105 PolarHBondContact OE1-NZ 3.03Å; I102-K105 PolarHBondContact O-N 2.82Å; E103-K105 VanDerWaalsContact C-N 3.33Å; E103-K105 PolarHBondContact O-N 3.45Å; K105-I108 PolarHBondContact O-N 3.25Å; K105-A109 PolarHBondContact O-N 2.94Å; K105-V124 HydrophobicContact CB-CG1 3.85Å; K105-V124 HydrophobicContact CG-CG1 4.06Å; K105-V124 WeakPolarHBondContact O-CG1 3.4Å; K105-I128 HydrophobicContact CB-CD1 3.89Å; K105-I128 HydrophobicContact CB-CG1 4.48Å; K105-I128 HydrophobicContact CD-CD1 3.91Å; K105-I128 HydrophobicContact CD-CG1 3.58Å
106Y96.1Very high88.9Confident38 Ų3850.6 Ų50.615%0.14925%0.253CS..Hα-helixtrans-61.1-48.9174179.6-104.5000111.1I102 E103 V104 I108 A109 E110 K136 I137 M140I102-Y106 PolarHBondContact O-N 3Å; E103-Y106 WeakPolarHBondContact O-CB 3.37Å; E103-Y106 PolarHBondContact O-N 3.01Å; V104-Y106 VanDerWaalsContact C-N 3.33Å; V104-Y106 PolarHBondContact O-N 3.1Å; Y106-I108 PolarHBondContact O-N 2.92Å; Y106-A109 WeakPolarHBondContact O-CB 3.48Å; Y106-A109 PolarHBondContact O-N 3.45Å; Y106-E110 HydrophobicContact CD1-CG 4.35Å; Y106-E110 HydrophobicContact CE1-CG 4.04Å; Y106-E110 WeakPolarHBondContact CE1-OE1 3.43Å; Y106-E110 PolarHBondContact O-N 2.85Å; Y106-E110 PolarHBondContact OH-OE1 3.39Å; Y106-K136 HydrophobicContact CD1-CD 4.32Å; Y106-K136 HydrophobicContact CD2-CG 4.49Å; Y106-K136 HydrophobicContact CE1-CD 4.01Å; Y106-K136 HydrophobicContact CE2-CB 4.33Å; Y106-K136 HydrophobicContact CE2-CD 4.31Å; Y106-K136 HydrophobicContact CE2-CG 4.21Å; Y106-I137 HydrophobicContact CD2-CG1 3.78Å; Y106-I137 HydrophobicContact CG-CG1 4.38Å; Y106-M140 HydrophobicContact CD2-CE 3.38Å; Y106-M140 HydrophobicContact CD2-SD 4.37Å; Y106-M140 HydrophobicContact CE2-CB 4.23Å; Y106-M140 HydrophobicContact CE2-CE 3.44Å; Y106-M140 VanDerWaalsContact CE2-CE 3.44Å; Y106-M140 HydrophobicContact CE2-SD 3.82Å; Y106-M140 HydrophobicContact CG-CE 4.3Å
107K95.1Very high91.1Very high39 Ų3945.9 Ų45.917%0.1723%0.233CC..Hα-helixtrans-63.1-36.2177.1-64.6-169.5-172.8-171.40113.7D51 Y66 E103 V104 A109 E110 C111D51-K107 VanDerWaalsContact OD1-CD 3.29Å; D51-K107 WeakPolarHBondContact OD1-CD 3.46Å; D51-K107 IonicContact OD1-NZ 3.37Å; D51-K107 PolarHBondContact OD1-NZ 3.42Å; D51-K107 IonicContact OD2-NZ 2.72Å; D51-K107 PolarHBondContact OD2-NZ 2.84Å; Y66-K107 HydrophobicContact CD2-CB 4.47Å; Y66-K107 HydrophobicContact CE1-CB 4.31Å; Y66-K107 HydrophobicContact CE1-CD 4.14Å; Y66-K107 HydrophobicContact CE2-CB 3.85Å; Y66-K107 WeakPolarHBondContact OH-CD 3.29Å; E103-K107 WeakPolarHBondContact O-CG 3.39Å; E103-K107 PolarHBondContact O-N 3.39Å; V104-K107 PolarHBondContact O-N 3.25Å; K107-A109 VanDerWaalsContact C-N 3.32Å; K107-E110 PolarHBondContact O-N 2.93Å; K107-C111 PolarHBondContact O-N 3.37Å; K107-C111 PolarHBondContact O-SG 2.9Å
108I95.8Very high92.7Very high2 Ų245.2 Ų45.21%0.0123%0.226CC..Hα-helixtrans-59.4-46.9171.4-70.1167.8000110.3Y66 L70 V104 K105 Y106 E110 C111 Y112 V124Y66-I108 HydrophobicContact CD2-CG1 4.05Å; Y66-I108 HydrophobicContact CG-CG1 3.93Å; L70-I108 HydrophobicContact CD1-CD1 3.44Å; L70-I108 VanDerWaalsContact CD1-CD1 3.44Å; L70-I108 HydrophobicContact CG-CD1 4.15Å; V104-I108 HydrophobicContact CG1-CD1 4.25Å; V104-I108 WeakPolarHBondContact O-CG1 3.33Å; V104-I108 PolarHBondContact O-N 3.19Å; K105-I108 PolarHBondContact O-N 3.25Å; Y106-I108 PolarHBondContact O-N 2.92Å; I108-E110 VanDerWaalsContact C-N 3.34Å; I108-E110 PolarHBondContact O-N 3.1Å; I108-C111 WeakPolarHBondContact O-CB 3.41Å; I108-C111 PolarHBondContact O-N 3.13Å; I108-Y112 HydrophobicContact CG2-CD2 3.74Å; I108-Y112 HydrophobicContact CG2-CE2 3.33Å; I108-Y112 PolarHBondContact O-N 2.94Å; I108-V124 HydrophobicContact CB-CG1 4.35Å; I108-V124 HydrophobicContact CG2-CG1 4.18Å; I108-V124 HydrophobicContact CG2-CG2 3.98Å
109A95.9Very high93.4Very high0 Ų052.1 Ų52.10%025%0.254CS..Hα-helixtrans-65.8-37.4179.900000111.4K105 Y106 K107 C111 Y112 T113 A121 L125 M140K105-A109 PolarHBondContact O-N 2.94Å; Y106-A109 WeakPolarHBondContact O-CB 3.48Å; Y106-A109 PolarHBondContact O-N 3.45Å; K107-A109 VanDerWaalsContact C-N 3.32Å; A109-C111 PolarHBondContact O-N 3.29Å; A109-Y112 PolarHBondContact O-N 3.13Å; A109-T113 WeakPolarHBondContact O-CG2 3.29Å; A109-T113 PolarHBondContact O-N 3.1Å; A109-T113 PolarHBondContact O-OG1 3.29Å; A109-A121 HydrophobicContact CB-CB 4.12Å; A109-L125 HydrophobicContact CB-CD1 4.12Å; A109-L125 HydrophobicContact CB-CD2 3.66Å; A109-L125 HydrophobicContact CB-CG 3.73Å; A109-M140 HydrophobicContact CB-CE 3.4Å; A109-M140 VanDerWaalsContact CB-CE 3.4Å
110E95.6Very high93.9Very high47 Ų4754.4 Ų54.422%0.2227%0.265CS..Hα-helixtrans-59.7-42.1170.1-68.9179.7138.500112.7F54 Y106 K107 I108 Y112 T113 I114 M140F54-E110 HydrophobicContact CE2-CB 4.24Å; F54-E110 HydrophobicContact CZ-CB 4.32Å; Y106-E110 HydrophobicContact CD1-CG 4.35Å; Y106-E110 HydrophobicContact CE1-CG 4.04Å; Y106-E110 WeakPolarHBondContact CE1-OE1 3.43Å; Y106-E110 PolarHBondContact O-N 2.85Å; Y106-E110 PolarHBondContact OH-OE1 3.39Å; K107-E110 PolarHBondContact O-N 2.93Å; I108-E110 VanDerWaalsContact C-N 3.34Å; I108-E110 PolarHBondContact O-N 3.1Å; E110-Y112 VanDerWaalsContact C-N 3.3Å; E110-Y112 PolarHBondContact O-N 3.35Å; E110-T113 WeakPolarHBondContact CA-OG1 3.46Å; E110-T113 PolarHBondContact O-N 3.16Å; E110-T113 PolarHBondContact O-OG1 3.15Å; E110-I114 VanDerWaalsContact O-CG1 3.29Å; E110-I114 WeakPolarHBondContact O-CG1 3.44Å; E110-I114 PolarHBondContact O-N 3.19Å; E110-I114 VanDerWaalsContact O-N 3.12Å; E110-M140 HydrophobicContact CG-CE 4.41Å; E110-M140 HydrophobicContact CG-SD 4.11Å
111C95.5Very high94.2Very high0 Ų051.3 Ų51.30%024%0.244CC..Hα-helixtrans-59.1-44.7173.8-63.40000111F54 A63 K107 I108 A109 I114 L115F54-C111 WeakPolarHBondContact CD2-SG 3.21Å; A63-C111 HydrophobicContact CB-CB 4.03Å; K107-C111 PolarHBondContact O-N 3.37Å; K107-C111 PolarHBondContact O-SG 2.9Å; I108-C111 WeakPolarHBondContact O-CB 3.41Å; I108-C111 PolarHBondContact O-N 3.13Å; A109-C111 PolarHBondContact O-N 3.29Å; C111-I114 PolarHBondContact O-N 3.44Å; C111-L115 WeakPolarHBondContact O-CB 3.33Å; C111-L115 VanDerWaalsContact O-CG 3.24Å; C111-L115 WeakPolarHBondContact O-CG 3.42Å; C111-L115 PolarHBondContact O-N 3.38Å
112Y95.8Very high94.4Very high46 Ų4649.3 Ų49.318%0.1823%0.234CC..Hα-helixtrans-68.4-36.5-179.7-70.2-31.4000113.1A63 I108 A109 E110 L115 K116 L117 D120 V124A63-Y112 HydrophobicContact CB-CE1 3.93Å; I108-Y112 HydrophobicContact CG2-CD2 3.74Å; I108-Y112 HydrophobicContact CG2-CE2 3.33Å; I108-Y112 PolarHBondContact O-N 2.94Å; A109-Y112 PolarHBondContact O-N 3.13Å; E110-Y112 VanDerWaalsContact C-N 3.3Å; E110-Y112 PolarHBondContact O-N 3.35Å; Y112-L115 CarbonylContact O-C 3.51Å; Y112-L115 PolarHBondContact O-N 3.04Å; Y112-K116 PolarHBondContact O-N 3.3Å; Y112-K116 VanDerWaalsContact O-N 3.1Å; Y112-L117 HydrophobicContact CD1-CB 4.41Å; Y112-L117 HydrophobicContact CD1-CD1 4.13Å; Y112-L117 PolarHBondContact O-N 3Å; Y112-D120 HydrophobicContact CD2-CB 3.75Å; Y112-D120 HydrophobicContact CE2-CB 3.88Å; Y112-D120 HydrophobicContact CG-CB 4.1Å; Y112-V124 HydrophobicContact CD2-CG2 4.38Å; Y112-V124 HydrophobicContact CE2-CG2 3.92Å
113T93.5Very high94.6Very high42 Ų4250.6 Ų50.626%0.25825%0.251SS..Hα-helixtrans-65.1-40.9175.256.30000111.6A109 E110 L115 K116 A121 M140 L144A109-T113 WeakPolarHBondContact O-CG2 3.29Å; A109-T113 PolarHBondContact O-N 3.1Å; A109-T113 PolarHBondContact O-OG1 3.29Å; E110-T113 WeakPolarHBondContact CA-OG1 3.46Å; E110-T113 PolarHBondContact O-N 3.16Å; E110-T113 PolarHBondContact O-OG1 3.15Å; T113-L115 VanDerWaalsContact C-N 3.33Å; T113-L115 PolarHBondContact O-N 3.37Å; T113-K116 PolarHBondContact O-N 2.99Å; T113-A121 HydrophobicContact CG2-CB 4.1Å; T113-M140 HydrophobicContact CG2-SD 4.5Å; T113-L144 HydrophobicContact CG2-CD1 4.01Å; T113-L144 HydrophobicContact CG2-CD2 3.66Å; T113-L144 HydrophobicContact CG2-CG 4.27Å
114I91.9Very high94.7Very high81 Ų8149.1 Ų49.142%0.41525%0.246SC..Hα-helixtrans-65.8-38176.1-62.8165.8000111.2F54 Y59 E110 C111 K116F54-I114 HydrophobicContact CE2-CD1 4.34Å; F54-I114 HydrophobicContact CZ-CD1 4.48Å; Y59-I114 HydrophobicContact CD1-CD1 3.83Å; Y59-I114 HydrophobicContact CD1-CG2 4.46Å; Y59-I114 HydrophobicContact CD2-CB 4.32Å; Y59-I114 HydrophobicContact CD2-CG2 3.55Å; Y59-I114 HydrophobicContact CE1-CD1 3.41Å; Y59-I114 VanDerWaalsContact CE1-CD1 3.41Å; Y59-I114 HydrophobicContact CE1-CG2 4.36Å; Y59-I114 HydrophobicContact CE2-CB 4.43Å; Y59-I114 HydrophobicContact CE2-CD1 4.4Å; Y59-I114 HydrophobicContact CE2-CG2 3.42Å; Y59-I114 VanDerWaalsContact CE2-CG2 3.42Å; Y59-I114 HydrophobicContact CG-CB 4.38Å; Y59-I114 HydrophobicContact CG-CD1 4.48Å; Y59-I114 HydrophobicContact CG-CG2 4.08Å; E110-I114 VanDerWaalsContact O-CG1 3.29Å; E110-I114 WeakPolarHBondContact O-CG1 3.44Å; E110-I114 PolarHBondContact O-N 3.19Å; E110-I114 VanDerWaalsContact O-N 3.12Å; C111-I114 PolarHBondContact O-N 3.44Å; I114-K116 PolarHBondContact O-N 3.06Å
115L93.1Very high94.7Very high65 Ų6549 Ų4934%0.3425%0.246SC..THydrogen-bonded Turntrans-74.70.2173.8-67.2172.8000113.9R60 C111 Y112 T113 L117R60-L115 HydrophobicContact CB-CD1 4.25Å; C111-L115 WeakPolarHBondContact O-CB 3.33Å; C111-L115 VanDerWaalsContact O-CG 3.24Å; C111-L115 WeakPolarHBondContact O-CG 3.42Å; C111-L115 PolarHBondContact O-N 3.38Å; Y112-L115 CarbonylContact O-C 3.51Å; Y112-L115 PolarHBondContact O-N 3.04Å; T113-L115 VanDerWaalsContact C-N 3.33Å; T113-L115 PolarHBondContact O-N 3.37Å; L115-L117 HydrophobicContact CB-CD1 4.18Å; L115-L117 HydrophobicContact CB-CG 4.18Å; L115-L117 HydrophobicContact CD1-CD1 4.49Å; L115-L117 PolarHBondContact O-N 2.87Å
116K91.7Very high94.7Very high152 Ų15250.4 Ų50.466%0.66126%0.255SS*.THydrogen-bonded Turntrans61.525.8-176.3-51.8-178179.1-176.20114.1Y112 T113 I114 D118Y112-K116 PolarHBondContact O-N 3.3Å; Y112-K116 VanDerWaalsContact O-N 3.1Å; T113-K116 PolarHBondContact O-N 2.99Å; I114-K116 PolarHBondContact O-N 3.06Å; K116-D118 PolarHBondContact O-N 3.24Å
117L94.3Very high94.5Very high77 Ų7751.1 Ų51.140%0.40327%0.273SS..  trans-96.260.7176-62.2175.4000110.9Y112 L115 K119 D120 A121Y112-L117 HydrophobicContact CD1-CB 4.41Å; Y112-L117 HydrophobicContact CD1-CD1 4.13Å; Y112-L117 PolarHBondContact O-N 3Å; L115-L117 HydrophobicContact CB-CD1 4.18Å; L115-L117 HydrophobicContact CB-CG 4.18Å; L115-L117 HydrophobicContact CD1-CD1 4.49Å; L115-L117 PolarHBondContact O-N 2.87Å; L117-K119 VanDerWaalsContact C-N 3.28Å; L117-K119 PolarHBondContact O-N 3.23Å; L117-D120 HydrophobicContact CB-CB 4.44Å; L117-D120 PolarHBondContact O-N 2.98Å; L117-A121 PolarHBondContact O-N 3.03Å
118D93.3Very high94.5Very high34 Ų3449.3 Ų49.318%0.18227%0.265CS..Hα-helixtrans-61.3-33.6-170.2-57.8-38.7000113.5K116 A121 I122 L144 K147K116-D118 PolarHBondContact O-N 3.24Å; D118-A121 WeakPolarHBondContact O-CB 3.48Å; D118-A121 PolarHBondContact O-N 3.26Å; D118-I122 VanDerWaalsContact O-CG1 3.29Å; D118-I122 WeakPolarHBondContact O-CG1 3.46Å; D118-I122 PolarHBondContact O-N 3.2Å; D118-L144 HydrophobicContact CB-CD2 3.99Å; D118-K147 VanDerWaalsContact CG-NZ 3.32Å; D118-K147 IonicContact OD1-NZ 2.75Å; D118-K147 PolarHBondContact OD1-NZ 3.18Å; D118-K147 VanDerWaalsContact OD1-NZ 3.17Å; D118-K147 WeakPolarHBondContact OD2-CD 3.12Å; D118-K147 WeakPolarHBondContact OD2-CE 3.4Å; D118-K147 IonicContact OD2-NZ 3.05Å; D118-K147 PolarHBondContact OD2-NZ 3.34Å
119K94.6Very high94.3Very high181 Ų18152.7 Ų52.779%0.78729%0.287SS*.Hα-helixtrans-64.9-40.1179.6-66.7-177.1-179.3178.30112.2L117 I122 A123L117-K119 VanDerWaalsContact C-N 3.28Å; L117-K119 PolarHBondContact O-N 3.23Å; K119-I122 PolarHBondContact O-N 3.26Å; K119-A123 PolarHBondContact O-N 2.97Å
120D94.8Very high94Very high76 Ų7656.6 Ų56.641%0.40632%0.315SS..Hα-helixtrans-71-38.3179.1-62.3-29.5000110.4Y112 L117 A123 V124Y112-D120 HydrophobicContact CD2-CB 3.75Å; Y112-D120 HydrophobicContact CE2-CB 3.88Å; Y112-D120 HydrophobicContact CG-CB 4.1Å; L117-D120 HydrophobicContact CB-CB 4.44Å; L117-D120 PolarHBondContact O-N 2.98Å; D120-A123 PolarHBondContact O-N 3.15Å; D120-V124 WeakPolarHBondContact O-CG2 3.4Å; D120-V124 PolarHBondContact O-N 3.27Å
121A95.5Very high93.7Very high0 Ų066 Ų660%035%0.348CS..Hα-helixtrans-58.7-48.7172.500000111.5A109 T113 L117 D118 A123 V124 L125 L144A109-A121 HydrophobicContact CB-CB 4.12Å; T113-A121 HydrophobicContact CG2-CB 4.1Å; L117-A121 PolarHBondContact O-N 3.03Å; D118-A121 WeakPolarHBondContact O-CB 3.48Å; D118-A121 PolarHBondContact O-N 3.26Å; A121-A123 PolarHBondContact O-N 3.42Å; A121-V124 PolarHBondContact O-N 3.34Å; A121-L125 WeakPolarHBondContact O-CG 3.37Å; A121-L125 PolarHBondContact O-N 3Å; A121-L125 VanDerWaalsContact O-N 3.11Å; A121-L144 HydrophobicContact CB-CD1 3.73Å
122I95.9Very high93.4Very high17 Ų1771.2 Ų71.29%0.08737%0.373CS..Hα-helixtrans-57.9-48.5176.2-68.4165.7000110.4D118 K119 V124 L125 D126 L141 L144 Y145 A148D118-I122 VanDerWaalsContact O-CG1 3.29Å; D118-I122 WeakPolarHBondContact O-CG1 3.46Å; D118-I122 PolarHBondContact O-N 3.2Å; K119-I122 PolarHBondContact O-N 3.26Å; I122-V124 VanDerWaalsContact C-N 3.32Å; I122-V124 PolarHBondContact O-N 2.89Å; I122-L125 PolarHBondContact O-N 2.82Å; I122-D126 WeakPolarHBondContact CG2-OD2 3.41Å; I122-D126 WeakPolarHBondContact O-CB 3.34Å; I122-D126 PolarHBondContact O-N 3.2Å; I122-L141 HydrophobicContact CG2-CD1 4.46Å; I122-L144 HydrophobicContact CD1-CB 4.04Å; I122-L144 HydrophobicContact CG1-CB 3.69Å; I122-L144 HydrophobicContact CG1-CD1 4.22Å; I122-Y145 HydrophobicContact CD1-CD1 4.24Å; I122-Y145 HydrophobicContact CG2-CD1 4.27Å; I122-Y145 HydrophobicContact CG2-CE1 3.56Å; I122-A148 HydrophobicContact CD1-CB 4.23Å
123A95.9Very high93.3Very high65 Ų6570.9 Ų70.954%0.53737%0.371SS..Hα-helixtrans-59.6-39.5-178.800000113.1K119 D120 A121 G127K119-A123 PolarHBondContact O-N 2.97Å; D120-A123 PolarHBondContact O-N 3.15Å; A121-A123 PolarHBondContact O-N 3.42Å; A123-G127 PolarHBondContact O-N 3.12Å
124V94.9Very high93.3Very high35 Ų3571.1 Ų71.121%0.21237%0.373CS..Hα-helixtrans-66.7-45.5177.5170.60000111.6K105 I108 Y112 D120 A121 I122 G127K105-V124 HydrophobicContact CB-CG1 3.85Å; K105-V124 HydrophobicContact CG-CG1 4.06Å; K105-V124 WeakPolarHBondContact O-CG1 3.4Å; I108-V124 HydrophobicContact CB-CG1 4.35Å; I108-V124 HydrophobicContact CG2-CG1 4.18Å; I108-V124 HydrophobicContact CG2-CG2 3.98Å; Y112-V124 HydrophobicContact CD2-CG2 4.38Å; Y112-V124 HydrophobicContact CE2-CG2 3.92Å; D120-V124 WeakPolarHBondContact O-CG2 3.4Å; D120-V124 PolarHBondContact O-N 3.27Å; A121-V124 PolarHBondContact O-N 3.34Å; I122-V124 VanDerWaalsContact C-N 3.32Å; I122-V124 PolarHBondContact O-N 2.89Å; V124-G127 PolarHBondContact O-N 3.32Å
125L94.9Very high93.5Very high0 Ų069.2 Ų69.20%037%0.365CS..Hα-helixtrans-71.1-35.7-179.6-63.9-178.3000112A109 A121 I122 G127 I128 I137 M140 L141 L144A109-L125 HydrophobicContact CB-CD1 4.12Å; A109-L125 HydrophobicContact CB-CD2 3.66Å; A109-L125 HydrophobicContact CB-CG 3.73Å; A121-L125 WeakPolarHBondContact O-CG 3.37Å; A121-L125 PolarHBondContact O-N 3Å; A121-L125 VanDerWaalsContact O-N 3.11Å; I122-L125 PolarHBondContact O-N 2.82Å; L125-G127 VanDerWaalsContact C-N 3.27Å; L125-G127 PolarHBondContact O-N 3.21Å; L125-I128 HydrophobicContact CD2-CD1 4.37Å; L125-I128 VanDerWaalsContact O-CB 3.3Å; L125-I128 WeakPolarHBondContact O-CB 3.45Å; L125-I128 WeakPolarHBondContact O-CG1 3.38Å; L125-I128 PolarHBondContact O-N 2.9Å; L125-I137 HydrophobicContact CD2-CG2 4.13Å; L125-M140 HydrophobicContact CD1-CB 4.42Å; L125-M140 HydrophobicContact CD1-CE 3.64Å; L125-M140 HydrophobicContact CD1-CG 4.26Å; L125-M140 HydrophobicContact CD2-CE 3.93Å; L125-M140 HydrophobicContact CG-CE 4.27Å; L125-L141 HydrophobicContact CB-CD1 3.64Å; L125-L141 HydrophobicContact CD1-CB 4.14Å; L125-L141 HydrophobicContact CD1-CD1 4.04Å; L125-L144 HydrophobicContact CD1-CD1 4.2Å
126D94.4Very high93.5Very high62 Ų6269.8 Ų69.833%0.33237%0.365SS..Hα-helixtrans-67.3-29.3176.6-92.2-30.8000113.3I122 I128 R133 Y145I122-D126 WeakPolarHBondContact CG2-OD2 3.41Å; I122-D126 WeakPolarHBondContact O-CB 3.34Å; I122-D126 PolarHBondContact O-N 3.2Å; D126-I128 PolarHBondContact O-N 3.08Å; D126-R133 PolarHBondContact O-NH2 2.93Å; D126-R133 IonicContact OD1-CZ 3.85Å; D126-R133 IonicContact OD1-NH1 3.8Å; D126-R133 IonicContact OD1-NH2 3.15Å; D126-R133 PolarHBondContact OD1-NH2 2.79Å; D126-R133 VanDerWaalsContact OD1-NH2 3.15Å; D126-Y145 PolarHBondContact OD1-OH 3.24Å; D126-Y145 PolarHBondContact OD2-OH 3.12Å
127G92.8Very high93.7Very high52 Ų5262.5 Ų62.554%0.53633%0.334SS..THydrogen-bonded Turntrans-62.9-7170.200000114.5A123 V124 L125A123-G127 PolarHBondContact O-N 3.12Å; V124-G127 PolarHBondContact O-N 3.32Å; L125-G127 VanDerWaalsContact C-N 3.27Å; L125-G127 PolarHBondContact O-N 3.21Å
128I93.8Very high93.8Very high1 Ų159 Ų591%0.00532%0.315CS..SBendtrans-91.5124.2173.4-52.9173.5000108.8I102 K105 L125 D126 Q132 R133 I137I102-I128 HydrophobicContact CG2-CD1 4.42Å; K105-I128 HydrophobicContact CB-CD1 3.89Å; K105-I128 HydrophobicContact CB-CG1 4.48Å; K105-I128 HydrophobicContact CD-CD1 3.91Å; K105-I128 HydrophobicContact CD-CG1 3.58Å; L125-I128 HydrophobicContact CD2-CD1 4.37Å; L125-I128 VanDerWaalsContact O-CB 3.3Å; L125-I128 WeakPolarHBondContact O-CB 3.45Å; L125-I128 WeakPolarHBondContact O-CG1 3.38Å; L125-I128 PolarHBondContact O-N 2.9Å; D126-I128 PolarHBondContact O-N 3.08Å; I128-Q132 HydrophobicContact CG2-CB 4.17Å; I128-R133 HydrophobicContact CB-CG 4.18Å; I128-R133 HydrophobicContact CG2-CG 3.83Å; I128-R133 PolarHBondContact O-NE 3.37Å; I128-R133 PolarHBondContact O-NH2 3.38Å; I128-I137 HydrophobicContact CD1-CD1 3.94Å; I128-I137 HydrophobicContact CD1-CG2 4.43Å
129P93.1Very high93.9Very high73 Ų7359.4 Ų59.447%0.47432%0.316SS..  trans-58.6139.9174.8-23.433.6000111.9R131 Q132 R133P129-R131 PolarHBondContact O-N 2.99Å; P129-R131 VanDerWaalsContact O-N 3.11Å; P129-Q132 PolarHBondContact O-N 3.31Å; P129-R133 PolarHBondContact O-N 3.25Å
130S88.6Confident94Very high82 Ų8251.9 Ų51.957%0.57329%0.285SS*.G310 helixtrans-52-38.7-175.6550000114.3Q132 R133S130-Q132 PolarHBondContact O-N 2.65Å; S130-R133 PolarHBondContact O-N 3.42Å
131R89Confident94Very high244 Ų24448.3 Ų48.392%0.92127%0.265SS*.G310 helixtrans-63.8-22.2178.4-62.7-176-177.1-174.80.5114.4P129P129-R131 PolarHBondContact O-N 2.99Å; P129-R131 VanDerWaalsContact O-N 3.11Å
132Q90.3Very high94Very high111 Ų11148.3 Ų48.352%0.51927%0.265SS..G310 helixtrans-101.5-3.6-178.4-65.4178.1-3.600112.3I102 I128 P129 S130I102-Q132 HydrophobicContact CD1-CB 4.06Å; I128-Q132 HydrophobicContact CG2-CB 4.17Å; P129-Q132 PolarHBondContact O-N 3.31Å; S130-Q132 PolarHBondContact O-N 2.65Å
133R93.1Very high93.9Very high38 Ų3850.5 Ų50.514%0.14328%0.277CS..  trans-77.2127.1-179.4-63.7179.4-169.3-178.9-6.1110D126 I128 P129 S130 I137 N138 L141D126-R133 PolarHBondContact O-NH2 2.93Å; D126-R133 IonicContact OD1-CZ 3.85Å; D126-R133 IonicContact OD1-NH1 3.8Å; D126-R133 IonicContact OD1-NH2 3.15Å; D126-R133 PolarHBondContact OD1-NH2 2.79Å; D126-R133 VanDerWaalsContact OD1-NH2 3.15Å; I128-R133 HydrophobicContact CB-CG 4.18Å; I128-R133 HydrophobicContact CG2-CG 3.83Å; I128-R133 PolarHBondContact O-NE 3.37Å; I128-R133 PolarHBondContact O-NH2 3.38Å; P129-R133 PolarHBondContact O-N 3.25Å; S130-R133 PolarHBondContact O-N 3.42Å; R133-I137 HydrophobicContact CB-CG2 4.16Å; R133-I137 HydrophobicContact CG-CG2 4.09Å; R133-N138 VanDerWaalsContact CB-OD1 3.3Å; R133-N138 WeakPolarHBondContact CB-OD1 3.36Å; R133-N138 WeakPolarHBondContact CD-OD1 3.26Å; R133-L141 VanDerWaalsContact NH1-CD2 3.29Å
134T94Very high93.8Very high48 Ų4847.9 Ų47.929%0.29425%0.254SS..  trans-79.7163.1172.259.90000110.6K136 I137 N138T134-K136 VanDerWaalsContact C-N 3.28Å; T134-K136 PolarHBondContact O-N 3.46Å; T134-K136 WeakPolarHBondContact OG1-CG 3.28Å; T134-I137 PolarHBondContact O-N 2.86Å; T134-I137 VanDerWaalsContact O-N 3.08Å; T134-I137 WeakPolarHBondContact OG1-CD1 3.5Å; T134-N138 PolarHBondContact O-N 3.02Å; T134-N138 VanDerWaalsContact O-N 3.11Å
135P94.7Very high93.9Very high40 Ų4046.9 Ų46.926%0.2625%0.247SC..Hα-helixtrans-56.4-40.8179.7-24.332.3000112.9I137 N138 M139 Q164P135-I137 VanDerWaalsContact C-N 3.3Å; P135-I137 PolarHBondContact O-N 3.44Å; P135-N138 PolarHBondContact O-N 3.29Å; P135-M139 WeakPolarHBondContact O-CB 2.96Å; P135-M139 PolarHBondContact O-N 2.92Å; P135-Q164 HydrophobicContact CG-CB 4.03Å
136K94.9Very high93.7Very high77 Ų7752 Ų5234%0.33527%0.266SS..Hα-helixtrans-62.4-34.4178.364.8174.7-175.3174.90113.4E103 Y106 T134 M140E103-K136 IonicContact OE1-NZ 3.17Å; E103-K136 PolarHBondContact OE1-NZ 2.88Å; E103-K136 VanDerWaalsContact OE2-CE 3.28Å; E103-K136 WeakPolarHBondContact OE2-CE 3.28Å; E103-K136 IonicContact OE2-NZ 3.85Å; E103-K136 PolarHBondContact OE2-NZ 2.9Å; Y106-K136 HydrophobicContact CD1-CD 4.32Å; Y106-K136 HydrophobicContact CD2-CG 4.49Å; Y106-K136 HydrophobicContact CE1-CD 4.01Å; Y106-K136 HydrophobicContact CE2-CB 4.33Å; Y106-K136 HydrophobicContact CE2-CD 4.31Å; Y106-K136 HydrophobicContact CE2-CG 4.21Å; T134-K136 VanDerWaalsContact C-N 3.28Å; T134-K136 PolarHBondContact O-N 3.46Å; T134-K136 WeakPolarHBondContact OG1-CG 3.28Å; K136-M140 WeakPolarHBondContact O-CB 3.4Å; K136-M140 PolarHBondContact O-N 3.15Å
137I95.4Very high93.4Very high0 Ų054.4 Ų54.40%027%0.273CS..Hα-helixtrans-69.9-48.9175.9-73.1168.1000110I102 Y106 L125 I128 R133 T134 P135 M139 M140 L141I102-I137 HydrophobicContact CG2-CD1 3.15Å; Y106-I137 HydrophobicContact CD2-CG1 3.78Å; Y106-I137 HydrophobicContact CG-CG1 4.38Å; L125-I137 HydrophobicContact CD2-CG2 4.13Å; I128-I137 HydrophobicContact CD1-CD1 3.94Å; I128-I137 HydrophobicContact CD1-CG2 4.43Å; R133-I137 HydrophobicContact CB-CG2 4.16Å; R133-I137 HydrophobicContact CG-CG2 4.09Å; T134-I137 PolarHBondContact O-N 2.86Å; T134-I137 VanDerWaalsContact O-N 3.08Å; T134-I137 WeakPolarHBondContact OG1-CD1 3.5Å; P135-I137 VanDerWaalsContact C-N 3.3Å; P135-I137 PolarHBondContact O-N 3.44Å; I137-M139 VanDerWaalsContact C-N 3.26Å; I137-M139 PolarHBondContact O-N 3.12Å; I137-M140 PolarHBondContact O-N 3.32Å; I137-L141 VanDerWaalsContact O-CB 3.25Å; I137-L141 WeakPolarHBondContact O-CB 3.41Å; I137-L141 PolarHBondContact O-N 3.06Å
138N95.8Very high93.3Very high4 Ų454.6 Ų54.62%0.02127%0.27CS..Hα-helixtrans-63.3-35.5179-71.1-31.3000111.5R133 T134 P135 A142 E160 V161R133-N138 VanDerWaalsContact CB-OD1 3.3Å; R133-N138 WeakPolarHBondContact CB-OD1 3.36Å; R133-N138 WeakPolarHBondContact CD-OD1 3.26Å; T134-N138 PolarHBondContact O-N 3.02Å; T134-N138 VanDerWaalsContact O-N 3.11Å; P135-N138 PolarHBondContact O-N 3.29Å; N138-A142 VanDerWaalsContact O-CB 3.23Å; N138-A142 WeakPolarHBondContact O-CB 3.5Å; N138-A142 PolarHBondContact O-N 3.06Å; N138-E160 WeakPolarHBondContact ND2-CG 3.42Å; N138-V161 HydrophobicContact CB-CG2 3.52Å
139M96.4Very high93.1Very high41 Ų4157.3 Ų57.320%0.20230%0.298CS..Hα-helixtrans-64-49.6174.3-173.268.788.800111.7P135 I137 L141 A142 N143 Y158 V161 A168 D170 A171P135-M139 WeakPolarHBondContact O-CB 2.96Å; P135-M139 PolarHBondContact O-N 2.92Å; I137-M139 VanDerWaalsContact C-N 3.26Å; I137-M139 PolarHBondContact O-N 3.12Å; M139-L141 PolarHBondContact O-N 3.01Å; M139-A142 PolarHBondContact O-N 2.9Å; M139-N143 PolarHBondContact O-N 2.68Å; M139-N143 PolarHBondContact O-ND2 3.13Å; M139-Y158 HydrophobicContact SD-CD1 4.25Å; M139-Y158 HydrophobicContact SD-CE1 3.93Å; M139-V161 HydrophobicContact CB-CG2 4.25Å; M139-V161 HydrophobicContact CE-CG1 3.95Å; M139-A168 HydrophobicContact CE-CB 4.27Å; M139-D170 HydrophobicContact CE-CB 4.45Å; M139-A171 HydrophobicContact CE-CB 3.93Å; M139-A171 HydrophobicContact SD-CB 4.31Å
140M95.7Very high93.1Very high24 Ų2458 Ų5812%0.11830%0.295CS..Hα-helixtrans-63.6-41.8178-174.4162.572.700111.8Y106 A109 E110 T113 L125 K136 I137 N143 L144Y106-M140 HydrophobicContact CD2-CE 3.38Å; Y106-M140 HydrophobicContact CD2-SD 4.37Å; Y106-M140 HydrophobicContact CE2-CB 4.23Å; Y106-M140 HydrophobicContact CE2-CE 3.44Å; Y106-M140 VanDerWaalsContact CE2-CE 3.44Å; Y106-M140 HydrophobicContact CE2-SD 3.82Å; Y106-M140 HydrophobicContact CG-CE 4.3Å; A109-M140 HydrophobicContact CB-CE 3.4Å; A109-M140 VanDerWaalsContact CB-CE 3.4Å; E110-M140 HydrophobicContact CG-CE 4.41Å; E110-M140 HydrophobicContact CG-SD 4.11Å; T113-M140 HydrophobicContact CG2-SD 4.5Å; L125-M140 HydrophobicContact CD1-CB 4.42Å; L125-M140 HydrophobicContact CD1-CE 3.64Å; L125-M140 HydrophobicContact CD1-CG 4.26Å; L125-M140 HydrophobicContact CD2-CE 3.93Å; L125-M140 HydrophobicContact CG-CE 4.27Å; K136-M140 WeakPolarHBondContact O-CB 3.4Å; K136-M140 PolarHBondContact O-N 3.15Å; I137-M140 PolarHBondContact O-N 3.32Å; M140-N143 PolarHBondContact O-N 3.29Å; M140-L144 HydrophobicContact CG-CD1 4.08Å; M140-L144 VanDerWaalsContact O-CG 3.32Å; M140-L144 WeakPolarHBondContact O-CG 3.37Å; M140-L144 PolarHBondContact O-N 3.27Å
141L95.6Very high93.3Very high0 Ų059.7 Ų59.70%029%0.294CS..Hα-helixtrans-61.6-44.3175.9-169.577.4000111.2I122 L125 R133 I137 M139 N143 L144 Y145I122-L141 HydrophobicContact CG2-CD1 4.46Å; L125-L141 HydrophobicContact CB-CD1 3.64Å; L125-L141 HydrophobicContact CD1-CB 4.14Å; L125-L141 HydrophobicContact CD1-CD1 4.04Å; R133-L141 VanDerWaalsContact NH1-CD2 3.29Å; I137-L141 VanDerWaalsContact O-CB 3.25Å; I137-L141 WeakPolarHBondContact O-CB 3.41Å; I137-L141 PolarHBondContact O-N 3.06Å; M139-L141 PolarHBondContact O-N 3.01Å; L141-N143 PolarHBondContact O-N 3.46Å; L141-L144 PolarHBondContact O-N 2.86Å; L141-Y145 HydrophobicContact CD1-CE1 4.43Å; L141-Y145 HydrophobicContact CD1-CE2 3.97Å; L141-Y145 HydrophobicContact CD2-CD2 4.31Å; L141-Y145 HydrophobicContact CD2-CE2 3.46Å; L141-Y145 VanDerWaalsContact CD2-CE2 3.46Å; L141-Y145 HydrophobicContact CG-CD2 3.83Å; L141-Y145 HydrophobicContact CG-CE2 3.35Å; L141-Y145 WeakPolarHBondContact O-CB 3.34Å; L141-Y145 VanDerWaalsContact O-CD2 3.29Å; L141-Y145 WeakPolarHBondContact O-CD2 3.2Å; L141-Y145 PolarHBondContact O-N 2.88Å
142A95.3Very high93.5Very high0 Ų058.6 Ų58.60%029%0.29CS..Hα-helixtrans-61.8-42.417700000112.2N138 M139 Y145 R146 Y158N138-A142 VanDerWaalsContact O-CB 3.23Å; N138-A142 WeakPolarHBondContact O-CB 3.5Å; N138-A142 PolarHBondContact O-N 3.06Å; M139-A142 PolarHBondContact O-N 2.9Å; A142-Y145 PolarHBondContact O-N 3.37Å; A142-R146 WeakPolarHBondContact O-CB 3.26Å; A142-R146 PolarHBondContact O-N 3.26Å; A142-Y158 HydrophobicContact CB-CD1 3.55Å; A142-Y158 HydrophobicContact CB-CD2 3.84Å; A142-Y158 HydrophobicContact CB-CE1 3.43Å; A142-Y158 VanDerWaalsContact CB-CE1 3.43Å; A142-Y158 HydrophobicContact CB-CE2 3.72Å; A142-Y158 HydrophobicContact CB-CG 3.74Å
143N94Very high93.7Very high64 Ų6455.2 Ų55.234%0.34228%0.278SS..Hα-helixtrans-62.4-42.6174.8-77.6-32.5000112.2M139 M140 L141 R146 K147 Y158M139-N143 PolarHBondContact O-N 2.68Å; M139-N143 PolarHBondContact O-ND2 3.13Å; M140-N143 PolarHBondContact O-N 3.29Å; L141-N143 PolarHBondContact O-N 3.46Å; N143-R146 PolarHBondContact O-N 3.16Å; N143-R146 PolarHBondContact OD1-NH2 3.5Å; N143-K147 WeakPolarHBondContact O-CB 3.4Å; N143-K147 PolarHBondContact O-N 3.29Å; N143-Y158 PolarHBondContact OD1-OH 2.99Å
144L94.3Very high93.8Very high9 Ų953.4 Ų53.45%0.04727%0.271CS..Hα-helixtrans-68.4-42177.9-71.2168.3000112.3T113 D118 A121 I122 L125 M140 L141 R146 K147 A148T113-L144 HydrophobicContact CG2-CD1 4.01Å; T113-L144 HydrophobicContact CG2-CD2 3.66Å; T113-L144 HydrophobicContact CG2-CG 4.27Å; D118-L144 HydrophobicContact CB-CD2 3.99Å; A121-L144 HydrophobicContact CB-CD1 3.73Å; I122-L144 HydrophobicContact CD1-CB 4.04Å; I122-L144 HydrophobicContact CG1-CB 3.69Å; I122-L144 HydrophobicContact CG1-CD1 4.22Å; L125-L144 HydrophobicContact CD1-CD1 4.2Å; M140-L144 HydrophobicContact CG-CD1 4.08Å; M140-L144 VanDerWaalsContact O-CG 3.32Å; M140-L144 WeakPolarHBondContact O-CG 3.37Å; M140-L144 PolarHBondContact O-N 3.27Å; L141-L144 PolarHBondContact O-N 2.86Å; L144-R146 VanDerWaalsContact C-N 3.35Å; L144-K147 PolarHBondContact O-N 2.85Å; L144-A148 WeakPolarHBondContact O-CB 3.27Å; L144-A148 PolarHBondContact O-N 3.09Å
145Y95.1Very high93.8Very high14 Ų1452.2 Ų52.26%0.05526%0.264CS..Hα-helixtrans-62.6-41.8173.9-73.7-38.8000112.3I122 D126 L141 A142 K147 A148 G149 Q150 S153I122-Y145 HydrophobicContact CD1-CD1 4.24Å; I122-Y145 HydrophobicContact CG2-CD1 4.27Å; I122-Y145 HydrophobicContact CG2-CE1 3.56Å; D126-Y145 PolarHBondContact OD1-OH 3.24Å; D126-Y145 PolarHBondContact OD2-OH 3.12Å; L141-Y145 HydrophobicContact CD1-CE1 4.43Å; L141-Y145 HydrophobicContact CD1-CE2 3.97Å; L141-Y145 HydrophobicContact CD2-CD2 4.31Å; L141-Y145 HydrophobicContact CD2-CE2 3.46Å; L141-Y145 VanDerWaalsContact CD2-CE2 3.46Å; L141-Y145 HydrophobicContact CG-CD2 3.83Å; L141-Y145 HydrophobicContact CG-CE2 3.35Å; L141-Y145 WeakPolarHBondContact O-CB 3.34Å; L141-Y145 VanDerWaalsContact O-CD2 3.29Å; L141-Y145 WeakPolarHBondContact O-CD2 3.2Å; L141-Y145 PolarHBondContact O-N 2.88Å; A142-Y145 PolarHBondContact O-N 3.37Å; Y145-K147 VanDerWaalsContact C-N 3.34Å; Y145-K147 PolarHBondContact O-N 3.47Å; Y145-A148 CarbonylContact O-C 3.51Å; Y145-A148 PolarHBondContact O-N 3.41Å; Y145-G149 PolarHBondContact O-N 2.77Å; Y145-Q150 HydrophobicContact CD1-CB 4.14Å; Y145-Q150 VanDerWaalsContact CE1-OE1 3.25Å; Y145-Q150 HydrophobicContact CG-CB 4.42Å; Y145-Q150 PolarHBondContact O-N 2.96Å; Y145-S153 VanDerWaalsContact CD2-C 3.46Å; Y145-S153 VanDerWaalsContact CD2-CB 3.48Å; Y145-S153 WeakPolarHBondContact CD2-O 3.37Å; Y145-S153 VanDerWaalsContact CE2-CB 3.43Å
146R91.3Very high93.8Very high107 Ų10754.5 Ų54.540%0.40428%0.278SS..Hα-helixtrans-59.1-46.3174.1-17717665.5-178.4-2.9110.7A142 N143 L144 A148 G149 A154 L178A142-R146 WeakPolarHBondContact O-CB 3.26Å; A142-R146 PolarHBondContact O-N 3.26Å; N143-R146 PolarHBondContact O-N 3.16Å; N143-R146 PolarHBondContact OD1-NH2 3.5Å; L144-R146 VanDerWaalsContact C-N 3.35Å; R146-A148 VanDerWaalsContact C-N 3.28Å; R146-A148 PolarHBondContact O-N 3.14Å; R146-G149 PolarHBondContact O-N 3.31Å; R146-G149 VanDerWaalsContact O-N 3.14Å; R146-A154 HydrophobicContact CB-CB 4.46Å; R146-L178 HydrophobicContact CG-CD2 4.33Å
147K88.9Confident93.8Very high113 Ų11351.1 Ų51.149%0.49126%0.263SS..Hα-helixtrans-62.3-34.8176.1-170.2-179.6179.1-164.40112.5D118 N143 L144 Y145 G149D118-K147 VanDerWaalsContact CG-NZ 3.32Å; D118-K147 IonicContact OD1-NZ 2.75Å; D118-K147 PolarHBondContact OD1-NZ 3.18Å; D118-K147 VanDerWaalsContact OD1-NZ 3.17Å; D118-K147 WeakPolarHBondContact OD2-CD 3.12Å; D118-K147 WeakPolarHBondContact OD2-CE 3.4Å; D118-K147 IonicContact OD2-NZ 3.05Å; D118-K147 PolarHBondContact OD2-NZ 3.34Å; N143-K147 WeakPolarHBondContact O-CB 3.4Å; N143-K147 PolarHBondContact O-N 3.29Å; L144-K147 PolarHBondContact O-N 2.85Å; Y145-K147 VanDerWaalsContact C-N 3.34Å; Y145-K147 PolarHBondContact O-N 3.47Å; K147-G149 VanDerWaalsContact C-N 3.31Å; K147-G149 PolarHBondContact O-N 3.02Å
148A90.6Very high93.9Very high57 Ų5751.1 Ų51.147%0.47126%0.263SS..THydrogen-bonded Turntrans-80.2-4.8177.200000114.3I122 L144 Y145 R146 Q150I122-A148 HydrophobicContact CD1-CB 4.23Å; L144-A148 WeakPolarHBondContact O-CB 3.27Å; L144-A148 PolarHBondContact O-N 3.09Å; Y145-A148 CarbonylContact O-C 3.51Å; Y145-A148 PolarHBondContact O-N 3.41Å; R146-A148 VanDerWaalsContact C-N 3.28Å; R146-A148 PolarHBondContact O-N 3.14Å; A148-Q150 VanDerWaalsContact C-N 3.34Å; A148-Q150 HydrophobicContact CB-CG 4.37Å
149G88.2Confident93.8Very high57 Ų5754 Ų5459%0.58828%0.276SS*.THydrogen-bonded Turntrans7615.5-175.900000114.8Y145 R146 K147 E151Y145-G149 PolarHBondContact O-N 2.77Å; R146-G149 PolarHBondContact O-N 3.31Å; R146-G149 VanDerWaalsContact O-N 3.14Å; K147-G149 VanDerWaalsContact C-N 3.31Å; K147-G149 PolarHBondContact O-N 3.02Å; G149-E151 PolarHBondContact O-N 3.11Å
150Q93.2Very high93.6Very high89 Ų8954.6 Ų54.642%0.41628%0.278SS..  trans-90.275.9178.1-63.6-174.91100111.1Y145 A148 R152 S153 A154Y145-Q150 HydrophobicContact CD1-CB 4.14Å; Y145-Q150 VanDerWaalsContact CE1-OE1 3.25Å; Y145-Q150 HydrophobicContact CG-CB 4.42Å; Y145-Q150 PolarHBondContact O-N 2.96Å; A148-Q150 VanDerWaalsContact C-N 3.34Å; A148-Q150 HydrophobicContact CB-CG 4.37Å; Q150-R152 PolarHBondContact O-N 3.35Å; Q150-S153 PolarHBondContact O-N 3.46Å; Q150-A154 WeakPolarHBondContact O-CB 3.2Å; Q150-A154 PolarHBondContact O-N 3.29Å; Q150-A154 VanDerWaalsContact O-N 3.07Å
151E93.1Very high93.6Very high116 Ų11653.6 Ų53.654%0.54227%0.273SS..Hα-helixtrans-60.5-44.9-171.7-58.8-178.4165.500113.3G149 S153 A154 V155 L178G149-E151 PolarHBondContact O-N 3.11Å; E151-S153 PolarHBondContact O-N 3.16Å; E151-A154 PolarHBondContact O-N 3.27Å; E151-V155 WeakPolarHBondContact O-CG2 3.43Å; E151-V155 PolarHBondContact O-N 3.08Å; E151-L178 HydrophobicContact CB-CD2 4.29Å; E151-L178 HydrophobicContact CG-CD2 4.05Å
152R93.8Very high93.5Very high221 Ų22153.9 Ų53.983%0.83428%0.275SS*.Hα-helixtrans-60.3-46-177.5-65.7-177.4-177.61770.8112.1Q150 A154 V155 T156Q150-R152 PolarHBondContact O-N 3.35Å; R152-A154 VanDerWaalsContact C-N 3.35Å; R152-V155 PolarHBondContact O-N 3.26Å; R152-T156 WeakPolarHBondContact O-CG2 3.37Å; R152-T156 PolarHBondContact O-N 2.7Å; R152-T156 VanDerWaalsContact O-N 3.15Å; R152-T156 PolarHBondContact O-OG1 3.05Å
153S93.8Very high93.3Very high40 Ų4062.3 Ų62.328%0.2831%0.307SS..Hα-helixtrans-70.5-32.6179.6-510000112.1Y145 Q150 E151 T156 S157Y145-S153 VanDerWaalsContact CD2-C 3.46Å; Y145-S153 VanDerWaalsContact CD2-CB 3.48Å; Y145-S153 WeakPolarHBondContact CD2-O 3.37Å; Y145-S153 VanDerWaalsContact CE2-CB 3.43Å; Q150-S153 PolarHBondContact O-N 3.46Å; E151-S153 PolarHBondContact O-N 3.16Å; S153-T156 WeakPolarHBondContact CA-OG1 3.09Å; S153-T156 PolarHBondContact O-OG1 3.32Å; S153-S157 WeakPolarHBondContact O-CB 3.41Å; S153-S157 PolarHBondContact O-N 3.37Å; S153-S157 PolarHBondContact O-OG 3.36Å
154A95.2Very high93.2Very high0 Ų062.7 Ų62.70%031%0.306CS..Hα-helixtrans-65.5-47.2173.100000111.2R146 Q150 E151 R152 T156 S157 Y158 L178R146-A154 HydrophobicContact CB-CB 4.46Å; Q150-A154 WeakPolarHBondContact O-CB 3.2Å; Q150-A154 PolarHBondContact O-N 3.29Å; Q150-A154 VanDerWaalsContact O-N 3.07Å; E151-A154 PolarHBondContact O-N 3.27Å; R152-A154 VanDerWaalsContact C-N 3.35Å; A154-T156 PolarHBondContact O-N 3.47Å; A154-S157 PolarHBondContact O-N 3.4Å; A154-Y158 HydrophobicContact CB-CD2 4.49Å; A154-Y158 HydrophobicContact CB-CE2 4.28Å; A154-Y158 WeakPolarHBondContact O-CD2 3.25Å; A154-Y158 PolarHBondContact O-N 3.29Å; A154-L178 HydrophobicContact CB-CD1 3.58Å
