A0A3Q0KKZ0_SCHMA Loading...

26S proteasome non-ATPase regulatory subunit 5

AlphaFold DB , UniProt , Accession A0A3Q0KKZ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 544 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
1M52.9Low82.4Confident199 Ų19974.2 Ų74.298%0.9840%0.395SS*.  0157.20-87.7166.4162.500106.6I3 E38M1-I3 PolarHBondContact O-N 2.81Å; M1-E38 PolarHBondContact N-OE1 3.41Å
2T73.2Confident82.9Confident135 Ų13573.3 Ų73.383%0.82840%0.399SS*.PPolyproline II helixtrans-66.4132166.440.90000108.1P4T2-P4 WeakPolarHBondContact O-CD 3.43Å
3I80.2Confident83.3Confident34 Ų3474.2 Ų74.217%0.17440%0.397CS..PPolyproline II helixtrans-57.9123.6175.7-62.7164.2000107.1M1 D5 V7 F8 E38 S41 V42M1-I3 PolarHBondContact O-N 2.81Å; I3-D5 PolarHBondContact O-N 3.12Å; I3-V7 HydrophobicContact CG2-CG1 3.84Å; I3-F8 HydrophobicContact CG2-CE2 3.72Å; I3-F8 HydrophobicContact CG2-CZ 3.77Å; I3-E38 HydrophobicContact CD1-CB 4.43Å; I3-E38 HydrophobicContact CG1-CB 4.27Å; I3-E38 HydrophobicContact CG1-CG 4.34Å; I3-S41 WeakPolarHBondContact CD1-OG 3.03Å; I3-V42 HydrophobicContact CD1-CG2 4.01Å; I3-V42 HydrophobicContact CG1-CG2 4.41Å; I3-V42 HydrophobicContact CG2-CG2 3.69Å
4P83.4Confident83.7Confident54 Ų5468.9 Ų68.935%0.35137%0.368SS..PPolyproline II helixtrans-61124.3180-22.833.4000110.4T2 E6 V7 I30T2-P4 WeakPolarHBondContact O-CD 3.43Å; P4-E6 PolarHBondContact O-N 3.02Å; P4-E6 VanDerWaalsContact O-N 3.12Å; P4-V7 VanDerWaalsContact O-CG1 3.27Å; P4-V7 WeakPolarHBondContact O-CG1 3.2Å; P4-V7 PolarHBondContact O-N 3.25Å; P4-I30 HydrophobicContact CG-CG2 4.13Å
5D83.7Confident83.8Confident127 Ų12765.2 Ų65.268%0.67935%0.35SS*.THydrogen-bonded Turntrans-58.1-29.3-180-71.7-32.8000112.1I3 V7 F8I3-D5 PolarHBondContact O-N 3.12Å; D5-V7 PolarHBondContact O-N 2.93Å; D5-V7 VanDerWaalsContact O-N 3.09Å; D5-F8 PolarHBondContact O-N 2.94Å
6E87.9Confident83.8Confident90 Ų9067.4 Ų67.442%0.42136%0.362SS..Hα-helixtrans-49.8-33.7173.4-172.6-171.9172.800113.2P4 F8 D9 L10 R26P4-E6 PolarHBondContact O-N 3.02Å; P4-E6 VanDerWaalsContact O-N 3.12Å; E6-F8 VanDerWaalsContact C-N 3.28Å; E6-F8 PolarHBondContact O-N 3.37Å; E6-D9 PolarHBondContact O-N 2.95Å; E6-L10 HydrophobicContact CG-CD1 3.95Å; E6-L10 HydrophobicContact CG-CG 4.22Å; E6-L10 WeakPolarHBondContact O-CB 3.43Å; E6-L10 WeakPolarHBondContact O-CG 3.42Å; E6-L10 PolarHBondContact O-N 3.38Å; E6-R26 IonicContact OE1-NE 3.94Å
7V88.9Confident83.4Confident0 Ų066.8 Ų66.80%038%0.375CS..Hα-helixtrans-64.7-35.3-17981.20000111.7I3 P4 D5 V11 I30 L31 V42I3-V7 HydrophobicContact CG2-CG1 3.84Å; P4-V7 VanDerWaalsContact O-CG1 3.27Å; P4-V7 WeakPolarHBondContact O-CG1 3.2Å; P4-V7 PolarHBondContact O-N 3.25Å; D5-V7 PolarHBondContact O-N 2.93Å; D5-V7 VanDerWaalsContact O-N 3.09Å; V7-V11 HydrophobicContact CG2-CG2 4.45Å; V7-V11 WeakPolarHBondContact O-CB 3.27Å; V7-V11 WeakPolarHBondContact O-CG2 3.34Å; V7-V11 PolarHBondContact O-N 3.33Å; V7-I30 HydrophobicContact CB-CD1 4.46Å; V7-I30 HydrophobicContact CB-CG2 4.05Å; V7-I30 HydrophobicContact CG2-CB 4.36Å; V7-I30 HydrophobicContact CG2-CG2 3.92Å; V7-L31 HydrophobicContact CG2-CD2 3.97Å; V7-L31 HydrophobicContact CG2-CG 4.45Å; V7-V42 HydrophobicContact CG1-CG1 4.38Å
8F89.2Confident83.3Confident38 Ų3869.6 Ų69.617%0.16739%0.389CS..Hα-helixtrans-70.3-40.8180-58.6-75.3000110.5I3 D5 E6 S12 V42 K45 C46I3-F8 HydrophobicContact CG2-CE2 3.72Å; I3-F8 HydrophobicContact CG2-CZ 3.77Å; D5-F8 PolarHBondContact O-N 2.94Å; E6-F8 VanDerWaalsContact C-N 3.28Å; E6-F8 PolarHBondContact O-N 3.37Å; F8-S12 WeakPolarHBondContact O-CB 3.38Å; F8-S12 PolarHBondContact O-N 3.02Å; F8-V42 HydrophobicContact CE1-CG1 4.36Å; F8-V42 HydrophobicContact CZ-CG2 4.45Å; F8-K45 HydrophobicContact CD1-CB 4.27Å; F8-K45 HydrophobicContact CE1-CB 3.74Å; F8-K45 HydrophobicContact CE1-CD 3.66Å; F8-K45 HydrophobicContact CE1-CG 4.37Å; F8-K45 HydrophobicContact CZ-CD 3.87Å; F8-C46 WeakPolarHBondContact CD1-SG 3.33Å
9D88.9Confident83.2Confident118 Ų11867.3 Ų67.363%0.63138%0.382SS*.Hα-helixtrans-65.6-45.2176.3-69.1-25.2000111.7E6 S12 K13E6-D9 PolarHBondContact O-N 2.95Å; D9-S12 PolarHBondContact O-N 3.09Å; D9-K13 WeakPolarHBondContact O-CB 3.46Å; D9-K13 PolarHBondContact O-N 2.86Å
10L90.8Very high83.4Confident18 Ų1868.4 Ų68.49%0.09439%0.386CS..Hα-helixtrans-62.2-48176.9-74.4173.7000111.5E6 S12 K13 V14 D23 R26 I27 I30E6-L10 HydrophobicContact CG-CD1 3.95Å; E6-L10 HydrophobicContact CG-CG 4.22Å; E6-L10 WeakPolarHBondContact O-CB 3.43Å; E6-L10 WeakPolarHBondContact O-CG 3.42Å; E6-L10 PolarHBondContact O-N 3.38Å; L10-S12 VanDerWaalsContact C-N 3.32Å; L10-S12 PolarHBondContact O-N 2.74Å; L10-K13 WeakPolarHBondContact O-CB 3.26Å; L10-K13 PolarHBondContact O-N 3.33Å; L10-V14 WeakPolarHBondContact O-CG1 3.32Å; L10-V14 WeakPolarHBondContact O-CG2 3.46Å; L10-V14 PolarHBondContact O-N 3.44Å; L10-D23 HydrophobicContact CD2-CB 4.19Å; L10-R26 HydrophobicContact CD1-CB 4.1Å; L10-R26 HydrophobicContact CD1-CG 3.73Å; L10-I27 HydrophobicContact CB-CD1 4.07Å; L10-I27 HydrophobicContact CB-CG1 3.77Å; L10-I27 HydrophobicContact CD1-CG1 4.36Å; L10-I30 HydrophobicContact CD1-CD1 4.09Å
11V87.7Confident83.4Confident3 Ų367.4 Ų67.42%0.01838%0.379CS..Hα-helixtrans-61.7-42.1178.3172.80000110.7V7 K13 V14 S15 I27 C46 I48 A51V7-V11 HydrophobicContact CG2-CG2 4.45Å; V7-V11 WeakPolarHBondContact O-CB 3.27Å; V7-V11 WeakPolarHBondContact O-CG2 3.34Å; V7-V11 PolarHBondContact O-N 3.33Å; V11-K13 PolarHBondContact O-N 3.06Å; V11-V14 WeakPolarHBondContact O-CG2 3.49Å; V11-S15 WeakPolarHBondContact O-CB 3.34Å; V11-S15 PolarHBondContact O-N 3.15Å; V11-S15 PolarHBondContact O-OG 3.09Å; V11-I27 HydrophobicContact CG2-CD1 4.08Å; V11-I27 HydrophobicContact CG2-CG1 4.26Å; V11-I27 HydrophobicContact CG2-CG2 4.25Å; V11-C46 HydrophobicContact CB-CB 4.45Å; V11-C46 HydrophobicContact CG1-CB 3.79Å; V11-I48 HydrophobicContact CG1-CG1 4.04Å; V11-I48 HydrophobicContact CG2-CD1 4.4Å; V11-I48 HydrophobicContact CG2-CG1 4.11Å; V11-A51 HydrophobicContact CG1-CB 4.35Å
12S87.9Confident85.1Confident64 Ų6464.4 Ų64.445%0.44836%0.363SS..Hα-helixtrans-63.7-40.1175.4-173.80000112.4F8 D9 L10 N16F8-S12 WeakPolarHBondContact O-CB 3.38Å; F8-S12 PolarHBondContact O-N 3.02Å; D9-S12 PolarHBondContact O-N 3.09Å; L10-S12 VanDerWaalsContact C-N 3.32Å; L10-S12 PolarHBondContact O-N 2.74Å; S12-N16 PolarHBondContact O-N 2.81Å; S12-N16 PolarHBondContact O-ND2 3.22Å; S12-N16 VanDerWaalsContact O-ND2 3.15Å
13K88.9Confident86Confident84 Ų8458.7 Ų58.737%0.36533%0.327SS..Hα-helixtrans-62.1-50.6178.6-178.8-170.5176.6-161.50111.3D9 L10 V11 N16 N18 D23D9-K13 WeakPolarHBondContact O-CB 3.46Å; D9-K13 PolarHBondContact O-N 2.86Å; L10-K13 WeakPolarHBondContact O-CB 3.26Å; L10-K13 PolarHBondContact O-N 3.33Å; V11-K13 PolarHBondContact O-N 3.06Å; K13-N16 PolarHBondContact O-N 3.1Å; K13-N18 WeakPolarHBondContact CE-O 3.47Å; K13-N18 HydrophobicContact CG-CB 4.3Å; K13-N18 PolarHBondContact O-N 2.65Å; K13-D23 VanDerWaalsContact CE-OD2 3.26Å; K13-D23 WeakPolarHBondContact CE-OD2 3.47Å; K13-D23 IonicContact NZ-OD1 2.87Å; K13-D23 PolarHBondContact NZ-OD1 2.84Å; K13-D23 IonicContact NZ-OD2 2.75Å; K13-D23 PolarHBondContact NZ-OD2 3.08Å
14V88.2Confident86.5Confident0 Ų057.7 Ų57.70%032%0.321CS..Hα-helixtrans-69.9-38.7-177.5-57.70000112.2L10 V11 N16 G17 D23 Y24 I27 A51 S54L10-V14 WeakPolarHBondContact O-CG1 3.32Å; L10-V14 WeakPolarHBondContact O-CG2 3.46Å; L10-V14 PolarHBondContact O-N 3.44Å; V11-V14 WeakPolarHBondContact O-CG2 3.49Å; V14-N16 PolarHBondContact O-N 3.25Å; V14-G17 PolarHBondContact O-N 2.99Å; V14-D23 HydrophobicContact CG1-CB 3.59Å; V14-Y24 HydrophobicContact CB-CD1 4.29Å; V14-Y24 HydrophobicContact CB-CE1 3.54Å; V14-Y24 HydrophobicContact CB-CE2 4.44Å; V14-Y24 HydrophobicContact CG1-CD1 4.19Å; V14-Y24 HydrophobicContact CG1-CE1 3.89Å; V14-Y24 HydrophobicContact CG1-CE2 4.31Å; V14-Y24 HydrophobicContact CG2-CD1 4.33Å; V14-Y24 HydrophobicContact CG2-CE1 3.73Å; V14-I27 HydrophobicContact CB-CD1 4.48Å; V14-I27 HydrophobicContact CG1-CD1 3.93Å; V14-I27 HydrophobicContact CG2-CD1 3.67Å; V14-A51 HydrophobicContact CG2-CB 3.53Å; V14-S54 VanDerWaalsContact O-CB 3.31Å; V14-S54 WeakPolarHBondContact O-CB 3.37Å; V14-S54 PolarHBondContact O-OG 3.1Å
15S85.8Confident86.8Confident14 Ų1459.8 Ų59.810%0.09833%0.326CS..Hα-helixtrans-66-18.5179-70.70000113.8V11 G17 K50 A51V11-S15 WeakPolarHBondContact O-CB 3.34Å; V11-S15 PolarHBondContact O-N 3.15Å; V11-S15 PolarHBondContact O-OG 3.09Å; S15-G17 VanDerWaalsContact C-N 3.35Å; S15-K50 VanDerWaalsContact O-CE 3.28Å; S15-K50 WeakPolarHBondContact O-CE 2.97Å; S15-A51 WeakPolarHBondContact OG-CA 3.39Å; S15-A51 PolarHBondContact OG-N 2.96Å
16N83.2Confident87.2Confident100 Ų10059.3 Ų59.354%0.53532%0.315SS..THydrogen-bonded Turntrans-926.4174.4-71.2-25.3000113.1S12 K13 V14 N18S12-N16 PolarHBondContact O-N 2.81Å; S12-N16 PolarHBondContact O-ND2 3.22Å; S12-N16 VanDerWaalsContact O-ND2 3.15Å; K13-N16 PolarHBondContact O-N 3.1Å; V14-N16 PolarHBondContact O-N 3.25Å; N16-N18 VanDerWaalsContact C-N 3.3Å; N16-N18 PolarHBondContact O-N 3.04Å
17G77.4Confident87.3Confident57 Ų5755 Ų5559%0.58830%0.295SS*.THydrogen-bonded Turntrans78.89.2-179.900000114.7V14 S15V14-G17 PolarHBondContact O-N 2.99Å; S15-G17 VanDerWaalsContact C-N 3.35Å
18N80.6Confident87.5Confident118 Ų11855.1 Ų55.163%0.63130%0.295SS*.  trans-98.212.9179.8-63.6-29.2000112.7K13 N16K13-N18 WeakPolarHBondContact CE-O 3.47Å; K13-N18 HydrophobicContact CG-CB 4.3Å; K13-N18 PolarHBondContact O-N 2.65Å; N16-N18 VanDerWaalsContact C-N 3.3Å; N16-N18 PolarHBondContact O-N 3.04Å
19G81.9Confident87.5Confident25 Ų2557.4 Ų57.426%0.25831%0.309SS..  trans-82.8144.1-176.100000113.5D23G19-D23 WeakPolarHBondContact CA-OD2 3.38Å
20I86.8Confident87.6Confident89 Ų8952.4 Ų52.446%0.45628%0.282SS..  trans-105.9165.8164.158.8168.9000110.3E22 D23 Y24I20-E22 VanDerWaalsContact C-N 3.28Å; I20-E22 HydrophobicContact CD1-CB 4.09Å; I20-E22 WeakPolarHBondContact CD1-OE2 3.38Å; I20-E22 HydrophobicContact CG1-CB 4.31Å; I20-E22 PolarHBondContact O-N 3.46Å; I20-D23 WeakPolarHBondContact CG1-OD2 3.23Å; I20-D23 PolarHBondContact N-OD2 3Å; I20-D23 VanDerWaalsContact O-CB 3.3Å; I20-D23 WeakPolarHBondContact O-CB 3.26Å; I20-D23 PolarHBondContact O-N 3.06Å; I20-Y24 WeakPolarHBondContact O-CD2 3.34Å
21M84.8Confident87.6Confident48 Ų4851.6 Ų51.624%0.23628%0.278CS..Hα-helixtrans-54.1-43.9-177.9-170.353.6-120.700112.8D23 Y24 E25 I65M21-D23 PolarHBondContact O-N 3.49Å; M21-D23 VanDerWaalsContact O-N 3.16Å; M21-Y24 PolarHBondContact O-N 2.93Å; M21-E25 HydrophobicContact CE-CG 3.58Å; M21-E25 PolarHBondContact O-N 2.9Å; M21-I65 HydrophobicContact CE-CB 3.46Å; M21-I65 VanDerWaalsContact CE-CB 3.46Å; M21-I65 HydrophobicContact CE-CD1 3.15Å; M21-I65 HydrophobicContact CE-CG1 3.17Å; M21-I65 HydrophobicContact CE-CG2 3.61Å; M21-I65 HydrophobicContact SD-CD1 4.21Å
22E88.6Confident87.6Confident136 Ų13654.4 Ų54.464%0.63630%0.298SS*.Hα-helixtrans-56.8-32.5177.5-65.1163.2-176.400113I20 E25 R26I20-E22 VanDerWaalsContact C-N 3.28Å; I20-E22 HydrophobicContact CD1-CB 4.09Å; I20-E22 WeakPolarHBondContact CD1-OE2 3.38Å; I20-E22 HydrophobicContact CG1-CB 4.31Å; I20-E22 PolarHBondContact O-N 3.46Å; E22-E25 PolarHBondContact O-N 2.75Å; E22-R26 VanDerWaalsContact O-CB 3.3Å; E22-R26 WeakPolarHBondContact O-CB 3.48Å; E22-R26 PolarHBondContact O-N 3.17Å
23D91.4Very high87.7Confident16 Ų1657.1 Ų57.19%0.08631%0.307CS..Hα-helixtrans-65.2-42.5176-61.2-45.9000110.6L10 K13 V14 G19 I20 M21 R26 I27L10-D23 HydrophobicContact CD2-CB 4.19Å; K13-D23 VanDerWaalsContact CE-OD2 3.26Å; K13-D23 WeakPolarHBondContact CE-OD2 3.47Å; K13-D23 IonicContact NZ-OD1 2.87Å; K13-D23 PolarHBondContact NZ-OD1 2.84Å; K13-D23 IonicContact NZ-OD2 2.75Å; K13-D23 PolarHBondContact NZ-OD2 3.08Å; V14-D23 HydrophobicContact CG1-CB 3.59Å; G19-D23 WeakPolarHBondContact CA-OD2 3.38Å; I20-D23 WeakPolarHBondContact CG1-OD2 3.23Å; I20-D23 PolarHBondContact N-OD2 3Å; I20-D23 VanDerWaalsContact O-CB 3.3Å; I20-D23 WeakPolarHBondContact O-CB 3.26Å; I20-D23 PolarHBondContact O-N 3.06Å; M21-D23 PolarHBondContact O-N 3.49Å; M21-D23 VanDerWaalsContact O-N 3.16Å; D23-R26 PolarHBondContact O-N 3.15Å; D23-I27 VanDerWaalsContact O-CG1 3.23Å; D23-I27 WeakPolarHBondContact O-CG1 3.43Å; D23-I27 PolarHBondContact O-N 3.19Å
24Y89.9Confident87.7Confident13 Ų1354.2 Ų54.25%0.05130%0.295CS..Hα-helixtrans-69-38.8178.3-65.6-72.5000112.7V14 I20 M21 R26 I27 C28 A51 S54 I55V14-Y24 HydrophobicContact CB-CD1 4.29Å; V14-Y24 HydrophobicContact CB-CE1 3.54Å; V14-Y24 HydrophobicContact CB-CE2 4.44Å; V14-Y24 HydrophobicContact CG1-CD1 4.19Å; V14-Y24 HydrophobicContact CG1-CE1 3.89Å; V14-Y24 HydrophobicContact CG1-CE2 4.31Å; V14-Y24 HydrophobicContact CG2-CD1 4.33Å; V14-Y24 HydrophobicContact CG2-CE1 3.73Å; I20-Y24 WeakPolarHBondContact O-CD2 3.34Å; M21-Y24 PolarHBondContact O-N 2.93Å; Y24-R26 VanDerWaalsContact C-N 3.29Å; Y24-R26 PolarHBondContact O-N 2.91Å; Y24-I27 PolarHBondContact O-N 3.49Å; Y24-C28 PolarHBondContact O-N 3.43Å; Y24-C28 PolarHBondContact O-SG 3.33Å; Y24-A51 WeakPolarHBondContact CE1-O 3.47Å; Y24-S54 VanDerWaalsContact OH-C 3.3Å; Y24-S54 VanDerWaalsContact OH-CB 3.26Å; Y24-S54 WeakPolarHBondContact OH-CB 3.44Å; Y24-S54 PolarHBondContact OH-O 2.93Å; Y24-I55 HydrophobicContact CD1-CD1 3.72Å; Y24-I55 HydrophobicContact CD1-CG1 3.51Å; Y24-I55 HydrophobicContact CD2-CG1 4.24Å; Y24-I55 HydrophobicContact CE1-CD1 3.96Å; Y24-I55 HydrophobicContact CE1-CG1 3.26Å; Y24-I55 HydrophobicContact CE2-CG1 4.04Å; Y24-I55 HydrophobicContact CG-CD1 4.2Å; Y24-I55 HydrophobicContact CG-CG1 3.99Å
25E90.2Very high87.5Confident98 Ų9857.5 Ų57.546%0.45832%0.316SS..Hα-helixtrans-60.6-42.7172.9-66.8-171.6163.300111M21 E22 C28 L29 I65M21-E25 HydrophobicContact CE-CG 3.58Å; M21-E25 PolarHBondContact O-N 2.9Å; E22-E25 PolarHBondContact O-N 2.75Å; E25-C28 PolarHBondContact O-N 2.87Å; E25-L29 WeakPolarHBondContact O-CB 3.2Å; E25-L29 PolarHBondContact O-N 3.14Å; E25-I65 HydrophobicContact CG-CD1 4.3Å; E25-I65 HydrophobicContact CG-CG1 4.03Å
26R91.9Very high87.3Confident117 Ų11760 Ų6044%0.44234%0.337SS..Hα-helixtrans-65.8-44.4178.7-165.965.8175.8169.92.4111.9E6 L10 E22 D23 Y24 C28 L29 I30E6-R26 IonicContact OE1-NE 3.94Å; L10-R26 HydrophobicContact CD1-CB 4.1Å; L10-R26 HydrophobicContact CD1-CG 3.73Å; E22-R26 VanDerWaalsContact O-CB 3.3Å; E22-R26 WeakPolarHBondContact O-CB 3.48Å; E22-R26 PolarHBondContact O-N 3.17Å; D23-R26 PolarHBondContact O-N 3.15Å; Y24-R26 VanDerWaalsContact C-N 3.29Å; Y24-R26 PolarHBondContact O-N 2.91Å; R26-C28 VanDerWaalsContact C-N 3.34Å; R26-C28 PolarHBondContact O-N 3.38Å; R26-L29 PolarHBondContact O-N 3.26Å; R26-I30 HydrophobicContact CG-CD1 4.14Å; R26-I30 WeakPolarHBondContact O-CG1 3.28Å; R26-I30 PolarHBondContact O-N 2.99Å
27I91.4Very high87.2Confident0 Ų060.5 Ų60.50%034%0.344CS..Hα-helixtrans-55.9-50.4172.4-69.7164.4000109.8L10 V11 V14 D23 Y24 L29 I30 L31 L69L10-I27 HydrophobicContact CB-CD1 4.07Å; L10-I27 HydrophobicContact CB-CG1 3.77Å; L10-I27 HydrophobicContact CD1-CG1 4.36Å; V11-I27 HydrophobicContact CG2-CD1 4.08Å; V11-I27 HydrophobicContact CG2-CG1 4.26Å; V11-I27 HydrophobicContact CG2-CG2 4.25Å; V14-I27 HydrophobicContact CB-CD1 4.48Å; V14-I27 HydrophobicContact CG1-CD1 3.93Å; V14-I27 HydrophobicContact CG2-CD1 3.67Å; D23-I27 VanDerWaalsContact O-CG1 3.23Å; D23-I27 WeakPolarHBondContact O-CG1 3.43Å; D23-I27 PolarHBondContact O-N 3.19Å; Y24-I27 PolarHBondContact O-N 3.49Å; I27-L29 VanDerWaalsContact C-N 3.3Å; I27-L29 PolarHBondContact O-N 3.28Å; I27-I30 PolarHBondContact O-N 3.42Å; I27-L31 HydrophobicContact CG2-CD1 3.58Å; I27-L31 HydrophobicContact CG2-CG 4.09Å; I27-L31 WeakPolarHBondContact O-CB 3.5Å; I27-L31 VanDerWaalsContact O-CG 3.26Å; I27-L31 WeakPolarHBondContact O-CG 3.47Å; I27-L31 PolarHBondContact O-N 2.97Å; I27-L69 HydrophobicContact CG2-CD1 4.02Å
28C91.3Very high87.7Confident1 Ų159.3 Ų59.31%0.00732%0.323CS..Hα-helixtrans-58.2-42.8178.8-72.50000112.3Y24 E25 R26 S32 K68 I72Y24-C28 PolarHBondContact O-N 3.43Å; Y24-C28 PolarHBondContact O-SG 3.33Å; E25-C28 PolarHBondContact O-N 2.87Å; R26-C28 VanDerWaalsContact C-N 3.34Å; R26-C28 PolarHBondContact O-N 3.38Å; C28-S32 VanDerWaalsContact O-CB 3.26Å; C28-S32 WeakPolarHBondContact O-CB 3.35Å; C28-S32 PolarHBondContact O-N 3.18Å; C28-S32 PolarHBondContact O-OG 3.01Å; C28-K68 HydrophobicContact CB-CD 4.21Å; C28-I72 HydrophobicContact CB-CD1 4.21Å
29L89.9Confident87.9Confident86 Ų8654.1 Ų54.145%0.4530%0.295SS..Hα-helixtrans-65.4-43.1179.8-173.7147.6000111.9E25 R26 I27 N33E25-L29 WeakPolarHBondContact O-CB 3.2Å; E25-L29 PolarHBondContact O-N 3.14Å; R26-L29 PolarHBondContact O-N 3.26Å; I27-L29 VanDerWaalsContact C-N 3.3Å; I27-L29 PolarHBondContact O-N 3.28Å; L29-N33 PolarHBondContact O-ND2 3.02Å
30I91.1Very high87.8Confident14 Ų1455 Ų557%0.07230%0.298CS..Hα-helixtrans-64.5-52.3177-65.1166.1000109.8P4 V7 L10 R26 I27 S32 N33P4-I30 HydrophobicContact CG-CG2 4.13Å; V7-I30 HydrophobicContact CB-CD1 4.46Å; V7-I30 HydrophobicContact CB-CG2 4.05Å; V7-I30 HydrophobicContact CG2-CB 4.36Å; V7-I30 HydrophobicContact CG2-CG2 3.92Å; L10-I30 HydrophobicContact CD1-CD1 4.09Å; R26-I30 HydrophobicContact CG-CD1 4.14Å; R26-I30 WeakPolarHBondContact O-CG1 3.28Å; R26-I30 PolarHBondContact O-N 2.99Å; I27-I30 PolarHBondContact O-N 3.42Å; I30-S32 VanDerWaalsContact C-N 3.34Å; I30-S32 PolarHBondContact O-N 3.2Å; I30-N33 PolarHBondContact O-N 3.35Å; I30-N33 VanDerWaalsContact O-N 3.17Å
31L90.3Very high87.7Confident0 Ų052.4 Ų52.40%029%0.288CS..Hα-helixtrans-64.6-36.1-176.1-63179.5000112.6V7 I27 N33 L34 L39 V42 I48 L69 I72V7-L31 HydrophobicContact CG2-CD2 3.97Å; V7-L31 HydrophobicContact CG2-CG 4.45Å; I27-L31 HydrophobicContact CG2-CD1 3.58Å; I27-L31 HydrophobicContact CG2-CG 4.09Å; I27-L31 WeakPolarHBondContact O-CB 3.5Å; I27-L31 VanDerWaalsContact O-CG 3.26Å; I27-L31 WeakPolarHBondContact O-CG 3.47Å; I27-L31 PolarHBondContact O-N 2.97Å; L31-N33 PolarHBondContact O-N 3.2Å; L31-N33 VanDerWaalsContact O-N 3.15Å; L31-L34 HydrophobicContact CD2-CD1 3.98Å; L31-L34 PolarHBondContact O-N 3.29Å; L31-L34 VanDerWaalsContact O-N 3.14Å; L31-L39 HydrophobicContact CB-CD2 3.97Å; L31-L39 HydrophobicContact CD2-CD2 4.04Å; L31-L39 WeakPolarHBondContact O-CD2 3.39Å; L31-V42 HydrophobicContact CD2-CG1 4.02Å; L31-I48 HydrophobicContact CD1-CD1 3.85Å; L31-I48 HydrophobicContact CD1-CG2 4.49Å; L31-I48 HydrophobicContact CD2-CD1 4.19Å; L31-L69 HydrophobicContact CD1-CD1 3.76Å; L31-I72 HydrophobicContact CB-CD1 4.38Å; L31-I72 HydrophobicContact CB-CG2 3.82Å
32S89.1Confident87.7Confident62 Ų6250.1 Ų50.143%0.43428%0.276SS..Hα-helixtrans-62.9-20.9178.1-59.60000113.6C28 I30 I72C28-S32 VanDerWaalsContact O-CB 3.26Å; C28-S32 WeakPolarHBondContact O-CB 3.35Å; C28-S32 PolarHBondContact O-N 3.18Å; C28-S32 PolarHBondContact O-OG 3.01Å; I30-S32 VanDerWaalsContact C-N 3.34Å; I30-S32 PolarHBondContact O-N 3.2Å; S32-I72 WeakPolarHBondContact OG-CD1 3.25Å
33N89.2Confident87.3Confident122 Ų12244.1 Ų44.165%0.65225%0.248SC*.THydrogen-bonded Turntrans-96.6-1.2-179.3-70.7-46000113.3L29 I30 L31L29-N33 PolarHBondContact O-ND2 3.02Å; I30-N33 PolarHBondContact O-N 3.35Å; I30-N33 VanDerWaalsContact O-N 3.17Å; L31-N33 PolarHBondContact O-N 3.2Å; L31-N33 VanDerWaalsContact O-N 3.15Å
34L88.2Confident86.7Confident22 Ų2251.4 Ų51.412%0.11528%0.281CS..SBendtrans-86.7146.3177.8-64.5-177.2000111.1L31 E38 L39 V42L31-L34 HydrophobicContact CD2-CD1 3.98Å; L31-L34 PolarHBondContact O-N 3.29Å; L31-L34 VanDerWaalsContact O-N 3.14Å; L34-E38 HydrophobicContact CB-CB 3.97Å; L34-E38 HydrophobicContact CD1-CB 4.48Å; L34-E38 HydrophobicContact CD2-CB 4.17Å; L34-E38 HydrophobicContact CG-CB 4.43Å; L34-L39 HydrophobicContact CB-CD2 4.02Å; L34-L39 HydrophobicContact CB-CG 3.83Å; L34-L39 HydrophobicContact CD1-CD2 4.2Å; L34-V42 HydrophobicContact CD1-CG2 3.76Å
35T85.5Confident86.4Confident70 Ų7057.9 Ų57.943%0.42931%0.31SS..  trans-68.1160.2168.859.50000111T37 E38 L39T35-T37 PolarHBondContact O-N 2.84Å; T35-T37 PolarHBondContact OG1-OG1 3.45Å; T35-T37 VanDerWaalsContact OG1-OG1 3.1Å; T35-E38 WeakPolarHBondContact CB-OE2 3.31Å; T35-E38 WeakPolarHBondContact CG2-OE2 3.3Å; T35-E38 PolarHBondContact N-OE2 3.28Å; T35-E38 PolarHBondContact O-N 3.11Å; T35-E38 WeakPolarHBondContact OG1-CB 3.29Å; T35-E38 VanDerWaalsContact OG1-CG 3.26Å; T35-E38 WeakPolarHBondContact OG1-CG 3.49Å; T35-E38 PolarHBondContact OG1-N 3.23Å; T35-E38 PolarHBondContact OG1-OE2 2.98Å; T35-L39 WeakPolarHBondContact O-CB 3.47Å; T35-L39 PolarHBondContact O-N 3.16Å
36A79.6Confident85.9Confident66 Ų6654.2 Ų54.255%0.54530%0.295SS..Hα-helixtrans-54.9-38.3177.400000112.8S40A36-S40 PolarHBondContact O-N 3.36Å; A36-S40 PolarHBondContact O-OG 3.3Å; A36-S40 VanDerWaalsContact O-OG 3.09Å
37T83Confident85.3Confident111 Ų11151.3 Ų51.368%0.68129%0.288SS*.Hα-helixtrans-66.9-41.117642.20000113T35 S41T35-T37 PolarHBondContact O-N 2.84Å; T35-T37 PolarHBondContact OG1-OG1 3.45Å; T35-T37 VanDerWaalsContact OG1-OG1 3.1Å; T37-S41 PolarHBondContact O-N 3.02Å
38E87.2Confident84.8Confident31 Ų3151.5 Ų51.515%0.14529%0.289CS..Hα-helixtrans-67.6-45175.9-73.2160.4156.600110.1M1 I3 L34 T35 S40 S41 V42M1-E38 PolarHBondContact N-OE1 3.41Å; I3-E38 HydrophobicContact CD1-CB 4.43Å; I3-E38 HydrophobicContact CG1-CB 4.27Å; I3-E38 HydrophobicContact CG1-CG 4.34Å; L34-E38 HydrophobicContact CB-CB 3.97Å; L34-E38 HydrophobicContact CD1-CB 4.48Å; L34-E38 HydrophobicContact CD2-CB 4.17Å; L34-E38 HydrophobicContact CG-CB 4.43Å; T35-E38 WeakPolarHBondContact CB-OE2 3.31Å; T35-E38 WeakPolarHBondContact CG2-OE2 3.3Å; T35-E38 PolarHBondContact N-OE2 3.28Å; T35-E38 PolarHBondContact O-N 3.11Å; T35-E38 WeakPolarHBondContact OG1-CB 3.29Å; T35-E38 VanDerWaalsContact OG1-CG 3.26Å; T35-E38 WeakPolarHBondContact OG1-CG 3.49Å; T35-E38 PolarHBondContact OG1-N 3.23Å; T35-E38 PolarHBondContact OG1-OE2 2.98Å; E38-S40 PolarHBondContact O-N 3.15Å; E38-S41 PolarHBondContact O-N 3.08Å; E38-S41 VanDerWaalsContact O-N 3.08Å; E38-S41 PolarHBondContact O-OG 3.22Å; E38-V42 WeakPolarHBondContact O-CG2 3.29Å; E38-V42 PolarHBondContact O-N 3.44Å
39L84.7Confident84.4Confident9 Ų951.6 Ų51.65%0.04729%0.289CS..Hα-helixtrans-54.8-50.4174.4-79.7175.3000111.8L31 L34 T35 S41 V42 F43 I72 L76L31-L39 HydrophobicContact CB-CD2 3.97Å; L31-L39 HydrophobicContact CD2-CD2 4.04Å; L31-L39 WeakPolarHBondContact O-CD2 3.39Å; L34-L39 HydrophobicContact CB-CD2 4.02Å; L34-L39 HydrophobicContact CB-CG 3.83Å; L34-L39 HydrophobicContact CD1-CD2 4.2Å; T35-L39 WeakPolarHBondContact O-CB 3.47Å; T35-L39 PolarHBondContact O-N 3.16Å; L39-S41 PolarHBondContact O-N 3.22Å; L39-V42 PolarHBondContact O-N 3.13Å; L39-F43 HydrophobicContact CB-CD2 4.23Å; L39-F43 HydrophobicContact CB-CE2 3.82Å; L39-F43 HydrophobicContact CD2-CE2 3.98Å; L39-F43 HydrophobicContact CD2-CZ 4.08Å; L39-F43 HydrophobicContact CG-CE2 4.4Å; L39-F43 WeakPolarHBondContact O-CD2 3.5Å; L39-F43 WeakPolarHBondContact O-CG 3.14Å; L39-F43 PolarHBondContact O-N 3.38Å; L39-I72 HydrophobicContact CD1-CG2 4.24Å; L39-I72 HydrophobicContact CD2-CG2 3.96Å; L39-L76 HydrophobicContact CB-CD2 3.85Å
40S80.4Confident84.1Confident45 Ų4552.1 Ų52.132%0.31529%0.288SS..Hα-helixtrans-55.2-40.2176.3-66.20000112.3A36 E38 F43 Q44A36-S40 PolarHBondContact O-N 3.36Å; A36-S40 PolarHBondContact O-OG 3.3Å; A36-S40 VanDerWaalsContact O-OG 3.09Å; E38-S40 PolarHBondContact O-N 3.15Å; S40-F43 PolarHBondContact O-N 3.49Å; S40-Q44 WeakPolarHBondContact O-CG 3.44Å; S40-Q44 PolarHBondContact O-N 2.99Å
41S83.9Confident83.8Confident34 Ų3451.4 Ų51.424%0.23829%0.285CS..Hα-helixtrans-71.2-30.5178.175.60000113.6I3 T37 E38 L39 K45I3-S41 WeakPolarHBondContact CD1-OG 3.03Å; T37-S41 PolarHBondContact O-N 3.02Å; E38-S41 PolarHBondContact O-N 3.08Å; E38-S41 VanDerWaalsContact O-N 3.08Å; E38-S41 PolarHBondContact O-OG 3.22Å; L39-S41 PolarHBondContact O-N 3.22Å; S41-K45 WeakPolarHBondContact O-CG 3.3Å
42V84.7Confident83.5Confident0 Ų051.4 Ų51.40%029%0.285CS..Hα-helixtrans-68.5-47.4172178.90000110.1I3 V7 F8 L31 L34 E38 L39 Q44 K45 C46 I48I3-V42 HydrophobicContact CD1-CG2 4.01Å; I3-V42 HydrophobicContact CG1-CG2 4.41Å; I3-V42 HydrophobicContact CG2-CG2 3.69Å; V7-V42 HydrophobicContact CG1-CG1 4.38Å; F8-V42 HydrophobicContact CE1-CG1 4.36Å; F8-V42 HydrophobicContact CZ-CG2 4.45Å; L31-V42 HydrophobicContact CD2-CG1 4.02Å; L34-V42 HydrophobicContact CD1-CG2 3.76Å; E38-V42 WeakPolarHBondContact O-CG2 3.29Å; E38-V42 PolarHBondContact O-N 3.44Å; L39-V42 PolarHBondContact O-N 3.13Å; V42-Q44 VanDerWaalsContact C-N 3.27Å; V42-Q44 PolarHBondContact O-N 2.93Å; V42-K45 PolarHBondContact O-N 3.48Å; V42-C46 PolarHBondContact O-N 3.46Å; V42-I48 HydrophobicContact CG1-CD1 3.63Å
43F81.1Confident83.2Confident9 Ų951 Ų514%0.03928%0.276CS..Hα-helixtrans-65.2-27.9-179.8-63.3-53000113.3L39 S40 K45 C46 I48 V73 L76L39-F43 HydrophobicContact CB-CD2 4.23Å; L39-F43 HydrophobicContact CB-CE2 3.82Å; L39-F43 HydrophobicContact CD2-CE2 3.98Å; L39-F43 HydrophobicContact CD2-CZ 4.08Å; L39-F43 HydrophobicContact CG-CE2 4.4Å; L39-F43 WeakPolarHBondContact O-CD2 3.5Å; L39-F43 WeakPolarHBondContact O-CG 3.14Å; L39-F43 PolarHBondContact O-N 3.38Å; S40-F43 PolarHBondContact O-N 3.49Å; F43-K45 VanDerWaalsContact C-N 3.29Å; F43-K45 PolarHBondContact O-N 3.33Å; F43-C46 VanDerWaalsContact O-O 3.11Å; F43-I48 HydrophobicContact CD1-CB 3.79Å; F43-I48 HydrophobicContact CD1-CD1 3.31Å; F43-I48 HydrophobicContact CD1-CG1 3.88Å; F43-I48 HydrophobicContact CD1-CG2 4.43Å; F43-I48 HydrophobicContact CE1-CB 3.71Å; F43-I48 HydrophobicContact CE1-CD1 3.18Å; F43-I48 HydrophobicContact CE1-CG1 3.91Å; F43-I48 HydrophobicContact CE1-CG2 3.84Å; F43-I48 HydrophobicContact CG-CD1 4.46Å; F43-I48 HydrophobicContact CZ-CD1 4.28Å; F43-V73 HydrophobicContact CE1-CB 4.46Å; F43-V73 HydrophobicContact CE1-CG2 3.79Å; F43-V73 HydrophobicContact CZ-CB 4.32Å; F43-V73 HydrophobicContact CZ-CG2 3.98Å; F43-L76 HydrophobicContact CD2-CD1 3.18Å; F43-L76 HydrophobicContact CD2-CD2 3.76Å; F43-L76 HydrophobicContact CD2-CG 3.83Å; F43-L76 HydrophobicContact CE2-CD1 3.44Å; F43-L76 VanDerWaalsContact CE2-CD1 3.44Å; F43-L76 HydrophobicContact CE2-CD2 3.68Å; F43-L76 HydrophobicContact CE2-CG 3.64Å; F43-L76 HydrophobicContact CG-CD1 4.07Å; F43-L76 HydrophobicContact CZ-CD1 4.5Å
44Q79.3Confident83Confident169 Ų16947.2 Ų47.279%0.7926%0.26SS*.Hα-helixtrans-71.2-23171.7-77.2177.4-3.100113.7S40 V42S40-Q44 WeakPolarHBondContact O-CG 3.44Å; S40-Q44 PolarHBondContact O-N 2.99Å; V42-Q44 VanDerWaalsContact C-N 3.27Å; V42-Q44 PolarHBondContact O-N 2.93Å
45K82.7Confident82.7Confident150 Ų15046.3 Ų46.365%0.65226%0.255SS*.Hα-helixtrans-99.8-23.4-177.3-72.3179.2177.7-175.40113.2F8 S41 V42 F43F8-K45 HydrophobicContact CD1-CB 4.27Å; F8-K45 HydrophobicContact CE1-CB 3.74Å; F8-K45 HydrophobicContact CE1-CD 3.66Å; F8-K45 HydrophobicContact CE1-CG 4.37Å; F8-K45 HydrophobicContact CZ-CD 3.87Å; S41-K45 WeakPolarHBondContact O-CG 3.3Å; V42-K45 PolarHBondContact O-N 3.48Å; F43-K45 VanDerWaalsContact C-N 3.29Å; F43-K45 PolarHBondContact O-N 3.33Å
46C80.6Confident82.4Confident21 Ų2147.5 Ų47.514%0.14226%0.258CS..SBendtrans-134.1139.4-175.6-78.50000112.5F8 V11 V42 F43 I48F8-C46 WeakPolarHBondContact CD1-SG 3.33Å; V11-C46 HydrophobicContact CB-CB 4.45Å; V11-C46 HydrophobicContact CG1-CB 3.79Å; V42-C46 PolarHBondContact O-N 3.46Å; F43-C46 VanDerWaalsContact O-O 3.11Å; C46-I48 VanDerWaalsContact C-N 3.35Å; C46-I48 HydrophobicContact CB-CG1 4.22Å; C46-I48 PolarHBondContact O-N 3.16Å
47D78Confident82.4Confident56 Ų5645.9 Ų45.930%0.29924%0.24SC..  trans-8081.9170.1-172.5-8.2000110.6L49 K50 A51D47-L49 PolarHBondContact O-N 2.97Å; D47-L49 PolarHBondContact OD1-N 3.48Å; D47-K50 HydrophobicContact CB-CB 4.05Å; D47-K50 WeakPolarHBondContact O-CB 3.44Å; D47-K50 PolarHBondContact O-N 2.93Å; D47-K50 PolarHBondContact OD1-N 3.07Å; D47-K50 VanDerWaalsContact OD2-CB 3.29Å; D47-K50 WeakPolarHBondContact OD2-CB 3.26Å; D47-A51 PolarHBondContact O-N 3.32Å
48I81.6Confident82.1Confident3 Ų349 Ų492%0.01525%0.247CC..Hα-helixtrans-71-21.4177.9-67.9175.5000111.3V11 L31 V42 F43 C46 K50 A51 L52 L69 V73V11-I48 HydrophobicContact CG1-CG1 4.04Å; V11-I48 HydrophobicContact CG2-CD1 4.4Å; V11-I48 HydrophobicContact CG2-CG1 4.11Å; L31-I48 HydrophobicContact CD1-CD1 3.85Å; L31-I48 HydrophobicContact CD1-CG2 4.49Å; L31-I48 HydrophobicContact CD2-CD1 4.19Å; V42-I48 HydrophobicContact CG1-CD1 3.63Å; F43-I48 HydrophobicContact CD1-CB 3.79Å; F43-I48 HydrophobicContact CD1-CD1 3.31Å; F43-I48 HydrophobicContact CD1-CG1 3.88Å; F43-I48 HydrophobicContact CD1-CG2 4.43Å; F43-I48 HydrophobicContact CE1-CB 3.71Å; F43-I48 HydrophobicContact CE1-CD1 3.18Å; F43-I48 HydrophobicContact CE1-CG1 3.91Å; F43-I48 HydrophobicContact CE1-CG2 3.84Å; F43-I48 HydrophobicContact CG-CD1 4.46Å; F43-I48 HydrophobicContact CZ-CD1 4.28Å; C46-I48 VanDerWaalsContact C-N 3.35Å; C46-I48 HydrophobicContact CB-CG1 4.22Å; C46-I48 PolarHBondContact O-N 3.16Å; I48-K50 VanDerWaalsContact C-N 3.34Å; I48-A51 WeakPolarHBondContact O-CB 3.35Å; I48-A51 PolarHBondContact O-N 2.98Å; I48-L52 WeakPolarHBondContact O-CB 3.3Å; I48-L52 PolarHBondContact O-N 2.95Å; I48-L69 HydrophobicContact CG2-CD1 4.01Å; I48-L69 HydrophobicContact CG2-CD2 4.39Å; I48-L69 HydrophobicContact CG2-CG 4.32Å; I48-V73 HydrophobicContact CB-CG2 4.5Å; I48-V73 HydrophobicContact CG2-CG2 3.6Å
49L82.9Confident81.8Confident3 Ų350.8 Ų50.82%0.01626%0.257CS..Hα-helixtrans-70.1-33.7173.1-69.5175.3000111.4D47 L52 M53 V73 F74 F82 H86 E89 L90 I93D47-L49 PolarHBondContact O-N 2.97Å; D47-L49 PolarHBondContact OD1-N 3.48Å; L49-L52 HydrophobicContact CD2-CD2 4.08Å; L49-L52 WeakPolarHBondContact O-CB 3.43Å; L49-L52 PolarHBondContact O-N 3.44Å; L49-M53 WeakPolarHBondContact O-CB 3.2Å; L49-M53 WeakPolarHBondContact O-CG 3.26Å; L49-M53 PolarHBondContact O-N 2.86Å; L49-V73 HydrophobicContact CD2-CG1 3.89Å; L49-F74 HydrophobicContact CD2-CE2 4.49Å; L49-F82 HydrophobicContact CD1-CE1 4.35Å; L49-F82 HydrophobicContact CD1-CZ 3.76Å; L49-F82 HydrophobicContact CD2-CZ 4.14Å; L49-F82 HydrophobicContact CG-CZ 4.06Å; L49-H86 HydrophobicContact CD1-CB 3.55Å; L49-E89 HydrophobicContact CB-CB 3.64Å; L49-E89 HydrophobicContact CB-CG 4.2Å; L49-E89 HydrophobicContact CD1-CB 3.46Å; L49-E89 VanDerWaalsContact CD1-CB 3.46Å; L49-E89 HydrophobicContact CD1-CG 4.32Å; L49-E89 HydrophobicContact CG-CB 4.22Å; L49-L90 HydrophobicContact CD1-CD2 4.11Å; L49-L90 HydrophobicContact CD1-CG 4.15Å; L49-L90 HydrophobicContact CD2-CD2 4.37Å; L49-I93 HydrophobicContact CB-CD1 4.38Å; L49-I93 HydrophobicContact CD2-CD1 3.81Å
50K83.2Confident81.6Confident97 Ų9758.8 Ų58.842%0.42229%0.292SS..Hα-helixtrans-63.4-41.4168.7-172.6175.3-175.7-170.30112.2S15 D47 I48 L52 M53 S54S15-K50 VanDerWaalsContact O-CE 3.28Å; S15-K50 WeakPolarHBondContact O-CE 2.97Å; D47-K50 HydrophobicContact CB-CB 4.05Å; D47-K50 WeakPolarHBondContact O-CB 3.44Å; D47-K50 PolarHBondContact O-N 2.93Å; D47-K50 PolarHBondContact OD1-N 3.07Å; D47-K50 VanDerWaalsContact OD2-CB 3.29Å; D47-K50 WeakPolarHBondContact OD2-CB 3.26Å; I48-K50 VanDerWaalsContact C-N 3.34Å; K50-L52 VanDerWaalsContact C-N 3.32Å; K50-L52 PolarHBondContact O-N 2.9Å; K50-M53 CarbonylContact O-C 3.48Å; K50-M53 WeakPolarHBondContact O-CA 3.44Å; K50-M53 WeakPolarHBondContact O-CB 3.26Å; K50-M53 PolarHBondContact O-N 3.25Å; K50-M53 VanDerWaalsContact O-N 3.1Å; K50-S54 PolarHBondContact O-N 3.42Å; K50-S54 PolarHBondContact O-OG 3.36Å; K50-S54 VanDerWaalsContact O-OG 3.13Å
51A83.7Confident81.8Confident0 Ų062.9 Ų62.90%031%0.306CS..Hα-helixtrans-58.5-45.6173.900000111.4V11 V14 S15 Y24 D47 I48 M53 S54 I55V11-A51 HydrophobicContact CG1-CB 4.35Å; V14-A51 HydrophobicContact CG2-CB 3.53Å; S15-A51 WeakPolarHBondContact OG-CA 3.39Å; S15-A51 PolarHBondContact OG-N 2.96Å; Y24-A51 WeakPolarHBondContact CE1-O 3.47Å; D47-A51 PolarHBondContact O-N 3.32Å; I48-A51 WeakPolarHBondContact O-CB 3.35Å; I48-A51 PolarHBondContact O-N 2.98Å; A51-M53 VanDerWaalsContact C-N 3.31Å; A51-M53 PolarHBondContact O-N 2.64Å; A51-S54 WeakPolarHBondContact O-CB 3.3Å; A51-S54 PolarHBondContact O-N 2.93Å; A51-S54 VanDerWaalsContact O-N 3.08Å; A51-I55 PolarHBondContact O-N 3.33Å
52L85.1Confident81.8Confident0 Ų061.9 Ų61.90%030%0.299CS..Hα-helixtrans-61-38.2174.7-175.367.5000112.2I48 L49 K50 S54 I55 A66 L69 A70 I93 K98 L101I48-L52 WeakPolarHBondContact O-CB 3.3Å; I48-L52 PolarHBondContact O-N 2.95Å; L49-L52 HydrophobicContact CD2-CD2 4.08Å; L49-L52 WeakPolarHBondContact O-CB 3.43Å; L49-L52 PolarHBondContact O-N 3.44Å; K50-L52 VanDerWaalsContact C-N 3.32Å; K50-L52 PolarHBondContact O-N 2.9Å; L52-S54 VanDerWaalsContact C-N 3.29Å; L52-S54 PolarHBondContact O-N 3.48Å; L52-I55 HydrophobicContact CD1-CD1 4.18Å; L52-I55 PolarHBondContact O-N 2.9Å; L52-A66 HydrophobicContact CD1-CB 4.02Å; L52-A66 VanDerWaalsContact CD1-O 3.23Å; L52-A66 WeakPolarHBondContact CD1-O 3.37Å; L52-L69 HydrophobicContact CB-CD2 4.22Å; L52-L69 HydrophobicContact CD1-CB 4.13Å; L52-L69 HydrophobicContact CD1-CD2 4.11Å; L52-L69 HydrophobicContact CD1-CG 4.26Å; L52-A70 HydrophobicContact CD1-CB 4.23Å; L52-A70 HydrophobicContact CD2-CB 4.04Å; L52-I93 HydrophobicContact CD2-CD1 4.22Å; L52-K98 PolarHBondContact O-NZ 3.28Å; L52-K98 VanDerWaalsContact O-NZ 3.09Å; L52-L101 HydrophobicContact CD1-CD1 4.2Å; L52-L101 HydrophobicContact CD1-CD2 4.29Å; L52-L101 HydrophobicContact CD2-CD1 3.77Å; L52-L101 HydrophobicContact CD2-CD2 3.88Å; L52-L101 HydrophobicContact CD2-CG 4.44Å; L52-L101 HydrophobicContact CG-CD1 4.16Å; L52-L101 HydrophobicContact CG-CD2 3.7Å
53M82.9Confident81.7Confident52 Ų5262.5 Ų62.526%0.25630%0.304SS..Hα-helixtrans-71-19173.7-79-62.9-74.600114.1L49 K50 A51 L92 I93 K98L49-M53 WeakPolarHBondContact O-CB 3.2Å; L49-M53 WeakPolarHBondContact O-CG 3.26Å; L49-M53 PolarHBondContact O-N 2.86Å; K50-M53 CarbonylContact O-C 3.48Å; K50-M53 WeakPolarHBondContact O-CA 3.44Å; K50-M53 WeakPolarHBondContact O-CB 3.26Å; K50-M53 PolarHBondContact O-N 3.25Å; K50-M53 VanDerWaalsContact O-N 3.1Å; A51-M53 VanDerWaalsContact C-N 3.31Å; A51-M53 PolarHBondContact O-N 2.64Å; M53-L92 HydrophobicContact CE-CB 4.35Å; M53-I93 HydrophobicContact CG-CD1 4.31Å; M53-I93 HydrophobicContact CG-CG1 3.52Å; M53-I93 HydrophobicContact SD-CB 4.05Å; M53-I93 HydrophobicContact SD-CG1 3.34Å; M53-I93 WeakPolarHBondContact SD-CG1 3.36Å; M53-I93 HydrophobicContact SD-CG2 4.47Å; M53-K98 VanDerWaalsContact O-CE 3.22Å; M53-K98 WeakPolarHBondContact O-CE 3.26Å; M53-K98 PolarHBondContact O-NZ 3.17Å; M53-K98 HydrophobicContact SD-CD 3.92Å
54S84.2Confident82Confident44 Ų4468.6 Ų68.631%0.30833%0.333SS..Hα-helixtrans-84-15.4174-61.20000113.8V14 Y24 K50 A51 L52 D56V14-S54 VanDerWaalsContact O-CB 3.31Å; V14-S54 WeakPolarHBondContact O-CB 3.37Å; V14-S54 PolarHBondContact O-OG 3.1Å; Y24-S54 VanDerWaalsContact OH-C 3.3Å; Y24-S54 VanDerWaalsContact OH-CB 3.26Å; Y24-S54 WeakPolarHBondContact OH-CB 3.44Å; Y24-S54 PolarHBondContact OH-O 2.93Å; K50-S54 PolarHBondContact O-N 3.42Å; K50-S54 PolarHBondContact O-OG 3.36Å; K50-S54 VanDerWaalsContact O-OG 3.13Å; A51-S54 WeakPolarHBondContact O-CB 3.3Å; A51-S54 PolarHBondContact O-N 2.93Å; A51-S54 VanDerWaalsContact O-N 3.08Å; L52-S54 VanDerWaalsContact C-N 3.29Å; L52-S54 PolarHBondContact O-N 3.48Å; S54-D56 PolarHBondContact O-N 3.41Å
55I82.9Confident82.4Confident3 Ų361.4 Ų61.42%0.01530%0.3CS..SBendtrans-68.9122.4179.4-56.1174.4000110.4Y24 A51 L52 L57 A66 L69 K98Y24-I55 HydrophobicContact CD1-CD1 3.72Å; Y24-I55 HydrophobicContact CD1-CG1 3.51Å; Y24-I55 HydrophobicContact CD2-CG1 4.24Å; Y24-I55 HydrophobicContact CE1-CD1 3.96Å; Y24-I55 HydrophobicContact CE1-CG1 3.26Å; Y24-I55 HydrophobicContact CE2-CG1 4.04Å; Y24-I55 HydrophobicContact CG-CD1 4.2Å; Y24-I55 HydrophobicContact CG-CG1 3.99Å; A51-I55 PolarHBondContact O-N 3.33Å; L52-I55 HydrophobicContact CD1-CD1 4.18Å; L52-I55 PolarHBondContact O-N 2.9Å; I55-L57 HydrophobicContact CB-CD2 4.15Å; I55-L57 HydrophobicContact CG2-CD2 3.74Å; I55-L57 PolarHBondContact O-N 3.34Å; I55-A66 HydrophobicContact CB-CB 4.47Å; I55-A66 HydrophobicContact CD1-CB 3.87Å; I55-A66 HydrophobicContact CG2-CB 4.23Å; I55-L69 HydrophobicContact CD1-CD2 4.1Å; I55-K98 PolarHBondContact O-NZ 2.98Å
56D79Confident82.6Confident94 Ų9454.2 Ų54.250%0.50327%0.268SS..  trans-68.9125168.7-173.9-6.9000109.8S54 H58 S62S54-D56 PolarHBondContact O-N 3.41Å; D56-H58 WeakPolarHBondContact OD1-CB 3.41Å; D56-H58 IonicContact OD1-CD2 3.54Å; D56-H58 PolarHBondContact OD1-CD2 3.13Å; D56-H58 IonicContact OD1-CG 3.24Å; D56-H58 VanDerWaalsContact OD1-CG 3.24Å; D56-H58 PolarHBondContact OD1-N 3.34Å; D56-H58 IonicContact OD1-NE2 3.7Å; D56-H58 IonicContact OD2-CD2 3.44Å; D56-H58 PolarHBondContact OD2-CD2 3.43Å; D56-S62 WeakPolarHBondContact O-CB 3.4Å
57L80.2Confident83Confident32 Ų3255.7 Ų55.717%0.16827%0.274CS..  trans-102.716-177.3-53-174.3000113.2I55 D59 A66 K98 L101I55-L57 HydrophobicContact CB-CD2 4.15Å; I55-L57 HydrophobicContact CG2-CD2 3.74Å; I55-L57 PolarHBondContact O-N 3.34Å; L57-D59 VanDerWaalsContact C-N 3.31Å; L57-D59 PolarHBondContact O-N 3.08Å; L57-A66 HydrophobicContact CD2-CB 3.33Å; L57-K98 HydrophobicContact CD1-CB 3.58Å; L57-K98 HydrophobicContact CD1-CD 3.83Å; L57-K98 HydrophobicContact CD1-CG 3.8Å; L57-K98 HydrophobicContact CG-CD 4.27Å; L57-K98 HydrophobicContact CG-CG 4.4Å; L57-L101 HydrophobicContact CD1-CB 4.2Å
58H75.8Confident83.5Confident178 Ų17858.2 Ų58.282%0.82428%0.282SS*.SBendtrans-66.1-30.6-179.4-75-48.5000113.7D56D56-H58 WeakPolarHBondContact OD1-CB 3.41Å; D56-H58 IonicContact OD1-CD2 3.54Å; D56-H58 PolarHBondContact OD1-CD2 3.13Å; D56-H58 IonicContact OD1-CG 3.24Å; D56-H58 VanDerWaalsContact OD1-CG 3.24Å; D56-H58 PolarHBondContact OD1-N 3.34Å; D56-H58 IonicContact OD1-NE2 3.7Å; D56-H58 IonicContact OD2-CD2 3.44Å; D56-H58 PolarHBondContact OD2-CD2 3.43Å
59D81.5Confident83.9Confident67 Ų6758 Ų5836%0.35828%0.282SS..SBendtrans-106.7157.8178.280.685.4000113.2L57 Q61 S62 A63L57-D59 VanDerWaalsContact C-N 3.31Å; L57-D59 PolarHBondContact O-N 3.08Å; D59-Q61 VanDerWaalsContact C-N 3.33Å; D59-Q61 PolarHBondContact O-N 3.44Å; D59-Q61 WeakPolarHBondContact OD1-CA 3.31Å; D59-Q61 VanDerWaalsContact OD1-CB 3.3Å; D59-Q61 WeakPolarHBondContact OD1-CB 3.34Å; D59-Q61 PolarHBondContact OD1-N 2.99Å; D59-S62 PolarHBondContact OD1-N 3.48Å; D59-S62 PolarHBondContact OD1-OG 3.48Å; D59-S62 VanDerWaalsContact OD2-CB 3.23Å; D59-S62 WeakPolarHBondContact OD2-CB 3.41Å; D59-S62 PolarHBondContact OD2-OG 3.09Å; D59-A63 WeakPolarHBondContact O-CB 3.5Å; D59-A63 PolarHBondContact O-N 3.01Å; D59-A63 VanDerWaalsContact O-N 3.09Å
60K80.1Confident84.2Confident178 Ų17857.9 Ų57.977%0.77428%0.281SS*.Hα-helixtrans-65.3-31.8-176.2-72-175.2178.4179.80113.5Q64K60-Q64 VanDerWaalsContact O-CG 3.29Å; K60-Q64 WeakPolarHBondContact O-CG 3.47Å; K60-Q64 PolarHBondContact O-N 2.86Å; K60-Q64 VanDerWaalsContact O-N 3.1Å
61Q84.2Confident84.5Confident131 Ų13155.8 Ų55.861%0.61228%0.278SS*.Hα-helixtrans-72-50.5-178.9-65.6179.2-20.700109.4D59 A63 Q64 I65D59-Q61 VanDerWaalsContact C-N 3.33Å; D59-Q61 PolarHBondContact O-N 3.44Å; D59-Q61 WeakPolarHBondContact OD1-CA 3.31Å; D59-Q61 VanDerWaalsContact OD1-CB 3.3Å; D59-Q61 WeakPolarHBondContact OD1-CB 3.34Å; D59-Q61 PolarHBondContact OD1-N 2.99Å; Q61-A63 VanDerWaalsContact C-N 3.27Å; Q61-A63 PolarHBondContact O-N 3.34Å; Q61-Q64 WeakPolarHBondContact O-CA 3.44Å; Q61-Q64 WeakPolarHBondContact O-CB 3.49Å; Q61-Q64 PolarHBondContact O-N 3.29Å; Q61-I65 WeakPolarHBondContact O-CD1 3.46Å; Q61-I65 PolarHBondContact O-N 3.1Å
62S83.9Confident84.7Confident13 Ų1356.5 Ų56.59%0.09128%0.282CS..Hα-helixtrans-60.7-37.7178.4-54.70000112.2D56 D59 I65 A66D56-S62 WeakPolarHBondContact O-CB 3.4Å; D59-S62 PolarHBondContact OD1-N 3.48Å; D59-S62 PolarHBondContact OD1-OG 3.48Å; D59-S62 VanDerWaalsContact OD2-CB 3.23Å; D59-S62 WeakPolarHBondContact OD2-CB 3.41Å; D59-S62 PolarHBondContact OD2-OG 3.09Å; S62-I65 PolarHBondContact O-N 2.92Å; S62-A66 WeakPolarHBondContact O-CB 3.41Å; S62-A66 PolarHBondContact O-N 2.63Å
63A83.6Confident84.7Confident13 Ų1356.5 Ų56.511%0.10728%0.282CS..Hα-helixtrans-58.8-47.5170.200000112.5D59 Q61 I65 A66 I67D59-A63 WeakPolarHBondContact O-CB 3.5Å; D59-A63 PolarHBondContact O-N 3.01Å; D59-A63 VanDerWaalsContact O-N 3.09Å; Q61-A63 VanDerWaalsContact C-N 3.27Å; Q61-A63 PolarHBondContact O-N 3.34Å; A63-I65 PolarHBondContact O-N 2.85Å; A63-A66 PolarHBondContact O-N 3.08Å; A63-I67 VanDerWaalsContact O-CG1 3.32Å; A63-I67 WeakPolarHBondContact O-CG1 3.34Å; A63-I67 PolarHBondContact O-N 3.13Å
64Q86.7Confident84.8Confident137 Ų13754.1 Ų54.164%0.6427%0.27SS*.Hα-helixtrans-61.3-42.2177.7-76.5175.3-0.300112.7K60 Q61 I67 K68K60-Q64 VanDerWaalsContact O-CG 3.29Å; K60-Q64 WeakPolarHBondContact O-CG 3.47Å; K60-Q64 PolarHBondContact O-N 2.86Å; K60-Q64 VanDerWaalsContact O-N 3.1Å; Q61-Q64 WeakPolarHBondContact O-CA 3.44Å; Q61-Q64 WeakPolarHBondContact O-CB 3.49Å; Q61-Q64 PolarHBondContact O-N 3.29Å; Q64-I67 PolarHBondContact O-N 2.86Å; Q64-K68 WeakPolarHBondContact O-CB 3.4Å; Q64-K68 PolarHBondContact O-N 3.27Å
65I87.4Confident84.8Confident17 Ų1755 Ų559%0.08728%0.276CS..Hα-helixtrans-67.4-40.7176.2-74.593.1000111.3M21 E25 Q61 S62 A63 I67 K68 L69M21-I65 HydrophobicContact CE-CB 3.46Å; M21-I65 VanDerWaalsContact CE-CB 3.46Å; M21-I65 HydrophobicContact CE-CD1 3.15Å; M21-I65 HydrophobicContact CE-CG1 3.17Å; M21-I65 HydrophobicContact CE-CG2 3.61Å; M21-I65 HydrophobicContact SD-CD1 4.21Å; E25-I65 HydrophobicContact CG-CD1 4.3Å; E25-I65 HydrophobicContact CG-CG1 4.03Å; Q61-I65 WeakPolarHBondContact O-CD1 3.46Å; Q61-I65 PolarHBondContact O-N 3.1Å; S62-I65 PolarHBondContact O-N 2.92Å; A63-I65 PolarHBondContact O-N 2.85Å; I65-I67 VanDerWaalsContact C-N 3.31Å; I65-I67 PolarHBondContact O-N 3.44Å; I65-K68 WeakPolarHBondContact O-CB 3.22Å; I65-K68 PolarHBondContact O-N 3.39Å; I65-K68 VanDerWaalsContact O-N 3.13Å; I65-L69 WeakPolarHBondContact O-CB 3.42Å; I65-L69 PolarHBondContact O-N 3.41Å
66A87.5Confident84.3Confident0 Ų055.2 Ų55.20%028%0.278CS..Hα-helixtrans-59.2-43.8175.300000111.6L52 I55 L57 S62 A63 K68 L69 A70L52-A66 HydrophobicContact CD1-CB 4.02Å; L52-A66 VanDerWaalsContact CD1-O 3.23Å; L52-A66 WeakPolarHBondContact CD1-O 3.37Å; I55-A66 HydrophobicContact CB-CB 4.47Å; I55-A66 HydrophobicContact CD1-CB 3.87Å; I55-A66 HydrophobicContact CG2-CB 4.23Å; L57-A66 HydrophobicContact CD2-CB 3.33Å; S62-A66 WeakPolarHBondContact O-CB 3.41Å; S62-A66 PolarHBondContact O-N 2.63Å; A63-A66 PolarHBondContact O-N 3.08Å; A66-K68 VanDerWaalsContact C-N 3.34Å; A66-K68 PolarHBondContact O-N 2.98Å; A66-L69 PolarHBondContact O-N 2.94Å; A66-A70 VanDerWaalsContact O-CB 3.25Å; A66-A70 WeakPolarHBondContact O-CB 3.37Å; A66-A70 PolarHBondContact O-N 2.74Å
67I88.5Confident84Confident51 Ų5157.1 Ų57.126%0.26229%0.286SS..Hα-helixtrans-64-39.1174.9-64.1-52.2000111.7A63 Q64 I65 S71 F104A63-I67 VanDerWaalsContact O-CG1 3.32Å; A63-I67 WeakPolarHBondContact O-CG1 3.34Å; A63-I67 PolarHBondContact O-N 3.13Å; Q64-I67 PolarHBondContact O-N 2.86Å; I65-I67 VanDerWaalsContact C-N 3.31Å; I65-I67 PolarHBondContact O-N 3.44Å; I67-S71 WeakPolarHBondContact O-CB 3.45Å; I67-S71 PolarHBondContact O-N 3.4Å; I67-S71 PolarHBondContact O-OG 2.79Å; I67-F104 HydrophobicContact CD1-CB 3.68Å; I67-F104 HydrophobicContact CD1-CD2 4.3Å; I67-F104 HydrophobicContact CD1-CG 4.07Å; I67-F104 HydrophobicContact CG2-CD2 3.9Å; I67-F104 HydrophobicContact CG2-CE2 4.24Å
68K89.6Confident83.9Confident109 Ų10959.9 Ų59.947%0.47431%0.306SS..Hα-helixtrans-64-46.6175.6-173178.6-179.2-178.30111.4C28 Q64 I65 A66 S71 I72C28-K68 HydrophobicContact CB-CD 4.21Å; Q64-K68 WeakPolarHBondContact O-CB 3.4Å; Q64-K68 PolarHBondContact O-N 3.27Å; I65-K68 WeakPolarHBondContact O-CB 3.22Å; I65-K68 PolarHBondContact O-N 3.39Å; I65-K68 VanDerWaalsContact O-N 3.13Å; A66-K68 VanDerWaalsContact C-N 3.34Å; A66-K68 PolarHBondContact O-N 2.98Å; K68-S71 WeakPolarHBondContact O-CB 3.41Å; K68-S71 PolarHBondContact O-N 3.35Å; K68-I72 WeakPolarHBondContact O-CG1 3.43Å; K68-I72 PolarHBondContact O-N 3.18Å
69L89.3Confident84.3Confident0 Ų051.5 Ų51.50%027%0.267CS..Hα-helixtrans-62.1-47.1177-176.358.8000110.7I27 L31 I48 L52 I55 I65 A66 S71 I72 V73I27-L69 HydrophobicContact CG2-CD1 4.02Å; L31-L69 HydrophobicContact CD1-CD1 3.76Å; I48-L69 HydrophobicContact CG2-CD1 4.01Å; I48-L69 HydrophobicContact CG2-CD2 4.39Å; I48-L69 HydrophobicContact CG2-CG 4.32Å; L52-L69 HydrophobicContact CB-CD2 4.22Å; L52-L69 HydrophobicContact CD1-CB 4.13Å; L52-L69 HydrophobicContact CD1-CD2 4.11Å; L52-L69 HydrophobicContact CD1-CG 4.26Å; I55-L69 HydrophobicContact CD1-CD2 4.1Å; I65-L69 WeakPolarHBondContact O-CB 3.42Å; I65-L69 PolarHBondContact O-N 3.41Å; A66-L69 PolarHBondContact O-N 2.94Å; L69-S71 VanDerWaalsContact C-N 3.27Å; L69-S71 PolarHBondContact O-N 2.95Å; L69-I72 PolarHBondContact O-N 3.31Å; L69-I72 VanDerWaalsContact O-N 3.1Å; L69-V73 VanDerWaalsContact O-CG2 3.3Å; L69-V73 WeakPolarHBondContact O-CG2 3.24Å; L69-V73 PolarHBondContact O-N 3.07Å
70A89.2Confident84.4Confident0 Ų048.8 Ų48.80%025%0.252CS..Hα-helixtrans-59-39.2174.800000111.6L52 A66 I72 V73 F74 L101 F104L52-A70 HydrophobicContact CD1-CB 4.23Å; L52-A70 HydrophobicContact CD2-CB 4.04Å; A66-A70 VanDerWaalsContact O-CB 3.25Å; A66-A70 WeakPolarHBondContact O-CB 3.37Å; A66-A70 PolarHBondContact O-N 2.74Å; A70-I72 VanDerWaalsContact C-N 3.31Å; A70-I72 PolarHBondContact O-N 2.94Å; A70-V73 PolarHBondContact O-N 3.04Å; A70-F74 WeakPolarHBondContact O-CB 3.5Å; A70-F74 VanDerWaalsContact O-CD2 3.25Å; A70-F74 WeakPolarHBondContact O-CD2 3.47Å; A70-F74 PolarHBondContact O-N 3.13Å; A70-L101 HydrophobicContact CB-CD1 3.68Å; A70-F104 HydrophobicContact CB-CD1 3.59Å; A70-F104 HydrophobicContact CB-CE1 3.51Å; A70-F104 HydrophobicContact CB-CG 4.42Å; A70-F104 HydrophobicContact CB-CZ 4.28Å
71S89.1Confident84.5Confident52 Ų5241.5 Ų41.536%0.36423%0.228SC..Hα-helixtrans-61-39.5175.1-60.30000112.6I67 K68 L69 S75 F104I67-S71 WeakPolarHBondContact O-CB 3.45Å; I67-S71 PolarHBondContact O-N 3.4Å; I67-S71 PolarHBondContact O-OG 2.79Å; K68-S71 WeakPolarHBondContact O-CB 3.41Å; K68-S71 PolarHBondContact O-N 3.35Å; L69-S71 VanDerWaalsContact C-N 3.27Å; L69-S71 PolarHBondContact O-N 2.95Å; S71-S75 WeakPolarHBondContact O-CB 3.48Å; S71-S75 PolarHBondContact O-N 3.13Å; S71-F104 VanDerWaalsContact OG-CE2 3.25Å; S71-F104 WeakPolarHBondContact OG-CE2 3.21Å; S71-F104 WeakPolarHBondContact OG-CZ 3.3Å
72I88.5Confident84.5Confident15 Ų1535.9 Ų35.98%0.07720%0.201CC..Hα-helixtrans-68.7-48175.5-60.1159.5000110.2C28 L31 S32 L39 K68 L69 A70 F74 S75C28-I72 HydrophobicContact CB-CD1 4.21Å; L31-I72 HydrophobicContact CB-CD1 4.38Å; L31-I72 HydrophobicContact CB-CG2 3.82Å; S32-I72 WeakPolarHBondContact OG-CD1 3.25Å; L39-I72 HydrophobicContact CD1-CG2 4.24Å; L39-I72 HydrophobicContact CD2-CG2 3.96Å; K68-I72 WeakPolarHBondContact O-CG1 3.43Å; K68-I72 PolarHBondContact O-N 3.18Å; L69-I72 PolarHBondContact O-N 3.31Å; L69-I72 VanDerWaalsContact O-N 3.1Å; A70-I72 VanDerWaalsContact C-N 3.31Å; A70-I72 PolarHBondContact O-N 2.94Å; I72-F74 VanDerWaalsContact C-N 3.3Å; I72-F74 PolarHBondContact O-N 3.11Å; I72-S75 WeakPolarHBondContact O-CB 3.25Å; I72-S75 PolarHBondContact O-N 2.98Å; I72-S75 VanDerWaalsContact O-N 3.09Å; I72-S75 PolarHBondContact O-OG 3.4Å
73V84.8Confident84.7Confident1 Ų135.2 Ų35.21%0.00620%0.197CC..Hα-helixtrans-56.1-45.8178.6172.80000111.3F43 I48 L49 L69 A70 S75 L76 F82F43-V73 HydrophobicContact CE1-CB 4.46Å; F43-V73 HydrophobicContact CE1-CG2 3.79Å; F43-V73 HydrophobicContact CZ-CB 4.32Å; F43-V73 HydrophobicContact CZ-CG2 3.98Å; I48-V73 HydrophobicContact CB-CG2 4.5Å; I48-V73 HydrophobicContact CG2-CG2 3.6Å; L49-V73 HydrophobicContact CD2-CG1 3.89Å; L69-V73 VanDerWaalsContact O-CG2 3.3Å; L69-V73 WeakPolarHBondContact O-CG2 3.24Å; L69-V73 PolarHBondContact O-N 3.07Å; A70-V73 PolarHBondContact O-N 3.04Å; V73-S75 VanDerWaalsContact C-N 3.33Å; V73-S75 PolarHBondContact O-N 3.07Å; V73-L76 WeakPolarHBondContact O-CD1 3.39Å; V73-L76 VanDerWaalsContact O-CG 3.25Å; V73-L76 WeakPolarHBondContact O-CG 3.38Å; V73-F82 HydrophobicContact CG1-CE1 3.85Å; V73-F82 HydrophobicContact CG1-CE2 3.88Å; V73-F82 HydrophobicContact CG1-CZ 3.24Å
74F85Confident84.8Confident1 Ų139.2 Ų39.20%0.00421%0.213CC..THydrogen-bonded Turntrans-88.64.1-178.7-73.7-104.7000114.1L49 A70 I72 L76 L79 F82 L90 F104 I105 R108 L109L49-F74 HydrophobicContact CD2-CE2 4.49Å; A70-F74 WeakPolarHBondContact O-CB 3.5Å; A70-F74 VanDerWaalsContact O-CD2 3.25Å; A70-F74 WeakPolarHBondContact O-CD2 3.47Å; A70-F74 PolarHBondContact O-N 3.13Å; I72-F74 VanDerWaalsContact C-N 3.3Å; I72-F74 PolarHBondContact O-N 3.11Å; F74-L76 PolarHBondContact O-N 2.74Å; F74-L79 HydrophobicContact CD1-CD1 3.58Å; F74-L79 HydrophobicContact CE1-CD1 4.25Å; F74-L79 HydrophobicContact CG-CD1 4.49Å; F74-F82 HydrophobicContact CE1-CE1 4.45Å; F74-F82 HydrophobicContact CE2-CE1 4.42Å; F74-F82 HydrophobicContact CZ-CE1 4.31Å; F74-L90 HydrophobicContact CE1-CD2 4.3Å; F74-L90 HydrophobicContact CE2-CD2 4.27Å; F74-L90 HydrophobicContact CZ-CD2 3.49Å; F74-L90 VanDerWaalsContact CZ-CD2 3.49Å; F74-F104 HydrophobicContact CB-CE1 4.4Å; F74-F104 HydrophobicContact CD2-CE1 4.17Å; F74-F104 HydrophobicContact CG-CE1 4.36Å; F74-I105 HydrophobicContact CE1-CG1 4.42Å; F74-I105 HydrophobicContact CE1-CG2 4.15Å; F74-I105 HydrophobicContact CE2-CD1 4.13Å; F74-I105 HydrophobicContact CE2-CG1 3.83Å; F74-I105 HydrophobicContact CZ-CB 4.24Å; F74-I105 HydrophobicContact CZ-CD1 3.9Å; F74-I105 HydrophobicContact CZ-CG1 3.59Å; F74-I105 HydrophobicContact CZ-CG2 3.89Å; F74-R108 HydrophobicContact CB-CG 3.57Å; F74-R108 HydrophobicContact CD1-CB 4.23Å; F74-R108 HydrophobicContact CD1-CG 3.6Å; F74-R108 HydrophobicContact CG-CG 3.91Å; F74-R108 VanDerWaalsContact O-CZ 3.31Å; F74-R108 PolarHBondContact O-NE 3.05Å; F74-R108 PolarHBondContact O-NH2 3.2Å; F74-L109 HydrophobicContact CE1-CD2 4.35Å
75S83.1Confident84.7Confident62 Ų6237.1 Ų37.143%0.43421%0.214SC..THydrogen-bonded Turntrans-75-10.9169.273.30000112.4S71 I72 V73S71-S75 WeakPolarHBondContact O-CB 3.48Å; S71-S75 PolarHBondContact O-N 3.13Å; I72-S75 WeakPolarHBondContact O-CB 3.25Å; I72-S75 PolarHBondContact O-N 2.98Å; I72-S75 VanDerWaalsContact O-N 3.09Å; I72-S75 PolarHBondContact O-OG 3.4Å; V73-S75 VanDerWaalsContact C-N 3.33Å; V73-S75 PolarHBondContact O-N 3.07Å
76L74.3Confident84.6Confident9 Ų937.8 Ų37.85%0.04722%0.217CC..  trans-61.3139.2175.6-66.8175000112.3L39 F43 V73 F74 F82L39-L76 HydrophobicContact CB-CD2 3.85Å; F43-L76 HydrophobicContact CD2-CD1 3.18Å; F43-L76 HydrophobicContact CD2-CD2 3.76Å; F43-L76 HydrophobicContact CD2-CG 3.83Å; F43-L76 HydrophobicContact CE2-CD1 3.44Å; F43-L76 VanDerWaalsContact CE2-CD1 3.44Å; F43-L76 HydrophobicContact CE2-CD2 3.68Å; F43-L76 HydrophobicContact CE2-CG 3.64Å; F43-L76 HydrophobicContact CG-CD1 4.07Å; F43-L76 HydrophobicContact CZ-CD1 4.5Å; V73-L76 WeakPolarHBondContact O-CD1 3.39Å; V73-L76 VanDerWaalsContact O-CG 3.25Å; V73-L76 WeakPolarHBondContact O-CG 3.38Å; F74-L76 PolarHBondContact O-N 2.74Å; L76-F82 HydrophobicContact CD1-CD2 3.59Å; L76-F82 HydrophobicContact CD1-CE2 4.08Å; L76-F82 HydrophobicContact CD1-CG 4.19Å
77I71.3Confident84.8Confident134 Ų13440.1 Ų40.169%0.68723%0.227SC*.SBendtrans-120.2131.4170.3-59.5177.1000107.2
78P78.1Confident84.8Confident89 Ų8942.2 Ų42.258%0.57824%0.236SC*.SBendcis-84.1129.63.331.5-32.3000113.2F80 G81 F82P78-F80 VanDerWaalsContact C-N 3.34Å; P78-F80 PolarHBondContact O-N 3.21Å; P78-G81 PolarHBondContact O-N 2.79Å; P78-G81 VanDerWaalsContact O-N 3.08Å; P78-F82 PolarHBondContact O-N 3.13Å
79L84.5Confident84.7Confident2 Ų239.3 Ų39.31%0.0122%0.224CC..Hα-helixtrans-53-48.2-177.5171.762.3000112.3F74 G81 F82 V83F74-L79 HydrophobicContact CD1-CD1 3.58Å; F74-L79 HydrophobicContact CE1-CD1 4.25Å; F74-L79 HydrophobicContact CG-CD1 4.49Å; L79-G81 VanDerWaalsContact C-N 3.33Å; L79-G81 PolarHBondContact O-N 3.48Å; L79-F82 WeakPolarHBondContact O-CA 3.23Å; L79-F82 VanDerWaalsContact O-CB 3.29Å; L79-F82 WeakPolarHBondContact O-CB 3.25Å; L79-F82 PolarHBondContact O-N 2.83Å; L79-F82 VanDerWaalsContact O-N 3.15Å; L79-V83 HydrophobicContact CD1-CG2 4.36Å; L79-V83 HydrophobicContact CG-CG2 4.47Å; L79-V83 WeakPolarHBondContact O-CG2 3.35Å; L79-V83 PolarHBondContact O-N 2.83Å
80F84.1Confident84.7Confident10 Ų1039.3 Ų39.34%0.04422%0.224CC..Hα-helixtrans-76.9-19.1-176.9-70.4-76.2000114.4P78 F82 V83 Q84 L109 L113 C118 N122 I123P78-F80 VanDerWaalsContact C-N 3.34Å; P78-F80 PolarHBondContact O-N 3.21Å; F80-F82 VanDerWaalsContact C-N 3.29Å; F80-V83 HydrophobicContact CD1-CB 4.24Å; F80-V83 HydrophobicContact CD1-CG1 4.46Å; F80-V83 HydrophobicContact CD1-CG2 4.15Å; F80-V83 PolarHBondContact O-N 3.38Å; F80-Q84 WeakPolarHBondContact O-CG 3.44Å; F80-Q84 PolarHBondContact O-N 3.34Å; F80-L109 HydrophobicContact CE1-CD2 4.36Å; F80-L113 HydrophobicContact CE1-CD2 4.37Å; F80-L113 HydrophobicContact CE2-CD2 4.33Å; F80-L113 HydrophobicContact CZ-CD2 3.63Å; F80-L113 HydrophobicContact CZ-CG 4.34Å; F80-C118 HydrophobicContact CE2-CB 4.26Å; F80-C118 WeakPolarHBondContact CE2-SG 3.25Å; F80-N122 HydrophobicContact CB-CB 3.59Å; F80-N122 HydrophobicContact CD1-CB 4.12Å; F80-N122 WeakPolarHBondContact CD1-O 3.33Å; F80-N122 HydrophobicContact CD2-CB 4.25Å; F80-N122 HydrophobicContact CG-CB 3.73Å; F80-I123 HydrophobicContact CD1-CG1 4.27Å; F80-I123 HydrophobicContact CE1-CG1 3.81Å; F80-I123 HydrophobicContact CZ-CG1 4.48Å
81G82.6Confident84.9Confident25 Ų2540 Ų4026%0.25823%0.228SC..Hα-helixtrans-63.7-41.3166.300000110.7P78 L79 Q84 S85P78-G81 PolarHBondContact O-N 2.79Å; P78-G81 VanDerWaalsContact O-N 3.08Å; L79-G81 VanDerWaalsContact C-N 3.33Å; L79-G81 PolarHBondContact O-N 3.48Å; G81-Q84 PolarHBondContact O-N 3.45Å; G81-S85 PolarHBondContact O-N 3.45Å; G81-S85 VanDerWaalsContact O-N 3.13Å; G81-S85 PolarHBondContact O-OG 3.09Å
82F83.5Confident84.9Confident13 Ų1342.9 Ų42.96%0.05724%0.238CC..Hα-helixtrans-62.8-45.6172.3172-95.4000112L49 V73 F74 L76 P78 L79 F80 Q84 S85 H86 L90L49-F82 HydrophobicContact CD1-CE1 4.35Å; L49-F82 HydrophobicContact CD1-CZ 3.76Å; L49-F82 HydrophobicContact CD2-CZ 4.14Å; L49-F82 HydrophobicContact CG-CZ 4.06Å; V73-F82 HydrophobicContact CG1-CE1 3.85Å; V73-F82 HydrophobicContact CG1-CE2 3.88Å; V73-F82 HydrophobicContact CG1-CZ 3.24Å; F74-F82 HydrophobicContact CE1-CE1 4.45Å; F74-F82 HydrophobicContact CE2-CE1 4.42Å; F74-F82 HydrophobicContact CZ-CE1 4.31Å; L76-F82 HydrophobicContact CD1-CD2 3.59Å; L76-F82 HydrophobicContact CD1-CE2 4.08Å; L76-F82 HydrophobicContact CD1-CG 4.19Å; P78-F82 PolarHBondContact O-N 3.13Å; L79-F82 WeakPolarHBondContact O-CA 3.23Å; L79-F82 VanDerWaalsContact O-CB 3.29Å; L79-F82 WeakPolarHBondContact O-CB 3.25Å; L79-F82 PolarHBondContact O-N 2.83Å; L79-F82 VanDerWaalsContact O-N 3.15Å; F80-F82 VanDerWaalsContact C-N 3.29Å; F82-Q84 VanDerWaalsContact C-N 3.32Å; F82-Q84 PolarHBondContact O-N 2.66Å; F82-S85 PolarHBondContact O-N 2.91Å; F82-S85 VanDerWaalsContact O-N 3.16Å; F82-H86 AromaticContact CD2-CE1 3.54Å; F82-H86 AromaticContact CD2-ND1 3.3Å; F82-H86 VanDerWaalsContact CD2-ND1 3.3Å; F82-H86 WeakPolarHBondContact CD2-ND1 3.42Å; F82-H86 HydrophobicContact CE2-CB 4.45Å; F82-H86 AromaticContact CE2-CE1 3.49Å; F82-H86 VanDerWaalsContact CE2-CE1 3.49Å; F82-H86 WeakPolarHBondContact CE2-CE1 3.34Å; F82-H86 AromaticContact CE2-CG 3.77Å; F82-H86 AromaticContact CE2-ND1 3.31Å; F82-H86 VanDerWaalsContact CE2-ND1 3.31Å; F82-H86 WeakPolarHBondContact CE2-ND1 3.22Å; F82-H86 HydrophobicContact CZ-CB 4.35Å; F82-H86 PolarHBondContact O-N 3.4Å; F82-H86 PolarHBondContact O-ND1 2.66Å; F82-H86 VanDerWaalsContact O-ND1 3.11Å; F82-L90 HydrophobicContact CE1-CD2 4.48Å
83V87.4Confident85.1Confident0 Ų042.1 Ų42.10%024%0.235CC..Hα-helixtrans-59-41.1178174.20000112.3L79 F80 Q87 L90 L109 P124 I127L79-V83 HydrophobicContact CD1-CG2 4.36Å; L79-V83 HydrophobicContact CG-CG2 4.47Å; L79-V83 WeakPolarHBondContact O-CG2 3.35Å; L79-V83 PolarHBondContact O-N 2.83Å; F80-V83 HydrophobicContact CD1-CB 4.24Å; F80-V83 HydrophobicContact CD1-CG1 4.46Å; F80-V83 HydrophobicContact CD1-CG2 4.15Å; F80-V83 PolarHBondContact O-N 3.38Å; V83-Q87 PolarHBondContact O-N 3.27Å; V83-L90 HydrophobicContact CB-CD1 4.07Å; V83-L90 HydrophobicContact CG1-CD1 3.94Å; V83-L90 HydrophobicContact CG2-CD1 4Å; V83-L109 HydrophobicContact CG2-CD2 3.5Å; V83-L109 VanDerWaalsContact CG2-CD2 3.5Å; V83-P124 HydrophobicContact CG1-CG 4.29Å; V83-I127 HydrophobicContact CG1-CD1 3.47Å; V83-I127 VanDerWaalsContact CG1-CD1 3.47Å