155V95.5Very high93Very high23 Ų2364.9 Ų64.914%0.13932%0.322CS..Hα-helixtrans-60-44.8178.8170.30000111.8E151 R152 S157 Y158 K159 L175 L178 V180E151-V155 WeakPolarHBondContact O-CG2 3.43Å; E151-V155 PolarHBondContact O-N 3.08Å; R152-V155 PolarHBondContact O-N 3.26Å; V155-S157 VanDerWaalsContact C-N 3.31Å; V155-S157 PolarHBondContact O-N 2.75Å; V155-Y158 PolarHBondContact O-N 2.95Å; V155-K159 HydrophobicContact CG1-CD 4.06Å; V155-K159 HydrophobicContact CG1-CG 4.46Å; V155-K159 WeakPolarHBondContact O-CB 3.49Å; V155-K159 WeakPolarHBondContact O-CG 3.45Å; V155-K159 PolarHBondContact O-N 3.48Å; V155-L175 HydrophobicContact CB-CD2 4.21Å; V155-L175 HydrophobicContact CG1-CD2 3.87Å; V155-L175 HydrophobicContact CG2-CD2 4.27Å; V155-L178 HydrophobicContact CG2-CB 3.96Å; V155-L178 HydrophobicContact CG2-CD1 3.82Å; V155-V180 HydrophobicContact CG1-CG2 4.06Å; V155-V180 HydrophobicContact CG2-CG2 3.87Å
156T94.5Very high92.7Very high89 Ų8966 Ų6655%0.54633%0.331SS..Hα-helixtrans-62.3-41.317853.80000111.8R152 S153 A154 K159 E160R152-T156 WeakPolarHBondContact O-CG2 3.37Å; R152-T156 PolarHBondContact O-N 2.7Å; R152-T156 VanDerWaalsContact O-N 3.15Å; R152-T156 PolarHBondContact O-OG1 3.05Å; S153-T156 WeakPolarHBondContact CA-OG1 3.09Å; S153-T156 PolarHBondContact O-OG1 3.32Å; A154-T156 PolarHBondContact O-N 3.47Å; T156-K159 PolarHBondContact O-N 2.88Å; T156-E160 PolarHBondContact O-N 3.47Å; T156-E160 VanDerWaalsContact O-N 3.12Å
157S94.8Very high92.7Very high5 Ų565.1 Ų65.14%0.03533%0.334CS..Hα-helixtrans-66.7-44.3179.2-57.60000111.8S153 A154 V155 E160 V161S153-S157 WeakPolarHBondContact O-CB 3.41Å; S153-S157 PolarHBondContact O-N 3.37Å; S153-S157 PolarHBondContact O-OG 3.36Å; A154-S157 PolarHBondContact O-N 3.4Å; V155-S157 VanDerWaalsContact C-N 3.31Å; V155-S157 PolarHBondContact O-N 2.75Å; S157-E160 PolarHBondContact O-N 3.28Å; S157-V161 WeakPolarHBondContact O-CG2 3.49Å; S157-V161 PolarHBondContact O-N 3.4Å; S157-V161 VanDerWaalsContact O-N 3.08Å
158Y96Very high93Very high0 Ų060.7 Ų60.70%032%0.318CS..Hα-helixtrans-63.9-40.1175.3-74.7-55.7000113M139 A142 N143 A154 V155 E160 V161 L162 A171 L175 L178M139-Y158 HydrophobicContact SD-CD1 4.25Å; M139-Y158 HydrophobicContact SD-CE1 3.93Å; A142-Y158 HydrophobicContact CB-CD1 3.55Å; A142-Y158 HydrophobicContact CB-CD2 3.84Å; A142-Y158 HydrophobicContact CB-CE1 3.43Å; A142-Y158 VanDerWaalsContact CB-CE1 3.43Å; A142-Y158 HydrophobicContact CB-CE2 3.72Å; A142-Y158 HydrophobicContact CB-CG 3.74Å; N143-Y158 PolarHBondContact OD1-OH 2.99Å; A154-Y158 HydrophobicContact CB-CD2 4.49Å; A154-Y158 HydrophobicContact CB-CE2 4.28Å; A154-Y158 WeakPolarHBondContact O-CD2 3.25Å; A154-Y158 PolarHBondContact O-N 3.29Å; V155-Y158 PolarHBondContact O-N 2.95Å; Y158-E160 VanDerWaalsContact C-N 3.29Å; Y158-E160 PolarHBondContact O-N 3.46Å; Y158-V161 WeakPolarHBondContact O-CB 3.19Å; Y158-V161 PolarHBondContact O-N 3.35Å; Y158-V161 VanDerWaalsContact O-N 3.17Å; Y158-L162 PolarHBondContact O-N 2.95Å; Y158-A171 HydrophobicContact CD1-CB 3.71Å; Y158-A171 HydrophobicContact CE1-CB 4.44Å; Y158-A171 HydrophobicContact CG-CB 4.49Å; Y158-L175 HydrophobicContact CD2-CD2 4.31Å; Y158-L175 HydrophobicContact CD2-CG 4.47Å; Y158-L175 HydrophobicContact CG-CD2 4.37Å; Y158-L175 HydrophobicContact CG-CG 4.3Å; Y158-L178 HydrophobicContact CD2-CD1 4.07Å; Y158-L178 HydrophobicContact CE2-CD1 3.89Å
159K94.4Very high93.1Very high65 Ų6560.6 Ų60.628%0.28331%0.31SS..Hα-helixtrans-60.8-39.8175.3-76.3177.8174.4-176.80111.9V155 T156 V161 L162 R163 L175 E184 M188V155-K159 HydrophobicContact CG1-CD 4.06Å; V155-K159 HydrophobicContact CG1-CG 4.46Å; V155-K159 WeakPolarHBondContact O-CB 3.49Å; V155-K159 WeakPolarHBondContact O-CG 3.45Å; V155-K159 PolarHBondContact O-N 3.48Å; T156-K159 PolarHBondContact O-N 2.88Å; K159-V161 VanDerWaalsContact C-N 3.35Å; K159-L162 PolarHBondContact O-N 3.19Å; K159-R163 PolarHBondContact O-N 3.21Å; K159-L175 HydrophobicContact CG-CD1 4.38Å; K159-L175 HydrophobicContact CG-CD2 4.22Å; K159-E184 VanDerWaalsContact CE-OE1 3.25Å; K159-E184 WeakPolarHBondContact CE-OE1 3.18Å; K159-E184 IonicContact NZ-OE1 2.76Å; K159-E184 PolarHBondContact NZ-OE1 2.94Å; K159-M188 HydrophobicContact CG-CE 4.36Å; K159-M188 HydrophobicContact CG-SD 4.14Å
160E93.4Very high93.4Very high54 Ų5463.6 Ų63.625%0.25231%0.312SS..Hα-helixtrans-67.5-35.4175.8-17556.8-153.700112.1N138 T156 S157 Y158 R163 Q164N138-E160 WeakPolarHBondContact ND2-CG 3.42Å; T156-E160 PolarHBondContact O-N 3.47Å; T156-E160 VanDerWaalsContact O-N 3.12Å; S157-E160 PolarHBondContact O-N 3.28Å; Y158-E160 VanDerWaalsContact C-N 3.29Å; Y158-E160 PolarHBondContact O-N 3.46Å; E160-R163 PolarHBondContact O-N 2.92Å; E160-R163 IonicContact OE1-CZ 2.58Å; E160-R163 IonicContact OE1-NE 3.85Å; E160-R163 PolarHBondContact OE1-NE 3.03Å; E160-R163 VanDerWaalsContact OE1-NE 3.17Å; E160-R163 IonicContact OE1-NH2 2.96Å; E160-R163 PolarHBondContact OE1-NH2 3.48Å; E160-R163 IonicContact OE2-CZ 3.94Å; E160-R163 IonicContact OE2-NE 2.9Å; E160-R163 PolarHBondContact OE2-NE 2.98Å; E160-R163 IonicContact OE2-NH2 3.13Å; E160-Q164 PolarHBondContact O-N 3.35Å; E160-Q164 PolarHBondContact OE1-NE2 3.27Å
161V94.9Very high93.5Very high3 Ų359.3 Ų59.32%0.01829%0.292CS..Hα-helixtrans-60.1-48.3170.7176.10000110.4N138 M139 S157 Y158 K159 R163 Q164 C165 A168 A171N138-V161 HydrophobicContact CB-CG2 3.52Å; M139-V161 HydrophobicContact CB-CG2 4.25Å; M139-V161 HydrophobicContact CE-CG1 3.95Å; S157-V161 WeakPolarHBondContact O-CG2 3.49Å; S157-V161 PolarHBondContact O-N 3.4Å; S157-V161 VanDerWaalsContact O-N 3.08Å; Y158-V161 WeakPolarHBondContact O-CB 3.19Å; Y158-V161 PolarHBondContact O-N 3.35Å; Y158-V161 VanDerWaalsContact O-N 3.17Å; K159-V161 VanDerWaalsContact C-N 3.35Å; V161-R163 VanDerWaalsContact C-N 3.31Å; V161-R163 PolarHBondContact O-N 2.86Å; V161-Q164 PolarHBondContact O-N 3Å; V161-Q164 VanDerWaalsContact O-N 3.15Å; V161-C165 PolarHBondContact O-N 3.35Å; V161-A168 HydrophobicContact CG1-CB 3.91Å; V161-A171 HydrophobicContact CB-CB 4.38Å; V161-A171 HydrophobicContact CG1-CB 4.11Å
162L93.3Very high93.6Very high6 Ų653.8 Ų53.83%0.03127%0.266CS..Hα-helixtrans-66.2-32.1-179.6-68.8179.8000113.3Y158 K159 Q164 C165 P166 A168 A171 I172 L175 M188Y158-L162 PolarHBondContact O-N 2.95Å; K159-L162 PolarHBondContact O-N 3.19Å; L162-Q164 VanDerWaalsContact C-N 3.26Å; L162-Q164 PolarHBondContact O-N 3.36Å; L162-C165 CarbonylContact O-C 3.4Å; L162-P166 VanDerWaalsContact O-CA 3.25Å; L162-P166 WeakPolarHBondContact O-CA 3.44Å; L162-A168 HydrophobicContact CD2-CB 4.12Å; L162-A171 HydrophobicContact CD2-CB 4.02Å; L162-A171 HydrophobicContact CG-CB 4.15Å; L162-I172 HydrophobicContact CD1-CG1 3.95Å; L162-I172 HydrophobicContact CD2-CD1 4.4Å; L162-I172 HydrophobicContact CD2-CG1 3.78Å; L162-L175 HydrophobicContact CD1-CD1 3.4Å; L162-L175 VanDerWaalsContact CD1-CD1 3.4Å; L162-M188 HydrophobicContact CD1-CE 3.59Å
163R91.6Very high93.6Very high176 Ų17645.4 Ų45.466%0.66424%0.237SC*.Hα-helixtrans-62.4-34.5173.9-165.8-175.173.179.93.9112.2K159 E160 V161K159-R163 PolarHBondContact O-N 3.21Å; E160-R163 PolarHBondContact O-N 2.92Å; E160-R163 IonicContact OE1-CZ 2.58Å; E160-R163 IonicContact OE1-NE 3.85Å; E160-R163 PolarHBondContact OE1-NE 3.03Å; E160-R163 VanDerWaalsContact OE1-NE 3.17Å; E160-R163 IonicContact OE1-NH2 2.96Å; E160-R163 PolarHBondContact OE1-NH2 3.48Å; E160-R163 IonicContact OE2-CZ 3.94Å; E160-R163 IonicContact OE2-NE 2.9Å; E160-R163 PolarHBondContact OE2-NE 2.98Å; E160-R163 IonicContact OE2-NH2 3.13Å; V161-R163 VanDerWaalsContact C-N 3.31Å; V161-R163 PolarHBondContact O-N 2.86Å
164Q90.7Very high93.5Very high72 Ų7243.5 Ų43.534%0.33622%0.224SC..Hα-helixtrans-89.8-36.6179-62.8-176.228.300112.3P135 E160 V161 L162P135-Q164 HydrophobicContact CG-CB 4.03Å; E160-Q164 PolarHBondContact O-N 3.35Å; E160-Q164 PolarHBondContact OE1-NE2 3.27Å; V161-Q164 PolarHBondContact O-N 3Å; V161-Q164 VanDerWaalsContact O-N 3.15Å; L162-Q164 VanDerWaalsContact C-N 3.26Å; L162-Q164 PolarHBondContact O-N 3.36Å
165C90.9Very high93.4Very high55 Ų5543.5 Ų43.537%0.37222%0.224SC..  trans-136.686.8-176.4-61.90000109.5V161 L162 L167 A168V161-C165 PolarHBondContact O-N 3.35Å; L162-C165 CarbonylContact O-C 3.4Å; C165-L167 PolarHBondContact O-N 2.72Å; C165-A168 HydrophobicContact CB-CB 4.47Å; C165-A168 WeakPolarHBondContact O-CB 3.31Å; C165-A168 PolarHBondContact O-N 3.5Å
166P89Confident93.3Very high39 Ų3942.6 Ų42.625%0.25322%0.219SC..THydrogen-bonded Turntrans-66.3-20.8-172.822.7-32.8000114.2L162 A168 V192L162-P166 VanDerWaalsContact O-CA 3.25Å; L162-P166 WeakPolarHBondContact O-CA 3.44Å; P166-A168 VanDerWaalsContact C-N 3.33Å; P166-V192 HydrophobicContact CB-CG2 3.52Å; P166-V192 HydrophobicContact CG-CG2 3.39Å
167L91.3Very high93.1Very high87 Ų8740.6 Ų40.646%0.45521%0.208SC..THydrogen-bonded Turntrans-90.211.9178.6-62.6175.1000113.7C165 L169 V192 L199 L202C165-L167 PolarHBondContact O-N 2.72Å; L167-L169 VanDerWaalsContact C-N 3.3Å; L167-L169 PolarHBondContact O-N 2.92Å; L167-V192 HydrophobicContact CD2-CG1 3.95Å; L167-V192 HydrophobicContact CG-CG1 4.3Å; L167-L199 HydrophobicContact CD2-CD1 4Å; L167-L202 HydrophobicContact CD2-CD2 4.06Å
168A94.8Very high92.9Very high20 Ų2041.2 Ų41.217%0.16521%0.211CC..  trans-73.183.1175.400000110.9M139 V161 L162 C165 P166 D170 A171 I172M139-A168 HydrophobicContact CE-CB 4.27Å; V161-A168 HydrophobicContact CG1-CB 3.91Å; L162-A168 HydrophobicContact CD2-CB 4.12Å; C165-A168 HydrophobicContact CB-CB 4.47Å; C165-A168 WeakPolarHBondContact O-CB 3.31Å; C165-A168 PolarHBondContact O-N 3.5Å; P166-A168 VanDerWaalsContact C-N 3.33Å; A168-D170 VanDerWaalsContact C-N 3.28Å; A168-D170 PolarHBondContact O-N 2.83Å; A168-A171 HydrophobicContact CB-CB 4.08Å; A168-A171 WeakPolarHBondContact O-CB 3.31Å; A168-A171 PolarHBondContact O-N 2.82Å; A168-I172 PolarHBondContact O-N 2.92Å
169L93.7Very high92.4Very high56 Ų5646.2 Ų46.229%0.29325%0.246SC..Hα-helixtrans-58.4-36.4-175.7-59.6-176000113.1L167 A171 I172 I173 L202 W205L167-L169 VanDerWaalsContact C-N 3.3Å; L167-L169 PolarHBondContact O-N 2.92Å; L169-A171 VanDerWaalsContact C-N 3.31Å; L169-A171 PolarHBondContact O-N 3.04Å; L169-I172 HydrophobicContact CD2-CD1 4.13Å; L169-I172 WeakPolarHBondContact O-CA 3.44Å; L169-I172 WeakPolarHBondContact O-CB 3.33Å; L169-I172 PolarHBondContact O-N 3.36Å; L169-I172 VanDerWaalsContact O-N 3.09Å; L169-I173 WeakPolarHBondContact O-CG1 3.43Å; L169-I173 PolarHBondContact O-N 3.13Å; L169-L202 HydrophobicContact CD2-CD1 3.64Å; L169-W205 HydrophobicContact CB-CH2 3.81Å; L169-W205 HydrophobicContact CB-CZ2 4.42Å; L169-W205 HydrophobicContact CB-CZ3 4.37Å; L169-W205 HydrophobicContact CD1-CH2 4.48Å; L169-W205 HydrophobicContact CD1-CZ2 4.47Å; L169-W205 HydrophobicContact CD2-CE3 4.36Å; L169-W205 HydrophobicContact CD2-CH2 4.11Å; L169-W205 HydrophobicContact CD2-CZ3 3.88Å; L169-W205 HydrophobicContact CG-CH2 4.34Å
170D94.1Very high92.2Very high119 Ų11944 Ų4464%0.63624%0.238SC*.Hα-helixtrans-63.9-35.4175.6-76.7-5.9000112.7M139 A168 I172 I173 G174M139-D170 HydrophobicContact CE-CB 4.45Å; A168-D170 VanDerWaalsContact C-N 3.28Å; A168-D170 PolarHBondContact O-N 2.83Å; D170-I172 VanDerWaalsContact C-N 3.33Å; D170-I173 PolarHBondContact O-N 3.27Å; D170-G174 PolarHBondContact O-N 3.12Å
171A94.8Very high92.1Very high0 Ų049.3 Ų49.30%026%0.26CS..Hα-helixtrans-68.7-35.3173.600000111.1M139 Y158 V161 L162 A168 L169 G174 L175M139-A171 HydrophobicContact CE-CB 3.93Å; M139-A171 HydrophobicContact SD-CB 4.31Å; Y158-A171 HydrophobicContact CD1-CB 3.71Å; Y158-A171 HydrophobicContact CE1-CB 4.44Å; Y158-A171 HydrophobicContact CG-CB 4.49Å; V161-A171 HydrophobicContact CB-CB 4.38Å; V161-A171 HydrophobicContact CG1-CB 4.11Å; L162-A171 HydrophobicContact CD2-CB 4.02Å; L162-A171 HydrophobicContact CG-CB 4.15Å; A168-A171 HydrophobicContact CB-CB 4.08Å; A168-A171 WeakPolarHBondContact O-CB 3.31Å; A168-A171 PolarHBondContact O-N 2.82Å; L169-A171 VanDerWaalsContact C-N 3.31Å; L169-A171 PolarHBondContact O-N 3.04Å; A171-G174 PolarHBondContact O-N 3.17Å; A171-L175 WeakPolarHBondContact O-CG 3.41Å; A171-L175 PolarHBondContact O-N 3.49Å
172I94.8Very high91.7Very high0 Ų050 Ų500%027%0.268CS..Hα-helixtrans-62.6-51.9173-66.2173.2000110.4L162 A168 L169 D170 G174 L175 L176 V185 T189 W205 I206L162-I172 HydrophobicContact CD1-CG1 3.95Å; L162-I172 HydrophobicContact CD2-CD1 4.4Å; L162-I172 HydrophobicContact CD2-CG1 3.78Å; A168-I172 PolarHBondContact O-N 2.92Å; L169-I172 HydrophobicContact CD2-CD1 4.13Å; L169-I172 WeakPolarHBondContact O-CA 3.44Å; L169-I172 WeakPolarHBondContact O-CB 3.33Å; L169-I172 PolarHBondContact O-N 3.36Å; L169-I172 VanDerWaalsContact O-N 3.09Å; D170-I172 VanDerWaalsContact C-N 3.33Å; I172-G174 PolarHBondContact O-N 3.38Å; I172-L175 PolarHBondContact O-N 2.88Å; I172-L175 VanDerWaalsContact O-N 3.12Å; I172-L176 HydrophobicContact CG2-CD1 3.84Å; I172-L176 HydrophobicContact CG2-CG 4.32Å; I172-L176 WeakPolarHBondContact O-CG 3.5Å; I172-L176 PolarHBondContact O-N 3.2Å; I172-V185 HydrophobicContact CB-CG1 4.28Å; I172-V185 HydrophobicContact CG1-CG1 4Å; I172-V185 HydrophobicContact CG2-CG1 3.74Å; I172-T189 HydrophobicContact CD1-CG2 4.11Å; I172-W205 HydrophobicContact CB-CZ3 4.32Å; I172-W205 HydrophobicContact CG2-CZ3 3.82Å; I172-I206 HydrophobicContact CD1-CD1 4.37Å; I172-I206 HydrophobicContact CG2-CG1 4.24Å
173I93.3Very high91.4Very high44 Ų4453.5 Ų53.523%0.22630%0.298CS..Hα-helixtrans-58.4-42.1176.7-64.6167.2000109.9L169 D170 L175 L176 S177 W205 Y209L169-I173 WeakPolarHBondContact O-CG1 3.43Å; L169-I173 PolarHBondContact O-N 3.13Å; D170-I173 PolarHBondContact O-N 3.27Å; I173-L175 PolarHBondContact O-N 2.91Å; I173-L176 PolarHBondContact O-N 3.11Å; I173-S177 WeakPolarHBondContact O-CB 3.4Å; I173-S177 PolarHBondContact O-N 3.17Å; I173-S177 PolarHBondContact O-OG 2.91Å; I173-W205 HydrophobicContact CD1-CH2 3.84Å; I173-W205 HydrophobicContact CD1-CZ2 3.98Å; I173-W205 HydrophobicContact CG1-CH2 3.67Å; I173-W205 HydrophobicContact CG1-CZ2 4.22Å; I173-Y209 HydrophobicContact CD1-CE1 4.3Å; I173-Y209 HydrophobicContact CG1-CD1 4.18Å; I173-Y209 HydrophobicContact CG1-CE1 4.46Å
174G92.3Very high91.4Very high0 Ų048.8 Ų48.80%028%0.283CS..Hα-helixtrans-54.7-48.3173.900000112.9D170 A171 I172 S177 L178D170-G174 PolarHBondContact O-N 3.12Å; A171-G174 PolarHBondContact O-N 3.17Å; I172-G174 PolarHBondContact O-N 3.38Å; G174-S177 PolarHBondContact O-N 3.45Å; G174-S177 PolarHBondContact O-OG 3.46Å; G174-L178 WeakPolarHBondContact O-CG 3.2Å; G174-L178 PolarHBondContact O-N 3.16Å
175L94Very high91.3Very high0 Ų045.4 Ų45.40%027%0.267CS..Hα-helixtrans-64.5-44.9176.7-72.4171.5000112.7V155 Y158 K159 L162 A171 I172 I173 S177 L178 V180 V185 M188V155-L175 HydrophobicContact CB-CD2 4.21Å; V155-L175 HydrophobicContact CG1-CD2 3.87Å; V155-L175 HydrophobicContact CG2-CD2 4.27Å; Y158-L175 HydrophobicContact CD2-CD2 4.31Å; Y158-L175 HydrophobicContact CD2-CG 4.47Å; Y158-L175 HydrophobicContact CG-CD2 4.37Å; Y158-L175 HydrophobicContact CG-CG 4.3Å; K159-L175 HydrophobicContact CG-CD1 4.38Å; K159-L175 HydrophobicContact CG-CD2 4.22Å; L162-L175 HydrophobicContact CD1-CD1 3.4Å; L162-L175 VanDerWaalsContact CD1-CD1 3.4Å; A171-L175 WeakPolarHBondContact O-CG 3.41Å; A171-L175 PolarHBondContact O-N 3.49Å; I172-L175 PolarHBondContact O-N 2.88Å; I172-L175 VanDerWaalsContact O-N 3.12Å; I173-L175 PolarHBondContact O-N 2.91Å; L175-S177 VanDerWaalsContact C-N 3.31Å; L175-S177 PolarHBondContact O-N 2.89Å; L175-L178 CarbonylContact O-C 3.53Å; L175-L178 PolarHBondContact O-N 2.93Å; L175-L178 VanDerWaalsContact O-N 3.11Å; L175-V180 HydrophobicContact CB-CB 4.22Å; L175-V180 HydrophobicContact CB-CG2 4.26Å; L175-V180 HydrophobicContact CD2-CG2 4.08Å; L175-V180 VanDerWaalsContact O-CB 3.31Å; L175-V180 WeakPolarHBondContact O-CB 3.5Å; L175-V180 WeakPolarHBondContact O-CG2 3.43Å; L175-V180 PolarHBondContact O-N 3.05Å; L175-V185 HydrophobicContact CB-CG2 4.26Å; L175-V185 HydrophobicContact CD1-CG2 4.4Å; L175-M188 HydrophobicContact CD1-CE 3.81Å
176L92.2Very high91.1Very high5 Ų544.1 Ų44.13%0.02626%0.261CS..Hα-helixtrans-64-38.3179.2-64.2173.9000111.2I172 I173 L178 S179 V185 A210 H213I172-L176 HydrophobicContact CG2-CD1 3.84Å; I172-L176 HydrophobicContact CG2-CG 4.32Å; I172-L176 WeakPolarHBondContact O-CG 3.5Å; I172-L176 PolarHBondContact O-N 3.2Å; I173-L176 PolarHBondContact O-N 3.11Å; L176-L178 PolarHBondContact O-N 3.16Å; L176-S179 PolarHBondContact O-N 3.47Å; L176-S179 VanDerWaalsContact O-N 3.13Å; L176-V185 HydrophobicContact CD2-CG2 4.06Å; L176-A210 HydrophobicContact CD2-CB 3.93Å; L176-H213 WeakPolarHBondContact O-CB 3.29Å
177S89.9Confident91.1Very high46 Ų4646 Ų4632%0.32228%0.275SS..Hα-helixtrans-64.5-25.4174.575.70000113.5I173 G174 L175 S179I173-S177 WeakPolarHBondContact O-CB 3.4Å; I173-S177 PolarHBondContact O-N 3.17Å; I173-S177 PolarHBondContact O-OG 2.91Å; G174-S177 PolarHBondContact O-N 3.45Å; G174-S177 PolarHBondContact O-OG 3.46Å; L175-S177 VanDerWaalsContact C-N 3.31Å; L175-S177 PolarHBondContact O-N 2.89Å; S177-S179 VanDerWaalsContact C-N 3.27Å; S177-S179 PolarHBondContact O-N 3.46Å
178L90.9Very high90.8Very high19 Ų1945 Ų4510%0.09927%0.269CS..THydrogen-bonded Turntrans-91.922.2176-65.4173.3000112.4R146 E151 A154 V155 Y158 G174 L175 L176 V180R146-L178 HydrophobicContact CG-CD2 4.33Å; E151-L178 HydrophobicContact CB-CD2 4.29Å; E151-L178 HydrophobicContact CG-CD2 4.05Å; A154-L178 HydrophobicContact CB-CD1 3.58Å; V155-L178 HydrophobicContact CG2-CB 3.96Å; V155-L178 HydrophobicContact CG2-CD1 3.82Å; Y158-L178 HydrophobicContact CD2-CD1 4.07Å; Y158-L178 HydrophobicContact CE2-CD1 3.89Å; G174-L178 WeakPolarHBondContact O-CG 3.2Å; G174-L178 PolarHBondContact O-N 3.16Å; L175-L178 CarbonylContact O-C 3.53Å; L175-L178 PolarHBondContact O-N 2.93Å; L175-L178 VanDerWaalsContact O-N 3.11Å; L176-L178 PolarHBondContact O-N 3.16Å; L178-V180 VanDerWaalsContact C-N 3.27Å; L178-V180 PolarHBondContact O-N 3.35Å
179S86.7Confident90.4Very high104 Ų10444 Ų4473%0.72726%0.261SS*.THydrogen-bonded Turntrans63.919.7177.174.10000116.1L176 S177L176-S179 PolarHBondContact O-N 3.47Å; L176-S179 VanDerWaalsContact O-N 3.13Å; S177-S179 VanDerWaalsContact C-N 3.27Å; S177-S179 PolarHBondContact O-N 3.46Å
180V90.2Very high90Very high19 Ų1945.7 Ų45.712%0.11527%0.268CS..  trans-68.9134.2172.1-178.80000109.5V155 L175 L178 G182 E184 V185V155-V180 HydrophobicContact CG1-CG2 4.06Å; V155-V180 HydrophobicContact CG2-CG2 3.87Å; L175-V180 HydrophobicContact CB-CB 4.22Å; L175-V180 HydrophobicContact CB-CG2 4.26Å; L175-V180 HydrophobicContact CD2-CG2 4.08Å; L175-V180 VanDerWaalsContact O-CB 3.31Å; L175-V180 WeakPolarHBondContact O-CB 3.5Å; L175-V180 WeakPolarHBondContact O-CG2 3.43Å; L175-V180 PolarHBondContact O-N 3.05Å; L178-V180 VanDerWaalsContact C-N 3.27Å; L178-V180 PolarHBondContact O-N 3.35Å; V180-G182 PolarHBondContact O-N 3.29Å; V180-E184 HydrophobicContact CG1-CB 4.34Å; V180-E184 HydrophobicContact CG1-CG 4.5Å; V180-E184 WeakPolarHBondContact CG1-OE2 3.41Å; V180-V185 HydrophobicContact CG1-CG2 3.97Å
181K89.9Confident89.6Confident165 Ų16545 Ų4572%0.71726%0.264SS*.  trans-63.8132.6-176.9-66.8-176.9179.7179.90110.5A183 E184 V185K181-A183 PolarHBondContact O-N 2.92Å; K181-A183 VanDerWaalsContact O-N 3.08Å; K181-E184 WeakPolarHBondContact O-CB 3.47Å; K181-E184 PolarHBondContact O-N 3.41Å; K181-V185 PolarHBondContact O-N 3.14Å
182G87.4Confident89.2Confident19 Ų1946 Ų4620%0.19627%0.27CS..Hα-helixtrans-56-29.5178.100000114.1V180 E184 V185 A186V180-G182 PolarHBondContact O-N 3.29Å; G182-E184 VanDerWaalsContact C-N 3.34Å; G182-E184 PolarHBondContact O-N 3.43Å; G182-V185 PolarHBondContact O-N 3.43Å; G182-A186 VanDerWaalsContact O-CB 3.3Å; G182-A186 WeakPolarHBondContact O-CB 3.27Å; G182-A186 PolarHBondContact O-N 3.2Å
183A88Confident88.8Confident78 Ų7846.8 Ų46.865%0.64527%0.274SS*.Hα-helixtrans-64.4-35.9175.100000113.2K181 S187K181-A183 PolarHBondContact O-N 2.92Å; K181-A183 VanDerWaalsContact O-N 3.08Å; A183-S187 PolarHBondContact O-N 2.96Å
184E89.8Confident88.4Confident78 Ų7851 Ų5136%0.36429%0.293SS..Hα-helixtrans-71.6-38176.8-172.9-179174.200111.1K159 V180 K181 G182 S187 M188K159-E184 VanDerWaalsContact CE-OE1 3.25Å; K159-E184 WeakPolarHBondContact CE-OE1 3.18Å; K159-E184 IonicContact NZ-OE1 2.76Å; K159-E184 PolarHBondContact NZ-OE1 2.94Å; V180-E184 HydrophobicContact CG1-CB 4.34Å; V180-E184 HydrophobicContact CG1-CG 4.5Å; V180-E184 WeakPolarHBondContact CG1-OE2 3.41Å; K181-E184 WeakPolarHBondContact O-CB 3.47Å; K181-E184 PolarHBondContact O-N 3.41Å; G182-E184 VanDerWaalsContact C-N 3.34Å; G182-E184 PolarHBondContact O-N 3.43Å; E184-S187 PolarHBondContact O-N 3Å; E184-S187 PolarHBondContact O-OG 2.86Å; E184-M188 WeakPolarHBondContact O-CG 3.36Å; E184-M188 PolarHBondContact O-N 3.26Å
185V88.9Confident88.1Confident0 Ų056.3 Ų56.30%032%0.322CS..Hα-helixtrans-70.8-37.8176.2-174.60000111.6I172 L175 L176 V180 K181 G182 M188 T189 I206I172-V185 HydrophobicContact CB-CG1 4.28Å; I172-V185 HydrophobicContact CG1-CG1 4Å; I172-V185 HydrophobicContact CG2-CG1 3.74Å; L175-V185 HydrophobicContact CB-CG2 4.26Å; L175-V185 HydrophobicContact CD1-CG2 4.4Å; L176-V185 HydrophobicContact CD2-CG2 4.06Å; V180-V185 HydrophobicContact CG1-CG2 3.97Å; K181-V185 PolarHBondContact O-N 3.14Å; G182-V185 PolarHBondContact O-N 3.43Å; V185-M188 HydrophobicContact CG1-CE 4.44Å; V185-M188 HydrophobicContact CG2-CE 4.45Å; V185-M188 PolarHBondContact O-N 3.2Å; V185-T189 PolarHBondContact O-N 2.91Å; V185-T189 PolarHBondContact O-OG1 3.42Å; V185-T189 VanDerWaalsContact O-OG1 3.05Å; V185-I206 HydrophobicContact CB-CG2 4.24Å; V185-I206 HydrophobicContact CG1-CG2 4.23Å
186A87.6Confident87.6Confident28 Ų2860.2 Ų60.223%0.23134%0.342CS..Hα-helixtrans-64-38.917500000111.9G182 M188 T189 M190G182-A186 VanDerWaalsContact O-CB 3.3Å; G182-A186 WeakPolarHBondContact O-CB 3.27Å; G182-A186 PolarHBondContact O-N 3.2Å; A186-M188 VanDerWaalsContact C-N 3.33Å; A186-M188 PolarHBondContact O-N 3.17Å; A186-T189 PolarHBondContact O-N 3.27Å; A186-T189 PolarHBondContact O-OG1 3.1Å; A186-M190 PolarHBondContact O-N 3.44Å
187S88.9Confident87.2Confident80 Ų8065 Ų6556%0.55937%0.373SS*.Hα-helixtrans-66.2-35.1178.168.30000112.7A183 E184 T189 M190A183-S187 PolarHBondContact O-N 2.96Å; E184-S187 PolarHBondContact O-N 3Å; E184-S187 PolarHBondContact O-OG 2.86Å; S187-T189 PolarHBondContact O-N 3.21Å; S187-M190 PolarHBondContact O-N 3.5Å
188M85Confident86.9Confident65 Ų6568.8 Ų68.832%0.3239%0.39SS..Hα-helixtrans-67.8-23175.8-67.3-169-58.400113.7K159 L162 L175 E184 V185 A186K159-M188 HydrophobicContact CG-CE 4.36Å; K159-M188 HydrophobicContact CG-SD 4.14Å; L162-M188 HydrophobicContact CD1-CE 3.59Å; L175-M188 HydrophobicContact CD1-CE 3.81Å; E184-M188 WeakPolarHBondContact O-CG 3.36Å; E184-M188 PolarHBondContact O-N 3.26Å; V185-M188 HydrophobicContact CG1-CE 4.44Å; V185-M188 HydrophobicContact CG2-CE 4.45Å; V185-M188 PolarHBondContact O-N 3.2Å; A186-M188 VanDerWaalsContact C-N 3.33Å; A186-M188 PolarHBondContact O-N 3.17Å
189T87.1Confident86.7Confident0 Ų069.1 Ų69.10%039%0.392CS..Hα-helixtrans-105.8-6-178.250.50000112.9I172 V185 A186 S187 D191 V192 I193 I206I172-T189 HydrophobicContact CD1-CG2 4.11Å; V185-T189 PolarHBondContact O-N 2.91Å; V185-T189 PolarHBondContact O-OG1 3.42Å; V185-T189 VanDerWaalsContact O-OG1 3.05Å; A186-T189 PolarHBondContact O-N 3.27Å; A186-T189 PolarHBondContact O-OG1 3.1Å; S187-T189 PolarHBondContact O-N 3.21Å; T189-D191 PolarHBondContact O-N 3.05Å; T189-V192 WeakPolarHBondContact O-CB 3.3Å; T189-V192 PolarHBondContact O-N 3.21Å; T189-V192 VanDerWaalsContact O-N 3.12Å; T189-I193 WeakPolarHBondContact O-CG1 3.36Å; T189-I193 PolarHBondContact O-N 2.9Å; T189-I193 VanDerWaalsContact O-N 3.09Å; T189-I206 HydrophobicContact CG2-CD1 4.43Å; T189-I206 WeakPolarHBondContact OG1-CD1 3.22Å
190M84.9Confident86.6Confident90 Ų9069.7 Ų69.744%0.44339%0.387SS..Hα-helixtrans-59.9-42.5-173.9-167.869.8-170.700113.1A186 S187 V192 I193 Q194A186-M190 PolarHBondContact O-N 3.44Å; S187-M190 PolarHBondContact O-N 3.5Å; M190-V192 PolarHBondContact O-N 3.3Å; M190-I193 PolarHBondContact O-N 3.25Å; M190-Q194 HydrophobicContact CE-CG 4.06Å; M190-Q194 VanDerWaalsContact CE-NE2 3.3Å; M190-Q194 WeakPolarHBondContact O-CG 3.33Å; M190-Q194 PolarHBondContact O-N 2.91Å
191D85.3Confident86.5Confident104 Ų10471.7 Ų71.756%0.55639%0.392SS*.Hα-helixtrans-59.8-38.8178.8-173.339000111.2T189 Q194 N195T189-D191 PolarHBondContact O-N 3.05Å; D191-Q194 PolarHBondContact O-N 3.33Å; D191-N195 WeakPolarHBondContact O-CB 3.36Å; D191-N195 PolarHBondContact O-N 3.1Å; D191-N195 VanDerWaalsContact O-N 3.07Å; D191-N195 PolarHBondContact O-ND2 2.97Å; D191-N195 PolarHBondContact OD1-ND2 3.29Å
192V86.9Confident86.5Confident21 Ų2163.9 Ų63.913%0.12736%0.358CS..Hα-helixtrans-70.5-39.8177.7-179.70000111.8P166 L167 T189 M190 Q194 N195 L196 L199P166-V192 HydrophobicContact CB-CG2 3.52Å; P166-V192 HydrophobicContact CG-CG2 3.39Å; L167-V192 HydrophobicContact CD2-CG1 3.95Å; L167-V192 HydrophobicContact CG-CG1 4.3Å; T189-V192 WeakPolarHBondContact O-CB 3.3Å; T189-V192 PolarHBondContact O-N 3.21Å; T189-V192 VanDerWaalsContact O-N 3.12Å; M190-V192 PolarHBondContact O-N 3.3Å; V192-Q194 VanDerWaalsContact C-N 3.3Å; V192-Q194 PolarHBondContact O-N 3.02Å; V192-N195 PolarHBondContact O-N 3.34Å; V192-L196 HydrophobicContact CG1-CD1 3.68Å; V192-L196 HydrophobicContact CG1-CG 4.45Å; V192-L196 WeakPolarHBondContact O-CB 3.44Å; V192-L196 PolarHBondContact O-N 3.46Å; V192-L196 VanDerWaalsContact O-N 3.07Å; V192-L199 HydrophobicContact CG1-CD1 4.2Å
193I84.9Confident86.6Confident17 Ų1764.8 Ų64.89%0.08736%0.362CS..Hα-helixtrans-64.8-37177.8-64.1164.3000110.7T189 M190 L202T189-I193 WeakPolarHBondContact O-CG1 3.36Å; T189-I193 PolarHBondContact O-N 2.9Å; T189-I193 VanDerWaalsContact O-N 3.09Å; M190-I193 PolarHBondContact O-N 3.25Å; I193-L202 HydrophobicContact CD1-CD2 4.4Å; I193-L202 HydrophobicContact CD1-CG 4.48Å; I193-L202 HydrophobicContact CG1-CB 4.44Å; I193-L202 HydrophobicContact CG1-CD2 4.14Å
194Q85.8Confident86.8Confident133 Ų13363.2 Ų63.262%0.62134%0.344SS*.Hα-helixtrans-76.2-34.3179.8-71.8-179.7-19.600113.2M190 D191 V192M190-Q194 HydrophobicContact CE-CG 4.06Å; M190-Q194 VanDerWaalsContact CE-NE2 3.3Å; M190-Q194 WeakPolarHBondContact O-CG 3.33Å; M190-Q194 PolarHBondContact O-N 2.91Å; D191-Q194 PolarHBondContact O-N 3.33Å; V192-Q194 VanDerWaalsContact C-N 3.3Å; V192-Q194 PolarHBondContact O-N 3.02Å
195N85.3Confident86.9Confident111 Ų11160.6 Ų60.659%0.59433%0.331SS*.Hα-helixtrans-89.9-23.3-173.4-66.6-30.9000113.8D191 V192D191-N195 WeakPolarHBondContact O-CB 3.36Å; D191-N195 PolarHBondContact O-N 3.1Å; D191-N195 VanDerWaalsContact O-N 3.07Å; D191-N195 PolarHBondContact O-ND2 2.97Å; D191-N195 PolarHBondContact OD1-ND2 3.29Å; V192-N195 PolarHBondContact O-N 3.34Å
196L85.1Confident87.1Confident83 Ų8360.6 Ų60.644%0.43533%0.331SS..SBendtrans-108.1124.7-179.1-67.3176.7000111.4V192 L199V192-L196 HydrophobicContact CG1-CD1 3.68Å; V192-L196 HydrophobicContact CG1-CG 4.45Å; V192-L196 WeakPolarHBondContact O-CB 3.44Å; V192-L196 PolarHBondContact O-N 3.46Å; V192-L196 VanDerWaalsContact O-N 3.07Å; L196-L199 HydrophobicContact CB-CD1 3.83Å; L196-L199 HydrophobicContact CB-CG 4.41Å; L196-L199 HydrophobicContact CD1-CD1 3.81Å; L196-L199 HydrophobicContact CG-CD1 4.49Å
197P83.5Confident87.3Confident105 Ų10565 Ų6568%0.68235%0.345SS*.THydrogen-bonded Turntrans-66.2155.7174.329-33.8000111.1L199P197-L199 PolarHBondContact O-N 3.46Å
198N83.4Confident87.5Confident125 Ų12561.2 Ų61.267%0.66832%0.318SS*.THydrogen-bonded Turntrans71.314175.9-50.2-32.4000116.6W201N198-W201 PolarHBondContact O-NE1 3.18Å
199L85.8Confident87.8Confident27 Ų2759.1 Ų59.114%0.14131%0.307CS..  trans-107.812.4177.7-67.2-175.2000114.9L167 V192 L196 P197 W201 L202L167-L199 HydrophobicContact CD2-CD1 4Å; V192-L199 HydrophobicContact CG1-CD1 4.2Å; L196-L199 HydrophobicContact CB-CD1 3.83Å; L196-L199 HydrophobicContact CB-CG 4.41Å; L196-L199 HydrophobicContact CD1-CD1 3.81Å; L196-L199 HydrophobicContact CG-CD1 4.49Å; P197-L199 PolarHBondContact O-N 3.46Å; L199-W201 HydrophobicContact CD2-CZ2 3.76Å; L199-W201 PolarHBondContact O-N 3.44Å; L199-W201 VanDerWaalsContact O-N 3.09Å; L199-L202 VanDerWaalsContact O-CB 3.25Å; L199-L202 WeakPolarHBondContact O-CB 3.31Å; L199-L202 PolarHBondContact O-N 3.22Å
200D84.2Confident88.1Confident115 Ų11560.1 Ų60.162%0.61532%0.315SS*.Hα-helixtrans-57.4-30.6-179-58.2-37.4000113L202 S203D200-L202 PolarHBondContact O-N 3.29Å; D200-S203 PolarHBondContact O-N 2.88Å; D200-S203 PolarHBondContact O-OG 3.49Å
201W88.9Confident88.4Confident62 Ų6258.8 Ų58.824%0.23531%0.307CS..Hα-helixtrans-63-26.5176.861.4-99.2000113.2N198 L199 S203 V204 W205 L227 L233N198-W201 PolarHBondContact O-NE1 3.18Å; L199-W201 HydrophobicContact CD2-CZ2 3.76Å; L199-W201 PolarHBondContact O-N 3.44Å; L199-W201 VanDerWaalsContact O-N 3.09Å; W201-S203 VanDerWaalsContact C-N 3.31Å; W201-S203 PolarHBondContact O-N 3.22Å; W201-V204 PolarHBondContact O-N 2.97Å; W201-V204 VanDerWaalsContact O-N 3.17Å; W201-W205 HydrophobicContact CE3-CB 4.14Å; W201-W205 HydrophobicContact CZ3-CB 4.4Å; W201-W205 HydrophobicContact CZ3-CG 4.37Å; W201-W205 WeakPolarHBondContact O-CB 3.48Å; W201-W205 PolarHBondContact O-N 3.43Å; W201-L227 HydrophobicContact CB-CD1 3.91Å; W201-L233 HydrophobicContact CB-CD1 3.97Å; W201-L233 HydrophobicContact CD2-CD1 3.6Å; W201-L233 HydrophobicContact CD2-CG 4.42Å; W201-L233 HydrophobicContact CE3-CD1 3.55Å; W201-L233 HydrophobicContact CG-CD1 3.8Å; W201-L233 HydrophobicContact CG-CG 4.41Å; W201-L233 HydrophobicContact CZ3-CD1 4.24Å
202L90.6Very high88.6Confident1 Ų154.3 Ų54.31%0.00528%0.283CS..Hα-helixtrans-63.7-38.4-177-178.260.4000111.2L167 L169 I193 L199 D200 V204 W205 I206L167-L202 HydrophobicContact CD2-CD2 4.06Å; L169-L202 HydrophobicContact CD2-CD1 3.64Å; I193-L202 HydrophobicContact CD1-CD2 4.4Å; I193-L202 HydrophobicContact CD1-CG 4.48Å; I193-L202 HydrophobicContact CG1-CB 4.44Å; I193-L202 HydrophobicContact CG1-CD2 4.14Å; L199-L202 VanDerWaalsContact O-CB 3.25Å; L199-L202 WeakPolarHBondContact O-CB 3.31Å; L199-L202 PolarHBondContact O-N 3.22Å; D200-L202 PolarHBondContact O-N 3.29Å; L202-V204 VanDerWaalsContact C-N 3.29Å; L202-V204 PolarHBondContact O-N 3.36Å; L202-W205 HydrophobicContact CD1-CE3 3.99Å; L202-W205 PolarHBondContact O-N 3.44Å; L202-I206 HydrophobicContact CD1-CD1 4.34Å; L202-I206 HydrophobicContact CD1-CG1 4.28Å; L202-I206 HydrophobicContact CG-CD1 4.09Å; L202-I206 HydrophobicContact CG-CG1 4.46Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.28Å; L202-I206 PolarHBondContact O-N 3.05Å
203S89.3Confident88.6Confident38 Ų3856.5 Ų56.527%0.26629%0.291SS..Hα-helixtrans-62.1-38.2177.1720000112.4D200 W201 K207D200-S203 PolarHBondContact O-N 2.88Å; D200-S203 PolarHBondContact O-OG 3.49Å; W201-S203 VanDerWaalsContact C-N 3.31Å; W201-S203 PolarHBondContact O-N 3.22Å; S203-K207 VanDerWaalsContact O-CG 3.31Å; S203-K207 WeakPolarHBondContact O-CG 3.36Å; S203-K207 PolarHBondContact O-N 3.04Å
204V90.9Very high88.6Confident44 Ų4459.4 Ų59.427%0.26732%0.318SS..Hα-helixtrans-74.9-38.7177.7-178.90000110.3W201 L202 K207 A208 T223 L227W201-V204 PolarHBondContact O-N 2.97Å; W201-V204 VanDerWaalsContact O-N 3.17Å; L202-V204 VanDerWaalsContact C-N 3.29Å; L202-V204 PolarHBondContact O-N 3.36Å; V204-K207 WeakPolarHBondContact O-CB 3.32Å; V204-K207 PolarHBondContact O-N 3Å; V204-A208 PolarHBondContact O-N 3.46Å; V204-T223 HydrophobicContact CG1-CG2 3.72Å; V204-L227 HydrophobicContact CB-CD1 4.14Å; V204-L227 HydrophobicContact CG1-CB 4.44Å; V204-L227 HydrophobicContact CG1-CD1 4.09Å
205W92.6Very high88.5Confident23 Ų2354.7 Ų54.79%0.08731%0.305CS..Hα-helixtrans-62.2-46.8175.6-175.692.9000111.8L169 I172 I173 W201 L202 K207 A208 Y209 L227L169-W205 HydrophobicContact CB-CH2 3.81Å; L169-W205 HydrophobicContact CB-CZ2 4.42Å; L169-W205 HydrophobicContact CB-CZ3 4.37Å; L169-W205 HydrophobicContact CD1-CH2 4.48Å; L169-W205 HydrophobicContact CD1-CZ2 4.47Å; L169-W205 HydrophobicContact CD2-CE3 4.36Å; L169-W205 HydrophobicContact CD2-CH2 4.11Å; L169-W205 HydrophobicContact CD2-CZ3 3.88Å; L169-W205 HydrophobicContact CG-CH2 4.34Å; I172-W205 HydrophobicContact CB-CZ3 4.32Å; I172-W205 HydrophobicContact CG2-CZ3 3.82Å; I173-W205 HydrophobicContact CD1-CH2 3.84Å; I173-W205 HydrophobicContact CD1-CZ2 3.98Å; I173-W205 HydrophobicContact CG1-CH2 3.67Å; I173-W205 HydrophobicContact CG1-CZ2 4.22Å; W201-W205 HydrophobicContact CE3-CB 4.14Å; W201-W205 HydrophobicContact CZ3-CB 4.4Å; W201-W205 HydrophobicContact CZ3-CG 4.37Å; W201-W205 WeakPolarHBondContact O-CB 3.48Å; W201-W205 PolarHBondContact O-N 3.43Å; L202-W205 HydrophobicContact CD1-CE3 3.99Å; L202-W205 PolarHBondContact O-N 3.44Å; W205-K207 VanDerWaalsContact C-N 3.29Å; W205-K207 PolarHBondContact O-N 2.92Å; W205-A208 WeakPolarHBondContact O-CB 3.41Å; W205-A208 PolarHBondContact O-N 3.42Å; W205-A208 VanDerWaalsContact O-N 3.13Å; W205-Y209 AromaticContact CD1-CE2 3.72Å; W205-Y209 AromaticContact CD2-CD2 3.83Å; W205-Y209 HydrophobicContact CD2-CD2 3.83Å; W205-Y209 AromaticContact CD2-CE2 3.99Å; W205-Y209 HydrophobicContact CD2-CE2 3.99Å; W205-Y209 AromaticContact CE2-CD2 3.54Å; W205-Y209 AromaticContact CE2-CE2 3.28Å; W205-Y209 HydrophobicContact CE3-CD2 4.37Å; W205-Y209 HydrophobicContact CG-CD2 4.2Å; W205-Y209 HydrophobicContact CG-CE2 4.23Å; W205-Y209 HydrophobicContact CH2-CD2 4.39Å; W205-Y209 AromaticContact CZ2-CD2 3.85Å; W205-Y209 HydrophobicContact CZ2-CD2 3.85Å; W205-Y209 AromaticContact CZ2-CE2 3.62Å; W205-Y209 HydrophobicContact CZ2-CE2 3.62Å; W205-Y209 HydrophobicContact CZ2-CG 4.44Å; W205-Y209 AromaticContact CZ2-CZ 3.99Å; W205-Y209 AromaticContact NE1-CD2 3.78Å; W205-Y209 AromaticContact NE1-CE2 3.13Å; W205-Y209 AromaticContact NE1-CZ 3.94Å; W205-Y209 WeakPolarHBondContact O-CD2 3.46Å; W205-Y209 PolarHBondContact O-N 3.29Å; W205-L227 HydrophobicContact CB-CD2 4.18Å
206I92.8Very high88.5Confident1 Ų151.5 Ų51.51%0.00529%0.288CS..Hα-helixtrans-59.2-42.3175.4-65.2168.9000110.7I172 V185 T189 L202 A210I172-I206 HydrophobicContact CD1-CD1 4.37Å; I172-I206 HydrophobicContact CG2-CG1 4.24Å; V185-I206 HydrophobicContact CB-CG2 4.24Å; V185-I206 HydrophobicContact CG1-CG2 4.23Å; T189-I206 HydrophobicContact CG2-CD1 4.43Å; T189-I206 WeakPolarHBondContact OG1-CD1 3.22Å; L202-I206 HydrophobicContact CD1-CD1 4.34Å; L202-I206 HydrophobicContact CD1-CG1 4.28Å; L202-I206 HydrophobicContact CG-CD1 4.09Å; L202-I206 HydrophobicContact CG-CG1 4.46Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.28Å; L202-I206 PolarHBondContact O-N 3.05Å; I206-A210 VanDerWaalsContact O-CB 3.28Å; I206-A210 WeakPolarHBondContact O-CB 3.28Å; I206-A210 PolarHBondContact O-N 3.34Å