84Q86.1Confident85.5Confident97 Ų9742.2 Ų42.245%0.45324%0.235SC..Hα-helixtrans-68-37.4177.3-75178.2-16.100112.4F80 G81 F82 Y121 P124F80-Q84 WeakPolarHBondContact O-CG 3.44Å; F80-Q84 PolarHBondContact O-N 3.34Å; G81-Q84 PolarHBondContact O-N 3.45Å; F82-Q84 VanDerWaalsContact C-N 3.32Å; F82-Q84 PolarHBondContact O-N 2.66Å; Q84-Y121 PolarHBondContact NE2-O 3.38Å; Q84-P124 HydrophobicContact CG-CG 4.33Å
85S84.2Confident85.9Confident93 Ų9347.6 Ų47.665%0.6526%0.26SS*.Hα-helixtrans-77-23.6-177.4-59.60000113.3G81 F82G81-S85 PolarHBondContact O-N 3.45Å; G81-S85 VanDerWaalsContact O-N 3.13Å; G81-S85 PolarHBondContact O-OG 3.09Å; F82-S85 PolarHBondContact O-N 2.91Å; F82-S85 VanDerWaalsContact O-N 3.16Å
86H86.8Confident86.2Confident31 Ų3145.9 Ų45.914%0.14425%0.248CC..THydrogen-bonded Turntrans-123.139.2-176.4-57.383.1000112.3L49 F82 E88 E89 L90L49-H86 HydrophobicContact CD1-CB 3.55Å; F82-H86 AromaticContact CD2-CE1 3.54Å; F82-H86 AromaticContact CD2-ND1 3.3Å; F82-H86 VanDerWaalsContact CD2-ND1 3.3Å; F82-H86 WeakPolarHBondContact CD2-ND1 3.42Å; F82-H86 HydrophobicContact CE2-CB 4.45Å; F82-H86 AromaticContact CE2-CE1 3.49Å; F82-H86 VanDerWaalsContact CE2-CE1 3.49Å; F82-H86 WeakPolarHBondContact CE2-CE1 3.34Å; F82-H86 AromaticContact CE2-CG 3.77Å; F82-H86 AromaticContact CE2-ND1 3.31Å; F82-H86 VanDerWaalsContact CE2-ND1 3.31Å; F82-H86 WeakPolarHBondContact CE2-ND1 3.22Å; F82-H86 HydrophobicContact CZ-CB 4.35Å; F82-H86 PolarHBondContact O-N 3.4Å; F82-H86 PolarHBondContact O-ND1 2.66Å; F82-H86 VanDerWaalsContact O-ND1 3.11Å; H86-E88 VanDerWaalsContact C-N 3.34Å; H86-E88 PolarHBondContact O-N 3.09Å; H86-E89 WeakPolarHBondContact CA-OE2 3.33Å; H86-L90 WeakPolarHBondContact O-CB 3.34Å; H86-L90 VanDerWaalsContact O-CG 3.22Å; H86-L90 WeakPolarHBondContact O-CG 3.47Å; H86-L90 PolarHBondContact O-N 3.29Å; H86-L90 VanDerWaalsContact O-N 3.08Å
87Q89.9Confident86.9Confident48 Ų4851.7 Ų51.722%0.22428%0.284CS..Hα-helixtrans-59.4-44.9-173.8-176.3-168-77.100112.1V83 L90 L91 P124 I127V83-Q87 PolarHBondContact O-N 3.27Å; Q87-L90 PolarHBondContact O-N 3.05Å; Q87-L91 HydrophobicContact CG-CD1 4.04Å; Q87-L91 WeakPolarHBondContact O-CB 3.43Å; Q87-L91 VanDerWaalsContact O-CG 3.24Å; Q87-L91 WeakPolarHBondContact O-CG 3.33Å; Q87-L91 PolarHBondContact O-N 3.34Å; Q87-P124 HydrophobicContact CG-CB 4.03Å; Q87-P124 HydrophobicContact CG-CG 4.23Å; Q87-I127 HydrophobicContact CB-CD1 4.47Å; Q87-I127 HydrophobicContact CG-CD1 3.95Å; Q87-I127 HydrophobicContact CG-CG1 4.01Å
88E89.7Confident87.8Confident95 Ų9546.7 Ų46.744%0.44426%0.258SS..Hα-helixtrans-71.9-38.3-172.3-61.6-60.1127.200111.3H86 L91 L92 R126H86-E88 VanDerWaalsContact C-N 3.34Å; H86-E88 PolarHBondContact O-N 3.09Å; E88-L91 PolarHBondContact O-N 3.2Å; E88-L92 WeakPolarHBondContact O-CG 3.26Å; E88-L92 PolarHBondContact O-N 2.9Å; E88-R126 IonicContact OE1-NH1 3.13Å; E88-R126 PolarHBondContact OE1-NH1 3.4Å; E88-R126 VanDerWaalsContact OE1-NH1 3.13Å; E88-R126 IonicContact OE2-NH1 3.72Å
89E87.1Confident88.4Confident48 Ų4845.1 Ų45.122%0.22424%0.244CC..Hα-helixtrans-67.1-39.8175.8-58.784.8170.800111.5L49 H86 L92 I93L49-E89 HydrophobicContact CB-CB 3.64Å; L49-E89 HydrophobicContact CB-CG 4.2Å; L49-E89 HydrophobicContact CD1-CB 3.46Å; L49-E89 VanDerWaalsContact CD1-CB 3.46Å; L49-E89 HydrophobicContact CD1-CG 4.32Å; L49-E89 HydrophobicContact CG-CB 4.22Å; H86-E89 WeakPolarHBondContact CA-OE2 3.33Å; E89-L92 PolarHBondContact O-N 3.26Å; E89-I93 WeakPolarHBondContact O-CG1 3.33Å; E89-I93 PolarHBondContact O-N 3.26Å; E89-I93 VanDerWaalsContact O-N 3.13Å
90L89.7Confident88.5Confident1 Ų148.8 Ų48.81%0.00526%0.264CS..Hα-helixtrans-65.8-39173.7-70.9176.9000112L49 F74 F82 V83 H86 Q87 I93 L94 I105 I127L49-L90 HydrophobicContact CD1-CD2 4.11Å; L49-L90 HydrophobicContact CD1-CG 4.15Å; L49-L90 HydrophobicContact CD2-CD2 4.37Å; F74-L90 HydrophobicContact CE1-CD2 4.3Å; F74-L90 HydrophobicContact CE2-CD2 4.27Å; F74-L90 HydrophobicContact CZ-CD2 3.49Å; F74-L90 VanDerWaalsContact CZ-CD2 3.49Å; F82-L90 HydrophobicContact CE1-CD2 4.48Å; V83-L90 HydrophobicContact CB-CD1 4.07Å; V83-L90 HydrophobicContact CG1-CD1 3.94Å; V83-L90 HydrophobicContact CG2-CD1 4Å; H86-L90 WeakPolarHBondContact O-CB 3.34Å; H86-L90 VanDerWaalsContact O-CG 3.22Å; H86-L90 WeakPolarHBondContact O-CG 3.47Å; H86-L90 PolarHBondContact O-N 3.29Å; H86-L90 VanDerWaalsContact O-N 3.08Å; Q87-L90 PolarHBondContact O-N 3.05Å; L90-I93 PolarHBondContact O-N 3.21Å; L90-L94 WeakPolarHBondContact O-CB 3.29Å; L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.32Å; L90-L94 PolarHBondContact O-N 3.14Å; L90-I105 HydrophobicContact CD2-CD1 4.26Å; L90-I127 HydrophobicContact CB-CD1 4.2Å; L90-I127 HydrophobicContact CD1-CD1 4.14Å
91L93Very high88.8Confident13 Ų1348.3 Ų48.37%0.06826%0.262CS..Hα-helixtrans-62.2-45.1174.3-74.8169000111.4Q87 E88 I93 L94 E95 R126 I127Q87-L91 HydrophobicContact CG-CD1 4.04Å; Q87-L91 WeakPolarHBondContact O-CB 3.43Å; Q87-L91 VanDerWaalsContact O-CG 3.24Å; Q87-L91 WeakPolarHBondContact O-CG 3.33Å; Q87-L91 PolarHBondContact O-N 3.34Å; E88-L91 PolarHBondContact O-N 3.2Å; L91-I93 PolarHBondContact O-N 3.15Å; L91-L94 PolarHBondContact O-N 3.45Å; L91-E95 WeakPolarHBondContact O-CB 3.38Å; L91-E95 WeakPolarHBondContact O-CG 3.46Å; L91-E95 PolarHBondContact O-N 3.44Å; L91-R126 HydrophobicContact CD1-CB 3.74Å; L91-R126 HydrophobicContact CD2-CB 4.08Å; L91-R126 WeakPolarHBondContact CD2-O 3.34Å; L91-I127 HydrophobicContact CD2-CG1 4.06Å; L91-I127 HydrophobicContact CG-CG1 4.16Å
92L90Very high89.4Confident113 Ų11347.2 Ų47.259%0.59225%0.25SC*.Hα-helixtrans-56.3-38.7175.5-74.1172.5000111.9M53 E88 E89 S96M53-L92 HydrophobicContact CE-CB 4.35Å; E88-L92 WeakPolarHBondContact O-CG 3.26Å; E88-L92 PolarHBondContact O-N 2.9Å; E89-L92 PolarHBondContact O-N 3.26Å; L92-S96 WeakPolarHBondContact O-CB 3.37Å; L92-S96 PolarHBondContact O-N 3.13Å
93I90.9Very high89.9Confident0 Ų048.1 Ų48.10%025%0.254CS..Hα-helixtrans-70.6-50176.3-62.9159.7000111.3L49 L52 M53 E89 L90 L91 E95 S96 L101 I102 I105L49-I93 HydrophobicContact CB-CD1 4.38Å; L49-I93 HydrophobicContact CD2-CD1 3.81Å; L52-I93 HydrophobicContact CD2-CD1 4.22Å; M53-I93 HydrophobicContact CG-CD1 4.31Å; M53-I93 HydrophobicContact CG-CG1 3.52Å; M53-I93 HydrophobicContact SD-CB 4.05Å; M53-I93 HydrophobicContact SD-CG1 3.34Å; M53-I93 WeakPolarHBondContact SD-CG1 3.36Å; M53-I93 HydrophobicContact SD-CG2 4.47Å; E89-I93 WeakPolarHBondContact O-CG1 3.33Å; E89-I93 PolarHBondContact O-N 3.26Å; E89-I93 VanDerWaalsContact O-N 3.13Å; L90-I93 PolarHBondContact O-N 3.21Å; L91-I93 PolarHBondContact O-N 3.15Å; I93-E95 PolarHBondContact O-N 3.36Å; I93-S96 WeakPolarHBondContact O-CB 3.5Å; I93-S96 PolarHBondContact O-N 3.25Å; I93-S96 PolarHBondContact O-OG 3.02Å; I93-L101 HydrophobicContact CD1-CD2 4.47Å; I93-L101 HydrophobicContact CG1-CD2 4.28Å; I93-L101 HydrophobicContact CG2-CB 4.49Å; I93-L101 HydrophobicContact CG2-CD2 3.5Å; I93-L101 HydrophobicContact CG2-CG 3.62Å; I93-I102 WeakPolarHBondContact O-CG1 3.3Å; I93-I105 HydrophobicContact CB-CD1 4.01Å; I93-I105 HydrophobicContact CD1-CD1 3.94Å; I93-I105 HydrophobicContact CG2-CD1 3.41Å; I93-I105 VanDerWaalsContact CG2-CD1 3.41Å
94L93.8Very high90.1Very high3 Ų350 Ų502%0.01626%0.263CS..Hα-helixtrans-62-27.5-177.7-70.7173.4000112.8L90 L91 I102 I105 L106 I127 S130 I131 L134L90-L94 WeakPolarHBondContact O-CB 3.29Å; L90-L94 VanDerWaalsContact O-CG 3.29Å; L90-L94 WeakPolarHBondContact O-CG 3.32Å; L90-L94 PolarHBondContact O-N 3.14Å; L91-L94 PolarHBondContact O-N 3.45Å; L94-I102 HydrophobicContact CD2-CG2 4.21Å; L94-I105 HydrophobicContact CD2-CG2 4.07Å; L94-L106 HydrophobicContact CD2-CD2 4.39Å; L94-I127 HydrophobicContact CD1-CG2 4.04Å; L94-S130 WeakPolarHBondContact CB-OG 3.49Å; L94-I131 HydrophobicContact CD1-CG1 4.26Å; L94-L134 HydrophobicContact CD2-CD1 4.08Å
95E92.8Very high90.4Very high113 Ų11345.4 Ų45.453%0.52824%0.241SC..THydrogen-bonded Turntrans-96.93.7178.4-61.8-175.7160.900113.3L91 I93 R133L91-E95 WeakPolarHBondContact O-CB 3.38Å; L91-E95 WeakPolarHBondContact O-CG 3.46Å; L91-E95 PolarHBondContact O-N 3.44Å; I93-E95 PolarHBondContact O-N 3.36Å; E95-R133 IonicContact OE1-NH1 2.62Å; E95-R133 PolarHBondContact OE1-NH1 2.91Å; E95-R133 VanDerWaalsContact OE1-NH1 3.09Å
96S91.2Very high91Very high26 Ų2641 Ų4118%0.18221%0.21CC..SBendtrans-85.1177.9179.175.40000113.4L92 I93 K98 I102L92-S96 WeakPolarHBondContact O-CB 3.37Å; L92-S96 PolarHBondContact O-N 3.13Å; I93-S96 WeakPolarHBondContact O-CB 3.5Å; I93-S96 PolarHBondContact O-N 3.25Å; I93-S96 PolarHBondContact O-OG 3.02Å; S96-K98 VanDerWaalsContact C-N 3.3Å; S96-K98 WeakPolarHBondContact OG-CB 3.28Å; S96-K98 PolarHBondContact OG-N 3.05Å; S96-I102 VanDerWaalsContact O-CD1 3.27Å; S96-I102 WeakPolarHBondContact O-CD1 3.42Å
97T89.1Confident91.4Very high132 Ų13243.7 Ų43.781%0.8122%0.222SC*.SBendtrans-89.28.6171.153.90000113.2L99T97-L99 VanDerWaalsContact C-N 3.3Å; T97-L99 WeakPolarHBondContact O-CG 3.21Å; T97-L99 PolarHBondContact O-N 3.39Å
98K88.4Confident91.5Very high28 Ų2844.2 Ų44.212%0.12222%0.221CC..  trans-82.567.9-176.5-64-168.5-178.3-144.50112.1L52 M53 I55 L57 S96 D100 L101 I102L52-K98 PolarHBondContact O-NZ 3.28Å; L52-K98 VanDerWaalsContact O-NZ 3.09Å; M53-K98 VanDerWaalsContact O-CE 3.22Å; M53-K98 WeakPolarHBondContact O-CE 3.26Å; M53-K98 PolarHBondContact O-NZ 3.17Å; M53-K98 HydrophobicContact SD-CD 3.92Å; I55-K98 PolarHBondContact O-NZ 2.98Å; L57-K98 HydrophobicContact CD1-CB 3.58Å; L57-K98 HydrophobicContact CD1-CD 3.83Å; L57-K98 HydrophobicContact CD1-CG 3.8Å; L57-K98 HydrophobicContact CG-CD 4.27Å; L57-K98 HydrophobicContact CG-CG 4.4Å; S96-K98 VanDerWaalsContact C-N 3.3Å; S96-K98 WeakPolarHBondContact OG-CB 3.28Å; S96-K98 PolarHBondContact OG-N 3.05Å; K98-D100 PolarHBondContact O-N 3.21Å; K98-L101 HydrophobicContact CB-CB 4.12Å; K98-L101 HydrophobicContact CD-CD2 4.2Å; K98-L101 WeakPolarHBondContact O-CB 3.33Å; K98-L101 PolarHBondContact O-N 3.4Å; K98-I102 WeakPolarHBondContact O-CG1 3.49Å; K98-I102 PolarHBondContact O-N 2.89Å
99L91Very high91.6Very high57 Ų5739.9 Ų39.930%0.29820%0.201SC..Hα-helixtrans-56.2-41.5-165.1-52.1-172.8000114.5T97 L101 I102 E103 K139 L142T97-L99 VanDerWaalsContact C-N 3.3Å; T97-L99 WeakPolarHBondContact O-CG 3.21Å; T97-L99 PolarHBondContact O-N 3.39Å; L99-L101 VanDerWaalsContact C-N 3.31Å; L99-L101 PolarHBondContact O-N 3.09Å; L99-I102 HydrophobicContact CD2-CD1 4.48Å; L99-I102 PolarHBondContact O-N 3.37Å; L99-E103 PolarHBondContact O-N 3.2Å; L99-K139 HydrophobicContact CB-CD 4.14Å; L99-K139 HydrophobicContact CD1-CD 3.83Å; L99-L142 HydrophobicContact CB-CD1 4.07Å; L99-L142 HydrophobicContact CD2-CD1 3.85Å; L99-L142 HydrophobicContact CG-CD1 4.44Å
100D87.5Confident92Very high78 Ų7840.8 Ų40.842%0.41720%0.203SC..Hα-helixtrans-68.4-34.1-179.6-65.7-24.7000112.1K98 F104 K139K98-D100 PolarHBondContact O-N 3.21Å; D100-F104 WeakPolarHBondContact O-CB 3.49Å; D100-F104 PolarHBondContact O-N 3.41Å; D100-K139 IonicContact OD1-NZ 3.13Å; D100-K139 PolarHBondContact OD1-NZ 2.91Å
101L90.2Very high92Very high1 Ų143.2 Ų43.21%0.00522%0.222CC..Hα-helixtrans-71.6-41175.8179.659.9000111.3L52 L57 A70 I93 K98 L99 E103 F104 I105L52-L101 HydrophobicContact CD1-CD1 4.2Å; L52-L101 HydrophobicContact CD1-CD2 4.29Å; L52-L101 HydrophobicContact CD2-CD1 3.77Å; L52-L101 HydrophobicContact CD2-CD2 3.88Å; L52-L101 HydrophobicContact CD2-CG 4.44Å; L52-L101 HydrophobicContact CG-CD1 4.16Å; L52-L101 HydrophobicContact CG-CD2 3.7Å; L57-L101 HydrophobicContact CD1-CB 4.2Å; A70-L101 HydrophobicContact CB-CD1 3.68Å; I93-L101 HydrophobicContact CD1-CD2 4.47Å; I93-L101 HydrophobicContact CG1-CD2 4.28Å; I93-L101 HydrophobicContact CG2-CB 4.49Å; I93-L101 HydrophobicContact CG2-CD2 3.5Å; I93-L101 HydrophobicContact CG2-CG 3.62Å; K98-L101 HydrophobicContact CB-CB 4.12Å; K98-L101 HydrophobicContact CD-CD2 4.2Å; K98-L101 WeakPolarHBondContact O-CB 3.33Å; K98-L101 PolarHBondContact O-N 3.4Å; L99-L101 VanDerWaalsContact C-N 3.31Å; L99-L101 PolarHBondContact O-N 3.09Å; L101-E103 VanDerWaalsContact C-N 3.32Å; L101-E103 PolarHBondContact O-N 2.85Å; L101-F104 PolarHBondContact O-N 3.22Å; L101-I105 HydrophobicContact CD1-CD1 4.25Å; L101-I105 HydrophobicContact CD1-CG1 4.31Å; L101-I105 HydrophobicContact CG-CD1 4.23Å; L101-I105 WeakPolarHBondContact O-CG1 3.36Å; L101-I105 PolarHBondContact O-N 3.45Å
102I94.3Very high91.9Very high1 Ų142.6 Ų42.61%0.00522%0.219CC..Hα-helixtrans-58-47.9173.2-63.2171.5000109.9I93 L94 S96 K98 L99 F104 I105 L106 L134 L142I93-I102 WeakPolarHBondContact O-CG1 3.3Å; L94-I102 HydrophobicContact CD2-CG2 4.21Å; S96-I102 VanDerWaalsContact O-CD1 3.27Å; S96-I102 WeakPolarHBondContact O-CD1 3.42Å; K98-I102 WeakPolarHBondContact O-CG1 3.49Å; K98-I102 PolarHBondContact O-N 2.89Å; L99-I102 HydrophobicContact CD2-CD1 4.48Å; L99-I102 PolarHBondContact O-N 3.37Å; I102-F104 VanDerWaalsContact C-N 3.31Å; I102-F104 PolarHBondContact O-N 3.45Å; I102-I105 PolarHBondContact O-N 3.4Å; I102-L106 HydrophobicContact CG2-CD1 4.2Å; I102-L106 HydrophobicContact CG2-CG 4.39Å; I102-L106 WeakPolarHBondContact O-CG 3.36Å; I102-L106 PolarHBondContact O-N 3.41Å; I102-L134 HydrophobicContact CG2-CD1 3.64Å; I102-L134 HydrophobicContact CG2-CD2 4.21Å; I102-L142 HydrophobicContact CB-CD2 4.16Å; I102-L142 HydrophobicContact CG2-CD1 4.39Å; I102-L142 HydrophobicContact CG2-CD2 3.88Å
103E93.9Very high91.9Very high33 Ų3337.3 Ų37.315%0.15419%0.192CC..Hα-helixtrans-60.4-42.2-180-161.7173.9142.600111.7L99 L101 K107 K139 S141 L142L99-E103 PolarHBondContact O-N 3.2Å; L101-E103 VanDerWaalsContact C-N 3.32Å; L101-E103 PolarHBondContact O-N 2.85Å; E103-K107 WeakPolarHBondContact O-CG 2.86Å; E103-K107 PolarHBondContact O-N 2.91Å; E103-K107 WeakPolarHBondContact OE1-CE 3.46Å; E103-K107 IonicContact OE1-NZ 3.09Å; E103-K107 PolarHBondContact OE1-NZ 3.09Å; E103-K139 IonicContact OE2-NZ 3.44Å; E103-K139 PolarHBondContact OE2-NZ 2.84Å; E103-S141 PolarHBondContact OE2-OG 3.08Å; E103-L142 HydrophobicContact CB-CD2 3.5Å; E103-L142 HydrophobicContact CG-CD2 3.98Å
104F92.4Very high91.8Very high39 Ų3941.8 Ų41.817%0.17122%0.219CC..Hα-helixtrans-60.8-48.2175.5176.1-88.5000112.1I67 A70 S71 F74 D100 L101 I102 K107 R108I67-F104 HydrophobicContact CD1-CB 3.68Å; I67-F104 HydrophobicContact CD1-CD2 4.3Å; I67-F104 HydrophobicContact CD1-CG 4.07Å; I67-F104 HydrophobicContact CG2-CD2 3.9Å; I67-F104 HydrophobicContact CG2-CE2 4.24Å; A70-F104 HydrophobicContact CB-CD1 3.59Å; A70-F104 HydrophobicContact CB-CE1 3.51Å; A70-F104 HydrophobicContact CB-CG 4.42Å; A70-F104 HydrophobicContact CB-CZ 4.28Å; S71-F104 VanDerWaalsContact OG-CE2 3.25Å; S71-F104 WeakPolarHBondContact OG-CE2 3.21Å; S71-F104 WeakPolarHBondContact OG-CZ 3.3Å; F74-F104 HydrophobicContact CB-CE1 4.4Å; F74-F104 HydrophobicContact CD2-CE1 4.17Å; F74-F104 HydrophobicContact CG-CE1 4.36Å; D100-F104 WeakPolarHBondContact O-CB 3.49Å; D100-F104 PolarHBondContact O-N 3.41Å; L101-F104 PolarHBondContact O-N 3.22Å; I102-F104 VanDerWaalsContact C-N 3.31Å; I102-F104 PolarHBondContact O-N 3.45Å; F104-K107 PolarHBondContact O-N 2.99Å; F104-R108 HydrophobicContact CE1-CB 4.46Å; F104-R108 WeakPolarHBondContact O-CB 3.44Å; F104-R108 PolarHBondContact O-N 2.9Å
105I92.7Very high91.4Very high0 Ų044.4 Ų44.40%023%0.231CC..Hα-helixtrans-62.7-46.3-179.8-68.4179000110.3F74 L90 I93 L94 L101 I102 K107 R108 L109F74-I105 HydrophobicContact CE1-CG1 4.42Å; F74-I105 HydrophobicContact CE1-CG2 4.15Å; F74-I105 HydrophobicContact CE2-CD1 4.13Å; F74-I105 HydrophobicContact CE2-CG1 3.83Å; F74-I105 HydrophobicContact CZ-CB 4.24Å; F74-I105 HydrophobicContact CZ-CD1 3.9Å; F74-I105 HydrophobicContact CZ-CG1 3.59Å; F74-I105 HydrophobicContact CZ-CG2 3.89Å; L90-I105 HydrophobicContact CD2-CD1 4.26Å; I93-I105 HydrophobicContact CB-CD1 4.01Å; I93-I105 HydrophobicContact CD1-CD1 3.94Å; I93-I105 HydrophobicContact CG2-CD1 3.41Å; I93-I105 VanDerWaalsContact CG2-CD1 3.41Å; L94-I105 HydrophobicContact CD2-CG2 4.07Å; L101-I105 HydrophobicContact CD1-CD1 4.25Å; L101-I105 HydrophobicContact CD1-CG1 4.31Å; L101-I105 HydrophobicContact CG-CD1 4.23Å; L101-I105 WeakPolarHBondContact O-CG1 3.36Å; L101-I105 PolarHBondContact O-N 3.45Å; I102-I105 PolarHBondContact O-N 3.4Å; I105-K107 PolarHBondContact O-N 3.1Å; I105-R108 PolarHBondContact O-N 2.93Å; I105-L109 HydrophobicContact CG2-CD1 3.76Å; I105-L109 HydrophobicContact CG2-CG 4.02Å; I105-L109 WeakPolarHBondContact O-CB 3.01Å; I105-L109 VanDerWaalsContact O-CG 3.27Å; I105-L109 WeakPolarHBondContact O-CG 3.4Å; I105-L109 PolarHBondContact O-N 2.96Å
106L96Very high90.6Very high0 Ų045.7 Ų45.70%025%0.249CC..Hα-helixtrans-57.1-47.5176.8-71176.8000111.9L94 I102 R108 L109 R110 I131 L134 L142 E145 A146L94-L106 HydrophobicContact CD2-CD2 4.39Å; I102-L106 HydrophobicContact CG2-CD1 4.2Å; I102-L106 HydrophobicContact CG2-CG 4.39Å; I102-L106 WeakPolarHBondContact O-CG 3.36Å; I102-L106 PolarHBondContact O-N 3.41Å; L106-R108 VanDerWaalsContact C-N 3.3Å; L106-R108 PolarHBondContact O-N 2.59Å; L106-L109 PolarHBondContact O-N 2.95Å; L106-R110 WeakPolarHBondContact O-CB 3.46Å; L106-R110 PolarHBondContact O-N 2.99Å; L106-I131 HydrophobicContact CD2-CB 4.3Å; L106-I131 HydrophobicContact CD2-CD1 4.15Å; L106-I131 HydrophobicContact CD2-CG1 3.73Å; L106-I131 HydrophobicContact CD2-CG2 3.8Å; L106-L134 HydrophobicContact CD1-CD1 4.07Å; L106-L134 HydrophobicContact CD2-CD1 4.13Å; L106-L134 HydrophobicContact CG-CD1 4.38Å; L106-L142 HydrophobicContact CD1-CD2 4.31Å; L106-E145 HydrophobicContact CB-CB 4.49Å; L106-E145 HydrophobicContact CB-CG 3.64Å; L106-E145 HydrophobicContact CD1-CB 4.26Å; L106-E145 HydrophobicContact CD1-CG 4.27Å; L106-A146 HydrophobicContact CD1-CB 4.28Å
107K94.9Very high90Very high89 Ų8949 Ų4939%0.38727%0.273SS..Hα-helixtrans-58.8-42.4177.3-76.8174.2-174.8168.50112E103 F104 I105 A111 E145E103-K107 WeakPolarHBondContact O-CG 2.86Å; E103-K107 PolarHBondContact O-N 2.91Å; E103-K107 WeakPolarHBondContact OE1-CE 3.46Å; E103-K107 IonicContact OE1-NZ 3.09Å; E103-K107 PolarHBondContact OE1-NZ 3.09Å; F104-K107 PolarHBondContact O-N 2.99Å; I105-K107 PolarHBondContact O-N 3.1Å; K107-A111 WeakPolarHBondContact O-CB 3.47Å; K107-A111 PolarHBondContact O-N 3.29Å; K107-E145 WeakPolarHBondContact CA-OE1 3.23Å; K107-E145 HydrophobicContact CG-CG 3.84Å; K107-E145 WeakPolarHBondContact CG-OE1 3.32Å
108R92.1Very high89.7Confident59 Ų5943.3 Ų43.322%0.22324%0.238CC..Hα-helixtrans-72.3-41.9-178.3-175.851.6-178.1137.50.2112.4F74 F104 I105 L106 R110 A111 G112F74-R108 HydrophobicContact CB-CG 3.57Å; F74-R108 HydrophobicContact CD1-CB 4.23Å; F74-R108 HydrophobicContact CD1-CG 3.6Å; F74-R108 HydrophobicContact CG-CG 3.91Å; F74-R108 VanDerWaalsContact O-CZ 3.31Å; F74-R108 PolarHBondContact O-NE 3.05Å; F74-R108 PolarHBondContact O-NH2 3.2Å; F104-R108 HydrophobicContact CE1-CB 4.46Å; F104-R108 WeakPolarHBondContact O-CB 3.44Å; F104-R108 PolarHBondContact O-N 2.9Å; I105-R108 PolarHBondContact O-N 2.93Å; L106-R108 VanDerWaalsContact C-N 3.3Å; L106-R108 PolarHBondContact O-N 2.59Å; R108-R110 VanDerWaalsContact C-N 3.35Å; R108-A111 PolarHBondContact O-N 3.47Å; R108-G112 PolarHBondContact O-N 3.44Å; R108-G112 VanDerWaalsContact O-N 3.09Å
109L93.1Very high89.4Confident3 Ų343.6 Ų43.62%0.01624%0.243CC..Hα-helixtrans-61.2-44.4173-68.1180000110.8F74 F80 V83 I105 L106 A111 G112 L113 I131 F149F74-L109 HydrophobicContact CE1-CD2 4.35Å; F80-L109 HydrophobicContact CE1-CD2 4.36Å; V83-L109 HydrophobicContact CG2-CD2 3.5Å; V83-L109 VanDerWaalsContact CG2-CD2 3.5Å; I105-L109 HydrophobicContact CG2-CD1 3.76Å; I105-L109 HydrophobicContact CG2-CG 4.02Å; I105-L109 WeakPolarHBondContact O-CB 3.01Å; I105-L109 VanDerWaalsContact O-CG 3.27Å; I105-L109 WeakPolarHBondContact O-CG 3.4Å; I105-L109 PolarHBondContact O-N 2.96Å; L106-L109 PolarHBondContact O-N 2.95Å; L109-A111 PolarHBondContact O-N 2.88Å; L109-G112 PolarHBondContact O-N 3.47Å; L109-G112 VanDerWaalsContact O-N 3.14Å; L109-L113 PolarHBondContact O-N 3.17Å; L109-I131 HydrophobicContact CD1-CD1 3.97Å; L109-F149 HydrophobicContact CB-CD2 4.11Å; L109-F149 HydrophobicContact CB-CE2 3.66Å
110R94.4Very high89Confident68 Ų6841.8 Ų41.826%0.25724%0.235SC..Hα-helixtrans-59.6-45.1176-174.1-177.371.2-164.6-9.9111.8L106 R108 G112 L113 E145 F149 T152L106-R110 WeakPolarHBondContact O-CB 3.46Å; L106-R110 PolarHBondContact O-N 2.99Å; R108-R110 VanDerWaalsContact C-N 3.35Å; R110-G112 PolarHBondContact O-N 3.2Å; R110-L113 WeakPolarHBondContact O-CB 3.34Å; R110-L113 PolarHBondContact O-N 3.37Å; R110-L113 VanDerWaalsContact O-N 3.13Å; R110-E145 VanDerWaalsContact CZ-CD 3.48Å; R110-E145 IonicContact CZ-OE1 3.69Å; R110-E145 IonicContact CZ-OE2 3.6Å; R110-E145 IonicContact NE-OE1 3.28Å; R110-E145 PolarHBondContact NE-OE1 3.44Å; R110-E145 IonicContact NH1-OE1 2.73Å; R110-E145 PolarHBondContact NH1-OE1 3.02Å; R110-E145 IonicContact NH1-OE2 3.65Å; R110-E145 PolarHBondContact NH1-OE2 2.97Å; R110-E145 IonicContact NH2-OE1 2.95Å; R110-E145 PolarHBondContact NH2-OE1 3.39Å; R110-E145 VanDerWaalsContact NH2-OE1 3.16Å; R110-E145 IonicContact NH2-OE2 3.81Å; R110-E145 PolarHBondContact NH2-OE2 2.68Å; R110-F149 HydrophobicContact CB-CB 4.41Å; R110-F149 HydrophobicContact CB-CD2 3.97Å; R110-T152 HydrophobicContact CG-CG2 4.17Å
111A90.8Very high88.9Confident51 Ų5146.5 Ų46.542%0.42125%0.248SC..Hα-helixtrans-59.4-37.817700000111.9K107 R108 L109 L113 V114K107-A111 WeakPolarHBondContact O-CB 3.47Å; K107-A111 PolarHBondContact O-N 3.29Å; R108-A111 PolarHBondContact O-N 3.47Å; L109-A111 PolarHBondContact O-N 2.88Å; A111-L113 VanDerWaalsContact C-N 3.32Å; A111-L113 PolarHBondContact O-N 3.18Å; A111-V114 PolarHBondContact O-N 3.02Å
112G89.7Confident88.6Confident0 Ų048.3 Ų48.30%026%0.257CS..Hα-helixtrans-64.6-30.1175.400000114.6R108 L109 R110 V114 E115R108-G112 PolarHBondContact O-N 3.44Å; R108-G112 VanDerWaalsContact O-N 3.09Å; L109-G112 PolarHBondContact O-N 3.47Å; L109-G112 VanDerWaalsContact O-N 3.14Å; R110-G112 PolarHBondContact O-N 3.2Å; G112-V114 PolarHBondContact O-N 3Å; G112-V114 VanDerWaalsContact O-N 3.15Å; G112-E115 WeakPolarHBondContact O-CB 3.34Å; G112-E115 PolarHBondContact O-N 2.96Å
113L91Very high88.4Confident3 Ų348.9 Ų48.92%0.01626%0.26CS..THydrogen-bonded Turntrans-63.7-19.5179.6-63.6-179.5000113.8F80 L109 R110 A111 E115 I123 F149 T152 L153F80-L113 HydrophobicContact CE1-CD2 4.37Å; F80-L113 HydrophobicContact CE2-CD2 4.33Å; F80-L113 HydrophobicContact CZ-CD2 3.63Å; F80-L113 HydrophobicContact CZ-CG 4.34Å; L109-L113 PolarHBondContact O-N 3.17Å; R110-L113 WeakPolarHBondContact O-CB 3.34Å; R110-L113 PolarHBondContact O-N 3.37Å; R110-L113 VanDerWaalsContact O-N 3.13Å; A111-L113 VanDerWaalsContact C-N 3.32Å; A111-L113 PolarHBondContact O-N 3.18Å; L113-E115 VanDerWaalsContact C-N 3.34Å; L113-I123 HydrophobicContact CD2-CD1 3.55Å; L113-I123 HydrophobicContact CD2-CG1 4.28Å; L113-F149 HydrophobicContact CD1-CD2 3.75Å; L113-F149 HydrophobicContact CD1-CE1 4.37Å; L113-F149 HydrophobicContact CD1-CE2 3.49Å; L113-F149 VanDerWaalsContact CD1-CE2 3.49Å; L113-F149 HydrophobicContact CD1-CG 4.27Å; L113-F149 HydrophobicContact CD1-CZ 3.85Å; L113-F149 HydrophobicContact CD2-CE2 4.24Å; L113-F149 HydrophobicContact CD2-CZ 4.31Å; L113-F149 HydrophobicContact CG-CD2 4.48Å; L113-F149 HydrophobicContact CG-CE2 3.91Å; L113-F149 HydrophobicContact CG-CZ 4.4Å; L113-T152 HydrophobicContact CB-CG2 3.93Å; L113-T152 HydrophobicContact CD1-CG2 4.19Å; L113-L153 HydrophobicContact CD1-CB 3.82Å; L113-L153 HydrophobicContact CD1-CD1 4.45Å; L113-L153 HydrophobicContact CD2-CD1 4.1Å
114V87.4Confident88.4Confident93 Ų9348 Ų4856%0.56426%0.258SS*.THydrogen-bonded Turntrans-87.2-9.4179.8-1680000111.3A111 G112 T152A111-V114 PolarHBondContact O-N 3.02Å; G112-V114 PolarHBondContact O-N 3Å; G112-V114 VanDerWaalsContact O-N 3.15Å; V114-T152 HydrophobicContact CG2-CG2 3.97Å
115E85.3Confident88.5Confident58 Ų5852.2 Ų52.227%0.27128%0.278SS..SBendtrans-69.5136178.7-65.4179.1-173.900111G112 L113 S117 C118G112-E115 WeakPolarHBondContact O-CB 3.34Å; G112-E115 PolarHBondContact O-N 2.96Å; L113-E115 VanDerWaalsContact C-N 3.34Å; E115-S117 PolarHBondContact O-N 2.99Å; E115-C118 VanDerWaalsContact O-CB 3.26Å; E115-C118 WeakPolarHBondContact O-CB 3.27Å; E115-C118 PolarHBondContact O-N 3.05Å
116P77.7Confident88.7Confident140 Ų14059.1 Ų59.191%0.90930%0.304SS*.THydrogen-bonded Turntrans-58.7-26.5-174.7-25.933.6000115.1C118P116-C118 VanDerWaalsContact C-N 3.29Å
117S77.7Confident88.7Confident97 Ų9759.2 Ų59.268%0.67830%0.304SS*.THydrogen-bonded Turntrans-81-6178.549.80000113.8E115E115-S117 PolarHBondContact O-N 2.99Å
118C82.3Confident88.7Confident11 Ų1155.1 Ų55.17%0.07429%0.287CS..  trans-81133.3-175.7-171.80000112.1F80 E115 P116F80-C118 HydrophobicContact CE2-CB 4.26Å; F80-C118 WeakPolarHBondContact CE2-SG 3.25Å; E115-C118 VanDerWaalsContact O-CB 3.26Å; E115-C118 WeakPolarHBondContact O-CB 3.27Å; E115-C118 PolarHBondContact O-N 3.05Å; P116-C118 VanDerWaalsContact C-N 3.29Å
119S83.2Confident89Confident35 Ų3555 Ų5525%0.24529%0.289CS..  trans-129.5163.9170.975.50000110.2Y121 N122S119-Y121 PolarHBondContact O-N 3.41Å; S119-N122 WeakPolarHBondContact CA-OD1 3.27Å; S119-N122 WeakPolarHBondContact CB-OD1 3.36Å; S119-N122 PolarHBondContact N-OD1 2.83Å; S119-N122 WeakPolarHBondContact O-CB 3.4Å; S119-N122 PolarHBondContact O-N 3.33Å; S119-N122 PolarHBondContact O-OD1 3.23Å; S119-N122 PolarHBondContact OG-OD1 2.96Å
120V82.4Confident89.2Confident19 Ų1955 Ų5512%0.11529%0.289CS..G310 helixtrans-57.6-33.9176.8172.30000112.4N122 I123 L153 C157 P158 L159 G160V120-N122 PolarHBondContact O-N 2.92Å; V120-N122 VanDerWaalsContact O-N 3.11Å; V120-I123 PolarHBondContact O-N 3.39Å; V120-L153 HydrophobicContact CG2-CD1 4.07Å; V120-C157 HydrophobicContact CG2-CB 4.05Å; V120-P158 WeakPolarHBondContact CG2-O 3.42Å; V120-L159 HydrophobicContact CG2-CB 4.43Å; V120-G160 VanDerWaalsContact CG2-CA 3.41Å
121Y84.7Confident89.4Confident176 Ų17651.7 Ų51.769%0.6928%0.277SS*.G310 helixtrans-66-13.5-179.8-55.5-70.4000113.5Q84 S119 L159Q84-Y121 PolarHBondContact NE2-O 3.38Å; S119-Y121 PolarHBondContact O-N 3.41Å; Y121-L159 HydrophobicContact CE2-CD1 4.14Å; Y121-L159 VanDerWaalsContact OH-CD1 3.3Å; Y121-L159 WeakPolarHBondContact OH-CD1 3.36Å
122N84.3Confident89.8Confident39 Ų3949.3 Ų49.321%0.20926%0.257CS..G310 helixtrans-76.2-13.8174.6-66.7111.7000113F80 S119 V120F80-N122 HydrophobicContact CB-CB 3.59Å; F80-N122 HydrophobicContact CD1-CB 4.12Å; F80-N122 WeakPolarHBondContact CD1-O 3.33Å; F80-N122 HydrophobicContact CD2-CB 4.25Å; F80-N122 HydrophobicContact CG-CB 3.73Å; S119-N122 WeakPolarHBondContact CA-OD1 3.27Å; S119-N122 WeakPolarHBondContact CB-OD1 3.36Å; S119-N122 PolarHBondContact N-OD1 2.83Å; S119-N122 WeakPolarHBondContact O-CB 3.4Å; S119-N122 PolarHBondContact O-N 3.33Å; S119-N122 PolarHBondContact O-OD1 3.23Å; S119-N122 PolarHBondContact OG-OD1 2.96Å; V120-N122 PolarHBondContact O-N 2.92Å; V120-N122 VanDerWaalsContact O-N 3.11Å
123I91.2Very high90.1Very high13 Ų1354.5 Ų54.57%0.06728%0.277CS..SBendtrans-104.9114.3-178.7-50.8165.8000108.7F80 L113 V120 I127 L128 F149 L153F80-I123 HydrophobicContact CD1-CG1 4.27Å; F80-I123 HydrophobicContact CE1-CG1 3.81Å; F80-I123 HydrophobicContact CZ-CG1 4.48Å; L113-I123 HydrophobicContact CD2-CD1 3.55Å; L113-I123 HydrophobicContact CD2-CG1 4.28Å; V120-I123 PolarHBondContact O-N 3.39Å; I123-I127 HydrophobicContact CG2-CG2 4.48Å; I123-L128 HydrophobicContact CG2-CB 4.1Å; I123-F149 HydrophobicContact CD1-CZ 4.09Å; I123-L153 HydrophobicContact CD1-CD1 3.42Å; I123-L153 VanDerWaalsContact CD1-CD1 3.42Å; I123-L153 HydrophobicContact CD1-CD2 3.9Å; I123-L153 HydrophobicContact CD1-CG 4.29Å
124P93.5Very high90.5Very high16 Ų1655 Ų5510%0.10428%0.279CS..  trans-62.4141.6175.6-21.131.9000112.6V83 Q84 Q87 R126 I127 L128V83-P124 HydrophobicContact CG1-CG 4.29Å; Q84-P124 HydrophobicContact CG-CG 4.33Å; Q87-P124 HydrophobicContact CG-CB 4.03Å; Q87-P124 HydrophobicContact CG-CG 4.23Å; P124-R126 VanDerWaalsContact C-N 3.3Å; P124-R126 PolarHBondContact O-N 3.3Å; P124-I127 HydrophobicContact CB-CD1 4.39Å; P124-I127 HydrophobicContact CB-CG1 4.38Å; P124-I127 HydrophobicContact CG-CD1 3.99Å; P124-I127 WeakPolarHBondContact O-CB 3.41Å; P124-I127 PolarHBondContact O-N 3.38Å; P124-L128 PolarHBondContact O-N 3.46Å