207K92Very high88.7Confident121 Ų12148.9 Ų48.953%0.52627%0.274SS..Hα-helixtrans-62.2-43.7175.9-73.8171.8-177.3175.10111.9S203 V204 W205 A210 F211S203-K207 VanDerWaalsContact O-CG 3.31Å; S203-K207 WeakPolarHBondContact O-CG 3.36Å; S203-K207 PolarHBondContact O-N 3.04Å; V204-K207 WeakPolarHBondContact O-CB 3.32Å; V204-K207 PolarHBondContact O-N 3Å; W205-K207 VanDerWaalsContact C-N 3.29Å; W205-K207 PolarHBondContact O-N 2.92Å; K207-A210 PolarHBondContact O-N 3.49Å; K207-F211 WeakPolarHBondContact O-CD2 3.44Å; K207-F211 WeakPolarHBondContact O-CG 3.47Å; K207-F211 PolarHBondContact O-N 3.2Å; K207-F211 VanDerWaalsContact O-N 3.11Å
208A92.7Very high88.9Confident0 Ų050.6 Ų50.60%027%0.273CS..Hα-helixtrans-58.3-54.1177.500000111.3V204 W205 A210 F211 I212 T223 I224V204-A208 PolarHBondContact O-N 3.46Å; W205-A208 WeakPolarHBondContact O-CB 3.41Å; W205-A208 PolarHBondContact O-N 3.42Å; W205-A208 VanDerWaalsContact O-N 3.13Å; A208-A210 VanDerWaalsContact C-N 3.29Å; A208-A210 PolarHBondContact O-N 3.03Å; A208-F211 PolarHBondContact O-N 3.41Å; A208-F211 VanDerWaalsContact O-N 3.09Å; A208-I212 WeakPolarHBondContact O-CG1 3.47Å; A208-I212 PolarHBondContact O-N 2.89Å; A208-T223 HydrophobicContact CB-CG2 3.92Å; A208-I224 HydrophobicContact CB-CG1 3.74Å
209Y92.1Very high89.3Confident21 Ų2151.8 Ų51.88%0.08227%0.269CS..Hα-helixtrans-66.4-29.6179.8-79.9-94.7000113I173 W205 F211 I212 H213 S242I173-Y209 HydrophobicContact CD1-CE1 4.3Å; I173-Y209 HydrophobicContact CG1-CD1 4.18Å; I173-Y209 HydrophobicContact CG1-CE1 4.46Å; W205-Y209 AromaticContact CD1-CE2 3.72Å; W205-Y209 AromaticContact CD2-CD2 3.83Å; W205-Y209 HydrophobicContact CD2-CD2 3.83Å; W205-Y209 AromaticContact CD2-CE2 3.99Å; W205-Y209 HydrophobicContact CD2-CE2 3.99Å; W205-Y209 AromaticContact CE2-CD2 3.54Å; W205-Y209 AromaticContact CE2-CE2 3.28Å; W205-Y209 HydrophobicContact CE3-CD2 4.37Å; W205-Y209 HydrophobicContact CG-CD2 4.2Å; W205-Y209 HydrophobicContact CG-CE2 4.23Å; W205-Y209 HydrophobicContact CH2-CD2 4.39Å; W205-Y209 AromaticContact CZ2-CD2 3.85Å; W205-Y209 HydrophobicContact CZ2-CD2 3.85Å; W205-Y209 AromaticContact CZ2-CE2 3.62Å; W205-Y209 HydrophobicContact CZ2-CE2 3.62Å; W205-Y209 HydrophobicContact CZ2-CG 4.44Å; W205-Y209 AromaticContact CZ2-CZ 3.99Å; W205-Y209 AromaticContact NE1-CD2 3.78Å; W205-Y209 AromaticContact NE1-CE2 3.13Å; W205-Y209 AromaticContact NE1-CZ 3.94Å; W205-Y209 WeakPolarHBondContact O-CD2 3.46Å; W205-Y209 PolarHBondContact O-N 3.29Å; Y209-F211 VanDerWaalsContact C-N 3.33Å; Y209-I212 HydrophobicContact CD1-CD1 4Å; Y209-I212 HydrophobicContact CE1-CD1 4.19Å; Y209-I212 HydrophobicContact CG-CD1 4.24Å; Y209-I212 PolarHBondContact O-N 2.83Å; Y209-H213 PolarHBondContact O-CD2 3.26Å; Y209-H213 VanDerWaalsContact O-CD2 3.24Å; Y209-H213 PolarHBondContact O-N 3.38Å; Y209-S242 PolarHBondContact OH-OG 2.79Å
210A92.3Very high89.7Confident20 Ų2050.5 Ų50.517%0.16526%0.262CS..Hα-helixtrans-62.6-40.7172.100000111.5L176 I206 K207 A208 A214L176-A210 HydrophobicContact CD2-CB 3.93Å; I206-A210 VanDerWaalsContact O-CB 3.28Å; I206-A210 WeakPolarHBondContact O-CB 3.28Å; I206-A210 PolarHBondContact O-N 3.34Å; K207-A210 PolarHBondContact O-N 3.49Å; A208-A210 VanDerWaalsContact C-N 3.29Å; A208-A210 PolarHBondContact O-N 3.03Å; A210-A214 VanDerWaalsContact O-CB 3.26Å; A210-A214 WeakPolarHBondContact O-CB 3.25Å; A210-A214 PolarHBondContact O-N 3.3Å
211F91.6Very high90.1Very high63 Ų6346 Ų4628%0.27624%0.237SC..Hα-helixtrans-68.5-38.5174.5-64.4-46.4000112.7K207 A208 Y209 H213 A214 G215 D216 R219 A220K207-F211 WeakPolarHBondContact O-CD2 3.44Å; K207-F211 WeakPolarHBondContact O-CG 3.47Å; K207-F211 PolarHBondContact O-N 3.2Å; K207-F211 VanDerWaalsContact O-N 3.11Å; A208-F211 PolarHBondContact O-N 3.41Å; A208-F211 VanDerWaalsContact O-N 3.09Å; Y209-F211 VanDerWaalsContact C-N 3.33Å; F211-H213 VanDerWaalsContact C-N 3.35Å; F211-H213 PolarHBondContact O-N 2.88Å; F211-A214 PolarHBondContact O-N 2.69Å; F211-G215 PolarHBondContact O-N 3.33Å; F211-G215 VanDerWaalsContact O-N 3.1Å; F211-D216 PolarHBondContact O-N 3.49Å; F211-D216 VanDerWaalsContact O-N 3.12Å; F211-R219 HydrophobicContact CD1-CB 4.28Å; F211-R219 HydrophobicContact CD2-CB 3.99Å; F211-R219 HydrophobicContact CE2-CB 4.21Å; F211-R219 HydrophobicContact CG-CB 4.04Å; F211-R219 HydrophobicContact CZ-CB 4.47Å; F211-A220 HydrophobicContact CB-CB 3.83Å
212I90.3Very high90.3Very high10 Ų1048.5 Ų48.55%0.05126%0.255CS..Hα-helixtrans-57-48.5175.7-63.1176.2000110.8A208 Y209 G215 A220 I224 V246A208-I212 WeakPolarHBondContact O-CG1 3.47Å; A208-I212 PolarHBondContact O-N 2.89Å; Y209-I212 HydrophobicContact CD1-CD1 4Å; Y209-I212 HydrophobicContact CE1-CD1 4.19Å; Y209-I212 HydrophobicContact CG-CD1 4.24Å; Y209-I212 PolarHBondContact O-N 2.83Å; I212-G215 PolarHBondContact O-N 2.95Å; I212-A220 HydrophobicContact CG1-CB 3.92Å; I212-I224 HydrophobicContact CD1-CD1 3.97Å; I212-I224 HydrophobicContact CG1-CD1 4.44Å; I212-V246 HydrophobicContact CD1-CG2 3.94Å; I212-V246 HydrophobicContact CG1-CG2 3.69Å; I212-V246 HydrophobicContact CG2-CG2 4.29Å
213H86.9Confident90.5Very high67 Ų6749.9 Ų49.931%0.3126%0.264SS..Hα-helixtrans-77.6-22.4-178.9-71.5-64.9000113.4L176 Y209 F211L176-H213 WeakPolarHBondContact O-CB 3.29Å; Y209-H213 PolarHBondContact O-CD2 3.26Å; Y209-H213 VanDerWaalsContact O-CD2 3.24Å; Y209-H213 PolarHBondContact O-N 3.38Å; F211-H213 VanDerWaalsContact C-N 3.35Å; F211-H213 PolarHBondContact O-N 2.88Å
214A85.4Confident90.6Very high77 Ų7748 Ų4864%0.63625%0.251SS*.Hα-helixtrans-74.3-14.4169.700000113.2A210 F211A210-A214 VanDerWaalsContact O-CB 3.26Å; A210-A214 WeakPolarHBondContact O-CB 3.25Å; A210-A214 PolarHBondContact O-N 3.3Å; F211-A214 PolarHBondContact O-N 2.69Å
215G82Confident90.6Very high35 Ų3547 Ų4736%0.36125%0.246SC..THydrogen-bonded Turntrans828.4-17700000114.6F211 I212 N217F211-G215 PolarHBondContact O-N 3.33Å; F211-G215 VanDerWaalsContact O-N 3.1Å; I212-G215 PolarHBondContact O-N 2.95Å; G215-N217 PolarHBondContact O-N 3.4Å; G215-N217 VanDerWaalsContact O-N 3.11Å
216D86.8Confident90.5Very high43 Ų4347.6 Ų47.623%0.2325%0.253CS..  trans-85.180.5176.5-169.5-18.8000110.1F211 Q218 R219 A220F211-D216 PolarHBondContact O-N 3.49Å; F211-D216 VanDerWaalsContact O-N 3.12Å; D216-Q218 VanDerWaalsContact C-N 3.34Å; D216-Q218 PolarHBondContact O-N 3.35Å; D216-R219 WeakPolarHBondContact OD1-CG 3.27Å; D216-R219 PolarHBondContact OD1-N 2.71Å; D216-R219 WeakPolarHBondContact OD2-CD 3.23Å; D216-R219 WeakPolarHBondContact OD2-CG 3.42Å; D216-R219 IonicContact OD2-CZ 3.91Å; D216-R219 VanDerWaalsContact OD2-CZ 3.32Å; D216-R219 IonicContact OD2-NE 3.72Å; D216-R219 PolarHBondContact OD2-NE 2.9Å; D216-R219 IonicContact OD2-NH1 2.87Å; D216-R219 PolarHBondContact OD2-NH1 3.4Å; D216-A220 WeakPolarHBondContact O-CB 3.46Å; D216-A220 PolarHBondContact O-N 2.72Å; D216-A220 VanDerWaalsContact O-N 3.09Å
217N88.3Confident90.3Very high28 Ų2847.8 Ų47.815%0.1525%0.254CS..Hα-helixtrans-63.1-37.4-172.3-62.7-33.5000112.6G215 A220 I221 V246 R249 A250G215-N217 PolarHBondContact O-N 3.4Å; G215-N217 VanDerWaalsContact O-N 3.11Å; N217-A220 PolarHBondContact O-N 3.05Å; N217-I221 WeakPolarHBondContact O-CD1 3.33Å; N217-I221 VanDerWaalsContact O-CG1 3.25Å; N217-I221 WeakPolarHBondContact O-CG1 3.43Å; N217-I221 PolarHBondContact O-N 3.34Å; N217-V246 HydrophobicContact CB-CG1 3.94Å; N217-R249 PolarHBondContact ND2-O 3.32Å; N217-A250 HydrophobicContact CB-CB 4.04Å
218Q89Confident90.2Very high142 Ų14243.1 Ų43.166%0.66423%0.234SC*.Hα-helixtrans-67.9-46.2-177.6-71.3-170.9-12.500111.9D216 A220 I221 N222D216-Q218 VanDerWaalsContact C-N 3.34Å; D216-Q218 PolarHBondContact O-N 3.35Å; Q218-A220 VanDerWaalsContact C-N 3.32Å; Q218-A220 PolarHBondContact O-N 2.92Å; Q218-I221 PolarHBondContact O-N 3.46Å; Q218-N222 PolarHBondContact O-N 3.35Å; Q218-N222 VanDerWaalsContact O-N 3.1Å; Q218-N222 PolarHBondContact O-ND2 3.32Å
219R91.4Very high89.8Confident150 Ų15050.5 Ų50.557%0.56627%0.266SS*.Hα-helixtrans-67.3-35.5176.8-66.1-168-171.9134.4-7.9111.9F211 D216 T223F211-R219 HydrophobicContact CD1-CB 4.28Å; F211-R219 HydrophobicContact CD2-CB 3.99Å; F211-R219 HydrophobicContact CE2-CB 4.21Å; F211-R219 HydrophobicContact CG-CB 4.04Å; F211-R219 HydrophobicContact CZ-CB 4.47Å; D216-R219 WeakPolarHBondContact OD1-CG 3.27Å; D216-R219 PolarHBondContact OD1-N 2.71Å; D216-R219 WeakPolarHBondContact OD2-CD 3.23Å; D216-R219 WeakPolarHBondContact OD2-CG 3.42Å; D216-R219 IonicContact OD2-CZ 3.91Å; D216-R219 VanDerWaalsContact OD2-CZ 3.32Å; D216-R219 IonicContact OD2-NE 3.72Å; D216-R219 PolarHBondContact OD2-NE 2.9Å; D216-R219 IonicContact OD2-NH1 2.87Å; D216-R219 PolarHBondContact OD2-NH1 3.4Å; R219-T223 WeakPolarHBondContact O-CB 3.48Å; R219-T223 PolarHBondContact O-N 3.33Å; R219-T223 PolarHBondContact O-OG1 3.26Å
220A92.9Very high88.8Confident0 Ų057.9 Ų57.90%030%0.299CS..Hα-helixtrans-60-52173.600000111.4F211 I212 D216 N217 Q218 N222 T223 I224 V246F211-A220 HydrophobicContact CB-CB 3.83Å; I212-A220 HydrophobicContact CG1-CB 3.92Å; D216-A220 WeakPolarHBondContact O-CB 3.46Å; D216-A220 PolarHBondContact O-N 2.72Å; D216-A220 VanDerWaalsContact O-N 3.09Å; N217-A220 PolarHBondContact O-N 3.05Å; Q218-A220 VanDerWaalsContact C-N 3.32Å; Q218-A220 PolarHBondContact O-N 2.92Å; A220-N222 PolarHBondContact O-N 2.88Å; A220-T223 PolarHBondContact O-N 3.32Å; A220-I224 VanDerWaalsContact O-CG1 3.28Å; A220-I224 WeakPolarHBondContact O-CG1 3.13Å; A220-I224 PolarHBondContact O-N 3.36Å; A220-V246 HydrophobicContact CB-CG1 3.99Å
221I93.9Very high87.7Confident20 Ų2058.2 Ų58.210%0.10330%0.3CS..Hα-helixtrans-55.5-52177.9-70.4161.2000110.8N217 Q218 T223 I224 C225 L243 V246 Y247 A250N217-I221 WeakPolarHBondContact O-CD1 3.33Å; N217-I221 VanDerWaalsContact O-CG1 3.25Å; N217-I221 WeakPolarHBondContact O-CG1 3.43Å; N217-I221 PolarHBondContact O-N 3.34Å; Q218-I221 PolarHBondContact O-N 3.46Å; I221-T223 VanDerWaalsContact C-N 3.27Å; I221-T223 PolarHBondContact O-N 3.43Å; I221-I224 PolarHBondContact O-N 2.82Å; I221-C225 WeakPolarHBondContact O-CB 3.37Å; I221-C225 PolarHBondContact O-N 3.37Å; I221-C225 PolarHBondContact O-SG 3.13Å; I221-L243 HydrophobicContact CB-CD1 4.49Å; I221-L243 HydrophobicContact CG1-CD1 4.3Å; I221-L243 HydrophobicContact CG2-CD1 4.3Å; I221-V246 HydrophobicContact CD1-CG1 4.05Å; I221-V246 HydrophobicContact CG1-CB 4.31Å; I221-V246 HydrophobicContact CG1-CG1 3.59Å; I221-Y247 HydrophobicContact CD1-CD1 3.72Å; I221-Y247 HydrophobicContact CD1-CE1 3.82Å; I221-Y247 HydrophobicContact CD1-CG 4.43Å; I221-Y247 HydrophobicContact CG1-CD1 4.27Å; I221-Y247 HydrophobicContact CG1-CE1 4.17Å; I221-Y247 HydrophobicContact CG2-CE1 3.78Å; I221-Y247 WeakPolarHBondContact CG2-OH 3.4Å; I221-A250 HydrophobicContact CD1-CB 4.16Å
222N93.1Very high87.1Confident115 Ų11562.9 Ų62.962%0.61533%0.327SS*.Hα-helixtrans-60.1-38.7-178.1-70.9-19.2000112.5Q218 A220 S226Q218-N222 PolarHBondContact O-N 3.35Å; Q218-N222 VanDerWaalsContact O-N 3.1Å; Q218-N222 PolarHBondContact O-ND2 3.32Å; A220-N222 PolarHBondContact O-N 2.88Å; N222-S226 WeakPolarHBondContact O-CB 2.99Å; N222-S226 PolarHBondContact O-N 2.66Å
223T93.3Very high86.7Confident29 Ų2964.3 Ų64.318%0.17833%0.334CS..Hα-helixtrans-71.2-43.7179.6-52.40000111.3V204 A208 R219 A220 I221 S226 L227V204-T223 HydrophobicContact CG1-CG2 3.72Å; A208-T223 HydrophobicContact CB-CG2 3.92Å; R219-T223 WeakPolarHBondContact O-CB 3.48Å; R219-T223 PolarHBondContact O-N 3.33Å; R219-T223 PolarHBondContact O-OG1 3.26Å; A220-T223 PolarHBondContact O-N 3.32Å; I221-T223 VanDerWaalsContact C-N 3.27Å; I221-T223 PolarHBondContact O-N 3.43Å; T223-S226 WeakPolarHBondContact O-CB 3.34Å; T223-S226 PolarHBondContact O-N 3.12Å; T223-L227 PolarHBondContact O-N 3.42Å
224I92.7Very high86.6Confident0 Ų068.7 Ų68.70%035%0.348CS..Hα-helixtrans-65.9-45.1178.2-65.7167.8000110.9A208 I212 A220 I221 S226 L227 E228 L239 L243 V246A208-I224 HydrophobicContact CB-CG1 3.74Å; I212-I224 HydrophobicContact CD1-CD1 3.97Å; I212-I224 HydrophobicContact CG1-CD1 4.44Å; A220-I224 VanDerWaalsContact O-CG1 3.28Å; A220-I224 WeakPolarHBondContact O-CG1 3.13Å; A220-I224 PolarHBondContact O-N 3.36Å; I221-I224 PolarHBondContact O-N 2.82Å; I224-S226 PolarHBondContact O-N 3.06Å; I224-L227 WeakPolarHBondContact O-CA 3.47Å; I224-L227 VanDerWaalsContact O-CB 3.27Å; I224-L227 WeakPolarHBondContact O-CB 3.38Å; I224-L227 PolarHBondContact O-N 3.48Å; I224-E228 PolarHBondContact O-N 3.45Å; I224-L239 HydrophobicContact CG1-CD1 4.35Å; I224-L239 HydrophobicContact CG2-CD1 3.61Å; I224-L239 HydrophobicContact CG2-CD2 4.25Å; I224-L239 HydrophobicContact CG2-CG 3.72Å; I224-L243 HydrophobicContact CB-CD1 4.15Å; I224-L243 HydrophobicContact CG2-CB 3.88Å; I224-L243 HydrophobicContact CG2-CD1 3.92Å; I224-L243 HydrophobicContact CG2-CD2 4.21Å; I224-L243 HydrophobicContact CG2-CG 4.21Å; I224-V246 HydrophobicContact CD1-CG2 4.43Å
225C90.8Very high86.7Confident23 Ų2368.5 Ų68.516%0.15534%0.336CS..Hα-helixtrans-61.1-35.2174.9-70.40000111.8I221 L227 K229I221-C225 WeakPolarHBondContact O-CB 3.37Å; I221-C225 PolarHBondContact O-N 3.37Å; I221-C225 PolarHBondContact O-SG 3.13Å; C225-L227 VanDerWaalsContact C-N 3.32Å; C225-K229 WeakPolarHBondContact O-CB 3.42Å; C225-K229 VanDerWaalsContact O-CG 3.27Å; C225-K229 WeakPolarHBondContact O-CG 3.36Å; C225-K229 PolarHBondContact O-N 3.38Å
226S90.5Very high87.2Confident35 Ų3570 Ų7025%0.24534%0.336CS..Hα-helixtrans-66.5-35.2172.3-177.20000111.9N222 T223 I224 K230N222-S226 WeakPolarHBondContact O-CB 2.99Å; N222-S226 PolarHBondContact O-N 2.66Å; T223-S226 WeakPolarHBondContact O-CB 3.34Å; T223-S226 PolarHBondContact O-N 3.12Å; I224-S226 PolarHBondContact O-N 3.06Å; S226-K230 VanDerWaalsContact O-CB 3.26Å; S226-K230 WeakPolarHBondContact O-CB 3.34Å; S226-K230 WeakPolarHBondContact O-CG 3.48Å; S226-K230 PolarHBondContact O-N 2.83Å; S226-K230 WeakPolarHBondContact OG-CD 3.43Å; S226-K230 WeakPolarHBondContact OG-CE 3.38Å; S226-K230 PolarHBondContact OG-NZ 3.19Å
227L89.4Confident87.6Confident5 Ų569.5 Ų69.53%0.02634%0.335CS..Hα-helixtrans-67.8-44.7177.3-169.665.3000111.1W201 V204 W205 T223 I224 C225 S231 L233 L239W201-L227 HydrophobicContact CB-CD1 3.91Å; V204-L227 HydrophobicContact CB-CD1 4.14Å; V204-L227 HydrophobicContact CG1-CB 4.44Å; V204-L227 HydrophobicContact CG1-CD1 4.09Å; W205-L227 HydrophobicContact CB-CD2 4.18Å; T223-L227 PolarHBondContact O-N 3.42Å; I224-L227 WeakPolarHBondContact O-CA 3.47Å; I224-L227 VanDerWaalsContact O-CB 3.27Å; I224-L227 WeakPolarHBondContact O-CB 3.38Å; I224-L227 PolarHBondContact O-N 3.48Å; C225-L227 VanDerWaalsContact C-N 3.32Å; L227-S231 VanDerWaalsContact O-CB 3.27Å; L227-S231 WeakPolarHBondContact O-CB 3.41Å; L227-S231 PolarHBondContact O-N 3.41Å; L227-S231 VanDerWaalsContact O-N 3.15Å; L227-S231 PolarHBondContact O-OG 2.97Å; L227-L233 HydrophobicContact CD1-CD1 4.21Å; L227-L233 HydrophobicContact CD2-CD1 4.26Å; L227-L233 HydrophobicContact CG-CD1 4.23Å; L227-L239 HydrophobicContact CB-CD2 4.31Å; L227-L239 HydrophobicContact CD2-CD1 4.01Å; L227-L239 HydrophobicContact CD2-CD2 3.83Å; L227-L239 HydrophobicContact CG-CD2 4.11Å
228E88.6Confident87.8Confident23 Ų2372 Ų7211%0.10735%0.348CS..Hα-helixtrans-62.5-41.4176.3-172.8-171.2-164.300111.9I224 L240 K259I224-E228 PolarHBondContact O-N 3.45Å; E228-L240 WeakPolarHBondContact OE1-CD2 3.04Å; E228-K259 IonicContact OE1-NZ 2.62Å; E228-K259 PolarHBondContact OE1-NZ 3.35Å; E228-K259 IonicContact OE2-NZ 3.84Å
229K84.3Confident87.9Confident154 Ų15465.7 Ų65.767%0.6732%0.319SS*.Hα-helixtrans-75-42.8-178.1-74.1178.7-178.1-176.50113.8C225C225-K229 WeakPolarHBondContact O-CB 3.42Å; C225-K229 VanDerWaalsContact O-CG 3.27Å; C225-K229 WeakPolarHBondContact O-CG 3.36Å; C225-K229 PolarHBondContact O-N 3.38Å
230K72.1Confident88.1Confident176 Ų17658.7 Ų58.777%0.76529%0.293SS*.Hα-helixtrans-98.2-23.1-166-63.4-178.2-176.8164.90114.7S226S226-K230 VanDerWaalsContact O-CB 3.26Å; S226-K230 WeakPolarHBondContact O-CB 3.34Å; S226-K230 WeakPolarHBondContact O-CG 3.48Å; S226-K230 PolarHBondContact O-N 2.83Å; S226-K230 WeakPolarHBondContact OG-CD 3.43Å; S226-K230 WeakPolarHBondContact OG-CE 3.38Å; S226-K230 PolarHBondContact OG-NZ 3.19Å
231S69.4Low88.2Confident27 Ų2759.1 Ų59.119%0.18930%0.295CS..SBendtrans-101.5168.5-171.382.90000112.4L227 L233L227-S231 VanDerWaalsContact O-CB 3.27Å; L227-S231 WeakPolarHBondContact O-CB 3.41Å; L227-S231 PolarHBondContact O-N 3.41Å; L227-S231 VanDerWaalsContact O-N 3.15Å; L227-S231 PolarHBondContact O-OG 2.97Å; S231-L233 PolarHBondContact O-N 2.95Å; S231-L233 VanDerWaalsContact O-N 3.12Å; S231-L233 VanDerWaalsContact OG-CB 3.23Å; S231-L233 WeakPolarHBondContact OG-CB 3.45Å; S231-L233 PolarHBondContact OG-N 2.9Å
232L78.4Confident88.2Confident162 Ų16258.9 Ų58.985%0.84830%0.295SS*.THydrogen-bonded Turntrans-63.4-6.7168.6-67.997.6000113.1R234L232-R234 VanDerWaalsContact C-N 3.27Å; L232-R234 PolarHBondContact O-N 3.47Å
233L81.7Confident88.2Confident39 Ų3953.5 Ų53.520%0.20427%0.266CS..THydrogen-bonded Turntrans-89.524-178.2-53.4170.7000113.4W201 L227 S231 N236W201-L233 HydrophobicContact CB-CD1 3.97Å; W201-L233 HydrophobicContact CD2-CD1 3.6Å; W201-L233 HydrophobicContact CD2-CG 4.42Å; W201-L233 HydrophobicContact CE3-CD1 3.55Å; W201-L233 HydrophobicContact CG-CD1 3.8Å; W201-L233 HydrophobicContact CG-CG 4.41Å; W201-L233 HydrophobicContact CZ3-CD1 4.24Å; L227-L233 HydrophobicContact CD1-CD1 4.21Å; L227-L233 HydrophobicContact CD2-CD1 4.26Å; L227-L233 HydrophobicContact CG-CD1 4.23Å; S231-L233 PolarHBondContact O-N 2.95Å; S231-L233 VanDerWaalsContact O-N 3.12Å; S231-L233 VanDerWaalsContact OG-CB 3.23Å; S231-L233 WeakPolarHBondContact OG-CB 3.45Å; S231-L233 PolarHBondContact OG-N 2.9Å; L233-N236 WeakPolarHBondContact O-CB 3.49Å; L233-N236 PolarHBondContact O-N 2.98Å
234R85.4Confident88.3Confident160 Ų16052.1 Ų52.160%0.60426%0.258SS*.THydrogen-bonded Turntrans-58.7141.6172.2-172.3-179.9-69.7179-0.5109.3L232 N236L232-R234 VanDerWaalsContact C-N 3.27Å; L232-R234 PolarHBondContact O-N 3.47Å; R234-N236 PolarHBondContact O-N 3.34Å
235D86.8Confident88.3Confident72 Ų7254 Ų5439%0.38527%0.268SS..THydrogen-bonded Turntrans60.327.2178.5-55.9-43.1000114.5V237 Q262 L266D235-V237 PolarHBondContact O-N 3.06Å; D235-Q262 PolarHBondContact OD1-NE2 3.13Å; D235-L266 HydrophobicContact CB-CD1 3.79Å; D235-L266 HydrophobicContact CB-CD2 4.19Å
236N92.8Very high88.4Confident67 Ų6752.9 Ų52.936%0.35826%0.261SS..  trans-71.9122.1169.9-178.6-83.8000110.9L233 R234 D238 L239 L240L233-N236 WeakPolarHBondContact O-CB 3.49Å; L233-N236 PolarHBondContact O-N 2.98Å; R234-N236 PolarHBondContact O-N 3.34Å; N236-D238 PolarHBondContact O-N 3.41Å; N236-D238 PolarHBondContact OD1-N 3.12Å; N236-L239 HydrophobicContact CB-CB 3.98Å; N236-L239 PolarHBondContact O-N 3.06Å; N236-L239 PolarHBondContact OD1-N 3.4Å; N236-L240 WeakPolarHBondContact O-CG 3.13Å; N236-L240 PolarHBondContact O-N 2.92Å
237V94.4Very high88.6Confident32 Ų3252.7 Ų52.719%0.19426%0.255CS..Hα-helixtrans-60-48.8-175.5-178.50000112.6D235 L239 L240 V241 A263 L266 D267 L270D235-V237 PolarHBondContact O-N 3.06Å; V237-L239 VanDerWaalsContact C-N 3.29Å; V237-L239 PolarHBondContact O-N 3.05Å; V237-L240 PolarHBondContact O-N 3.22Å; V237-V241 WeakPolarHBondContact O-CG2 3.33Å; V237-V241 PolarHBondContact O-N 2.87Å; V237-A263 HydrophobicContact CG1-CB 4.43Å; V237-L266 HydrophobicContact CG2-CB 4.01Å; V237-D267 HydrophobicContact CG1-CB 4.09Å; V237-D267 HydrophobicContact CG2-CB 3.95Å; V237-L270 HydrophobicContact CG1-CD1 3.97Å; V237-L270 HydrophobicContact CG1-CD2 3.75Å; V237-L270 HydrophobicContact CG1-CG 4.36Å
238D92.1Very high88.7Confident82 Ų8253.3 Ų53.344%0.43926%0.257SS..Hα-helixtrans-63-35.9179.4-85.9-60000112.6N236 S242 K272N236-D238 PolarHBondContact O-N 3.41Å; N236-D238 PolarHBondContact OD1-N 3.12Å; D238-S242 WeakPolarHBondContact O-CB 3.29Å; D238-S242 PolarHBondContact O-N 2.9Å; D238-S242 PolarHBondContact O-OG 2.77Å; D238-K272 IonicContact OD1-NZ 2.79Å; D238-K272 PolarHBondContact OD1-NZ 2.98Å; D238-K272 VanDerWaalsContact OD1-NZ 3.13Å
239L92.6Very high88.7Confident8 Ų855.2 Ų55.24%0.04226%0.264CS..Hα-helixtrans-68.8-41.5176.5-169.364.8000111.2I224 L227 N236 V237 S242 L243I224-L239 HydrophobicContact CG1-CD1 4.35Å; I224-L239 HydrophobicContact CG2-CD1 3.61Å; I224-L239 HydrophobicContact CG2-CD2 4.25Å; I224-L239 HydrophobicContact CG2-CG 3.72Å; L227-L239 HydrophobicContact CB-CD2 4.31Å; L227-L239 HydrophobicContact CD2-CD1 4.01Å; L227-L239 HydrophobicContact CD2-CD2 3.83Å; L227-L239 HydrophobicContact CG-CD2 4.11Å; N236-L239 HydrophobicContact CB-CB 3.98Å; N236-L239 PolarHBondContact O-N 3.06Å; N236-L239 PolarHBondContact OD1-N 3.4Å; V237-L239 VanDerWaalsContact C-N 3.29Å; V237-L239 PolarHBondContact O-N 3.05Å; L239-S242 PolarHBondContact O-N 3.09Å; L239-L243 VanDerWaalsContact O-CB 3.28Å; L239-L243 WeakPolarHBondContact O-CB 3.24Å; L239-L243 PolarHBondContact O-N 3.11Å
240L94.6Very high88.9Confident4 Ų448.4 Ų48.42%0.02124%0.236CC..Hα-helixtrans-63.5-44175-71.4170.4000111.5E228 N236 V237 S242 L243 A244 K259 Q262 A263 L266E228-L240 WeakPolarHBondContact OE1-CD2 3.04Å; N236-L240 WeakPolarHBondContact O-CG 3.13Å; N236-L240 PolarHBondContact O-N 2.92Å; V237-L240 PolarHBondContact O-N 3.22Å; L240-S242 VanDerWaalsContact C-N 3.35Å; L240-S242 PolarHBondContact O-N 3.35Å; L240-L243 WeakPolarHBondContact O-CB 3.35Å; L240-L243 PolarHBondContact O-N 3.09Å; L240-A244 WeakPolarHBondContact O-CB 3.39Å; L240-A244 PolarHBondContact O-N 3.37Å; L240-K259 HydrophobicContact CD2-CD 3.8Å; L240-Q262 HydrophobicContact CD1-CB 4.46Å; L240-Q262 HydrophobicContact CD1-CG 3.97Å; L240-A263 HydrophobicContact CB-CB 3.96Å; L240-A263 HydrophobicContact CD1-CB 4.45Å; L240-L266 HydrophobicContact CD1-CD1 3.4Å; L240-L266 VanDerWaalsContact CD1-CD1 3.4Å
241V95.5Very high89.5Confident8 Ų841 Ų415%0.04821%0.21CC..Hα-helixtrans-61.9-43.5174.9170.60000111.1V237 L243 A244 D245 F260 A263 L270V237-V241 WeakPolarHBondContact O-CG2 3.33Å; V237-V241 PolarHBondContact O-N 2.87Å; V241-L243 VanDerWaalsContact C-N 3.34Å; V241-A244 PolarHBondContact O-N 3.01Å; V241-D245 PolarHBondContact O-N 3.05Å; V241-F260 HydrophobicContact CG1-CE1 4.37Å; V241-A263 HydrophobicContact CG2-CB 4.04Å; V241-L270 HydrophobicContact CG2-CD1 4.2Å; V241-L270 HydrophobicContact CG2-CD2 3.61Å; V241-L270 HydrophobicContact CG2-CG 4.46Å
242S93.1Very high90.4Very high16 Ų1642.2 Ų42.211%0.11221%0.214CC..Hα-helixtrans-65.2-39.8177.2-57.10000111.3Y209 D238 L239 L240 D245 V246Y209-S242 PolarHBondContact OH-OG 2.79Å; D238-S242 WeakPolarHBondContact O-CB 3.29Å; D238-S242 PolarHBondContact O-N 2.9Å; D238-S242 PolarHBondContact O-OG 2.77Å; L239-S242 PolarHBondContact O-N 3.09Å; L240-S242 VanDerWaalsContact C-N 3.35Å; L240-S242 PolarHBondContact O-N 3.35Å; S242-D245 PolarHBondContact O-N 3.26Å; S242-V246 VanDerWaalsContact O-CG2 3.22Å; S242-V246 WeakPolarHBondContact O-CG2 3.36Å; S242-V246 PolarHBondContact O-N 3.39Å
243L94.4Very high90.9Very high1 Ų135.4 Ų35.41%0.00518%0.179CC..Hα-helixtrans-63.7-44.4175.5-179.157.5000111.4I221 I224 L239 L240 V241 V246 Y247 K259I221-L243 HydrophobicContact CB-CD1 4.49Å; I221-L243 HydrophobicContact CG1-CD1 4.3Å; I221-L243 HydrophobicContact CG2-CD1 4.3Å; I224-L243 HydrophobicContact CB-CD1 4.15Å; I224-L243 HydrophobicContact CG2-CB 3.88Å; I224-L243 HydrophobicContact CG2-CD1 3.92Å; I224-L243 HydrophobicContact CG2-CD2 4.21Å; I224-L243 HydrophobicContact CG2-CG 4.21Å; L239-L243 VanDerWaalsContact O-CB 3.28Å; L239-L243 WeakPolarHBondContact O-CB 3.24Å; L239-L243 PolarHBondContact O-N 3.11Å; L240-L243 WeakPolarHBondContact O-CB 3.35Å; L240-L243 PolarHBondContact O-N 3.09Å; V241-L243 VanDerWaalsContact C-N 3.34Å; L243-V246 PolarHBondContact O-N 3.13Å; L243-Y247 HydrophobicContact CD1-CD2 3.93Å; L243-Y247 HydrophobicContact CD1-CE2 3.51Å; L243-Y247 HydrophobicContact CD2-CE2 3.94Å; L243-Y247 HydrophobicContact CG-CD2 3.78Å; L243-Y247 HydrophobicContact CG-CE2 3.48Å; L243-Y247 VanDerWaalsContact CG-CE2 3.48Å; L243-Y247 VanDerWaalsContact O-CD2 3.26Å; L243-Y247 WeakPolarHBondContact O-CD2 3.49Å; L243-Y247 PolarHBondContact O-N 2.89Å; L243-K259 HydrophobicContact CD2-CD 4.01Å; L243-K259 HydrophobicContact CD2-CG 4.21Å
244A95.6Very high91.3Very high0 Ų039.7 Ų39.70%020%0.196CC..Hα-helixtrans-63.3-40.4177.800000112L240 V241 V246 Y247 F248 K259 F260L240-A244 WeakPolarHBondContact O-CB 3.39Å; L240-A244 PolarHBondContact O-N 3.37Å; V241-A244 PolarHBondContact O-N 3.01Å; A244-V246 VanDerWaalsContact C-N 3.35Å; A244-V246 PolarHBondContact O-N 3.01Å; A244-Y247 PolarHBondContact O-N 2.92Å; A244-F248 WeakPolarHBondContact O-CB 3.31Å; A244-F248 PolarHBondContact O-N 2.86Å; A244-K259 HydrophobicContact CB-CB 3.89Å; A244-F260 HydrophobicContact CB-CD1 3.66Å; A244-F260 HydrophobicContact CB-CD2 3.64Å; A244-F260 HydrophobicContact CB-CE1 3.53Å; A244-F260 HydrophobicContact CB-CE2 3.51Å; A244-F260 HydrophobicContact CB-CG 3.71Å; A244-F260 HydrophobicContact CB-CZ 3.44Å; A244-F260 VanDerWaalsContact CB-CZ 3.44Å
245D92.9Very high91.6Very high40 Ų4035.3 Ų35.321%0.21419%0.185CC..Hα-helixtrans-64.5-37.1173.2-174.537.7000112V241 S242 F248 R249V241-D245 PolarHBondContact O-N 3.05Å; S242-D245 PolarHBondContact O-N 3.26Å; D245-F248 WeakPolarHBondContact O-CB 3.33Å; D245-F248 PolarHBondContact O-N 3.29Å; D245-R249 VanDerWaalsContact O-CG 3.24Å; D245-R249 WeakPolarHBondContact O-CG 3.26Å; D245-R249 PolarHBondContact O-N 3.39Å; D245-R249 IonicContact OD1-NE 3.27Å; D245-R249 IonicContact OD2-CZ 3.22Å; D245-R249 IonicContact OD2-NE 2.74Å; D245-R249 PolarHBondContact OD2-NE 3.38Å; D245-R249 VanDerWaalsContact OD2-NE 3.12Å; D245-R249 IonicContact OD2-NH2 3.17Å; D245-R249 PolarHBondContact OD2-NH2 3.17Å
246V92.7Very high92Very high0 Ų031.9 Ų31.90%017%0.166CC..Hα-helixtrans-69.9-40.1175.3-178.50000111.6I212 N217 A220 I221 I224 S242 L243 A244 F248 R249 A250I212-V246 HydrophobicContact CD1-CG2 3.94Å; I212-V246 HydrophobicContact CG1-CG2 3.69Å; I212-V246 HydrophobicContact CG2-CG2 4.29Å; N217-V246 HydrophobicContact CB-CG1 3.94Å; A220-V246 HydrophobicContact CB-CG1 3.99Å; I221-V246 HydrophobicContact CD1-CG1 4.05Å; I221-V246 HydrophobicContact CG1-CB 4.31Å; I221-V246 HydrophobicContact CG1-CG1 3.59Å; I224-V246 HydrophobicContact CD1-CG2 4.43Å; S242-V246 VanDerWaalsContact O-CG2 3.22Å; S242-V246 WeakPolarHBondContact O-CG2 3.36Å; S242-V246 PolarHBondContact O-N 3.39Å; L243-V246 PolarHBondContact O-N 3.13Å; A244-V246 VanDerWaalsContact C-N 3.35Å; A244-V246 PolarHBondContact O-N 3.01Å; V246-F248 VanDerWaalsContact C-N 3.3Å; V246-F248 PolarHBondContact O-N 2.71Å; V246-R249 PolarHBondContact O-N 3.46Å; V246-A250 WeakPolarHBondContact O-CB 3.41Å; V246-A250 PolarHBondContact O-N 3.09Å
247Y93.7Very high92.1Very high31 Ų3129.8 Ų29.812%0.12216%0.155CC..Hα-helixtrans-59.7-43.6172.1-82.6-58.5000111.4I221 L243 A244 R249 A250 G251 D252 N255 K259I221-Y247 HydrophobicContact CD1-CD1 3.72Å; I221-Y247 HydrophobicContact CD1-CE1 3.82Å; I221-Y247 HydrophobicContact CD1-CG 4.43Å; I221-Y247 HydrophobicContact CG1-CD1 4.27Å; I221-Y247 HydrophobicContact CG1-CE1 4.17Å; I221-Y247 HydrophobicContact CG2-CE1 3.78Å; I221-Y247 WeakPolarHBondContact CG2-OH 3.4Å; L243-Y247 HydrophobicContact CD1-CD2 3.93Å; L243-Y247 HydrophobicContact CD1-CE2 3.51Å; L243-Y247 HydrophobicContact CD2-CE2 3.94Å; L243-Y247 HydrophobicContact CG-CD2 3.78Å; L243-Y247 HydrophobicContact CG-CE2 3.48Å; L243-Y247 VanDerWaalsContact CG-CE2 3.48Å; L243-Y247 VanDerWaalsContact O-CD2 3.26Å; L243-Y247 WeakPolarHBondContact O-CD2 3.49Å; L243-Y247 PolarHBondContact O-N 2.89Å; A244-Y247 PolarHBondContact O-N 2.92Å; Y247-R249 PolarHBondContact O-N 2.94Å; Y247-A250 CarbonylContact O-C 3.58Å; Y247-A250 WeakPolarHBondContact O-CB 3.36Å; Y247-A250 PolarHBondContact O-N 2.9Å; Y247-A250 VanDerWaalsContact O-N 3.13Å; Y247-G251 PolarHBondContact O-N 3.34Å; Y247-G251 VanDerWaalsContact O-N 3.11Å; Y247-D252 HydrophobicContact CD1-CB 4.08Å; Y247-D252 PolarHBondContact O-N 3.37Å; Y247-N255 HydrophobicContact CD1-CB 3.9Å; Y247-N255 HydrophobicContact CD2-CB 4.2Å; Y247-N255 HydrophobicContact CE1-CB 3.95Å; Y247-N255 HydrophobicContact CE2-CB 4.23Å; Y247-N255 HydrophobicContact CG-CB 4.05Å; Y247-K259 HydrophobicContact CD2-CG 4.34Å; Y247-K259 HydrophobicContact CE2-CG 4.19Å
248F92.3Very high92.1Very high17 Ų1732.9 Ų32.98%0.07517%0.17CC..Hα-helixtrans-57.8-48.2174.3171.8-111.2000112A244 D245 V246 A250 G251 A256 V276 Y279 L280 R372 D374A244-F248 WeakPolarHBondContact O-CB 3.31Å; A244-F248 PolarHBondContact O-N 2.86Å; D245-F248 WeakPolarHBondContact O-CB 3.33Å; D245-F248 PolarHBondContact O-N 3.29Å; V246-F248 VanDerWaalsContact C-N 3.3Å; V246-F248 PolarHBondContact O-N 2.71Å; F248-A250 VanDerWaalsContact C-N 3.28Å; F248-A250 PolarHBondContact O-N 3.3Å; F248-G251 PolarHBondContact O-N 2.75Å; F248-A256 HydrophobicContact CB-CB 4.34Å; F248-V276 HydrophobicContact CB-CG1 4.23Å; F248-V276 HydrophobicContact CD1-CG1 3.71Å; F248-V276 HydrophobicContact CD2-CG1 4.05Å; F248-V276 HydrophobicContact CE1-CG1 4.08Å; F248-V276 HydrophobicContact CE2-CG1 4.37Å; F248-V276 HydrophobicContact CG-CG1 3.7Å; F248-V276 HydrophobicContact CZ-CG1 4.38Å; F248-Y279 HydrophobicContact CE2-CD1 4.25Å; F248-Y279 HydrophobicContact CE2-CE1 4.03Å; F248-Y279 HydrophobicContact CZ-CD1 4.43Å; F248-Y279 HydrophobicContact CZ-CE1 4.23Å; F248-L280 HydrophobicContact CB-CD1 4.49Å; F248-L280 HydrophobicContact CD2-CD1 3.94Å; F248-L280 HydrophobicContact CD2-CD2 3.72Å; F248-L280 HydrophobicContact CD2-CG 4.05Å; F248-L280 HydrophobicContact CE2-CD2 3.85Å; F248-L280 HydrophobicContact CE2-CG 4.35Å; F248-R372 HydrophobicContact CE1-CG 4.34Å; F248-R372 VanDerWaalsContact CE1-NH2 3.27Å; F248-R372 VanDerWaalsContact CZ-NH2 3.29Å; F248-D374 WeakPolarHBondContact CZ-OD2 3.48Å
249R88.4Confident92.3Very high64 Ų6430.8 Ų30.824%0.24216%0.157CC..Hα-helixtrans-63.3-31175.6-68.1169.6-167.3-162.54.9113.2N217 D245 V246 Y247 G251N217-R249 PolarHBondContact ND2-O 3.32Å; D245-R249 VanDerWaalsContact O-CG 3.24Å; D245-R249 WeakPolarHBondContact O-CG 3.26Å; D245-R249 PolarHBondContact O-N 3.39Å; D245-R249 IonicContact OD1-NE 3.27Å; D245-R249 IonicContact OD2-CZ 3.22Å; D245-R249 IonicContact OD2-NE 2.74Å; D245-R249 PolarHBondContact OD2-NE 3.38Å; D245-R249 VanDerWaalsContact OD2-NE 3.12Å; D245-R249 IonicContact OD2-NH2 3.17Å; D245-R249 PolarHBondContact OD2-NH2 3.17Å; V246-R249 PolarHBondContact O-N 3.46Å; Y247-R249 PolarHBondContact O-N 2.94Å; R249-G251 PolarHBondContact O-N 3.48Å
250A87.4Confident92.4Very high10 Ų1030.5 Ų30.58%0.08316%0.155CC..Hα-helixtrans-75.9-10.1174.900000113.7N217 I221 V246 Y247 F248 D252 Q408 R438N217-A250 HydrophobicContact CB-CB 4.04Å; I221-A250 HydrophobicContact CD1-CB 4.16Å; V246-A250 WeakPolarHBondContact O-CB 3.41Å; V246-A250 PolarHBondContact O-N 3.09Å; Y247-A250 CarbonylContact O-C 3.58Å; Y247-A250 WeakPolarHBondContact O-CB 3.36Å; Y247-A250 PolarHBondContact O-N 2.9Å; Y247-A250 VanDerWaalsContact O-N 3.13Å; F248-A250 VanDerWaalsContact C-N 3.28Å; F248-A250 PolarHBondContact O-N 3.3Å; A250-D252 VanDerWaalsContact C-N 3.34Å; A250-Q408 PolarHBondContact O-OE1 3.1Å; A250-R438 PolarHBondContact O-NH1 3.41Å; A250-R438 PolarHBondContact O-NH2 3.43Å; A250-R438 VanDerWaalsContact O-NH2 3.12Å
251G84.9Confident92.4Very high21 Ų2133.5 Ų33.522%0.21617%0.169CC..THydrogen-bonded Turntrans819.5-176.200000114.9Y247 F248 R249 T253Y247-G251 PolarHBondContact O-N 3.34Å; Y247-G251 VanDerWaalsContact O-N 3.11Å; F248-G251 PolarHBondContact O-N 2.75Å; R249-G251 PolarHBondContact O-N 3.48Å; G251-T253 PolarHBondContact O-N 3.04Å
252D88Confident92.3Very high52 Ų5235.3 Ų35.328%0.27818%0.177SC..  trans-9189.1177.7-175.5-9.9000109.3Y247 A250 N255 A256Y247-D252 HydrophobicContact CD1-CB 4.08Å; Y247-D252 PolarHBondContact O-N 3.37Å; A250-D252 VanDerWaalsContact C-N 3.34Å; D252-N255 PolarHBondContact OD1-N 3.18Å; D252-N255 PolarHBondContact OD1-ND2 3.13Å; D252-N255 PolarHBondContact OD2-ND2 3.42Å; D252-A256 WeakPolarHBondContact O-CB 3.41Å; D252-A256 PolarHBondContact O-N 3.06Å
253T89.3Confident92.4Very high20 Ų2034.6 Ų34.612%0.12317%0.172CC..Hα-helixtrans-81.1-29.4-169.654.90000113G251 A256 I257 L280 R283G251-T253 PolarHBondContact O-N 3.04Å; T253-A256 PolarHBondContact O-N 3.36Å; T253-I257 VanDerWaalsContact O-CG1 3.29Å; T253-I257 WeakPolarHBondContact O-CG1 3.3Å; T253-I257 PolarHBondContact O-N 2.98Å; T253-L280 HydrophobicContact CG2-CD2 3.71Å; T253-R283 VanDerWaalsContact CB-NH2 3.26Å; T253-R283 PolarHBondContact OG1-NH2 3.07Å; T253-R283 VanDerWaalsContact OG1-NH2 3.1Å
254K89.8Confident92.4Very high129 Ų12936.3 Ų36.356%0.56118%0.18SC*.Hα-helixtrans-63.4-51.2175.7-63.8-175.7179.8-177.90111.1A256 I257 L258K254-A256 VanDerWaalsContact C-N 3.33Å; K254-A256 PolarHBondContact O-N 3.01Å; K254-I257 PolarHBondContact O-N 3.37Å; K254-L258 WeakPolarHBondContact O-CG 3.43Å; K254-L258 PolarHBondContact O-N 2.93Å
255N92.1Very high92.2Very high67 Ų6743.2 Ų43.236%0.35821%0.214SC..Hα-helixtrans-68.6-31.8178.5-73.8-44.3000112.7Y247 D252 K259Y247-N255 HydrophobicContact CD1-CB 3.9Å; Y247-N255 HydrophobicContact CD2-CB 4.2Å; Y247-N255 HydrophobicContact CE1-CB 3.95Å; Y247-N255 HydrophobicContact CE2-CB 4.23Å; Y247-N255 HydrophobicContact CG-CB 4.05Å; D252-N255 PolarHBondContact OD1-N 3.18Å; D252-N255 PolarHBondContact OD1-ND2 3.13Å; D252-N255 PolarHBondContact OD2-ND2 3.42Å; N255-K259 WeakPolarHBondContact O-CG 3.47Å; N255-K259 PolarHBondContact O-N 3.39Å; N255-K259 VanDerWaalsContact O-N 3.15Å
256A95.3Very high92.3Very high0 Ų045.1 Ų45.10%022%0.224CC..Hα-helixtrans-61.6-48.7173.900000111.8F248 D252 T253 K254 K259 F260 L280F248-A256 HydrophobicContact CB-CB 4.34Å; D252-A256 WeakPolarHBondContact O-CB 3.41Å; D252-A256 PolarHBondContact O-N 3.06Å; T253-A256 PolarHBondContact O-N 3.36Å; K254-A256 VanDerWaalsContact C-N 3.33Å; K254-A256 PolarHBondContact O-N 3.01Å; A256-K259 PolarHBondContact O-N 3.23Å; A256-F260 HydrophobicContact CB-CE2 4.46Å; A256-F260 WeakPolarHBondContact O-CD2 3.37Å; A256-F260 PolarHBondContact O-N 2.89Å; A256-L280 HydrophobicContact CB-CD1 3.8Å
257I95.1Very high92.3Very high23 Ų2347.7 Ų47.712%0.11824%0.238CC..Hα-helixtrans-58.3-50.3178.5-72.9168.6000110.7T253 K254 K259 F260 E261 Y277 L280 E284T253-I257 VanDerWaalsContact O-CG1 3.29Å; T253-I257 WeakPolarHBondContact O-CG1 3.3Å; T253-I257 PolarHBondContact O-N 2.98Å; K254-I257 PolarHBondContact O-N 3.37Å; I257-K259 VanDerWaalsContact C-N 3.27Å; I257-K259 PolarHBondContact O-N 2.94Å; I257-F260 PolarHBondContact O-N 3.32Å; I257-F260 VanDerWaalsContact O-N 3.12Å; I257-E261 WeakPolarHBondContact CG2-OE1 3.37Å; I257-E261 WeakPolarHBondContact O-CG 3.17Å; I257-E261 PolarHBondContact O-N 3.29Å; I257-Y277 HydrophobicContact CG2-CE2 4.11Å; I257-L280 HydrophobicContact CD1-CB 4.19Å; I257-L280 HydrophobicContact CG1-CB 3.95Å; I257-L280 HydrophobicContact CG1-CD1 4.3Å; I257-E284 HydrophobicContact CD1-CG 3.72Å
258L94.4Very high92.2Very high97 Ų9749.4 Ų49.451%0.50825%0.252SS..Hα-helixtrans-57.5-38.8179.1-69.3174.3000112.9K254 Q262K254-L258 WeakPolarHBondContact O-CG 3.43Å; K254-L258 PolarHBondContact O-N 2.93Å; L258-Q262 WeakPolarHBondContact O-CB 3.39Å; L258-Q262 PolarHBondContact O-N 3.46Å
259K95.3Very high92.3Very high39 Ų3956.5 Ų56.517%0.1728%0.28CS..Hα-helixtrans-75.1-33.3178.8-69.6-65.5178.2-177.90112.9E228 L240 L243 A244 Y247 N255 A256 I257 A263E228-K259 IonicContact OE1-NZ 2.62Å; E228-K259 PolarHBondContact OE1-NZ 3.35Å; E228-K259 IonicContact OE2-NZ 3.84Å; L240-K259 HydrophobicContact CD2-CD 3.8Å; L243-K259 HydrophobicContact CD2-CD 4.01Å; L243-K259 HydrophobicContact CD2-CG 4.21Å; A244-K259 HydrophobicContact CB-CB 3.89Å; Y247-K259 HydrophobicContact CD2-CG 4.34Å; Y247-K259 HydrophobicContact CE2-CG 4.19Å; N255-K259 WeakPolarHBondContact O-CG 3.47Å; N255-K259 PolarHBondContact O-N 3.39Å; N255-K259 VanDerWaalsContact O-N 3.15Å; A256-K259 PolarHBondContact O-N 3.23Å; I257-K259 VanDerWaalsContact C-N 3.27Å; I257-K259 PolarHBondContact O-N 2.94Å; K259-A263 WeakPolarHBondContact O-CB 3.41Å; K259-A263 PolarHBondContact O-N 3.05Å
260F95.9Very high92.5Very high1 Ų154 Ų540%0.00427%0.271CS..Hα-helixtrans-67.1-41.1170.3-76.8-57.2000112.1V241 A244 A256 I257 A263 Q264 V276 Y277 L280V241-F260 HydrophobicContact CG1-CE1 4.37Å; A244-F260 HydrophobicContact CB-CD1 3.66Å; A244-F260 HydrophobicContact CB-CD2 3.64Å; A244-F260 HydrophobicContact CB-CE1 3.53Å; A244-F260 HydrophobicContact CB-CE2 3.51Å; A244-F260 HydrophobicContact CB-CG 3.71Å; A244-F260 HydrophobicContact CB-CZ 3.44Å; A244-F260 VanDerWaalsContact CB-CZ 3.44Å; A256-F260 HydrophobicContact CB-CE2 4.46Å; A256-F260 WeakPolarHBondContact O-CD2 3.37Å; A256-F260 PolarHBondContact O-N 2.89Å; I257-F260 PolarHBondContact O-N 3.32Å; I257-F260 VanDerWaalsContact O-N 3.12Å; F260-A263 PolarHBondContact O-N 3.12Å; F260-Q264 WeakPolarHBondContact O-CB 3.41Å; F260-Q264 PolarHBondContact O-N 3.16Å; F260-V276 HydrophobicContact CE2-CB 4.45Å; F260-V276 HydrophobicContact CE2-CG1 4.07Å; F260-V276 HydrophobicContact CZ-CB 4.16Å; F260-V276 HydrophobicContact CZ-CG1 4.12Å; F260-Y277 HydrophobicContact CB-CD1 4.33Å; F260-Y277 HydrophobicContact CB-CD2 3.33Å; F260-Y277 HydrophobicContact CB-CE2 3.88Å; F260-Y277 HydrophobicContact CB-CG 3.6Å; F260-Y277 AromaticContact CD2-CD2 3.95Å; F260-Y277 HydrophobicContact CD2-CD2 3.95Å; F260-Y277 HydrophobicContact CD2-CG 4.26Å; F260-Y277 AromaticContact CG-CD2 3.91Å; F260-Y277 HydrophobicContact CG-CD2 3.91Å; F260-Y277 AromaticContact CG-CG 3.99Å; F260-Y277 HydrophobicContact CG-CG 3.99Å; F260-L280 HydrophobicContact CD2-CD1 4.44Å; F260-L280 HydrophobicContact CE2-CD1 4.17Å
261E94.1Very high92.8Very high68 Ų6855 Ų5532%0.31827%0.274SS..Hα-helixtrans-60-46173.8-76.2170.7-175.600111.5I257 A263 Q264 M265 Y277I257-E261 WeakPolarHBondContact CG2-OE1 3.37Å; I257-E261 WeakPolarHBondContact O-CG 3.17Å; I257-E261 PolarHBondContact O-N 3.29Å; E261-A263 VanDerWaalsContact C-N 3.35Å; E261-A263 PolarHBondContact O-N 3.47Å; E261-Q264 PolarHBondContact O-N 3.07Å; E261-M265 WeakPolarHBondContact O-CG 3.33Å; E261-M265 PolarHBondContact O-N 2.94Å; E261-Y277 HydrophobicContact CG-CE2 4.02Å; E261-Y277 WeakPolarHBondContact CG-OH 3.48Å; E261-Y277 PolarHBondContact OE1-OH 3.06Å
262Q94.2Very high93.1Very high46 Ų4659.6 Ų59.622%0.21529%0.289CS..Hα-helixtrans-58.8-45.9174.5-169.8-176.8-4.500111.4D235 L240 L258 Q264 M265 L266D235-Q262 PolarHBondContact OD1-NE2 3.13Å; L240-Q262 HydrophobicContact CD1-CB 4.46Å; L240-Q262 HydrophobicContact CD1-CG 3.97Å; L258-Q262 WeakPolarHBondContact O-CB 3.39Å; L258-Q262 PolarHBondContact O-N 3.46Å; Q262-Q264 VanDerWaalsContact C-N 3.33Å; Q262-Q264 PolarHBondContact O-N 2.89Å; Q262-M265 PolarHBondContact O-N 2.83Å; Q262-L266 HydrophobicContact CG-CD1 4.28Å; Q262-L266 WeakPolarHBondContact O-CD1 3.1Å; Q262-L266 VanDerWaalsContact O-CG 3.31Å; Q262-L266 WeakPolarHBondContact O-CG 3.49Å; Q262-L266 PolarHBondContact O-N 3.2Å; Q262-L266 VanDerWaalsContact O-N 3.17Å
263A95.1Very high93.2Very high0 Ų057.7 Ų57.70%028%0.282CS..Hα-helixtrans-62.2-41.1178.400000112.2V237 L240 V241 K259 F260 E261 L266 D267 L270V237-A263 HydrophobicContact CG1-CB 4.43Å; L240-A263 HydrophobicContact CB-CB 3.96Å; L240-A263 HydrophobicContact CD1-CB 4.45Å; V241-A263 HydrophobicContact CG2-CB 4.04Å; K259-A263 WeakPolarHBondContact O-CB 3.41Å; K259-A263 PolarHBondContact O-N 3.05Å; F260-A263 PolarHBondContact O-N 3.12Å; E261-A263 VanDerWaalsContact C-N 3.35Å; E261-A263 PolarHBondContact O-N 3.47Å; A263-L266 PolarHBondContact O-N 2.87Å; A263-D267 PolarHBondContact O-N 3Å; A263-L270 HydrophobicContact CB-CD2 3.8Å
264Q93.2Very high93.5Very high37 Ų3756.8 Ų56.817%0.17328%0.276CS..Hα-helixtrans-66.8-38177.1170.6174.6-57.600113F260 E261 Q262 L266 D267 M274 R296F260-Q264 WeakPolarHBondContact O-CB 3.41Å; F260-Q264 PolarHBondContact O-N 3.16Å; E261-Q264 PolarHBondContact O-N 3.07Å; Q262-Q264 VanDerWaalsContact C-N 3.33Å; Q262-Q264 PolarHBondContact O-N 2.89Å; Q264-L266 VanDerWaalsContact C-N 3.28Å; Q264-L266 PolarHBondContact O-N 3.49Å; Q264-D267 CarbonylContact O-C 3.54Å; Q264-D267 VanDerWaalsContact O-C 3.3Å; Q264-M274 HydrophobicContact CB-CE 4.1Å; Q264-R296 VanDerWaalsContact CD-CZ 3.5Å; Q264-R296 VanDerWaalsContact CG-NH2 3.29Å
265M92.9Very high93.7Very high146 Ų14651.6 Ų51.672%0.71926%0.255SS*.Hα-helixtrans-66.3-33176.2-75.1-172.6-72.100111.9E261 Q262E261-M265 WeakPolarHBondContact O-CG 3.33Å; E261-M265 PolarHBondContact O-N 2.94Å; Q262-M265 PolarHBondContact O-N 2.83Å
266L94.1Very high93.8Very high80 Ų8048.8 Ų48.842%0.41924%0.24SC..Hα-helixtrans-77.6-39.1178.3-68.3166.4000112.4D235 V237 L240 Q262 A263 Q264D235-L266 HydrophobicContact CB-CD1 3.79Å; D235-L266 HydrophobicContact CB-CD2 4.19Å; V237-L266 HydrophobicContact CG2-CB 4.01Å; L240-L266 HydrophobicContact CD1-CD1 3.4Å; L240-L266 VanDerWaalsContact CD1-CD1 3.4Å; Q262-L266 HydrophobicContact CG-CD1 4.28Å; Q262-L266 WeakPolarHBondContact O-CD1 3.1Å; Q262-L266 VanDerWaalsContact O-CG 3.31Å; Q262-L266 WeakPolarHBondContact O-CG 3.49Å; Q262-L266 PolarHBondContact O-N 3.2Å; Q262-L266 VanDerWaalsContact O-N 3.17Å; A263-L266 PolarHBondContact O-N 2.87Å; Q264-L266 VanDerWaalsContact C-N 3.28Å; Q264-L266 PolarHBondContact O-N 3.49Å
267D93.8Very high93.8Very high54 Ų5449.3 Ų49.329%0.28924%0.242SC..  trans-130100.6176.8-176.56.7000111.9V237 A263 Q264 Y269 L270V237-D267 HydrophobicContact CG1-CB 4.09Å; V237-D267 HydrophobicContact CG2-CB 3.95Å; A263-D267 PolarHBondContact O-N 3Å; Q264-D267 CarbonylContact O-C 3.54Å; Q264-D267 VanDerWaalsContact O-C 3.3Å; D267-Y269 PolarHBondContact O-N 3.24Å; D267-Y269 PolarHBondContact OD1-N 3.18Å; D267-L270 HydrophobicContact CB-CB 4.21Å; D267-L270 VanDerWaalsContact O-CB 3.29Å; D267-L270 WeakPolarHBondContact O-CB 3.38Å; D267-L270 PolarHBondContact O-N 3.36Å
268P91.3Very high93.8Very high66 Ų6648.2 Ų48.243%0.42924%0.236SC..THydrogen-bonded Turntrans-61.9-21.2176.4-25.135.4000114.6I300P268-I300 VanDerWaalsContact O-CD1 3.28Å; P268-I300 WeakPolarHBondContact O-CD1 3.49Å
269Y92.9Very high93.8Very high167 Ų16745.7 Ų45.766%0.65522%0.22SC*.THydrogen-bonded Turntrans-96.99.8-177.4-57.6-79.7000113.1D267 I271 I300D267-Y269 PolarHBondContact O-N 3.24Å; D267-Y269 PolarHBondContact OD1-N 3.18Å; Y269-I271 PolarHBondContact O-N 3.17Å; Y269-I300 HydrophobicContact CD1-CD1 4.39Å; Y269-I300 HydrophobicContact CD1-CG1 3.96Å; Y269-I300 HydrophobicContact CD1-CG2 4.08Å
270L93.9Very high93.7Very high12 Ų1243.9 Ų43.96%0.06321%0.212CC..  trans-66118.9-179.6177.861.2000111.5V237 V241 A263 D267 K272 M274V237-L270 HydrophobicContact CG1-CD1 3.97Å; V237-L270 HydrophobicContact CG1-CD2 3.75Å; V237-L270 HydrophobicContact CG1-CG 4.36Å; V241-L270 HydrophobicContact CG2-CD1 4.2Å; V241-L270 HydrophobicContact CG2-CD2 3.61Å; V241-L270 HydrophobicContact CG2-CG 4.46Å; A263-L270 HydrophobicContact CB-CD2 3.8Å; D267-L270 HydrophobicContact CB-CB 4.21Å; D267-L270 VanDerWaalsContact O-CB 3.29Å; D267-L270 WeakPolarHBondContact O-CB 3.38Å; D267-L270 PolarHBondContact O-N 3.36Å; L270-K272 HydrophobicContact CD1-CB 4.36Å; L270-M274 HydrophobicContact CB-CE 3.9Å; L270-M274 HydrophobicContact CD2-CE 3.2Å; L270-M274 HydrophobicContact CG-CE 3.47Å; L270-M274 VanDerWaalsContact CG-CE 3.47Å; L270-M274 WeakPolarHBondContact O-CG 3.46Å
271I92.7Very high93.6Very high29 Ų2944 Ų4415%0.14921%0.213CC..  trans-99.9-42.4176.8-62.2172.5000111Y269 G273 M274 L297 I300 S301 H304 E306Y269-I271 PolarHBondContact O-N 3.17Å; I271-G273 PolarHBondContact O-N 3.36Å; I271-M274 WeakPolarHBondContact O-CB 3.34Å; I271-M274 PolarHBondContact O-N 3.35Å; I271-L297 HydrophobicContact CG1-CD2 4.48Å; I271-I300 HydrophobicContact CD1-CG2 4.33Å; I271-S301 WeakPolarHBondContact CD1-OG 3.2Å; I271-H304 VanDerWaalsContact CD1-CD2 3.43Å; I271-H304 WeakPolarHBondContact CD1-CD2 3.48Å; I271-H304 HydrophobicContact CG2-CB 4.05Å; I271-E306 HydrophobicContact CG2-CB 3.99Å; I271-E306 HydrophobicContact CG2-CG 3.95Å
272K91.2Very high93.5Very high118 Ų11840.8 Ų40.851%0.51320%0.198SC..THydrogen-bonded Turntrans-66.2126.8-173.9-177.7-177.9168.6-164.30111.1D238 L270 M274D238-K272 IonicContact OD1-NZ 2.79Å; D238-K272 PolarHBondContact OD1-NZ 2.98Å; D238-K272 VanDerWaalsContact OD1-NZ 3.13Å; L270-K272 HydrophobicContact CD1-CB 4.36Å; K272-M274 VanDerWaalsContact C-N 3.28Å; K272-M274 PolarHBondContact O-N 3.44Å
273G91.4Very high93.2Very high13 Ų1342.5 Ų42.513%0.13420%0.202CC..THydrogen-bonded Turntrans84.8-7.1178.600000114.8I271 D275 V276 Y277I271-G273 PolarHBondContact O-N 3.36Å; G273-D275 WeakPolarHBondContact CA-OD1 3.5Å; G273-D275 PolarHBondContact O-N 3.25Å; G273-V276 PolarHBondContact O-N 3.15Å; G273-Y277 PolarHBondContact O-N 3.23Å; G273-Y277 VanDerWaalsContact O-N 3.08Å
274M94.6Very high92.8Very high0 Ų046.5 Ų46.50%022%0.221CC..Hα-helixtrans-68-24.2176.9-67.3-62.3148.900112.9Q264 L270 I271 K272 Y277 G278 L293 L297 I310Q264-M274 HydrophobicContact CB-CE 4.1Å; L270-M274 HydrophobicContact CB-CE 3.9Å; L270-M274 HydrophobicContact CD2-CE 3.2Å; L270-M274 HydrophobicContact CG-CE 3.47Å; L270-M274 VanDerWaalsContact CG-CE 3.47Å; L270-M274 WeakPolarHBondContact O-CG 3.46Å; I271-M274 WeakPolarHBondContact O-CB 3.34Å; I271-M274 PolarHBondContact O-N 3.35Å; K272-M274 VanDerWaalsContact C-N 3.28Å; K272-M274 PolarHBondContact O-N 3.44Å; M274-Y277 PolarHBondContact O-N 3.16Å; M274-Y277 HydrophobicContact SD-CD1 3.86Å; M274-G278 PolarHBondContact O-N 3.2Å; M274-L293 HydrophobicContact SD-CD1 4.18Å; M274-L297 HydrophobicContact CB-CD1 3.76Å; M274-L297 HydrophobicContact CG-CD1 4.16Å; M274-L297 HydrophobicContact CG-CD2 4.32Å; M274-I310 HydrophobicContact CB-CD1 3.87Å; M274-I310 WeakPolarHBondContact O-CD1 3.42Å; M274-I310 WeakPolarHBondContact O-CG1 3.49Å
275D94.2Very high92.5Very high21 Ų2147.2 Ų47.211%0.11224%0.238CC..Hα-helixtrans-64-42.117360-23.8000112.3G273 Y279 E306 V309 Q340G273-D275 WeakPolarHBondContact CA-OD1 3.5Å; G273-D275 PolarHBondContact O-N 3.25Å; D275-Y279 WeakPolarHBondContact O-CB 3.43Å; D275-Y279 PolarHBondContact O-N 2.83Å; D275-Y279 VanDerWaalsContact O-N 3.16Å; D275-E306 HydrophobicContact CB-CB 4.34Å; D275-E306 HydrophobicContact CB-CG 4.12Å; D275-V309 HydrophobicContact CB-CB 4.26Å; D275-V309 HydrophobicContact CB-CG1 3.96Å; D275-Q340 HydrophobicContact CB-CB 4.22Å; D275-Q340 HydrophobicContact CB-CG 4.26Å
276V94.3Very high92.3Very high8 Ų845.1 Ų45.15%0.04823%0.227CC..Hα-helixtrans-70.3-43.2173.9-1800000110.6F248 F260 G273 Y279 L280F248-V276 HydrophobicContact CB-CG1 4.23Å; F248-V276 HydrophobicContact CD1-CG1 3.71Å; F248-V276 HydrophobicContact CD2-CG1 4.05Å; F248-V276 HydrophobicContact CE1-CG1 4.08Å; F248-V276 HydrophobicContact CE2-CG1 4.37Å; F248-V276 HydrophobicContact CG-CG1 3.7Å; F248-V276 HydrophobicContact CZ-CG1 4.38Å; F260-V276 HydrophobicContact CE2-CB 4.45Å; F260-V276 HydrophobicContact CE2-CG1 4.07Å; F260-V276 HydrophobicContact CZ-CB 4.16Å; F260-V276 HydrophobicContact CZ-CG1 4.12Å; G273-V276 PolarHBondContact O-N 3.15Å; V276-Y279 WeakPolarHBondContact O-CB 3.17Å; V276-Y279 PolarHBondContact O-N 3Å; V276-L280 HydrophobicContact CG1-CD1 4.31Å; V276-L280 WeakPolarHBondContact O-CG 3.3Å; V276-L280 PolarHBondContact O-N 3.16Å
277Y95.3Very high92.2Very high10 Ų1043.7 Ų43.74%0.03922%0.219CC..Hα-helixtrans-60.4-49.3177.4177.5-129.4000112.3I257 F260 E261 G273 M274 Y279 L280 M281 L293I257-Y277 HydrophobicContact CG2-CE2 4.11Å; F260-Y277 HydrophobicContact CB-CD1 4.33Å; F260-Y277 HydrophobicContact CB-CD2 3.33Å; F260-Y277 HydrophobicContact CB-CE2 3.88Å; F260-Y277 HydrophobicContact CB-CG 3.6Å; F260-Y277 AromaticContact CD2-CD2 3.95Å; F260-Y277 HydrophobicContact CD2-CD2 3.95Å; F260-Y277 HydrophobicContact CD2-CG 4.26Å; F260-Y277 AromaticContact CG-CD2 3.91Å; F260-Y277 HydrophobicContact CG-CD2 3.91Å; F260-Y277 AromaticContact CG-CG 3.99Å; F260-Y277 HydrophobicContact CG-CG 3.99Å; E261-Y277 HydrophobicContact CG-CE2 4.02Å; E261-Y277 WeakPolarHBondContact CG-OH 3.48Å; E261-Y277 PolarHBondContact OE1-OH 3.06Å; G273-Y277 PolarHBondContact O-N 3.23Å; G273-Y277 VanDerWaalsContact O-N 3.08Å; M274-Y277 PolarHBondContact O-N 3.16Å; M274-Y277 HydrophobicContact SD-CD1 3.86Å; Y277-Y279 VanDerWaalsContact C-N 3.3Å; Y277-Y279 PolarHBondContact O-N 3.05Å; Y277-L280 WeakPolarHBondContact O-CB 3.43Å; Y277-L280 PolarHBondContact O-N 2.85Å; Y277-L280 VanDerWaalsContact O-N 3.1Å; Y277-M281 HydrophobicContact CD1-CE 3.68Å; Y277-M281 HydrophobicContact CD1-SD 4.39Å; Y277-M281 HydrophobicContact CD2-CE 4.46Å; Y277-M281 HydrophobicContact CD2-CG 4.07Å; Y277-M281 HydrophobicContact CD2-SD 4.41Å; Y277-M281 HydrophobicContact CE1-CE 3.33Å; Y277-M281 HydrophobicContact CE1-CG 4.5Å; Y277-M281 HydrophobicContact CE1-SD 3.65Å; Y277-M281 HydrophobicContact CE2-CE 4.19Å; Y277-M281 HydrophobicContact CE2-CG 3.65Å; Y277-M281 HydrophobicContact CE2-SD 3.68Å; Y277-M281 HydrophobicContact CG-CE 4.23Å; Y277-M281 PolarHBondContact O-N 3.32Å; Y277-M281 PolarHBondContact OH-SD 3.01Å; Y277-L293 HydrophobicContact CD1-CD2 3.57Å; Y277-L293 HydrophobicContact CE1-CD2 3.87Å
278G94.3Very high92.1Very high0 Ų048.8 Ų48.80%024%0.241CC..Hα-helixtrans-63.5-34.2177.500000113.1M274 A282M274-G278 PolarHBondContact O-N 3.2Å; G278-A282 VanDerWaalsContact O-CB 3.22Å; G278-A282 WeakPolarHBondContact O-CB 3.32Å; G278-A282 PolarHBondContact O-N 3.35Å
279Y94.6Very high92.1Very high45 Ų4549.8 Ų49.818%0.17624%0.243CC..Hα-helixtrans-63.7-44.7170.7167.3-107.8000112.3F248 D275 V276 Y277 A282 R283 Q340F248-Y279 HydrophobicContact CE2-CD1 4.25Å; F248-Y279 HydrophobicContact CE2-CE1 4.03Å; F248-Y279 HydrophobicContact CZ-CD1 4.43Å; F248-Y279 HydrophobicContact CZ-CE1 4.23Å; D275-Y279 WeakPolarHBondContact O-CB 3.43Å; D275-Y279 PolarHBondContact O-N 2.83Å; D275-Y279 VanDerWaalsContact O-N 3.16Å; V276-Y279 WeakPolarHBondContact O-CB 3.17Å; V276-Y279 PolarHBondContact O-N 3Å; Y277-Y279 VanDerWaalsContact C-N 3.3Å; Y277-Y279 PolarHBondContact O-N 3.05Å; Y279-A282 PolarHBondContact O-N 3.35Å; Y279-R283 WeakPolarHBondContact O-CB 3.39Å; Y279-R283 PolarHBondContact O-N 3.45Å; Y279-Q340 VanDerWaalsContact CB-NE2 3.28Å; Y279-Q340 VanDerWaalsContact CD2-NE2 3.31Å
280L93.8Very high92.2Very high0 Ų041.8 Ų41.80%021%0.212CC..Hα-helixtrans-62.4-50.2178.5-76177.9000111.6F248 T253 A256 I257 F260 V276 Y277 A282 R283 E284F248-L280 HydrophobicContact CB-CD1 4.49Å; F248-L280 HydrophobicContact CD2-CD1 3.94Å; F248-L280 HydrophobicContact CD2-CD2 3.72Å; F248-L280 HydrophobicContact CD2-CG 4.05Å; F248-L280 HydrophobicContact CE2-CD2 3.85Å; F248-L280 HydrophobicContact CE2-CG 4.35Å; T253-L280 HydrophobicContact CG2-CD2 3.71Å; A256-L280 HydrophobicContact CB-CD1 3.8Å; I257-L280 HydrophobicContact CD1-CB 4.19Å; I257-L280 HydrophobicContact CG1-CB 3.95Å; I257-L280 HydrophobicContact CG1-CD1 4.3Å; F260-L280 HydrophobicContact CD2-CD1 4.44Å; F260-L280 HydrophobicContact CE2-CD1 4.17Å; V276-L280 HydrophobicContact CG1-CD1 4.31Å; V276-L280 WeakPolarHBondContact O-CG 3.3Å; V276-L280 PolarHBondContact O-N 3.16Å; Y277-L280 WeakPolarHBondContact O-CB 3.43Å; Y277-L280 PolarHBondContact O-N 2.85Å; Y277-L280 VanDerWaalsContact O-N 3.1Å; L280-A282 VanDerWaalsContact C-N 3.32Å; L280-A282 PolarHBondContact O-N 3.24Å; L280-R283 WeakPolarHBondContact O-CB 3.46Å; L280-R283 PolarHBondContact O-N 3.29Å; L280-R283 VanDerWaalsContact O-N 3.1Å; L280-E284 WeakPolarHBondContact O-CG 3.47Å; L280-E284 PolarHBondContact O-N 3.28Å
281M92.8Very high92.1Very high4 Ų447.1 Ų47.12%0.0224%0.236CC..Hα-helixtrans-58.9-43.8177.1-70.9-166.4-66.500112.4Y277 R283 E284 G285 H286 D289 V290 L293Y277-M281 HydrophobicContact CD1-CE 3.68Å; Y277-M281 HydrophobicContact CD1-SD 4.39Å; Y277-M281 HydrophobicContact CD2-CE 4.46Å; Y277-M281 HydrophobicContact CD2-CG 4.07Å; Y277-M281 HydrophobicContact CD2-SD 4.41Å; Y277-M281 HydrophobicContact CE1-CE 3.33Å; Y277-M281 HydrophobicContact CE1-CG 4.5Å; Y277-M281 HydrophobicContact CE1-SD 3.65Å; Y277-M281 HydrophobicContact CE2-CE 4.19Å; Y277-M281 HydrophobicContact CE2-CG 3.65Å; Y277-M281 HydrophobicContact CE2-SD 3.68Å; Y277-M281 HydrophobicContact CG-CE 4.23Å; Y277-M281 PolarHBondContact O-N 3.32Å; Y277-M281 PolarHBondContact OH-SD 3.01Å; M281-R283 PolarHBondContact O-N 2.98Å; M281-E284 PolarHBondContact O-N 3.09Å; M281-G285 PolarHBondContact O-N 2.87Å; M281-G285 VanDerWaalsContact O-N 3.17Å; M281-H286 PolarHBondContact O-N 3.45Å; M281-H286 VanDerWaalsContact O-N 3.13Å; M281-D289 HydrophobicContact SD-CB 4.07Å; M281-V290 HydrophobicContact CB-CG2 3.55Å; M281-V290 HydrophobicContact CE-CG2 4.07Å; M281-L293 HydrophobicContact CE-CB 4.2Å; M281-L293 HydrophobicContact CE-CD2 3.32Å; M281-L293 HydrophobicContact CE-CG 4.35Å
282A92.4Very high92.2Very high1 Ų150.6 Ų50.61%0.00826%0.259CS..Hα-helixtrans-65.2-30.7178.800000112.2G278 Y279 L280 G285 L287 V290 C313 Y317G278-A282 VanDerWaalsContact O-CB 3.22Å; G278-A282 WeakPolarHBondContact O-CB 3.32Å; G278-A282 PolarHBondContact O-N 3.35Å; Y279-A282 PolarHBondContact O-N 3.35Å; L280-A282 VanDerWaalsContact C-N 3.32Å; L280-A282 PolarHBondContact O-N 3.24Å; A282-G285 PolarHBondContact O-N 3.18Å; A282-L287 HydrophobicContact CB-CD2 4.39Å; A282-V290 HydrophobicContact CB-CG2 3.99Å; A282-C313 HydrophobicContact CB-CB 4.23Å; A282-Y317 HydrophobicContact CB-CD2 3.37Å; A282-Y317 HydrophobicContact CB-CE2 3.62Å; A282-Y317 HydrophobicContact CB-CG 4.16Å; A282-Y317 WeakPolarHBondContact O-CD1 3.43Å
283R88.9Confident92.3Very high81 Ų8145.2 Ų45.231%0.30624%0.235SC..Hα-helixtrans-73.9-33.4176-165.7-17172.4170.811.1113.1T253 Y279 L280 M281 Y317T253-R283 VanDerWaalsContact CB-NH2 3.26Å; T253-R283 PolarHBondContact OG1-NH2 3.07Å; T253-R283 VanDerWaalsContact OG1-NH2 3.1Å; Y279-R283 WeakPolarHBondContact O-CB 3.39Å; Y279-R283 PolarHBondContact O-N 3.45Å; L280-R283 WeakPolarHBondContact O-CB 3.46Å; L280-R283 PolarHBondContact O-N 3.29Å; L280-R283 VanDerWaalsContact O-N 3.1Å; M281-R283 PolarHBondContact O-N 2.98Å; R283-Y317 HydrophobicContact CB-CE1 4.5Å; R283-Y317 WeakPolarHBondContact CB-OH 3.21Å; R283-Y317 WeakPolarHBondContact CG-OH 3.21Å
284E87.2Confident92.3Very high85 Ų8544.7 Ų44.740%0.39723%0.23SC..Hα-helixtrans-78.9-6.5174.2-57.6-59.4136.700112.5I257 L280 M281I257-E284 HydrophobicContact CD1-CG 3.72Å; L280-E284 WeakPolarHBondContact O-CG 3.47Å; L280-E284 PolarHBondContact O-N 3.28Å; M281-E284 PolarHBondContact O-N 3.09Å
285G86Confident92.2Very high51 Ų5146.3 Ų46.353%0.52625%0.247SC..THydrogen-bonded Turntrans96.20174.700000115.4M281 A282 L287M281-G285 PolarHBondContact O-N 2.87Å; M281-G285 VanDerWaalsContact O-N 3.17Å; A282-G285 PolarHBondContact O-N 3.18Å; G285-L287 PolarHBondContact O-N 3.1Å
286H89.5Confident92.1Very high103 Ų10348.6 Ų48.648%0.47725%0.254SS..  trans-76.867.3178.2-62.4-75000112M281 D289 V290M281-H286 PolarHBondContact O-N 3.45Å; M281-H286 VanDerWaalsContact O-N 3.13Å; H286-D289 HydrophobicContact CB-CB 4.4Å; H286-D289 IonicContact ND1-OD2 2.75Å; H286-V290 WeakPolarHBondContact O-CG2 3.3Å; H286-V290 PolarHBondContact O-N 3Å
287L91Very high92Very high50 Ų5048.2 Ų48.226%0.26225%0.252SS..Hα-helixtrans-69.7-32.9-174.5-62.9-177.4000113.5A282 G285 V290 E291 Y317A282-L287 HydrophobicContact CB-CD2 4.39Å; G285-L287 PolarHBondContact O-N 3.1Å; L287-V290 PolarHBondContact O-N 2.88Å; L287-E291 PolarHBondContact O-N 3.24Å; L287-E291 VanDerWaalsContact O-N 3.07Å; L287-Y317 HydrophobicContact CD2-CG 4.48Å
288E91.1Very high92Very high160 Ų16050.8 Ų50.875%0.74826%0.263SS*.Hα-helixtrans-63.9-46.9178.5-62.4-176.6177.800111.3V290 E291 V292E288-V290 VanDerWaalsContact C-N 3.27Å; E288-V290 PolarHBondContact O-N 3.31Å; E288-E291 WeakPolarHBondContact O-CB 3.34Å; E288-E291 PolarHBondContact O-N 3.35Å; E288-E291 VanDerWaalsContact O-N 3.1Å; E288-V292 WeakPolarHBondContact O-CG2 3.49Å; E288-V292 PolarHBondContact O-N 3.33Å
289D91.4Very high91.9Very high87 Ų8757.7 Ų57.747%0.46530%0.3SS..Hα-helixtrans-62.9-35.5177.7-64.4-40.2000111.9M281 H286 E291 V292 L293M281-D289 HydrophobicContact SD-CB 4.07Å; H286-D289 HydrophobicContact CB-CB 4.4Å; H286-D289 IonicContact ND1-OD2 2.75Å; D289-E291 VanDerWaalsContact C-N 3.35Å; D289-V292 PolarHBondContact O-N 3.03Å; D289-L293 VanDerWaalsContact O-CB 3.26Å; D289-L293 WeakPolarHBondContact O-CB 3.35Å; D289-L293 PolarHBondContact O-N 3.44Å
290V94.6Very high91.8Very high0 Ų058.1 Ų58.10%031%0.305CS..Hα-helixtrans-66.2-38175.4178.60000111.1M281 A282 H286 L287 E288 G294 I310 H314M281-V290 HydrophobicContact CB-CG2 3.55Å; M281-V290 HydrophobicContact CE-CG2 4.07Å; A282-V290 HydrophobicContact CB-CG2 3.99Å; H286-V290 WeakPolarHBondContact O-CG2 3.3Å; H286-V290 PolarHBondContact O-N 3Å; L287-V290 PolarHBondContact O-N 2.88Å; E288-V290 VanDerWaalsContact C-N 3.27Å; E288-V290 PolarHBondContact O-N 3.31Å; V290-G294 PolarHBondContact O-N 3.12Å; V290-I310 HydrophobicContact CG1-CG2 3.71Å; V290-H314 HydrophobicContact CG1-CB 3.81Å
291E93.6Very high91.6Very high123 Ų12359 Ų5958%0.57531%0.311SS*.Hα-helixtrans-67.2-44.5175.8-177163.2-149.500111.5L287 E288 D289 L293 G294 G295 H314L287-E291 PolarHBondContact O-N 3.24Å; L287-E291 VanDerWaalsContact O-N 3.07Å; E288-E291 WeakPolarHBondContact O-CB 3.34Å; E288-E291 PolarHBondContact O-N 3.35Å; E288-E291 VanDerWaalsContact O-N 3.1Å; D289-E291 VanDerWaalsContact C-N 3.35Å; E291-L293 PolarHBondContact O-N 3.29Å; E291-G294 PolarHBondContact O-N 2.94Å; E291-G295 PolarHBondContact O-N 3.07Å; E291-H314 IonicContact OE2-CE1 3.39Å
292V93.6Very high91.5Very high103 Ų10363 Ų6362%0.62433%0.333SS*.Hα-helixtrans-60.4-45.4174.5175.50000110.9E288 D289 G295 R296E288-V292 WeakPolarHBondContact O-CG2 3.49Å; E288-V292 PolarHBondContact O-N 3.33Å; D289-V292 PolarHBondContact O-N 3.03Å; V292-G295 PolarHBondContact O-N 3.26Å; V292-R296 PolarHBondContact O-N 3Å
293L92.8Very high91.4Very high4 Ų470 Ų702%0.02137%0.365CS..Hα-helixtrans-60.6-46.5176.3177.363000111.6M274 Y277 M281 D289 E291 R296 L297 I310M274-L293 HydrophobicContact SD-CD1 4.18Å; Y277-L293 HydrophobicContact CD1-CD2 3.57Å; Y277-L293 HydrophobicContact CE1-CD2 3.87Å; M281-L293 HydrophobicContact CE-CB 4.2Å; M281-L293 HydrophobicContact CE-CD2 3.32Å; M281-L293 HydrophobicContact CE-CG 4.35Å; D289-L293 VanDerWaalsContact O-CB 3.26Å; D289-L293 WeakPolarHBondContact O-CB 3.35Å; D289-L293 PolarHBondContact O-N 3.44Å; E291-L293 PolarHBondContact O-N 3.29Å; L293-R296 PolarHBondContact O-N 3.38Å; L293-L297 HydrophobicContact CD1-CD1 3.86Å; L293-L297 HydrophobicContact CD1-CG 4.23Å; L293-L297 HydrophobicContact CG-CD1 3.93Å; L293-L297 WeakPolarHBondContact O-CG 3.4Å; L293-L297 PolarHBondContact O-N 3.47Å; L293-I310 HydrophobicContact CD2-CD1 4.04Å; L293-I310 HydrophobicContact CD2-CG2 4.25Å; L293-I310 HydrophobicContact CG-CD1 4.24Å; L293-I310 HydrophobicContact CG-CG2 4.33Å
294G92.4Very high91.6Very high3 Ų370.4 Ų70.43%0.03137%0.37CS..Hα-helixtrans-59.6-46.9177.700000112.1V290 E291 R296 L297 F298V290-G294 PolarHBondContact O-N 3.12Å; E291-G294 PolarHBondContact O-N 2.94Å; G294-R296 PolarHBondContact O-N 3.11Å; G294-L297 PolarHBondContact O-N 3.47Å; G294-F298 WeakPolarHBondContact O-CD2 3.47Å; G294-F298 PolarHBondContact O-N 3.1Å
295G92.2Very high92Very high34 Ų3466.4 Ų66.435%0.35135%0.352SS..Hα-helixtrans-59.8-44176.100000112.6E291 V292 L297 F298 N299E291-G295 PolarHBondContact O-N 3.07Å; V292-G295 PolarHBondContact O-N 3.26Å; G295-L297 PolarHBondContact O-N 3.09Å; G295-F298 PolarHBondContact O-N 2.87Å; G295-N299 VanDerWaalsContact O-CG 3.29Å; G295-N299 PolarHBondContact O-N 3.19Å; G295-N299 VanDerWaalsContact O-N 3.16Å; G295-N299 PolarHBondContact O-ND2 3.45Å
296R91.8Very high92.4Very high69 Ų6965.4 Ų65.426%0.2633%0.333SS..Hα-helixtrans-62-44.7176.3-168.4-179.971.4-138.9-9.3111.8Q264 V292 L293 G294 F298 N299 I300Q264-R296 VanDerWaalsContact CD-CZ 3.5Å; Q264-R296 VanDerWaalsContact CG-NH2 3.29Å; V292-R296 PolarHBondContact O-N 3Å; L293-R296 PolarHBondContact O-N 3.38Å; G294-R296 PolarHBondContact O-N 3.11Å; R296-F298 PolarHBondContact O-N 3.29Å; R296-N299 WeakPolarHBondContact O-CB 3.33Å; R296-N299 PolarHBondContact O-N 3.07Å; R296-I300 HydrophobicContact CG-CD1 4.11Å; R296-I300 WeakPolarHBondContact O-CD1 3.44Å; R296-I300 WeakPolarHBondContact O-CG1 3.37Å; R296-I300 PolarHBondContact O-N 3.07Å
297L93Very high92.6Very high0 Ų060.5 Ų60.50%031%0.311CS..Hα-helixtrans-68.7-33.6-178.1-73.9169.2000113.1I271 M274 L293 G294 G295 N299 I300 S301 P307 I310I271-L297 HydrophobicContact CG1-CD2 4.48Å; M274-L297 HydrophobicContact CB-CD1 3.76Å; M274-L297 HydrophobicContact CG-CD1 4.16Å; M274-L297 HydrophobicContact CG-CD2 4.32Å; L293-L297 HydrophobicContact CD1-CD1 3.86Å; L293-L297 HydrophobicContact CD1-CG 4.23Å; L293-L297 HydrophobicContact CG-CD1 3.93Å; L293-L297 WeakPolarHBondContact O-CG 3.4Å; L293-L297 PolarHBondContact O-N 3.47Å; G294-L297 PolarHBondContact O-N 3.47Å; G295-L297 PolarHBondContact O-N 3.09Å; L297-N299 VanDerWaalsContact C-N 3.33Å; L297-I300 HydrophobicContact CD2-CD1 4.14Å; L297-I300 PolarHBondContact O-N 2.98Å; L297-S301 PolarHBondContact O-N 2.74Å; L297-S301 VanDerWaalsContact O-O 3.12Å; L297-P307 HydrophobicContact CB-CB 3.97Å; L297-P307 HydrophobicContact CB-CG 4.02Å; L297-I310 HydrophobicContact CD1-CD1 3.08Å
298F94.6Very high92.9Very high63 Ų6359.3 Ų59.328%0.27630%0.303SS..Hα-helixtrans-64.8-36.7170.5-80.7-58000112.9G294 G295 R296 I300 P307 W308 S311G294-F298 WeakPolarHBondContact O-CD2 3.47Å; G294-F298 PolarHBondContact O-N 3.1Å; G295-F298 PolarHBondContact O-N 2.87Å; R296-F298 PolarHBondContact O-N 3.29Å; F298-I300 PolarHBondContact O-N 2.7Å; F298-P307 HydrophobicContact CD1-CB 3.85Å; F298-P307 HydrophobicContact CE1-CB 3.82Å; F298-P307 HydrophobicContact CG-CB 4.2Å; F298-P307 HydrophobicContact CZ-CB 4.19Å; F298-W308 HydrophobicContact CE1-CD2 4.04Å; F298-W308 AromaticContact CE1-CE2 3.71Å; F298-W308 HydrophobicContact CE1-CE3 4.42Å; F298-W308 HydrophobicContact CE1-CG 4.48Å; F298-W308 HydrophobicContact CE1-CH2 4.11Å; F298-W308 AromaticContact CE1-CZ2 3.76Å; F298-W308 HydrophobicContact CE1-CZ2 3.76Å; F298-W308 HydrophobicContact CE1-CZ3 4.45Å; F298-W308 HydrophobicContact CZ-CD2 4.18Å; F298-W308 HydrophobicContact CZ-CE3 4.21Å; F298-W308 HydrophobicContact CZ-CH2 4.34Å; F298-W308 HydrophobicContact CZ-CZ2 4.38Å; F298-W308 HydrophobicContact CZ-CZ3 4.28Å; F298-S311 WeakPolarHBondContact CE2-OG 3.32Å
299N92.7Very high93.1Very high146 Ų14651.7 Ų51.778%0.78127%0.267SS*.Hα-helixtrans-65.7-28175.3-67.4-21.6000112.4G295 R296 L297G295-N299 VanDerWaalsContact O-CG 3.29Å; G295-N299 PolarHBondContact O-N 3.19Å; G295-N299 VanDerWaalsContact O-N 3.16Å; G295-N299 PolarHBondContact O-ND2 3.45Å; R296-N299 WeakPolarHBondContact O-CB 3.33Å; R296-N299 PolarHBondContact O-N 3.07Å; L297-N299 VanDerWaalsContact C-N 3.33Å
300I91.9Very high93.3Very high53 Ų5347.6 Ų47.627%0.27225%0.245SC..Hα-helixtrans-82.1-49.4177.9-61.3158.1000110.4P268 Y269 I271 R296 L297 F298P268-I300 VanDerWaalsContact O-CD1 3.28Å; P268-I300 WeakPolarHBondContact O-CD1 3.49Å; Y269-I300 HydrophobicContact CD1-CD1 4.39Å; Y269-I300 HydrophobicContact CD1-CG1 3.96Å; Y269-I300 HydrophobicContact CD1-CG2 4.08Å; I271-I300 HydrophobicContact CD1-CG2 4.33Å; R296-I300 HydrophobicContact CG-CD1 4.11Å; R296-I300 WeakPolarHBondContact O-CD1 3.44Å; R296-I300 WeakPolarHBondContact O-CG1 3.37Å; R296-I300 PolarHBondContact O-N 3.07Å; L297-I300 HydrophobicContact CD2-CD1 4.14Å; L297-I300 PolarHBondContact O-N 2.98Å; F298-I300 PolarHBondContact O-N 2.7Å
301S89.3Confident93.4Very high19 Ų1948.7 Ų48.713%0.13325%0.253CS..  trans-157130.2-176.668.80000113.6I271 L297 H304 P307I271-S301 WeakPolarHBondContact CD1-OG 3.2Å; L297-S301 PolarHBondContact O-N 2.74Å; L297-S301 VanDerWaalsContact O-O 3.12Å; S301-H304 PolarHBondContact OG-CD2 2.98Å; S301-P307 VanDerWaalsContact O-CG 3.31Å; S301-P307 WeakPolarHBondContact O-CG 3.22Å
302D90.8Very high93.5Very high89 Ų8942.9 Ų42.948%0.47623%0.226SC..SBendtrans-93.3-18.5172.7-169.640000113.2W308D302-W308 PolarHBondContact O-NE1 3.08Å; D302-W308 VanDerWaalsContact O-NE1 3.1Å; D302-W308 WeakPolarHBondContact OD1-CZ2 3.27Å
303Q91.2Very high93.6Very high146 Ų14638 Ų3868%0.68220%0.197SC*.SBendtrans-85.4-13.2-171.4-167.358.859.300113.8L334Q303-L334 VanDerWaalsContact NE2-CD2 3.27Å
304H93Very high93.7Very high91 Ų9139 Ų3942%0.42120%0.201SC..SBendtrans-88.7158179.4-75.2-66000111.5I271 S301 E306 P307 L334I271-H304 VanDerWaalsContact CD1-CD2 3.43Å; I271-H304 WeakPolarHBondContact CD1-CD2 3.48Å; I271-H304 HydrophobicContact CG2-CB 4.05Å; S301-H304 PolarHBondContact OG-CD2 2.98Å; H304-E306 WeakPolarHBondContact CB-OE2 3.26Å; H304-P307 WeakPolarHBondContact O-CD 3.25Å; H304-L334 WeakPolarHBondContact O-CD1 3.41Å
305A94.5Very high93.8Very high1 Ų139 Ų391%0.00820%0.2CC..SBendtrans-83.7-28.7-17400000112.6W308 V309 A331 L334 N335A305-W308 WeakPolarHBondContact O-CB 3.34Å; A305-W308 PolarHBondContact O-N 3.38Å; A305-V309 WeakPolarHBondContact O-CG2 3.28Å; A305-V309 PolarHBondContact O-N 3.43Å; A305-A331 HydrophobicContact CB-CB 4.29Å; A305-A331 WeakPolarHBondContact CB-O 3.43Å; A305-L334 HydrophobicContact CB-CB 4.34Å; A305-N335 HydrophobicContact CB-CB 3.63Å
306E94.8Very high94Very high29 Ų2938.9 Ų38.914%0.13619%0.19CC..Hα-helixtrans-58-45.9-174-61.785161.300113.4I271 D275 H304 W308 V309 I310I271-E306 HydrophobicContact CG2-CB 3.99Å; I271-E306 HydrophobicContact CG2-CG 3.95Å; D275-E306 HydrophobicContact CB-CB 4.34Å; D275-E306 HydrophobicContact CB-CG 4.12Å; H304-E306 WeakPolarHBondContact CB-OE2 3.26Å; E306-W308 VanDerWaalsContact C-N 3.31Å; E306-W308 PolarHBondContact O-N 3.36Å; E306-V309 PolarHBondContact O-N 3.17Å; E306-I310 WeakPolarHBondContact O-CD1 3.44Å; E306-I310 VanDerWaalsContact O-CG1 3.31Å; E306-I310 WeakPolarHBondContact O-CG1 3.5Å; E306-I310 PolarHBondContact O-N 2.95Å
307P95.2Very high94.1Very high0 Ų039 Ų390%019%0.191CC..Hα-helixtrans-59.8-39.4176-14.523.3000113.1L297 F298 S301 H304 I310 S311L297-P307 HydrophobicContact CB-CB 3.97Å; L297-P307 HydrophobicContact CB-CG 4.02Å; F298-P307 HydrophobicContact CD1-CB 3.85Å; F298-P307 HydrophobicContact CE1-CB 3.82Å; F298-P307 HydrophobicContact CG-CB 4.2Å; F298-P307 HydrophobicContact CZ-CB 4.19Å; S301-P307 VanDerWaalsContact O-CG 3.31Å; S301-P307 WeakPolarHBondContact O-CG 3.22Å; H304-P307 WeakPolarHBondContact O-CD 3.25Å; P307-I310 PolarHBondContact O-N 3.15Å; P307-S311 WeakPolarHBondContact O-CB 3.39Å; P307-S311 PolarHBondContact O-N 3.11Å; P307-S311 VanDerWaalsContact O-N 3.12Å; P307-S311 PolarHBondContact O-OG 3.07Å
308W96.1Very high94.1Very high26 Ų2640.9 Ų40.910%0.09820%0.204CC..Hα-helixtrans-67.2-38.9177.5-65.394.8000111.8F298 D302 A305 E306 G312 L327 K330 A331 L334F298-W308 HydrophobicContact CE1-CD2 4.04Å; F298-W308 AromaticContact CE1-CE2 3.71Å; F298-W308 HydrophobicContact CE1-CE3 4.42Å; F298-W308 HydrophobicContact CE1-CG 4.48Å; F298-W308 HydrophobicContact CE1-CH2 4.11Å; F298-W308 AromaticContact CE1-CZ2 3.76Å; F298-W308 HydrophobicContact CE1-CZ2 3.76Å; F298-W308 HydrophobicContact CE1-CZ3 4.45Å; F298-W308 HydrophobicContact CZ-CD2 4.18Å; F298-W308 HydrophobicContact CZ-CE3 4.21Å; F298-W308 HydrophobicContact CZ-CH2 4.34Å; F298-W308 HydrophobicContact CZ-CZ2 4.38Å; F298-W308 HydrophobicContact CZ-CZ3 4.28Å; D302-W308 PolarHBondContact O-NE1 3.08Å; D302-W308 VanDerWaalsContact O-NE1 3.1Å; D302-W308 WeakPolarHBondContact OD1-CZ2 3.27Å; A305-W308 WeakPolarHBondContact O-CB 3.34Å; A305-W308 PolarHBondContact O-N 3.38Å; E306-W308 VanDerWaalsContact C-N 3.31Å; E306-W308 PolarHBondContact O-N 3.36Å; W308-G312 PolarHBondContact O-N 3.24Å; W308-L327 HydrophobicContact CE3-CD2 3.49Å; W308-L327 VanDerWaalsContact CE3-CD2 3.49Å; W308-L327 HydrophobicContact CZ3-CD2 3.57Å; W308-K330 HydrophobicContact CD2-CB 4.37Å; W308-K330 HydrophobicContact CD2-CD 3.81Å; W308-K330 HydrophobicContact CD2-CG 3.99Å; W308-K330 VanDerWaalsContact CE2-CE 3.49Å; W308-K330 HydrophobicContact CE3-CB 4.24Å; W308-K330 HydrophobicContact CE3-CD 3.69Å; W308-K330 HydrophobicContact CE3-CG 4.15Å; W308-K330 HydrophobicContact CG-CG 4.47Å; W308-K330 HydrophobicContact CH2-CD 3.62Å; W308-K330 HydrophobicContact CZ2-CD 3.64Å; W308-K330 HydrophobicContact CZ3-CD 3.61Å; W308-A331 HydrophobicContact CB-CB 3.84Å; W308-L334 HydrophobicContact CG-CD1 4.28Å