125E94.7Very high91Very high127 Ų12750.5 Ų50.559%0.59325%0.252SS*.Hα-helixtrans-57.8-41.3-174.1-61.1-169.3138.300112.7I127 L128 M129 N168E125-I127 VanDerWaalsContact C-N 3.32Å; E125-I127 PolarHBondContact O-N 2.87Å; E125-L128 WeakPolarHBondContact O-CB 3.24Å; E125-L128 PolarHBondContact O-N 3.2Å; E125-M129 VanDerWaalsContact O-CG 3.26Å; E125-M129 WeakPolarHBondContact O-CG 3.45Å; E125-M129 PolarHBondContact O-N 3.47Å; E125-N168 PolarHBondContact OE1-ND2 2.67Å; E125-N168 VanDerWaalsContact OE1-ND2 3.13Å
126R95.5Very high91.5Very high144 Ų14448.4 Ų48.454%0.54324%0.243SC..Hα-helixtrans-62.1-39.8177.9-67.2-173.9-179.4176.9-4.8112.3E88 L91 P124 M129 S130E88-R126 IonicContact OE1-NH1 3.13Å; E88-R126 PolarHBondContact OE1-NH1 3.4Å; E88-R126 VanDerWaalsContact OE1-NH1 3.13Å; E88-R126 IonicContact OE2-NH1 3.72Å; L91-R126 HydrophobicContact CD1-CB 3.74Å; L91-R126 HydrophobicContact CD2-CB 4.08Å; L91-R126 WeakPolarHBondContact CD2-O 3.34Å; P124-R126 VanDerWaalsContact C-N 3.3Å; P124-R126 PolarHBondContact O-N 3.3Å; R126-M129 PolarHBondContact O-N 3.07Å; R126-S130 WeakPolarHBondContact O-CB 3.46Å; R126-S130 PolarHBondContact O-N 3.24Å
127I96.1Very high92.4Very high2 Ų244.3 Ų44.31%0.0121%0.211CC..Hα-helixtrans-65.5-45.7176.6-68.8-177.9000109.2V83 Q87 L90 L91 L94 I123 P124 E125 M129 S130 I131V83-I127 HydrophobicContact CG1-CD1 3.47Å; V83-I127 VanDerWaalsContact CG1-CD1 3.47Å; Q87-I127 HydrophobicContact CB-CD1 4.47Å; Q87-I127 HydrophobicContact CG-CD1 3.95Å; Q87-I127 HydrophobicContact CG-CG1 4.01Å; L90-I127 HydrophobicContact CB-CD1 4.2Å; L90-I127 HydrophobicContact CD1-CD1 4.14Å; L91-I127 HydrophobicContact CD2-CG1 4.06Å; L91-I127 HydrophobicContact CG-CG1 4.16Å; L94-I127 HydrophobicContact CD1-CG2 4.04Å; I123-I127 HydrophobicContact CG2-CG2 4.48Å; P124-I127 HydrophobicContact CB-CD1 4.39Å; P124-I127 HydrophobicContact CB-CG1 4.38Å; P124-I127 HydrophobicContact CG-CD1 3.99Å; P124-I127 WeakPolarHBondContact O-CB 3.41Å; P124-I127 PolarHBondContact O-N 3.38Å; E125-I127 VanDerWaalsContact C-N 3.32Å; E125-I127 PolarHBondContact O-N 2.87Å; I127-M129 VanDerWaalsContact C-N 3.31Å; I127-M129 PolarHBondContact O-N 3.4Å; I127-S130 PolarHBondContact O-N 2.85Å; I127-I131 HydrophobicContact CG2-CD1 3.85Å; I127-I131 HydrophobicContact CG2-CG1 4.38Å; I127-I131 VanDerWaalsContact O-CG1 3.32Å; I127-I131 WeakPolarHBondContact O-CG1 3.44Å; I127-I131 PolarHBondContact O-N 3.36Å
128L96.7Very high93.1Very high4 Ų445 Ų452%0.02121%0.208CC..Hα-helixtrans-59.4-42.2176.8-177.560.9000112I123 P124 E125 I131 A132 F149 L150 L153 S163 N168 V169I123-L128 HydrophobicContact CG2-CB 4.1Å; P124-L128 PolarHBondContact O-N 3.46Å; E125-L128 WeakPolarHBondContact O-CB 3.24Å; E125-L128 PolarHBondContact O-N 3.2Å; L128-I131 PolarHBondContact O-N 3.41Å; L128-A132 WeakPolarHBondContact O-CB 3.37Å; L128-A132 PolarHBondContact O-N 3.13Å; L128-F149 HydrophobicContact CD1-CE1 4.17Å; L128-L150 HydrophobicContact CD1-CD2 3.77Å; L128-L153 HydrophobicContact CD1-CD2 3.66Å; L128-L153 HydrophobicContact CD2-CD2 4.47Å; L128-S163 VanDerWaalsContact CD2-OG 3.28Å; L128-S163 WeakPolarHBondContact CD2-OG 3.48Å; L128-N168 HydrophobicContact CD2-CB 4.13Å; L128-V169 HydrophobicContact CD1-CG2 3.81Å; L128-V169 HydrophobicContact CD2-CG2 3.89Å; L128-V169 HydrophobicContact CG-CG2 3.65Å
129M97.6Very high93.7Very high55 Ų5547.5 Ų47.527%0.27122%0.217SC..Hα-helixtrans-63.7-41.6175.2-69.1173.774.100112.1E125 R126 I127 A132 R133 N168E125-M129 VanDerWaalsContact O-CG 3.26Å; E125-M129 WeakPolarHBondContact O-CG 3.45Å; E125-M129 PolarHBondContact O-N 3.47Å; R126-M129 PolarHBondContact O-N 3.07Å; I127-M129 VanDerWaalsContact C-N 3.31Å; I127-M129 PolarHBondContact O-N 3.4Å; M129-A132 WeakPolarHBondContact O-CB 3.44Å; M129-A132 PolarHBondContact O-N 3.19Å; M129-R133 WeakPolarHBondContact O-CG 3.46Å; M129-R133 PolarHBondContact O-N 3.43Å; M129-N168 HydrophobicContact CG-CB 4.24Å; M129-N168 WeakPolarHBondContact CG-O 3.39Å
130S97.6Very high94.2Very high3 Ų350 Ų502%0.02123%0.228CC..Hα-helixtrans-63.2-44.4176.4-173.40000111.2L94 R126 I127 A132 R133 L134L94-S130 WeakPolarHBondContact CB-OG 3.49Å; R126-S130 WeakPolarHBondContact O-CB 3.46Å; R126-S130 PolarHBondContact O-N 3.24Å; I127-S130 PolarHBondContact O-N 2.85Å; S130-A132 VanDerWaalsContact C-N 3.33Å; S130-A132 PolarHBondContact O-N 2.98Å; S130-R133 WeakPolarHBondContact O-CB 3.36Å; S130-R133 PolarHBondContact O-N 3.28Å; S130-L134 PolarHBondContact O-N 2.85Å; S130-L134 VanDerWaalsContact O-N 3.13Å
131I98.3Very high94.8Very high0 Ų051 Ų510%024%0.235CC..Hα-helixtrans-62.8-39.7173.7-62.4171.5000111.4L94 L106 L109 I127 L128 R133 L134 V135 A146 F149L94-I131 HydrophobicContact CD1-CG1 4.26Å; L106-I131 HydrophobicContact CD2-CB 4.3Å; L106-I131 HydrophobicContact CD2-CD1 4.15Å; L106-I131 HydrophobicContact CD2-CG1 3.73Å; L106-I131 HydrophobicContact CD2-CG2 3.8Å; L109-I131 HydrophobicContact CD1-CD1 3.97Å; I127-I131 HydrophobicContact CG2-CD1 3.85Å; I127-I131 HydrophobicContact CG2-CG1 4.38Å; I127-I131 VanDerWaalsContact O-CG1 3.32Å; I127-I131 WeakPolarHBondContact O-CG1 3.44Å; I127-I131 PolarHBondContact O-N 3.36Å; L128-I131 PolarHBondContact O-N 3.41Å; I131-R133 VanDerWaalsContact C-N 3.34Å; I131-R133 PolarHBondContact O-N 3.26Å; I131-L134 WeakPolarHBondContact O-CB 3.42Å; I131-L134 PolarHBondContact O-N 3.41Å; I131-L134 VanDerWaalsContact O-N 3.12Å; I131-V135 PolarHBondContact O-N 2.89Å; I131-A146 HydrophobicContact CG2-CB 4.23Å; I131-F149 HydrophobicContact CB-CD1 4.48Å; I131-F149 HydrophobicContact CD1-CD1 4.03Å; I131-F149 HydrophobicContact CD1-CD2 4.49Å; I131-F149 HydrophobicContact CD1-CE1 3.63Å; I131-F149 HydrophobicContact CD1-CE2 4.16Å; I131-F149 HydrophobicContact CD1-CG 4.44Å; I131-F149 HydrophobicContact CD1-CZ 3.7Å; I131-F149 HydrophobicContact CG2-CB 4.36Å; I131-F149 HydrophobicContact CG2-CD1 3.56Å; I131-F149 HydrophobicContact CG2-CE1 4.1Å; I131-F149 HydrophobicContact CG2-CG 4.09Å
132A98.3Very high95.4Very high0 Ų042.6 Ų42.60%020%0.202CC..Hα-helixtrans-59.3-44.6174.700000111.2L128 M129 S130 L134 V135 V169 T172 L173L128-A132 WeakPolarHBondContact O-CB 3.37Å; L128-A132 PolarHBondContact O-N 3.13Å; M129-A132 WeakPolarHBondContact O-CB 3.44Å; M129-A132 PolarHBondContact O-N 3.19Å; S130-A132 VanDerWaalsContact C-N 3.33Å; S130-A132 PolarHBondContact O-N 2.98Å; A132-L134 PolarHBondContact O-N 3.46Å; A132-V135 VanDerWaalsContact O-CB 3.24Å; A132-V135 WeakPolarHBondContact O-CB 3.45Å; A132-V135 WeakPolarHBondContact O-CG2 3.39Å; A132-V135 PolarHBondContact O-N 3.38Å; A132-V135 VanDerWaalsContact O-N 3.08Å; A132-V169 HydrophobicContact CB-CB 4.3Å; A132-V169 HydrophobicContact CB-CG1 4.05Å; A132-V169 HydrophobicContact CB-CG2 4.28Å; A132-T172 HydrophobicContact CB-CG2 4.35Å; A132-L173 HydrophobicContact CB-CG 4.47Å; A132-L173 WeakPolarHBondContact O-CD2 3.23Å
133R97.4Very high96Very high110 Ų11040.8 Ų40.842%0.41519%0.192SC..Hα-helixtrans-59.9-34.3175.2-66.2172.3-170.4155.11112.5E95 M129 S130 I131 V135 L136 T172 L176E95-R133 IonicContact OE1-NH1 2.62Å; E95-R133 PolarHBondContact OE1-NH1 2.91Å; E95-R133 VanDerWaalsContact OE1-NH1 3.09Å; M129-R133 WeakPolarHBondContact O-CG 3.46Å; M129-R133 PolarHBondContact O-N 3.43Å; S130-R133 WeakPolarHBondContact O-CB 3.36Å; S130-R133 PolarHBondContact O-N 3.28Å; I131-R133 VanDerWaalsContact C-N 3.34Å; I131-R133 PolarHBondContact O-N 3.26Å; R133-V135 PolarHBondContact O-N 2.7Å; R133-L136 WeakPolarHBondContact O-CB 3.36Å; R133-L136 PolarHBondContact O-N 2.87Å; R133-T172 HydrophobicContact CG-CG2 3.73Å; R133-L176 HydrophobicContact CG-CD1 3.78Å
134L97.9Very high96.4Very high12 Ų1244.1 Ų44.16%0.06321%0.209CC..Hα-helixtrans-65.4-19.3178-69.5170.9000113.4L94 I102 L106 S130 I131 A132 L136 H137 S143 A146L94-L134 HydrophobicContact CD2-CD1 4.08Å; I102-L134 HydrophobicContact CG2-CD1 3.64Å; I102-L134 HydrophobicContact CG2-CD2 4.21Å; L106-L134 HydrophobicContact CD1-CD1 4.07Å; L106-L134 HydrophobicContact CD2-CD1 4.13Å; L106-L134 HydrophobicContact CG-CD1 4.38Å; S130-L134 PolarHBondContact O-N 2.85Å; S130-L134 VanDerWaalsContact O-N 3.13Å; I131-L134 WeakPolarHBondContact O-CB 3.42Å; I131-L134 PolarHBondContact O-N 3.41Å; I131-L134 VanDerWaalsContact O-N 3.12Å; A132-L134 PolarHBondContact O-N 3.46Å; L134-L136 PolarHBondContact O-N 3.34Å; L134-H137 HydrophobicContact CD2-CB 4.32Å; L134-H137 WeakPolarHBondContact O-CB 3.44Å; L134-H137 PolarHBondContact O-N 3.48Å; L134-H137 VanDerWaalsContact O-N 3.08Å; L134-S143 WeakPolarHBondContact O-CA 3.29Å; L134-A146 HydrophobicContact CB-CB 3.84Å
135V98.2Very high96.6Very high0 Ų044 Ų440%021%0.207CC..THydrogen-bonded Turntrans-56.7-32.2168.2175.10000111I131 A132 R133 S143 A146 Q147 L150 L173 R185 V186I131-V135 PolarHBondContact O-N 2.89Å; A132-V135 VanDerWaalsContact O-CB 3.24Å; A132-V135 WeakPolarHBondContact O-CB 3.45Å; A132-V135 WeakPolarHBondContact O-CG2 3.39Å; A132-V135 PolarHBondContact O-N 3.38Å; A132-V135 VanDerWaalsContact O-N 3.08Å; R133-V135 PolarHBondContact O-N 2.7Å; V135-S143 WeakPolarHBondContact O-CB 3.46Å; V135-S143 PolarHBondContact O-OG 3.35Å; V135-A146 HydrophobicContact CG2-CB 4.01Å; V135-Q147 HydrophobicContact CG1-CG 3.86Å; V135-Q147 HydrophobicContact CG2-CG 4.27Å; V135-L150 HydrophobicContact CG2-CD1 3.57Å; V135-L173 HydrophobicContact CB-CD2 4.09Å; V135-L173 HydrophobicContact CG1-CD2 4.44Å; V135-R185 HydrophobicContact CG1-CB 4.44Å; V135-R185 WeakPolarHBondContact O-CD 3.44Å; V135-V186 HydrophobicContact CG1-CG2 4.43Å
136L96.9Very high96.8Very high14 Ų1438 Ų387%0.07318%0.179CC..THydrogen-bonded Turntrans-89.1-0.3-178.9-53.7-174.8000113.6R133 L134 L173 L176 H182 R185 V186R133-L136 WeakPolarHBondContact O-CB 3.36Å; R133-L136 PolarHBondContact O-N 2.87Å; L134-L136 PolarHBondContact O-N 3.34Å; L136-L173 HydrophobicContact CD1-CD2 4.15Å; L136-L173 HydrophobicContact CD2-CD2 4.02Å; L136-L173 HydrophobicContact CG-CD2 3.84Å; L136-L176 HydrophobicContact CD1-CB 3.49Å; L136-L176 VanDerWaalsContact CD1-CB 3.49Å; L136-L176 HydrophobicContact CD1-CD1 4.48Å; L136-H182 HydrophobicContact CD2-CB 3.85Å; L136-R185 PolarHBondContact O-NH1 2.9Å; L136-V186 HydrophobicContact CD2-CG2 3.57Å
137H95.7Very high96.9Very high53 Ų5331.1 Ų31.125%0.24515%0.153CC..  trans-66.9136.6-172.4-171.3-78.2000113.3L134 K139 L142 R185L134-H137 HydrophobicContact CD2-CB 4.32Å; L134-H137 WeakPolarHBondContact O-CB 3.44Å; L134-H137 PolarHBondContact O-N 3.48Å; L134-H137 VanDerWaalsContact O-N 3.08Å; H137-K139 VanDerWaalsContact C-N 3.32Å; H137-K139 WeakPolarHBondContact ND1-CB 3.12Å; H137-K139 PolarHBondContact ND1-N 3.34Å; H137-K139 PolarHBondContact O-N 3.1Å; H137-L142 HydrophobicContact CB-CB 4.42Å; H137-R185 VanDerWaalsContact C-NH1 3.25Å; H137-R185 PolarHBondContact O-NH1 3.49Å; H137-R185 PolarHBondContact O-NH2 3.4Å
138D92.6Very high97Very high113 Ų11333.7 Ų33.760%0.60417%0.167SC*.SBendtrans-57.2-36.7-175.8-65.3-25.3000114.2L140 R185D138-L140 PolarHBondContact O-N 3.27Å; D138-R185 PolarHBondContact O-NH2 3.41Å; D138-R185 VanDerWaalsContact O-NH2 3.15Å
139K94.4Very high97.1Very high62 Ų6233.6 Ų33.627%0.2717%0.166SC..SBendtrans-69.2110.5171.3-170.7-179.4-177.8-157.50110.3L99 D100 E103 H137 S141 L142 S143L99-K139 HydrophobicContact CB-CD 4.14Å; L99-K139 HydrophobicContact CD1-CD 3.83Å; D100-K139 IonicContact OD1-NZ 3.13Å; D100-K139 PolarHBondContact OD1-NZ 2.91Å; E103-K139 IonicContact OE2-NZ 3.44Å; E103-K139 PolarHBondContact OE2-NZ 2.84Å; H137-K139 VanDerWaalsContact C-N 3.32Å; H137-K139 WeakPolarHBondContact ND1-CB 3.12Å; H137-K139 PolarHBondContact ND1-N 3.34Å; H137-K139 PolarHBondContact O-N 3.1Å; K139-S141 VanDerWaalsContact C-N 3.29Å; K139-S141 WeakPolarHBondContact CE-OG 3.03Å; K139-S141 PolarHBondContact O-N 3.22Å; K139-L142 HydrophobicContact CB-CB 4.49Å; K139-L142 HydrophobicContact CB-CD1 4.27Å; K139-L142 HydrophobicContact CB-CG 4.37Å; K139-L142 HydrophobicContact CD-CD1 4.14Å; K139-L142 HydrophobicContact CD-CG 4.07Å; K139-L142 HydrophobicContact CG-CG 4.46Å; K139-L142 PolarHBondContact O-N 3.07Å; K139-S143 PolarHBondContact O-N 3.32Å
140L94.4Very high97.1Very high89 Ų8931 Ų3147%0.46615%0.153SC..Hα-helixtrans-54.8-38.4-177.3-172.461.9000114D138 L142 S143 M144D138-L140 PolarHBondContact O-N 3.27Å; L140-L142 VanDerWaalsContact C-N 3.3Å; L140-L142 PolarHBondContact O-N 3.18Å; L140-S143 PolarHBondContact O-N 2.91Å; L140-M144 HydrophobicContact CD1-CE 3.87Å; L140-M144 HydrophobicContact CD1-CG 4.29Å; L140-M144 HydrophobicContact CD2-CE 3.72Å; L140-M144 HydrophobicContact CD2-SD 4.5Å; L140-M144 HydrophobicContact CG-CE 3.69Å; L140-M144 HydrophobicContact CG-CG 4.31Å; L140-M144 HydrophobicContact CG-SD 4.05Å; L140-M144 WeakPolarHBondContact O-CB 3.49Å; L140-M144 WeakPolarHBondContact O-CG 3.36Å; L140-M144 PolarHBondContact O-N 3.28Å
141S95.4Very high97.1Very high39 Ų3931.3 Ų31.327%0.27316%0.155SC..Hα-helixtrans-62.6-3717969.10000112.7E103 K139 E145E103-S141 PolarHBondContact OE2-OG 3.08Å; K139-S141 VanDerWaalsContact C-N 3.29Å; K139-S141 WeakPolarHBondContact CE-OG 3.03Å; K139-S141 PolarHBondContact O-N 3.22Å; S141-E145 VanDerWaalsContact O-CB 3.31Å; S141-E145 WeakPolarHBondContact O-CB 3.41Å; S141-E145 PolarHBondContact O-N 3.33Å
142L97.1Very high97.1Very high0 Ų032.5 Ų32.50%016%0.162CC..Hα-helixtrans-71.7-43.4176.9-70.3-179.6000111.6L99 I102 E103 L106 H137 K139 L140 E145 A146L99-L142 HydrophobicContact CB-CD1 4.07Å; L99-L142 HydrophobicContact CD2-CD1 3.85Å; L99-L142 HydrophobicContact CG-CD1 4.44Å; I102-L142 HydrophobicContact CB-CD2 4.16Å; I102-L142 HydrophobicContact CG2-CD1 4.39Å; I102-L142 HydrophobicContact CG2-CD2 3.88Å; E103-L142 HydrophobicContact CB-CD2 3.5Å; E103-L142 HydrophobicContact CG-CD2 3.98Å; L106-L142 HydrophobicContact CD1-CD2 4.31Å; H137-L142 HydrophobicContact CB-CB 4.42Å; K139-L142 HydrophobicContact CB-CB 4.49Å; K139-L142 HydrophobicContact CB-CD1 4.27Å; K139-L142 HydrophobicContact CB-CG 4.37Å; K139-L142 HydrophobicContact CD-CD1 4.14Å; K139-L142 HydrophobicContact CD-CG 4.07Å; K139-L142 HydrophobicContact CG-CG 4.46Å; K139-L142 PolarHBondContact O-N 3.07Å; L140-L142 VanDerWaalsContact C-N 3.3Å; L140-L142 PolarHBondContact O-N 3.18Å; L142-E145 PolarHBondContact O-N 3.43Å; L142-A146 WeakPolarHBondContact O-CB 3.44Å; L142-A146 PolarHBondContact O-N 2.98Å
143S97.5Very high97Very high0 Ų032.5 Ų32.50%016%0.162CC..Hα-helixtrans-56.1-53.9173.6175.80000110.6L134 V135 K139 L140 E145 A146 Q147 R185L134-S143 WeakPolarHBondContact O-CA 3.29Å; V135-S143 WeakPolarHBondContact O-CB 3.46Å; V135-S143 PolarHBondContact O-OG 3.35Å; K139-S143 PolarHBondContact O-N 3.32Å; L140-S143 PolarHBondContact O-N 2.91Å; S143-E145 VanDerWaalsContact C-N 3.33Å; S143-E145 PolarHBondContact O-N 3.11Å; S143-A146 PolarHBondContact O-N 3.37Å; S143-Q147 VanDerWaalsContact O-CG 3.26Å; S143-Q147 WeakPolarHBondContact O-CG 3.4Å; S143-Q147 PolarHBondContact O-N 2.8Å; S143-Q147 PolarHBondContact OG-NE2 2.9Å; S143-R185 WeakPolarHBondContact OG-CD 3.42Å
144M97.8Very high96.9Very high84 Ų8427.5 Ų27.541%0.41414%0.144SC..Hα-helixtrans-59.1-41.7179.5-73178.6170.900112.5L140 Q147 N148L140-M144 HydrophobicContact CD1-CE 3.87Å; L140-M144 HydrophobicContact CD1-CG 4.29Å; L140-M144 HydrophobicContact CD2-CE 3.72Å; L140-M144 HydrophobicContact CD2-SD 4.5Å; L140-M144 HydrophobicContact CG-CE 3.69Å; L140-M144 HydrophobicContact CG-CG 4.31Å; L140-M144 HydrophobicContact CG-SD 4.05Å; L140-M144 WeakPolarHBondContact O-CB 3.49Å; L140-M144 WeakPolarHBondContact O-CG 3.36Å; L140-M144 PolarHBondContact O-N 3.28Å; M144-Q147 PolarHBondContact O-N 3.22Å; M144-N148 WeakPolarHBondContact O-CB 3.31Å; M144-N148 VanDerWaalsContact O-CG 3.26Å; M144-N148 PolarHBondContact O-N 3.02Å; M144-N148 PolarHBondContact O-ND2 2.91Å
145E98Very high96.7Very high13 Ų1328.8 Ų28.86%0.06115%0.153CC..Hα-helixtrans-68.5-38.3179.3-170.558.9-148.400112L106 K107 R110 S141 L142 S143 N148 F149L106-E145 HydrophobicContact CB-CB 4.49Å; L106-E145 HydrophobicContact CB-CG 3.64Å; L106-E145 HydrophobicContact CD1-CB 4.26Å; L106-E145 HydrophobicContact CD1-CG 4.27Å; K107-E145 WeakPolarHBondContact CA-OE1 3.23Å; K107-E145 HydrophobicContact CG-CG 3.84Å; K107-E145 WeakPolarHBondContact CG-OE1 3.32Å; R110-E145 VanDerWaalsContact CZ-CD 3.48Å; R110-E145 IonicContact CZ-OE1 3.69Å; R110-E145 IonicContact CZ-OE2 3.6Å; R110-E145 IonicContact NE-OE1 3.28Å; R110-E145 PolarHBondContact NE-OE1 3.44Å; R110-E145 IonicContact NH1-OE1 2.73Å; R110-E145 PolarHBondContact NH1-OE1 3.02Å; R110-E145 IonicContact NH1-OE2 3.65Å; R110-E145 PolarHBondContact NH1-OE2 2.97Å; R110-E145 IonicContact NH2-OE1 2.95Å; R110-E145 PolarHBondContact NH2-OE1 3.39Å; R110-E145 VanDerWaalsContact NH2-OE1 3.16Å; R110-E145 IonicContact NH2-OE2 3.81Å; R110-E145 PolarHBondContact NH2-OE2 2.68Å; S141-E145 VanDerWaalsContact O-CB 3.31Å; S141-E145 WeakPolarHBondContact O-CB 3.41Å; S141-E145 PolarHBondContact O-N 3.33Å; L142-E145 PolarHBondContact O-N 3.43Å; S143-E145 VanDerWaalsContact C-N 3.33Å; S143-E145 PolarHBondContact O-N 3.11Å; E145-N148 PolarHBondContact O-N 3.38Å; E145-F149 PolarHBondContact O-N 2.81Å
146A98.7Very high96.5Very high0 Ų035.3 Ų35.30%018%0.181CC..Hα-helixtrans-64.2-43.5172.700000112L106 I131 L134 V135 L142 S143 N148 F149 L150L106-A146 HydrophobicContact CD1-CB 4.28Å; I131-A146 HydrophobicContact CG2-CB 4.23Å; L134-A146 HydrophobicContact CB-CB 3.84Å; V135-A146 HydrophobicContact CG2-CB 4.01Å; L142-A146 WeakPolarHBondContact O-CB 3.44Å; L142-A146 PolarHBondContact O-N 2.98Å; S143-A146 PolarHBondContact O-N 3.37Å; A146-N148 VanDerWaalsContact C-N 3.35Å; A146-N148 PolarHBondContact O-N 3.19Å; A146-F149 WeakPolarHBondContact O-CB 3.36Å; A146-F149 PolarHBondContact O-N 3.21Å; A146-L150 WeakPolarHBondContact O-CG 3.33Å; A146-L150 PolarHBondContact O-N 2.7Å
147Q98.5Very high96.2Very high0 Ų035.1 Ų35.10%018%0.181CC..Hα-helixtrans-58-48173.2-65.7-177.739.600110.8V135 S143 M144 F149 L150 I151 F189V135-Q147 HydrophobicContact CG1-CG 3.86Å; V135-Q147 HydrophobicContact CG2-CG 4.27Å; S143-Q147 VanDerWaalsContact O-CG 3.26Å; S143-Q147 WeakPolarHBondContact O-CG 3.4Å; S143-Q147 PolarHBondContact O-N 2.8Å; S143-Q147 PolarHBondContact OG-NE2 2.9Å; M144-Q147 PolarHBondContact O-N 3.22Å; Q147-F149 VanDerWaalsContact C-N 3.32Å; Q147-F149 PolarHBondContact O-N 2.88Å; Q147-L150 PolarHBondContact O-N 2.91Å; Q147-I151 VanDerWaalsContact O-CG1 3.26Å; Q147-I151 WeakPolarHBondContact O-CG1 3.36Å; Q147-I151 PolarHBondContact O-N 3.16Å; Q147-F189 HydrophobicContact CB-CB 4.37Å; Q147-F189 HydrophobicContact CB-CD2 4.5Å; Q147-F189 HydrophobicContact CG-CB 3.93Å
148N98.4Very high95.9Very high57 Ų5737.1 Ų37.131%0.30520%0.198SC..Hα-helixtrans-63.5-36.1178.6-75.1-47.1000112.8M144 E145 A146 T152M144-N148 WeakPolarHBondContact O-CB 3.31Å; M144-N148 VanDerWaalsContact O-CG 3.26Å; M144-N148 PolarHBondContact O-N 3.02Å; M144-N148 PolarHBondContact O-ND2 2.91Å; E145-N148 PolarHBondContact O-N 3.38Å; A146-N148 VanDerWaalsContact C-N 3.35Å; A146-N148 PolarHBondContact O-N 3.19Å; N148-T152 WeakPolarHBondContact O-CB 3.33Å; N148-T152 PolarHBondContact O-N 3.17Å; N148-T152 PolarHBondContact O-OG1 3.47Å
149F98.1Very high95.8Very high1 Ų136.3 Ų36.30%0.00419%0.194CC..Hα-helixtrans-59.3-51171.8175.2-86.7000110.8L109 R110 L113 I123 L128 I131 E145 A146 Q147 I151 T152 L153L109-F149 HydrophobicContact CB-CD2 4.11Å; L109-F149 HydrophobicContact CB-CE2 3.66Å; R110-F149 HydrophobicContact CB-CB 4.41Å; R110-F149 HydrophobicContact CB-CD2 3.97Å; L113-F149 HydrophobicContact CD1-CD2 3.75Å; L113-F149 HydrophobicContact CD1-CE1 4.37Å; L113-F149 HydrophobicContact CD1-CE2 3.49Å; L113-F149 VanDerWaalsContact CD1-CE2 3.49Å; L113-F149 HydrophobicContact CD1-CG 4.27Å; L113-F149 HydrophobicContact CD1-CZ 3.85Å; L113-F149 HydrophobicContact CD2-CE2 4.24Å; L113-F149 HydrophobicContact CD2-CZ 4.31Å; L113-F149 HydrophobicContact CG-CD2 4.48Å; L113-F149 HydrophobicContact CG-CE2 3.91Å; L113-F149 HydrophobicContact CG-CZ 4.4Å; I123-F149 HydrophobicContact CD1-CZ 4.09Å; L128-F149 HydrophobicContact CD1-CE1 4.17Å; I131-F149 HydrophobicContact CB-CD1 4.48Å; I131-F149 HydrophobicContact CD1-CD1 4.03Å; I131-F149 HydrophobicContact CD1-CD2 4.49Å; I131-F149 HydrophobicContact CD1-CE1 3.63Å; I131-F149 HydrophobicContact CD1-CE2 4.16Å; I131-F149 HydrophobicContact CD1-CG 4.44Å; I131-F149 HydrophobicContact CD1-CZ 3.7Å; I131-F149 HydrophobicContact CG2-CB 4.36Å; I131-F149 HydrophobicContact CG2-CD1 3.56Å; I131-F149 HydrophobicContact CG2-CE1 4.1Å; I131-F149 HydrophobicContact CG2-CG 4.09Å; E145-F149 PolarHBondContact O-N 2.81Å; A146-F149 WeakPolarHBondContact O-CB 3.36Å; A146-F149 PolarHBondContact O-N 3.21Å; Q147-F149 VanDerWaalsContact C-N 3.32Å; Q147-F149 PolarHBondContact O-N 2.88Å; F149-I151 PolarHBondContact O-N 3.35Å; F149-T152 PolarHBondContact O-N 3.34Å; F149-L153 HydrophobicContact CE1-CD2 4.32Å; F149-L153 WeakPolarHBondContact O-CB 3.41Å; F149-L153 PolarHBondContact O-N 2.86Å
150L98.4Very high95.8Very high0 Ų033.4 Ų33.40%018%0.181CC..Hα-helixtrans-64.2-39.8-179.8-65.3176.2000112.4L128 V135 A146 Q147 T152 L153 A154 V164 V169 F189L128-L150 HydrophobicContact CD1-CD2 3.77Å; V135-L150 HydrophobicContact CG2-CD1 3.57Å; A146-L150 WeakPolarHBondContact O-CG 3.33Å; A146-L150 PolarHBondContact O-N 2.7Å; Q147-L150 PolarHBondContact O-N 2.91Å; L150-T152 VanDerWaalsContact C-N 3.34Å; L150-L153 PolarHBondContact O-N 2.89Å; L150-A154 WeakPolarHBondContact O-CB 3.41Å; L150-A154 PolarHBondContact O-N 3.47Å; L150-V164 HydrophobicContact CB-CG1 4.45Å; L150-V164 HydrophobicContact CD2-CG2 4.42Å; L150-V169 HydrophobicContact CD1-CG1 3.83Å; L150-V169 HydrophobicContact CD2-CG1 4.18Å; L150-V169 HydrophobicContact CD2-CG2 3.98Å; L150-F189 HydrophobicContact CB-CD2 4.34Å; L150-F189 HydrophobicContact CB-CE2 3.72Å; L150-F189 HydrophobicContact CB-CZ 4.27Å
151I98Very high95.9Very high11 Ų1130.9 Ų30.96%0.05617%0.168CC..Hα-helixtrans-62.8-43.4174.2-67.1163.9000110.2Q147 F149 A154 T155 F189 Q192 L193 K196Q147-I151 VanDerWaalsContact O-CG1 3.26Å; Q147-I151 WeakPolarHBondContact O-CG1 3.36Å; Q147-I151 PolarHBondContact O-N 3.16Å; F149-I151 PolarHBondContact O-N 3.35Å; I151-A154 PolarHBondContact O-N 3.25Å; I151-T155 HydrophobicContact CG2-CG2 4.25Å; I151-T155 WeakPolarHBondContact O-CB 3.38Å; I151-T155 WeakPolarHBondContact O-CG2 3.24Å; I151-T155 PolarHBondContact O-N 3.08Å; I151-T155 PolarHBondContact O-OG1 3.28Å; I151-F189 HydrophobicContact CD1-CD2 4.27Å; I151-F189 HydrophobicContact CG1-CD2 3.81Å; I151-F189 HydrophobicContact CG1-CE2 3.81Å; I151-Q192 HydrophobicContact CD1-CB 3.61Å; I151-L193 HydrophobicContact CG1-CB 4.26Å; I151-L193 HydrophobicContact CG2-CD1 4.4Å; I151-K196 HydrophobicContact CG2-CG 4.37Å
152T96.9Very high95.9Very high24 Ų2436.9 Ų36.915%0.14719%0.189CC..Hα-helixtrans-64-43.7177.5-55.50000110.7R110 L113 V114 N148 F149 L150 A154 T155 K156R110-T152 HydrophobicContact CG-CG2 4.17Å; L113-T152 HydrophobicContact CB-CG2 3.93Å; L113-T152 HydrophobicContact CD1-CG2 4.19Å; V114-T152 HydrophobicContact CG2-CG2 3.97Å; N148-T152 WeakPolarHBondContact O-CB 3.33Å; N148-T152 PolarHBondContact O-N 3.17Å; N148-T152 PolarHBondContact O-OG1 3.47Å; F149-T152 PolarHBondContact O-N 3.34Å; L150-T152 VanDerWaalsContact C-N 3.34Å; T152-A154 PolarHBondContact O-N 3.03Å; T152-T155 PolarHBondContact O-N 3.39Å; T152-T155 PolarHBondContact O-OG1 3.26Å; T152-K156 HydrophobicContact CG2-CB 4.4Å; T152-K156 HydrophobicContact CG2-CG 3.92Å; T152-K156 VanDerWaalsContact O-CB 3.24Å; T152-K156 WeakPolarHBondContact O-CB 3.19Å; T152-K156 WeakPolarHBondContact O-CG 3.44Å; T152-K156 PolarHBondContact O-N 3.12Å
153L96.2Very high95.8Very high0 Ų038 Ų380%020%0.197CC..Hα-helixtrans-58.1-49.5175.6-179.658.2000111.1L113 V120 I123 L128 F149 L150 T155 C157 G160 V164L113-L153 HydrophobicContact CD1-CB 3.82Å; L113-L153 HydrophobicContact CD1-CD1 4.45Å; L113-L153 HydrophobicContact CD2-CD1 4.1Å; V120-L153 HydrophobicContact CG2-CD1 4.07Å; I123-L153 HydrophobicContact CD1-CD1 3.42Å; I123-L153 VanDerWaalsContact CD1-CD1 3.42Å; I123-L153 HydrophobicContact CD1-CD2 3.9Å; I123-L153 HydrophobicContact CD1-CG 4.29Å; L128-L153 HydrophobicContact CD1-CD2 3.66Å; L128-L153 HydrophobicContact CD2-CD2 4.47Å; F149-L153 HydrophobicContact CE1-CD2 4.32Å; F149-L153 WeakPolarHBondContact O-CB 3.41Å; F149-L153 PolarHBondContact O-N 2.86Å; L150-L153 PolarHBondContact O-N 2.89Å; L153-T155 VanDerWaalsContact C-N 3.33Å; L153-T155 PolarHBondContact O-N 3.08Å; L153-C157 HydrophobicContact CD1-CB 3.92Å; L153-C157 PolarHBondContact O-N 3.44Å; L153-G160 WeakPolarHBondContact O-CA 3.26Å; L153-V164 HydrophobicContact CB-CG2 4.13Å; L153-V164 HydrophobicContact CD2-CG2 3.77Å; L153-V164 HydrophobicContact CG-CG2 3.91Å
154A96.3Very high95.8Very high6 Ų638 Ų385%0.0520%0.197CC..Hα-helixtrans-61.5-39.5-179.500000113L150 I151 T152 L161 V164 L193L150-A154 WeakPolarHBondContact O-CB 3.41Å; L150-A154 PolarHBondContact O-N 3.47Å; I151-A154 PolarHBondContact O-N 3.25Å; T152-A154 PolarHBondContact O-N 3.03Å; A154-L161 HydrophobicContact CB-CD1 4.28Å; A154-L161 PolarHBondContact O-N 3.21Å; A154-V164 HydrophobicContact CB-CB 4.21Å; A154-V164 HydrophobicContact CB-CG1 4.32Å; A154-V164 HydrophobicContact CB-CG2 4.1Å; A154-L193 HydrophobicContact CB-CD1 3.72Å; A154-L193 HydrophobicContact CB-CD2 4.35Å
155T94.3Very high95.7Very high39 Ų3935.5 Ų35.524%0.23919%0.185CC..Hα-helixtrans-94.9-20.3-170.559.40000114.5I151 T152 L153 L193 Q197I151-T155 HydrophobicContact CG2-CG2 4.25Å; I151-T155 WeakPolarHBondContact O-CB 3.38Å; I151-T155 WeakPolarHBondContact O-CG2 3.24Å; I151-T155 PolarHBondContact O-N 3.08Å; I151-T155 PolarHBondContact O-OG1 3.28Å; T152-T155 PolarHBondContact O-N 3.39Å; T152-T155 PolarHBondContact O-OG1 3.26Å; L153-T155 VanDerWaalsContact C-N 3.33Å; L153-T155 PolarHBondContact O-N 3.08Å; T155-L193 HydrophobicContact CG2-CD1 3.88Å; T155-Q197 HydrophobicContact CG2-CB 4.12Å
156K92.3Very high95.6Very high136 Ų13635.7 Ų35.759%0.59119%0.19SC*.Hα-helixtrans-113.1-28.8-173.9-58.1-58.1178.9-173.40114.5T152T152-K156 HydrophobicContact CG2-CB 4.4Å; T152-K156 HydrophobicContact CG2-CG 3.92Å; T152-K156 VanDerWaalsContact O-CB 3.24Å; T152-K156 WeakPolarHBondContact O-CB 3.19Å; T152-K156 WeakPolarHBondContact O-CG 3.44Å; T152-K156 PolarHBondContact O-N 3.12Å
157C91.8Very high95.3Very high10 Ų1040.5 Ų40.57%0.06822%0.222CC..SBendtrans-97.3137-176.4-60.20000111.8V120 L153 L159 G160V120-C157 HydrophobicContact CG2-CB 4.05Å; L153-C157 HydrophobicContact CD1-CB 3.92Å; L153-C157 PolarHBondContact O-N 3.44Å; C157-L159 PolarHBondContact O-N 2.74Å; C157-G160 WeakPolarHBondContact O-CA 3.22Å; C157-G160 PolarHBondContact O-N 3.24Å
158P88.2Confident95.1Very high95 Ų9542 Ų4262%0.61723%0.23SC*.THydrogen-bonded Turntrans-55.1133.2168.7-24.634.1000111.2V120 G160V120-P158 WeakPolarHBondContact CG2-O 3.42Å; P158-G160 PolarHBondContact O-N 2.96Å
159L91.2Very high95Very high97 Ų9739.3 Ų39.351%0.50822%0.215SC..THydrogen-bonded Turntrans64.55.2-173-52173000115.2V120 Y121 C157 L161 K162 S163V120-L159 HydrophobicContact CG2-CB 4.43Å; Y121-L159 HydrophobicContact CE2-CD1 4.14Å; Y121-L159 VanDerWaalsContact OH-CD1 3.3Å; Y121-L159 WeakPolarHBondContact OH-CD1 3.36Å; C157-L159 PolarHBondContact O-N 2.74Å; L159-L161 PolarHBondContact O-N 2.98Å; L159-K162 PolarHBondContact O-N 3.47Å; L159-S163 PolarHBondContact O-N 2.98Å; L159-S163 VanDerWaalsContact O-N 3.08Å
160G94.3Very high94.9Very high1 Ų139.8 Ų39.81%0.0122%0.218CC..Hα-helixtrans-58.7-47-178.300000112.8V120 L153 C157 P158 K162 S163 V164V120-G160 VanDerWaalsContact CG2-CA 3.41Å; L153-G160 WeakPolarHBondContact O-CA 3.26Å; C157-G160 WeakPolarHBondContact O-CA 3.22Å; C157-G160 PolarHBondContact O-N 3.24Å; P158-G160 PolarHBondContact O-N 2.96Å; G160-K162 VanDerWaalsContact C-N 3.31Å; G160-K162 PolarHBondContact O-N 2.99Å; G160-S163 WeakPolarHBondContact O-CB 3.34Å; G160-S163 PolarHBondContact O-N 3.34Å; G160-S163 VanDerWaalsContact O-N 3.1Å; G160-V164 WeakPolarHBondContact O-CG2 3.5Å; G160-V164 PolarHBondContact O-N 2.89Å
161L96.2Very high94.7Very high36 Ų3641.6 Ų41.619%0.18824%0.237CC..Hα-helixtrans-56.1-45.7176.9-177.568.7000111.8A154 L159 S163 V164 L165 L193 V200 D203A154-L161 HydrophobicContact CB-CD1 4.28Å; A154-L161 PolarHBondContact O-N 3.21Å; L159-L161 PolarHBondContact O-N 2.98Å; L161-S163 VanDerWaalsContact C-N 3.3Å; L161-S163 PolarHBondContact O-N 3.18Å; L161-V164 PolarHBondContact O-N 3.02Å; L161-L165 HydrophobicContact CD1-CD1 3.72Å; L161-L165 HydrophobicContact CD1-CG 4.01Å; L161-L165 HydrophobicContact CG-CD1 3.92Å; L161-L165 HydrophobicContact CG-CG 4.36Å; L161-L165 WeakPolarHBondContact O-CB 3.36Å; L161-L165 WeakPolarHBondContact O-CG 3.41Å; L161-L165 PolarHBondContact O-N 3.35Å; L161-L193 HydrophobicContact CD1-CD2 4.25Å; L161-V200 HydrophobicContact CD1-CB 3.94Å; L161-V200 HydrophobicContact CD1-CG1 4.04Å; L161-V200 HydrophobicContact CD1-CG2 4.16Å; L161-V200 HydrophobicContact CD2-CB 3.81Å; L161-V200 HydrophobicContact CD2-CG1 3.56Å; L161-V200 HydrophobicContact CG-CG1 4.4Å; L161-D203 HydrophobicContact CD2-CB 4.24Å
162K95.3Very high94.6Very high165 Ų16541.6 Ų41.672%0.71724%0.238SC*.Hα-helixtrans-63.3-37.3178.7-176-179.8177.7-178.40111.9L159 G160 G166L159-K162 PolarHBondContact O-N 3.47Å; G160-K162 VanDerWaalsContact C-N 3.31Å; G160-K162 PolarHBondContact O-N 2.99Å; K162-G166 WeakPolarHBondContact O-CA 3.29Å; K162-G166 PolarHBondContact O-N 3.26Å; K162-G166 VanDerWaalsContact O-N 3.07Å
163S95Very high94.6Very high23 Ų2340.5 Ų40.516%0.16123%0.231CC..Hα-helixtrans-65.9-45.5175.8-170.80000111.6L128 L159 G160 L161 G166L128-S163 VanDerWaalsContact CD2-OG 3.28Å; L128-S163 WeakPolarHBondContact CD2-OG 3.48Å; L159-S163 PolarHBondContact O-N 2.98Å; L159-S163 VanDerWaalsContact O-N 3.08Å; G160-S163 WeakPolarHBondContact O-CB 3.34Å; G160-S163 PolarHBondContact O-N 3.34Å; G160-S163 VanDerWaalsContact O-N 3.1Å; L161-S163 VanDerWaalsContact C-N 3.3Å; L161-S163 PolarHBondContact O-N 3.18Å; S163-G166 PolarHBondContact O-N 2.79Å
164V97.3Very high94.3Very high0 Ų044.6 Ų44.60%025%0.252CS..Hα-helixtrans-71.3-35-178.2170.80000112.7L150 L153 A154 G160 L161 G166 V169 V170 F189L150-V164 HydrophobicContact CB-CG1 4.45Å; L150-V164 HydrophobicContact CD2-CG2 4.42Å; L153-V164 HydrophobicContact CB-CG2 4.13Å; L153-V164 HydrophobicContact CD2-CG2 3.77Å; L153-V164 HydrophobicContact CG-CG2 3.91Å; A154-V164 HydrophobicContact CB-CB 4.21Å; A154-V164 HydrophobicContact CB-CG1 4.32Å; A154-V164 HydrophobicContact CB-CG2 4.1Å; G160-V164 WeakPolarHBondContact O-CG2 3.5Å; G160-V164 PolarHBondContact O-N 2.89Å; L161-V164 PolarHBondContact O-N 3.02Å; V164-G166 VanDerWaalsContact C-N 3.27Å; V164-V169 HydrophobicContact CG1-CG1 4.43Å; V164-V169 VanDerWaalsContact O-CB 3.23Å; V164-V169 WeakPolarHBondContact O-CB 3.48Å; V164-V169 WeakPolarHBondContact O-CG1 3.43Å; V164-V170 WeakPolarHBondContact O-CG2 3.15Å; V164-F189 HydrophobicContact CG1-CE1 4.34Å; V164-F189 HydrophobicContact CG1-CE2 4.28Å; V164-F189 HydrophobicContact CG1-CZ 3.48Å; V164-F189 VanDerWaalsContact CG1-CZ 3.48Å
165L97.1Very high94Very high32 Ų3249 Ų4917%0.16828%0.281CS..THydrogen-bonded Turntrans-86.7-1173.9-59.5-176.1000113L161 V170 D203 V204 L209L161-L165 HydrophobicContact CD1-CD1 3.72Å; L161-L165 HydrophobicContact CD1-CG 4.01Å; L161-L165 HydrophobicContact CG-CD1 3.92Å; L161-L165 HydrophobicContact CG-CG 4.36Å; L161-L165 WeakPolarHBondContact O-CB 3.36Å; L161-L165 WeakPolarHBondContact O-CG 3.41Å; L161-L165 PolarHBondContact O-N 3.35Å; L165-V170 HydrophobicContact CD2-CG2 4.49Å; L165-D203 HydrophobicContact CD1-CB 3.53Å; L165-V204 HydrophobicContact CD1-CG2 4.38Å; L165-V204 HydrophobicContact CD2-CG2 4.22Å; L165-L209 HydrophobicContact CD2-CD1 3.87Å
166G94.8Very high93.9Very high16 Ų1650.8 Ų50.817%0.16529%0.288CS..SBendtrans-85-176-178.100000114K162 S163 V164 N168 V169 V170K162-G166 WeakPolarHBondContact O-CA 3.29Å; K162-G166 PolarHBondContact O-N 3.26Å; K162-G166 VanDerWaalsContact O-N 3.07Å; S163-G166 PolarHBondContact O-N 2.79Å; V164-G166 VanDerWaalsContact C-N 3.27Å; G166-N168 VanDerWaalsContact C-N 3.28Å; G166-N168 PolarHBondContact O-N 3.2Å; G166-V169 PolarHBondContact O-N 3Å; G166-V170 PolarHBondContact O-N 3.05Å
167P93.2Very high93.8Very high102 Ų10245.5 Ų45.566%0.66227%0.268SS*.THydrogen-bonded Turntrans-64-29.6-176.125.8-34.8000113.5V169 G171 T172P167-V169 VanDerWaalsContact C-N 3.27Å; P167-V169 PolarHBondContact O-N 3.34Å; P167-G171 CarbonylContact O-C 3.41Å; P167-G171 WeakPolarHBondContact O-CA 3.44Å; P167-G171 PolarHBondContact O-N 3.2Å; P167-T172 PolarHBondContact O-N 3.38Å
168N94Very high93.5Very high32 Ų3249.8 Ų49.817%0.17130%0.298CS..THydrogen-bonded Turntrans-67.4-28.2-176.8-65.5-13.5000112.6E125 L128 M129 G166 T172E125-N168 PolarHBondContact OE1-ND2 2.67Å; E125-N168 VanDerWaalsContact OE1-ND2 3.13Å; L128-N168 HydrophobicContact CD2-CB 4.13Å; M129-N168 HydrophobicContact CG-CB 4.24Å; M129-N168 WeakPolarHBondContact CG-O 3.39Å; G166-N168 VanDerWaalsContact C-N 3.28Å; G166-N168 PolarHBondContact O-N 3.2Å; N168-T172 WeakPolarHBondContact O-CB 3.29Å; N168-T172 PolarHBondContact O-OG1 2.93Å
169V97.1Very high93.4Very high0 Ų050.7 Ų50.70%029%0.293CS..THydrogen-bonded Turntrans-111.3-65.5-179.5176.60000110.5L128 A132 L150 V164 G166 P167 G171 T172 L173L128-V169 HydrophobicContact CD1-CG2 3.81Å; L128-V169 HydrophobicContact CD2-CG2 3.89Å; L128-V169 HydrophobicContact CG-CG2 3.65Å; A132-V169 HydrophobicContact CB-CB 4.3Å; A132-V169 HydrophobicContact CB-CG1 4.05Å; A132-V169 HydrophobicContact CB-CG2 4.28Å; L150-V169 HydrophobicContact CD1-CG1 3.83Å; L150-V169 HydrophobicContact CD2-CG1 4.18Å; L150-V169 HydrophobicContact CD2-CG2 3.98Å; V164-V169 HydrophobicContact CG1-CG1 4.43Å; V164-V169 VanDerWaalsContact O-CB 3.23Å; V164-V169 WeakPolarHBondContact O-CB 3.48Å; V164-V169 WeakPolarHBondContact O-CG1 3.43Å; G166-V169 PolarHBondContact O-N 3Å; P167-V169 VanDerWaalsContact C-N 3.27Å; P167-V169 PolarHBondContact O-N 3.34Å; V169-G171 PolarHBondContact O-N 3.01Å; V169-T172 WeakPolarHBondContact O-CB 3.36Å; V169-T172 PolarHBondContact O-N 3.25Å; V169-T172 VanDerWaalsContact O-N 3.11Å; V169-L173 HydrophobicContact CG1-CD1 4Å; V169-L173 WeakPolarHBondContact O-CB 3.17Å; V169-L173 WeakPolarHBondContact O-CG 3.26Å; V169-L173 PolarHBondContact O-N 3.42Å
170V96Very high93.2Very high10 Ų1048.7 Ų48.76%0.06129%0.287CS..Hα-helixtrans-62.3-43.7-180173.60000111.2V164 L165 G166 T172 L173 N174 L209V164-V170 WeakPolarHBondContact O-CG2 3.15Å; L165-V170 HydrophobicContact CD2-CG2 4.49Å; G166-V170 PolarHBondContact O-N 3.05Å; V170-T172 PolarHBondContact O-N 2.89Å; V170-L173 PolarHBondContact O-N 2.91Å; V170-N174 WeakPolarHBondContact CG1-ND2 3.47Å; V170-N174 WeakPolarHBondContact O-CB 3.38Å; V170-N174 PolarHBondContact O-N 2.89Å; V170-N174 PolarHBondContact O-OD1 3.32Å; V170-L209 HydrophobicContact CG2-CD1 3.99Å; V170-L209 HydrophobicContact CG2-CD2 4.21Å; V170-L209 HydrophobicContact CG2-CG 4.21Å
171G93.7Very high93Very high38 Ų3852.7 Ų52.739%0.39231%0.305SS..Hα-helixtrans-64.4-28176.400000113.6P167 V169 P175P167-G171 CarbonylContact O-C 3.41Å; P167-G171 WeakPolarHBondContact O-CA 3.44Å; P167-G171 PolarHBondContact O-N 3.2Å; V169-G171 PolarHBondContact O-N 3.01Å; G171-P175 WeakPolarHBondContact O-CD 3.36Å; G171-P175 WeakPolarHBondContact O-CG 3.46Å
172T95.3Very high92.8Very high12 Ų1252 Ų527%0.07430%0.301CS..Hα-helixtrans-76.1-42.2172.9-62.60000111.8A132 R133 P167 N168 V169 V170 L176A132-T172 HydrophobicContact CB-CG2 4.35Å; R133-T172 HydrophobicContact CG-CG2 3.73Å; P167-T172 PolarHBondContact O-N 3.38Å; N168-T172 WeakPolarHBondContact O-CB 3.29Å; N168-T172 PolarHBondContact O-OG1 2.93Å; V169-T172 WeakPolarHBondContact O-CB 3.36Å; V169-T172 PolarHBondContact O-N 3.25Å; V169-T172 VanDerWaalsContact O-N 3.11Å; V170-T172 PolarHBondContact O-N 2.89Å; T172-L176 HydrophobicContact CG2-CD1 4.19Å; T172-L176 VanDerWaalsContact O-CD1 3.29Å; T172-L176 WeakPolarHBondContact O-CD1 3.35Å; T172-L176 VanDerWaalsContact O-CG 3.29Å; T172-L176 WeakPolarHBondContact O-CG 3.4Å
173L96.1Very high92.8Very high0 Ų046.8 Ų46.80%028%0.281CS..Hα-helixtrans-71.7-47.6-175.5-74.1172.2000112.9A132 V135 L136 V169 V170 L176 C177 V186A132-L173 HydrophobicContact CB-CG 4.47Å; A132-L173 WeakPolarHBondContact O-CD2 3.23Å; V135-L173 HydrophobicContact CB-CD2 4.09Å; V135-L173 HydrophobicContact CG1-CD2 4.44Å; L136-L173 HydrophobicContact CD1-CD2 4.15Å; L136-L173 HydrophobicContact CD2-CD2 4.02Å; L136-L173 HydrophobicContact CG-CD2 3.84Å; V169-L173 HydrophobicContact CG1-CD1 4Å; V169-L173 WeakPolarHBondContact O-CB 3.17Å; V169-L173 WeakPolarHBondContact O-CG 3.26Å; V169-L173 PolarHBondContact O-N 3.42Å; V170-L173 PolarHBondContact O-N 2.91Å; L173-L176 PolarHBondContact O-N 3.34Å; L173-C177 PolarHBondContact O-N 2.63Å; L173-C177 PolarHBondContact O-SG 3Å; L173-V186 HydrophobicContact CB-CG2 4.31Å; L173-V186 HydrophobicContact CD1-CG2 4.23Å; L173-V186 HydrophobicContact CD2-CG2 4.05Å; L173-V186 HydrophobicContact CG-CG2 4.44Å
174N90.1Very high92.7Very high86 Ų8647.3 Ų47.346%0.4628%0.281SS..Hα-helixtrans-51.1-50.9-173.8-73.7-6.5000114.2V170 L176 C177V170-N174 WeakPolarHBondContact CG1-ND2 3.47Å; V170-N174 WeakPolarHBondContact O-CB 3.38Å; V170-N174 PolarHBondContact O-N 2.89Å; V170-N174 PolarHBondContact O-OD1 3.32Å; N174-L176 VanDerWaalsContact C-N 3.27Å; N174-L176 PolarHBondContact O-N 3.2Å; N174-C177 PolarHBondContact O-N 3.01Å
175P90.2Very high92.5Very high100 Ų10047.8 Ų47.865%0.64928%0.283SS*.Hα-helixtrans-72.1-17.9-179.429-35.7000113.9G171G171-P175 WeakPolarHBondContact O-CD 3.36Å; G171-P175 WeakPolarHBondContact O-CG 3.46Å
176L92.1Very high92.5Very high75 Ų7546.5 Ų46.539%0.39328%0.276SS..Hα-helixtrans-91.4-10.8-178-62.2178.6000113.1R133 L136 T172 L173 N174 S178 H182R133-L176 HydrophobicContact CG-CD1 3.78Å; L136-L176 HydrophobicContact CD1-CB 3.49Å; L136-L176 VanDerWaalsContact CD1-CB 3.49Å; L136-L176 HydrophobicContact CD1-CD1 4.48Å; T172-L176 HydrophobicContact CG2-CD1 4.19Å; T172-L176 VanDerWaalsContact O-CD1 3.29Å; T172-L176 WeakPolarHBondContact O-CD1 3.35Å; T172-L176 VanDerWaalsContact O-CG 3.29Å; T172-L176 WeakPolarHBondContact O-CG 3.4Å; L173-L176 PolarHBondContact O-N 3.34Å; N174-L176 VanDerWaalsContact C-N 3.27Å; N174-L176 PolarHBondContact O-N 3.2Å; L176-S178 VanDerWaalsContact C-N 3.31Å; L176-S178 PolarHBondContact O-N 3.19Å; L176-H182 PolarHBondContact O-ND1 2.9Å
177C91.1Very high92.5Very high25 Ų2545.7 Ų45.717%0.16927%0.269CS..  trans-77.178.4178.2-68.20000111.5L173 N174 H182 L183L173-C177 PolarHBondContact O-N 2.63Å; L173-C177 PolarHBondContact O-SG 3Å; N174-C177 PolarHBondContact O-N 3.01Å; C177-H182 HydrophobicContact CB-CB 4.27Å; C177-L183 HydrophobicContact CB-CD2 3.61Å; C177-L183 HydrophobicContact CB-CG 4.26Å
178S84.6Confident92.6Very high100 Ų10043.4 Ų43.470%0.69925%0.249SC*.  trans-94.3-23.3179.956.80000114.4L176L176-S178 VanDerWaalsContact C-N 3.31Å; L176-S178 PolarHBondContact O-N 3.19Å
179K87.6Confident92.7Very high114 Ų11441.9 Ų41.950%0.49624%0.241SC..SBendtrans-113.7155.1-176.8-60.1177.9-174.3171.20111.2E181 H182 L183K179-E181 VanDerWaalsContact C-N 3.26Å; K179-E181 PolarHBondContact O-N 3.09Å; K179-H182 WeakPolarHBondContact O-CB 3.38Å; K179-H182 PolarHBondContact O-N 3.25Å; K179-L183 PolarHBondContact O-N 3.41Å
180S86.3Confident92.7Very high56 Ų5641.9 Ų41.939%0.39224%0.241SC..Hα-helixtrans-54-41.9174.5-1720000112.4H182 L183 I184S180-H182 VanDerWaalsContact C-N 3.33Å; S180-H182 PolarHBondContact O-N 3.49Å; S180-L183 WeakPolarHBondContact O-CB 3.44Å; S180-L183 PolarHBondContact O-N 3.39Å; S180-I184 WeakPolarHBondContact O-CG1 3.42Å; S180-I184 PolarHBondContact O-N 3.11Å
181E88.9Confident92.7Very high84 Ų8441.6 Ų41.639%0.39324%0.239SC..Hα-helixtrans-59.9-38.5177.2-176179.6177.600113.2K179 I184 R185K179-E181 VanDerWaalsContact C-N 3.26Å; K179-E181 PolarHBondContact O-N 3.09Å; E181-I184 PolarHBondContact O-N 3.47Å; E181-R185 WeakPolarHBondContact O-CG 3.27Å; E181-R185 PolarHBondContact O-N 3.41Å; E181-R185 IonicContact OE1-CZ 3.24Å; E181-R185 IonicContact OE1-NE 2.95Å; E181-R185 IonicContact OE1-NH1 2.81Å; E181-R185 PolarHBondContact OE1-NH1 2.67Å; E181-R185 IonicContact OE1-NH2 3.39Å; E181-R185 PolarHBondContact OE1-NH2 3.04Å
182H93.6Very high92.8Very high21 Ų2142.8 Ų42.810%0.09724%0.235CC..Hα-helixtrans-65.8-44.1177-64.1-176.3000110.6L136 L176 C177 K179 S180 I184 R185 V186L136-H182 HydrophobicContact CD2-CB 3.85Å; L176-H182 PolarHBondContact O-ND1 2.9Å; C177-H182 HydrophobicContact CB-CB 4.27Å; K179-H182 WeakPolarHBondContact O-CB 3.38Å; K179-H182 PolarHBondContact O-N 3.25Å; S180-H182 VanDerWaalsContact C-N 3.33Å; S180-H182 PolarHBondContact O-N 3.49Å; H182-I184 VanDerWaalsContact C-N 3.31Å; H182-I184 PolarHBondContact O-N 3.41Å; H182-R185 PolarHBondContact O-N 3.5Å; H182-V186 WeakPolarHBondContact O-CG2 3.32Å; H182-V186 PolarHBondContact O-N 3.05Å
183L94.1Very high92.9Very high57 Ų5742.2 Ų42.230%0.29823%0.231SC..Hα-helixtrans-62.1-40.5177.6-65.4171.5000111.3C177 K179 S180 S187 P212 W228C177-L183 HydrophobicContact CB-CD2 3.61Å; C177-L183 HydrophobicContact CB-CG 4.26Å; K179-L183 PolarHBondContact O-N 3.41Å; S180-L183 WeakPolarHBondContact O-CB 3.44Å; S180-L183 PolarHBondContact O-N 3.39Å; L183-S187 VanDerWaalsContact O-CB 3.24Å; L183-S187 WeakPolarHBondContact O-CB 3.43Å; L183-S187 PolarHBondContact O-N 3.22Å; L183-S187 PolarHBondContact O-OG 3.12Å; L183-P212 HydrophobicContact CB-CB 4.18Å; L183-P212 HydrophobicContact CD2-CB 4.07Å; L183-P212 HydrophobicContact CD2-CG 4Å; L183-W228 HydrophobicContact CB-CH2 3.78Å; L183-W228 HydrophobicContact CB-CZ2 3.96Å
184I93Very high92.9Very high33 Ų3342.4 Ų42.417%0.16923%0.232CC..Hα-helixtrans-62.3-49.5175.8-70.2169.6000110.3S180 E181 H182 V186 S187 E188 N227 W228 L231S180-I184 WeakPolarHBondContact O-CG1 3.42Å; S180-I184 PolarHBondContact O-N 3.11Å; E181-I184 PolarHBondContact O-N 3.47Å; H182-I184 VanDerWaalsContact C-N 3.31Å; H182-I184 PolarHBondContact O-N 3.41Å; I184-V186 PolarHBondContact O-N 3.19Å; I184-S187 CarbonylContact O-C 3.52Å; I184-S187 WeakPolarHBondContact O-CB 3.43Å; I184-S187 PolarHBondContact O-N 2.93Å; I184-S187 VanDerWaalsContact O-N 3.13Å; I184-E188 HydrophobicContact CG2-CG 4.24Å; I184-E188 WeakPolarHBondContact O-CB 3.31Å; I184-E188 WeakPolarHBondContact O-CG 3.41Å; I184-E188 PolarHBondContact O-N 2.98Å; I184-N227 HydrophobicContact CD1-CB 4.28Å; I184-W228 HydrophobicContact CG1-CH2 4.01Å; I184-W228 HydrophobicContact CG1-CZ2 3.85Å; I184-W228 HydrophobicContact CG1-CZ3 4.45Å; I184-L231 HydrophobicContact CG2-CD1 4.32Å
185R94.5Very high93Very high11 Ų1141.7 Ų41.74%0.04223%0.234CC..Hα-helixtrans-60.9-41.8179.9-74.6171.1166.8152.89.9113.4V135 L136 H137 D138 S143 E181 H182 S187 E188 F189V135-R185 HydrophobicContact CG1-CB 4.44Å; V135-R185 WeakPolarHBondContact O-CD 3.44Å; L136-R185 PolarHBondContact O-NH1 2.9Å; H137-R185 VanDerWaalsContact C-NH1 3.25Å; H137-R185 PolarHBondContact O-NH1 3.49Å; H137-R185 PolarHBondContact O-NH2 3.4Å; D138-R185 PolarHBondContact O-NH2 3.41Å; D138-R185 VanDerWaalsContact O-NH2 3.15Å; S143-R185 WeakPolarHBondContact OG-CD 3.42Å; E181-R185 WeakPolarHBondContact O-CG 3.27Å; E181-R185 PolarHBondContact O-N 3.41Å; E181-R185 IonicContact OE1-CZ 3.24Å; E181-R185 IonicContact OE1-NE 2.95Å; E181-R185 IonicContact OE1-NH1 2.81Å; E181-R185 PolarHBondContact OE1-NH1 2.67Å; E181-R185 IonicContact OE1-NH2 3.39Å; E181-R185 PolarHBondContact OE1-NH2 3.04Å; H182-R185 PolarHBondContact O-N 3.5Å; R185-S187 VanDerWaalsContact C-N 3.3Å; R185-E188 PolarHBondContact O-N 3.06Å; R185-F189 PolarHBondContact O-N 3.47Å
186V95.9Very high93.1Very high4 Ų444.5 Ų44.52%0.02424%0.236CC..Hα-helixtrans-66.3-37.8176172.70000111.2V135 L136 L173 H182 I184 F189 A190 L209V135-V186 HydrophobicContact CG1-CG2 4.43Å; L136-V186 HydrophobicContact CD2-CG2 3.57Å; L173-V186 HydrophobicContact CB-CG2 4.31Å; L173-V186 HydrophobicContact CD1-CG2 4.23Å; L173-V186 HydrophobicContact CD2-CG2 4.05Å; L173-V186 HydrophobicContact CG-CG2 4.44Å; H182-V186 WeakPolarHBondContact O-CG2 3.32Å; H182-V186 PolarHBondContact O-N 3.05Å; I184-V186 PolarHBondContact O-N 3.19Å; V186-F189 WeakPolarHBondContact O-CB 3.22Å; V186-F189 PolarHBondContact O-N 3.49Å; V186-A190 PolarHBondContact O-N 3.29Å; V186-A190 VanDerWaalsContact O-N 3.12Å; V186-L209 HydrophobicContact CG1-CD2 3.49Å; V186-L209 VanDerWaalsContact CG1-CD2 3.49Å
187S95.6Very high93.1Very high0 Ų043.4 Ų43.40%023%0.229CC..Hα-helixtrans-70-41.9176.6-60.10000111.9L183 I184 R185 F189 A190 V191 W228L183-S187 VanDerWaalsContact O-CB 3.24Å; L183-S187 WeakPolarHBondContact O-CB 3.43Å; L183-S187 PolarHBondContact O-N 3.22Å; L183-S187 PolarHBondContact O-OG 3.12Å; I184-S187 CarbonylContact O-C 3.52Å; I184-S187 WeakPolarHBondContact O-CB 3.43Å; I184-S187 PolarHBondContact O-N 2.93Å; I184-S187 VanDerWaalsContact O-N 3.13Å; R185-S187 VanDerWaalsContact C-N 3.3Å; S187-F189 VanDerWaalsContact C-N 3.31Å; S187-F189 PolarHBondContact O-N 3.18Å; S187-A190 WeakPolarHBondContact O-CB 3.48Å; S187-A190 PolarHBondContact O-N 3.01Å; S187-A190 VanDerWaalsContact O-N 3.11Å; S187-V191 VanDerWaalsContact O-CG2 3.26Å; S187-V191 WeakPolarHBondContact O-CG2 3.39Å; S187-V191 PolarHBondContact O-N 3.09Å; S187-W228 WeakPolarHBondContact OG-CZ3 3.25Å
188E95.3Very high93.1Very high53 Ų5345.6 Ų45.625%0.24824%0.242CC..Hα-helixtrans-54.3-48.2172.4-79.8176.2168.700111I184 R185 A190 V191 Q192 L231I184-E188 HydrophobicContact CG2-CG 4.24Å; I184-E188 WeakPolarHBondContact O-CB 3.31Å; I184-E188 WeakPolarHBondContact O-CG 3.41Å; I184-E188 PolarHBondContact O-N 2.98Å; R185-E188 PolarHBondContact O-N 3.06Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.07Å; E188-V191 PolarHBondContact O-N 3.17Å; E188-Q192 WeakPolarHBondContact O-CB 3.16Å; E188-Q192 VanDerWaalsContact O-CG 3.24Å; E188-Q192 WeakPolarHBondContact O-CG 3.35Å; E188-Q192 PolarHBondContact O-N 3.46Å; E188-L231 HydrophobicContact CB-CD2 4.42Å; E188-L231 HydrophobicContact CG-CD2 3.54Å
189F96.6Very high93.5Very high0 Ų048.9 Ų48.90%025%0.247CC..Hα-helixtrans-54.6-49.1174.2157.9-111000111.9Q147 L150 I151 V164 R185 V186 S187 Q192 L193 L209Q147-F189 HydrophobicContact CB-CB 4.37Å; Q147-F189 HydrophobicContact CB-CD2 4.5Å; Q147-F189 HydrophobicContact CG-CB 3.93Å; L150-F189 HydrophobicContact CB-CD2 4.34Å; L150-F189 HydrophobicContact CB-CE2 3.72Å; L150-F189 HydrophobicContact CB-CZ 4.27Å; I151-F189 HydrophobicContact CD1-CD2 4.27Å; I151-F189 HydrophobicContact CG1-CD2 3.81Å; I151-F189 HydrophobicContact CG1-CE2 3.81Å; V164-F189 HydrophobicContact CG1-CE1 4.34Å; V164-F189 HydrophobicContact CG1-CE2 4.28Å; V164-F189 HydrophobicContact CG1-CZ 3.48Å; V164-F189 VanDerWaalsContact CG1-CZ 3.48Å; R185-F189 PolarHBondContact O-N 3.47Å; V186-F189 WeakPolarHBondContact O-CB 3.22Å; V186-F189 PolarHBondContact O-N 3.49Å; S187-F189 VanDerWaalsContact C-N 3.31Å; S187-F189 PolarHBondContact O-N 3.18Å; F189-Q192 PolarHBondContact O-N 3.35Å; F189-L193 HydrophobicContact CE2-CB 4.48Å; F189-L193 HydrophobicContact CE2-CD2 4.4Å; F189-L193 HydrophobicContact CZ-CD2 4.06Å; F189-L193 WeakPolarHBondContact O-CB 3.24Å; F189-L193 PolarHBondContact O-N 3.38Å; F189-L209 HydrophobicContact CD1-CD1 4.5Å; F189-L209 HydrophobicContact CE1-CD1 3.96Å
190A96.9Very high93.9Very high0 Ų043.7 Ų43.70%023%0.225CC..Hα-helixtrans-63.1-44.7-179.400000112.1V186 S187 E188 L193 V194 V204 L209 F210V186-A190 PolarHBondContact O-N 3.29Å; V186-A190 VanDerWaalsContact O-N 3.12Å; S187-A190 WeakPolarHBondContact O-CB 3.48Å; S187-A190 PolarHBondContact O-N 3.01Å; S187-A190 VanDerWaalsContact O-N 3.11Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.07Å; A190-L193 PolarHBondContact O-N 2.61Å; A190-V194 PolarHBondContact O-N 3.27Å; A190-V204 HydrophobicContact CB-CG1 3.92Å; A190-L209 HydrophobicContact CB-CB 3.81Å; A190-L209 HydrophobicContact CB-CD1 4.31Å; A190-F210 HydrophobicContact CB-CD1 4.17Å; A190-F210 HydrophobicContact CB-CE1 3.93Å
191V96.2Very high94.4Very high4 Ų441.3 Ų41.32%0.02421%0.207CC..Hα-helixtrans-63.3-44.9177.3175.50000110.9S187 E188 V194 S195 I213 L234 L235S187-V191 VanDerWaalsContact O-CG2 3.26Å; S187-V191 WeakPolarHBondContact O-CG2 3.39Å; S187-V191 PolarHBondContact O-N 3.09Å; E188-V191 PolarHBondContact O-N 3.17Å; V191-V194 VanDerWaalsContact O-CG2 3.3Å; V191-V194 WeakPolarHBondContact O-CG2 3.24Å; V191-V194 PolarHBondContact O-N 3.35Å; V191-S195 WeakPolarHBondContact O-CB 3.38Å; V191-S195 PolarHBondContact O-N 2.88Å; V191-I213 HydrophobicContact CG2-CD1 3.62Å; V191-L234 HydrophobicContact CG1-CB 3.53Å; V191-L234 HydrophobicContact CG1-CD1 4.4Å; V191-L235 HydrophobicContact CB-CD2 4.34Å; V191-L235 HydrophobicContact CG1-CD2 4.22Å; V191-L235 HydrophobicContact CG1-CG 4.28Å; V191-L235 HydrophobicContact CG2-CD1 4.27Å; V191-L235 HydrophobicContact CG2-CD2 3.78Å; V191-L235 HydrophobicContact CG2-CG 3.74Å
192Q95.6Very high94.7Very high64 Ų6442.2 Ų42.230%0.29921%0.21SC..Hα-helixtrans-64.4-41.9177.9-72.9178.512.600111.7I151 E188 F189 V194 S195 K196I151-Q192 HydrophobicContact CD1-CB 3.61Å; E188-Q192 WeakPolarHBondContact O-CB 3.16Å; E188-Q192 VanDerWaalsContact O-CG 3.24Å; E188-Q192 WeakPolarHBondContact O-CG 3.35Å; E188-Q192 PolarHBondContact O-N 3.46Å; F189-Q192 PolarHBondContact O-N 3.35Å; Q192-V194 PolarHBondContact O-N 3.4Å; Q192-S195 WeakPolarHBondContact CA-OG 3.42Å; Q192-S195 PolarHBondContact O-N 3.48Å; Q192-S195 PolarHBondContact O-OG 3.08Å; Q192-K196 WeakPolarHBondContact O-CG 3.47Å; Q192-K196 PolarHBondContact O-N 3.48Å; Q192-K196 VanDerWaalsContact O-N 3.09Å
193L96.8Very high94.9Very high0 Ų044.9 Ų44.90%023%0.225CC..Hα-helixtrans-57.1-51.8176.9176.456.5000111.5I151 A154 T155 L161 F189 A190 S195 K196 Q197 V200 V204I151-L193 HydrophobicContact CG1-CB 4.26Å; I151-L193 HydrophobicContact CG2-CD1 4.4Å; A154-L193 HydrophobicContact CB-CD1 3.72Å; A154-L193 HydrophobicContact CB-CD2 4.35Å; T155-L193 HydrophobicContact CG2-CD1 3.88Å; L161-L193 HydrophobicContact CD1-CD2 4.25Å; F189-L193 HydrophobicContact CE2-CB 4.48Å; F189-L193 HydrophobicContact CE2-CD2 4.4Å; F189-L193 HydrophobicContact CZ-CD2 4.06Å; F189-L193 WeakPolarHBondContact O-CB 3.24Å; F189-L193 PolarHBondContact O-N 3.38Å; A190-L193 PolarHBondContact O-N 2.61Å; L193-S195 VanDerWaalsContact C-N 3.3Å; L193-S195 PolarHBondContact O-N 3.25Å; L193-K196 PolarHBondContact O-N 2.94Å; L193-Q197 PolarHBondContact O-N 3.43Å; L193-V200 HydrophobicContact CD1-CG2 4.45Å; L193-V200 HydrophobicContact CG-CG2 4.06Å; L193-V204 HydrophobicContact CD2-CG2 3.81Å; L193-V204 HydrophobicContact CG-CG2 4.34Å
194V96.5Very high95Very high4 Ų442.2 Ų42.22%0.02421%0.211CC..Hα-helixtrans-70.4-27.1-179.9-58.50000112.8A190 V191 Q192 K196 Q197 P198 V200 F201 V204 F210 L235A190-V194 PolarHBondContact O-N 3.27Å; V191-V194 VanDerWaalsContact O-CG2 3.3Å; V191-V194 WeakPolarHBondContact O-CG2 3.24Å; V191-V194 PolarHBondContact O-N 3.35Å; Q192-V194 PolarHBondContact O-N 3.4Å; V194-K196 VanDerWaalsContact C-N 3.29Å; V194-K196 PolarHBondContact O-N 3.13Å; V194-Q197 CarbonylContact O-C 3.34Å; V194-P198 VanDerWaalsContact O-CA 3.27Å; V194-P198 WeakPolarHBondContact O-CA 3.36Å; V194-V200 HydrophobicContact CG1-CG2 4.28Å; V194-F201 HydrophobicContact CB-CD2 3.94Å; V194-F201 HydrophobicContact CG1-CB 4.37Å; V194-F201 HydrophobicContact CG1-CD2 4.14Å; V194-F201 HydrophobicContact CG2-CD2 4.03Å; V194-F201 HydrophobicContact CG2-CE2 4.27Å; V194-V204 HydrophobicContact CG1-CB 3.81Å; V194-V204 HydrophobicContact CG1-CG1 4.06Å; V194-V204 HydrophobicContact CG1-CG2 3.72Å; V194-F210 HydrophobicContact CG1-CZ 3.84Å; V194-F210 HydrophobicContact CG2-CE1 4.5Å; V194-F210 HydrophobicContact CG2-CZ 4.01Å; V194-L235 HydrophobicContact CG2-CD2 4.04Å
195S91.9Very high95.1Very high70 Ų7043 Ų4349%0.4921%0.214SC..Hα-helixtrans-66-32.617380.40000112.5V191 Q192 L193V191-S195 WeakPolarHBondContact O-CB 3.38Å; V191-S195 PolarHBondContact O-N 2.88Å; Q192-S195 WeakPolarHBondContact CA-OG 3.42Å; Q192-S195 PolarHBondContact O-N 3.48Å; Q192-S195 PolarHBondContact O-OG 3.08Å; L193-S195 VanDerWaalsContact C-N 3.3Å; L193-S195 PolarHBondContact O-N 3.25Å
196K91.8Very high95.2Very high159 Ų15947.6 Ų47.669%0.69124%0.239SC*.Hα-helixtrans-85-31.6178.9-66.4-62-177.7-1680112.7I151 Q192 L193 V194I151-K196 HydrophobicContact CG2-CG 4.37Å; Q192-K196 WeakPolarHBondContact O-CG 3.47Å; Q192-K196 PolarHBondContact O-N 3.48Å; Q192-K196 VanDerWaalsContact O-N 3.09Å; L193-K196 PolarHBondContact O-N 2.94Å; V194-K196 VanDerWaalsContact C-N 3.29Å; V194-K196 PolarHBondContact O-N 3.13Å
197Q92.5Very high95.1Very high53 Ų5348.7 Ų48.725%0.24825%0.247CC..  trans-137.681.5178.9-164.8176.97.500110.7T155 L193 V194 E199 V200T155-Q197 HydrophobicContact CG2-CB 4.12Å; L193-Q197 PolarHBondContact O-N 3.43Å; V194-Q197 CarbonylContact O-C 3.34Å; Q197-E199 PolarHBondContact O-N 3.5Å; Q197-V200 HydrophobicContact CB-CG1 4.3Å; Q197-V200 HydrophobicContact CB-CG2 4.47Å; Q197-V200 HydrophobicContact CG-CG1 3.85Å; Q197-V200 WeakPolarHBondContact O-CG2 3.33Å; Q197-V200 PolarHBondContact O-N 2.74Å; Q197-V200 VanDerWaalsContact O-N 3.09Å
198P91.7Very high95Very high70 Ų7050.4 Ų50.446%0.45526%0.264SS..G310 helixtrans-56.5-23.1-174.7-28.436.3000115.4V194 V200 F201V194-P198 VanDerWaalsContact O-CA 3.27Å; V194-P198 WeakPolarHBondContact O-CA 3.36Å; P198-V200 VanDerWaalsContact C-N 3.26Å; P198-V200 PolarHBondContact O-N 3.3Å; P198-F201 VanDerWaalsContact O-CB 3.31Å; P198-F201 WeakPolarHBondContact O-CB 3.3Å; P198-F201 PolarHBondContact O-N 3.15Å
199E93.3Very high95Very high170 Ų17048 Ų4879%0.79425%0.253SS*.G310 helixtrans-62.4-30.1178.3-62175.3176.100113.2Q197 F201Q197-E199 PolarHBondContact O-N 3.5Å; E199-F201 PolarHBondContact O-N 3.2Å
200V95.1Very high95Very high5 Ų548.1 Ų48.13%0.0325%0.254CS..G310 helixtrans-84.53.4-177.4-46.30000113L161 L193 V194 Q197 P198 K202 D203 V204L161-V200 HydrophobicContact CD1-CB 3.94Å; L161-V200 HydrophobicContact CD1-CG1 4.04Å; L161-V200 HydrophobicContact CD1-CG2 4.16Å; L161-V200 HydrophobicContact CD2-CB 3.81Å; L161-V200 HydrophobicContact CD2-CG1 3.56Å; L161-V200 HydrophobicContact CG-CG1 4.4Å; L193-V200 HydrophobicContact CD1-CG2 4.45Å; L193-V200 HydrophobicContact CG-CG2 4.06Å; V194-V200 HydrophobicContact CG1-CG2 4.28Å; Q197-V200 HydrophobicContact CB-CG1 4.3Å; Q197-V200 HydrophobicContact CB-CG2 4.47Å; Q197-V200 HydrophobicContact CG-CG1 3.85Å; Q197-V200 WeakPolarHBondContact O-CG2 3.33Å; Q197-V200 PolarHBondContact O-N 2.74Å; Q197-V200 VanDerWaalsContact O-N 3.09Å; P198-V200 VanDerWaalsContact C-N 3.26Å; P198-V200 PolarHBondContact O-N 3.3Å; V200-K202 PolarHBondContact O-N 3.25Å; V200-D203 PolarHBondContact O-N 2.93Å; V200-D203 VanDerWaalsContact O-N 3.07Å; V200-V204 HydrophobicContact CG2-CG2 3.95Å; V200-V204 WeakPolarHBondContact O-CG2 3.45Å; V200-V204 PolarHBondContact O-N 2.63Å
201F96.6Very high94.8Very high5 Ų552.7 Ų52.72%0.02228%0.275CS..Hα-helixtrans-53.4-42.7-175-169.3-76.8000111.9V194 P198 E199 V204 E205 F210 L235 T240 G241 F244V194-F201 HydrophobicContact CB-CD2 3.94Å; V194-F201 HydrophobicContact CG1-CB 4.37Å; V194-F201 HydrophobicContact CG1-CD2 4.14Å; V194-F201 HydrophobicContact CG2-CD2 4.03Å; V194-F201 HydrophobicContact CG2-CE2 4.27Å; P198-F201 VanDerWaalsContact O-CB 3.31Å; P198-F201 WeakPolarHBondContact O-CB 3.3Å; P198-F201 PolarHBondContact O-N 3.15Å; E199-F201 PolarHBondContact O-N 3.2Å; F201-V204 PolarHBondContact O-N 3.32Å; F201-E205 WeakPolarHBondContact O-CB 3.49Å; F201-E205 PolarHBondContact O-N 2.75Å; F201-F210 HydrophobicContact CD1-CE2 4.16Å; F201-F210 HydrophobicContact CD2-CE2 4.32Å; F201-F210 HydrophobicContact CD2-CZ 4.36Å; F201-F210 HydrophobicContact CE1-CD2 4.4Å; F201-F210 AromaticContact CE1-CE2 3.71Å; F201-F210 HydrophobicContact CE1-CE2 3.71Å; F201-F210 AromaticContact CE2-CE2 3.89Å; F201-F210 HydrophobicContact CE2-CE2 3.89Å; F201-F210 HydrophobicContact CE2-CZ 4Å; F201-F210 HydrophobicContact CG-CE2 4.44Å; F201-F210 HydrophobicContact CZ-CD2 4.32Å; F201-F210 AromaticContact CZ-CE2 3.54Å; F201-F210 HydrophobicContact CZ-CE2 3.54Å; F201-F210 HydrophobicContact CZ-CZ 4.11Å; F201-L235 HydrophobicContact CE2-CD2 4.22Å; F201-T240 HydrophobicContact CB-CG2 4Å; F201-T240 HydrophobicContact CD1-CG2 3.51Å; F201-T240 HydrophobicContact CD2-CG2 4.1Å; F201-T240 HydrophobicContact CE1-CG2 4Å; F201-T240 HydrophobicContact CG-CG2 3.59Å; F201-T240 HydrophobicContact CZ-CG2 4.49Å; F201-G241 VanDerWaalsContact CE2-CA 3.5Å; F201-F244 HydrophobicContact CE1-CB 3.83Å; F201-F244 HydrophobicContact CE1-CD1 4.49Å; F201-F244 HydrophobicContact CE1-CD2 4.29Å; F201-F244 AromaticContact CE1-CG 3.96Å; F201-F244 HydrophobicContact CE1-CG 3.96Å; F201-F244 HydrophobicContact CZ-CB 3.75Å; F201-F244 HydrophobicContact CZ-CD1 4.09Å; F201-F244 AromaticContact CZ-CG 3.93Å; F201-F244 HydrophobicContact CZ-CG 3.93Å