309V96.5Very high94Very high0 Ų045.5 Ų45.50%022%0.224CC..Hα-helixtrans-63.5-47.2175.9172.60000110.9D275 A305 E306 S311 G312 C313 A331 Q340 A341D275-V309 HydrophobicContact CB-CB 4.26Å; D275-V309 HydrophobicContact CB-CG1 3.96Å; A305-V309 WeakPolarHBondContact O-CG2 3.28Å; A305-V309 PolarHBondContact O-N 3.43Å; E306-V309 PolarHBondContact O-N 3.17Å; V309-S311 PolarHBondContact O-N 3.41Å; V309-G312 CarbonylContact O-C 3.6Å; V309-G312 WeakPolarHBondContact O-CA 3.31Å; V309-G312 PolarHBondContact O-N 3.23Å; V309-G312 VanDerWaalsContact O-N 3.11Å; V309-C313 PolarHBondContact O-N 3.41Å; V309-C313 PolarHBondContact O-SG 2.98Å; V309-C313 VanDerWaalsContact O-SG 3.41Å; V309-A331 HydrophobicContact CG2-CB 3.71Å; V309-Q340 HydrophobicContact CG1-CB 4.03Å; V309-Q340 HydrophobicContact CG1-CG 3.4Å; V309-A341 HydrophobicContact CG2-CB 3.69Å
310I95.6Very high94.1Very high0 Ų043.7 Ų43.70%021%0.206CC..Hα-helixtrans-63.5-46.7-177.3-66.8161.8000110.8M274 V290 L293 L297 E306 P307 G312 C313 H314M274-I310 HydrophobicContact CB-CD1 3.87Å; M274-I310 WeakPolarHBondContact O-CD1 3.42Å; M274-I310 WeakPolarHBondContact O-CG1 3.49Å; V290-I310 HydrophobicContact CG1-CG2 3.71Å; L293-I310 HydrophobicContact CD2-CD1 4.04Å; L293-I310 HydrophobicContact CD2-CG2 4.25Å; L293-I310 HydrophobicContact CG-CD1 4.24Å; L293-I310 HydrophobicContact CG-CG2 4.33Å; L297-I310 HydrophobicContact CD1-CD1 3.08Å; E306-I310 WeakPolarHBondContact O-CD1 3.44Å; E306-I310 VanDerWaalsContact O-CG1 3.31Å; E306-I310 WeakPolarHBondContact O-CG1 3.5Å; E306-I310 PolarHBondContact O-N 2.95Å; P307-I310 PolarHBondContact O-N 3.15Å; I310-G312 PolarHBondContact O-N 2.98Å; I310-C313 WeakPolarHBondContact O-CB 3.19Å; I310-C313 PolarHBondContact O-N 3.08Å; I310-C313 VanDerWaalsContact O-N 3.14Å; I310-H314 PolarHBondContact O-N 3.18Å
311S95Very high94.4Very high24 Ų2444.4 Ų44.417%0.16821%0.206CC..Hα-helixtrans-62.8-33.3175.1-58.60000112.5F298 P307 V309 S315F298-S311 WeakPolarHBondContact CE2-OG 3.32Å; P307-S311 WeakPolarHBondContact O-CB 3.39Å; P307-S311 PolarHBondContact O-N 3.11Å; P307-S311 VanDerWaalsContact O-N 3.12Å; P307-S311 PolarHBondContact O-OG 3.07Å; V309-S311 PolarHBondContact O-N 3.41Å; S311-S315 WeakPolarHBondContact O-CB 3.41Å; S311-S315 PolarHBondContact O-N 3.4Å; S311-S315 PolarHBondContact O-OG 2.94Å
312G95.8Very high94.7Very high0 Ų047.8 Ų47.80%023%0.23CC..Hα-helixtrans-68.6-42.1173.300000112.8W308 V309 I310 S315 F316W308-G312 PolarHBondContact O-N 3.24Å; V309-G312 CarbonylContact O-C 3.6Å; V309-G312 WeakPolarHBondContact O-CA 3.31Å; V309-G312 PolarHBondContact O-N 3.23Å; V309-G312 VanDerWaalsContact O-N 3.11Å; I310-G312 PolarHBondContact O-N 2.98Å; G312-S315 PolarHBondContact O-N 3.11Å; G312-F316 WeakPolarHBondContact O-CB 3.43Å; G312-F316 PolarHBondContact O-N 3.5Å
313C95.6Very high94.9Very high2 Ų250.2 Ų50.21%0.01423%0.232CC..Hα-helixtrans-59.8-49.1172.1-73.20000110.6A282 V309 I310 S315 F316 Y317A282-C313 HydrophobicContact CB-CB 4.23Å; V309-C313 PolarHBondContact O-N 3.41Å; V309-C313 PolarHBondContact O-SG 2.98Å; V309-C313 VanDerWaalsContact O-SG 3.41Å; I310-C313 WeakPolarHBondContact O-CB 3.19Å; I310-C313 PolarHBondContact O-N 3.08Å; I310-C313 VanDerWaalsContact O-N 3.14Å; C313-S315 VanDerWaalsContact C-N 3.32Å; C313-S315 PolarHBondContact O-N 2.96Å; C313-F316 WeakPolarHBondContact O-CB 3.29Å; C313-F316 PolarHBondContact O-N 3.34Å; C313-F316 VanDerWaalsContact O-N 3.09Å; C313-Y317 VanDerWaalsContact O-CD2 3.31Å; C313-Y317 WeakPolarHBondContact O-CD2 3.41Å; C313-Y317 PolarHBondContact O-N 3.13Å
314H95.6Very high95.2Very high24 Ų2443.2 Ų43.211%0.11120%0.2CC..Hα-helixtrans-53.4-49.1173.7177-122.9000111.9V290 E291 I310 F316 Y317 S318V290-H314 HydrophobicContact CG1-CB 3.81Å; E291-H314 IonicContact OE2-CE1 3.39Å; I310-H314 PolarHBondContact O-N 3.18Å; H314-F316 VanDerWaalsContact C-N 3.31Å; H314-F316 PolarHBondContact O-N 3.04Å; H314-Y317 PolarHBondContact O-N 3.27Å; H314-S318 WeakPolarHBondContact O-CB 3.46Å; H314-S318 PolarHBondContact O-N 3.1Å; H314-S318 PolarHBondContact O-OG 3.28Å
315S95.4Very high95.3Very high2 Ų240.4 Ų40.41%0.01419%0.187CC..Hα-helixtrans-63.2-35.6178.7-59.60000112.8S311 G312 C313 R320S311-S315 WeakPolarHBondContact O-CB 3.41Å; S311-S315 PolarHBondContact O-N 3.4Å; S311-S315 PolarHBondContact O-OG 2.94Å; G312-S315 PolarHBondContact O-N 3.11Å; C313-S315 VanDerWaalsContact C-N 3.32Å; C313-S315 PolarHBondContact O-N 2.96Å; S315-R320 CarbonylContact O-C 3.21Å; S315-R320 WeakPolarHBondContact O-CA 3.46Å; S315-R320 PolarHBondContact O-N 2.91Å
316F96.1Very high95.4Very high33 Ų3347.4 Ų47.415%0.14522%0.215CC..Hα-helixtrans-66.8-49.2179177-94.2000111.6G312 C313 H314 S318 K319 Y321 A324 L344 A347 A348 N351G312-F316 WeakPolarHBondContact O-CB 3.43Å; G312-F316 PolarHBondContact O-N 3.5Å; C313-F316 WeakPolarHBondContact O-CB 3.29Å; C313-F316 PolarHBondContact O-N 3.34Å; C313-F316 VanDerWaalsContact O-N 3.09Å; H314-F316 VanDerWaalsContact C-N 3.31Å; H314-F316 PolarHBondContact O-N 3.04Å; F316-S318 VanDerWaalsContact C-N 3.31Å; F316-S318 PolarHBondContact O-N 3.4Å; F316-K319 WeakPolarHBondContact O-CA 3.39Å; F316-K319 PolarHBondContact O-N 3.45Å; F316-Y321 AromaticContact CD2-CD1 3.85Å; F316-Y321 HydrophobicContact CD2-CD1 3.85Å; F316-Y321 HydrophobicContact CD2-CE1 4.1Å; F316-Y321 HydrophobicContact CE2-CD1 4.07Å; F316-Y321 HydrophobicContact CE2-CE1 4.07Å; F316-Y321 WeakPolarHBondContact O-CE1 3.44Å; F316-A324 HydrophobicContact CB-CB 4.01Å; F316-L344 HydrophobicContact CB-CD1 3.9Å; F316-L344 HydrophobicContact CG-CD1 4.31Å; F316-A347 HydrophobicContact CD2-CB 4.49Å; F316-A347 HydrophobicContact CE2-CB 3.72Å; F316-A347 HydrophobicContact CZ-CB 3.83Å; F316-A348 HydrophobicContact CD2-CB 4.34Å; F316-N351 WeakPolarHBondContact CE2-ND2 3.47Å; F316-N351 WeakPolarHBondContact CZ-ND2 3.36Å
317Y93Very high95.5Very high72 Ų7246.7 Ų46.728%0.28221%0.212SC..Hα-helixtrans-71.9-25.7177.7-74.2-83.6000112.5A282 R283 L287 C313 H314 K319A282-Y317 HydrophobicContact CB-CD2 3.37Å; A282-Y317 HydrophobicContact CB-CE2 3.62Å; A282-Y317 HydrophobicContact CB-CG 4.16Å; A282-Y317 WeakPolarHBondContact O-CD1 3.43Å; R283-Y317 HydrophobicContact CB-CE1 4.5Å; R283-Y317 WeakPolarHBondContact CB-OH 3.21Å; R283-Y317 WeakPolarHBondContact CG-OH 3.21Å; L287-Y317 HydrophobicContact CD2-CG 4.48Å; C313-Y317 VanDerWaalsContact O-CD2 3.31Å; C313-Y317 WeakPolarHBondContact O-CD2 3.41Å; C313-Y317 PolarHBondContact O-N 3.13Å; H314-Y317 PolarHBondContact O-N 3.27Å; Y317-K319 PolarHBondContact O-N 3.17Å; Y317-K319 VanDerWaalsContact O-N 3.1Å
318S92.6Very high95.5Very high39 Ų3946.7 Ų46.727%0.27321%0.212SC..THydrogen-bonded Turntrans-69.25.8165.1-59.10000114.1H314 F316 R320H314-S318 WeakPolarHBondContact O-CB 3.46Å; H314-S318 PolarHBondContact O-N 3.1Å; H314-S318 PolarHBondContact O-OG 3.28Å; F316-S318 VanDerWaalsContact C-N 3.31Å; F316-S318 PolarHBondContact O-N 3.4Å; S318-R320 PolarHBondContact O-N 2.8Å; S318-R320 VanDerWaalsContact O-N 3.08Å
319K93.1Very high95.5Very high160 Ų16047.3 Ų47.370%0.69622%0.223SC*.THydrogen-bonded Turntrans60.313.7-175.6-55.2176.8-178.1172.20115.2F316 Y317 Y321F316-K319 WeakPolarHBondContact O-CA 3.39Å; F316-K319 PolarHBondContact O-N 3.45Å; Y317-K319 PolarHBondContact O-N 3.17Å; Y317-K319 VanDerWaalsContact O-N 3.1Å; K319-Y321 VanDerWaalsContact C-N 3.34Å; K319-Y321 HydrophobicContact CB-CE2 4.5Å; K319-Y321 PolarHBondContact O-N 3Å; K319-Y321 VanDerWaalsContact O-N 3.16Å
320R95.7Very high95.4Very high108 Ų10850 Ų5041%0.40823%0.234SC..  trans-89.867.9176.1-69.2-178.7-69.9172.4-3.9110.5S315 S318 S322 R323 A324S315-R320 CarbonylContact O-C 3.21Å; S315-R320 WeakPolarHBondContact O-CA 3.46Å; S315-R320 PolarHBondContact O-N 2.91Å; S318-R320 PolarHBondContact O-N 2.8Å; S318-R320 VanDerWaalsContact O-N 3.08Å; R320-S322 VanDerWaalsContact C-N 3.32Å; R320-S322 PolarHBondContact O-N 3.28Å; R320-R323 HydrophobicContact CB-CB 4.42Å; R320-R323 PolarHBondContact O-N 3.2Å; R320-A324 PolarHBondContact O-N 3.39Å; R320-A324 VanDerWaalsContact O-N 3.13Å
321Y96.6Very high95.4Very high67 Ų6750 Ų5026%0.26323%0.234SC..Hα-helixtrans-61.9-35.4-172.1-51.8-54.4000113.4F316 K319 R323 A324 L325 N351 M352F316-Y321 AromaticContact CD2-CD1 3.85Å; F316-Y321 HydrophobicContact CD2-CD1 3.85Å; F316-Y321 HydrophobicContact CD2-CE1 4.1Å; F316-Y321 HydrophobicContact CE2-CD1 4.07Å; F316-Y321 HydrophobicContact CE2-CE1 4.07Å; F316-Y321 WeakPolarHBondContact O-CE1 3.44Å; K319-Y321 VanDerWaalsContact C-N 3.34Å; K319-Y321 HydrophobicContact CB-CE2 4.5Å; K319-Y321 PolarHBondContact O-N 3Å; K319-Y321 VanDerWaalsContact O-N 3.16Å; Y321-R323 PolarHBondContact O-N 3.41Å; Y321-A324 PolarHBondContact O-N 3.33Å; Y321-L325 WeakPolarHBondContact O-CB 3.31Å; Y321-L325 PolarHBondContact O-N 3.35Å; Y321-N351 HydrophobicContact CD1-CB 3.89Å; Y321-N351 HydrophobicContact CD2-CB 4.02Å; Y321-N351 HydrophobicContact CE1-CB 3.82Å; Y321-N351 WeakPolarHBondContact CE1-ND2 3.38Å; Y321-N351 HydrophobicContact CE2-CB 3.93Å; Y321-N351 HydrophobicContact CG-CB 4Å; Y321-M352 WeakPolarHBondContact O-CE 3.38Å
322S95.8Very high95.4Very high90 Ų9050.4 Ų50.463%0.62923%0.234SC*.Hα-helixtrans-61.2-43.7179.853.90000112.2R320 L325 Y326R320-S322 VanDerWaalsContact C-N 3.32Å; R320-S322 PolarHBondContact O-N 3.28Å; S322-L325 PolarHBondContact O-N 2.95Å; S322-Y326 PolarHBondContact O-N 3.49Å
323R96.2Very high95.3Very high140 Ų14057.3 Ų57.353%0.52827%0.267SS..Hα-helixtrans-67.1-44174.7-173.9173.1176.4150.4-3.7111.3R320 Y321 L325 Y326 L327R320-R323 HydrophobicContact CB-CB 4.42Å; R320-R323 PolarHBondContact O-N 3.2Å; Y321-R323 PolarHBondContact O-N 3.41Å; R323-L325 VanDerWaalsContact C-N 3.27Å; R323-L325 PolarHBondContact O-N 3.25Å; R323-Y326 PolarHBondContact O-N 3.49Å; R323-L327 HydrophobicContact CG-CD1 3.95Å; R323-L327 HydrophobicContact CG-CG 4.39Å; R323-L327 WeakPolarHBondContact O-CG 3.39Å; R323-L327 PolarHBondContact O-N 2.94Å
324A96.4Very high95.1Very high0 Ų059.9 Ų59.90%028%0.28CS..Hα-helixtrans-58.9-38.8176.800000112.4F316 R320 Y321 L327 G328 A348F316-A324 HydrophobicContact CB-CB 4.01Å; R320-A324 PolarHBondContact O-N 3.39Å; R320-A324 VanDerWaalsContact O-N 3.13Å; Y321-A324 PolarHBondContact O-N 3.33Å; A324-L327 PolarHBondContact O-N 2.86Å; A324-G328 PolarHBondContact O-N 3.24Å; A324-A348 HydrophobicContact CB-CB 4.22Å
325L96.4Very high94.8Very high31 Ų3161.5 Ų61.516%0.16229%0.289CS..Hα-helixtrans-61.3-45.8175.9177.360.7000112.2Y321 S322 R323 A329 K345 A348 L349 M352Y321-L325 WeakPolarHBondContact O-CB 3.31Å; Y321-L325 PolarHBondContact O-N 3.35Å; S322-L325 PolarHBondContact O-N 2.95Å; R323-L325 VanDerWaalsContact C-N 3.27Å; R323-L325 PolarHBondContact O-N 3.25Å; L325-A329 WeakPolarHBondContact O-CB 3.41Å; L325-A329 PolarHBondContact O-N 2.73Å; L325-K345 HydrophobicContact CD1-CD 4.39Å; L325-K345 HydrophobicContact CD1-CG 3.76Å; L325-A348 HydrophobicContact CB-CB 4.4Å; L325-L349 HydrophobicContact CD1-CD1 4.38Å; L325-L349 HydrophobicContact CD1-CD2 3.82Å; L325-L349 HydrophobicContact CD1-CG 3.83Å; L325-L349 HydrophobicContact CD2-CD2 4.04Å; L325-M352 HydrophobicContact CB-CE 3.8Å; L325-M352 HydrophobicContact CD2-CE 3.92Å; L325-M352 HydrophobicContact CD2-SD 3.95Å; L325-M352 HydrophobicContact CG-CE 4.49Å
326Y96.5Very high94.5Very high149 Ų14964.3 Ų64.358%0.58431%0.309SS*.Hα-helixtrans-63.3-47.5177174.8-95.3000111.7S322 R323 A329 K330S322-Y326 PolarHBondContact O-N 3.49Å; R323-Y326 PolarHBondContact O-N 3.49Å; Y326-A329 PolarHBondContact O-N 3.2Å; Y326-K330 PolarHBondContact O-N 2.97Å
327L96Very high94.1Very high13 Ų1367 Ų677%0.06832%0.324CS..Hα-helixtrans-63.8-44.1-179.2-64.9172.8000111.6W308 R323 A324 A329 K330 A331W308-L327 HydrophobicContact CE3-CD2 3.49Å; W308-L327 VanDerWaalsContact CE3-CD2 3.49Å; W308-L327 HydrophobicContact CZ3-CD2 3.57Å; R323-L327 HydrophobicContact CG-CD1 3.95Å; R323-L327 HydrophobicContact CG-CG 4.39Å; R323-L327 WeakPolarHBondContact O-CG 3.39Å; R323-L327 PolarHBondContact O-N 2.94Å; A324-L327 PolarHBondContact O-N 2.86Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 3.44Å; L327-K330 PolarHBondContact O-N 3.45Å; L327-A331 PolarHBondContact O-N 2.88Å
328G95.4Very high94.1Very high0 Ų063.9 Ų63.90%031%0.314CS..Hα-helixtrans-62.6-38.217400000112.8A324 A331 I332A324-G328 PolarHBondContact O-N 3.24Å; G328-A331 PolarHBondContact O-N 3.49Å; G328-I332 WeakPolarHBondContact O-CD1 3.34Å; G328-I332 VanDerWaalsContact O-CG1 3.32Å; G328-I332 WeakPolarHBondContact O-CG1 3.43Å; G328-I332 PolarHBondContact O-N 3.36Å; G328-I332 VanDerWaalsContact O-N 3.07Å
329A95.8Very high94.1Very high40 Ų4063 Ų6333%0.33131%0.306SS..Hα-helixtrans-65.3-41.2175.300000112.4L325 Y326 L327 I332 Q333L325-A329 WeakPolarHBondContact O-CB 3.41Å; L325-A329 PolarHBondContact O-N 2.73Å; Y326-A329 PolarHBondContact O-N 3.2Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 3.44Å; A329-I332 PolarHBondContact O-N 3.03Å; A329-Q333 PolarHBondContact O-N 3.01Å
330K95.2Very high94.2Very high56 Ų5655.6 Ų55.624%0.24327%0.274CS..Hα-helixtrans-64.5-40.7174.7-171.7164.8175.9-174.50111.6W308 Y326 L327 I332 Q333 L334W308-K330 HydrophobicContact CD2-CB 4.37Å; W308-K330 HydrophobicContact CD2-CD 3.81Å; W308-K330 HydrophobicContact CD2-CG 3.99Å; W308-K330 VanDerWaalsContact CE2-CE 3.49Å; W308-K330 HydrophobicContact CE3-CB 4.24Å; W308-K330 HydrophobicContact CE3-CD 3.69Å; W308-K330 HydrophobicContact CE3-CG 4.15Å; W308-K330 HydrophobicContact CG-CG 4.47Å; W308-K330 HydrophobicContact CH2-CD 3.62Å; W308-K330 HydrophobicContact CZ2-CD 3.64Å; W308-K330 HydrophobicContact CZ3-CD 3.61Å; Y326-K330 PolarHBondContact O-N 2.97Å; L327-K330 PolarHBondContact O-N 3.45Å; K330-I332 PolarHBondContact O-N 3.35Å; K330-Q333 WeakPolarHBondContact O-CB 3.41Å; K330-Q333 PolarHBondContact O-N 3.16Å; K330-L334 WeakPolarHBondContact O-CG 3.45Å; K330-L334 PolarHBondContact O-N 3.04Å; K330-L334 VanDerWaalsContact O-N 3.13Å
331A95.6Very high94.2Very high0 Ų050.5 Ų50.50%026%0.255CS..Hα-helixtrans-58.5-44174.300000112.6A305 W308 V309 L327 G328 Q333 L334 N335 A341A305-A331 HydrophobicContact CB-CB 4.29Å; A305-A331 WeakPolarHBondContact CB-O 3.43Å; W308-A331 HydrophobicContact CB-CB 3.84Å; V309-A331 HydrophobicContact CG2-CB 3.71Å; L327-A331 PolarHBondContact O-N 2.88Å; G328-A331 PolarHBondContact O-N 3.49Å; A331-Q333 VanDerWaalsContact C-N 3.33Å; A331-Q333 PolarHBondContact O-N 3.49Å; A331-L334 PolarHBondContact O-N 3.02Å; A331-N335 PolarHBondContact O-N 3.28Å; A331-A341 HydrophobicContact CB-CB 3.69Å
332I94.8Very high94.2Very high32 Ų3247.3 Ų47.316%0.16424%0.242CC..Hα-helixtrans-65.8-35.5177.1-65.2160.6000111.7G328 A329 K330 L334 N335 S336 A341 L342 K345G328-I332 WeakPolarHBondContact O-CD1 3.34Å; G328-I332 VanDerWaalsContact O-CG1 3.32Å; G328-I332 WeakPolarHBondContact O-CG1 3.43Å; G328-I332 PolarHBondContact O-N 3.36Å; G328-I332 VanDerWaalsContact O-N 3.07Å; A329-I332 PolarHBondContact O-N 3.03Å; K330-I332 PolarHBondContact O-N 3.35Å; I332-L334 VanDerWaalsContact C-N 3.3Å; I332-L334 PolarHBondContact O-N 3.4Å; I332-N335 CarbonylContact O-C 3.52Å; I332-S336 WeakPolarHBondContact O-CA 3.37Å; I332-S336 PolarHBondContact O-N 2.88Å; I332-S336 VanDerWaalsContact O-N 3.15Å; I332-A341 HydrophobicContact CG1-CB 3.81Å; I332-L342 HydrophobicContact CD1-CD2 3.8Å; I332-L342 HydrophobicContact CD1-CG 4.39Å; I332-L342 HydrophobicContact CG1-CD2 4.14Å; I332-L342 HydrophobicContact CG1-CG 4.36Å; I332-K345 HydrophobicContact CD1-CB 4.02Å; I332-K345 HydrophobicContact CD1-CD 3.52Å; I332-K345 HydrophobicContact CD1-CG 4.39Å
333Q93.4Very high94.2Very high146 Ų14643.6 Ų43.668%0.68222%0.216SC*.Hα-helixtrans-63.1-39.3176.7-174.3-178.4900111.7A329 K330 A331A329-Q333 PolarHBondContact O-N 3.01Å; K330-Q333 WeakPolarHBondContact O-CB 3.41Å; K330-Q333 PolarHBondContact O-N 3.16Å; A331-Q333 VanDerWaalsContact C-N 3.33Å; A331-Q333 PolarHBondContact O-N 3.49Å
334L92.1Very high94.2Very high56 Ų5637.3 Ų37.329%0.29319%0.192SC..Hα-helixtrans-73.3-47.7177.4-64.1173.6000111.4Q303 H304 A305 W308 K330 A331 I332Q303-L334 VanDerWaalsContact NE2-CD2 3.27Å; H304-L334 WeakPolarHBondContact O-CD1 3.41Å; A305-L334 HydrophobicContact CB-CB 4.34Å; W308-L334 HydrophobicContact CG-CD1 4.28Å; K330-L334 WeakPolarHBondContact O-CG 3.45Å; K330-L334 PolarHBondContact O-N 3.04Å; K330-L334 VanDerWaalsContact O-N 3.13Å; A331-L334 PolarHBondContact O-N 3.02Å; I332-L334 VanDerWaalsContact C-N 3.3Å; I332-L334 PolarHBondContact O-N 3.4Å
335N89.6Confident94.1Very high58 Ų5839.4 Ų39.431%0.3120%0.201SC..  trans-134.4102177-172.8-0.9000111.2A305 A331 I332 N337 S338A305-N335 HydrophobicContact CB-CB 3.63Å; A331-N335 PolarHBondContact O-N 3.28Å; I332-N335 CarbonylContact O-C 3.52Å; N335-N337 PolarHBondContact O-N 2.84Å; N335-N337 WeakPolarHBondContact OD1-CB 3.37Å; N335-N337 PolarHBondContact OD1-N 3.34Å; N335-S338 PolarHBondContact O-N 3.4Å
336S88.3Confident94.1Very high60 Ų6037.9 Ų37.942%0.4219%0.194SC..THydrogen-bonded Turntrans-65.6-18.2177.259.90000113.5I332I332-S336 WeakPolarHBondContact O-CA 3.37Å; I332-S336 PolarHBondContact O-N 2.88Å; I332-S336 VanDerWaalsContact O-N 3.15Å
337N88.4Confident94Very high89 Ų8932 Ų3248%0.47618%0.175SC..THydrogen-bonded Turntrans-95.80.2-177.5-60.7-7.9000112.4N335 V339N335-N337 PolarHBondContact O-N 2.84Å; N335-N337 WeakPolarHBondContact OD1-CB 3.37Å; N335-N337 PolarHBondContact OD1-N 3.34Å; N337-V339 PolarHBondContact O-N 3.38Å; N337-V339 VanDerWaalsContact O-N 3.15Å
338S92.4Very high94Very high8 Ų831.3 Ų31.36%0.05617%0.172CC..  trans-71.9108.3176.2177.70000110.2N335 Q340 A341 L342N335-S338 PolarHBondContact O-N 3.4Å; S338-Q340 VanDerWaalsContact C-N 3.34Å; S338-A341 PolarHBondContact O-N 3.45Å; S338-A341 PolarHBondContact OG-N 3.49Å; S338-L342 PolarHBondContact O-N 3.44Å
339V93.5Very high94Very high20 Ų2031.4 Ų31.412%0.12117%0.172CC..Hα-helixtrans-63.2-43.6177.9179.70000110.1N337 A341 L342 L343 A365 L368 A369 C375N337-V339 PolarHBondContact O-N 3.38Å; N337-V339 VanDerWaalsContact O-N 3.15Å; V339-A341 VanDerWaalsContact C-N 3.31Å; V339-A341 PolarHBondContact O-N 3.3Å; V339-L342 PolarHBondContact O-N 2.85Å; V339-L343 HydrophobicContact CG1-CD1 4.12Å; V339-L343 HydrophobicContact CG1-CG 4.29Å; V339-L343 WeakPolarHBondContact O-CG 3.48Å; V339-L343 PolarHBondContact O-N 2.72Å; V339-A365 HydrophobicContact CG1-CB 4.17Å; V339-L368 HydrophobicContact CG2-CB 3.86Å; V339-A369 HydrophobicContact CG1-CB 4.14Å; V339-A369 HydrophobicContact CG2-CB 3.76Å; V339-C375 VanDerWaalsContact CG1-SG 3.55Å
340Q94.9Very high94Very high5 Ų533.4 Ų33.42%0.02317%0.172CC..Hα-helixtrans-62.3-38.3-178.6-167.962.52600112.3D275 Y279 V309 S338 L342 L343 L344D275-Q340 HydrophobicContact CB-CB 4.22Å; D275-Q340 HydrophobicContact CB-CG 4.26Å; Y279-Q340 VanDerWaalsContact CB-NE2 3.28Å; Y279-Q340 VanDerWaalsContact CD2-NE2 3.31Å; V309-Q340 HydrophobicContact CG1-CB 4.03Å; V309-Q340 HydrophobicContact CG1-CG 3.4Å; S338-Q340 VanDerWaalsContact C-N 3.34Å; Q340-L342 PolarHBondContact O-N 2.84Å; Q340-L343 PolarHBondContact O-N 3.46Å; Q340-L344 WeakPolarHBondContact O-CB 3.17Å; Q340-L344 PolarHBondContact O-N 3.08Å
341A95.5Very high94Very high0 Ų033.9 Ų33.90%018%0.177CC..Hα-helixtrans-63.3-41176.500000112.4V309 A331 I332 S338 V339 K345V309-A341 HydrophobicContact CG2-CB 3.69Å; A331-A341 HydrophobicContact CB-CB 3.69Å; I332-A341 HydrophobicContact CG1-CB 3.81Å; S338-A341 PolarHBondContact O-N 3.45Å; S338-A341 PolarHBondContact OG-N 3.49Å; V339-A341 VanDerWaalsContact C-N 3.31Å; V339-A341 PolarHBondContact O-N 3.3Å; A341-K345 WeakPolarHBondContact O-CB 3.41Å; A341-K345 PolarHBondContact O-N 3.18Å
342L96Very high93.9Very high0 Ų037 Ų370%019%0.192CC..Hα-helixtrans-65.5-42.5175.3-70.5165.3000111.8I332 S338 V339 Q340 K345 G346 E364 A365 L368I332-L342 HydrophobicContact CD1-CD2 3.8Å; I332-L342 HydrophobicContact CD1-CG 4.39Å; I332-L342 HydrophobicContact CG1-CD2 4.14Å; I332-L342 HydrophobicContact CG1-CG 4.36Å; S338-L342 PolarHBondContact O-N 3.44Å; V339-L342 PolarHBondContact O-N 2.85Å; Q340-L342 PolarHBondContact O-N 2.84Å; L342-K345 PolarHBondContact O-N 3.19Å; L342-G346 PolarHBondContact O-N 3.12Å; L342-E364 HydrophobicContact CD1-CB 4.37Å; L342-E364 HydrophobicContact CD1-CG 3.94Å; L342-E364 HydrophobicContact CD2-CG 4.45Å; L342-A365 HydrophobicContact CB-CB 4.02Å; L342-A365 HydrophobicContact CD1-CB 4.42Å; L342-L368 HydrophobicContact CD1-CD1 3.52Å
343L95.4Very high93.8Very high12 Ų1238.2 Ų38.26%0.06321%0.212CC..Hα-helixtrans-62.8-46.2176.5-65.7178.9000111.7V339 Q340 K345 G346 A347 F362 A365 D374 C375V339-L343 HydrophobicContact CG1-CD1 4.12Å; V339-L343 HydrophobicContact CG1-CG 4.29Å; V339-L343 WeakPolarHBondContact O-CG 3.48Å; V339-L343 PolarHBondContact O-N 2.72Å; Q340-L343 PolarHBondContact O-N 3.46Å; L343-K345 VanDerWaalsContact C-N 3.34Å; L343-K345 PolarHBondContact O-N 3.19Å; L343-G346 PolarHBondContact O-N 3.03Å; L343-A347 WeakPolarHBondContact O-CB 3.35Å; L343-A347 PolarHBondContact O-N 3.32Å; L343-F362 HydrophobicContact CD2-CD1 3.59Å; L343-F362 HydrophobicContact CD2-CE1 3.68Å; L343-A365 HydrophobicContact CD2-CB 3.8Å; L343-A365 HydrophobicContact CG-CB 4.29Å; L343-D374 WeakPolarHBondContact CD1-OD2 3.35Å; L343-C375 HydrophobicContact CD2-CB 4.17Å
344L95.8Very high93.9Very high8 Ų836.4 Ų36.44%0.04220%0.199CC..Hα-helixtrans-59.2-46.6177.2175.868.2000111.2F316 Q340 A347 A348F316-L344 HydrophobicContact CB-CD1 3.9Å; F316-L344 HydrophobicContact CG-CD1 4.31Å; Q340-L344 WeakPolarHBondContact O-CB 3.17Å; Q340-L344 PolarHBondContact O-N 3.08Å; L344-A347 PolarHBondContact O-N 3.06Å; L344-A348 WeakPolarHBondContact O-CB 3.33Å; L344-A348 PolarHBondContact O-N 2.94Å
345K95.9Very high94.1Very high44 Ų4434.8 Ų34.819%0.19119%0.192CC..Hα-helixtrans-62.6-44.8177.6-174.2174.8-178-157.20111.6L325 I332 A341 L342 L343 A348 L349 H361L325-K345 HydrophobicContact CD1-CD 4.39Å; L325-K345 HydrophobicContact CD1-CG 3.76Å; I332-K345 HydrophobicContact CD1-CB 4.02Å; I332-K345 HydrophobicContact CD1-CD 3.52Å; I332-K345 HydrophobicContact CD1-CG 4.39Å; A341-K345 WeakPolarHBondContact O-CB 3.41Å; A341-K345 PolarHBondContact O-N 3.18Å; L342-K345 PolarHBondContact O-N 3.19Å; L343-K345 VanDerWaalsContact C-N 3.34Å; L343-K345 PolarHBondContact O-N 3.19Å; K345-A348 PolarHBondContact O-N 3.09Å; K345-L349 HydrophobicContact CG-CD1 4.15Å; K345-L349 WeakPolarHBondContact O-CB 3.35Å; K345-L349 WeakPolarHBondContact O-CG 3.39Å; K345-L349 PolarHBondContact O-N 3.13Å; K345-H361 WeakPolarHBondContact CE-NE2 3.41Å; K345-H361 PolarHBondContact NZ-CE1 2.89Å; K345-H361 PolarHBondContact NZ-NE2 3.06Å
346G95.4Very high94.2Very high0 Ų038.3 Ų38.30%021%0.206CC..Hα-helixtrans-60-46.2176.400000112.2L342 L343 L349 R350 A358 F362L342-G346 PolarHBondContact O-N 3.12Å; L343-G346 PolarHBondContact O-N 3.03Å; G346-L349 PolarHBondContact O-N 3.4Å; G346-R350 WeakPolarHBondContact O-CB 3.33Å; G346-R350 PolarHBondContact O-N 3.08Å; G346-A358 VanDerWaalsContact O-CB 3.3Å; G346-A358 WeakPolarHBondContact O-CB 3.33Å; G346-F362 VanDerWaalsContact C-CE2 3.49Å
347A95.1Very high94.6Very high24 Ų2439.2 Ų39.220%0.19820%0.204CC..Hα-helixtrans-64.4-43.1178.200000112F316 L343 L344 L349 R350 N351 F362F316-A347 HydrophobicContact CD2-CB 4.49Å; F316-A347 HydrophobicContact CE2-CB 3.72Å; F316-A347 HydrophobicContact CZ-CB 3.83Å; L343-A347 WeakPolarHBondContact O-CB 3.35Å; L343-A347 PolarHBondContact O-N 3.32Å; L344-A347 PolarHBondContact O-N 3.06Å; A347-L349 PolarHBondContact O-N 3.34Å; A347-R350 PolarHBondContact O-N 3.34Å; A347-N351 PolarHBondContact O-N 2.97Å; A347-F362 HydrophobicContact CB-CZ 4.42Å
348A96Very high94.9Very high0 Ų035 Ų350%018%0.181CC..Hα-helixtrans-61.7-4317600000112F316 A324 L325 L344 K345 N351 M352F316-A348 HydrophobicContact CD2-CB 4.34Å; A324-A348 HydrophobicContact CB-CB 4.22Å; L325-A348 HydrophobicContact CB-CB 4.4Å; L344-A348 WeakPolarHBondContact O-CB 3.33Å; L344-A348 PolarHBondContact O-N 2.94Å; K345-A348 PolarHBondContact O-N 3.09Å; A348-N351 PolarHBondContact O-N 2.93Å; A348-M352 WeakPolarHBondContact O-CG 3.25Å; A348-M352 PolarHBondContact O-N 3.36Å
349L96Very high95Very high1 Ų135 Ų351%0.00518%0.181CC..Hα-helixtrans-64.9-40.7176-74.4168.1000112.5L325 K345 G346 A347 M352 G353 R354 E357 A358L325-L349 HydrophobicContact CD1-CD1 4.38Å; L325-L349 HydrophobicContact CD1-CD2 3.82Å; L325-L349 HydrophobicContact CD1-CG 3.83Å; L325-L349 HydrophobicContact CD2-CD2 4.04Å; K345-L349 HydrophobicContact CG-CD1 4.15Å; K345-L349 WeakPolarHBondContact O-CB 3.35Å; K345-L349 WeakPolarHBondContact O-CG 3.39Å; K345-L349 PolarHBondContact O-N 3.13Å; G346-L349 PolarHBondContact O-N 3.4Å; A347-L349 PolarHBondContact O-N 3.34Å; L349-M352 PolarHBondContact O-N 3.36Å; L349-G353 PolarHBondContact O-N 3.38Å; L349-R354 HydrophobicContact CB-CB 4.37Å; L349-R354 HydrophobicContact CD2-CB 4.1Å; L349-R354 PolarHBondContact O-N 2.94Å; L349-E357 HydrophobicContact CD1-CB 4.09Å; L349-A358 HydrophobicContact CB-CB 4Å
350R95.4Very high95.1Very high83 Ų8339.3 Ų39.331%0.31320%0.202SC..Hα-helixtrans-57.9-48.9175.2178.2-168.5166.3-157.23.6111G346 A347 M352 G353 A358 D381G346-R350 WeakPolarHBondContact O-CB 3.33Å; G346-R350 PolarHBondContact O-N 3.08Å; A347-R350 PolarHBondContact O-N 3.34Å; R350-M352 PolarHBondContact O-N 3.22Å; R350-G353 PolarHBondContact O-N 3.2Å; R350-A358 HydrophobicContact CB-CB 4.33Å; R350-D381 IonicContact CZ-OD2 3.54Å; R350-D381 IonicContact NH1-OD2 3.25Å; R350-D381 PolarHBondContact NH1-OD2 3.12Å; R350-D381 IonicContact NH2-OD2 2.92Å; R350-D381 PolarHBondContact NH2-OD2 3.48Å
351N94.4Very high95Very high66 Ų6640.4 Ų40.435%0.35321%0.207SC..Hα-helixtrans-68.7-19.4-179.6-76.1-7.5000113.7F316 Y321 A347 A348 G353F316-N351 WeakPolarHBondContact CE2-ND2 3.47Å; F316-N351 WeakPolarHBondContact CZ-ND2 3.36Å; Y321-N351 HydrophobicContact CD1-CB 3.89Å; Y321-N351 HydrophobicContact CD2-CB 4.02Å; Y321-N351 HydrophobicContact CE1-CB 3.82Å; Y321-N351 WeakPolarHBondContact CE1-ND2 3.38Å; Y321-N351 HydrophobicContact CE2-CB 3.93Å; Y321-N351 HydrophobicContact CG-CB 4Å; A347-N351 PolarHBondContact O-N 2.97Å; A348-N351 PolarHBondContact O-N 2.93Å; N351-G353 VanDerWaalsContact C-N 3.3Å
352M94.2Very high95Very high66 Ų6640.8 Ų40.833%0.32521%0.208SC..THydrogen-bonded Turntrans-83-1.9168.6-67.2177.6-167.800113.9Y321 L325 A348 L349 R350 R354Y321-M352 WeakPolarHBondContact O-CE 3.38Å; L325-M352 HydrophobicContact CB-CE 3.8Å; L325-M352 HydrophobicContact CD2-CE 3.92Å; L325-M352 HydrophobicContact CD2-SD 3.95Å; L325-M352 HydrophobicContact CG-CE 4.49Å; A348-M352 WeakPolarHBondContact O-CG 3.25Å; A348-M352 PolarHBondContact O-N 3.36Å; L349-M352 PolarHBondContact O-N 3.36Å; R350-M352 PolarHBondContact O-N 3.22Å; M352-R354 VanDerWaalsContact C-N 3.34Å
353G92.8Very high94.9Very high57 Ų5746.6 Ų46.659%0.58823%0.23SC*.THydrogen-bonded Turntrans82.22.1-175.200000115.1L349 R350 N351 V355L349-G353 PolarHBondContact O-N 3.38Å; R350-G353 PolarHBondContact O-N 3.2Å; N351-G353 VanDerWaalsContact C-N 3.3Å; G353-V355 PolarHBondContact O-N 3.05Å
354R95.4Very high94.7Very high108 Ų10849.2 Ų49.241%0.40824%0.242SC..  trans-84.958.2177.8-67.3172.169.3-179.38.2111.4L349 M352 Q356 E357 A358L349-R354 HydrophobicContact CB-CB 4.37Å; L349-R354 HydrophobicContact CD2-CB 4.1Å; L349-R354 PolarHBondContact O-N 2.94Å; M352-R354 VanDerWaalsContact C-N 3.34Å; R354-Q356 PolarHBondContact O-N 3.48Å; R354-E357 IonicContact CZ-OE1 2.65Å; R354-E357 VanDerWaalsContact CZ-OE1 3.29Å; R354-E357 IonicContact CZ-OE2 3.08Å; R354-E357 IonicContact NE-OE1 2.7Å; R354-E357 PolarHBondContact NE-OE1 2.87Å; R354-E357 IonicContact NE-OE2 3.86Å; R354-E357 PolarHBondContact NE-OE2 3.38Å; R354-E357 IonicContact NH2-OE1 2.72Å; R354-E357 PolarHBondContact NH2-OE1 2.79Å; R354-E357 IonicContact NH2-OE2 2.88Å; R354-E357 PolarHBondContact NH2-OE2 2.98Å; R354-E357 PolarHBondContact O-N 3.06Å; R354-A358 PolarHBondContact O-N 3.45Å
355V94.9Very high94.6Very high22 Ų2248.8 Ų48.813%0.13324%0.24CC..Hα-helixtrans-64.8-38-169.1-1720000113G353 E357 A358 I359 C382 S386G353-V355 PolarHBondContact O-N 3.05Å; V355-E357 VanDerWaalsContact C-N 3.33Å; V355-E357 PolarHBondContact O-N 3.47Å; V355-A358 WeakPolarHBondContact O-CB 2.92Å; V355-A358 PolarHBondContact O-N 3.03Å; V355-I359 HydrophobicContact CG1-CD1 4.42Å; V355-I359 WeakPolarHBondContact O-CG1 3.33Å; V355-I359 PolarHBondContact O-N 3.4Å; V355-I359 VanDerWaalsContact O-N 3.08Å; V355-C382 HydrophobicContact CG1-CB 3.77Å; V355-C382 WeakPolarHBondContact CG1-O 3.48Å; V355-S386 WeakPolarHBondContact CG1-OG 3.3Å
356Q93.3Very high94.3Very high132 Ų13248.9 Ų48.962%0.61724%0.242SC*.Hα-helixtrans-63.4-37.5-179.5-65.8-59.4-29.100113R354R354-Q356 PolarHBondContact O-N 3.48Å
357E94.8Very high93.9Very high79 Ų7957.6 Ų57.637%0.36928%0.275SS..Hα-helixtrans-72.3-36.6175-67.3-178.3-144.200111.9L349 R354 V355 I359 I360L349-E357 HydrophobicContact CD1-CB 4.09Å; R354-E357 IonicContact CZ-OE1 2.65Å; R354-E357 VanDerWaalsContact CZ-OE1 3.29Å; R354-E357 IonicContact CZ-OE2 3.08Å; R354-E357 IonicContact NE-OE1 2.7Å; R354-E357 PolarHBondContact NE-OE1 2.87Å; R354-E357 IonicContact NE-OE2 3.86Å; R354-E357 PolarHBondContact NE-OE2 3.38Å; R354-E357 IonicContact NH2-OE1 2.72Å; R354-E357 PolarHBondContact NH2-OE1 2.79Å; R354-E357 IonicContact NH2-OE2 2.88Å; R354-E357 PolarHBondContact NH2-OE2 2.98Å; R354-E357 PolarHBondContact O-N 3.06Å; V355-E357 VanDerWaalsContact C-N 3.33Å; V355-E357 PolarHBondContact O-N 3.47Å; E357-I359 VanDerWaalsContact C-N 3.3Å; E357-I359 PolarHBondContact O-N 3.22Å; E357-I360 PolarHBondContact O-N 3.44Å
358A95.6Very high93.5Very high0 Ų059.9 Ų59.90%028%0.283CS..Hα-helixtrans-59.3-41.7176.400000111.8G346 L349 R350 R354 V355 I360 H361 F362G346-A358 VanDerWaalsContact O-CB 3.3Å; G346-A358 WeakPolarHBondContact O-CB 3.33Å; L349-A358 HydrophobicContact CB-CB 4Å; R350-A358 HydrophobicContact CB-CB 4.33Å; R354-A358 PolarHBondContact O-N 3.45Å; V355-A358 WeakPolarHBondContact O-CB 2.92Å; V355-A358 PolarHBondContact O-N 3.03Å; A358-I360 PolarHBondContact O-N 3.31Å; A358-H361 PolarHBondContact O-N 3.2Å; A358-H361 VanDerWaalsContact O-N 3.11Å; A358-F362 HydrophobicContact CB-CD2 4.28Å; A358-F362 HydrophobicContact CB-CE2 4.12Å; A358-F362 WeakPolarHBondContact O-CD2 3.33Å; A358-F362 PolarHBondContact O-N 3.34Å
359I94.9Very high93Very high9 Ų960.9 Ų60.95%0.04629%0.292CS..Hα-helixtrans-55.6-38.8178.3-71.1167.3000111.9V355 E357 F362 R363 L379 C382 Y383V355-I359 HydrophobicContact CG1-CD1 4.42Å; V355-I359 WeakPolarHBondContact O-CG1 3.33Å; V355-I359 PolarHBondContact O-N 3.4Å; V355-I359 VanDerWaalsContact O-N 3.08Å; E357-I359 VanDerWaalsContact C-N 3.3Å; E357-I359 PolarHBondContact O-N 3.22Å; I359-F362 PolarHBondContact O-N 3.46Å; I359-R363 HydrophobicContact CG2-CG 4.4Å; I359-R363 WeakPolarHBondContact O-CB 3.3Å; I359-R363 VanDerWaalsContact O-CG 3.29Å; I359-R363 WeakPolarHBondContact O-CG 3.19Å; I359-R363 PolarHBondContact O-N 3.4Å; I359-L379 HydrophobicContact CB-CD1 4.33Å; I359-L379 HydrophobicContact CG1-CD1 4.27Å; I359-L379 HydrophobicContact CG2-CD1 3.92Å; I359-C382 HydrophobicContact CD1-CB 4.45Å; I359-C382 HydrophobicContact CG1-CB 3.76Å; I359-Y383 HydrophobicContact CD1-CD1 4.05Å; I359-Y383 HydrophobicContact CD1-CE1 3.91Å; I359-Y383 HydrophobicContact CG1-CE1 4.45Å; I359-Y383 HydrophobicContact CG2-CE1 4.34Å
360I94.4Very high92.3Very high109 Ų10964.1 Ų64.156%0.55931%0.312SS*.Hα-helixtrans-63-46.3179.8-57.1170.7000110.1E357 A358 R363 E364E357-I360 PolarHBondContact O-N 3.44Å; A358-I360 PolarHBondContact O-N 3.31Å; I360-R363 PolarHBondContact O-N 2.7Å; I360-E364 PolarHBondContact O-N 3.27Å; I360-E364 VanDerWaalsContact O-N 3.07Å
361H94.6Very high91.4Very high29 Ų2962.9 Ų62.913%0.13432%0.316CS..Hα-helixtrans-69-39.2-179.7-70.5-51.7000112.8K345 A358 E364 A365K345-H361 WeakPolarHBondContact CE-NE2 3.41Å; K345-H361 PolarHBondContact NZ-CE1 2.89Å; K345-H361 PolarHBondContact NZ-NE2 3.06Å; A358-H361 PolarHBondContact O-N 3.2Å; A358-H361 VanDerWaalsContact O-N 3.11Å; H361-E364 PolarHBondContact O-N 3.13Å; H361-A365 PolarHBondContact O-N 3.27Å
362F94.8Very high90.9Very high7 Ų760.8 Ų60.83%0.03130%0.303CS..Hα-helixtrans-65.9-38.3174.3-74.2-63.4000112.6L343 G346 A347 A358 I359 E364 A365 M366 L379 C382L343-F362 HydrophobicContact CD2-CD1 3.59Å; L343-F362 HydrophobicContact CD2-CE1 3.68Å; G346-F362 VanDerWaalsContact C-CE2 3.49Å; A347-F362 HydrophobicContact CB-CZ 4.42Å; A358-F362 HydrophobicContact CB-CD2 4.28Å; A358-F362 HydrophobicContact CB-CE2 4.12Å; A358-F362 WeakPolarHBondContact O-CD2 3.33Å; A358-F362 PolarHBondContact O-N 3.34Å; I359-F362 PolarHBondContact O-N 3.46Å; F362-E364 VanDerWaalsContact C-N 3.3Å; F362-E364 PolarHBondContact O-N 3.01Å; F362-A365 PolarHBondContact O-N 3.29Å; F362-M366 WeakPolarHBondContact O-CB 3.36Å; F362-M366 PolarHBondContact O-N 3.44Å; F362-L379 HydrophobicContact CB-CB 3.95Å; F362-L379 HydrophobicContact CB-CD1 4.06Å; F362-C382 WeakPolarHBondContact CE2-SG 3.33Å
363R92.9Very high90.5Very high122 Ų12258.5 Ų58.546%0.4629%0.292SS..Hα-helixtrans-64.1-35.8173.9-75.7177.5179.4-173.51.2112.4I359 I360 R367 L379 Y383I359-R363 HydrophobicContact CG2-CG 4.4Å; I359-R363 WeakPolarHBondContact O-CB 3.3Å; I359-R363 VanDerWaalsContact O-CG 3.29Å; I359-R363 WeakPolarHBondContact O-CG 3.19Å; I359-R363 PolarHBondContact O-N 3.4Å; I360-R363 PolarHBondContact O-N 2.7Å; R363-R367 PolarHBondContact O-N 3.22Å; R363-R367 VanDerWaalsContact O-N 3.17Å; R363-L379 HydrophobicContact CG-CD1 4.23Å; R363-L379 HydrophobicContact CG-CD2 4.17Å; R363-Y383 PolarHBondContact NE-OH 3.45Å; R363-Y383 PolarHBondContact NH2-OH 3.47Å
364E91.8Very high90.3Very high67 Ų6756.7 Ų56.731%0.31327%0.269SS..Hα-helixtrans-67.3-46174.1-171.7172.5-16200111.6L342 I360 H361 F362 M366 R367 L368L342-E364 HydrophobicContact CD1-CB 4.37Å; L342-E364 HydrophobicContact CD1-CG 3.94Å; L342-E364 HydrophobicContact CD2-CG 4.45Å; I360-E364 PolarHBondContact O-N 3.27Å; I360-E364 VanDerWaalsContact O-N 3.07Å; H361-E364 PolarHBondContact O-N 3.13Å; F362-E364 VanDerWaalsContact C-N 3.3Å; F362-E364 PolarHBondContact O-N 3.01Å; E364-M366 VanDerWaalsContact C-N 3.32Å; E364-M366 PolarHBondContact O-N 3.33Å; E364-R367 WeakPolarHBondContact O-CB 3.35Å; E364-R367 PolarHBondContact O-N 3.17Å; E364-R367 VanDerWaalsContact O-N 3.1Å; E364-L368 PolarHBondContact O-N 3.42Å; E364-L368 VanDerWaalsContact O-N 3.13Å
365A93Very high90Very high0 Ų051.6 Ų51.60%025%0.25CC..Hα-helixtrans-58-43.1174.900000112.1V339 L342 L343 H361 F362 R367 L368 A369V339-A365 HydrophobicContact CG1-CB 4.17Å; L342-A365 HydrophobicContact CB-CB 4.02Å; L342-A365 HydrophobicContact CD1-CB 4.42Å; L343-A365 HydrophobicContact CD2-CB 3.8Å; L343-A365 HydrophobicContact CG-CB 4.29Å; H361-A365 PolarHBondContact O-N 3.27Å; F362-A365 PolarHBondContact O-N 3.29Å; A365-R367 VanDerWaalsContact C-N 3.32Å; A365-R367 PolarHBondContact O-N 3.06Å; A365-L368 PolarHBondContact O-N 3.45Å; A365-A369 PolarHBondContact O-N 3.43Å