202K95.7Very high94.7Very high103 Ų10353.7 Ų53.745%0.44828%0.282SS..Hα-helixtrans-69.4-36.7-178.1-171.456.7-175168.60112.4V200 E205 N206V200-K202 PolarHBondContact O-N 3.25Å; K202-E205 WeakPolarHBondContact CD-OE2 3.26Å; K202-E205 IonicContact NZ-OE1 2.88Å; K202-E205 PolarHBondContact NZ-OE1 3.4Å; K202-E205 IonicContact NZ-OE2 3.81Å; K202-E205 PolarHBondContact NZ-OE2 2.83Å; K202-E205 PolarHBondContact O-N 2.87Å; K202-N206 VanDerWaalsContact CE-OD1 3.24Å; K202-N206 WeakPolarHBondContact CE-OD1 3.24Å; K202-N206 PolarHBondContact NZ-OD1 3.32Å; K202-N206 WeakPolarHBondContact O-CB 3.47Å; K202-N206 PolarHBondContact O-N 3.02Å; K202-N206 PolarHBondContact O-ND2 3.13Å; K202-N206 PolarHBondContact O-OD1 2.98Å
203D97.1Very high94.7Very high78 Ų7850.6 Ų50.642%0.41727%0.267SS..Hα-helixtrans-66.2-42.6176.2-59.8-61.5000111L161 L165 V200 N206 S207L161-D203 HydrophobicContact CD2-CB 4.24Å; L165-D203 HydrophobicContact CD1-CB 3.53Å; V200-D203 PolarHBondContact O-N 2.93Å; V200-D203 VanDerWaalsContact O-N 3.07Å; D203-N206 PolarHBondContact O-N 2.96Å; D203-S207 PolarHBondContact O-N 3.49Å
204V97Very high94.6Very high0 Ų051.1 Ų51.10%027%0.27CS..Hα-helixtrans-65.4-42.5176177.90000111L165 A190 L193 V194 V200 F201 N206 S207 L209 F210L165-V204 HydrophobicContact CD1-CG2 4.38Å; L165-V204 HydrophobicContact CD2-CG2 4.22Å; A190-V204 HydrophobicContact CB-CG1 3.92Å; L193-V204 HydrophobicContact CD2-CG2 3.81Å; L193-V204 HydrophobicContact CG-CG2 4.34Å; V194-V204 HydrophobicContact CG1-CB 3.81Å; V194-V204 HydrophobicContact CG1-CG1 4.06Å; V194-V204 HydrophobicContact CG1-CG2 3.72Å; V200-V204 HydrophobicContact CG2-CG2 3.95Å; V200-V204 WeakPolarHBondContact O-CG2 3.45Å; V200-V204 PolarHBondContact O-N 2.63Å; F201-V204 PolarHBondContact O-N 3.32Å; V204-N206 PolarHBondContact O-N 3.41Å; V204-S207 PolarHBondContact O-N 3.45Å; V204-S207 PolarHBondContact O-OG 2.7Å; V204-L209 HydrophobicContact CG1-CB 4.19Å; V204-L209 HydrophobicContact CG1-CD1 4.33Å; V204-F210 HydrophobicContact CB-CE2 4.42Å; V204-F210 HydrophobicContact CB-CZ 4.2Å; V204-F210 HydrophobicContact CG1-CD1 4.26Å; V204-F210 HydrophobicContact CG1-CE1 3.69Å; V204-F210 HydrophobicContact CG1-CE2 4.08Å; V204-F210 HydrophobicContact CG1-CZ 3.59Å
205E95.5Very high94.5Very high49 Ų4955.1 Ų55.123%0.22929%0.291CS..Hα-helixtrans-57.7-49.1173.1-174.5-167.2172.400111.1F201 K202 S207 G208 F210 F244F201-E205 WeakPolarHBondContact O-CB 3.49Å; F201-E205 PolarHBondContact O-N 2.75Å; K202-E205 WeakPolarHBondContact CD-OE2 3.26Å; K202-E205 IonicContact NZ-OE1 2.88Å; K202-E205 PolarHBondContact NZ-OE1 3.4Å; K202-E205 IonicContact NZ-OE2 3.81Å; K202-E205 PolarHBondContact NZ-OE2 2.83Å; K202-E205 PolarHBondContact O-N 2.87Å; E205-S207 PolarHBondContact O-N 2.94Å; E205-G208 PolarHBondContact O-N 3.18Å; E205-G208 VanDerWaalsContact O-N 3.08Å; E205-F210 HydrophobicContact CB-CD2 3.96Å; E205-F210 HydrophobicContact CB-CE2 4.17Å; E205-F210 HydrophobicContact CG-CD2 4.35Å; E205-F244 HydrophobicContact CG-CD2 4.27Å; E205-F244 HydrophobicContact CG-CE2 3.75Å; E205-F244 HydrophobicContact CG-CZ 4.46Å
206N95.5Very high94.6Very high109 Ų10952.1 Ų52.158%0.58327%0.271SS*.Hα-helixtrans-66.1-24.1-178.9-68.3-20.4000113.1K202 D203 V204 G208K202-N206 VanDerWaalsContact CE-OD1 3.24Å; K202-N206 WeakPolarHBondContact CE-OD1 3.24Å; K202-N206 PolarHBondContact NZ-OD1 3.32Å; K202-N206 WeakPolarHBondContact O-CB 3.47Å; K202-N206 PolarHBondContact O-N 3.02Å; K202-N206 PolarHBondContact O-ND2 3.13Å; K202-N206 PolarHBondContact O-OD1 2.98Å; D203-N206 PolarHBondContact O-N 2.96Å; V204-N206 PolarHBondContact O-N 3.41Å; N206-G208 PolarHBondContact O-N 3.23Å
207S94.9Very high94.7Very high27 Ų2744.5 Ų44.519%0.18924%0.238CC..THydrogen-bonded Turntrans-72.5-11.6175.176.20000113.8D203 V204 E205 L209D203-S207 PolarHBondContact O-N 3.49Å; V204-S207 PolarHBondContact O-N 3.45Å; V204-S207 PolarHBondContact O-OG 2.7Å; E205-S207 PolarHBondContact O-N 2.94Å; S207-L209 VanDerWaalsContact C-N 3.29Å; S207-L209 PolarHBondContact O-N 3.28Å; S207-L209 WeakPolarHBondContact OG-CD1 3.35Å; S207-L209 VanDerWaalsContact OG-CG 3.25Å; S207-L209 WeakPolarHBondContact OG-CG 3.5Å
208G92.8Very high94.6Very high35 Ų3545.3 Ų45.336%0.36124%0.244SC..THydrogen-bonded Turntrans820.3-178.300000114.5E205 N206 F210 Q211E205-G208 PolarHBondContact O-N 3.18Å; E205-G208 VanDerWaalsContact O-N 3.08Å; N206-G208 PolarHBondContact O-N 3.23Å; G208-F210 PolarHBondContact O-N 3.35Å; G208-F210 VanDerWaalsContact O-N 3.13Å; G208-Q211 WeakPolarHBondContact O-CB 3.48Å; G208-Q211 PolarHBondContact O-N 3.07Å
209L95.1Very high94.5Very high2 Ų243.3 Ų43.31%0.0123%0.232CC..THydrogen-bonded Turntrans-63.3-19-178.5-73174.4000114.3L165 V170 V186 F189 A190 V204 S207 P212L165-L209 HydrophobicContact CD2-CD1 3.87Å; V170-L209 HydrophobicContact CG2-CD1 3.99Å; V170-L209 HydrophobicContact CG2-CD2 4.21Å; V170-L209 HydrophobicContact CG2-CG 4.21Å; V186-L209 HydrophobicContact CG1-CD2 3.49Å; V186-L209 VanDerWaalsContact CG1-CD2 3.49Å; F189-L209 HydrophobicContact CD1-CD1 4.5Å; F189-L209 HydrophobicContact CE1-CD1 3.96Å; A190-L209 HydrophobicContact CB-CB 3.81Å; A190-L209 HydrophobicContact CB-CD1 4.31Å; V204-L209 HydrophobicContact CG1-CB 4.19Å; V204-L209 HydrophobicContact CG1-CD1 4.33Å; S207-L209 VanDerWaalsContact C-N 3.29Å; S207-L209 PolarHBondContact O-N 3.28Å; S207-L209 WeakPolarHBondContact OG-CD1 3.35Å; S207-L209 VanDerWaalsContact OG-CG 3.25Å; S207-L209 WeakPolarHBondContact OG-CG 3.5Å; L209-P212 WeakPolarHBondContact O-CD 3.39Å
210F95.6Very high94.1Very high4 Ų446.6 Ų46.62%0.01824%0.237CC..THydrogen-bonded Turntrans-85.9-10.6173.1-65.5-28.9000114.2A190 V194 F201 V204 E205 G208 I213 L214 L235 F244A190-F210 HydrophobicContact CB-CD1 4.17Å; A190-F210 HydrophobicContact CB-CE1 3.93Å; V194-F210 HydrophobicContact CG1-CZ 3.84Å; V194-F210 HydrophobicContact CG2-CE1 4.5Å; V194-F210 HydrophobicContact CG2-CZ 4.01Å; F201-F210 HydrophobicContact CD1-CE2 4.16Å; F201-F210 HydrophobicContact CD2-CE2 4.32Å; F201-F210 HydrophobicContact CD2-CZ 4.36Å; F201-F210 HydrophobicContact CE1-CD2 4.4Å; F201-F210 AromaticContact CE1-CE2 3.71Å; F201-F210 HydrophobicContact CE1-CE2 3.71Å; F201-F210 AromaticContact CE2-CE2 3.89Å; F201-F210 HydrophobicContact CE2-CE2 3.89Å; F201-F210 HydrophobicContact CE2-CZ 4Å; F201-F210 HydrophobicContact CG-CE2 4.44Å; F201-F210 HydrophobicContact CZ-CD2 4.32Å; F201-F210 AromaticContact CZ-CE2 3.54Å; F201-F210 HydrophobicContact CZ-CE2 3.54Å; F201-F210 HydrophobicContact CZ-CZ 4.11Å; V204-F210 HydrophobicContact CB-CE2 4.42Å; V204-F210 HydrophobicContact CB-CZ 4.2Å; V204-F210 HydrophobicContact CG1-CD1 4.26Å; V204-F210 HydrophobicContact CG1-CE1 3.69Å; V204-F210 HydrophobicContact CG1-CE2 4.08Å; V204-F210 HydrophobicContact CG1-CZ 3.59Å; E205-F210 HydrophobicContact CB-CD2 3.96Å; E205-F210 HydrophobicContact CB-CE2 4.17Å; E205-F210 HydrophobicContact CG-CD2 4.35Å; G208-F210 PolarHBondContact O-N 3.35Å; G208-F210 VanDerWaalsContact O-N 3.13Å; F210-I213 HydrophobicContact CD1-CD1 3.92Å; F210-I213 WeakPolarHBondContact O-CB 3.38Å; F210-I213 PolarHBondContact O-N 3.31Å; F210-I213 VanDerWaalsContact O-N 3.11Å; F210-L214 PolarHBondContact O-N 3.16Å; F210-L214 VanDerWaalsContact O-N 3.16Å; F210-L235 HydrophobicContact CE1-CD2 3.88Å; F210-L235 HydrophobicContact CZ-CD2 3.98Å; F210-F244 HydrophobicContact CB-CE1 4.18Å; F210-F244 HydrophobicContact CB-CZ 4.03Å; F210-F244 HydrophobicContact CD2-CE1 4.13Å; F210-F244 HydrophobicContact CD2-CZ 4.12Å; F210-F244 HydrophobicContact CG-CE1 4.41Å; F210-F244 HydrophobicContact CG-CZ 4.49Å
211Q93.9Very high93.6Very high95 Ų9550 Ų5044%0.44426%0.255SS..Hα-helixtrans-59.2-43.6-177.8-169.460.340.500112.7G208 I213 L214 D215G208-Q211 WeakPolarHBondContact O-CB 3.48Å; G208-Q211 PolarHBondContact O-N 3.07Å; Q211-I213 PolarHBondContact O-N 3.5Å; Q211-L214 PolarHBondContact O-N 2.88Å; Q211-L214 VanDerWaalsContact O-N 3.1Å; Q211-D215 PolarHBondContact NE2-OD1 3.09Å; Q211-D215 VanDerWaalsContact O-CG 3.25Å; Q211-D215 PolarHBondContact O-N 3.1Å
212P93.7Very high92.9Very high25 Ų2551.1 Ų51.116%0.16226%0.263CS..Hα-helixtrans-60.4-32.4176.6-23.835000113.6L183 L209 D215 G216 W228L183-P212 HydrophobicContact CB-CB 4.18Å; L183-P212 HydrophobicContact CD2-CB 4.07Å; L183-P212 HydrophobicContact CD2-CG 4Å; L209-P212 WeakPolarHBondContact O-CD 3.39Å; P212-D215 PolarHBondContact O-N 3.01Å; P212-G216 PolarHBondContact O-N 3.5Å; P212-W228 HydrophobicContact CB-CH2 3.76Å; P212-W228 HydrophobicContact CB-CZ3 4.22Å
213I95.5Very high92.3Very high0 Ų050 Ų500%026%0.261CS..Hα-helixtrans-66.1-46.5175.6-55.4172.6000110V191 F210 Q211 G216 L217 W228 L235V191-I213 HydrophobicContact CG2-CD1 3.62Å; F210-I213 HydrophobicContact CD1-CD1 3.92Å; F210-I213 WeakPolarHBondContact O-CB 3.38Å; F210-I213 PolarHBondContact O-N 3.31Å; F210-I213 VanDerWaalsContact O-N 3.11Å; Q211-I213 PolarHBondContact O-N 3.5Å; I213-G216 PolarHBondContact O-N 3.03Å; I213-L217 HydrophobicContact CG2-CD1 3.83Å; I213-L217 HydrophobicContact CG2-CG 4.38Å; I213-L217 WeakPolarHBondContact O-CB 3.42Å; I213-L217 WeakPolarHBondContact O-CG 3.45Å; I213-L217 PolarHBondContact O-N 3.29Å; I213-W228 HydrophobicContact CB-CE3 4.28Å; I213-W228 HydrophobicContact CB-CZ3 4.34Å; I213-W228 HydrophobicContact CG1-CE3 4.17Å; I213-W228 HydrophobicContact CG1-CZ3 3.89Å; I213-W228 HydrophobicContact CG2-CE3 4.5Å; I213-L235 HydrophobicContact CD1-CD1 3.79Å; I213-L235 HydrophobicContact CG2-CD1 4.19Å
214L95.8Very high91.8Very high10 Ų1048.2 Ų48.25%0.05225%0.253CS..Hα-helixtrans-62.9-43.5177.2-62.8-178.3000111.5F210 Q211 N218 F244 L245 Q248 V250F210-L214 PolarHBondContact O-N 3.16Å; F210-L214 VanDerWaalsContact O-N 3.16Å; Q211-L214 PolarHBondContact O-N 2.88Å; Q211-L214 VanDerWaalsContact O-N 3.1Å; L214-N218 VanDerWaalsContact O-CB 3.28Å; L214-N218 WeakPolarHBondContact O-CB 3.38Å; L214-N218 PolarHBondContact O-N 3.29Å; L214-N218 PolarHBondContact O-ND2 3.27Å; L214-F244 HydrophobicContact CD1-CZ 3.89Å; L214-F244 HydrophobicContact CD2-CE1 3.97Å; L214-F244 HydrophobicContact CD2-CZ 4.13Å; L214-F244 HydrophobicContact CG-CE1 4.42Å; L214-F244 HydrophobicContact CG-CZ 4.24Å; L214-L245 HydrophobicContact CD2-CD2 3.94Å; L214-Q248 HydrophobicContact CD1-CG 4.04Å; L214-Q248 HydrophobicContact CD2-CB 4.03Å; L214-Q248 HydrophobicContact CD2-CG 3.94Å; L214-V250 HydrophobicContact CD2-CG2 4.12Å
215D93.9Very high91.5Very high88 Ų8849.3 Ų49.347%0.47126%0.257SS..Hα-helixtrans-65.6-42.3179-65.1-18.6000111.3Q211 P212 N218 S219Q211-D215 PolarHBondContact NE2-OD1 3.09Å; Q211-D215 VanDerWaalsContact O-CG 3.25Å; Q211-D215 PolarHBondContact O-N 3.1Å; P212-D215 PolarHBondContact O-N 3.01Å; D215-N218 CarbonylContact O-C 3.48Å; D215-N218 WeakPolarHBondContact O-CA 3.41Å; D215-N218 WeakPolarHBondContact O-CB 3.31Å; D215-N218 PolarHBondContact O-N 3.41Å; D215-N218 VanDerWaalsContact O-N 3.13Å; D215-S219 PolarHBondContact O-N 3.18Å
216G93.1Very high91.1Very high7 Ų748.8 Ų48.87%0.07226%0.256CS..Hα-helixtrans-65.1-42.4177.500000113.4P212 I213 N218 S219P212-G216 PolarHBondContact O-N 3.5Å; I213-G216 PolarHBondContact O-N 3.03Å; G216-N218 PolarHBondContact O-N 3.36Å; G216-S219 WeakPolarHBondContact O-CB 3.39Å; G216-S219 PolarHBondContact O-N 3.37Å; G216-S219 VanDerWaalsContact O-N 3.1Å
217L93.8Very high90.7Very high0 Ų048 Ų480%025%0.252CS..Hα-helixtrans-67-22.8172.4-69.2171.6000112.4I213 W228 L229 L245 V250 L254I213-L217 HydrophobicContact CG2-CD1 3.83Å; I213-L217 HydrophobicContact CG2-CG 4.38Å; I213-L217 WeakPolarHBondContact O-CB 3.42Å; I213-L217 WeakPolarHBondContact O-CG 3.45Å; I213-L217 PolarHBondContact O-N 3.29Å; L217-W228 HydrophobicContact CD2-CB 3.93Å; L217-W228 HydrophobicContact CG-CB 4.07Å; L217-L229 HydrophobicContact CD2-CD2 3.81Å; L217-L229 HydrophobicContact CD2-CG 4.38Å; L217-L245 HydrophobicContact CD1-CD2 4.39Å; L217-V250 HydrophobicContact CB-CG1 4.49Å; L217-V250 HydrophobicContact CD1-CG1 3.95Å; L217-L254 HydrophobicContact CD2-CD1 4.45Å
218N91Very high90.7Very high70 Ų7047 Ų4737%0.37424%0.244SC..THydrogen-bonded Turntrans-91.63173.2-75.4-34.5000114.1L214 D215 G216 R220 R253L214-N218 VanDerWaalsContact O-CB 3.28Å; L214-N218 WeakPolarHBondContact O-CB 3.38Å; L214-N218 PolarHBondContact O-N 3.29Å; L214-N218 PolarHBondContact O-ND2 3.27Å; D215-N218 CarbonylContact O-C 3.48Å; D215-N218 WeakPolarHBondContact O-CA 3.41Å; D215-N218 WeakPolarHBondContact O-CB 3.31Å; D215-N218 PolarHBondContact O-N 3.41Å; D215-N218 VanDerWaalsContact O-N 3.13Å; G216-N218 PolarHBondContact O-N 3.36Å; N218-R220 PolarHBondContact O-N 3.47Å; N218-R253 WeakPolarHBondContact OD1-CD 3.46Å; N218-R253 PolarHBondContact OD1-NE 3.33Å; N218-R253 PolarHBondContact OD1-NH1 3.37Å
219S90Very high90.7Very high27 Ų2745.4 Ų45.419%0.18923%0.227CC..  trans-57.7139.2178.9-179.30000110.7D215 G216 D221 R225D215-S219 PolarHBondContact O-N 3.18Å; G216-S219 WeakPolarHBondContact O-CB 3.39Å; G216-S219 PolarHBondContact O-N 3.37Å; G216-S219 VanDerWaalsContact O-N 3.1Å; S219-D221 VanDerWaalsContact C-N 3.25Å; S219-D221 PolarHBondContact OG-N 3.05Å; S219-D221 VanDerWaalsContact OG-N 3.07Å; S219-D221 PolarHBondContact OG-O 3.23Å; S219-R225 PolarHBondContact O-NE 3Å; S219-R225 VanDerWaalsContact O-NE 3.1Å; S219-R225 PolarHBondContact O-NH2 3.4Å
220R84.6Confident90.5Very high240 Ų24050 Ų5091%0.90625%0.248SC*.SBendtrans-74.4-20.5170.5-64.9-176-178.3-176.50.2112.3N218 P222N218-R220 PolarHBondContact O-N 3.47Å; R220-P222 VanDerWaalsContact O-CD 3.29Å; R220-P222 WeakPolarHBondContact O-CD 3.35Å
221D85.1Confident90.4Very high75 Ų7550.1 Ų50.140%0.40125%0.249SC..SBendtrans-81.9113.5172.6-177.3-29.4000108.9S219 L223 V224 R225S219-D221 VanDerWaalsContact C-N 3.25Å; S219-D221 PolarHBondContact OG-N 3.05Å; S219-D221 VanDerWaalsContact OG-N 3.07Å; S219-D221 PolarHBondContact OG-O 3.23Å; D221-L223 VanDerWaalsContact C-N 3.3Å; D221-L223 PolarHBondContact O-N 3.46Å; D221-L223 WeakPolarHBondContact OD1-CB 3.29Å; D221-L223 PolarHBondContact OD1-N 2.92Å; D221-V224 HydrophobicContact CB-CB 3.99Å; D221-V224 HydrophobicContact CB-CG2 3.81Å; D221-V224 PolarHBondContact O-N 3.11Å; D221-V224 PolarHBondContact OD1-N 2.83Å; D221-R225 PolarHBondContact O-N 3.24Å; D221-R225 VanDerWaalsContact O-N 3.08Å
222P81.1Confident90.5Very high29 Ų2945.6 Ų45.619%0.18823%0.228CC..Hα-helixtrans-64.7-29.9-178.2-22.836.1000113.9R220 R225 L226 L270R220-P222 VanDerWaalsContact O-CD 3.29Å; R220-P222 WeakPolarHBondContact O-CD 3.35Å; P222-R225 WeakPolarHBondContact O-CB 3.28Å; P222-R225 PolarHBondContact O-N 3.5Å; P222-L226 PolarHBondContact O-N 3.39Å; P222-L270 HydrophobicContact CB-CD1 3.45Å; P222-L270 VanDerWaalsContact CB-CD1 3.45Å; P222-L270 HydrophobicContact CB-CD2 3.49Å; P222-L270 VanDerWaalsContact CB-CD2 3.49Å; P222-L270 HydrophobicContact CB-CG 4.09Å; P222-L270 HydrophobicContact CG-CD1 4.21Å
223L83.8Confident90.5Very high79 Ų7947.6 Ų47.641%0.41423%0.234SC..Hα-helixtrans-73.5-40178.5-61.8-179.1000111.3D221 R225 L226 N227 L269 L270D221-L223 VanDerWaalsContact C-N 3.3Å; D221-L223 PolarHBondContact O-N 3.46Å; D221-L223 WeakPolarHBondContact OD1-CB 3.29Å; D221-L223 PolarHBondContact OD1-N 2.92Å; L223-R225 VanDerWaalsContact C-N 3.25Å; L223-R225 PolarHBondContact O-N 3.23Å; L223-L226 HydrophobicContact CD2-CD1 4.34Å; L223-L226 WeakPolarHBondContact O-CB 3.26Å; L223-L226 PolarHBondContact O-N 2.9Å; L223-N227 PolarHBondContact O-N 3.47Å; L223-L269 HydrophobicContact CD2-CD2 3.68Å; L223-L269 HydrophobicContact CD2-CG 4.27Å; L223-L270 HydrophobicContact CD2-CD2 4.28Å
224V87.4Confident90.3Very high42 Ų4251.6 Ų51.626%0.25526%0.255SS..Hα-helixtrans-58.5-46171.21720000109.3D221 L226 N227 W228D221-V224 HydrophobicContact CB-CB 3.99Å; D221-V224 HydrophobicContact CB-CG2 3.81Å; D221-V224 PolarHBondContact O-N 3.11Å; D221-V224 PolarHBondContact OD1-N 2.83Å; V224-L226 VanDerWaalsContact C-N 3.3Å; V224-L226 PolarHBondContact O-N 3.5Å; V224-N227 WeakPolarHBondContact O-CB 3.31Å; V224-N227 PolarHBondContact O-N 3.47Å; V224-N227 VanDerWaalsContact O-N 3.1Å; V224-W228 PolarHBondContact O-N 3.46Å
225R88.8Confident90.2Very high23 Ų2351.3 Ų51.39%0.08725%0.253CS..Hα-helixtrans-59.3-38.1-180-166.3-168.9-69.4-171.1-7.5112.8S219 D221 P222 L223 N227 W228 L229 L254 D257 Y274S219-R225 PolarHBondContact O-NE 3Å; S219-R225 VanDerWaalsContact O-NE 3.1Å; S219-R225 PolarHBondContact O-NH2 3.4Å; D221-R225 PolarHBondContact O-N 3.24Å; D221-R225 VanDerWaalsContact O-N 3.08Å; P222-R225 WeakPolarHBondContact O-CB 3.28Å; P222-R225 PolarHBondContact O-N 3.5Å; L223-R225 VanDerWaalsContact C-N 3.25Å; L223-R225 PolarHBondContact O-N 3.23Å; R225-N227 VanDerWaalsContact C-N 3.31Å; R225-N227 PolarHBondContact O-N 2.92Å; R225-W228 PolarHBondContact O-N 3.07Å; R225-W228 VanDerWaalsContact O-N 3.09Å; R225-L229 PolarHBondContact O-N 3.39Å; R225-L254 HydrophobicContact CG-CD2 4.18Å; R225-D257 IonicContact CZ-OD2 2.7Å; R225-D257 VanDerWaalsContact CZ-OD2 3.28Å; R225-D257 IonicContact NH1-OD2 2.82Å; R225-D257 PolarHBondContact NH1-OD2 3.13Å; R225-D257 IonicContact NH2-OD2 3.06Å; R225-D257 PolarHBondContact NH2-OD2 3.16Å; R225-Y274 WeakPolarHBondContact CD-OH 3.27Å; R225-Y274 PolarHBondContact NH1-OH 3.35Å
226L87.2Confident90.2Very high37 Ų3747.5 Ų47.519%0.19423%0.233CC..Hα-helixtrans-56.4-42.8174.4-73.7-174.7000112.4P222 L223 V224 W228 L229 L270 Y274P222-L226 PolarHBondContact O-N 3.39Å; L223-L226 HydrophobicContact CD2-CD1 4.34Å; L223-L226 WeakPolarHBondContact O-CB 3.26Å; L223-L226 PolarHBondContact O-N 2.9Å; V224-L226 VanDerWaalsContact C-N 3.3Å; V224-L226 PolarHBondContact O-N 3.5Å; L226-W228 PolarHBondContact O-N 3.43Å; L226-L229 HydrophobicContact CD2-CD1 3.83Å; L226-L229 WeakPolarHBondContact O-CB 3.46Å; L226-L229 PolarHBondContact O-N 3.43Å; L226-L229 VanDerWaalsContact O-N 3.16Å; L226-L270 HydrophobicContact CD1-CD2 3.79Å; L226-L270 HydrophobicContact CD2-CD2 4.2Å; L226-L270 HydrophobicContact CG-CD2 3.81Å; L226-Y274 HydrophobicContact CD2-CD2 4.08Å; L226-Y274 HydrophobicContact CD2-CE2 4.06Å
227N87.6Confident90.1Very high93 Ų9353 Ų5350%0.49726%0.26SS..Hα-helixtrans-61.4-33.3178.4-64.6-29.5000112I184 L223 V224 R225I184-N227 HydrophobicContact CD1-CB 4.28Å; L223-N227 PolarHBondContact O-N 3.47Å; V224-N227 WeakPolarHBondContact O-CB 3.31Å; V224-N227 PolarHBondContact O-N 3.47Å; V224-N227 VanDerWaalsContact O-N 3.1Å; R225-N227 VanDerWaalsContact C-N 3.31Å; R225-N227 PolarHBondContact O-N 2.92Å
228W94.1Very high89.9Confident6 Ų654.3 Ų54.32%0.02327%0.269CS..Hα-helixtrans-82.7-20.2179.3-66.2103.7000113.6L183 I184 S187 P212 I213 L217 V224 R225 L226 E230 L231 G232L183-W228 HydrophobicContact CB-CH2 3.78Å; L183-W228 HydrophobicContact CB-CZ2 3.96Å; I184-W228 HydrophobicContact CG1-CH2 4.01Å; I184-W228 HydrophobicContact CG1-CZ2 3.85Å; I184-W228 HydrophobicContact CG1-CZ3 4.45Å; S187-W228 WeakPolarHBondContact OG-CZ3 3.25Å; P212-W228 HydrophobicContact CB-CH2 3.76Å; P212-W228 HydrophobicContact CB-CZ3 4.22Å; I213-W228 HydrophobicContact CB-CE3 4.28Å; I213-W228 HydrophobicContact CB-CZ3 4.34Å; I213-W228 HydrophobicContact CG1-CE3 4.17Å; I213-W228 HydrophobicContact CG1-CZ3 3.89Å; I213-W228 HydrophobicContact CG2-CE3 4.5Å; L217-W228 HydrophobicContact CD2-CB 3.93Å; L217-W228 HydrophobicContact CG-CB 4.07Å; V224-W228 PolarHBondContact O-N 3.46Å; R225-W228 PolarHBondContact O-N 3.07Å; R225-W228 VanDerWaalsContact O-N 3.09Å; L226-W228 PolarHBondContact O-N 3.43Å; W228-E230 VanDerWaalsContact C-N 3.29Å; W228-E230 PolarHBondContact O-N 2.79Å; W228-L231 HydrophobicContact CE3-CD1 3.74Å; W228-L231 HydrophobicContact CZ3-CD1 3.77Å; W228-L231 PolarHBondContact O-N 3.31Å; W228-G232 PolarHBondContact O-N 3.36Å
229L93.8Very high89.9Confident1 Ų155 Ų551%0.00527%0.27CS..Hα-helixtrans-61.8-36.8175.6-74.8179.6000112.1L217 R225 L226 L231 G232 K233 L254 Y274 F277L217-L229 HydrophobicContact CD2-CD2 3.81Å; L217-L229 HydrophobicContact CD2-CG 4.38Å; R225-L229 PolarHBondContact O-N 3.39Å; L226-L229 HydrophobicContact CD2-CD1 3.83Å; L226-L229 WeakPolarHBondContact O-CB 3.46Å; L226-L229 PolarHBondContact O-N 3.43Å; L226-L229 VanDerWaalsContact O-N 3.16Å; L229-L231 PolarHBondContact O-N 3.32Å; L229-G232 CarbonylContact O-C 3.37Å; L229-G232 PolarHBondContact O-N 3.02Å; L229-K233 VanDerWaalsContact O-CB 3.31Å; L229-K233 WeakPolarHBondContact O-CB 3.42Å; L229-K233 PolarHBondContact O-N 2.98Å; L229-L254 HydrophobicContact CD2-CD1 3.75Å; L229-Y274 HydrophobicContact CD1-CD1 4.29Å; L229-Y274 HydrophobicContact CD1-CD2 4.08Å; L229-Y274 HydrophobicContact CD1-CE1 4.46Å; L229-Y274 HydrophobicContact CD1-CE2 4.23Å; L229-Y274 HydrophobicContact CD1-CG 4.15Å; L229-F277 HydrophobicContact CD1-CB 4.47Å; L229-F277 HydrophobicContact CD2-CB 4.28Å; L229-F277 HydrophobicContact CD2-CD1 4.08Å; L229-F277 HydrophobicContact CD2-CD2 4.08Å; L229-F277 HydrophobicContact CD2-CE1 4.44Å; L229-F277 HydrophobicContact CD2-CE2 4.46Å; L229-F277 HydrophobicContact CD2-CG 3.89Å
230E91.4Very high90.1Very high99 Ų9957.1 Ų57.146%0.46328%0.282SS..Hα-helixtrans-64.5-40.6177.7-70.1-56137.200111.7W228 K233 L234W228-E230 VanDerWaalsContact C-N 3.29Å; W228-E230 PolarHBondContact O-N 2.79Å; E230-K233 WeakPolarHBondContact O-CB 3.47Å; E230-K233 PolarHBondContact O-N 3.01Å; E230-L234 WeakPolarHBondContact O-CG 3.41Å; E230-L234 PolarHBondContact O-N 2.86Å
231L93.7Very high90.5Very high7 Ų745.7 Ų45.74%0.03724%0.238CC..Hα-helixtrans-67.9-39.9173.2-64.5-178.9000112.1I184 E188 W228 L229 K233 L234 L235I184-L231 HydrophobicContact CG2-CD1 4.32Å; E188-L231 HydrophobicContact CB-CD2 4.42Å; E188-L231 HydrophobicContact CG-CD2 3.54Å; W228-L231 HydrophobicContact CE3-CD1 3.74Å; W228-L231 HydrophobicContact CZ3-CD1 3.77Å; W228-L231 PolarHBondContact O-N 3.31Å; L229-L231 PolarHBondContact O-N 3.32Å; L231-K233 VanDerWaalsContact C-N 3.31Å; L231-K233 PolarHBondContact O-N 3.2Å; L231-L234 HydrophobicContact CD2-CD1 4.44Å; L231-L234 PolarHBondContact O-N 3.47Å; L231-L235 PolarHBondContact O-N 2.87Å
232G95.2Very high91Very high0 Ų042.7 Ų42.70%022%0.222CC..Hα-helixtrans-57.5-45.1172.300000111.8W228 L229 L234 L235 T236W228-G232 PolarHBondContact O-N 3.36Å; L229-G232 CarbonylContact O-C 3.37Å; L229-G232 PolarHBondContact O-N 3.02Å; G232-L234 PolarHBondContact O-N 3.03Å; G232-L235 WeakPolarHBondContact O-CB 3.2Å; G232-L235 PolarHBondContact O-N 2.86Å; G232-T236 WeakPolarHBondContact O-CG2 3.42Å; G232-T236 PolarHBondContact O-N 2.72Å
233K93.8Very high91.7Very high67 Ų6746.2 Ų46.229%0.29124%0.235SC..Hα-helixtrans-62.3-41.5177.5-175.9176.5175.3-177.80112.1L229 E230 L231 L235 T236 F277L229-K233 VanDerWaalsContact O-CB 3.31Å; L229-K233 WeakPolarHBondContact O-CB 3.42Å; L229-K233 PolarHBondContact O-N 2.98Å; E230-K233 WeakPolarHBondContact O-CB 3.47Å; E230-K233 PolarHBondContact O-N 3.01Å; L231-K233 VanDerWaalsContact C-N 3.31Å; L231-K233 PolarHBondContact O-N 3.2Å; K233-L235 VanDerWaalsContact C-N 3.33Å; K233-L235 PolarHBondContact O-N 2.9Å; K233-T236 PolarHBondContact O-N 2.9Å; K233-T236 PolarHBondContact O-OG1 2.79Å; K233-F277 HydrophobicContact CB-CD2 4.05Å
234L91.7Very high92.3Very high84 Ų8443.1 Ų43.144%0.4422%0.219SC..Hα-helixtrans-65.1-36.9175.9-71175.9000112.1V191 E230 L231 G232 T236 I237V191-L234 HydrophobicContact CG1-CB 3.53Å; V191-L234 HydrophobicContact CG1-CD1 4.4Å; E230-L234 WeakPolarHBondContact O-CG 3.41Å; E230-L234 PolarHBondContact O-N 2.86Å; L231-L234 HydrophobicContact CD2-CD1 4.44Å; L231-L234 PolarHBondContact O-N 3.47Å; G232-L234 PolarHBondContact O-N 3.03Å; L234-T236 VanDerWaalsContact C-N 3.33Å; L234-T236 PolarHBondContact O-N 2.92Å; L234-I237 HydrophobicContact CD2-CD1 3.85Å; L234-I237 WeakPolarHBondContact O-CB 3.36Å; L234-I237 WeakPolarHBondContact O-CG1 3.48Å; L234-I237 PolarHBondContact O-N 2.98Å
235L93.6Very high92.7Very high3 Ų341.1 Ų41.12%0.01621%0.207CC..Hα-helixtrans-63.2-37.8174.9-77.6174.7000112.7V191 V194 F201 F210 I213 L231 G232 K233 I237 S238 G241 L245V191-L235 HydrophobicContact CB-CD2 4.34Å; V191-L235 HydrophobicContact CG1-CD2 4.22Å; V191-L235 HydrophobicContact CG1-CG 4.28Å; V191-L235 HydrophobicContact CG2-CD1 4.27Å; V191-L235 HydrophobicContact CG2-CD2 3.78Å; V191-L235 HydrophobicContact CG2-CG 3.74Å; V194-L235 HydrophobicContact CG2-CD2 4.04Å; F201-L235 HydrophobicContact CE2-CD2 4.22Å; F210-L235 HydrophobicContact CE1-CD2 3.88Å; F210-L235 HydrophobicContact CZ-CD2 3.98Å; I213-L235 HydrophobicContact CD1-CD1 3.79Å; I213-L235 HydrophobicContact CG2-CD1 4.19Å; L231-L235 PolarHBondContact O-N 2.87Å; G232-L235 WeakPolarHBondContact O-CB 3.2Å; G232-L235 PolarHBondContact O-N 2.86Å; K233-L235 VanDerWaalsContact C-N 3.33Å; K233-L235 PolarHBondContact O-N 2.9Å; L235-I237 PolarHBondContact O-N 3.47Å; L235-S238 PolarHBondContact O-N 3.35Å; L235-S238 PolarHBondContact O-OG 3.26Å; L235-S238 VanDerWaalsContact O-OG 3.09Å; L235-G241 WeakPolarHBondContact O-CA 3.17Å; L235-L245 HydrophobicContact CB-CD1 4.33Å; L235-L245 HydrophobicContact CD1-CD2 4.41Å
236T93.8Very high93Very high8 Ų843.5 Ų43.55%0.04922%0.221CC..THydrogen-bonded Turntrans-76-4.6-177.361.30000114.7G232 K233 L234 S238 Y242 L245 F251 L281 R284G232-T236 WeakPolarHBondContact O-CG2 3.42Å; G232-T236 PolarHBondContact O-N 2.72Å; K233-T236 PolarHBondContact O-N 2.9Å; K233-T236 PolarHBondContact O-OG1 2.79Å; L234-T236 VanDerWaalsContact C-N 3.33Å; L234-T236 PolarHBondContact O-N 2.92Å; T236-S238 PolarHBondContact O-N 3.42Å; T236-Y242 HydrophobicContact CG2-CD2 4.31Å; T236-L245 HydrophobicContact CG2-CD1 3.76Å; T236-F251 HydrophobicContact CG2-CE1 4.04Å; T236-F251 HydrophobicContact CG2-CZ 3.82Å; T236-L281 HydrophobicContact CG2-CD2 3.7Å; T236-R284 PolarHBondContact O-NH1 3.12Å
237I89.9Confident93.5Very high124 Ų12450 Ų5064%0.63625%0.248SC*.THydrogen-bonded Turntrans-56.6-41.7168.3-63174.8000109.6L234 L235 R284L234-I237 HydrophobicContact CD2-CD1 3.85Å; L234-I237 WeakPolarHBondContact O-CB 3.36Å; L234-I237 WeakPolarHBondContact O-CG1 3.48Å; L234-I237 PolarHBondContact O-N 2.98Å; L235-I237 PolarHBondContact O-N 3.47Å; I237-R284 PolarHBondContact O-NH1 2.84Å
238S90.4Very high93.8Very high26 Ų2649.2 Ų49.218%0.18224%0.241CC..SBendtrans-85.4146.8175.773.50000112.3L235 T236 T240 G241 Y242L235-S238 PolarHBondContact O-N 3.35Å; L235-S238 PolarHBondContact O-OG 3.26Å; L235-S238 VanDerWaalsContact O-OG 3.09Å; T236-S238 PolarHBondContact O-N 3.42Å; S238-T240 VanDerWaalsContact C-N 3.33Å; S238-T240 PolarHBondContact O-N 3.09Å; S238-G241 PolarHBondContact O-N 3.48Å; S238-G241 PolarHBondContact OG-N 2.77Å; S238-Y242 PolarHBondContact O-N 2.92Å
239E91.7Very high93.9Very high86 Ų8650 Ų5040%0.40225%0.25SS..Hα-helixtrans-60.4-43.2173.7-173.767.7-96.600111.4G241 Y242 H243 R284E239-G241 VanDerWaalsContact C-N 3.34Å; E239-G241 PolarHBondContact O-N 3.33Å; E239-Y242 WeakPolarHBondContact O-CB 3.43Å; E239-Y242 PolarHBondContact O-N 2.92Å; E239-H243 PolarHBondContact O-CD2 3.16Å; E239-H243 PolarHBondContact O-N 3.03Å; E239-H243 IonicContact OE1-CD2 3.17Å; E239-H243 IonicContact OE1-CE1 2.66Å; E239-H243 PolarHBondContact OE1-CE1 3.27Å; E239-H243 VanDerWaalsContact OE1-CE1 3.24Å; E239-H243 IonicContact OE1-ND1 3.37Å; E239-H243 IonicContact OE1-NE2 3.13Å; E239-H243 PolarHBondContact OE1-NE2 3.47Å; E239-H243 VanDerWaalsContact OE1-NE2 3.13Å; E239-R284 VanDerWaalsContact CA-NH2 3.34Å; E239-R284 VanDerWaalsContact CB-NH2 3.32Å; E239-R284 IonicContact OE1-CZ 3.34Å; E239-R284 IonicContact OE1-NE 3.16Å; E239-R284 IonicContact OE1-NH2 2.8Å; E239-R284 PolarHBondContact OE1-NH2 3.35Å; E239-R284 IonicContact OE2-CZ 2.68Å; E239-R284 IonicContact OE2-NE 2.82Å; E239-R284 IonicContact OE2-NH2 3.37Å; E239-R284 PolarHBondContact OE2-NH2 2.91Å
240T93.2Very high94Very high70 Ų7050 Ų5043%0.42925%0.25SS..Hα-helixtrans-60.5-44.3179.6-45.10000111.7F201 S238 H243 F244F201-T240 HydrophobicContact CB-CG2 4Å; F201-T240 HydrophobicContact CD1-CG2 3.51Å; F201-T240 HydrophobicContact CD2-CG2 4.1Å; F201-T240 HydrophobicContact CE1-CG2 4Å; F201-T240 HydrophobicContact CG-CG2 3.59Å; F201-T240 HydrophobicContact CZ-CG2 4.49Å; S238-T240 VanDerWaalsContact C-N 3.33Å; S238-T240 PolarHBondContact O-N 3.09Å; T240-H243 PolarHBondContact O-N 3.1Å; T240-F244 VanDerWaalsContact O-CB 3.31Å; T240-F244 WeakPolarHBondContact O-CB 3.45Å; T240-F244 PolarHBondContact O-N 3.38Å