366M90.3Very high89.8Confident46 Ų4651.2 Ų51.223%0.22725%0.246CC..Hα-helixtrans-60.4-38.2175.3-178-171.272.600112.6F362 E364 L368 A369 P370 Y376 L379 M395F362-M366 WeakPolarHBondContact O-CB 3.36Å; F362-M366 PolarHBondContact O-N 3.44Å; E364-M366 VanDerWaalsContact C-N 3.32Å; E364-M366 PolarHBondContact O-N 3.33Å; M366-L368 VanDerWaalsContact C-N 3.35Å; M366-A369 CarbonylContact O-C 3.28Å; M366-P370 WeakPolarHBondContact O-CA 3.41Å; M366-Y376 HydrophobicContact CG-CD1 4.1Å; M366-Y376 HydrophobicContact CG-CE1 3.51Å; M366-Y376 HydrophobicContact CG-CE2 4.48Å; M366-Y376 HydrophobicContact SD-CD1 3.84Å; M366-Y376 HydrophobicContact SD-CE1 3.41Å; M366-Y376 WeakPolarHBondContact SD-CE1 3.34Å; M366-L379 HydrophobicContact SD-CD2 4.34Å; M366-M395 HydrophobicContact CE-CE 4.28Å; M366-M395 HydrophobicContact SD-CE 3.51Å; M366-M395 VanDerWaalsContact SD-CE 3.51Å
367R87.3Confident89.7Confident183 Ų18347.9 Ų47.969%0.69123%0.23SC*.Hα-helixtrans-67.3-37.3176.9-168.3-169.9-58.6111.80.5111.7R363 E364 A365R363-R367 PolarHBondContact O-N 3.22Å; R363-R367 VanDerWaalsContact O-N 3.17Å; E364-R367 WeakPolarHBondContact O-CB 3.35Å; E364-R367 PolarHBondContact O-N 3.17Å; E364-R367 VanDerWaalsContact O-N 3.1Å; A365-R367 VanDerWaalsContact C-N 3.32Å; A365-R367 PolarHBondContact O-N 3.06Å
368L86.6Confident89.4Confident71 Ų7144.6 Ų44.637%0.37222%0.218SC..Hα-helixtrans-75.8-37.4-179-68.8174.5000112.7V339 L342 E364 A365 M366V339-L368 HydrophobicContact CG2-CB 3.86Å; L342-L368 HydrophobicContact CD1-CD1 3.52Å; E364-L368 PolarHBondContact O-N 3.42Å; E364-L368 VanDerWaalsContact O-N 3.13Å; A365-L368 PolarHBondContact O-N 3.45Å; M366-L368 VanDerWaalsContact C-N 3.35Å
369A84.7Confident89.3Confident22 Ų2244.6 Ų44.618%0.18222%0.218CC..  trans-133.283.4178.600000111.8V339 A365 M366 C371 R372V339-A369 HydrophobicContact CG1-CB 4.14Å; V339-A369 HydrophobicContact CG2-CB 3.76Å; A365-A369 PolarHBondContact O-N 3.43Å; M366-A369 CarbonylContact O-C 3.28Å; A369-C371 PolarHBondContact O-N 3.09Å; A369-R372 HydrophobicContact CB-CB 4.02Å; A369-R372 PolarHBondContact O-N 3.17Å
370P81.4Confident89.2Confident68 Ų6844.3 Ų44.344%0.44222%0.217SC..THydrogen-bonded Turntrans-70-16.5-175.427.2-35.2000114.2M366 Y376M366-P370 WeakPolarHBondContact O-CA 3.41Å; P370-Y376 WeakPolarHBondContact O-CE2 3.08Å; P370-Y376 PolarHBondContact O-OH 3.45Å
371C77.7Confident89.1Confident57 Ų5741.3 Ų41.339%0.38520%0.202SC..THydrogen-bonded Turntrans-95.70.9-178.8-54.90000113.6A369A369-C371 PolarHBondContact O-N 3.09Å
372R84.3Confident89.1Confident22 Ų2240 Ų408%0.08320%0.195CC..  trans-97.4118.8-174.2-147.2-167.4151.2149.3-0.6109.9F248 A369 D374 Y376F248-R372 HydrophobicContact CE1-CG 4.34Å; F248-R372 VanDerWaalsContact CE1-NH2 3.27Å; F248-R372 VanDerWaalsContact CZ-NH2 3.29Å; A369-R372 HydrophobicContact CB-CB 4.02Å; A369-R372 PolarHBondContact O-N 3.17Å; R372-D374 WeakPolarHBondContact CD-OD1 3.4Å; R372-D374 WeakPolarHBondContact CG-OD1 3.5Å; R372-D374 IonicContact CZ-OD1 3.56Å; R372-D374 IonicContact CZ-OD2 2.74Å; R372-D374 IonicContact NE-OD1 2.69Å; R372-D374 PolarHBondContact NE-OD1 2.82Å; R372-D374 IonicContact NE-OD2 2.7Å; R372-D374 PolarHBondContact NE-OD2 3.15Å; R372-D374 IonicContact NH2-OD2 3.47Å; R372-D374 PolarHBondContact NH2-OD2 2.96Å; R372-Y376 WeakPolarHBondContact O-CD2 3.43Å
373L85.9Confident89Confident18 Ų1840.5 Ų40.59%0.09420%0.198CC..Hα-helixtrans-71.1-35.8-170.1-77.1168.9000114.2C375 Y376 E377 I399 L403 Q408 T409 I412L373-C375 VanDerWaalsContact C-N 3.28Å; L373-C375 PolarHBondContact O-N 3.26Å; L373-Y376 PolarHBondContact O-N 3.27Å; L373-E377 PolarHBondContact O-N 2.97Å; L373-I399 HydrophobicContact CD2-CG2 3.85Å; L373-L403 HydrophobicContact CD1-CD2 4.38Å; L373-L403 HydrophobicContact CD2-CD2 3.47Å; L373-L403 VanDerWaalsContact CD2-CD2 3.47Å; L373-L403 HydrophobicContact CG-CD2 3.72Å; L373-Q408 HydrophobicContact CD1-CB 3.63Å; L373-Q408 HydrophobicContact CD1-CG 4.22Å; L373-T409 HydrophobicContact CD2-CG2 3.73Å; L373-I412 HydrophobicContact CD2-CD1 4.24Å
374D87.4Confident88.9Confident20 Ų2036.3 Ų36.311%0.10718%0.184CC..Hα-helixtrans-61.4-32.6179.657.6-11.3000113.3F248 L343 R372 Y376 E377 G378F248-D374 WeakPolarHBondContact CZ-OD2 3.48Å; L343-D374 WeakPolarHBondContact CD1-OD2 3.35Å; R372-D374 WeakPolarHBondContact CD-OD1 3.4Å; R372-D374 WeakPolarHBondContact CG-OD1 3.5Å; R372-D374 IonicContact CZ-OD1 3.56Å; R372-D374 IonicContact CZ-OD2 2.74Å; R372-D374 IonicContact NE-OD1 2.69Å; R372-D374 PolarHBondContact NE-OD1 2.82Å; R372-D374 IonicContact NE-OD2 2.7Å; R372-D374 PolarHBondContact NE-OD2 3.15Å; R372-D374 IonicContact NH2-OD2 3.47Å; R372-D374 PolarHBondContact NH2-OD2 2.96Å; D374-Y376 VanDerWaalsContact C-N 3.27Å; D374-Y376 PolarHBondContact O-N 3.48Å; D374-E377 PolarHBondContact O-N 3.4Å; D374-G378 PolarHBondContact O-N 3.12Å
375C89.9Confident88.8Confident0 Ų036 Ų360%019%0.193CC..Hα-helixtrans-57.3-42.7171.2-63.60000112V339 L343 L373 L379V339-C375 VanDerWaalsContact CG1-SG 3.55Å; L343-C375 HydrophobicContact CD2-CB 4.17Å; L373-C375 VanDerWaalsContact C-N 3.28Å; L373-C375 PolarHBondContact O-N 3.26Å; C375-L379 PolarHBondContact O-N 3.44Å
376Y90.2Very high88.7Confident15 Ų1538.2 Ų38.26%0.05921%0.208CC..Hα-helixtrans-78.6-38.4179.8-62-87.3000112.2M366 P370 R372 L373 D374 G378 L379 I380 M395 I399M366-Y376 HydrophobicContact CG-CD1 4.1Å; M366-Y376 HydrophobicContact CG-CE1 3.51Å; M366-Y376 HydrophobicContact CG-CE2 4.48Å; M366-Y376 HydrophobicContact SD-CD1 3.84Å; M366-Y376 HydrophobicContact SD-CE1 3.41Å; M366-Y376 WeakPolarHBondContact SD-CE1 3.34Å; P370-Y376 WeakPolarHBondContact O-CE2 3.08Å; P370-Y376 PolarHBondContact O-OH 3.45Å; R372-Y376 WeakPolarHBondContact O-CD2 3.43Å; L373-Y376 PolarHBondContact O-N 3.27Å; D374-Y376 VanDerWaalsContact C-N 3.27Å; D374-Y376 PolarHBondContact O-N 3.48Å; Y376-G378 VanDerWaalsContact C-N 3.35Å; Y376-G378 PolarHBondContact O-N 2.87Å; Y376-L379 PolarHBondContact O-N 2.69Å; Y376-I380 WeakPolarHBondContact O-CB 3.29Å; Y376-I380 WeakPolarHBondContact O-CG1 3.5Å; Y376-I380 PolarHBondContact O-N 3.35Å; Y376-M395 HydrophobicContact CD1-CE 4.33Å; Y376-M395 HydrophobicContact CE1-CE 4.49Å; Y376-I399 HydrophobicContact CD1-CD1 3.96Å; Y376-I399 HydrophobicContact CD1-CG1 3.49Å; Y376-I399 VanDerWaalsContact CD1-CG1 3.49Å; Y376-I399 HydrophobicContact CD2-CG1 4.18Å; Y376-I399 HydrophobicContact CE1-CG1 4.03Å; Y376-I399 HydrophobicContact CG-CD1 3.73Å; Y376-I399 HydrophobicContact CG-CG1 3.57Å
377E90.4Very high88.6Confident61 Ų6142.8 Ų42.829%0.28523%0.234SC..Hα-helixtrans-56-50.6174.9-172.4174.7-179.900109.9L373 D374 L379 I380 D381 K443L373-E377 PolarHBondContact O-N 2.97Å; D374-E377 PolarHBondContact O-N 3.4Å; E377-L379 VanDerWaalsContact C-N 3.3Å; E377-L379 PolarHBondContact O-N 3.5Å; E377-I380 PolarHBondContact O-N 2.94Å; E377-D381 VanDerWaalsContact O-CB 3.29Å; E377-D381 WeakPolarHBondContact O-CB 3.35Å; E377-D381 PolarHBondContact O-N 3.42Å; E377-K443 VanDerWaalsContact CD-NZ 3.3Å; E377-K443 IonicContact OE1-NZ 3.99Å; E377-K443 PolarHBondContact OE1-NZ 3.3Å; E377-K443 IonicContact OE2-NZ 3.99Å; E377-K443 PolarHBondContact OE2-NZ 3.43Å
378G90.2Very high88.7Confident11 Ų1134.7 Ų34.711%0.11321%0.207CC..Hα-helixtrans-61-35.4177.200000114D374 Y376 C382D374-G378 PolarHBondContact O-N 3.12Å; Y376-G378 VanDerWaalsContact C-N 3.35Å; Y376-G378 PolarHBondContact O-N 2.87Å; G378-C382 PolarHBondContact O-N 3.37Å; G378-C382 VanDerWaalsContact O-N 3.16Å; G378-C382 PolarHBondContact O-SG 3.48Å
379L93.2Very high88.8Confident0 Ų034.1 Ų34.10%020%0.204CC..Hα-helixtrans-71.5-43.9176.3-177.358.5000112.5I359 F362 R363 M366 C375 Y376 E377 D381 C382 Y383 M395I359-L379 HydrophobicContact CB-CD1 4.33Å; I359-L379 HydrophobicContact CG1-CD1 4.27Å; I359-L379 HydrophobicContact CG2-CD1 3.92Å; F362-L379 HydrophobicContact CB-CB 3.95Å; F362-L379 HydrophobicContact CB-CD1 4.06Å; R363-L379 HydrophobicContact CG-CD1 4.23Å; R363-L379 HydrophobicContact CG-CD2 4.17Å; M366-L379 HydrophobicContact SD-CD2 4.34Å; C375-L379 PolarHBondContact O-N 3.44Å; Y376-L379 PolarHBondContact O-N 2.69Å; E377-L379 VanDerWaalsContact C-N 3.3Å; E377-L379 PolarHBondContact O-N 3.5Å; L379-D381 VanDerWaalsContact C-N 3.34Å; L379-C382 WeakPolarHBondContact O-CB 3.36Å; L379-C382 PolarHBondContact O-N 3.3Å; L379-Y383 HydrophobicContact CD1-CD2 4.33Å; L379-Y383 HydrophobicContact CD1-CE2 3.71Å; L379-Y383 HydrophobicContact CD2-CE2 4.11Å; L379-Y383 HydrophobicContact CG-CD2 4.12Å; L379-Y383 HydrophobicContact CG-CE2 3.62Å; L379-Y383 WeakPolarHBondContact O-CD2 3.04Å; L379-Y383 PolarHBondContact O-N 3.17Å; L379-M395 HydrophobicContact CD2-CE 3.82Å; L379-M395 HydrophobicContact CD2-CG 4.44Å
380I92.7Very high89.1Confident3 Ų343.5 Ų43.52%0.01524%0.235CC..Hα-helixtrans-61.3-47.5176.6-75.8170.3000109.5Y376 E377 C382 Y383 L384 A392 M395 A396 I399 I412 V416Y376-I380 WeakPolarHBondContact O-CB 3.29Å; Y376-I380 WeakPolarHBondContact O-CG1 3.5Å; Y376-I380 PolarHBondContact O-N 3.35Å; E377-I380 PolarHBondContact O-N 2.94Å; I380-C382 PolarHBondContact O-N 3.04Å; I380-Y383 PolarHBondContact O-N 2.99Å; I380-L384 HydrophobicContact CG2-CD1 4Å; I380-L384 HydrophobicContact CG2-CG 4.2Å; I380-L384 WeakPolarHBondContact O-CG 3.33Å; I380-L384 PolarHBondContact O-N 3.34Å; I380-A392 HydrophobicContact CG2-CB 4.4Å; I380-M395 HydrophobicContact CG1-CB 4.17Å; I380-A396 HydrophobicContact CD1-CB 3.96Å; I380-I399 HydrophobicContact CD1-CD1 3.6Å; I380-I412 HydrophobicContact CD1-CG2 3.38Å; I380-V416 HydrophobicContact CG2-CG2 3.42Å; I380-V416 VanDerWaalsContact CG2-CG2 3.42Å
381D91.9Very high89.5Confident46 Ų4645.3 Ų45.325%0.24624%0.237CC..Hα-helixtrans-54.5-38.9175-88.213.6000112.7R350 E377 L379 A385R350-D381 IonicContact CZ-OD2 3.54Å; R350-D381 IonicContact NH1-OD2 3.25Å; R350-D381 PolarHBondContact NH1-OD2 3.12Å; R350-D381 IonicContact NH2-OD2 2.92Å; R350-D381 PolarHBondContact NH2-OD2 3.48Å; E377-D381 VanDerWaalsContact O-CB 3.29Å; E377-D381 WeakPolarHBondContact O-CB 3.35Å; E377-D381 PolarHBondContact O-N 3.42Å; L379-D381 VanDerWaalsContact C-N 3.34Å; D381-A385 VanDerWaalsContact O-CB 3.3Å; D381-A385 WeakPolarHBondContact O-CB 3.46Å; D381-A385 PolarHBondContact O-N 3.27Å
382C93.7Very high90.2Very high0 Ų042.6 Ų42.60%022%0.219CC..Hα-helixtrans-68.6-39.5175.1-70.50000112.5V355 I359 F362 G378 L379 I380 A385 S386V355-C382 HydrophobicContact CG1-CB 3.77Å; V355-C382 WeakPolarHBondContact CG1-O 3.48Å; I359-C382 HydrophobicContact CD1-CB 4.45Å; I359-C382 HydrophobicContact CG1-CB 3.76Å; F362-C382 WeakPolarHBondContact CE2-SG 3.33Å; G378-C382 PolarHBondContact O-N 3.37Å; G378-C382 VanDerWaalsContact O-N 3.16Å; G378-C382 PolarHBondContact O-SG 3.48Å; L379-C382 WeakPolarHBondContact O-CB 3.36Å; L379-C382 PolarHBondContact O-N 3.3Å; I380-C382 PolarHBondContact O-N 3.04Å; C382-A385 PolarHBondContact O-N 3.28Å; C382-S386 PolarHBondContact O-N 2.83Å; C382-S386 VanDerWaalsContact O-N 3.12Å; C382-S386 PolarHBondContact O-OG 3.31Å
383Y93.6Very high90.5Very high19 Ų1943.6 Ų43.68%0.07523%0.225CC..Hα-helixtrans-67.6-41.6175.3-71.7-50000111.9I359 R363 L379 I380 S386 N387 G388 E391 M395I359-Y383 HydrophobicContact CD1-CD1 4.05Å; I359-Y383 HydrophobicContact CD1-CE1 3.91Å; I359-Y383 HydrophobicContact CG1-CE1 4.45Å; I359-Y383 HydrophobicContact CG2-CE1 4.34Å; R363-Y383 PolarHBondContact NE-OH 3.45Å; R363-Y383 PolarHBondContact NH2-OH 3.47Å; L379-Y383 HydrophobicContact CD1-CD2 4.33Å; L379-Y383 HydrophobicContact CD1-CE2 3.71Å; L379-Y383 HydrophobicContact CD2-CE2 4.11Å; L379-Y383 HydrophobicContact CG-CD2 4.12Å; L379-Y383 HydrophobicContact CG-CE2 3.62Å; L379-Y383 WeakPolarHBondContact O-CD2 3.04Å; L379-Y383 PolarHBondContact O-N 3.17Å; I380-Y383 PolarHBondContact O-N 2.99Å; Y383-S386 CarbonylContact O-C 3.3Å; Y383-S386 WeakPolarHBondContact O-CA 3.14Å; Y383-S386 PolarHBondContact O-N 3.24Å; Y383-N387 PolarHBondContact O-N 3Å; Y383-G388 PolarHBondContact O-N 2.99Å; Y383-E391 HydrophobicContact CD1-CB 4.03Å; Y383-E391 HydrophobicContact CD2-CB 4.29Å; Y383-E391 HydrophobicContact CE1-CB 4.17Å; Y383-E391 HydrophobicContact CE2-CB 4.4Å; Y383-E391 HydrophobicContact CG-CB 4.1Å; Y383-M395 HydrophobicContact CD2-CG 4.3Å; Y383-M395 HydrophobicContact CE2-CG 3.76Å
384L91.2Very high90.7Very high33 Ų3344.3 Ų44.317%0.17324%0.236CC..Hα-helixtrans-60.9-44.9174.6-67.6-177.5000111I380 S386 N387 A392 V416 E419I380-L384 HydrophobicContact CG2-CD1 4Å; I380-L384 HydrophobicContact CG2-CG 4.2Å; I380-L384 WeakPolarHBondContact O-CG 3.33Å; I380-L384 PolarHBondContact O-N 3.34Å; L384-S386 PolarHBondContact O-N 3.11Å; L384-S386 VanDerWaalsContact O-N 3.16Å; L384-N387 PolarHBondContact O-N 3.31Å; L384-A392 HydrophobicContact CD2-CB 3.9Å; L384-A392 HydrophobicContact CG-CB 4.32Å; L384-V416 HydrophobicContact CD2-CG1 4.3Å; L384-E419 HydrophobicContact CD1-CG 4.3Å; L384-E419 HydrophobicContact CD2-CB 4.37Å; L384-E419 HydrophobicContact CD2-CG 3.99Å
385A90.2Very high90.8Very high60 Ų6044.8 Ų44.850%0.49624%0.238SC..Hα-helixtrans-62.6-20.9174.200000113.8D381 C382D381-A385 VanDerWaalsContact O-CB 3.3Å; D381-A385 WeakPolarHBondContact O-CB 3.46Å; D381-A385 PolarHBondContact O-N 3.27Å; C382-A385 PolarHBondContact O-N 3.28Å
386S90.4Very high90.8Very high47 Ų4744.8 Ų44.833%0.32924%0.238SC..THydrogen-bonded Turntrans-96.67.6175.6-52.50000113.3V355 C382 Y383 L384 G388V355-S386 WeakPolarHBondContact CG1-OG 3.3Å; C382-S386 PolarHBondContact O-N 2.83Å; C382-S386 VanDerWaalsContact O-N 3.12Å; C382-S386 PolarHBondContact O-OG 3.31Å; Y383-S386 CarbonylContact O-C 3.3Å; Y383-S386 WeakPolarHBondContact O-CA 3.14Å; Y383-S386 PolarHBondContact O-N 3.24Å; L384-S386 PolarHBondContact O-N 3.11Å; L384-S386 VanDerWaalsContact O-N 3.16Å; S386-G388 PolarHBondContact O-N 2.76Å
387N87.1Confident90.8Very high142 Ų14247.3 Ų47.376%0.75925%0.253SS*.THydrogen-bonded Turntrans56.219.8-169.9-78.87.2000115.4Y383 L384 I389Y383-N387 PolarHBondContact O-N 3Å; L384-N387 PolarHBondContact O-N 3.31Å; N387-I389 VanDerWaalsContact C-N 3.28Å; N387-I389 PolarHBondContact O-N 3.47Å
388G89.4Confident90.7Very high13 Ų1348 Ų4813%0.13426%0.259CS..  trans-81.961175.800000112.8Y383 S386 R390 E391 A392Y383-G388 PolarHBondContact O-N 2.99Å; S386-G388 PolarHBondContact O-N 2.76Å; G388-R390 VanDerWaalsContact C-N 3.28Å; G388-R390 PolarHBondContact O-N 3.15Å; G388-E391 VanDerWaalsContact CA-OE2 3.31Å; G388-E391 WeakPolarHBondContact CA-OE2 3.34Å; G388-E391 PolarHBondContact O-N 3.4Å; G388-A392 WeakPolarHBondContact O-CB 3.42Å; G388-A392 PolarHBondContact O-N 3.29Å
389I89.7Confident90.5Very high59 Ų5947.6 Ų47.630%0.30325%0.254SS..Hα-helixtrans-62.7-36.5-174.5-55.8173.4000111.2N387 A392 M393 D420N387-I389 VanDerWaalsContact C-N 3.28Å; N387-I389 PolarHBondContact O-N 3.47Å; I389-A392 PolarHBondContact O-N 3.17Å; I389-M393 HydrophobicContact CG2-CG 4.43Å; I389-M393 WeakPolarHBondContact O-CB 3.31Å; I389-M393 WeakPolarHBondContact O-CG 3.49Å; I389-M393 PolarHBondContact O-N 3.19Å; I389-D420 HydrophobicContact CG2-CB 4.42Å
390R89.7Confident90.2Very high220 Ų22052.2 Ų52.283%0.8327%0.272SS*.Hα-helixtrans-65.9-43.6-179.9-172.7-178.3-69.2-178.7-0.3111.5G388 M393 G394G388-R390 VanDerWaalsContact C-N 3.28Å; G388-R390 PolarHBondContact O-N 3.15Å; R390-M393 PolarHBondContact O-N 3.27Å; R390-G394 PolarHBondContact O-N 2.94Å
391E91Very high89.9Confident105 Ų10560 Ų6049%0.49131%0.306SS..Hα-helixtrans-65.6-43.5175.7-66.285.1171.500111.2Y383 G388 M393 G394 M395Y383-E391 HydrophobicContact CD1-CB 4.03Å; Y383-E391 HydrophobicContact CD2-CB 4.29Å; Y383-E391 HydrophobicContact CE1-CB 4.17Å; Y383-E391 HydrophobicContact CE2-CB 4.4Å; Y383-E391 HydrophobicContact CG-CB 4.1Å; G388-E391 VanDerWaalsContact CA-OE2 3.31Å; G388-E391 WeakPolarHBondContact CA-OE2 3.34Å; G388-E391 PolarHBondContact O-N 3.4Å; E391-M393 VanDerWaalsContact C-N 3.33Å; E391-M393 PolarHBondContact O-N 2.98Å; E391-G394 PolarHBondContact O-N 3.34Å; E391-M395 WeakPolarHBondContact O-CG 3.45Å; E391-M395 PolarHBondContact O-N 2.74Å
392A91.9Very high89.4Confident0 Ų062.2 Ų62.20%032%0.321CS..Hα-helixtrans-57.9-45.317500000111.4I380 L384 G388 I389 G394 M395 A396 V416I380-A392 HydrophobicContact CG2-CB 4.4Å; L384-A392 HydrophobicContact CD2-CB 3.9Å; L384-A392 HydrophobicContact CG-CB 4.32Å; G388-A392 WeakPolarHBondContact O-CB 3.42Å; G388-A392 PolarHBondContact O-N 3.29Å; I389-A392 PolarHBondContact O-N 3.17Å; A392-G394 PolarHBondContact O-N 3.35Å; A392-M395 PolarHBondContact O-N 2.87Å; A392-A396 WeakPolarHBondContact O-CB 3.36Å; A392-A396 PolarHBondContact O-N 3.42Å; A392-V416 HydrophobicContact CB-CG1 3.67Å; A392-V416 HydrophobicContact CB-CG2 4.33Å
393M90.4Very high88.7Confident43 Ų4365 Ų6521%0.21234%0.335CS..Hα-helixtrans-64.1-40.1176.1-78.7-59.8-7100112.3I389 R390 E391 M395 A396 N397 V416I389-M393 HydrophobicContact CG2-CG 4.43Å; I389-M393 WeakPolarHBondContact O-CB 3.31Å; I389-M393 WeakPolarHBondContact O-CG 3.49Å; I389-M393 PolarHBondContact O-N 3.19Å; R390-M393 PolarHBondContact O-N 3.27Å; E391-M393 VanDerWaalsContact C-N 3.33Å; E391-M393 PolarHBondContact O-N 2.98Å; M393-M395 VanDerWaalsContact C-N 3.33Å; M393-M395 PolarHBondContact O-N 3.46Å; M393-A396 PolarHBondContact O-N 3.31Å; M393-N397 WeakPolarHBondContact O-CB 3.2Å; M393-N397 PolarHBondContact O-N 2.86Å; M393-N397 PolarHBondContact O-ND2 3.39Å; M393-V416 HydrophobicContact CB-CG1 4.36Å; M393-V416 HydrophobicContact CG-CG1 3.54Å; M393-V416 HydrophobicContact SD-CB 3.75Å; M393-V416 HydrophobicContact SD-CG1 3.33Å; M393-V416 WeakPolarHBondContact SD-CG1 3.1Å
394G90.6Very high88.2Confident33 Ų3365.4 Ų65.434%0.3435%0.345SS..Hα-helixtrans-58.5-45.5173.600000111.8R390 E391 A392 N398R390-G394 PolarHBondContact O-N 2.94Å; E391-G394 PolarHBondContact O-N 3.34Å; A392-G394 PolarHBondContact O-N 3.35Å; G394-N398 VanDerWaalsContact O-CG 3.23Å; G394-N398 PolarHBondContact O-N 2.59Å; G394-N398 VanDerWaalsContact O-N 3.16Å; G394-N398 PolarHBondContact O-ND2 2.89Å; G394-N398 PolarHBondContact O-OD1 3.22Å
395M90.4Very high87.7Confident30 Ų3066.3 Ų66.315%0.14836%0.358CS..Hα-helixtrans-67.9-45178-68.3-49.5-64.300112.7M366 Y376 L379 I380 Y383 E391 A392 M393 N397 N398 I399M366-M395 HydrophobicContact CE-CE 4.28Å; M366-M395 HydrophobicContact SD-CE 3.51Å; M366-M395 VanDerWaalsContact SD-CE 3.51Å; Y376-M395 HydrophobicContact CD1-CE 4.33Å; Y376-M395 HydrophobicContact CE1-CE 4.49Å; L379-M395 HydrophobicContact CD2-CE 3.82Å; L379-M395 HydrophobicContact CD2-CG 4.44Å; I380-M395 HydrophobicContact CG1-CB 4.17Å; Y383-M395 HydrophobicContact CD2-CG 4.3Å; Y383-M395 HydrophobicContact CE2-CG 3.76Å; E391-M395 WeakPolarHBondContact O-CG 3.45Å; E391-M395 PolarHBondContact O-N 2.74Å; A392-M395 PolarHBondContact O-N 2.87Å; M393-M395 VanDerWaalsContact C-N 3.33Å; M393-M395 PolarHBondContact O-N 3.46Å; M395-N397 VanDerWaalsContact C-N 3.28Å; M395-N397 PolarHBondContact O-N 2.81Å; M395-N398 WeakPolarHBondContact O-CA 3.09Å; M395-N398 WeakPolarHBondContact O-CB 3.5Å; M395-N398 PolarHBondContact O-N 3.15Å; M395-I399 WeakPolarHBondContact O-CG1 3.33Å; M395-I399 PolarHBondContact O-N 3.05Å
396A89.5Confident87.4Confident0 Ų065.6 Ų65.60%035%0.346CS..Hα-helixtrans-60.9-39.2179.400000111.7I380 A392 M393 N398 I399 Y400 L413 V416I380-A396 HydrophobicContact CD1-CB 3.96Å; A392-A396 WeakPolarHBondContact O-CB 3.36Å; A392-A396 PolarHBondContact O-N 3.42Å; M393-A396 PolarHBondContact O-N 3.31Å; A396-N398 VanDerWaalsContact C-N 3.33Å; A396-N398 PolarHBondContact O-N 3.48Å; A396-I399 PolarHBondContact O-N 2.94Å; A396-Y400 PolarHBondContact O-N 3.2Å; A396-Y400 VanDerWaalsContact O-N 3.07Å; A396-L413 VanDerWaalsContact C-CD2 3.46Å; A396-L413 HydrophobicContact CB-CD2 3.63Å; A396-L413 HydrophobicContact CB-CG 4.34Å; A396-L413 WeakPolarHBondContact O-CD2 3.39Å; A396-V416 HydrophobicContact CB-CG2 4.14Å
397N89.9Confident87.2Confident69 Ų6963.4 Ų63.437%0.36933%0.331SS..Hα-helixtrans-65-34172.8-77.3-50.3000113.1M393 M395 Y400 K401M393-N397 WeakPolarHBondContact O-CB 3.2Å; M393-N397 PolarHBondContact O-N 2.86Å; M393-N397 PolarHBondContact O-ND2 3.39Å; M395-N397 VanDerWaalsContact C-N 3.28Å; M395-N397 PolarHBondContact O-N 2.81Å; N397-Y400 PolarHBondContact O-N 2.94Å; N397-K401 WeakPolarHBondContact O-CG 3.46Å; N397-K401 PolarHBondContact O-N 3.05Å; N397-K401 VanDerWaalsContact O-N 3.08Å
398N87.8Confident87.2Confident75 Ų7557.5 Ų57.540%0.40130%0.298SS..Hα-helixtrans-67.6-38.8175.1-69-19.6000111.6G394 M395 A396 Y400 K401 T402G394-N398 VanDerWaalsContact O-CG 3.23Å; G394-N398 PolarHBondContact O-N 2.59Å; G394-N398 VanDerWaalsContact O-N 3.16Å; G394-N398 PolarHBondContact O-ND2 2.89Å; G394-N398 PolarHBondContact O-OD1 3.22Å; M395-N398 WeakPolarHBondContact O-CA 3.09Å; M395-N398 WeakPolarHBondContact O-CB 3.5Å; M395-N398 PolarHBondContact O-N 3.15Å; A396-N398 VanDerWaalsContact C-N 3.33Å; A396-N398 PolarHBondContact O-N 3.48Å; N398-Y400 VanDerWaalsContact C-N 3.35Å; N398-K401 PolarHBondContact O-N 3.31Å; N398-T402 WeakPolarHBondContact O-CG2 3.47Å; N398-T402 PolarHBondContact O-N 3.08Å; N398-T402 PolarHBondContact O-OG1 3.49Å
399I86.1Confident87.1Confident2 Ų257 Ų571%0.0129%0.292CS..Hα-helixtrans-61.5-46.9174.2-58.2162.5000110.1L373 Y376 I380 M395 A396 K401 T402 L403 T409 I412L373-I399 HydrophobicContact CD2-CG2 3.85Å; Y376-I399 HydrophobicContact CD1-CD1 3.96Å; Y376-I399 HydrophobicContact CD1-CG1 3.49Å; Y376-I399 VanDerWaalsContact CD1-CG1 3.49Å; Y376-I399 HydrophobicContact CD2-CG1 4.18Å; Y376-I399 HydrophobicContact CE1-CG1 4.03Å; Y376-I399 HydrophobicContact CG-CD1 3.73Å; Y376-I399 HydrophobicContact CG-CG1 3.57Å; I380-I399 HydrophobicContact CD1-CD1 3.6Å; M395-I399 WeakPolarHBondContact O-CG1 3.33Å; M395-I399 PolarHBondContact O-N 3.05Å; A396-I399 PolarHBondContact O-N 2.94Å; I399-K401 VanDerWaalsContact C-N 3.26Å; I399-K401 PolarHBondContact O-N 3.1Å; I399-T402 WeakPolarHBondContact CA-OG1 3.35Å; I399-T402 PolarHBondContact O-N 2.96Å; I399-T402 VanDerWaalsContact O-N 3.1Å; I399-T402 PolarHBondContact O-OG1 3.16Å; I399-L403 PolarHBondContact O-N 3.33Å; I399-T409 HydrophobicContact CG2-CG2 3.69Å; I399-I412 HydrophobicContact CD1-CG2 4.09Å
400Y87Confident87.1Confident98 Ų9854.3 Ų54.338%0.38428%0.279SS..Hα-helixtrans-60.3-36.9179.2-175.3-99.7000112.7A396 N397 N398 G404 A405 L410 L413A396-Y400 PolarHBondContact O-N 3.2Å; A396-Y400 VanDerWaalsContact O-N 3.07Å; N397-Y400 PolarHBondContact O-N 2.94Å; N398-Y400 VanDerWaalsContact C-N 3.35Å; Y400-G404 WeakPolarHBondContact O-CA 3.39Å; Y400-G404 PolarHBondContact O-N 3.41Å; Y400-A405 HydrophobicContact CE2-CB 3.85Å; Y400-L410 HydrophobicContact CD2-CD2 4.39Å; Y400-L410 HydrophobicContact CE2-CD2 3.84Å; Y400-L413 HydrophobicContact CD2-CD1 3.42Å; Y400-L413 VanDerWaalsContact CD2-CD1 3.42Å; Y400-L413 HydrophobicContact CE2-CD1 4.22Å; Y400-L413 HydrophobicContact CG-CD1 3.68Å
401K86.6Confident87.2Confident167 Ų16744.1 Ų44.173%0.72624%0.241SC*.Hα-helixtrans-70.2-33.8174.9-73.4175-178.5177.80113.4N397 N398 I399N397-K401 WeakPolarHBondContact O-CG 3.46Å; N397-K401 PolarHBondContact O-N 3.05Å; N397-K401 VanDerWaalsContact O-N 3.08Å; N398-K401 PolarHBondContact O-N 3.31Å; I399-K401 VanDerWaalsContact C-N 3.26Å; I399-K401 PolarHBondContact O-N 3.1Å
402T81.8Confident87.2Confident91 Ų9139.8 Ų39.856%0.55822%0.221SC*.Hα-helixtrans-86.6-46.5-173.846.80000112.6N398 I399N398-T402 WeakPolarHBondContact O-CG2 3.47Å; N398-T402 PolarHBondContact O-N 3.08Å; N398-T402 PolarHBondContact O-OG1 3.49Å; I399-T402 WeakPolarHBondContact CA-OG1 3.35Å; I399-T402 PolarHBondContact O-N 2.96Å; I399-T402 VanDerWaalsContact O-N 3.1Å; I399-T402 PolarHBondContact O-OG1 3.16Å
403L78Confident87.1Confident58 Ų5840.3 Ų40.330%0.30422%0.224SC..Hα-helixtrans-97.9-10.8-177.4-82.173.4000113.2L373 I399 T409L373-L403 HydrophobicContact CD1-CD2 4.38Å; L373-L403 HydrophobicContact CD2-CD2 3.47Å; L373-L403 VanDerWaalsContact CD2-CD2 3.47Å; L373-L403 HydrophobicContact CG-CD2 3.72Å; I399-L403 PolarHBondContact O-N 3.33Å; L403-T409 HydrophobicContact CB-CG2 3.94Å; L403-T409 HydrophobicContact CD2-CG2 4.45Å
404G82.8Confident87.2Confident28 Ų2838.2 Ų38.229%0.28921%0.214SC..  trans77.3-167.6-179.100000114Y400 N406 T409Y400-G404 WeakPolarHBondContact O-CA 3.39Å; Y400-G404 PolarHBondContact O-N 3.41Å; G404-N406 PolarHBondContact O-N 3.36Å; G404-T409 PolarHBondContact O-OG1 3.49Å
405A81.2Confident87.2Confident52 Ų5238.1 Ų38.143%0.4321%0.206SC..SBendtrans-84.685.2-177.300000111.4Y400 Q437Y400-A405 HydrophobicContact CE2-CB 3.85Å; A405-Q437 PolarHBondContact O-NE2 2.85Å; A405-Q437 PolarHBondContact O-OE1 2.91Å
406N84.5Confident87.2Confident46 Ų4636.7 Ų36.725%0.24620%0.199CC..  trans-110151.8171.8179.210.8000108.9G404 Q408 T409 L410 Q437G404-N406 PolarHBondContact O-N 3.36Å; N406-Q408 PolarHBondContact ND2-OE1 3.06Å; N406-Q408 PolarHBondContact O-N 3.45Å; N406-Q408 VanDerWaalsContact O-N 3.17Å; N406-T409 HydrophobicContact CB-CG2 4.37Å; N406-T409 PolarHBondContact N-OG1 3.35Å; N406-T409 PolarHBondContact O-N 3.32Å; N406-T409 PolarHBondContact O-OG1 2.81Å; N406-L410 WeakPolarHBondContact O-CB 3.4Å; N406-L410 WeakPolarHBondContact O-CG 3.44Å; N406-L410 PolarHBondContact O-N 2.88Å; N406-Q437 VanDerWaalsContact C-OE1 3.27Å
407A85.6Confident87.1Confident1 Ų137 Ų371%0.00820%0.201CC..Hα-helixtrans-50.8-43.4178.200000111.6L410 T411 A434 Q437 R438 Y441A407-L410 PolarHBondContact O-N 3.49Å; A407-T411 PolarHBondContact O-N 2.99Å; A407-T411 PolarHBondContact O-OG1 3.3Å; A407-A434 HydrophobicContact CB-CB 4.45Å; A407-Q437 HydrophobicContact CB-CB 4.39Å; A407-R438 HydrophobicContact CB-CB 3.88Å; A407-Y441 HydrophobicContact CB-CD1 4.45Å
408Q87Confident87.1Confident17 Ų1734 Ų348%0.07919%0.185CC..Hα-helixtrans-64.5-42.9178.7-58.4169.8-73.100113A250 L373 N406 T411 I412 Y441A250-Q408 PolarHBondContact O-OE1 3.1Å; L373-Q408 HydrophobicContact CD1-CB 3.63Å; L373-Q408 HydrophobicContact CD1-CG 4.22Å; N406-Q408 PolarHBondContact ND2-OE1 3.06Å; N406-Q408 PolarHBondContact O-N 3.45Å; N406-Q408 VanDerWaalsContact O-N 3.17Å; Q408-T411 PolarHBondContact O-N 3.02Å; Q408-I412 WeakPolarHBondContact O-CG1 3.44Å; Q408-I412 PolarHBondContact O-N 2.95Å; Q408-Y441 HydrophobicContact CG-CE1 4.4Å; Q408-Y441 HydrophobicContact CG-CE2 4.21Å
409T87.5Confident87.1Confident2 Ų235.1 Ų35.11%0.01219%0.188CC..Hα-helixtrans-70.7-37.8-179.958.40000111.5L373 I399 L403 G404 N406 I412 L413L373-T409 HydrophobicContact CD2-CG2 3.73Å; I399-T409 HydrophobicContact CG2-CG2 3.69Å; L403-T409 HydrophobicContact CB-CG2 3.94Å; L403-T409 HydrophobicContact CD2-CG2 4.45Å; G404-T409 PolarHBondContact O-OG1 3.49Å; N406-T409 HydrophobicContact CB-CG2 4.37Å; N406-T409 PolarHBondContact N-OG1 3.35Å; N406-T409 PolarHBondContact O-N 3.32Å; N406-T409 PolarHBondContact O-OG1 2.81Å; T409-I412 PolarHBondContact O-N 3.33Å; T409-L413 PolarHBondContact O-N 3.2Å
410L90.9Very high87Confident4 Ų437.4 Ų37.42%0.02120%0.2CC..Hα-helixtrans-63.3-41173.7-69.3171.7000111.6Y400 N406 A407 L413 A414 L430 K433 A434Y400-L410 HydrophobicContact CD2-CD2 4.39Å; Y400-L410 HydrophobicContact CE2-CD2 3.84Å; N406-L410 WeakPolarHBondContact O-CB 3.4Å; N406-L410 WeakPolarHBondContact O-CG 3.44Å; N406-L410 PolarHBondContact O-N 2.88Å; A407-L410 PolarHBondContact O-N 3.49Å; L410-L413 PolarHBondContact O-N 2.97Å; L410-A414 WeakPolarHBondContact O-CB 3.24Å; L410-A414 PolarHBondContact O-N 3.41Å; L410-L430 HydrophobicContact CD2-CD2 3.82Å; L410-K433 HydrophobicContact CD1-CB 4.11Å; L410-A434 HydrophobicContact CB-CB 3.88Å; L410-A434 HydrophobicContact CD1-CB 4.39Å
411T91.7Very high86.8Confident5 Ų537.4 Ų37.43%0.03121%0.212CC..Hα-helixtrans-65.6-42.2175.3-53.80000111.9A407 Q408 L413 A414 T415 L431 Y441 K443 A444A407-T411 PolarHBondContact O-N 2.99Å; A407-T411 PolarHBondContact O-OG1 3.3Å; Q408-T411 PolarHBondContact O-N 3.02Å; T411-L413 VanDerWaalsContact C-N 3.35Å; T411-L413 PolarHBondContact O-N 2.54Å; T411-A414 PolarHBondContact O-N 3.45Å; T411-T415 WeakPolarHBondContact O-CG2 3.37Å; T411-T415 PolarHBondContact O-N 3.38Å; T411-T415 PolarHBondContact O-OG1 2.72Å; T411-L431 HydrophobicContact CG2-CD2 4.33Å; T411-Y441 HydrophobicContact CG2-CE1 4.17Å; T411-Y441 VanDerWaalsContact OG1-CE1 3.31Å; T411-Y441 WeakPolarHBondContact OG1-CE1 3.47Å; T411-K443 HydrophobicContact CG2-CB 4.34Å; T411-A444 HydrophobicContact CG2-CB 4.29Å
412I89.8Confident86.8Confident15 Ų1535.6 Ų35.68%0.07722%0.215CC..Hα-helixtrans-63.5-40.5176.2-68.2166.6000111.3L373 I380 I399 Q408 T409 A414 T415 V416L373-I412 HydrophobicContact CD2-CD1 4.24Å; I380-I412 HydrophobicContact CD1-CG2 3.38Å; I399-I412 HydrophobicContact CD1-CG2 4.09Å; Q408-I412 WeakPolarHBondContact O-CG1 3.44Å; Q408-I412 PolarHBondContact O-N 2.95Å; T409-I412 PolarHBondContact O-N 3.33Å; I412-A414 VanDerWaalsContact C-N 3.34Å; I412-T415 VanDerWaalsContact C-OG1 3.32Å; I412-T415 WeakPolarHBondContact CA-OG1 3.35Å; I412-T415 PolarHBondContact O-N 2.88Å; I412-T415 PolarHBondContact O-OG1 3.41Å; I412-V416 WeakPolarHBondContact O-CG2 3.44Å; I412-V416 PolarHBondContact O-N 3.17Å
413L90.4Very high87Confident10 Ų1032 Ų325%0.05219%0.193CC..Hα-helixtrans-61.1-45.8172.4-80.7169.4000111.3A396 Y400 T409 L410 T411 T415 V416 C417 L430A396-L413 VanDerWaalsContact C-CD2 3.46Å; A396-L413 HydrophobicContact CB-CD2 3.63Å; A396-L413 HydrophobicContact CB-CG 4.34Å; A396-L413 WeakPolarHBondContact O-CD2 3.39Å; Y400-L413 HydrophobicContact CD2-CD1 3.42Å; Y400-L413 VanDerWaalsContact CD2-CD1 3.42Å; Y400-L413 HydrophobicContact CE2-CD1 4.22Å; Y400-L413 HydrophobicContact CG-CD1 3.68Å; T409-L413 PolarHBondContact O-N 3.2Å; L410-L413 PolarHBondContact O-N 2.97Å; T411-L413 VanDerWaalsContact C-N 3.35Å; T411-L413 PolarHBondContact O-N 2.54Å; L413-T415 VanDerWaalsContact C-N 3.35Å; L413-T415 PolarHBondContact O-N 2.88Å; L413-V416 PolarHBondContact O-N 3.01Å; L413-C417 PolarHBondContact O-N 3.48Å; L413-C417 PolarHBondContact O-SG 2.87Å; L413-L430 HydrophobicContact CB-CD1 4.04Å
414A91.3Very high87.5Confident0 Ų032.5 Ų32.50%019%0.194CC..Hα-helixtrans-62.5-41.2179.300000111.9L410 T411 I412 V416 C417 L418 A427 L430 L431L410-A414 WeakPolarHBondContact O-CB 3.24Å; L410-A414 PolarHBondContact O-N 3.41Å; T411-A414 PolarHBondContact O-N 3.45Å; I412-A414 VanDerWaalsContact C-N 3.34Å; A414-V416 VanDerWaalsContact C-N 3.28Å; A414-V416 PolarHBondContact O-N 3.15Å; A414-C417 CarbonylContact O-C 3.46Å; A414-C417 PolarHBondContact O-N 2.96Å; A414-C417 VanDerWaalsContact O-N 3.16Å; A414-L418 VanDerWaalsContact O-CG 3.3Å; A414-L418 WeakPolarHBondContact O-CG 3.3Å; A414-L418 PolarHBondContact O-N 3.35Å; A414-A427 HydrophobicContact CB-CB 4.44Å; A414-L430 HydrophobicContact CB-CB 4.06Å; A414-L431 HydrophobicContact CB-CD1 4.27Å; A414-L431 HydrophobicContact CB-CD2 3.7Å; A414-L431 HydrophobicContact CB-CG 3.6Å
415T90.6Very high87.7Confident30 Ų3039.2 Ų39.218%0.18422%0.218CC..Hα-helixtrans-59.1-39.817848.90000112.2T411 I412 L413 L418 K447T411-T415 WeakPolarHBondContact O-CG2 3.37Å; T411-T415 PolarHBondContact O-N 3.38Å; T411-T415 PolarHBondContact O-OG1 2.72Å; I412-T415 VanDerWaalsContact C-OG1 3.32Å; I412-T415 WeakPolarHBondContact CA-OG1 3.35Å; I412-T415 PolarHBondContact O-N 2.88Å; I412-T415 PolarHBondContact O-OG1 3.41Å; L413-T415 VanDerWaalsContact C-N 3.35Å; L413-T415 PolarHBondContact O-N 2.88Å; T415-L418 PolarHBondContact O-N 2.84Å; T415-K447 HydrophobicContact CG2-CD 3.69Å; T415-K447 HydrophobicContact CG2-CG 3.72Å
416V90.7Very high88.2Confident0 Ų043.5 Ų43.50%023%0.226CC..Hα-helixtrans-72.5-39.4177.2-172.90000111.1I380 L384 A392 M393 A396 I412 L413 A414 L418 E419I380-V416 HydrophobicContact CG2-CG2 3.42Å; I380-V416 VanDerWaalsContact CG2-CG2 3.42Å; L384-V416 HydrophobicContact CD2-CG1 4.3Å; A392-V416 HydrophobicContact CB-CG1 3.67Å; A392-V416 HydrophobicContact CB-CG2 4.33Å; M393-V416 HydrophobicContact CB-CG1 4.36Å; M393-V416 HydrophobicContact CG-CG1 3.54Å; M393-V416 HydrophobicContact SD-CB 3.75Å; M393-V416 HydrophobicContact SD-CG1 3.33Å; M393-V416 WeakPolarHBondContact SD-CG1 3.1Å; A396-V416 HydrophobicContact CB-CG2 4.14Å; I412-V416 WeakPolarHBondContact O-CG2 3.44Å; I412-V416 PolarHBondContact O-N 3.17Å; L413-V416 PolarHBondContact O-N 3.01Å; A414-V416 VanDerWaalsContact C-N 3.28Å; A414-V416 PolarHBondContact O-N 3.15Å; V416-L418 VanDerWaalsContact C-N 3.25Å; V416-L418 PolarHBondContact O-N 2.72Å; V416-E419 PolarHBondContact O-N 2.97Å
417C88.9Confident88.4Confident6 Ų641.3 Ų41.34%0.04122%0.215CC..Hα-helixtrans-64.6-26.9175.4-67.70000113.3L413 A414 E419 D420 T423 A427L413-C417 PolarHBondContact O-N 3.48Å; L413-C417 PolarHBondContact O-SG 2.87Å; A414-C417 CarbonylContact O-C 3.46Å; A414-C417 PolarHBondContact O-N 2.96Å; A414-C417 VanDerWaalsContact O-N 3.16Å; C417-E419 VanDerWaalsContact C-N 3.25Å; C417-E419 PolarHBondContact O-N 3.33Å; C417-D420 PolarHBondContact O-N 3.2Å; C417-T423 VanDerWaalsContact CA-OG1 3.32Å; C417-T423 WeakPolarHBondContact CA-OG1 3.19Å; C417-T423 WeakPolarHBondContact CB-OG1 3.29Å; C417-T423 PolarHBondContact O-OG1 3.38Å; C417-A427 HydrophobicContact CB-CB 3.74Å
418L88.4Confident88.7Confident8 Ų843.1 Ų43.14%0.04222%0.222CC..Hα-helixtrans-69-22.8177.3-76.7173.7000113.2A414 T415 V416 A427 K447 L451 R454A414-L418 VanDerWaalsContact O-CG 3.3Å; A414-L418 WeakPolarHBondContact O-CG 3.3Å; A414-L418 PolarHBondContact O-N 3.35Å; T415-L418 PolarHBondContact O-N 2.84Å; V416-L418 VanDerWaalsContact C-N 3.25Å; V416-L418 PolarHBondContact O-N 2.72Å; L418-A427 HydrophobicContact CD2-CB 3.76Å; L418-A427 HydrophobicContact CG-CB 3.87Å; L418-K447 HydrophobicContact CD1-CB 4.27Å; L418-K447 HydrophobicContact CD1-CD 4.25Å; L418-L451 HydrophobicContact CD2-CB 4.07Å; L418-L451 HydrophobicContact CD2-CD1 3.27Å; L418-L451 HydrophobicContact CD2-CG 4.22Å; L418-R454 PolarHBondContact O-NH1 3.43Å
419E87.4Confident89Confident97 Ų9744.5 Ų44.545%0.45324%0.237SC..Hα-helixtrans-81.1-19177.4-60.8-58.7152.400112.4L384 V416 C417L384-E419 HydrophobicContact CD1-CG 4.3Å; L384-E419 HydrophobicContact CD2-CB 4.37Å; L384-E419 HydrophobicContact CD2-CG 3.99Å; V416-E419 PolarHBondContact O-N 2.97Å; C417-E419 VanDerWaalsContact C-N 3.25Å; C417-E419 PolarHBondContact O-N 3.33Å
420D85.6Confident89.2Confident51 Ų5146 Ų4627%0.27325%0.245SC..SBendtrans-100.3113.8173.5-179.90.4000110.4I389 C417 V422 T423I389-D420 HydrophobicContact CG2-CB 4.42Å; C417-D420 PolarHBondContact O-N 3.2Å; D420-V422 PolarHBondContact O-N 3.18Å; D420-V422 VanDerWaalsContact O-N 3.09Å; D420-V422 PolarHBondContact OD1-N 3.26Å; D420-T423 WeakPolarHBondContact CB-OG1 3.29Å; D420-T423 PolarHBondContact O-N 3.44Å; D420-T423 PolarHBondContact O-OG1 2.9Å