241G94.2Very high94.2Very high0 Ų045.3 Ų45.30%023%0.229CC..Hα-helixtrans-68-37.517700000113.2F201 L235 S238 E239 F244 L245F201-G241 VanDerWaalsContact CE2-CA 3.5Å; L235-G241 WeakPolarHBondContact O-CA 3.17Å; S238-G241 PolarHBondContact O-N 3.48Å; S238-G241 PolarHBondContact OG-N 2.77Å; E239-G241 VanDerWaalsContact C-N 3.34Å; E239-G241 PolarHBondContact O-N 3.33Å; G241-F244 PolarHBondContact O-N 3.34Å; G241-L245 PolarHBondContact O-N 3.44Å; G241-L245 VanDerWaalsContact O-N 3.07Å
242Y95.1Very high94.1Very high13 Ų1348.1 Ų48.15%0.05125%0.249CC..Hα-helixtrans-58.7-52.6172-179.1-91.2000111.5T236 S238 E239 F244 L245 N246 F251 L281 W289T236-Y242 HydrophobicContact CG2-CD2 4.31Å; S238-Y242 PolarHBondContact O-N 2.92Å; E239-Y242 WeakPolarHBondContact O-CB 3.43Å; E239-Y242 PolarHBondContact O-N 2.92Å; Y242-F244 VanDerWaalsContact C-N 3.32Å; Y242-F244 PolarHBondContact O-N 3.36Å; Y242-L245 PolarHBondContact O-N 3.24Å; Y242-N246 WeakPolarHBondContact O-CB 3.39Å; Y242-N246 PolarHBondContact O-N 3.1Å; Y242-F251 AromaticContact CD2-CE2 3.87Å; Y242-F251 HydrophobicContact CD2-CE2 3.87Å; Y242-F251 AromaticContact CD2-CZ 3.93Å; Y242-F251 HydrophobicContact CD2-CZ 3.93Å; Y242-F251 HydrophobicContact CE1-CE2 4.28Å; Y242-F251 AromaticContact CE2-CE2 3.62Å; Y242-F251 HydrophobicContact CE2-CE2 3.62Å; Y242-F251 HydrophobicContact CE2-CZ 4.06Å; Y242-F251 HydrophobicContact CG-CE2 4.3Å; Y242-F251 HydrophobicContact CG-CZ 4.44Å; Y242-F251 AromaticContact CZ-CE2 3.84Å; Y242-L281 HydrophobicContact CD2-CD2 4Å; Y242-L281 HydrophobicContact CE2-CB 4.33Å; Y242-L281 HydrophobicContact CE2-CD2 3.91Å; Y242-W289 PolarHBondContact OH-NE1 3.02Å; Y242-W289 VanDerWaalsContact OH-NE1 3.17Å
243H94.9Very high94Very high102 Ų10251.7 Ų51.747%0.47226%0.262SS..Hα-helixtrans-63.3-36.7178.1-71.8-38.7000113.1E239 T240 N246 K247E239-H243 PolarHBondContact O-CD2 3.16Å; E239-H243 PolarHBondContact O-N 3.03Å; E239-H243 IonicContact OE1-CD2 3.17Å; E239-H243 IonicContact OE1-CE1 2.66Å; E239-H243 PolarHBondContact OE1-CE1 3.27Å; E239-H243 VanDerWaalsContact OE1-CE1 3.24Å; E239-H243 IonicContact OE1-ND1 3.37Å; E239-H243 IonicContact OE1-NE2 3.13Å; E239-H243 PolarHBondContact OE1-NE2 3.47Å; E239-H243 VanDerWaalsContact OE1-NE2 3.13Å; T240-H243 PolarHBondContact O-N 3.1Å; H243-N246 PolarHBondContact O-N 3.08Å; H243-K247 VanDerWaalsContact O-CB 3.26Å; H243-K247 WeakPolarHBondContact O-CB 3.42Å; H243-K247 PolarHBondContact O-N 3.3Å
244F96.1Very high93.9Very high15 Ų1548.5 Ų48.57%0.06625%0.248CC..Hα-helixtrans-59.5-55.1175.8169-104.3000111.4F201 E205 F210 L214 T240 G241 Y242 N246 K247 Q248F201-F244 HydrophobicContact CE1-CB 3.83Å; F201-F244 HydrophobicContact CE1-CD1 4.49Å; F201-F244 HydrophobicContact CE1-CD2 4.29Å; F201-F244 AromaticContact CE1-CG 3.96Å; F201-F244 HydrophobicContact CE1-CG 3.96Å; F201-F244 HydrophobicContact CZ-CB 3.75Å; F201-F244 HydrophobicContact CZ-CD1 4.09Å; F201-F244 AromaticContact CZ-CG 3.93Å; F201-F244 HydrophobicContact CZ-CG 3.93Å; E205-F244 HydrophobicContact CG-CD2 4.27Å; E205-F244 HydrophobicContact CG-CE2 3.75Å; E205-F244 HydrophobicContact CG-CZ 4.46Å; F210-F244 HydrophobicContact CB-CE1 4.18Å; F210-F244 HydrophobicContact CB-CZ 4.03Å; F210-F244 HydrophobicContact CD2-CE1 4.13Å; F210-F244 HydrophobicContact CD2-CZ 4.12Å; F210-F244 HydrophobicContact CG-CE1 4.41Å; F210-F244 HydrophobicContact CG-CZ 4.49Å; L214-F244 HydrophobicContact CD1-CZ 3.89Å; L214-F244 HydrophobicContact CD2-CE1 3.97Å; L214-F244 HydrophobicContact CD2-CZ 4.13Å; L214-F244 HydrophobicContact CG-CE1 4.42Å; L214-F244 HydrophobicContact CG-CZ 4.24Å; T240-F244 VanDerWaalsContact O-CB 3.31Å; T240-F244 WeakPolarHBondContact O-CB 3.45Å; T240-F244 PolarHBondContact O-N 3.38Å; G241-F244 PolarHBondContact O-N 3.34Å; Y242-F244 VanDerWaalsContact C-N 3.32Å; Y242-F244 PolarHBondContact O-N 3.36Å; F244-N246 VanDerWaalsContact C-N 3.29Å; F244-N246 PolarHBondContact O-N 3.07Å; F244-K247 PolarHBondContact O-N 2.62Å; F244-Q248 HydrophobicContact CD2-CG 4.32Å; F244-Q248 HydrophobicContact CE2-CG 4.01Å; F244-Q248 HydrophobicContact CZ-CG 4.13Å; F244-Q248 VanDerWaalsContact O-CG 3.29Å; F244-Q248 WeakPolarHBondContact O-CG 3.29Å; F244-Q248 PolarHBondContact O-N 3.13Å
245L96.8Very high93.9Very high0 Ų044.7 Ų44.70%023%0.228CC..Hα-helixtrans-63.6-36.8179.9-66.7-174.8000112L214 L217 L235 T236 G241 Y242 Q248 G249 V250 F251L214-L245 HydrophobicContact CD2-CD2 3.94Å; L217-L245 HydrophobicContact CD1-CD2 4.39Å; L235-L245 HydrophobicContact CB-CD1 4.33Å; L235-L245 HydrophobicContact CD1-CD2 4.41Å; T236-L245 HydrophobicContact CG2-CD1 3.76Å; G241-L245 PolarHBondContact O-N 3.44Å; G241-L245 VanDerWaalsContact O-N 3.07Å; Y242-L245 PolarHBondContact O-N 3.24Å; L245-Q248 PolarHBondContact O-N 3.02Å; L245-G249 PolarHBondContact O-N 3.13Å; L245-V250 HydrophobicContact CB-CB 4.3Å; L245-V250 HydrophobicContact CD2-CG2 4.26Å; L245-V250 WeakPolarHBondContact O-CB 2.98Å; L245-V250 PolarHBondContact O-N 3.41Å; L245-V250 VanDerWaalsContact O-N 3.11Å; L245-F251 HydrophobicContact CB-CD1 4.35Å; L245-F251 HydrophobicContact CB-CE1 3.5Å; L245-F251 HydrophobicContact CB-CZ 3.68Å; L245-F251 HydrophobicContact CD1-CE1 4.07Å; L245-F251 HydrophobicContact CG-CE1 4.46Å
246N95.7Very high93.7Very high72 Ų7247.5 Ų47.539%0.38524%0.244SC..Hα-helixtrans-62.1-47174.4-165.332.4000111.9Y242 H243 F244 Q248 G249 F251Y242-N246 WeakPolarHBondContact O-CB 3.39Å; Y242-N246 PolarHBondContact O-N 3.1Å; H243-N246 PolarHBondContact O-N 3.08Å; F244-N246 VanDerWaalsContact C-N 3.29Å; F244-N246 PolarHBondContact O-N 3.07Å; N246-Q248 PolarHBondContact O-N 3.43Å; N246-G249 WeakPolarHBondContact O-CA 3.35Å; N246-G249 PolarHBondContact O-N 3.03Å; N246-F251 HydrophobicContact CB-CD2 3.81Å; N246-F251 HydrophobicContact CB-CE2 3.65Å
247K95.9Very high93.3Very high174 Ų17450 Ų5076%0.75726%0.256SS*.Hα-helixtrans-61.5-33.1177.8-177.1-176.7175.4-172.60112.2H243 F244 G249H243-K247 VanDerWaalsContact O-CB 3.26Å; H243-K247 WeakPolarHBondContact O-CB 3.42Å; H243-K247 PolarHBondContact O-N 3.3Å; F244-K247 PolarHBondContact O-N 2.62Å; K247-G249 PolarHBondContact O-N 3.11Å
248Q95.4Very high93.1Very high77 Ų7744.5 Ų44.536%0.3623%0.228SC..THydrogen-bonded Turntrans-76.34.1174.3-62.6-64.2-12.300113.2L214 F244 L245 N246 V250 R253L214-Q248 HydrophobicContact CD1-CG 4.04Å; L214-Q248 HydrophobicContact CD2-CB 4.03Å; L214-Q248 HydrophobicContact CD2-CG 3.94Å; F244-Q248 HydrophobicContact CD2-CG 4.32Å; F244-Q248 HydrophobicContact CE2-CG 4.01Å; F244-Q248 HydrophobicContact CZ-CG 4.13Å; F244-Q248 VanDerWaalsContact O-CG 3.29Å; F244-Q248 WeakPolarHBondContact O-CG 3.29Å; F244-Q248 PolarHBondContact O-N 3.13Å; L245-Q248 PolarHBondContact O-N 3.02Å; N246-Q248 PolarHBondContact O-N 3.43Å; Q248-V250 HydrophobicContact CB-CG2 3.97Å; Q248-V250 PolarHBondContact O-N 3.41Å; Q248-R253 PolarHBondContact O-NH2 2.91Å
249G95.4Very high92.7Very high21 Ų2148.9 Ų48.922%0.21624%0.242CC..THydrogen-bonded Turntrans65.519.717900000113.6L245 N246 K247 S252 R253L245-G249 PolarHBondContact O-N 3.13Å; N246-G249 WeakPolarHBondContact O-CA 3.35Å; N246-G249 PolarHBondContact O-N 3.03Å; K247-G249 PolarHBondContact O-N 3.11Å; G249-S252 PolarHBondContact O-OG 3.25Å; G249-R253 VanDerWaalsContact O-CB 3.28Å; G249-R253 WeakPolarHBondContact O-CB 3.31Å; G249-R253 PolarHBondContact O-N 2.62Å; G249-R253 PolarHBondContact O-NH2 2.88Å
250V95.8Very high92.2Very high1 Ų149.2 Ų49.21%0.00625%0.254CS..Hα-helixtrans-65.4-47.3-175.2170.80000110.6L214 L217 L245 Q248 R253 L254L214-V250 HydrophobicContact CD2-CG2 4.12Å; L217-V250 HydrophobicContact CB-CG1 4.49Å; L217-V250 HydrophobicContact CD1-CG1 3.95Å; L245-V250 HydrophobicContact CB-CB 4.3Å; L245-V250 HydrophobicContact CD2-CG2 4.26Å; L245-V250 WeakPolarHBondContact O-CB 2.98Å; L245-V250 PolarHBondContact O-N 3.41Å; L245-V250 VanDerWaalsContact O-N 3.11Å; Q248-V250 HydrophobicContact CB-CG2 3.97Å; Q248-V250 PolarHBondContact O-N 3.41Å; V250-R253 PolarHBondContact O-N 3.22Å; V250-L254 HydrophobicContact CG1-CD1 3.59Å; V250-L254 HydrophobicContact CG1-CG 4.17Å; V250-L254 WeakPolarHBondContact O-CB 3.17Å; V250-L254 VanDerWaalsContact O-CG 3.27Å; V250-L254 WeakPolarHBondContact O-CG 3.28Å; V250-L254 PolarHBondContact O-N 3.12Å
251F95.4Very high91.4Very high1 Ų147 Ų470%0.00424%0.241CC..Hα-helixtrans-67.2-47.1-172.2-51.1-29.5000112.8T236 Y242 L245 N246 R253 L254 L255 F277 F278 L281 W289T236-F251 HydrophobicContact CG2-CE1 4.04Å; T236-F251 HydrophobicContact CG2-CZ 3.82Å; Y242-F251 AromaticContact CD2-CE2 3.87Å; Y242-F251 HydrophobicContact CD2-CE2 3.87Å; Y242-F251 AromaticContact CD2-CZ 3.93Å; Y242-F251 HydrophobicContact CD2-CZ 3.93Å; Y242-F251 HydrophobicContact CE1-CE2 4.28Å; Y242-F251 AromaticContact CE2-CE2 3.62Å; Y242-F251 HydrophobicContact CE2-CE2 3.62Å; Y242-F251 HydrophobicContact CE2-CZ 4.06Å; Y242-F251 HydrophobicContact CG-CE2 4.3Å; Y242-F251 HydrophobicContact CG-CZ 4.44Å; Y242-F251 AromaticContact CZ-CE2 3.84Å; L245-F251 HydrophobicContact CB-CD1 4.35Å; L245-F251 HydrophobicContact CB-CE1 3.5Å; L245-F251 HydrophobicContact CB-CZ 3.68Å; L245-F251 HydrophobicContact CD1-CE1 4.07Å; L245-F251 HydrophobicContact CG-CE1 4.46Å; N246-F251 HydrophobicContact CB-CD2 3.81Å; N246-F251 HydrophobicContact CB-CE2 3.65Å; F251-R253 VanDerWaalsContact C-N 3.33Å; F251-R253 PolarHBondContact O-N 3.28Å; F251-L254 PolarHBondContact O-N 3.33Å; F251-L255 WeakPolarHBondContact O-CB 3.16Å; F251-L255 PolarHBondContact O-N 2.84Å; F251-L255 VanDerWaalsContact O-N 3.07Å; F251-F277 HydrophobicContact CD1-CE1 4.1Å; F251-F277 AromaticContact CD1-CZ 3.95Å; F251-F277 HydrophobicContact CD1-CZ 3.95Å; F251-F277 HydrophobicContact CE1-CE1 4.4Å; F251-F277 AromaticContact CE1-CZ 3.83Å; F251-F277 HydrophobicContact CE1-CZ 3.83Å; F251-F278 HydrophobicContact CB-CE1 4.42Å; F251-L281 HydrophobicContact CD1-CD1 3.8Å; F251-L281 HydrophobicContact CD2-CD1 4.24Å; F251-L281 HydrophobicContact CE1-CD1 3.89Å; F251-L281 HydrophobicContact CE1-CD2 4.37Å; F251-L281 HydrophobicContact CE2-CD1 4.29Å; F251-L281 HydrophobicContact CG-CD1 4Å; F251-L281 HydrophobicContact CZ-CD1 4.14Å; F251-L281 HydrophobicContact CZ-CD2 4.21Å; F251-W289 HydrophobicContact CB-CH2 3.65Å; F251-W289 HydrophobicContact CB-CZ2 4.22Å; F251-W289 HydrophobicContact CD2-CH2 4.18Å; F251-W289 AromaticContact CD2-CZ2 3.89Å; F251-W289 HydrophobicContact CD2-CZ2 3.89Å; F251-W289 HydrophobicContact CG-CH2 4.2Å; F251-W289 HydrophobicContact CG-CZ2 4.28Å
252S92.7Very high90Very high66 Ų6651 Ų5146%0.46227%0.274SS..Hα-helixtrans-60.3-45.2178.456.20000111G249 L255 D256G249-S252 PolarHBondContact O-OG 3.25Å; S252-L255 PolarHBondContact O-N 2.95Å; S252-D256 WeakPolarHBondContact O-CB 3.33Å; S252-D256 PolarHBondContact O-N 3.18Å
253R92.6Very high88.6Confident75 Ų7555.8 Ų55.828%0.28331%0.309SS..Hα-helixtrans-61.9-49.8179.2-172.5-168.2-47.8111.111.7112.5N218 Q248 G249 V250 F251 L255 D256 D257N218-R253 WeakPolarHBondContact OD1-CD 3.46Å; N218-R253 PolarHBondContact OD1-NE 3.33Å; N218-R253 PolarHBondContact OD1-NH1 3.37Å; Q248-R253 PolarHBondContact O-NH2 2.91Å; G249-R253 VanDerWaalsContact O-CB 3.28Å; G249-R253 WeakPolarHBondContact O-CB 3.31Å; G249-R253 PolarHBondContact O-N 2.62Å; G249-R253 PolarHBondContact O-NH2 2.88Å; V250-R253 PolarHBondContact O-N 3.22Å; F251-R253 VanDerWaalsContact C-N 3.33Å; F251-R253 PolarHBondContact O-N 3.28Å; R253-L255 PolarHBondContact O-N 2.88Å; R253-D256 PolarHBondContact O-N 3.35Å; R253-D257 WeakPolarHBondContact O-CB 3.39Å; R253-D257 PolarHBondContact O-N 3.39Å
254L92.3Very high87.5Confident0 Ų053.7 Ų53.70%030%0.302CS..Hα-helixtrans-60.6-37.3179.4-72.5177000111.8L217 R225 L229 V250 F251 L258 Y274 F277 F278L217-L254 HydrophobicContact CD2-CD1 4.45Å; R225-L254 HydrophobicContact CG-CD2 4.18Å; L229-L254 HydrophobicContact CD2-CD1 3.75Å; V250-L254 HydrophobicContact CG1-CD1 3.59Å; V250-L254 HydrophobicContact CG1-CG 4.17Å; V250-L254 WeakPolarHBondContact O-CB 3.17Å; V250-L254 VanDerWaalsContact O-CG 3.27Å; V250-L254 WeakPolarHBondContact O-CG 3.28Å; V250-L254 PolarHBondContact O-N 3.12Å; F251-L254 PolarHBondContact O-N 3.33Å; L254-L258 WeakPolarHBondContact O-CB 3.45Å; L254-L258 PolarHBondContact O-N 3.37Å; L254-L258 VanDerWaalsContact O-N 3.09Å; L254-Y274 HydrophobicContact CB-CE1 4.2Å; L254-Y274 HydrophobicContact CD2-CE1 4.09Å; L254-F277 HydrophobicContact CD1-CD1 4.49Å; L254-F277 HydrophobicContact CD1-CE1 3.91Å; L254-F277 HydrophobicContact CD1-CZ 4.36Å; L254-F278 HydrophobicContact CB-CE2 4.19Å; L254-F278 HydrophobicContact CB-CZ 3.91Å
255L91.4Very high86.3Confident4 Ų458.9 Ų58.92%0.02134%0.337CS..Hα-helixtrans-73-41.1178.7-168.257.2000111.8F251 S252 R253 L258 Y259 F278 W289 K297 F298 I301F251-L255 WeakPolarHBondContact O-CB 3.16Å; F251-L255 PolarHBondContact O-N 2.84Å; F251-L255 VanDerWaalsContact O-N 3.07Å; S252-L255 PolarHBondContact O-N 2.95Å; R253-L255 PolarHBondContact O-N 2.88Å; L255-L258 PolarHBondContact O-N 2.78Å; L255-Y259 VanDerWaalsContact O-CB 3.27Å; L255-Y259 WeakPolarHBondContact O-CB 3.41Å; L255-Y259 PolarHBondContact O-N 3.42Å; L255-F278 HydrophobicContact CB-CE1 4.11Å; L255-F278 HydrophobicContact CB-CE2 4.3Å; L255-F278 HydrophobicContact CB-CZ 3.65Å; L255-F278 HydrophobicContact CD1-CD2 4.47Å; L255-F278 HydrophobicContact CD1-CE1 4.43Å; L255-F278 HydrophobicContact CD1-CE2 4.14Å; L255-F278 HydrophobicContact CD1-CZ 4.15Å; L255-F278 HydrophobicContact CG-CZ 4.4Å; L255-W289 HydrophobicContact CD2-CZ3 4.09Å; L255-K297 HydrophobicContact CD1-CB 4.18Å; L255-K297 HydrophobicContact CD2-CB 3.85Å; L255-K297 HydrophobicContact CD2-CD 4.38Å; L255-K297 HydrophobicContact CG-CB 3.84Å; L255-K297 HydrophobicContact CG-CD 4.15Å; L255-F298 HydrophobicContact CD1-CB 3.97Å; L255-F298 HydrophobicContact CD2-CB 4.25Å; L255-I301 HydrophobicContact CD1-CD1 3.74Å
256D89.3Confident85.4Confident63 Ų6362.5 Ų62.534%0.33736%0.356SS..Hα-helixtrans-63.9-43.3176.2-71.6-22.8000111.6S252 R253 Y259 S260 K297S252-D256 WeakPolarHBondContact O-CB 3.33Å; S252-D256 PolarHBondContact O-N 3.18Å; R253-D256 PolarHBondContact O-N 3.35Å; D256-Y259 PolarHBondContact O-N 3Å; D256-S260 VanDerWaalsContact O-CB 3.23Å; D256-S260 WeakPolarHBondContact O-CB 3.5Å; D256-S260 PolarHBondContact O-N 3.5Å; D256-S260 PolarHBondContact O-OG 3.37Å; D256-K297 WeakPolarHBondContact OD1-CE 3.5Å; D256-K297 IonicContact OD1-NZ 3.24Å; D256-K297 PolarHBondContact OD1-NZ 3.05Å
257D85.4Confident84.7Confident59 Ų5960.1 Ų60.132%0.31634%0.344SS..Hα-helixtrans-60.3-49.9175.2-81.25.4000110.6R225 R253 Y259 S260 S261R225-D257 IonicContact CZ-OD2 2.7Å; R225-D257 VanDerWaalsContact CZ-OD2 3.28Å; R225-D257 IonicContact NH1-OD2 2.82Å; R225-D257 PolarHBondContact NH1-OD2 3.13Å; R225-D257 IonicContact NH2-OD2 3.06Å; R225-D257 PolarHBondContact NH2-OD2 3.16Å; R253-D257 WeakPolarHBondContact O-CB 3.39Å; R253-D257 PolarHBondContact O-N 3.39Å; D257-Y259 PolarHBondContact O-N 3.42Å; D257-S260 PolarHBondContact O-N 2.89Å; D257-S261 WeakPolarHBondContact O-CB 3.33Å; D257-S261 PolarHBondContact O-N 3.45Å; D257-S261 PolarHBondContact O-OG 3.37Å
258L84.5Confident84.1Confident9 Ų956 Ų565%0.04733%0.33CS..Hα-helixtrans-62-45.3-179.7-177.164.5000111.4L254 L255 S260 S261 L271 Y274 I301L254-L258 WeakPolarHBondContact O-CB 3.45Å; L254-L258 PolarHBondContact O-N 3.37Å; L254-L258 VanDerWaalsContact O-N 3.09Å; L255-L258 PolarHBondContact O-N 2.78Å; L258-S260 VanDerWaalsContact C-N 3.34Å; L258-S260 PolarHBondContact O-N 2.93Å; L258-S261 WeakPolarHBondContact CA-OG 3.5Å; L258-S261 PolarHBondContact O-N 3.1Å; L258-S261 PolarHBondContact O-OG 3Å; L258-L271 HydrophobicContact CD1-CD1 4.48Å; L258-L271 HydrophobicContact CD2-CD1 4.3Å; L258-Y274 HydrophobicContact CB-CD1 4.35Å; L258-Y274 HydrophobicContact CB-CE1 4.42Å; L258-Y274 HydrophobicContact CD1-CD2 4.29Å; L258-Y274 HydrophobicContact CD1-CG 4.23Å; L258-Y274 HydrophobicContact CD2-CD1 3.94Å; L258-Y274 HydrophobicContact CD2-CG 3.86Å; L258-I301 HydrophobicContact CD2-CD1 3.89Å; L258-I301 HydrophobicContact CD2-CG2 4.23Å; L258-I301 HydrophobicContact CG-CD1 4.13Å
259Y82.2Confident83.7Confident118 Ų11857.2 Ų57.246%0.46334%0.339SS..Hα-helixtrans-65.3-37.7179.4-166.4-95.4000112.2L255 D256 D257 S261 K297 I301L255-Y259 VanDerWaalsContact O-CB 3.27Å; L255-Y259 WeakPolarHBondContact O-CB 3.41Å; L255-Y259 PolarHBondContact O-N 3.42Å; D256-Y259 PolarHBondContact O-N 3Å; D257-Y259 PolarHBondContact O-N 3.42Å; Y259-S261 VanDerWaalsContact C-N 3.32Å; Y259-K297 HydrophobicContact CD2-CB 4.1Å; Y259-K297 HydrophobicContact CD2-CG 4.11Å; Y259-K297 HydrophobicContact CE2-CG 4.41Å; Y259-K297 HydrophobicContact CG-CD 4.34Å; Y259-K297 HydrophobicContact CG-CG 4.26Å; Y259-I301 HydrophobicContact CD2-CD1 4.23Å; Y259-I301 HydrophobicContact CD2-CG1 4.34Å
260S81.3Confident83.3Confident93 Ų9356.4 Ų56.465%0.6533%0.329SS*.Hα-helixtrans-74.4-24.4176.9-55.30000112.6D256 D257 L258 A262D256-S260 VanDerWaalsContact O-CB 3.23Å; D256-S260 WeakPolarHBondContact O-CB 3.5Å; D256-S260 PolarHBondContact O-N 3.5Å; D256-S260 PolarHBondContact O-OG 3.37Å; D257-S260 PolarHBondContact O-N 2.89Å; L258-S260 VanDerWaalsContact C-N 3.34Å; L258-S260 PolarHBondContact O-N 2.93Å; S260-A262 PolarHBondContact O-N 2.89Å
261S75.9Confident83.1Confident23 Ų2356.8 Ų56.816%0.16133%0.331CS..THydrogen-bonded Turntrans-77.85.2-178.171.40000114.4D257 L258 Y259 S263 D264 V267D257-S261 WeakPolarHBondContact O-CB 3.33Å; D257-S261 PolarHBondContact O-N 3.45Å; D257-S261 PolarHBondContact O-OG 3.37Å; L258-S261 WeakPolarHBondContact CA-OG 3.5Å; L258-S261 PolarHBondContact O-N 3.1Å; L258-S261 PolarHBondContact O-OG 3Å; Y259-S261 VanDerWaalsContact C-N 3.32Å; S261-S263 PolarHBondContact O-N 3.21Å; S261-D264 VanDerWaalsContact O-CB 3.3Å; S261-D264 WeakPolarHBondContact O-CB 3.35Å; S261-D264 PolarHBondContact O-N 3.41Å; S261-V267 WeakPolarHBondContact O-CG2 3.42Å
262A66.6Low82.9Confident85 Ų8558.7 Ų58.770%0.70234%0.344SS*.THydrogen-bonded Turntrans-52.4-17.7-17400000116S260S260-A262 PolarHBondContact O-N 2.89Å
263S65.1Low82.9Confident113 Ų11356.5 Ų56.579%0.7933%0.332SS*.THydrogen-bonded Turntrans-96.4-4.1174.853.90000115.3S261S261-S263 PolarHBondContact O-N 3.21Å
264D72Confident83Confident58 Ų5853.1 Ų53.131%0.3132%0.319SS..  trans-76.6126-178.2-176.6-22.2000110.4S261 L266 V267S261-D264 VanDerWaalsContact O-CB 3.3Å; S261-D264 WeakPolarHBondContact O-CB 3.35Å; S261-D264 PolarHBondContact O-N 3.41Å; D264-L266 PolarHBondContact O-N 3.31Å; D264-L266 WeakPolarHBondContact OD1-CB 3.3Å; D264-L266 PolarHBondContact OD1-N 3.35Å; D264-V267 HydrophobicContact CB-CG2 3.91Å; D264-V267 WeakPolarHBondContact O-CB 3.35Å; D264-V267 WeakPolarHBondContact O-CG2 3.45Å; D264-V267 PolarHBondContact O-N 3.09Å
265P70.9Confident83.1Confident124 Ų12453.1 Ų53.181%0.80532%0.319SS*.THydrogen-bonded Turntrans-56-22.7177.1-24.633.4000114.6
266L77.7Confident83.2Confident76 Ų7653.8 Ų53.840%0.39833%0.327SS..THydrogen-bonded Turntrans-87.5-5.1-179.4-60.7178.1000113.3D264 D268 L269 L270D264-L266 PolarHBondContact O-N 3.31Å; D264-L266 WeakPolarHBondContact OD1-CB 3.3Å; D264-L266 PolarHBondContact OD1-N 3.35Å; L266-D268 VanDerWaalsContact C-N 3.27Å; L266-D268 PolarHBondContact O-N 3.48Å; L266-L269 HydrophobicContact CD2-CD2 4.46Å; L266-L269 WeakPolarHBondContact O-CA 3.41Å; L266-L269 WeakPolarHBondContact O-CB 3.41Å; L266-L269 PolarHBondContact O-N 2.94Å; L266-L270 WeakPolarHBondContact O-CG 3.48Å; L266-L270 PolarHBondContact O-N 3.22Å; L266-L270 VanDerWaalsContact O-N 3.14Å
267V80.5Confident83.5Confident22 Ų2250.9 Ų50.913%0.13331%0.311CS..Hα-helixtrans-52.2-46.2-177.6172.20000111.9S261 D264 L269 L270 L271S261-V267 WeakPolarHBondContact O-CG2 3.42Å; D264-V267 HydrophobicContact CB-CG2 3.91Å; D264-V267 WeakPolarHBondContact O-CB 3.35Å; D264-V267 WeakPolarHBondContact O-CG2 3.45Å; D264-V267 PolarHBondContact O-N 3.09Å; V267-L269 PolarHBondContact O-N 3.46Å; V267-L270 PolarHBondContact O-N 2.96Å; V267-L271 VanDerWaalsContact O-CB 3.23Å; V267-L271 WeakPolarHBondContact O-CB 3.04Å; V267-L271 PolarHBondContact O-N 3.07Å
268D84.5Confident84.1Confident88 Ų8848 Ų4847%0.47130%0.296SS..Hα-helixtrans-62.1-28.1-179-82.9-14.2000112.8L266 P272 N309 I313L266-D268 VanDerWaalsContact C-N 3.27Å; L266-D268 PolarHBondContact O-N 3.48Å; D268-P272 VanDerWaalsContact O-CD 3.31Å; D268-P272 WeakPolarHBondContact O-CD 3.48Å; D268-N309 PolarHBondContact OD1-ND2 3.43Å; D268-I313 HydrophobicContact CB-CD1 3.87Å; D268-I313 WeakPolarHBondContact OD1-CD1 3.31Å
269L85.5Confident84.6Confident102 Ų10247.8 Ų47.853%0.53430%0.295SS..Hα-helixtrans-76.5-32.6175.1-178.661.6000111.9L223 L266 V267L223-L269 HydrophobicContact CD2-CD2 3.68Å; L223-L269 HydrophobicContact CD2-CG 4.27Å; L266-L269 HydrophobicContact CD2-CD2 4.46Å; L266-L269 WeakPolarHBondContact O-CA 3.41Å; L266-L269 WeakPolarHBondContact O-CB 3.41Å; L266-L269 PolarHBondContact O-N 2.94Å; V267-L269 PolarHBondContact O-N 3.46Å
270L87.3Confident85.3Confident5 Ų543.8 Ų43.83%0.02629%0.285CS..Hα-helixtrans-82.9-40.7-177.7-60.6174.6000112.1P222 L223 L226 L266 V267 P272 G273 Y274P222-L270 HydrophobicContact CB-CD1 3.45Å; P222-L270 VanDerWaalsContact CB-CD1 3.45Å; P222-L270 HydrophobicContact CB-CD2 3.49Å; P222-L270 VanDerWaalsContact CB-CD2 3.49Å; P222-L270 HydrophobicContact CB-CG 4.09Å; P222-L270 HydrophobicContact CG-CD1 4.21Å; L223-L270 HydrophobicContact CD2-CD2 4.28Å; L226-L270 HydrophobicContact CD1-CD2 3.79Å; L226-L270 HydrophobicContact CD2-CD2 4.2Å; L226-L270 HydrophobicContact CG-CD2 3.81Å; L266-L270 WeakPolarHBondContact O-CG 3.48Å; L266-L270 PolarHBondContact O-N 3.22Å; L266-L270 VanDerWaalsContact O-N 3.14Å; V267-L270 PolarHBondContact O-N 2.96Å; L270-P272 VanDerWaalsContact C-CD 3.45Å; L270-P272 VanDerWaalsContact C-N 3.34Å; L270-P272 VanDerWaalsContact O-N 3.16Å; L270-G273 PolarHBondContact O-N 3.33Å; L270-Y274 HydrophobicContact CB-CD2 4.02Å; L270-Y274 HydrophobicContact CB-CE2 3.92Å; L270-Y274 WeakPolarHBondContact O-CD2 3.4Å; L270-Y274 PolarHBondContact O-N 3.49Å
271L91.5Very high86Confident9 Ų939.4 Ų39.45%0.04725%0.254CS..Hα-helixtrans-51.8-41.9-167.3-175.659.3000113.7L258 V267 G273 Y274 I275 I301 A305 I313L258-L271 HydrophobicContact CD1-CD1 4.48Å; L258-L271 HydrophobicContact CD2-CD1 4.3Å; V267-L271 VanDerWaalsContact O-CB 3.23Å; V267-L271 WeakPolarHBondContact O-CB 3.04Å; V267-L271 PolarHBondContact O-N 3.07Å; L271-G273 PolarHBondContact O-N 2.89Å; L271-Y274 PolarHBondContact O-N 3.06Å; L271-I275 HydrophobicContact CD1-CD1 3.77Å; L271-I275 HydrophobicContact CD1-CG1 3.82Å; L271-I275 HydrophobicContact CD2-CD1 4.32Å; L271-I275 HydrophobicContact CG-CD1 3.64Å; L271-I275 HydrophobicContact CG-CG1 4.15Å; L271-I275 WeakPolarHBondContact O-CB 3.43Å; L271-I275 VanDerWaalsContact O-CG1 3.31Å; L271-I275 WeakPolarHBondContact O-CG1 3.29Å; L271-I275 PolarHBondContact O-N 2.9Å; L271-I301 HydrophobicContact CD1-CG2 3.54Å; L271-A305 HydrophobicContact CD2-CB 4.39Å; L271-I313 HydrophobicContact CD2-CG2 3.63Å; L271-I313 HydrophobicContact CG-CG2 4.11Å
272P92.5Very high87.1Confident41 Ų4138.3 Ų38.327%0.26625%0.246SC..Hα-helixtrans-55.7-45.1174.7-28.837.4000114.2D268 L270 I275 G276 I313 V316D268-P272 VanDerWaalsContact O-CD 3.31Å; D268-P272 WeakPolarHBondContact O-CD 3.48Å; L270-P272 VanDerWaalsContact C-CD 3.45Å; L270-P272 VanDerWaalsContact C-N 3.34Å; L270-P272 VanDerWaalsContact O-N 3.16Å; P272-I275 PolarHBondContact O-N 3.33Å; P272-G276 PolarHBondContact O-N 2.73Å; P272-I313 HydrophobicContact CG-CG1 4.18Å; P272-V316 HydrophobicContact CB-CG1 4.35Å; P272-V316 HydrophobicContact CB-CG2 4.27Å
273G92.1Very high88.5Confident20 Ų2036.6 Ų36.621%0.20623%0.225CC..Hα-helixtrans-66.5-40.9-179.600000112L270 L271 G276 F277L270-G273 PolarHBondContact O-N 3.33Å; L271-G273 PolarHBondContact O-N 2.89Å; G273-G276 PolarHBondContact O-N 3.25Å; G273-F277 WeakPolarHBondContact O-CB 3.39Å; G273-F277 PolarHBondContact O-N 2.73Å
274Y93.7Very high89.8Confident4 Ų435.4 Ų35.42%0.01620%0.204CC..Hα-helixtrans-69.6-41.6176.5-78.2-95.1000113R225 L226 L229 L254 L258 L270 L271 G276 F277 F278R225-Y274 WeakPolarHBondContact CD-OH 3.27Å; R225-Y274 PolarHBondContact NH1-OH 3.35Å; L226-Y274 HydrophobicContact CD2-CD2 4.08Å; L226-Y274 HydrophobicContact CD2-CE2 4.06Å; L229-Y274 HydrophobicContact CD1-CD1 4.29Å; L229-Y274 HydrophobicContact CD1-CD2 4.08Å; L229-Y274 HydrophobicContact CD1-CE1 4.46Å; L229-Y274 HydrophobicContact CD1-CE2 4.23Å; L229-Y274 HydrophobicContact CD1-CG 4.15Å; L254-Y274 HydrophobicContact CB-CE1 4.2Å; L254-Y274 HydrophobicContact CD2-CE1 4.09Å; L258-Y274 HydrophobicContact CB-CD1 4.35Å; L258-Y274 HydrophobicContact CB-CE1 4.42Å; L258-Y274 HydrophobicContact CD1-CD2 4.29Å; L258-Y274 HydrophobicContact CD1-CG 4.23Å; L258-Y274 HydrophobicContact CD2-CD1 3.94Å; L258-Y274 HydrophobicContact CD2-CG 3.86Å; L270-Y274 HydrophobicContact CB-CD2 4.02Å; L270-Y274 HydrophobicContact CB-CE2 3.92Å; L270-Y274 WeakPolarHBondContact O-CD2 3.4Å; L270-Y274 PolarHBondContact O-N 3.49Å; L271-Y274 PolarHBondContact O-N 3.06Å; Y274-G276 VanDerWaalsContact C-N 3.3Å; Y274-G276 PolarHBondContact O-N 2.88Å; Y274-F277 PolarHBondContact O-N 3.48Å; Y274-F278 HydrophobicContact CD1-CD2 4.46Å; Y274-F278 HydrophobicContact CD1-CE2 4.04Å; Y274-F278 WeakPolarHBondContact O-CD2 3.28Å; Y274-F278 PolarHBondContact O-N 2.94Å
275I95.6Very high90.9Very high0 Ų035.4 Ų35.40%020%0.203CC..Hα-helixtrans-60.3-44.5173.8-72.6174.3000109.7L271 P272 F277 G279 L302 A305 I313 V316 A317 S320L271-I275 HydrophobicContact CD1-CD1 3.77Å; L271-I275 HydrophobicContact CD1-CG1 3.82Å; L271-I275 HydrophobicContact CD2-CD1 4.32Å; L271-I275 HydrophobicContact CG-CD1 3.64Å; L271-I275 HydrophobicContact CG-CG1 4.15Å; L271-I275 WeakPolarHBondContact O-CB 3.43Å; L271-I275 VanDerWaalsContact O-CG1 3.31Å; L271-I275 WeakPolarHBondContact O-CG1 3.29Å; L271-I275 PolarHBondContact O-N 2.9Å; P272-I275 PolarHBondContact O-N 3.33Å; I275-F277 VanDerWaalsContact C-N 3.32Å; I275-F277 PolarHBondContact O-N 3.49Å; I275-G279 VanDerWaalsContact O-CA 3.3Å; I275-G279 WeakPolarHBondContact O-CA 3.39Å; I275-G279 PolarHBondContact O-N 3.43Å; I275-L302 HydrophobicContact CG2-CD1 3.87Å; I275-A305 HydrophobicContact CD1-CB 3.46Å; I275-A305 VanDerWaalsContact CD1-CB 3.46Å; I275-I313 HydrophobicContact CD1-CG2 4.37Å; I275-V316 HydrophobicContact CB-CG1 4.14Å; I275-V316 HydrophobicContact CG2-CG1 3.82Å; I275-A317 HydrophobicContact CD1-CB 4.48Å; I275-S320 VanDerWaalsContact CG2-OG 3.23Å; I275-S320 WeakPolarHBondContact CG2-OG 3.42Å
276G93.8Very high92.2Very high18 Ų1829.7 Ų29.719%0.18617%0.166CC..Hα-helixtrans-61.8-37.9176.100000113.3P272 G273 Y274 S280P272-G276 PolarHBondContact O-N 2.73Å; G273-G276 PolarHBondContact O-N 3.25Å; Y274-G276 VanDerWaalsContact C-N 3.3Å; Y274-G276 PolarHBondContact O-N 2.88Å; G276-S280 PolarHBondContact O-N 3.28Å
277F95.8Very high93.2Very high1 Ų127.8 Ų27.80%0.00416%0.157CC..Hα-helixtrans-68.7-59.6175.8177.9-103.3000111.7L229 K233 F251 L254 G273 Y274 I275 G279 S280 L281L229-F277 HydrophobicContact CD1-CB 4.47Å; L229-F277 HydrophobicContact CD2-CB 4.28Å; L229-F277 HydrophobicContact CD2-CD1 4.08Å; L229-F277 HydrophobicContact CD2-CD2 4.08Å; L229-F277 HydrophobicContact CD2-CE1 4.44Å; L229-F277 HydrophobicContact CD2-CE2 4.46Å; L229-F277 HydrophobicContact CD2-CG 3.89Å; K233-F277 HydrophobicContact CB-CD2 4.05Å; F251-F277 HydrophobicContact CD1-CE1 4.1Å; F251-F277 AromaticContact CD1-CZ 3.95Å; F251-F277 HydrophobicContact CD1-CZ 3.95Å; F251-F277 HydrophobicContact CE1-CE1 4.4Å; F251-F277 AromaticContact CE1-CZ 3.83Å; F251-F277 HydrophobicContact CE1-CZ 3.83Å; L254-F277 HydrophobicContact CD1-CD1 4.49Å; L254-F277 HydrophobicContact CD1-CE1 3.91Å; L254-F277 HydrophobicContact CD1-CZ 4.36Å; G273-F277 WeakPolarHBondContact O-CB 3.39Å; G273-F277 PolarHBondContact O-N 2.73Å; Y274-F277 PolarHBondContact O-N 3.48Å; I275-F277 VanDerWaalsContact C-N 3.32Å; I275-F277 PolarHBondContact O-N 3.49Å; F277-G279 VanDerWaalsContact C-N 3.31Å; F277-G279 PolarHBondContact O-N 2.62Å; F277-S280 WeakPolarHBondContact O-CB 3.28Å; F277-S280 PolarHBondContact O-N 3.41Å; F277-S280 VanDerWaalsContact O-N 3.09Å; F277-S280 PolarHBondContact O-OG 2.94Å; F277-L281 HydrophobicContact CD1-CD1 4.32Å; F277-L281 HydrophobicContact CE1-CD1 3.75Å; F277-L281 HydrophobicContact CE1-CG 4.47Å; F277-L281 HydrophobicContact CZ-CD1 4.08Å; F277-L281 PolarHBondContact O-N 3.37Å