421P82.1Confident89.3Confident98 Ų9845.9 Ų45.964%0.63624%0.244SC*.G310 helixtrans-53.7-31.5179.1-26.234.4000113.9T423P421-T423 VanDerWaalsContact C-N 3.25Å; P421-T423 PolarHBondContact O-N 3.07Å
422V85.9Confident89.4Confident129 Ų12948.6 Ų48.678%0.78226%0.259SS*.G310 helixtrans-71.7-22.8-178.1-1760000111.7D420D420-V422 PolarHBondContact O-N 3.18Å; D420-V422 VanDerWaalsContact O-N 3.09Å; D420-V422 PolarHBondContact OD1-N 3.26Å
423T87.8Confident89.6Confident16 Ų1654 Ų5410%0.09828%0.282CS..G310 helixtrans-108.512.2-173.264.10000115C417 D420 P421 E425 K426 A427C417-T423 VanDerWaalsContact CA-OG1 3.32Å; C417-T423 WeakPolarHBondContact CA-OG1 3.19Å; C417-T423 WeakPolarHBondContact CB-OG1 3.29Å; C417-T423 PolarHBondContact O-OG1 3.38Å; D420-T423 WeakPolarHBondContact CB-OG1 3.29Å; D420-T423 PolarHBondContact O-N 3.44Å; D420-T423 PolarHBondContact O-OG1 2.9Å; P421-T423 VanDerWaalsContact C-N 3.25Å; P421-T423 PolarHBondContact O-N 3.07Å; T423-E425 PolarHBondContact O-N 2.88Å; T423-K426 HydrophobicContact CG2-CD 4.43Å; T423-K426 WeakPolarHBondContact O-CB 3.5Å; T423-K426 PolarHBondContact O-N 3.39Å; T423-K426 VanDerWaalsContact O-N 3.12Å; T423-A427 PolarHBondContact O-N 3.5Å
424Q87.1Confident89.6Confident68 Ų6853.6 Ų53.632%0.31828%0.279SS..Hα-helixtrans-59.5-43.1-178.7-71.1179.5-10.100113.5K426 A427 K428 L451Q424-K426 VanDerWaalsContact C-N 3.28Å; Q424-K426 PolarHBondContact O-N 3.17Å; Q424-A427 WeakPolarHBondContact O-CA 3.46Å; Q424-A427 VanDerWaalsContact O-CB 3.31Å; Q424-A427 WeakPolarHBondContact O-CB 3.36Å; Q424-A427 PolarHBondContact O-N 2.68Å; Q424-K428 PolarHBondContact O-N 3.08Å; Q424-L451 HydrophobicContact CB-CD1 4.43Å
425E87.7Confident89.7Confident169 Ų16954.4 Ų54.479%0.7928%0.284SS*.Hα-helixtrans-61.6-37.9176.4-67.4-170.9163.900112.2T423 A427 K428 A429T423-E425 PolarHBondContact O-N 2.88Å; E425-A427 VanDerWaalsContact C-N 3.33Å; E425-K428 PolarHBondContact O-N 3.35Å; E425-A429 PolarHBondContact O-N 2.86Å; E425-A429 VanDerWaalsContact O-N 3.14Å
426K90.4Very high89.7Confident141 Ų14156.9 Ų56.961%0.61331%0.307SS*.Hα-helixtrans-65.6-39.2174.8-64.6178.5-178.5170.50110.8T423 Q424 K428 A429 L430T423-K426 HydrophobicContact CG2-CD 4.43Å; T423-K426 WeakPolarHBondContact O-CB 3.5Å; T423-K426 PolarHBondContact O-N 3.39Å; T423-K426 VanDerWaalsContact O-N 3.12Å; Q424-K426 VanDerWaalsContact C-N 3.28Å; Q424-K426 PolarHBondContact O-N 3.17Å; K426-K428 VanDerWaalsContact C-N 3.35Å; K426-A429 PolarHBondContact O-N 2.95Å; K426-L430 VanDerWaalsContact O-CG 3.26Å; K426-L430 WeakPolarHBondContact O-CG 3.36Å; K426-L430 PolarHBondContact O-N 3.38Å
427A90.6Very high89.6Confident0 Ų061.6 Ų61.60%033%0.329CS..Hα-helixtrans-60.6-44.1175.800000111.5A414 C417 L418 T423 Q424 E425 L430 L431A414-A427 HydrophobicContact CB-CB 4.44Å; C417-A427 HydrophobicContact CB-CB 3.74Å; L418-A427 HydrophobicContact CD2-CB 3.76Å; L418-A427 HydrophobicContact CG-CB 3.87Å; T423-A427 PolarHBondContact O-N 3.5Å; Q424-A427 WeakPolarHBondContact O-CA 3.46Å; Q424-A427 VanDerWaalsContact O-CB 3.31Å; Q424-A427 WeakPolarHBondContact O-CB 3.36Å; Q424-A427 PolarHBondContact O-N 2.68Å; E425-A427 VanDerWaalsContact C-N 3.33Å; A427-L430 PolarHBondContact O-N 3.48Å; A427-L431 WeakPolarHBondContact O-CG 3.35Å; A427-L431 PolarHBondContact O-N 2.92Å
428K90.6Very high89.5Confident39 Ų3964.1 Ų64.117%0.1734%0.338CS..Hα-helixtrans-57.8-50.7175.9-164.6171.6-171.7166.40111.8Q424 E425 K426 L430 L431 D432 L451 E455 E460Q424-K428 PolarHBondContact O-N 3.08Å; E425-K428 PolarHBondContact O-N 3.35Å; K426-K428 VanDerWaalsContact C-N 3.35Å; K428-L430 VanDerWaalsContact C-N 3.28Å; K428-L430 PolarHBondContact O-N 2.87Å; K428-L431 PolarHBondContact O-N 2.86Å; K428-L431 VanDerWaalsContact O-N 3.16Å; K428-D432 PolarHBondContact O-N 3.49Å; K428-L451 HydrophobicContact CB-CD2 3.67Å; K428-L451 HydrophobicContact CD-CD2 3.85Å; K428-L451 HydrophobicContact CG-CD2 3.65Å; K428-E455 IonicContact NZ-OE1 2.7Å; K428-E455 IonicContact NZ-OE2 3.37Å; K428-E455 PolarHBondContact NZ-OE2 3.47Å; K428-E455 VanDerWaalsContact NZ-OE2 3.08Å; K428-E460 IonicContact NZ-OE2 3.04Å
429A92.9Very high89.3Confident47 Ų4767.4 Ų67.439%0.38836%0.36SS..Hα-helixtrans-62-33.2178.200000113.3E425 K426 K433E425-A429 PolarHBondContact O-N 2.86Å; E425-A429 VanDerWaalsContact O-N 3.14Å; K426-A429 PolarHBondContact O-N 2.95Å; A429-K433 VanDerWaalsContact O-CG 3.3Å; A429-K433 WeakPolarHBondContact O-CG 3.35Å; A429-K433 PolarHBondContact O-N 3.26Å; A429-K433 VanDerWaalsContact O-N 3.17Å
430L93.4Very high89.1Confident34 Ų3465.9 Ų65.918%0.17836%0.355CS..Hα-helixtrans-71.4-40.6175-72.1170.4000112.1L410 L413 A414 K426 A427 K428 K433 A434L410-L430 HydrophobicContact CD2-CD2 3.82Å; L413-L430 HydrophobicContact CB-CD1 4.04Å; A414-L430 HydrophobicContact CB-CB 4.06Å; K426-L430 VanDerWaalsContact O-CG 3.26Å; K426-L430 WeakPolarHBondContact O-CG 3.36Å; K426-L430 PolarHBondContact O-N 3.38Å; A427-L430 PolarHBondContact O-N 3.48Å; K428-L430 VanDerWaalsContact C-N 3.28Å; K428-L430 PolarHBondContact O-N 2.87Å; L430-K433 PolarHBondContact O-N 2.85Å; L430-A434 PolarHBondContact O-N 3.26Å
431L93.1Very high89.2Confident0 Ų064.7 Ų64.70%035%0.347CS..Hα-helixtrans-65.8-40175.6-70167.4000111.6T411 A414 A427 K428 K433 A434 L435 A444 K447 K448T411-L431 HydrophobicContact CG2-CD2 4.33Å; A414-L431 HydrophobicContact CB-CD1 4.27Å; A414-L431 HydrophobicContact CB-CD2 3.7Å; A414-L431 HydrophobicContact CB-CG 3.6Å; A427-L431 WeakPolarHBondContact O-CG 3.35Å; A427-L431 PolarHBondContact O-N 2.92Å; K428-L431 PolarHBondContact O-N 2.86Å; K428-L431 VanDerWaalsContact O-N 3.16Å; L431-K433 VanDerWaalsContact C-N 3.33Å; L431-K433 PolarHBondContact O-N 3.14Å; L431-A434 WeakPolarHBondContact O-CB 3.48Å; L431-A434 PolarHBondContact O-N 3.04Å; L431-A434 VanDerWaalsContact O-N 3.16Å; L431-L435 WeakPolarHBondContact O-CG 3.4Å; L431-L435 PolarHBondContact O-N 3.11Å; L431-A444 HydrophobicContact CD2-CB 4.32Å; L431-K447 HydrophobicContact CD1-CB 4.33Å; L431-K447 HydrophobicContact CD2-CB 4.01Å; L431-K448 HydrophobicContact CB-CB 4.33Å; L431-K448 HydrophobicContact CD1-CB 4.05Å
432D92.8Very high89.4Confident63 Ų6361.8 Ų61.834%0.33733%0.327SS..Hα-helixtrans-61.8-41.9174.5-70-27.9000111.6K428 L435 A436 K448K428-D432 PolarHBondContact O-N 3.49Å; D432-L435 PolarHBondContact O-N 2.81Å; D432-A436 VanDerWaalsContact O-CB 3.29Å; D432-A436 WeakPolarHBondContact O-CB 3.47Å; D432-A436 PolarHBondContact O-N 3.23Å; D432-K448 VanDerWaalsContact OD1-CE 3.28Å; D432-K448 WeakPolarHBondContact OD1-CE 3.36Å; D432-K448 IonicContact OD1-NZ 3.97Å; D432-K448 PolarHBondContact OD1-NZ 3.19Å
433K93.2Very high89.6Confident129 Ų12959.7 Ų59.756%0.56131%0.307SS*.Hα-helixtrans-64.2-39173-73.8173.9-177.4179.90112.4L410 A429 L430 L431 A436 Q437L410-K433 HydrophobicContact CD1-CB 4.11Å; A429-K433 VanDerWaalsContact O-CG 3.3Å; A429-K433 WeakPolarHBondContact O-CG 3.35Å; A429-K433 PolarHBondContact O-N 3.26Å; A429-K433 VanDerWaalsContact O-N 3.17Å; L430-K433 PolarHBondContact O-N 2.85Å; L431-K433 VanDerWaalsContact C-N 3.33Å; L431-K433 PolarHBondContact O-N 3.14Å; K433-A436 PolarHBondContact O-N 3.44Å; K433-Q437 WeakPolarHBondContact O-CG 3.32Å; K433-Q437 PolarHBondContact O-N 3.23Å
434A92.4Very high89.7Confident0 Ų058.9 Ų58.90%030%0.303CS..Hα-helixtrans-64.2-45.4177.500000111.3A407 L410 L430 L431 Q437 R438 A444A407-A434 HydrophobicContact CB-CB 4.45Å; L410-A434 HydrophobicContact CB-CB 3.88Å; L410-A434 HydrophobicContact CD1-CB 4.39Å; L430-A434 PolarHBondContact O-N 3.26Å; L431-A434 WeakPolarHBondContact O-CB 3.48Å; L431-A434 PolarHBondContact O-N 3.04Å; L431-A434 VanDerWaalsContact O-N 3.16Å; A434-Q437 PolarHBondContact O-N 3.07Å; A434-R438 PolarHBondContact O-N 3.43Å; A434-A444 HydrophobicContact CB-CB 4.35Å
435L91.4Very high90Very high18 Ų1855.8 Ų55.89%0.09429%0.288CS..Hα-helixtrans-71.4-29.7178.1-67.1172.6000112.7L431 D432 Q437 R438 P439 A444 V445 K448 L464L431-L435 WeakPolarHBondContact O-CG 3.4Å; L431-L435 PolarHBondContact O-N 3.11Å; D432-L435 PolarHBondContact O-N 2.81Å; L435-Q437 VanDerWaalsContact C-N 3.26Å; L435-Q437 PolarHBondContact O-N 2.92Å; L435-R438 CarbonylContact O-C 3.43Å; L435-R438 VanDerWaalsContact O-C 3.28Å; L435-P439 WeakPolarHBondContact O-CA 3.28Å; L435-P439 WeakPolarHBondContact O-CD 3.25Å; L435-P439 WeakPolarHBondContact O-CG 3.48Å; L435-A444 HydrophobicContact CD2-CB 3.72Å; L435-A444 HydrophobicContact CG-CB 4.07Å; L435-V445 HydrophobicContact CD2-CG2 3.61Å; L435-K448 HydrophobicContact CD1-CB 4.46Å; L435-K448 HydrophobicContact CD1-CD 3.56Å; L435-L464 HydrophobicContact CD1-CD1 4.05Å
436A91.5Very high90.3Very high82 Ų8248.8 Ų48.868%0.67826%0.257SS*.Hα-helixtrans-65.7-30.2170.900000112.4D432 K433D432-A436 VanDerWaalsContact O-CB 3.29Å; D432-A436 WeakPolarHBondContact O-CB 3.47Å; D432-A436 PolarHBondContact O-N 3.23Å; K433-A436 PolarHBondContact O-N 3.44Å
437Q89.2Confident90.4Very high98 Ų9844.8 Ų44.846%0.45824%0.239SC..Hα-helixtrans-80-44.1173.8-70.2-174.6-3.300112.4A405 N406 A407 K433 A434 L435A405-Q437 PolarHBondContact O-NE2 2.85Å; A405-Q437 PolarHBondContact O-OE1 2.91Å; N406-Q437 VanDerWaalsContact C-OE1 3.27Å; A407-Q437 HydrophobicContact CB-CB 4.39Å; K433-Q437 WeakPolarHBondContact O-CG 3.32Å; K433-Q437 PolarHBondContact O-N 3.23Å; A434-Q437 PolarHBondContact O-N 3.07Å; L435-Q437 VanDerWaalsContact C-N 3.26Å; L435-Q437 PolarHBondContact O-N 2.92Å
438R85.4Confident90.5Very high59 Ų5946.4 Ų46.422%0.22325%0.246CC..  trans-138.292.3-178.8-171.5-179.1-80.4161.1-7.4109.3A250 A407 A434 L435 D440 Y441A250-R438 PolarHBondContact O-NH1 3.41Å; A250-R438 PolarHBondContact O-NH2 3.43Å; A250-R438 VanDerWaalsContact O-NH2 3.12Å; A407-R438 HydrophobicContact CB-CB 3.88Å; A434-R438 PolarHBondContact O-N 3.43Å; L435-R438 CarbonylContact O-C 3.43Å; L435-R438 VanDerWaalsContact O-C 3.28Å; R438-D440 WeakPolarHBondContact CG-OD1 3.36Å; R438-D440 PolarHBondContact O-N 3.39Å; R438-Y441 PolarHBondContact O-N 2.93Å
439P85.8Confident90.6Very high78 Ų7844.5 Ų44.551%0.50624%0.238SC..THydrogen-bonded Turntrans-62-26.8-177-2534.6000113.8L435L435-P439 WeakPolarHBondContact O-CA 3.28Å; L435-P439 WeakPolarHBondContact O-CD 3.25Å; L435-P439 WeakPolarHBondContact O-CG 3.48Å
440D81.8Confident90.6Very high64 Ų6445.2 Ų45.234%0.34223%0.233SC..THydrogen-bonded Turntrans-96.117.5-174.967.2-42.8000112.9R438 T442 Q472R438-D440 WeakPolarHBondContact CG-OD1 3.36Å; R438-D440 PolarHBondContact O-N 3.39Å; D440-T442 PolarHBondContact O-N 2.72Å; D440-Q472 HydrophobicContact CB-CG 4.41Å; D440-Q472 VanDerWaalsContact O-CD 3.28Å; D440-Q472 PolarHBondContact O-NE2 2.99Å; D440-Q472 PolarHBondContact O-OE1 3.43Å; D440-Q472 VanDerWaalsContact O-OE1 3.05Å; D440-Q472 PolarHBondContact OD2-NE2 3.01Å
441Y87.8Confident90.5Very high27 Ų2743.7 Ų43.711%0.10623%0.225CC..  trans-84.498.8179.5-170.5-133000112.3A407 Q408 T411 R438 K443 A444 V445A407-Y441 HydrophobicContact CB-CD1 4.45Å; Q408-Y441 HydrophobicContact CG-CE1 4.4Å; Q408-Y441 HydrophobicContact CG-CE2 4.21Å; T411-Y441 HydrophobicContact CG2-CE1 4.17Å; T411-Y441 VanDerWaalsContact OG1-CE1 3.31Å; T411-Y441 WeakPolarHBondContact OG1-CE1 3.47Å; R438-Y441 PolarHBondContact O-N 2.93Å; Y441-K443 VanDerWaalsContact C-N 3.34Å; Y441-K443 HydrophobicContact CE1-CB 3.92Å; Y441-K443 HydrophobicContact CE2-CB 4.34Å; Y441-K443 PolarHBondContact O-N 3.17Å; Y441-A444 HydrophobicContact CD1-CB 3.61Å; Y441-A444 HydrophobicContact CE1-CB 4.36Å; Y441-A444 HydrophobicContact CG-CB 4.41Å; Y441-A444 PolarHBondContact O-N 3.08Å; Y441-V445 PolarHBondContact O-N 3.12Å; Y441-V445 VanDerWaalsContact O-N 3.12Å
442T87.4Confident90.4Very high37 Ų3743.7 Ų43.723%0.22723%0.226CC..Hα-helixtrans-49.3-47.3-175.3-34.30000113.4D440 A444 V445 V446 Q472 D474 L477D440-T442 PolarHBondContact O-N 2.72Å; T442-A444 VanDerWaalsContact C-N 3.32Å; T442-A444 PolarHBondContact O-N 3.3Å; T442-V445 PolarHBondContact O-N 3.46Å; T442-V446 HydrophobicContact CG2-CG2 4.45Å; T442-V446 WeakPolarHBondContact O-CG2 3.42Å; T442-V446 PolarHBondContact O-N 2.98Å; T442-Q472 PolarHBondContact OG1-OE1 3.34Å; T442-D474 HydrophobicContact CG2-CB 4.48Å; T442-L477 HydrophobicContact CG2-CD1 4.09Å; T442-L477 HydrophobicContact CG2-CD2 4.11Å; T442-L477 HydrophobicContact CG2-CG 3.97Å
443K88.9Confident90.3Very high84 Ų8444.2 Ų44.237%0.36523%0.228SC..Hα-helixtrans-61.2-37.5-179.5-68.6-167.3179.8-173.60112.7E377 T411 Y441 K447E377-K443 VanDerWaalsContact CD-NZ 3.3Å; E377-K443 IonicContact OE1-NZ 3.99Å; E377-K443 PolarHBondContact OE1-NZ 3.3Å; E377-K443 IonicContact OE2-NZ 3.99Å; E377-K443 PolarHBondContact OE2-NZ 3.43Å; T411-K443 HydrophobicContact CG2-CB 4.34Å; Y441-K443 VanDerWaalsContact C-N 3.34Å; Y441-K443 HydrophobicContact CE1-CB 3.92Å; Y441-K443 HydrophobicContact CE2-CB 4.34Å; Y441-K443 PolarHBondContact O-N 3.17Å; K443-K447 WeakPolarHBondContact O-CB 3.29Å; K443-K447 VanDerWaalsContact O-CG 3.27Å; K443-K447 WeakPolarHBondContact O-CG 3.23Å; K443-K447 PolarHBondContact O-N 3.15Å; K443-K447 VanDerWaalsContact O-N 3.13Å
444A91.1Very high90.1Very high0 Ų044.7 Ų44.70%023%0.226CC..Hα-helixtrans-71.9-40.3176.900000111.9T411 L431 A434 L435 Y441 T442 K447 K448T411-A444 HydrophobicContact CG2-CB 4.29Å; L431-A444 HydrophobicContact CD2-CB 4.32Å; A434-A444 HydrophobicContact CB-CB 4.35Å; L435-A444 HydrophobicContact CD2-CB 3.72Å; L435-A444 HydrophobicContact CG-CB 4.07Å; Y441-A444 HydrophobicContact CD1-CB 3.61Å; Y441-A444 HydrophobicContact CE1-CB 4.36Å; Y441-A444 HydrophobicContact CG-CB 4.41Å; Y441-A444 PolarHBondContact O-N 3.08Å; T442-A444 VanDerWaalsContact C-N 3.32Å; T442-A444 PolarHBondContact O-N 3.3Å; A444-K447 PolarHBondContact O-N 2.96Å; A444-K448 WeakPolarHBondContact O-CB 3.48Å; A444-K448 PolarHBondContact O-N 3.42Å
445V92.9Very high90Very high3 Ų347.6 Ų47.62%0.01824%0.24CC..Hα-helixtrans-60.5-50.2176.3177.10000110.2L435 Y441 T442 K447 K448 A449 L464 L465 A468 L477L435-V445 HydrophobicContact CD2-CG2 3.61Å; Y441-V445 PolarHBondContact O-N 3.12Å; Y441-V445 VanDerWaalsContact O-N 3.12Å; T442-V445 PolarHBondContact O-N 3.46Å; V445-K447 VanDerWaalsContact C-N 3.34Å; V445-K447 PolarHBondContact O-N 2.58Å; V445-K448 PolarHBondContact O-N 3Å; V445-A449 WeakPolarHBondContact O-CB 3.33Å; V445-A449 PolarHBondContact O-N 3.34Å; V445-L464 HydrophobicContact CG1-CD2 4.5Å; V445-L464 HydrophobicContact CG1-CG 4.38Å; V445-L465 HydrophobicContact CG1-CD2 3.93Å; V445-A468 HydrophobicContact CB-CB 4.46Å; V445-A468 HydrophobicContact CG1-CB 3.78Å; V445-A468 HydrophobicContact CG2-CB 3.98Å; V445-L477 HydrophobicContact CB-CD2 4.26Å; V445-L477 HydrophobicContact CG1-CD2 3.79Å
446V92.9Very high90.1Very high21 Ų2153.5 Ų53.513%0.12727%0.267CS..Hα-helixtrans-55.9-48.1176.9168.70000110.8T442 K448 A449 E450 V476 L477 M480T442-V446 HydrophobicContact CG2-CG2 4.45Å; T442-V446 WeakPolarHBondContact O-CG2 3.42Å; T442-V446 PolarHBondContact O-N 2.98Å; V446-K448 PolarHBondContact O-N 3.44Å; V446-A449 PolarHBondContact O-N 3.44Å; V446-E450 WeakPolarHBondContact O-CG 3.48Å; V446-E450 PolarHBondContact O-N 3.47Å; V446-V476 HydrophobicContact CG2-CG1 4.09Å; V446-L477 HydrophobicContact CG2-CD2 3.78Å; V446-M480 HydrophobicContact CB-SD 4.11Å; V446-M480 HydrophobicContact CG1-CE 4.43Å; V446-M480 HydrophobicContact CG1-SD 3.81Å; V446-M480 HydrophobicContact CG2-SD 3.92Å
447K93.2Very high90.2Very high57 Ų5753.6 Ų53.625%0.24825%0.253CS..Hα-helixtrans-67.7-33.5-179.6-69.1-66.7166.9-160.20113.8T415 L418 L431 K443 A444 V445 E450 L451T415-K447 HydrophobicContact CG2-CD 3.69Å; T415-K447 HydrophobicContact CG2-CG 3.72Å; L418-K447 HydrophobicContact CD1-CB 4.27Å; L418-K447 HydrophobicContact CD1-CD 4.25Å; L431-K447 HydrophobicContact CD1-CB 4.33Å; L431-K447 HydrophobicContact CD2-CB 4.01Å; K443-K447 WeakPolarHBondContact O-CB 3.29Å; K443-K447 VanDerWaalsContact O-CG 3.27Å; K443-K447 WeakPolarHBondContact O-CG 3.23Å; K443-K447 PolarHBondContact O-N 3.15Å; K443-K447 VanDerWaalsContact O-N 3.13Å; A444-K447 PolarHBondContact O-N 2.96Å; V445-K447 VanDerWaalsContact C-N 3.34Å; V445-K447 PolarHBondContact O-N 2.58Å; K447-E450 WeakPolarHBondContact CD-OE2 3.25Å; K447-E450 IonicContact NZ-OE1 3.29Å; K447-E450 PolarHBondContact NZ-OE1 3.04Å; K447-E450 IonicContact NZ-OE2 3.04Å; K447-E450 PolarHBondContact NZ-OE2 3.49Å; K447-L451 PolarHBondContact O-N 2.98Å; K447-L451 VanDerWaalsContact O-N 3.16Å
448K93.1Very high90.4Very high34 Ų3451.9 Ų51.915%0.14824%0.242CC..Hα-helixtrans-71.8-39.2173.9-174174.8170.21790111.5L431 D432 L435 A444 V445 V446 L451 L452 L464L431-K448 HydrophobicContact CB-CB 4.33Å; L431-K448 HydrophobicContact CD1-CB 4.05Å; D432-K448 VanDerWaalsContact OD1-CE 3.28Å; D432-K448 WeakPolarHBondContact OD1-CE 3.36Å; D432-K448 IonicContact OD1-NZ 3.97Å; D432-K448 PolarHBondContact OD1-NZ 3.19Å; L435-K448 HydrophobicContact CD1-CB 4.46Å; L435-K448 HydrophobicContact CD1-CD 3.56Å; A444-K448 WeakPolarHBondContact O-CB 3.48Å; A444-K448 PolarHBondContact O-N 3.42Å; V445-K448 PolarHBondContact O-N 3Å; V446-K448 PolarHBondContact O-N 3.44Å; K448-L451 WeakPolarHBondContact O-CB 3.36Å; K448-L451 PolarHBondContact O-N 3.26Å; K448-L452 HydrophobicContact CG-CD1 4.28Å; K448-L452 WeakPolarHBondContact O-CG 3.24Å; K448-L452 PolarHBondContact O-N 3.11Å; K448-L464 HydrophobicContact CB-CD2 3.87Å; K448-L464 HydrophobicContact CD-CD1 4.19Å; K448-L464 HydrophobicContact CD-CD2 3.64Å; K448-L464 HydrophobicContact CG-CD2 3.66Å
449A92.6Very high90.7Very high0 Ų055.2 Ų55.20%026%0.26CS..Hα-helixtrans-65.2-41.4173.900000111.4V445 V446 L451 L452 N453 L465 M480 F484V445-A449 WeakPolarHBondContact O-CB 3.33Å; V445-A449 PolarHBondContact O-N 3.34Å; V446-A449 PolarHBondContact O-N 3.44Å; A449-L451 VanDerWaalsContact C-N 3.31Å; A449-L451 PolarHBondContact O-N 2.86Å; A449-L452 PolarHBondContact O-N 3.35Å; A449-N453 WeakPolarHBondContact O-CB 3.37Å; A449-N453 PolarHBondContact O-N 3.32Å; A449-L465 HydrophobicContact CB-CD1 4.37Å; A449-L465 HydrophobicContact CB-CD2 4.2Å; A449-L465 HydrophobicContact CB-CG 4.37Å; A449-M480 HydrophobicContact CB-CE 3.42Å; A449-M480 VanDerWaalsContact CB-CE 3.42Å; A449-M480 HydrophobicContact CB-SD 4.45Å; A449-F484 HydrophobicContact CB-CE2 4.15Å; A449-F484 HydrophobicContact CB-CZ 4.32Å; A449-F484 VanDerWaalsContact O-CZ 3.27Å; A449-F484 WeakPolarHBondContact O-CZ 3.12Å
450E92.1Very high91.1Very high61 Ų6156.5 Ų56.529%0.28526%0.259SS..Hα-helixtrans-57-42.3171.8-75.7174.3-165.800112.2V446 K447 R454 M480V446-E450 WeakPolarHBondContact O-CG 3.48Å; V446-E450 PolarHBondContact O-N 3.47Å; K447-E450 WeakPolarHBondContact CD-OE2 3.25Å; K447-E450 IonicContact NZ-OE1 3.29Å; K447-E450 PolarHBondContact NZ-OE1 3.04Å; K447-E450 IonicContact NZ-OE2 3.04Å; K447-E450 PolarHBondContact NZ-OE2 3.49Å; E450-R454 WeakPolarHBondContact O-CG 3.34Å; E450-R454 PolarHBondContact O-N 2.88Å; E450-R454 VanDerWaalsContact O-N 3.15Å; E450-M480 HydrophobicContact CG-CE 4.07Å
451L91.4Very high91.6Very high2 Ų253.4 Ų53.41%0.0124%0.243CC..Hα-helixtrans-63.1-47.8174.5179.592.1000111.6L418 Q424 K428 K447 K448 A449 N453 R454 E455L418-L451 HydrophobicContact CD2-CB 4.07Å; L418-L451 HydrophobicContact CD2-CD1 3.27Å; L418-L451 HydrophobicContact CD2-CG 4.22Å; Q424-L451 HydrophobicContact CB-CD1 4.43Å; K428-L451 HydrophobicContact CB-CD2 3.67Å; K428-L451 HydrophobicContact CD-CD2 3.85Å; K428-L451 HydrophobicContact CG-CD2 3.65Å; K447-L451 PolarHBondContact O-N 2.98Å; K447-L451 VanDerWaalsContact O-N 3.16Å; K448-L451 WeakPolarHBondContact O-CB 3.36Å; K448-L451 PolarHBondContact O-N 3.26Å; A449-L451 VanDerWaalsContact C-N 3.31Å; A449-L451 PolarHBondContact O-N 2.86Å; L451-N453 VanDerWaalsContact C-N 3.28Å; L451-N453 PolarHBondContact O-N 2.99Å; L451-R454 WeakPolarHBondContact O-CB 3.46Å; L451-R454 PolarHBondContact O-N 3.29Å; L451-R454 VanDerWaalsContact O-N 3.13Å; L451-E455 PolarHBondContact O-N 3.44Å
452L92Very high91.9Very high1 Ų152.6 Ų52.61%0.00524%0.24CC..Hα-helixtrans-63.8-34.3-179.1-70.6170.5000112.3K448 A449 E455 Q456 K457 E460 L464 F484K448-L452 HydrophobicContact CG-CD1 4.28Å; K448-L452 WeakPolarHBondContact O-CG 3.24Å; K448-L452 PolarHBondContact O-N 3.11Å; A449-L452 PolarHBondContact O-N 3.35Å; L452-E455 CarbonylContact O-C 3.6Å; L452-E455 PolarHBondContact O-N 2.95Å; L452-Q456 PolarHBondContact O-N 3.14Å; L452-K457 HydrophobicContact CD2-CB 4.07Å; L452-K457 HydrophobicContact CD2-CD 4.45Å; L452-K457 PolarHBondContact O-N 3.26Å; L452-E460 HydrophobicContact CD1-CB 4.32Å; L452-E460 HydrophobicContact CD2-CB 4.2Å; L452-L464 HydrophobicContact CD1-CD2 4.08Å; L452-F484 HydrophobicContact CB-CE1 4.36Å; L452-F484 HydrophobicContact CB-CZ 4.26Å
453N90.9Very high92.2Very high73 Ų7353.7 Ų53.739%0.3925%0.253SS..Hα-helixtrans-63.4-45.3172.6-168.68.7000110.9A449 L451 E455 Q456 Y458 F484A449-N453 WeakPolarHBondContact O-CB 3.37Å; A449-N453 PolarHBondContact O-N 3.32Å; L451-N453 VanDerWaalsContact C-N 3.28Å; L451-N453 PolarHBondContact O-N 2.99Å; N453-E455 VanDerWaalsContact C-N 3.29Å; N453-E455 PolarHBondContact O-N 3.2Å; N453-Q456 PolarHBondContact O-N 2.99Å; N453-Y458 WeakPolarHBondContact OD1-CE1 3.21Å; N453-F484 HydrophobicContact CB-CE2 4.03Å; N453-F484 HydrophobicContact CB-CZ 3.74Å
454R89.4Confident92.3Very high139 Ų13951 Ų5153%0.52524%0.242SC..Hα-helixtrans-62.5-34174.2-68.4175.4-176.7-174.81.3112.9L418 E450 L451 Q456L418-R454 PolarHBondContact O-NH1 3.43Å; E450-R454 WeakPolarHBondContact O-CG 3.34Å; E450-R454 PolarHBondContact O-N 2.88Å; E450-R454 VanDerWaalsContact O-N 3.15Å; L451-R454 WeakPolarHBondContact O-CB 3.46Å; L451-R454 PolarHBondContact O-N 3.29Å; L451-R454 VanDerWaalsContact O-N 3.13Å; R454-Q456 VanDerWaalsContact C-N 3.29Å
455E90.3Very high92.4Very high61 Ų6151 Ų5129%0.28524%0.242SC..THydrogen-bonded Turntrans-79.7-4.8175-71-176-16900113.6K428 L451 L452 N453 K457K428-E455 IonicContact NZ-OE1 2.7Å; K428-E455 IonicContact NZ-OE2 3.37Å; K428-E455 PolarHBondContact NZ-OE2 3.47Å; K428-E455 VanDerWaalsContact NZ-OE2 3.08Å; L451-E455 PolarHBondContact O-N 3.44Å; L452-E455 CarbonylContact O-C 3.6Å; L452-E455 PolarHBondContact O-N 2.95Å; N453-E455 VanDerWaalsContact C-N 3.29Å; N453-E455 PolarHBondContact O-N 3.2Å; E455-K457 HydrophobicContact CB-CD 4.28Å; E455-K457 HydrophobicContact CB-CG 4.18Å; E455-K457 PolarHBondContact O-N 2.86Å; E455-K457 WeakPolarHBondContact OE2-CD 3.23Å; E455-K457 WeakPolarHBondContact OE2-CE 3.35Å; E455-K457 IonicContact OE2-NZ 3.46Å; E455-K457 PolarHBondContact OE2-NZ 3.16Å
456Q91.8Very high92.3Very high143 Ų14356.6 Ų56.667%0.66826%0.263SS*.THydrogen-bonded Turntrans56.626.3-173.3-56.2-179-6.600114.4L452 N453 R454 Y458L452-Q456 PolarHBondContact O-N 3.14Å; N453-Q456 PolarHBondContact O-N 2.99Å; R454-Q456 VanDerWaalsContact C-N 3.29Å; Q456-Y458 HydrophobicContact CB-CE2 3.98Å; Q456-Y458 WeakPolarHBondContact O-CD2 3.27Å; Q456-Y458 PolarHBondContact O-N 3.28Å
457K93.6Very high92.2Very high84 Ų8460.6 Ų60.637%0.36528%0.284SS..  trans-93.269.1177-68.7-179.9-172.5158.90110.2L452 E455 E459 E460 G461L452-K457 HydrophobicContact CD2-CB 4.07Å; L452-K457 HydrophobicContact CD2-CD 4.45Å; L452-K457 PolarHBondContact O-N 3.26Å; E455-K457 HydrophobicContact CB-CD 4.28Å; E455-K457 HydrophobicContact CB-CG 4.18Å; E455-K457 PolarHBondContact O-N 2.86Å; E455-K457 WeakPolarHBondContact OE2-CD 3.23Å; E455-K457 WeakPolarHBondContact OE2-CE 3.35Å; E455-K457 IonicContact OE2-NZ 3.46Å; E455-K457 PolarHBondContact OE2-NZ 3.16Å; K457-E459 PolarHBondContact O-N 3.43Å; K457-E460 HydrophobicContact CB-CB 4.42Å; K457-G461 PolarHBondContact O-N 3.01Å
458Y93.8Very high92Very high62 Ų6258.2 Ų58.224%0.24328%0.275CS..Hα-helixtrans-65-41.9-171.3-55.4-65.5000113.1N453 Q456 E460 G461 I462 F484 A487 V488N453-Y458 WeakPolarHBondContact OD1-CE1 3.21Å; Q456-Y458 HydrophobicContact CB-CE2 3.98Å; Q456-Y458 WeakPolarHBondContact O-CD2 3.27Å; Q456-Y458 PolarHBondContact O-N 3.28Å; Y458-E460 PolarHBondContact O-N 2.82Å; Y458-G461 CarbonylContact O-C 3.33Å; Y458-G461 WeakPolarHBondContact O-CA 3.43Å; Y458-G461 PolarHBondContact O-N 2.97Å; Y458-I462 WeakPolarHBondContact O-CG1 3.36Å; Y458-I462 PolarHBondContact O-N 2.93Å; Y458-F484 AromaticContact CD1-CD1 3.84Å; Y458-F484 HydrophobicContact CD1-CD1 3.84Å; Y458-F484 HydrophobicContact CD1-CE1 4.03Å; Y458-F484 HydrophobicContact CG-CD1 4.47Å; Y458-F484 WeakPolarHBondContact O-CD1 3.43Å; Y458-A487 HydrophobicContact CD1-CB 3.74Å; Y458-A487 HydrophobicContact CD2-CB 4.25Å; Y458-A487 HydrophobicContact CE1-CB 3.64Å; Y458-A487 HydrophobicContact CE2-CB 4.16Å; Y458-A487 HydrophobicContact CG-CB 4.05Å; Y458-V488 HydrophobicContact CG-CG2 4.4Å
459E93Very high91.8Very high128 Ų12858 Ų5860%0.59828%0.275SS*.Hα-helixtrans-60.4-44179.4-63.6-62.2166.200113.4K457 G461 I462 A463K457-E459 PolarHBondContact O-N 3.43Å; E459-G461 VanDerWaalsContact C-N 3.26Å; E459-G461 PolarHBondContact O-N 3.26Å; E459-I462 PolarHBondContact O-N 3.21Å; E459-A463 PolarHBondContact O-N 3.49Å
460E92.8Very high91.5Very high105 Ų10561.8 Ų61.849%0.49131%0.307SS..Hα-helixtrans-62.7-36.5174.7-70.9-177.7-160.100111.2K428 L452 K457 Y458 L464K428-E460 IonicContact NZ-OE2 3.04Å; L452-E460 HydrophobicContact CD1-CB 4.32Å; L452-E460 HydrophobicContact CD2-CB 4.2Å; K457-E460 HydrophobicContact CB-CB 4.42Å; Y458-E460 PolarHBondContact O-N 2.82Å; E460-L464 WeakPolarHBondContact O-CB 3.32Å; E460-L464 PolarHBondContact O-N 2.9Å
461G92.6Very high91.1Very high0 Ų064.1 Ų64.10%032%0.321CS..Hα-helixtrans-68.3-43.9177.600000112.9K457 Y458 E459 L464 L465K457-G461 PolarHBondContact O-N 3.01Å; Y458-G461 CarbonylContact O-C 3.33Å; Y458-G461 WeakPolarHBondContact O-CA 3.43Å; Y458-G461 PolarHBondContact O-N 2.97Å; E459-G461 VanDerWaalsContact C-N 3.26Å; E459-G461 PolarHBondContact O-N 3.26Å; G461-L464 WeakPolarHBondContact O-CB 3.39Å; G461-L464 PolarHBondContact O-N 2.85Å; G461-L465 WeakPolarHBondContact O-CB 3.25Å; G461-L465 WeakPolarHBondContact O-CG 3.38Å; G461-L465 PolarHBondContact O-N 2.97Å
462I94.3Very high90.3Very high9 Ų966.1 Ų66.15%0.04633%0.33CS..Hα-helixtrans-60.8-47.7175.6-69.1167.4000110.1Y458 E459 L464 L465 R466 L481 F484 L485 V488Y458-I462 WeakPolarHBondContact O-CG1 3.36Å; Y458-I462 PolarHBondContact O-N 2.93Å; E459-I462 PolarHBondContact O-N 3.21Å; I462-L464 VanDerWaalsContact C-N 3.32Å; I462-L464 PolarHBondContact O-N 3.02Å; I462-L465 PolarHBondContact O-N 3.45Å; I462-R466 HydrophobicContact CG2-CG 4.3Å; I462-R466 WeakPolarHBondContact O-CB 3.09Å; I462-R466 WeakPolarHBondContact O-CG 3.35Å; I462-R466 PolarHBondContact O-N 3.42Å; I462-L481 HydrophobicContact CB-CD1 4.34Å; I462-L481 HydrophobicContact CG1-CD1 4.25Å; I462-L481 HydrophobicContact CG2-CD1 4.04Å; I462-F484 HydrophobicContact CD1-CB 4.5Å; I462-F484 HydrophobicContact CG1-CB 3.86Å; I462-F484 HydrophobicContact CG1-CD1 4.43Å; I462-L485 HydrophobicContact CD1-CD2 3.99Å; I462-L485 HydrophobicContact CG1-CD2 4.5Å; I462-V488 HydrophobicContact CD1-CB 4.48Å; I462-V488 HydrophobicContact CD1-CG2 3.78Å
463A93.3Very high89.8Confident60 Ų6070 Ų7050%0.49636%0.357SS..Hα-helixtrans-60.6-41.5177.900000112.2E459 N467E459-A463 PolarHBondContact O-N 3.49Å; A463-N467 WeakPolarHBondContact O-CB 3.49Å; A463-N467 PolarHBondContact O-N 3.38Å; A463-N467 VanDerWaalsContact O-N 3.12Å
464L92.3Very high89.5Confident27 Ų2768.9 Ų68.914%0.14135%0.352CS..Hα-helixtrans-62.3-48.4175.6177.871.8000111.9L435 V445 K448 L452 E460 G461 I462 N467 A468L435-L464 HydrophobicContact CD1-CD1 4.05Å; V445-L464 HydrophobicContact CG1-CD2 4.5Å; V445-L464 HydrophobicContact CG1-CG 4.38Å; K448-L464 HydrophobicContact CB-CD2 3.87Å; K448-L464 HydrophobicContact CD-CD1 4.19Å; K448-L464 HydrophobicContact CD-CD2 3.64Å; K448-L464 HydrophobicContact CG-CD2 3.66Å; L452-L464 HydrophobicContact CD1-CD2 4.08Å; E460-L464 WeakPolarHBondContact O-CB 3.32Å; E460-L464 PolarHBondContact O-N 2.9Å; G461-L464 WeakPolarHBondContact O-CB 3.39Å; G461-L464 PolarHBondContact O-N 2.85Å; I462-L464 VanDerWaalsContact C-N 3.32Å; I462-L464 PolarHBondContact O-N 3.02Å; L464-N467 PolarHBondContact O-N 3.2Å; L464-A468 PolarHBondContact O-N 3.03Å
465L91.8Very high89.4Confident0 Ų063.2 Ų63.20%033%0.333CS..Hα-helixtrans-67.9-41.9-177.7-73.2168000111.6V445 A449 G461 I462 N467 A468 L469 L477 M480 L481 F484V445-L465 HydrophobicContact CG1-CD2 3.93Å; A449-L465 HydrophobicContact CB-CD1 4.37Å; A449-L465 HydrophobicContact CB-CD2 4.2Å; A449-L465 HydrophobicContact CB-CG 4.37Å; G461-L465 WeakPolarHBondContact O-CB 3.25Å; G461-L465 WeakPolarHBondContact O-CG 3.38Å; G461-L465 PolarHBondContact O-N 2.97Å; I462-L465 PolarHBondContact O-N 3.45Å; L465-N467 VanDerWaalsContact C-N 3.32Å; L465-N467 PolarHBondContact O-N 3.4Å; L465-A468 PolarHBondContact O-N 3.5Å; L465-L469 WeakPolarHBondContact O-CB 3.35Å; L465-L469 VanDerWaalsContact O-CG 3.31Å; L465-L469 WeakPolarHBondContact O-CG 3.36Å; L465-L469 PolarHBondContact O-N 3.23Å; L465-L477 HydrophobicContact CD2-CD2 3.97Å; L465-M480 HydrophobicContact CD1-CB 4.08Å; L465-M480 HydrophobicContact CD2-CB 4.31Å; L465-L481 HydrophobicContact CB-CB 4.34Å; L465-L481 HydrophobicContact CB-CD1 4.04Å; L465-L481 HydrophobicContact CD1-CB 4.22Å; L465-L481 HydrophobicContact CD1-CD1 4.41Å; L465-F484 HydrophobicContact CD1-CD2 3.97Å; L465-F484 HydrophobicContact CD1-CE2 4.27Å; L465-F484 HydrophobicContact CD1-CG 4.36Å
466R91.7Very high89.3Confident122 Ų12263.1 Ų63.146%0.4634%0.337SS..Hα-helixtrans-60.2-40.8174.2-74.8-177.5174.5-179.7-2.3111.9I462 L469 A470 L481 E493I462-R466 HydrophobicContact CG2-CG 4.3Å; I462-R466 WeakPolarHBondContact O-CB 3.09Å; I462-R466 WeakPolarHBondContact O-CG 3.35Å; I462-R466 PolarHBondContact O-N 3.42Å; R466-L469 PolarHBondContact O-N 2.78Å; R466-A470 PolarHBondContact O-N 3.48Å; R466-L481 HydrophobicContact CG-CD1 4.33Å; R466-L481 HydrophobicContact CG-CD2 4.24Å; R466-E493 IonicContact CZ-OE2 3.19Å; R466-E493 IonicContact NH2-OE1 3.55Å; R466-E493 PolarHBondContact NH2-OE1 2.92Å; R466-E493 IonicContact NH2-OE2 3.12Å; R466-E493 PolarHBondContact NH2-OE2 3.32Å
467N90.3Very high89.3Confident104 Ų10456.3 Ų56.356%0.55631%0.305SS*.Hα-helixtrans-65.8-40.3175.4-173.313.7000112.3A463 L464 L465 N471A463-N467 WeakPolarHBondContact O-CB 3.49Å; A463-N467 PolarHBondContact O-N 3.38Å; A463-N467 VanDerWaalsContact O-N 3.12Å; L464-N467 PolarHBondContact O-N 3.2Å; L465-N467 VanDerWaalsContact C-N 3.32Å; L465-N467 PolarHBondContact O-N 3.4Å; N467-N471 PolarHBondContact O-ND2 3.22Å
468A88.3Confident89.2Confident8 Ų853.2 Ų53.27%0.06629%0.292CS..Hα-helixtrans-65.1-45.4175.600000111.8V445 L464 L465 A470 N471 Q472 L477V445-A468 HydrophobicContact CB-CB 4.46Å; V445-A468 HydrophobicContact CG1-CB 3.78Å; V445-A468 HydrophobicContact CG2-CB 3.98Å; L464-A468 PolarHBondContact O-N 3.03Å; L465-A468 PolarHBondContact O-N 3.5Å; A468-A470 VanDerWaalsContact C-N 3.28Å; A468-A470 PolarHBondContact O-N 3.13Å; A468-N471 PolarHBondContact O-N 3.28Å; A468-N471 VanDerWaalsContact O-N 3.13Å; A468-Q472 PolarHBondContact O-N 3.48Å; A468-L477 HydrophobicContact CB-CD1 4.08Å
469L89.7Confident89.2Confident28 Ų2851.9 Ų51.915%0.14729%0.286CS..Hα-helixtrans-66.7-26.2-179.8-74.1171.4000113.5L465 R466 N471 Q472 L477 L481L465-L469 WeakPolarHBondContact O-CB 3.35Å; L465-L469 VanDerWaalsContact O-CG 3.31Å; L465-L469 WeakPolarHBondContact O-CG 3.36Å; L465-L469 PolarHBondContact O-N 3.23Å; R466-L469 PolarHBondContact O-N 2.78Å; L469-N471 PolarHBondContact O-N 3.16Å; L469-Q472 WeakPolarHBondContact CA-O 3.49Å; L469-L477 HydrophobicContact CD2-CB 3.57Å; L469-L477 HydrophobicContact CD2-CD1 4.27Å; L469-L477 HydrophobicContact CG-CB 4.08Å; L469-L481 HydrophobicContact CD1-CB 4.23Å; L469-L481 HydrophobicContact CD1-CD2 3.62Å
470A87.2Confident89.1Confident80 Ų8046.3 Ų46.366%0.66126%0.26SS*.Hα-helixtrans-61.2-27.6173.100000113R466 A468R466-A470 PolarHBondContact O-N 3.48Å; A468-A470 VanDerWaalsContact C-N 3.28Å; A468-A470 PolarHBondContact O-N 3.13Å
471N82.1Confident89.1Confident110 Ų11041.5 Ų41.559%0.58824%0.238SC*.Hα-helixtrans-103.5-32.2-179.3-64.7-51.6000113.1N467 A468 L469N467-N471 PolarHBondContact O-ND2 3.22Å; A468-N471 PolarHBondContact O-N 3.28Å; A468-N471 VanDerWaalsContact O-N 3.13Å; L469-N471 PolarHBondContact O-N 3.16Å
472Q75.9Confident89.1Confident44 Ų4441.5 Ų41.521%0.20624%0.238CC..  trans-139.9119-176.3-66.6-175.5-2.700111D440 T442 A468 L469D440-Q472 HydrophobicContact CB-CG 4.41Å; D440-Q472 VanDerWaalsContact O-CD 3.28Å; D440-Q472 PolarHBondContact O-NE2 2.99Å; D440-Q472 PolarHBondContact O-OE1 3.43Å; D440-Q472 VanDerWaalsContact O-OE1 3.05Å; D440-Q472 PolarHBondContact OD2-NE2 3.01Å; T442-Q472 PolarHBondContact OG1-OE1 3.34Å; A468-Q472 PolarHBondContact O-N 3.48Å; L469-Q472 WeakPolarHBondContact CA-O 3.49Å
473S80.6Confident89Confident82 Ų8243.7 Ų43.757%0.57325%0.25SC*.  trans-77.6121.2166.3590000109.5
474D84.9Confident89.1Confident50 Ų5041 Ų4127%0.26723%0.227SC..  trans-142.7135.5178.8-178-83000109.4T442 V476 L477 H478T442-D474 HydrophobicContact CG2-CB 4.48Å; D474-V476 VanDerWaalsContact C-N 3.3Å; D474-V476 PolarHBondContact O-N 3.24Å; D474-V476 WeakPolarHBondContact OD1-CA 3.37Å; D474-V476 VanDerWaalsContact OD1-CB 3.26Å; D474-V476 WeakPolarHBondContact OD1-CB 3.29Å; D474-V476 PolarHBondContact OD1-N 3.11Å; D474-L477 HydrophobicContact CB-CB 4.19Å; D474-L477 HydrophobicContact CB-CD1 4.06Å; D474-L477 HydrophobicContact CB-CG 3.95Å; D474-L477 PolarHBondContact O-N 3.49Å; D474-L477 PolarHBondContact OD1-N 3.32Å; D474-H478 PolarHBondContact O-CD2 3.46Å; D474-H478 VanDerWaalsContact O-CD2 3.23Å; D474-H478 PolarHBondContact O-N 3.05Å; D474-H478 VanDerWaalsContact O-N 3.07Å
475C86.1Confident89.1Confident20 Ų2039.9 Ų39.914%0.13522%0.221CC..Hα-helixtrans-58.3-42.1-177.5-178.10000112L477 H478 R479 A501 L504 D505C475-L477 PolarHBondContact O-N 2.82Å; C475-H478 PolarHBondContact O-N 3.33Å; C475-R479 WeakPolarHBondContact O-CB 3.3Å; C475-R479 PolarHBondContact O-N 3.03Å; C475-A501 PolarHBondContact SG-O 3.48Å; C475-A501 VanDerWaalsContact SG-O 3.36Å; C475-L504 HydrophobicContact CB-CB 4.15Å; C475-L504 HydrophobicContact CB-CD1 4.49Å; C475-D505 HydrophobicContact CB-CB 4.45Å
476V89.6Confident89.1Confident59 Ų5941.7 Ų41.736%0.35823%0.232SC..Hα-helixtrans-68.8-38.1-177.6-178.20000110.6V446 D474 M480V446-V476 HydrophobicContact CG2-CG1 4.09Å; D474-V476 VanDerWaalsContact C-N 3.3Å; D474-V476 PolarHBondContact O-N 3.24Å; D474-V476 WeakPolarHBondContact OD1-CA 3.37Å; D474-V476 VanDerWaalsContact OD1-CB 3.26Å; D474-V476 WeakPolarHBondContact OD1-CB 3.29Å; D474-V476 PolarHBondContact OD1-N 3.11Å; V476-M480 HydrophobicContact CG1-SD 4.38Å; V476-M480 VanDerWaalsContact O-CG 3.3Å; V476-M480 WeakPolarHBondContact O-CG 3.48Å; V476-M480 PolarHBondContact O-N 3.46Å
477L91.2Very high89.1Confident1 Ų137.8 Ų37.81%0.00523%0.226CC..Hα-helixtrans-67.7-42.1177.6-64.3-174.4000112.2T442 V445 V446 L465 A468 L469 D474 C475 M480 L481T442-L477 HydrophobicContact CG2-CD1 4.09Å; T442-L477 HydrophobicContact CG2-CD2 4.11Å; T442-L477 HydrophobicContact CG2-CG 3.97Å; V445-L477 HydrophobicContact CB-CD2 4.26Å; V445-L477 HydrophobicContact CG1-CD2 3.79Å; V446-L477 HydrophobicContact CG2-CD2 3.78Å; L465-L477 HydrophobicContact CD2-CD2 3.97Å; A468-L477 HydrophobicContact CB-CD1 4.08Å; L469-L477 HydrophobicContact CD2-CB 3.57Å; L469-L477 HydrophobicContact CD2-CD1 4.27Å; L469-L477 HydrophobicContact CG-CB 4.08Å; D474-L477 HydrophobicContact CB-CB 4.19Å; D474-L477 HydrophobicContact CB-CD1 4.06Å; D474-L477 HydrophobicContact CB-CG 3.95Å; D474-L477 PolarHBondContact O-N 3.49Å; D474-L477 PolarHBondContact OD1-N 3.32Å; C475-L477 PolarHBondContact O-N 2.82Å; L477-M480 PolarHBondContact O-N 3.43Å; L477-L481 WeakPolarHBondContact O-CB 3.5Å; L477-L481 PolarHBondContact O-N 2.98Å
478H92.1Very high89.2Confident19 Ų1935.2 Ų35.29%0.08821%0.214CC..Hα-helixtrans-62.9-44.1174.3-78.5-68.8000111.7D474 C475 M480 L481 G482 Q497 A501D474-H478 PolarHBondContact O-CD2 3.46Å; D474-H478 VanDerWaalsContact O-CD2 3.23Å; D474-H478 PolarHBondContact O-N 3.05Å; D474-H478 VanDerWaalsContact O-N 3.07Å; C475-H478 PolarHBondContact O-N 3.33Å; H478-M480 PolarHBondContact O-N 3.48Å; H478-L481 PolarHBondContact O-N 3.5Å; H478-L481 VanDerWaalsContact O-N 3.17Å; H478-G482 PolarHBondContact O-N 3.41Å; H478-Q497 PolarHBondContact ND1-OE1 3.03Å; H478-A501 HydrophobicContact CB-CB 3.96Å
479R92.6Very high89.3Confident33 Ų3340.4 Ų40.413%0.12524%0.241CC..Hα-helixtrans-57.7-47.7174.4-175.5-1766072.19.8112C475 L481 G482 D483 Y498 A501 D508 K510 S511C475-R479 WeakPolarHBondContact O-CB 3.3Å; C475-R479 PolarHBondContact O-N 3.03Å; R479-L481 VanDerWaalsContact C-N 3.31Å; R479-L481 PolarHBondContact O-N 3.32Å; R479-G482 PolarHBondContact O-N 3Å; R479-D483 IonicContact NH1-OD2 3.21Å; R479-D483 PolarHBondContact NH1-OD2 3.21Å; R479-D483 VanDerWaalsContact O-CG 3.26Å; R479-D483 PolarHBondContact O-N 2.79Å; R479-Y498 HydrophobicContact CG-CD1 4.49Å; R479-Y498 HydrophobicContact CG-CE1 4.11Å; R479-A501 HydrophobicContact CB-CB 4.49Å; R479-D508 WeakPolarHBondContact CD-OD2 3.48Å; R479-D508 IonicContact NE-OD2 3.32Å; R479-K510 VanDerWaalsContact CD-CB 3.42Å; R479-S511 WeakPolarHBondContact CB-OG 3.43Å; R479-S511 WeakPolarHBondContact CD-OG 3.19Å; R479-S511 WeakPolarHBondContact CG-OG 3.5Å
480M92.1Very high89.3Confident11 Ų1142 Ų425%0.05425%0.249CC..Hα-helixtrans-64-37.7177.6-71.9-175.379.400111.6V446 A449 E450 L465 V476 L477 H478 G482 D483 F484V446-M480 HydrophobicContact CB-SD 4.11Å; V446-M480 HydrophobicContact CG1-CE 4.43Å; V446-M480 HydrophobicContact CG1-SD 3.81Å; V446-M480 HydrophobicContact CG2-SD 3.92Å; A449-M480 HydrophobicContact CB-CE 3.42Å; A449-M480 VanDerWaalsContact CB-CE 3.42Å; A449-M480 HydrophobicContact CB-SD 4.45Å; E450-M480 HydrophobicContact CG-CE 4.07Å; L465-M480 HydrophobicContact CD1-CB 4.08Å; L465-M480 HydrophobicContact CD2-CB 4.31Å; V476-M480 HydrophobicContact CG1-SD 4.38Å; V476-M480 VanDerWaalsContact O-CG 3.3Å; V476-M480 WeakPolarHBondContact O-CG 3.48Å; V476-M480 PolarHBondContact O-N 3.46Å; L477-M480 PolarHBondContact O-N 3.43Å; H478-M480 PolarHBondContact O-N 3.48Å; M480-G482 VanDerWaalsContact C-N 3.32Å; M480-G482 PolarHBondContact O-N 3.05Å; M480-D483 PolarHBondContact O-N 2.79Å; M480-F484 WeakPolarHBondContact O-CD2 3.41Å; M480-F484 PolarHBondContact O-N 2.96Å
481L93Very high89.4Confident4 Ų441 Ų412%0.02123%0.23CC..Hα-helixtrans-62.9-42.4175.5-178.562.4000111I462 L465 R466 L469 L477 H478 R479 F484 L485 Q497I462-L481 HydrophobicContact CB-CD1 4.34Å; I462-L481 HydrophobicContact CG1-CD1 4.25Å; I462-L481 HydrophobicContact CG2-CD1 4.04Å; L465-L481 HydrophobicContact CB-CB 4.34Å; L465-L481 HydrophobicContact CB-CD1 4.04Å; L465-L481 HydrophobicContact CD1-CB 4.22Å; L465-L481 HydrophobicContact CD1-CD1 4.41Å; R466-L481 HydrophobicContact CG-CD1 4.33Å; R466-L481 HydrophobicContact CG-CD2 4.24Å; L469-L481 HydrophobicContact CD1-CB 4.23Å; L469-L481 HydrophobicContact CD1-CD2 3.62Å; L477-L481 WeakPolarHBondContact O-CB 3.5Å; L477-L481 PolarHBondContact O-N 2.98Å; H478-L481 PolarHBondContact O-N 3.5Å; H478-L481 VanDerWaalsContact O-N 3.17Å; R479-L481 VanDerWaalsContact C-N 3.31Å; R479-L481 PolarHBondContact O-N 3.32Å; L481-F484 PolarHBondContact O-N 3.38Å; L481-L485 HydrophobicContact CD1-CD1 4.31Å; L481-L485 HydrophobicContact CD1-CG 4.36Å; L481-L485 HydrophobicContact CG-CD1 3.94Å; L481-L485 HydrophobicContact CG-CG 4.44Å; L481-L485 VanDerWaalsContact O-CG 3.3Å; L481-L485 WeakPolarHBondContact O-CG 3.3Å; L481-L485 PolarHBondContact O-N 3.33Å; L481-Q497 HydrophobicContact CB-CG 4.49Å; L481-Q497 HydrophobicContact CD2-CG 3.81Å; L481-Q497 HydrophobicContact CG-CG 4.03Å
482G92.4Very high89.8Confident0 Ų041.5 Ų41.50%023%0.229CC..Hα-helixtrans-55-51.2170.600000112H478 R479 M480 F484 L485 V486H478-G482 PolarHBondContact O-N 3.41Å; R479-G482 PolarHBondContact O-N 3Å; M480-G482 VanDerWaalsContact C-N 3.32Å; M480-G482 PolarHBondContact O-N 3.05Å; G482-F484 PolarHBondContact O-N 3.41Å; G482-L485 PolarHBondContact O-N 2.63Å; G482-L485 VanDerWaalsContact O-N 3.08Å; G482-V486 WeakPolarHBondContact O-CG2 3.5Å; G482-V486 PolarHBondContact O-N 3.23Å
483D92.5Very high90.5Very high56 Ų5642.6 Ų42.630%0.29923%0.234SC..Hα-helixtrans-56.1-37.5179-62.7-21.6000112.1R479 M480 A487 Y498R479-D483 IonicContact NH1-OD2 3.21Å; R479-D483 PolarHBondContact NH1-OD2 3.21Å; R479-D483 VanDerWaalsContact O-CG 3.26Å; R479-D483 PolarHBondContact O-N 2.79Å; M480-D483 PolarHBondContact O-N 2.79Å; D483-A487 PolarHBondContact O-N 3.45Å; D483-Y498 WeakPolarHBondContact CA-OH 3.47Å; D483-Y498 PolarHBondContact N-OH 3.2Å; D483-Y498 PolarHBondContact OD1-OH 3.45Å
484F94.1Very high91.1Very high3 Ų338.7 Ų38.71%0.01321%0.207CC..Hα-helixtrans-74.1-38.9177.2-89.7-102.9000113.2A449 L452 N453 Y458 I462 L465 M480 L481 G482 A487 V488A449-F484 HydrophobicContact CB-CE2 4.15Å; A449-F484 HydrophobicContact CB-CZ 4.32Å; A449-F484 VanDerWaalsContact O-CZ 3.27Å; A449-F484 WeakPolarHBondContact O-CZ 3.12Å; L452-F484 HydrophobicContact CB-CE1 4.36Å; L452-F484 HydrophobicContact CB-CZ 4.26Å; N453-F484 HydrophobicContact CB-CE2 4.03Å; N453-F484 HydrophobicContact CB-CZ 3.74Å; Y458-F484 AromaticContact CD1-CD1 3.84Å; Y458-F484 HydrophobicContact CD1-CD1 3.84Å; Y458-F484 HydrophobicContact CD1-CE1 4.03Å; Y458-F484 HydrophobicContact CG-CD1 4.47Å; Y458-F484 WeakPolarHBondContact O-CD1 3.43Å; I462-F484 HydrophobicContact CD1-CB 4.5Å; I462-F484 HydrophobicContact CG1-CB 3.86Å; I462-F484 HydrophobicContact CG1-CD1 4.43Å; L465-F484 HydrophobicContact CD1-CD2 3.97Å; L465-F484 HydrophobicContact CD1-CE2 4.27Å; L465-F484 HydrophobicContact CD1-CG 4.36Å; M480-F484 WeakPolarHBondContact O-CD2 3.41Å; M480-F484 PolarHBondContact O-N 2.96Å; L481-F484 PolarHBondContact O-N 3.38Å; G482-F484 PolarHBondContact O-N 3.41Å; F484-A487 WeakPolarHBondContact O-CB 3.46Å; F484-A487 PolarHBondContact O-N 3Å; F484-V488 PolarHBondContact O-N 2.91Å
485L93.3Very high91.3Very high4 Ų437.7 Ų37.72%0.02120%0.201CC..Hα-helixtrans-68-38.2178.5-72.4166.3000111.6I462 L481 G482 A487 V488 N489 D490 E493 A494 Q497I462-L485 HydrophobicContact CD1-CD2 3.99Å; I462-L485 HydrophobicContact CG1-CD2 4.5Å; L481-L485 HydrophobicContact CD1-CD1 4.31Å; L481-L485 HydrophobicContact CD1-CG 4.36Å; L481-L485 HydrophobicContact CG-CD1 3.94Å; L481-L485 HydrophobicContact CG-CG 4.44Å; L481-L485 VanDerWaalsContact O-CG 3.3Å; L481-L485 WeakPolarHBondContact O-CG 3.3Å; L481-L485 PolarHBondContact O-N 3.33Å; G482-L485 PolarHBondContact O-N 2.63Å; G482-L485 VanDerWaalsContact O-N 3.08Å; L485-A487 VanDerWaalsContact C-N 3.27Å; L485-A487 PolarHBondContact O-N 3.19Å; L485-V488 CarbonylContact O-C 3.58Å; L485-V488 PolarHBondContact O-N 3.2Å; L485-N489 PolarHBondContact O-N 3.41Å; L485-N489 VanDerWaalsContact O-N 3.11Å; L485-D490 HydrophobicContact CD2-CB 4.23Å; L485-D490 PolarHBondContact O-N 2.89Å; L485-E493 HydrophobicContact CD1-CB 3.85Å; L485-E493 HydrophobicContact CD2-CB 4.43Å; L485-A494 HydrophobicContact CB-CB 3.82Å; L485-Q497 HydrophobicContact CD1-CG 3.82Å
486V91.6Very high91.6Very high37 Ų3740.5 Ų40.522%0.22421%0.214CC..Hα-helixtrans-57.4-42.7170.7175.10000110.7G482 V488 N489 F491 A494 Y498 M518G482-V486 WeakPolarHBondContact O-CG2 3.5Å; G482-V486 PolarHBondContact O-N 3.23Å; V486-V488 PolarHBondContact O-N 3.43Å; V486-N489 PolarHBondContact O-N 2.69Å; V486-F491 HydrophobicContact CG1-CE1 4.23Å; V486-A494 HydrophobicContact CG2-CB 3.68Å; V486-Y498 HydrophobicContact CG2-CE2 3.96Å; V486-M518 HydrophobicContact CB-SD 4.41Å; V486-M518 HydrophobicContact CG1-SD 3.97Å; V486-M518 HydrophobicContact CG2-CE 4.34Å; V486-M518 HydrophobicContact CG2-CG 4.36Å; V486-M518 HydrophobicContact CG2-SD 3.51Å; V486-M518 VanDerWaalsContact CG2-SD 3.51Å
487A90.6Very high91.8Very high41 Ų4139.2 Ų39.234%0.33920%0.204SC..Hα-helixtrans-66.4-22.5178.200000113.9Y458 D483 F484 L485Y458-A487 HydrophobicContact CD1-CB 3.74Å; Y458-A487 HydrophobicContact CD2-CB 4.25Å; Y458-A487 HydrophobicContact CE1-CB 3.64Å; Y458-A487 HydrophobicContact CE2-CB 4.16Å; Y458-A487 HydrophobicContact CG-CB 4.05Å; D483-A487 PolarHBondContact O-N 3.45Å; F484-A487 WeakPolarHBondContact O-CB 3.46Å; F484-A487 PolarHBondContact O-N 3Å; L485-A487 VanDerWaalsContact C-N 3.27Å; L485-A487 PolarHBondContact O-N 3.19Å
488V92.9Very high91.8Very high50 Ų5039.5 Ų39.530%0.30321%0.205SC..Hα-helixtrans-92.1-2.6174.9-179.60000111.9Y458 I462 F484 L485 V486 D490Y458-V488 HydrophobicContact CG-CG2 4.4Å; I462-V488 HydrophobicContact CD1-CB 4.48Å; I462-V488 HydrophobicContact CD1-CG2 3.78Å; F484-V488 PolarHBondContact O-N 2.91Å; L485-V488 CarbonylContact O-C 3.58Å; L485-V488 PolarHBondContact O-N 3.2Å; V486-V488 PolarHBondContact O-N 3.43Å; V488-D490 VanDerWaalsContact C-N 3.31Å
489N89.7Confident91.8Very high117 Ų11741 Ų4163%0.62622%0.218SC*.THydrogen-bonded Turntrans6525.8-173.8-48.2-69.2000114.5L485 V486 F491L485-N489 PolarHBondContact O-N 3.41Å; L485-N489 VanDerWaalsContact O-N 3.11Å; V486-N489 PolarHBondContact O-N 2.69Å; N489-F491 HydrophobicContact CB-CE1 4.36Å; N489-F491 HydrophobicContact CB-CE2 4.16Å; N489-F491 HydrophobicContact CB-CZ 3.93Å; N489-F491 PolarHBondContact O-N 3.23Å
490D91.1Very high91.8Very high60 Ų6042.2 Ų42.232%0.32123%0.227SC..  trans-92.777.6169.6-164.7-17.8000109.8L485 V488 E493 A494L485-D490 HydrophobicContact CD2-CB 4.23Å; L485-D490 PolarHBondContact O-N 2.89Å; V488-D490 VanDerWaalsContact C-N 3.31Å; D490-E493 PolarHBondContact OD1-N 2.91Å; D490-A494 VanDerWaalsContact O-CB 3.3Å; D490-A494 WeakPolarHBondContact O-CB 3.46Å; D490-A494 PolarHBondContact O-N 2.97Å; D490-A494 VanDerWaalsContact O-N 3.11Å
491F89.9Confident91.7Very high61 Ų6141.7 Ų41.727%0.26822%0.224SC..Hα-helixtrans-71.7-32.2-171.8-56.8-45.4000113.1V486 N489 A494 M495 M518V486-F491 HydrophobicContact CG1-CE1 4.23Å; N489-F491 HydrophobicContact CB-CE1 4.36Å; N489-F491 HydrophobicContact CB-CE2 4.16Å; N489-F491 HydrophobicContact CB-CZ 3.93Å; N489-F491 PolarHBondContact O-N 3.23Å; F491-A494 PolarHBondContact O-N 3.47Å; F491-M495 WeakPolarHBondContact O-CG 3.39Å; F491-M495 PolarHBondContact O-N 3.14Å; F491-M518 HydrophobicContact CB-CE 3.65Å; F491-M518 HydrophobicContact CD1-CE 2.95Å; F491-M518 HydrophobicContact CD1-SD 4.3Å; F491-M518 HydrophobicContact CD2-CE 4.38Å; F491-M518 HydrophobicContact CE1-CE 3.54Å; F491-M518 HydrophobicContact CG-CE 3.42Å; F491-M518 VanDerWaalsContact CG-CE 3.42Å; F491-M518 HydrophobicContact CZ-CE 4.45Å
492Q89.3Confident91.6Very high119 Ų11943 Ų4356%0.55623%0.231SC*.Hα-helixtrans-65-52.7179.1-171.666.834.100110.9A494 M495 D496Q492-A494 VanDerWaalsContact C-N 3.28Å; Q492-A494 PolarHBondContact O-N 3.41Å; Q492-M495 PolarHBondContact O-N 3.31Å; Q492-D496 PolarHBondContact O-N 3.29Å
493E91.3Very high91.5Very high68 Ų6847.3 Ų47.332%0.31826%0.261SS..Hα-helixtrans-65.7-34.1176.8-72.6-163.3179.100111.5R466 L485 D490 D496 Q497R466-E493 IonicContact CZ-OE2 3.19Å; R466-E493 IonicContact NH2-OE1 3.55Å; R466-E493 PolarHBondContact NH2-OE1 2.92Å; R466-E493 IonicContact NH2-OE2 3.12Å; R466-E493 PolarHBondContact NH2-OE2 3.32Å; L485-E493 HydrophobicContact CD1-CB 3.85Å; L485-E493 HydrophobicContact CD2-CB 4.43Å; D490-E493 PolarHBondContact OD1-N 2.91Å; E493-D496 PolarHBondContact O-N 3.44Å; E493-Q497 WeakPolarHBondContact O-CG 3.36Å; E493-Q497 PolarHBondContact O-N 3.29Å
494A92.3Very high91.2Very high0 Ų048.7 Ų48.70%027%0.268CS..Hα-helixtrans-61.2-44.8177.100000112.3L485 V486 D490 F491 Q492 D496 Q497 Y498L485-A494 HydrophobicContact CB-CB 3.82Å; V486-A494 HydrophobicContact CG2-CB 3.68Å; D490-A494 VanDerWaalsContact O-CB 3.3Å; D490-A494 WeakPolarHBondContact O-CB 3.46Å; D490-A494 PolarHBondContact O-N 2.97Å; D490-A494 VanDerWaalsContact O-N 3.11Å; F491-A494 PolarHBondContact O-N 3.47Å; Q492-A494 VanDerWaalsContact C-N 3.28Å; Q492-A494 PolarHBondContact O-N 3.41Å; A494-D496 VanDerWaalsContact C-N 3.33Å; A494-D496 PolarHBondContact O-N 3Å; A494-Q497 PolarHBondContact O-N 3.47Å; A494-Y498 HydrophobicContact CB-CE2 4.42Å; A494-Y498 WeakPolarHBondContact O-CD2 3.48Å; A494-Y498 PolarHBondContact O-N 3.31Å
495M89.4Confident90.6Very high29 Ų2951.8 Ų51.814%0.14328%0.284CS..Hα-helixtrans-60.7-42.7175.6-74.7-166.1-7000111.8F491 Q492 Q497 Y498 S499 M518 E522F491-M495 WeakPolarHBondContact O-CG 3.39Å; F491-M495 PolarHBondContact O-N 3.14Å; Q492-M495 PolarHBondContact O-N 3.31Å; M495-Q497 VanDerWaalsContact C-N 3.32Å; M495-Q497 PolarHBondContact O-N 2.93Å; M495-Y498 PolarHBondContact O-N 2.95Å; M495-S499 WeakPolarHBondContact O-CB 3.4Å; M495-S499 PolarHBondContact O-N 3.29Å; M495-M518 HydrophobicContact CG-CB 3.95Å; M495-M518 HydrophobicContact CG-CG 4.32Å; M495-M518 HydrophobicContact SD-CB 4.34Å; M495-E522 WeakPolarHBondContact CE-OE1 3.39Å
496D92.3Very high90.2Very high78 Ų7855.8 Ų55.842%0.41731%0.311SS..Hα-helixtrans-58.8-45.3175.3-71.2-15.6000110.6Q492 E493 A494 S499 I500Q492-D496 PolarHBondContact O-N 3.29Å; E493-D496 PolarHBondContact O-N 3.44Å; A494-D496 VanDerWaalsContact C-N 3.33Å; A494-D496 PolarHBondContact O-N 3Å; D496-S499 PolarHBondContact O-N 2.92Å; D496-S499 PolarHBondContact O-OG 2.86Å; D496-I500 VanDerWaalsContact O-CG1 3.3Å; D496-I500 WeakPolarHBondContact O-CG1 3.35Å; D496-I500 PolarHBondContact O-N 3.12Å
497Q93.4Very high89.7Confident32 Ų3260.9 Ų60.915%0.1534%0.337CS..Hα-helixtrans-66.7-40.2178.6-63.1-48.1-51.300113.3H478 L481 L485 E493 A494 M495 S499 I500 A501H478-Q497 PolarHBondContact ND1-OE1 3.03Å; L481-Q497 HydrophobicContact CB-CG 4.49Å; L481-Q497 HydrophobicContact CD2-CG 3.81Å; L481-Q497 HydrophobicContact CG-CG 4.03Å; L485-Q497 HydrophobicContact CD1-CG 3.82Å; E493-Q497 WeakPolarHBondContact O-CG 3.36Å; E493-Q497 PolarHBondContact O-N 3.29Å; A494-Q497 PolarHBondContact O-N 3.47Å; M495-Q497 VanDerWaalsContact C-N 3.32Å; M495-Q497 PolarHBondContact O-N 2.93Å; Q497-S499 VanDerWaalsContact C-N 3.33Å; Q497-I500 PolarHBondContact O-N 3.05Å; Q497-A501 PolarHBondContact O-N 3.2Å
498Y92.9Very high89.4Confident7 Ų760.2 Ų60.23%0.02733%0.328CS..Hα-helixtrans-65.1-37.7174-71.1-53.8000111.7R479 D483 V486 A494 M495 I500 A501 L502 M518R479-Y498 HydrophobicContact CG-CD1 4.49Å; R479-Y498 HydrophobicContact CG-CE1 4.11Å; D483-Y498 WeakPolarHBondContact CA-OH 3.47Å; D483-Y498 PolarHBondContact N-OH 3.2Å; D483-Y498 PolarHBondContact OD1-OH 3.45Å; V486-Y498 HydrophobicContact CG2-CE2 3.96Å; A494-Y498 HydrophobicContact CB-CE2 4.42Å; A494-Y498 WeakPolarHBondContact O-CD2 3.48Å; A494-Y498 PolarHBondContact O-N 3.31Å; M495-Y498 PolarHBondContact O-N 2.95Å; Y498-I500 VanDerWaalsContact C-N 3.34Å; Y498-I500 PolarHBondContact O-N 3.45Å; Y498-A501 WeakPolarHBondContact O-CB 3.45Å; Y498-A501 PolarHBondContact O-N 3.41Å; Y498-L502 WeakPolarHBondContact O-CG 3.42Å; Y498-L502 PolarHBondContact O-N 2.76Å; Y498-M518 HydrophobicContact CE2-CG 4.42Å
499S91.7Very high89.1Confident51 Ų5163 Ų6336%0.35734%0.337SS..Hα-helixtrans-63.3-40.3175.382.10000111.9M495 D496 Q497 L502 S503M495-S499 WeakPolarHBondContact O-CB 3.4Å; M495-S499 PolarHBondContact O-N 3.29Å; D496-S499 PolarHBondContact O-N 2.92Å; D496-S499 PolarHBondContact O-OG 2.86Å; Q497-S499 VanDerWaalsContact C-N 3.33Å; S499-L502 PolarHBondContact O-N 3.23Å; S499-S503 WeakPolarHBondContact O-CB 3.36Å; S499-S503 PolarHBondContact O-N 3.47Å
500I91.7Very high89Confident59 Ų5963.3 Ų63.330%0.30333%0.333SS..Hα-helixtrans-65-44.1174.7-65163.7000109.9D496 Q497 Y498 L502 S503 L504D496-I500 VanDerWaalsContact O-CG1 3.3Å; D496-I500 WeakPolarHBondContact O-CG1 3.35Å; D496-I500 PolarHBondContact O-N 3.12Å; Q497-I500 PolarHBondContact O-N 3.05Å; Y498-I500 VanDerWaalsContact C-N 3.34Å; Y498-I500 PolarHBondContact O-N 3.45Å; I500-L502 VanDerWaalsContact C-N 3.35Å; I500-L502 PolarHBondContact O-N 3.06Å; I500-S503 PolarHBondContact O-N 3.15Å; I500-S503 VanDerWaalsContact O-N 3.16Å; I500-S503 PolarHBondContact O-OG 3.37Å; I500-L504 HydrophobicContact CG2-CD1 4.43Å; I500-L504 WeakPolarHBondContact O-CG 3.47Å; I500-L504 PolarHBondContact O-N 3.45Å; I500-L504 VanDerWaalsContact O-N 3.16Å
501A90.7Very high88.8Confident0 Ų060.4 Ų60.40%032%0.318CS..Hα-helixtrans-58.2-46.3176.500000111.7C475 H478 R479 Q497 Y498 S503 L504 D505 S511C475-A501 PolarHBondContact SG-O 3.48Å; C475-A501 VanDerWaalsContact SG-O 3.36Å; H478-A501 HydrophobicContact CB-CB 3.96Å; R479-A501 HydrophobicContact CB-CB 4.49Å; Q497-A501 PolarHBondContact O-N 3.2Å; Y498-A501 WeakPolarHBondContact O-CB 3.45Å; Y498-A501 PolarHBondContact O-N 3.41Å; A501-S503 VanDerWaalsContact C-N 3.3Å; A501-S503 PolarHBondContact O-N 3.26Å; A501-L504 WeakPolarHBondContact O-CB 3.47Å; A501-L504 PolarHBondContact O-N 3.11Å; A501-L504 VanDerWaalsContact O-N 3.09Å; A501-D505 PolarHBondContact O-N 2.91Å; A501-S511 WeakPolarHBondContact CB-OG 3.43Å
502L90.7Very high88.8Confident31 Ų3160.3 Ų60.316%0.16232%0.319CS..Hα-helixtrans-67.9-27177.3-69.2169.5000113.3Y498 S499 I500 L504 D505 P506 L512 M515Y498-L502 WeakPolarHBondContact O-CG 3.42Å; Y498-L502 PolarHBondContact O-N 2.76Å; S499-L502 PolarHBondContact O-N 3.23Å; I500-L502 VanDerWaalsContact C-N 3.35Å; I500-L502 PolarHBondContact O-N 3.06Å; L502-L504 VanDerWaalsContact C-N 3.29Å; L502-D505 CarbonylContact O-C 3.49Å; L502-P506 VanDerWaalsContact O-CA 3.24Å; L502-P506 WeakPolarHBondContact O-CA 3.46Å; L502-P506 VanDerWaalsContact O-N 3.16Å; L502-L512 HydrophobicContact CD2-CB 4.16Å; L502-M515 HydrophobicContact CD1-CB 4.47Å; L502-M515 HydrophobicContact CD1-SD 3.5Å; L502-M515 VanDerWaalsContact CD1-SD 3.5Å
503S90.4Very high88.8Confident90 Ų9058.6 Ų58.663%0.62931%0.311SS*.Hα-helixtrans-69.8-28.1171.9800000112.6S499 I500 A501S499-S503 WeakPolarHBondContact O-CB 3.36Å; S499-S503 PolarHBondContact O-N 3.47Å; I500-S503 PolarHBondContact O-N 3.15Å; I500-S503 VanDerWaalsContact O-N 3.16Å; I500-S503 PolarHBondContact O-OG 3.37Å; A501-S503 VanDerWaalsContact C-N 3.3Å; A501-S503 PolarHBondContact O-N 3.26Å
504L86.3Confident88.6Confident86 Ų8655.6 Ų55.645%0.4530%0.299SS..Hα-helixtrans-84.5-45.1177.8-65.8173.1000111.5C475 I500 A501 L502C475-L504 HydrophobicContact CB-CB 4.15Å; C475-L504 HydrophobicContact CB-CD1 4.49Å; I500-L504 HydrophobicContact CG2-CD1 4.43Å; I500-L504 WeakPolarHBondContact O-CG 3.47Å; I500-L504 PolarHBondContact O-N 3.45Å; I500-L504 VanDerWaalsContact O-N 3.16Å; A501-L504 WeakPolarHBondContact O-CB 3.47Å; A501-L504 PolarHBondContact O-N 3.11Å; A501-L504 VanDerWaalsContact O-N 3.09Å; L502-L504 VanDerWaalsContact C-N 3.29Å
505D82.2Confident88.3Confident67 Ų6758 Ų5836%0.35831%0.311SS..  trans-131.799.5171.8-174.60.1000110.5C475 A501 L502 N507 D508C475-D505 HydrophobicContact CB-CB 4.45Å; A501-D505 PolarHBondContact O-N 2.91Å; L502-D505 CarbonylContact O-C 3.49Å; D505-N507 PolarHBondContact O-N 3.04Å; D505-N507 VanDerWaalsContact O-N 3.1Å; D505-N507 PolarHBondContact OD1-N 3.16Å; D505-D508 HydrophobicContact CB-CB 4.31Å; D505-D508 PolarHBondContact O-N 3.12Å
506P84.1Confident88.3Confident89 Ų8960.8 Ų60.858%0.57832%0.323SS*.THydrogen-bonded Turntrans-61.4-19.7179.3-25.335000114.2L502L502-P506 VanDerWaalsContact O-CA 3.24Å; L502-P506 WeakPolarHBondContact O-CA 3.46Å; L502-P506 VanDerWaalsContact O-N 3.16Å
507N80.6Confident88Confident143 Ų14363.1 Ų63.177%0.76533%0.33SS*.THydrogen-bonded Turntrans-100.78.5-175.8-64.7-42.8000113.1D505 Q509D505-N507 PolarHBondContact O-N 3.04Å; D505-N507 VanDerWaalsContact O-N 3.1Å; D505-N507 PolarHBondContact OD1-N 3.16Å; N507-Q509 PolarHBondContact O-N 2.97Å
508D85.1Confident87.5Confident28 Ų2861.8 Ų61.815%0.1532%0.324CS..  trans-72.595.7176.7-17826.4000111.6R479 D505 K510 S511 L512R479-D508 WeakPolarHBondContact CD-OD2 3.48Å; R479-D508 IonicContact NE-OD2 3.32Å; D505-D508 HydrophobicContact CB-CB 4.31Å; D505-D508 PolarHBondContact O-N 3.12Å; D508-K510 PolarHBondContact O-N 3.31Å; D508-K510 VanDerWaalsContact O-N 3.11Å; D508-K510 PolarHBondContact OD1-N 2.68Å; D508-S511 PolarHBondContact O-N 3.07Å; D508-S511 VanDerWaalsContact OD2-CB 3.32Å; D508-S511 WeakPolarHBondContact OD2-CB 3.49Å; D508-S511 PolarHBondContact OD2-N 3.28Å; D508-S511 PolarHBondContact OD2-OG 2.96Å; D508-L512 PolarHBondContact O-N 3.17Å; D508-L512 VanDerWaalsContact O-N 3.11Å
509Q86.1Confident87Confident109 Ų10966.3 Ų66.351%0.50935%0.345SS..Hα-helixtrans-52.1-35.5180-172.762.43600113.2N507 L512 E513N507-Q509 PolarHBondContact O-N 2.97Å; Q509-L512 PolarHBondContact O-N 3.47Å; Q509-E513 WeakPolarHBondContact CG-OE1 3.21Å; Q509-E513 WeakPolarHBondContact O-CB 3.24Å; Q509-E513 VanDerWaalsContact O-CG 3.29Å; Q509-E513 WeakPolarHBondContact O-CG 3.33Å; Q509-E513 PolarHBondContact O-N 3.24Å
510K87.3Confident86.4Confident122 Ų12270.8 Ų70.853%0.5336%0.358SS..Hα-helixtrans-74.6-38.8-176.2-65.6-179.1-178.9176.50112.3R479 D508 L512 E513 G514R479-K510 VanDerWaalsContact CD-CB 3.42Å; D508-K510 PolarHBondContact O-N 3.31Å; D508-K510 VanDerWaalsContact O-N 3.11Å; D508-K510 PolarHBondContact OD1-N 2.68Å; K510-L512 VanDerWaalsContact C-N 3.3Å; K510-E513 PolarHBondContact O-N 3.07Å; K510-G514 PolarHBondContact O-N 3.48Å
511S87.8Confident85.3Confident0 Ų073.7 Ų73.70%037%0.371CS..Hα-helixtrans-66-38.2173.7-64.20000110.8R479 A501 D508 G514 M515R479-S511 WeakPolarHBondContact CB-OG 3.43Å; R479-S511 WeakPolarHBondContact CD-OG 3.19Å; R479-S511 WeakPolarHBondContact CG-OG 3.5Å; A501-S511 WeakPolarHBondContact CB-OG 3.43Å; D508-S511 PolarHBondContact O-N 3.07Å; D508-S511 VanDerWaalsContact OD2-CB 3.32Å; D508-S511 WeakPolarHBondContact OD2-CB 3.49Å; D508-S511 PolarHBondContact OD2-N 3.28Å; D508-S511 PolarHBondContact OD2-OG 2.96Å; S511-G514 PolarHBondContact O-N 2.96Å; S511-M515 PolarHBondContact O-N 3.24Å
512L89.4Confident83.9Confident58 Ų5878.1 Ų78.130%0.30439%0.391SS..Hα-helixtrans-64.5-44.7175.4-162.5157.7000111.7L502 D508 Q509 K510 G514 M515 Q516L502-L512 HydrophobicContact CD2-CB 4.16Å; D508-L512 PolarHBondContact O-N 3.17Å; D508-L512 VanDerWaalsContact O-N 3.11Å; Q509-L512 PolarHBondContact O-N 3.47Å; K510-L512 VanDerWaalsContact C-N 3.3Å; L512-G514 VanDerWaalsContact C-N 3.32Å; L512-G514 PolarHBondContact O-N 3.17Å; L512-M515 PolarHBondContact O-N 3.4Å; L512-Q516 VanDerWaalsContact CD2-CD 3.48Å; L512-Q516 HydrophobicContact CD2-CG 3.97Å; L512-Q516 WeakPolarHBondContact O-CB 3.5Å; L512-Q516 WeakPolarHBondContact O-CG 3.48Å; L512-Q516 PolarHBondContact O-N 2.79Å
513E89.1Confident82.2Confident83 Ų8380.2 Ų80.239%0.38841%0.409SS..Hα-helixtrans-61.7-38.3173.3-77.3171.9-162.800112.8Q509 K510 K517Q509-E513 WeakPolarHBondContact CG-OE1 3.21Å; Q509-E513 WeakPolarHBondContact O-CB 3.24Å; Q509-E513 VanDerWaalsContact O-CG 3.29Å; Q509-E513 WeakPolarHBondContact O-CG 3.33Å; Q509-E513 PolarHBondContact O-N 3.24Å; K510-E513 PolarHBondContact O-N 3.07Å; E513-K517 VanDerWaalsContact O-CG 3.26Å; E513-K517 WeakPolarHBondContact O-CG 3.31Å; E513-K517 PolarHBondContact O-N 3.2Å; E513-K517 VanDerWaalsContact O-N 3.11Å
514G86.5Confident80.3Confident6 Ų680 Ų806%0.06241%0.405CS..Hα-helixtrans-60-51.7173.700000111.1K510 S511 L512 Q516 K517 M518K510-G514 PolarHBondContact O-N 3.48Å; S511-G514 PolarHBondContact O-N 2.96Å; L512-G514 VanDerWaalsContact C-N 3.32Å; L512-G514 PolarHBondContact O-N 3.17Å; G514-Q516 PolarHBondContact O-N 3.23Å; G514-K517 PolarHBondContact O-N 2.96Å; G514-M518 WeakPolarHBondContact O-CG 3.24Å; G514-M518 PolarHBondContact O-N 2.98Å
515M87.5Confident78.4Confident50 Ų5081.2 Ų81.225%0.24642%0.416CS..Hα-helixtrans-59.7-46.1178.5-163.5171.8-161.300112.5L502 S511 L512 K517 M518 E519L502-M515 HydrophobicContact CD1-CB 4.47Å; L502-M515 HydrophobicContact CD1-SD 3.5Å; L502-M515 VanDerWaalsContact CD1-SD 3.5Å; S511-M515 PolarHBondContact O-N 3.24Å; L512-M515 PolarHBondContact O-N 3.4Å; M515-K517 VanDerWaalsContact C-N 3.31Å; M515-K517 PolarHBondContact O-N 3.37Å; M515-M518 WeakPolarHBondContact O-CB 3.35Å; M515-M518 PolarHBondContact O-N 3.3Å; M515-M518 VanDerWaalsContact O-N 3.1Å; M515-E519 WeakPolarHBondContact O-CG 3.43Å; M515-E519 PolarHBondContact O-N 3.34Å
516Q87.8Confident76.3Confident87 Ų8785.2 Ų85.241%0.40744%0.437SS..Hα-helixtrans-63.7-32.2178.1-76.1-176.5-7.500113.9L512 G514 M518 K520L512-Q516 VanDerWaalsContact CD2-CD 3.48Å; L512-Q516 HydrophobicContact CD2-CG 3.97Å; L512-Q516 WeakPolarHBondContact O-CB 3.5Å; L512-Q516 WeakPolarHBondContact O-CG 3.48Å; L512-Q516 PolarHBondContact O-N 2.79Å; G514-Q516 PolarHBondContact O-N 3.23Å; Q516-M518 VanDerWaalsContact C-N 3.34Å; Q516-K520 VanDerWaalsContact O-CG 3.29Å; Q516-K520 WeakPolarHBondContact O-CG 3.49Å; Q516-K520 PolarHBondContact O-N 3.11Å
517K86.9Confident74.3Confident128 Ų12885.1 Ų85.156%0.55744%0.444SS*.Hα-helixtrans-66.5-41.3174.1-75.6168.7-174.2171.70110.3E513 G514 M515 K520 E521E513-K517 VanDerWaalsContact O-CG 3.26Å; E513-K517 WeakPolarHBondContact O-CG 3.31Å; E513-K517 PolarHBondContact O-N 3.2Å; E513-K517 VanDerWaalsContact O-N 3.11Å; G514-K517 PolarHBondContact O-N 2.96Å; M515-K517 VanDerWaalsContact C-N 3.31Å; M515-K517 PolarHBondContact O-N 3.37Å; K517-K520 PolarHBondContact O-N 3.35Å; K517-E521 PolarHBondContact O-N 3.46Å
518M82.9Confident72.3Confident4 Ų484.2 Ų84.22%0.0244%0.444CS..Hα-helixtrans-65.9-46.2178.9-58-37-55.800112.4V486 F491 M495 Y498 G514 M515 Q516 K520 E521 E522V486-M518 HydrophobicContact CB-SD 4.41Å; V486-M518 HydrophobicContact CG1-SD 3.97Å; V486-M518 HydrophobicContact CG2-CE 4.34Å; V486-M518 HydrophobicContact CG2-CG 4.36Å; V486-M518 HydrophobicContact CG2-SD 3.51Å; V486-M518 VanDerWaalsContact CG2-SD 3.51Å; F491-M518 HydrophobicContact CB-CE 3.65Å; F491-M518 HydrophobicContact CD1-CE 2.95Å; F491-M518 HydrophobicContact CD1-SD 4.3Å; F491-M518 HydrophobicContact CD2-CE 4.38Å; F491-M518 HydrophobicContact CE1-CE 3.54Å; F491-M518 HydrophobicContact CG-CE 3.42Å; F491-M518 VanDerWaalsContact CG-CE 3.42Å; F491-M518 HydrophobicContact CZ-CE 4.45Å; M495-M518 HydrophobicContact CG-CB 3.95Å; M495-M518 HydrophobicContact CG-CG 4.32Å; M495-M518 HydrophobicContact SD-CB 4.34Å; Y498-M518 HydrophobicContact CE2-CG 4.42Å; G514-M518 WeakPolarHBondContact O-CG 3.24Å; G514-M518 PolarHBondContact O-N 2.98Å; M515-M518 WeakPolarHBondContact O-CB 3.35Å; M515-M518 PolarHBondContact O-N 3.3Å; M515-M518 VanDerWaalsContact O-N 3.1Å; Q516-M518 VanDerWaalsContact C-N 3.34Å; M518-K520 PolarHBondContact O-N 3.45Å; M518-E521 PolarHBondContact O-N 2.91Å; M518-E521 VanDerWaalsContact O-N 3.11Å; M518-E522 PolarHBondContact O-N 3.1Å
519E81.9Confident70.4Confident102 Ų10288.5 Ų88.548%0.47747%0.471SS..Hα-helixtrans-58.6-36.3176.7-70.1172176.800112.2M515 S523M515-E519 WeakPolarHBondContact O-CG 3.43Å; M515-E519 PolarHBondContact O-N 3.34Å; E519-S523 WeakPolarHBondContact O-CB 3.46Å; E519-S523 PolarHBondContact O-N 3.11Å
520K79.6Confident67.9Low144 Ų14491.5 Ų91.563%0.62649%0.485SS*.Hα-helixtrans-72.8-34.5176.9-74.9174.9-176.8175.20113.1Q516 K517 M518 S523 P524Q516-K520 VanDerWaalsContact O-CG 3.29Å; Q516-K520 WeakPolarHBondContact O-CG 3.49Å; Q516-K520 PolarHBondContact O-N 3.11Å; K517-K520 PolarHBondContact O-N 3.35Å; M518-K520 PolarHBondContact O-N 3.45Å; K520-S523 PolarHBondContact O-N 3.25Å; K520-S523 PolarHBondContact O-OG 3.18Å; K520-P524 WeakPolarHBondContact O-CD 3.42Å
521E67.6Low65.5Low121 Ų12193 Ų9357%0.56550%0.498SS*.Hα-helixtrans-79-19.7178.2-75.2-172.4178.600113.7K517 M518 P524K517-E521 PolarHBondContact O-N 3.46Å; M518-E521 PolarHBondContact O-N 2.91Å; M518-E521 VanDerWaalsContact O-N 3.11Å; E521-P524 WeakPolarHBondContact O-CD 3.42Å; E521-P524 WeakPolarHBondContact O-CG 3.5Å
522E62.3Low63Low93 Ų93101.6 Ų101.644%0.43554%0.544SS..Hα-helixtrans-82.9-25.5167.7-72.8-170.4159.400113.1M495 M518 P524 T525M495-E522 WeakPolarHBondContact CE-OE1 3.39Å; M518-E522 PolarHBondContact O-N 3.1Å; E522-P524 WeakPolarHBondContact O-CD 3.46Å; E522-T525 PolarHBondContact O-OG1 3.28Å
523S54.3Low60.4Low75 Ų75102.3 Ų102.352%0.52457%0.565SS.*G310 helixtrans-75-8.9176.775.40000119.2E519 K520 T525E519-S523 WeakPolarHBondContact O-CB 3.46Å; E519-S523 PolarHBondContact O-N 3.11Å; K520-S523 PolarHBondContact O-N 3.25Å; K520-S523 PolarHBondContact O-OG 3.18Å; S523-T525 VanDerWaalsContact C-N 3.28Å; S523-T525 PolarHBondContact O-N 3.02Å
524P51Low58.1Low85 Ų85105.7 Ų105.755%0.55259%0.586SS**G310 helixtrans-81.1-5.1-178.528.6-20.4000113.2K520 E521 E522K520-P524 WeakPolarHBondContact O-CD 3.42Å; E521-P524 WeakPolarHBondContact O-CD 3.42Å; E521-P524 WeakPolarHBondContact O-CG 3.5Å; E522-P524 WeakPolarHBondContact O-CD 3.46Å
525T45.7Very low55.6Low111 Ų111112.4 Ų112.468%0.68162%0.62SS**G310 helixtrans-90.7-3.6177.344.20000115E522 S523E522-T525 PolarHBondContact O-OG1 3.28Å; S523-T525 VanDerWaalsContact C-N 3.28Å; S523-T525 PolarHBondContact O-N 3.02Å
526D39.6Very low53.1Low151 Ų151117.2 Ų117.281%0.80764%0.644SS**SBendtrans-100.23.2179-1199.2000113.9
527A40.4Very low50.6Low88 Ų88121.4 Ų121.473%0.72766%0.664SS**SBendtrans-96.712.6179.700000114.4
528T38.8Very low48Very low124 Ų124118.8 Ų118.876%0.76167%0.673SS**SBendtrans-122.731.5-179.756.80000114.9
529V44.8Very low45.6Very low117 Ų117124.8 Ų124.871%0.70972%0.715SS**  trans-135.7130.4165.7-165.60000108.8
530E34.7Very low43.2Very low172 Ų172123.1 Ų123.180%0.80473%0.726SS**SBendtrans88.5110.5176-53-164.6173.700114.8
531L36.8Very low41.1Very low155 Ų155124.8 Ų124.881%0.81274%0.736SS**  cis-153.9119.419.9-73.8119.1000110.9
532D34.9Very low39.6Very low180 Ų180126.5 Ų126.596%0.96375%0.749SS**  trans-97.6123.1147.4-87.6-25.8000106.8
533G36.2Very low38.3Very low72 Ų72125.6 Ų125.674%0.74276%0.764SS**  trans-17977.6-178.500000111.1
534D39.2Very low37.4Very low154 Ų154128.5 Ų128.582%0.82477%0.774SS**  trans-50.9138.9165.7-73.6-43.4000112.2
535D34.4Very low36.9Very low148 Ų148130.8 Ų130.879%0.79178%0.78SS**  167.7121.1110.4-91.9-30000114.1
536M35.4Very low36.4Very low150 Ų150133.6 Ų133.674%0.73979%0.786SS**  trans56124.6131.3-74.1-76-122.900124.4
537E34.3Very low36.2Very low176 Ų176129.4 Ų129.482%0.82278%0.778SS**  trans77.6127.5137-76.9-179.2-171.900122.7
538G32.2Very low35.9Very low73 Ų73130 Ų13075%0.75378%0.777SS**  trans161.270.8158.500000117.7
539S33.9Very low35.6Very low130 Ų130131.1 Ų131.191%0.90978%0.778SS**  trans8.6144148.659.70000123.2
540G31.7Very low35.1Very low67 Ų67129.9 Ų129.969%0.69178%0.775SS**  trans128.888.4143.300000114.3
541E35.5Very low35.2Very low179 Ų179130.3 Ų130.384%0.83678%0.777SS**  88.4108.3101.8-85.5-176.2176.700114.5
542D35.6Very low35Very low157 Ų157127.5 Ų127.584%0.8478%0.776SS**  trans54.9127.8131.4-59.1-15.1000121.5
543G34.4Very low34.9Very low73 Ų73123.2 Ų123.275%0.75377%0.766SS**  trans167.239.3165.200000116.3
544D36.3Very low34.7Very low137 Ų137128.2 Ų128.273%0.73377%0.77SS**  trans33.4125.3141.1-78.4-17.1000122.4
545L40Very low34.4Very low132 Ų132133 Ų13369%0.69178%0.777SS**  66.4137.7125.4-55.8165.3000117.1
546E35.4Very low34.3Very low170 Ų170130.8 Ų130.879%0.79478%0.779SS**  cis-165.6140.511.5-115.5164.2-172.700104.7
547G34.6Very low34.3Very low63 Ų63131.1 Ų131.165%0.64978%0.784SS**  99.884.1100.300000109.6
548S33.8Very low34.3Very low101 Ų101131.3 Ų131.371%0.70679%0.785SS**  73.7139.681.178.60000114.3
549D33.9Very low34.5Very low147 Ų147136.1 Ų136.179%0.78679%0.788SS**  trans92.1134.3157.6-55.1-17000116.7
550S34.8Very low34.6Very low92 Ų92137.8 Ų137.864%0.64378%0.781SS**  cis172.9179.9-11.557.10000104.4
551E36.1Very low34.7Very low180 Ų180145.3 Ų145.384%0.84179%0.789SS**  trans8398.7172.8-51.8-174.716000114.6
552A32.6Very low35.2Very low96 Ų96146.4 Ų146.479%0.79379%0.791SS**  63103.253.900000115.1
553A32.8Very low35.4Very low91 Ų91141.7 Ų141.775%0.75278%0.78SS**  trans100.7146.5130.400000121.3
554Q31.7Very low35.9Very low176 Ų176147.2 Ų147.282%0.82279%0.788SS**  trans90102.1157-59.3176.5-0.200116.5
555W33.2Very low36.5Very low255 Ų255153.7 Ų153.797%0.96681%0.814SS**  63.6109.283.2-74.544000113.6
556A31.6Very low36.4Very low102 Ų102154.8 Ų154.884%0.84382%0.82SS**  trans-169.1130.7139.900000111.5
557D36.1Very low36.4Very low157 Ų157153.9 Ų153.984%0.8482%0.822SS**  trans-55.3150.9170.1-62.7-59000113.8
558Q34.3Very low36.5Very low179 Ų179159 Ų15984%0.83683%0.831SS**  trans-148.9100.3144.8-114.7174.328.600110.9
559E36.2Very low36.7Very low175 Ų175162.4 Ų162.482%0.81884%0.839SS**  trans-60.1128.5154.2-67.2179.2146.400109.2
560Q36.1Very low36.9Very low165 Ų165163.4 Ų163.477%0.77184%0.842SS**  trans-132.8113.6154.8-96.1-171.8-800110.9
561W34.6Very low37Very low225 Ų225168.1 Ų168.185%0.85286%0.855SS**  trans-47.8139.5160.8-79.742.6000112.8
562F44.6Very low37.1Very low201 Ų201167.3 Ų167.388%0.88286%0.856SS**  trans-130.8116.6145.6-96-81.9000109.8
563G39.6Very low37.4Very low59 Ų59172.8 Ų172.861%0.60886%0.861SS**  trans-87.1151.9170.800000112.2
564M45.3Very low37.8Very low188 Ų188179.6 Ų179.693%0.92687%0.87SS**  trans32.6122.6142.9-72.5176.2168.600119.7
565Q50.5Low38.4Very low273 Ų273179.9 Ų179.9100%1.27687%0.874SS**  -125.20119.7-82.9-172.9-13.900109.8

Retrieved 565 of 565 residues in 278.7 ms (Link to these results)

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