278F96.5Very high93.9Very high0 Ų030 Ų300%017%0.165CC..Hα-helixtrans-67.8-29.3-178.5-78.1-72.9000113F251 L254 L255 Y274 S280 L281 A282 W289 F298F251-F278 HydrophobicContact CB-CE1 4.42Å; L254-F278 HydrophobicContact CB-CE2 4.19Å; L254-F278 HydrophobicContact CB-CZ 3.91Å; L255-F278 HydrophobicContact CB-CE1 4.11Å; L255-F278 HydrophobicContact CB-CE2 4.3Å; L255-F278 HydrophobicContact CB-CZ 3.65Å; L255-F278 HydrophobicContact CD1-CD2 4.47Å; L255-F278 HydrophobicContact CD1-CE1 4.43Å; L255-F278 HydrophobicContact CD1-CE2 4.14Å; L255-F278 HydrophobicContact CD1-CZ 4.15Å; L255-F278 HydrophobicContact CG-CZ 4.4Å; Y274-F278 HydrophobicContact CD1-CD2 4.46Å; Y274-F278 HydrophobicContact CD1-CE2 4.04Å; Y274-F278 WeakPolarHBondContact O-CD2 3.28Å; Y274-F278 PolarHBondContact O-N 2.94Å; F278-S280 VanDerWaalsContact C-N 3.28Å; F278-S280 PolarHBondContact O-N 3.24Å; F278-L281 HydrophobicContact CD1-CD1 3.9Å; F278-L281 HydrophobicContact CE1-CD1 4.18Å; F278-L281 PolarHBondContact O-N 3.42Å; F278-L281 VanDerWaalsContact O-N 3.16Å; F278-A282 WeakPolarHBondContact O-CB 3.28Å; F278-A282 PolarHBondContact O-N 3.05Å; F278-W289 HydrophobicContact CD1-CE3 4.03Å; F278-W289 HydrophobicContact CD1-CH2 4.2Å; F278-W289 AromaticContact CD1-CZ3 3.75Å; F278-W289 HydrophobicContact CD1-CZ3 3.75Å; F278-W289 HydrophobicContact CE1-CE3 4.41Å; F278-W289 AromaticContact CE1-CH2 3.94Å; F278-W289 HydrophobicContact CE1-CH2 3.94Å; F278-W289 AromaticContact CE1-CZ3 3.68Å; F278-W289 HydrophobicContact CE1-CZ3 3.68Å; F278-F298 HydrophobicContact CB-CD1 4.12Å; F278-F298 HydrophobicContact CB-CD2 3.48Å; F278-F298 VanDerWaalsContact CB-CD2 3.48Å; F278-F298 HydrophobicContact CB-CE1 3.95Å; F278-F298 HydrophobicContact CB-CE2 3.3Å; F278-F298 HydrophobicContact CB-CG 3.91Å; F278-F298 HydrophobicContact CB-CZ 3.54Å; F278-F298 HydrophobicContact CD2-CD2 4.48Å; F278-F298 HydrophobicContact CG-CD2 4.06Å; F278-F298 HydrophobicContact CG-CE2 4.29Å; F278-F298 HydrophobicContact CG-CG 4.44Å
279G96.9Very high94.5Very high3 Ų326.4 Ų26.43%0.03115%0.145CC..Hα-helixtrans-60.7-37.217100000112.1I275 F277 A282 N283I275-G279 VanDerWaalsContact O-CA 3.3Å; I275-G279 WeakPolarHBondContact O-CA 3.39Å; I275-G279 PolarHBondContact O-N 3.43Å; F277-G279 VanDerWaalsContact C-N 3.31Å; F277-G279 PolarHBondContact O-N 2.62Å; G279-A282 PolarHBondContact O-N 3.22Å; G279-N283 WeakPolarHBondContact O-CB 3.35Å; G279-N283 PolarHBondContact O-N 3.36Å
280S95.4Very high95.1Very high34 Ų3421.5 Ų21.524%0.23812%0.12CC..Hα-helixtrans-67.9-37.2173.478.70000112.8G276 F277 F278 N283 R284G276-S280 PolarHBondContact O-N 3.28Å; F277-S280 WeakPolarHBondContact O-CB 3.28Å; F277-S280 PolarHBondContact O-N 3.41Å; F277-S280 VanDerWaalsContact O-N 3.09Å; F277-S280 PolarHBondContact O-OG 2.94Å; F278-S280 VanDerWaalsContact C-N 3.28Å; F278-S280 PolarHBondContact O-N 3.24Å; S280-N283 PolarHBondContact O-N 3.43Å; S280-R284 PolarHBondContact O-N 3.39Å
281L97Very high95.5Very high1 Ų122 Ų221%0.00513%0.126CC..Hα-helixtrans-68.5-41.6175.2-52.4-173.8000111.1T236 Y242 F251 F277 F278 N283 R284 D285 W289T236-L281 HydrophobicContact CG2-CD2 3.7Å; Y242-L281 HydrophobicContact CD2-CD2 4Å; Y242-L281 HydrophobicContact CE2-CB 4.33Å; Y242-L281 HydrophobicContact CE2-CD2 3.91Å; F251-L281 HydrophobicContact CD1-CD1 3.8Å; F251-L281 HydrophobicContact CD2-CD1 4.24Å; F251-L281 HydrophobicContact CE1-CD1 3.89Å; F251-L281 HydrophobicContact CE1-CD2 4.37Å; F251-L281 HydrophobicContact CE2-CD1 4.29Å; F251-L281 HydrophobicContact CG-CD1 4Å; F251-L281 HydrophobicContact CZ-CD1 4.14Å; F251-L281 HydrophobicContact CZ-CD2 4.21Å; F277-L281 HydrophobicContact CD1-CD1 4.32Å; F277-L281 HydrophobicContact CE1-CD1 3.75Å; F277-L281 HydrophobicContact CE1-CG 4.47Å; F277-L281 HydrophobicContact CZ-CD1 4.08Å; F277-L281 PolarHBondContact O-N 3.37Å; F278-L281 HydrophobicContact CD1-CD1 3.9Å; F278-L281 HydrophobicContact CE1-CD1 4.18Å; F278-L281 PolarHBondContact O-N 3.42Å; F278-L281 VanDerWaalsContact O-N 3.16Å; L281-N283 VanDerWaalsContact C-N 3.3Å; L281-N283 PolarHBondContact O-N 2.84Å; L281-R284 WeakPolarHBondContact O-CB 3.43Å; L281-R284 PolarHBondContact O-N 3.42Å; L281-R284 VanDerWaalsContact O-N 3.12Å; L281-D285 PolarHBondContact O-N 3.29Å; L281-W289 VanDerWaalsContact C-CD1 3.43Å; L281-W289 HydrophobicContact CB-CD2 4.32Å; L281-W289 HydrophobicContact CB-CG 4.5Å; L281-W289 HydrophobicContact CB-CZ2 4.19Å; L281-W289 HydrophobicContact CD1-CH2 4.23Å; L281-W289 HydrophobicContact CD1-CZ2 3.77Å; L281-W289 VanDerWaalsContact O-CD1 3.28Å
282A97.6Very high95.6Very high0 Ų026.4 Ų26.40%016%0.158CC..Hα-helixtrans-66.5-29.8175.800000112.5F278 G279 R284 D285 P286 W289 L290 F298 I324F278-A282 WeakPolarHBondContact O-CB 3.28Å; F278-A282 PolarHBondContact O-N 3.05Å; G279-A282 PolarHBondContact O-N 3.22Å; A282-R284 VanDerWaalsContact C-N 3.29Å; A282-R284 PolarHBondContact O-N 3.49Å; A282-D285 CarbonylContact O-C 3.54Å; A282-P286 WeakPolarHBondContact O-CA 3.31Å; A282-P286 VanDerWaalsContact O-CD 3.27Å; A282-P286 WeakPolarHBondContact O-CD 3.24Å; A282-P286 WeakPolarHBondContact O-CG 3.29Å; A282-W289 HydrophobicContact CB-CB 3.67Å; A282-W289 HydrophobicContact CB-CG 4.2Å; A282-L290 HydrophobicContact CB-CD1 4.24Å; A282-L290 HydrophobicContact CB-CG 4.31Å; A282-F298 HydrophobicContact CB-CD1 4.4Å; A282-F298 HydrophobicContact CB-CE1 3.87Å; A282-I324 HydrophobicContact CB-CD1 3.64Å; A282-I324 HydrophobicContact CB-CG1 4.21Å
283N95.8Very high95.7Very high50 Ų5031.5 Ų31.527%0.26718%0.175SC..Hα-helixtrans-66.6-32.3171.9-174.261.1000112.2G279 S280 L281 C323 I324G279-N283 WeakPolarHBondContact O-CB 3.35Å; G279-N283 PolarHBondContact O-N 3.36Å; S280-N283 PolarHBondContact O-N 3.43Å; L281-N283 VanDerWaalsContact C-N 3.3Å; L281-N283 PolarHBondContact O-N 2.84Å; N283-C323 PolarHBondContact OD1-O 3.37Å; N283-I324 HydrophobicContact CB-CG1 4.17Å; N283-I324 WeakPolarHBondContact OD1-CA 3.47Å
284R93.6Very high95.8Very high88 Ų8831.6 Ų31.633%0.33217%0.173SC..Hα-helixtrans-74.6-49.6175.2-174.4-168.9-17079.922112.1T236 I237 E239 S280 L281 A282T236-R284 PolarHBondContact O-NH1 3.12Å; I237-R284 PolarHBondContact O-NH1 2.84Å; E239-R284 VanDerWaalsContact CA-NH2 3.34Å; E239-R284 VanDerWaalsContact CB-NH2 3.32Å; E239-R284 IonicContact OE1-CZ 3.34Å; E239-R284 IonicContact OE1-NE 3.16Å; E239-R284 IonicContact OE1-NH2 2.8Å; E239-R284 PolarHBondContact OE1-NH2 3.35Å; E239-R284 IonicContact OE2-CZ 2.68Å; E239-R284 IonicContact OE2-NE 2.82Å; E239-R284 IonicContact OE2-NH2 3.37Å; E239-R284 PolarHBondContact OE2-NH2 2.91Å; S280-R284 PolarHBondContact O-N 3.39Å; L281-R284 WeakPolarHBondContact O-CB 3.43Å; L281-R284 PolarHBondContact O-N 3.42Å; L281-R284 VanDerWaalsContact O-N 3.12Å; A282-R284 VanDerWaalsContact C-N 3.29Å; A282-R284 PolarHBondContact O-N 3.49Å
285D95.6Very high95.8Very high57 Ų5736 Ų3631%0.30520%0.197SC..  trans-13177.5-178-167.4-14.2000111.8L281 A282 D287 H288 W289L281-D285 PolarHBondContact O-N 3.29Å; A282-D285 CarbonylContact O-C 3.54Å; D285-D287 VanDerWaalsContact C-N 3.29Å; D285-D287 PolarHBondContact O-N 3.3Å; D285-H288 HydrophobicContact CB-CB 4.08Å; D285-H288 PolarHBondContact O-N 3.45Å; D285-H288 WeakPolarHBondContact OD1-CB 3.45Å; D285-H288 PolarHBondContact OD1-N 3.46Å; D285-H288 VanDerWaalsContact OD1-N 3.16Å; D285-H288 VanDerWaalsContact OD2-CB 3.28Å; D285-H288 WeakPolarHBondContact OD2-CB 3.28Å; D285-W289 PolarHBondContact O-N 3.4Å
286P97.9Very high95.7Very high4 Ų436.6 Ų36.63%0.02620%0.203CC..Hα-helixtrans-60.3-37.4-174.6-22.530.1000113.5A282 W289 L290 G291 I324 G330 T333A282-P286 WeakPolarHBondContact O-CA 3.31Å; A282-P286 VanDerWaalsContact O-CD 3.27Å; A282-P286 WeakPolarHBondContact O-CD 3.24Å; A282-P286 WeakPolarHBondContact O-CG 3.29Å; P286-W289 PolarHBondContact O-N 2.81Å; P286-L290 WeakPolarHBondContact O-CB 3.44Å; P286-L290 PolarHBondContact O-N 2.96Å; P286-G291 PolarHBondContact O-N 3.16Å; P286-G291 VanDerWaalsContact O-N 3.13Å; P286-I324 HydrophobicContact CB-CG2 4.23Å; P286-I324 HydrophobicContact CG-CG2 4.28Å; P286-G330 VanDerWaalsContact CG-CA 3.46Å; P286-T333 HydrophobicContact CB-CG2 4.19Å
287D97.3Very high95.7Very high37 Ų3738.2 Ų38.220%0.19821%0.205CC..Hα-helixtrans-71.8-36.4-176.3-174.951.7000112D285 G291 S292 K293D285-D287 VanDerWaalsContact C-N 3.29Å; D285-D287 PolarHBondContact O-N 3.3Å; D287-G291 CarbonylContact O-C 3.59Å; D287-G291 VanDerWaalsContact O-CA 3.31Å; D287-G291 WeakPolarHBondContact O-CA 3.3Å; D287-G291 PolarHBondContact O-N 3.16Å; D287-G291 VanDerWaalsContact O-N 3.15Å; D287-S292 PolarHBondContact OD1-N 3.42Å; D287-S292 PolarHBondContact OD1-OG 3.17Å; D287-S292 PolarHBondContact OD2-OG 3.09Å; D287-K293 PolarHBondContact O-N 2.62Å; D287-K293 VanDerWaalsContact OD2-CD 3.25Å; D287-K293 WeakPolarHBondContact OD2-CD 3.23Å; D287-K293 VanDerWaalsContact OD2-CE 3.23Å; D287-K293 WeakPolarHBondContact OD2-CE 3.49Å; D287-K293 WeakPolarHBondContact OD2-CG 3.43Å; D287-K293 IonicContact OD2-NZ 3.26Å
288H96Very high95.7Very high68 Ų6838.2 Ų38.232%0.31521%0.205SC..Hα-helixtrans-65.9-41.8172.7178.9-85.3000112.6D285 S294D285-H288 HydrophobicContact CB-CB 4.08Å; D285-H288 PolarHBondContact O-N 3.45Å; D285-H288 WeakPolarHBondContact OD1-CB 3.45Å; D285-H288 PolarHBondContact OD1-N 3.46Å; D285-H288 VanDerWaalsContact OD1-N 3.16Å; D285-H288 VanDerWaalsContact OD2-CB 3.28Å; D285-H288 WeakPolarHBondContact OD2-CB 3.28Å; H288-S294 WeakPolarHBondContact O-CA 3.42Å; H288-S294 VanDerWaalsContact O-CB 3.28Å; H288-S294 WeakPolarHBondContact O-CB 3.35Å; H288-S294 PolarHBondContact O-N 2.84Å
289W97.1Very high95.7Very high12 Ų1240.2 Ų40.25%0.04521%0.213CC..Hα-helixtrans-89.2-31.3-172.7-69.6103.7000114.1Y242 F251 L255 F278 L281 A282 D285 P286 S294 F298Y242-W289 PolarHBondContact OH-NE1 3.02Å; Y242-W289 VanDerWaalsContact OH-NE1 3.17Å; F251-W289 HydrophobicContact CB-CH2 3.65Å; F251-W289 HydrophobicContact CB-CZ2 4.22Å; F251-W289 HydrophobicContact CD2-CH2 4.18Å; F251-W289 AromaticContact CD2-CZ2 3.89Å; F251-W289 HydrophobicContact CD2-CZ2 3.89Å; F251-W289 HydrophobicContact CG-CH2 4.2Å; F251-W289 HydrophobicContact CG-CZ2 4.28Å; L255-W289 HydrophobicContact CD2-CZ3 4.09Å; F278-W289 HydrophobicContact CD1-CE3 4.03Å; F278-W289 HydrophobicContact CD1-CH2 4.2Å; F278-W289 AromaticContact CD1-CZ3 3.75Å; F278-W289 HydrophobicContact CD1-CZ3 3.75Å; F278-W289 HydrophobicContact CE1-CE3 4.41Å; F278-W289 AromaticContact CE1-CH2 3.94Å; F278-W289 HydrophobicContact CE1-CH2 3.94Å; F278-W289 AromaticContact CE1-CZ3 3.68Å; F278-W289 HydrophobicContact CE1-CZ3 3.68Å; L281-W289 VanDerWaalsContact C-CD1 3.43Å; L281-W289 HydrophobicContact CB-CD2 4.32Å; L281-W289 HydrophobicContact CB-CG 4.5Å; L281-W289 HydrophobicContact CB-CZ2 4.19Å; L281-W289 HydrophobicContact CD1-CH2 4.23Å; L281-W289 HydrophobicContact CD1-CZ2 3.77Å; L281-W289 VanDerWaalsContact O-CD1 3.28Å; A282-W289 HydrophobicContact CB-CB 3.67Å; A282-W289 HydrophobicContact CB-CG 4.2Å; D285-W289 PolarHBondContact O-N 3.4Å; P286-W289 PolarHBondContact O-N 2.81Å; W289-S294 WeakPolarHBondContact O-CB 3.33Å; W289-S294 PolarHBondContact O-OG 3.38Å; W289-F298 HydrophobicContact CB-CD1 4.37Å
290L98.2Very high95.6Very high0 Ų043.2 Ų43.20%023%0.229CC..THydrogen-bonded Turntrans-126.9-31.5-173.9-60.8176.6000113.5A282 P286 F298 K299 L302 I324 T333 L337 F344A282-L290 HydrophobicContact CB-CD1 4.24Å; A282-L290 HydrophobicContact CB-CG 4.31Å; P286-L290 WeakPolarHBondContact O-CB 3.44Å; P286-L290 PolarHBondContact O-N 2.96Å; L290-F298 HydrophobicContact CD2-CD1 3.67Å; L290-F298 HydrophobicContact CD2-CE1 4.01Å; L290-F298 HydrophobicContact CG-CD1 4.42Å; L290-K299 HydrophobicContact CD2-CB 3.93Å; L290-K299 WeakPolarHBondContact O-CD 3.38Å; L290-K299 PolarHBondContact O-NZ 3.1Å; L290-L302 HydrophobicContact CD2-CD2 4.27Å; L290-I324 HydrophobicContact CD1-CD1 3.68Å; L290-T333 HydrophobicContact CB-CG2 4.06Å; L290-L337 HydrophobicContact CB-CD1 3.85Å; L290-F344 HydrophobicContact CD1-CE2 4.31Å; L290-F344 HydrophobicContact CD2-CZ 4.19Å
291G95.4Very high95.5Very high16 Ų1642.4 Ų42.417%0.16522%0.222CC..SBendtrans-80-140.7-172.600000114.6P286 D287 S294P286-G291 PolarHBondContact O-N 3.16Å; P286-G291 VanDerWaalsContact O-N 3.13Å; D287-G291 CarbonylContact O-C 3.59Å; D287-G291 VanDerWaalsContact O-CA 3.31Å; D287-G291 WeakPolarHBondContact O-CA 3.3Å; D287-G291 PolarHBondContact O-N 3.16Å; D287-G291 VanDerWaalsContact O-N 3.15Å; G291-S294 WeakPolarHBondContact O-CB 3.14Å
292S93.7Very high95.4Very high101 Ų10142.4 Ų42.471%0.70622%0.221SC*.THydrogen-bonded Turntrans-77.8-23.8-170.762.10000113.8D287D287-S292 PolarHBondContact OD1-N 3.42Å; D287-S292 PolarHBondContact OD1-OG 3.17Å; D287-S292 PolarHBondContact OD2-OG 3.09Å
293K95Very high95.3Very high147 Ų14743.1 Ų43.164%0.63923%0.227SC*.THydrogen-bonded Turntrans-91.3-3.6178.2-65.3175.1-170.6167.30113.3D287D287-K293 PolarHBondContact O-N 2.62Å; D287-K293 VanDerWaalsContact OD2-CD 3.25Å; D287-K293 WeakPolarHBondContact OD2-CD 3.23Å; D287-K293 VanDerWaalsContact OD2-CE 3.23Å; D287-K293 WeakPolarHBondContact OD2-CE 3.49Å; D287-K293 WeakPolarHBondContact OD2-CG 3.43Å; D287-K293 IonicContact OD2-NZ 3.26Å
294S94.2Very high95.2Very high23 Ų2344.3 Ų44.316%0.16123%0.233CC..  trans-73143.9-178.3178.30000113H288 W289 G291 G296H288-S294 WeakPolarHBondContact O-CA 3.42Å; H288-S294 VanDerWaalsContact O-CB 3.28Å; H288-S294 WeakPolarHBondContact O-CB 3.35Å; H288-S294 PolarHBondContact O-N 2.84Å; W289-S294 WeakPolarHBondContact O-CB 3.33Å; W289-S294 PolarHBondContact O-OG 3.38Å; G291-S294 WeakPolarHBondContact O-CB 3.14Å; S294-G296 PolarHBondContact O-N 2.96Å; S294-G296 PolarHBondContact OG-N 3.07Å
295D92.8Very high95.2Very high97 Ų9740.1 Ų40.152%0.51922%0.217SC..  trans-73.9-5.5167.779.2-10.3000113K297D295-K297 VanDerWaalsContact C-N 3.31Å; D295-K297 PolarHBondContact O-N 2.81Å; D295-K297 PolarHBondContact OD1-N 2.95Å; D295-K297 WeakPolarHBondContact OD2-CD 3.24Å; D295-K297 WeakPolarHBondContact OD2-CE 3.37Å; D295-K297 IonicContact OD2-NZ 3.54Å; D295-K297 PolarHBondContact OD2-NZ 3.47Å
296G93.9Very high95.3Very high11 Ų1137.6 Ų37.611%0.11320%0.204CC..SBendtrans84-12.9175.600000115.3S294 K299 N300S294-G296 PolarHBondContact O-N 2.96Å; S294-G296 PolarHBondContact OG-N 3.07Å; G296-K299 PolarHBondContact O-N 3.14Å; G296-N300 PolarHBondContact O-N 3.45Å; G296-N300 PolarHBondContact O-OD1 3.45Å
297K94.7Very high95Very high52 Ų5239.2 Ų39.223%0.22621%0.212CC..Hα-helixtrans-64.3-51.9-173.7-68.2177.3-165.9134.90112.2L255 D256 Y259 D295 K299 N300 I301L255-K297 HydrophobicContact CD1-CB 4.18Å; L255-K297 HydrophobicContact CD2-CB 3.85Å; L255-K297 HydrophobicContact CD2-CD 4.38Å; L255-K297 HydrophobicContact CG-CB 3.84Å; L255-K297 HydrophobicContact CG-CD 4.15Å; D256-K297 WeakPolarHBondContact OD1-CE 3.5Å; D256-K297 IonicContact OD1-NZ 3.24Å; D256-K297 PolarHBondContact OD1-NZ 3.05Å; Y259-K297 HydrophobicContact CD2-CB 4.1Å; Y259-K297 HydrophobicContact CD2-CG 4.11Å; Y259-K297 HydrophobicContact CE2-CG 4.41Å; Y259-K297 HydrophobicContact CG-CD 4.34Å; Y259-K297 HydrophobicContact CG-CG 4.26Å; D295-K297 VanDerWaalsContact C-N 3.31Å; D295-K297 PolarHBondContact O-N 2.81Å; D295-K297 PolarHBondContact OD1-N 2.95Å; D295-K297 WeakPolarHBondContact OD2-CD 3.24Å; D295-K297 WeakPolarHBondContact OD2-CE 3.37Å; D295-K297 IonicContact OD2-NZ 3.54Å; D295-K297 PolarHBondContact OD2-NZ 3.47Å; K297-K299 VanDerWaalsContact C-N 3.3Å; K297-K299 PolarHBondContact O-N 3.3Å; K297-N300 PolarHBondContact O-N 2.86Å; K297-I301 WeakPolarHBondContact O-CD1 3.49Å; K297-I301 WeakPolarHBondContact O-CG1 3.42Å; K297-I301 PolarHBondContact O-N 2.88Å
298F95.9Very high94.6Very high1 Ų146 Ų460%0.00424%0.237CC..Hα-helixtrans-65-37.5-179.9-180-122.3000111.7L255 F278 A282 W289 L290 N300 I301 L302L255-F298 HydrophobicContact CD1-CB 3.97Å; L255-F298 HydrophobicContact CD2-CB 4.25Å; F278-F298 HydrophobicContact CB-CD1 4.12Å; F278-F298 HydrophobicContact CB-CD2 3.48Å; F278-F298 VanDerWaalsContact CB-CD2 3.48Å; F278-F298 HydrophobicContact CB-CE1 3.95Å; F278-F298 HydrophobicContact CB-CE2 3.3Å; F278-F298 HydrophobicContact CB-CG 3.91Å; F278-F298 HydrophobicContact CB-CZ 3.54Å; F278-F298 HydrophobicContact CD2-CD2 4.48Å; F278-F298 HydrophobicContact CG-CD2 4.06Å; F278-F298 HydrophobicContact CG-CE2 4.29Å; F278-F298 HydrophobicContact CG-CG 4.44Å; A282-F298 HydrophobicContact CB-CD1 4.4Å; A282-F298 HydrophobicContact CB-CE1 3.87Å; W289-F298 HydrophobicContact CB-CD1 4.37Å; L290-F298 HydrophobicContact CD2-CD1 3.67Å; L290-F298 HydrophobicContact CD2-CE1 4.01Å; L290-F298 HydrophobicContact CG-CD1 4.42Å; F298-N300 VanDerWaalsContact C-N 3.34Å; F298-N300 PolarHBondContact O-N 3.34Å; F298-I301 PolarHBondContact O-N 3.3Å; F298-L302 HydrophobicContact CE1-CD2 4.08Å; F298-L302 HydrophobicContact CE2-CB 4.47Å; F298-L302 HydrophobicContact CZ-CB 4.46Å; F298-L302 HydrophobicContact CZ-CD1 4.4Å; F298-L302 HydrophobicContact CZ-CD2 4.03Å; F298-L302 VanDerWaalsContact O-CB 3.26Å; F298-L302 WeakPolarHBondContact O-CB 3.35Å; F298-L302 PolarHBondContact O-N 3.45Å
299K96.2Very high94.3Very high42 Ų4244.9 Ų44.918%0.18323%0.233CC..Hα-helixtrans-58-45.4173.5173.7171.458.2-158.30112L290 G296 K297 L302 S303 L337 A343 F344L290-K299 HydrophobicContact CD2-CB 3.93Å; L290-K299 WeakPolarHBondContact O-CD 3.38Å; L290-K299 PolarHBondContact O-NZ 3.1Å; G296-K299 PolarHBondContact O-N 3.14Å; K297-K299 VanDerWaalsContact C-N 3.3Å; K297-K299 PolarHBondContact O-N 3.3Å; K299-L302 PolarHBondContact O-N 3.23Å; K299-S303 WeakPolarHBondContact O-CB 3.41Å; K299-S303 PolarHBondContact O-N 3.16Å; K299-L337 HydrophobicContact CD-CD2 3.72Å; K299-A343 HydrophobicContact CD-CB 3.76Å; K299-A343 HydrophobicContact CG-CB 3.77Å; K299-F344 HydrophobicContact CG-CE1 4.34Å; K299-F344 HydrophobicContact CG-CZ 4.4Å
300N93.6Very high94Very high66 Ų6647.1 Ų47.135%0.35325%0.253SS..Hα-helixtrans-66.3-46.6178.4-66.4-8.5000111.1G296 K297 F298 L302 S303 D304G296-N300 PolarHBondContact O-N 3.45Å; G296-N300 PolarHBondContact O-OD1 3.45Å; K297-N300 PolarHBondContact O-N 2.86Å; F298-N300 VanDerWaalsContact C-N 3.34Å; F298-N300 PolarHBondContact O-N 3.34Å; N300-L302 VanDerWaalsContact C-N 3.29Å; N300-L302 PolarHBondContact O-N 3.19Å; N300-S303 WeakPolarHBondContact O-CB 3.43Å; N300-S303 PolarHBondContact O-N 3.22Å; N300-S303 VanDerWaalsContact O-N 3.16Å; N300-D304 WeakPolarHBondContact O-CB 3.18Å; N300-D304 VanDerWaalsContact O-CG 3.31Å; N300-D304 PolarHBondContact O-N 3.13Å
301I93.4Very high93.8Very high18 Ų1850.4 Ų50.49%0.09227%0.27CS..Hα-helixtrans-56.1-45.2175.4-71158.6000111.1L255 L258 Y259 L271 K297 F298 D304 A305L255-I301 HydrophobicContact CD1-CD1 3.74Å; L258-I301 HydrophobicContact CD2-CD1 3.89Å; L258-I301 HydrophobicContact CD2-CG2 4.23Å; L258-I301 HydrophobicContact CG-CD1 4.13Å; Y259-I301 HydrophobicContact CD2-CD1 4.23Å; Y259-I301 HydrophobicContact CD2-CG1 4.34Å; L271-I301 HydrophobicContact CD1-CG2 3.54Å; K297-I301 WeakPolarHBondContact O-CD1 3.49Å; K297-I301 WeakPolarHBondContact O-CG1 3.42Å; K297-I301 PolarHBondContact O-N 2.88Å; F298-I301 PolarHBondContact O-N 3.3Å; I301-D304 PolarHBondContact O-N 2.85Å; I301-A305 VanDerWaalsContact O-CB 3.26Å; I301-A305 WeakPolarHBondContact O-CB 3.23Å; I301-A305 PolarHBondContact O-N 3.42Å
302L95.7Very high93.6Very high0 Ų054.1 Ų54.10%029%0.287CS..Hα-helixtrans-69.2-36-179.2-16860000111.9I275 L290 F298 K299 N300 V306 A317 I321 F344I275-L302 HydrophobicContact CG2-CD1 3.87Å; L290-L302 HydrophobicContact CD2-CD2 4.27Å; F298-L302 HydrophobicContact CE1-CD2 4.08Å; F298-L302 HydrophobicContact CE2-CB 4.47Å; F298-L302 HydrophobicContact CZ-CB 4.46Å; F298-L302 HydrophobicContact CZ-CD1 4.4Å; F298-L302 HydrophobicContact CZ-CD2 4.03Å; F298-L302 VanDerWaalsContact O-CB 3.26Å; F298-L302 WeakPolarHBondContact O-CB 3.35Å; F298-L302 PolarHBondContact O-N 3.45Å; K299-L302 PolarHBondContact O-N 3.23Å; N300-L302 VanDerWaalsContact C-N 3.29Å; N300-L302 PolarHBondContact O-N 3.19Å; L302-V306 PolarHBondContact O-N 3.11Å; L302-A317 HydrophobicContact CD1-CB 3.67Å; L302-I321 HydrophobicContact CD1-CG1 4.46Å; L302-I321 HydrophobicContact CD2-CD1 4.29Å; L302-I321 HydrophobicContact CD2-CG1 3.73Å; L302-I321 HydrophobicContact CG-CD1 4.18Å; L302-I321 HydrophobicContact CG-CG1 4.1Å; L302-F344 HydrophobicContact CB-CE1 4.33Å; L302-F344 HydrophobicContact CB-CZ 4.16Å; L302-F344 HydrophobicContact CD2-CE2 4.34Å; L302-F344 HydrophobicContact CD2-CZ 3.81Å; L302-F344 HydrophobicContact CG-CE1 4.45Å; L302-F344 HydrophobicContact CG-CZ 4.07Å
303S95.8Very high93.7Very high16 Ų1649.8 Ų49.811%0.11226%0.255CS..Hα-helixtrans-63.1-51.1172.5-171.70000111.2K299 N300 A305 V306 D307 A343K299-S303 WeakPolarHBondContact O-CB 3.41Å; K299-S303 PolarHBondContact O-N 3.16Å; N300-S303 WeakPolarHBondContact O-CB 3.43Å; N300-S303 PolarHBondContact O-N 3.22Å; N300-S303 VanDerWaalsContact O-N 3.16Å; S303-A305 VanDerWaalsContact C-N 3.3Å; S303-A305 PolarHBondContact O-N 3.48Å; S303-V306 PolarHBondContact O-N 3.43Å; S303-V306 VanDerWaalsContact O-N 3.11Å; S303-D307 WeakPolarHBondContact O-CB 3.38Å; S303-D307 PolarHBondContact O-N 2.66Å; S303-A343 PolarHBondContact OG-O 3.29Å
304D93.5Very high93.8Very high74 Ų7443 Ų4340%0.39623%0.226SC..Hα-helixtrans-63.1-38.1-178.3-68.6-21.3000111.4N300 I301 V306 D307 Y308 N309N300-D304 WeakPolarHBondContact O-CB 3.18Å; N300-D304 VanDerWaalsContact O-CG 3.31Å; N300-D304 PolarHBondContact O-N 3.13Å; I301-D304 PolarHBondContact O-N 2.85Å; D304-V306 VanDerWaalsContact C-N 3.28Å; D304-V306 PolarHBondContact O-N 3.47Å; D304-D307 PolarHBondContact O-N 3.29Å; D304-Y308 HydrophobicContact CB-CD2 4.09Å; D304-Y308 PolarHBondContact O-N 3.39Å; D304-Y308 WeakPolarHBondContact OD1-CE2 3.13Å; D304-N309 PolarHBondContact O-OD1 2.89Å; D304-N309 VanDerWaalsContact O-OD1 3.07Å
305A94.5Very high93.9Very high0 Ų041.9 Ų41.90%022%0.218CC..Hα-helixtrans-58.9-37.3174.600000113.2L271 I275 I301 S303 N309 I313 S314 A317L271-A305 HydrophobicContact CD2-CB 4.39Å; I275-A305 HydrophobicContact CD1-CB 3.46Å; I275-A305 VanDerWaalsContact CD1-CB 3.46Å; I301-A305 VanDerWaalsContact O-CB 3.26Å; I301-A305 WeakPolarHBondContact O-CB 3.23Å; I301-A305 PolarHBondContact O-N 3.42Å; S303-A305 VanDerWaalsContact C-N 3.3Å; S303-A305 PolarHBondContact O-N 3.48Å; A305-N309 WeakPolarHBondContact CA-OD1 3.41Å; A305-I313 HydrophobicContact CB-CG2 3.89Å; A305-S314 VanDerWaalsContact O-CA 3.23Å; A305-S314 WeakPolarHBondContact O-CA 3.47Å; A305-S314 WeakPolarHBondContact O-CB 3.31Å; A305-S314 PolarHBondContact O-N 2.96Å; A305-S314 PolarHBondContact O-OG 3.4Å; A305-A317 HydrophobicContact CB-CB 3.86Å
306V96Very high94.1Very high4 Ų438.5 Ų38.52%0.02420%0.201CC..Hα-helixtrans-74.4-36.6171.9175.20000110.7L302 S303 D304 A317 F318 I321 V347 K350L302-V306 PolarHBondContact O-N 3.11Å; S303-V306 PolarHBondContact O-N 3.43Å; S303-V306 VanDerWaalsContact O-N 3.11Å; D304-V306 VanDerWaalsContact C-N 3.28Å; D304-V306 PolarHBondContact O-N 3.47Å; V306-A317 HydrophobicContact CG2-CB 3.59Å; V306-F318 HydrophobicContact CG1-CE1 3.68Å; V306-F318 HydrophobicContact CG1-CZ 3.78Å; V306-F318 HydrophobicContact CG2-CD1 4.32Å; V306-F318 HydrophobicContact CG2-CE1 4.09Å; V306-I321 HydrophobicContact CG2-CD1 4.11Å; V306-V347 HydrophobicContact CB-CG2 4.4Å; V306-V347 HydrophobicContact CG1-CG2 4.07Å; V306-V347 HydrophobicContact CG2-CG2 4.23Å; V306-K350 HydrophobicContact CG1-CB 4.38Å; V306-K350 HydrophobicContact CG1-CD 3.85Å; V306-K350 PolarHBondContact O-NZ 3.13Å
307D92.6Very high94.3Very high38 Ų3838 Ų3820%0.20320%0.196CC..Hα-helixtrans-86.7-39.5-165.7-82.8-31.9000116.5S303 D304 S346 K350S303-D307 WeakPolarHBondContact O-CB 3.38Å; S303-D307 PolarHBondContact O-N 2.66Å; D304-D307 PolarHBondContact O-N 3.29Å; D307-S346 VanDerWaalsContact CG-OG 3.3Å; D307-S346 WeakPolarHBondContact OD1-CB 3.36Å; D307-S346 PolarHBondContact OD1-OG 3.26Å; D307-S346 PolarHBondContact OD2-OG 3.2Å; D307-K350 PolarHBondContact O-NZ 3.29Å; D307-K350 WeakPolarHBondContact OD1-CE 3.09Å; D307-K350 IonicContact OD1-NZ 2.72Å; D307-K350 PolarHBondContact OD1-NZ 3.15Å
308Y88.2Confident94.5Very high181 Ų18135.6 Ų35.671%0.7119%0.185SC*.THydrogen-bonded Turntrans-129.5-11.7-163-53.2-63.6000114.3D304D304-Y308 HydrophobicContact CB-CD2 4.09Å; D304-Y308 PolarHBondContact O-N 3.39Å; D304-Y308 WeakPolarHBondContact OD1-CE2 3.13Å
309N89.6Confident94.6Very high44 Ų4438.4 Ų38.424%0.23520%0.199CC..SBendtrans-91.6173.1-178-6785.3000113.6D268 D304 A305 I313D268-N309 PolarHBondContact OD1-ND2 3.43Å; D304-N309 PolarHBondContact O-OD1 2.89Å; D304-N309 VanDerWaalsContact O-OD1 3.07Å; A305-N309 WeakPolarHBondContact CA-OD1 3.41Å; N309-I313 HydrophobicContact CB-CB 3.76Å; N309-I313 HydrophobicContact CB-CD1 3.98Å; N309-I313 HydrophobicContact CB-CG1 4.47Å; N309-I313 HydrophobicContact CB-CG2 3.56Å
310A91.3Very high94.7Very high58 Ų5836.9 Ų36.948%0.47919%0.193SC..  trans-60153.1176.600000112.3N312 I313 S314A310-N312 PolarHBondContact O-N 2.97Å; A310-I313 WeakPolarHBondContact O-CA 3.25Å; A310-I313 WeakPolarHBondContact O-CB 3.32Å; A310-I313 PolarHBondContact O-N 3.4Å; A310-S314 PolarHBondContact O-N 3.09Å; A310-S314 PolarHBondContact O-OG 3.47Å
311I93.9Very high95Very high70 Ų7033.9 Ų33.936%0.35918%0.177SC..Hα-helixtrans-49.9-36.7-175.5-162.2170.8000113.7M315 F354 I362I311-M315 WeakPolarHBondContact O-CG 3.48Å; I311-M315 PolarHBondContact O-N 2.96Å; I311-F354 HydrophobicContact CD1-CE1 4.24Å; I311-F354 HydrophobicContact CG1-CD1 4.16Å; I311-F354 HydrophobicContact CG1-CE1 3.39Å; I311-F354 HydrophobicContact CG1-CZ 3.74Å; I311-I362 HydrophobicContact CD1-CB 4.47Å; I311-I362 HydrophobicContact CD1-CG1 4.14Å; I311-I362 HydrophobicContact CD1-CG2 3.91Å; I311-I362 HydrophobicContact CG1-CG2 4.12Å
312N92Very high95.2Very high94 Ų9433.2 Ų33.250%0.50317%0.174SC..Hα-helixtrans-70.8-35.8179.2-69.4-21.9000112.8A310 M315 V316A310-N312 PolarHBondContact O-N 2.97Å; N312-M315 PolarHBondContact O-N 2.99Å; N312-V316 WeakPolarHBondContact O-CG2 3.33Å; N312-V316 PolarHBondContact O-N 2.96Å
313I94.7Very high95.3Very high9 Ų936 Ų365%0.04619%0.193CC..Hα-helixtrans-70.9-44.6176.1-65.2170.7000109.4D268 L271 P272 I275 A305 N309 A310 M315 V316 A317D268-I313 HydrophobicContact CB-CD1 3.87Å; D268-I313 WeakPolarHBondContact OD1-CD1 3.31Å; L271-I313 HydrophobicContact CD2-CG2 3.63Å; L271-I313 HydrophobicContact CG-CG2 4.11Å; P272-I313 HydrophobicContact CG-CG1 4.18Å; I275-I313 HydrophobicContact CD1-CG2 4.37Å; A305-I313 HydrophobicContact CB-CG2 3.89Å; N309-I313 HydrophobicContact CB-CB 3.76Å; N309-I313 HydrophobicContact CB-CD1 3.98Å; N309-I313 HydrophobicContact CB-CG1 4.47Å; N309-I313 HydrophobicContact CB-CG2 3.56Å; A310-I313 WeakPolarHBondContact O-CA 3.25Å; A310-I313 WeakPolarHBondContact O-CB 3.32Å; A310-I313 PolarHBondContact O-N 3.4Å; I313-M315 PolarHBondContact O-N 3.28Å; I313-V316 PolarHBondContact O-N 3.07Å; I313-V316 VanDerWaalsContact O-N 3.11Å; I313-A317 PolarHBondContact O-N 3.35Å
314S97.2Very high95.4Very high4 Ų435.2 Ų35.23%0.02819%0.188CC..Hα-helixtrans-59.2-37174.7-50.60000111.9A305 A310 A317 F318A305-S314 VanDerWaalsContact O-CA 3.23Å; A305-S314 WeakPolarHBondContact O-CA 3.47Å; A305-S314 WeakPolarHBondContact O-CB 3.31Å; A305-S314 PolarHBondContact O-N 2.96Å; A305-S314 PolarHBondContact O-OG 3.4Å; A310-S314 PolarHBondContact O-N 3.09Å; A310-S314 PolarHBondContact O-OG 3.47Å; S314-A317 WeakPolarHBondContact O-CB 3.35Å; S314-A317 PolarHBondContact O-N 3.44Å; S314-F318 WeakPolarHBondContact O-CD2 3.33Å; S314-F318 WeakPolarHBondContact O-CG 3.46Å; S314-F318 PolarHBondContact O-N 3.04Å
315M97.5Very high95.6Very high0 Ų031.7 Ų31.70%017%0.169CC..Hα-helixtrans-62.1-44.1173.8-81.1-53.2-46.700113.1I311 N312 I313 A317 F318 E319 F354 I362 R365 A366I311-M315 WeakPolarHBondContact O-CG 3.48Å; I311-M315 PolarHBondContact O-N 2.96Å; N312-M315 PolarHBondContact O-N 2.99Å; I313-M315 PolarHBondContact O-N 3.28Å; M315-A317 VanDerWaalsContact C-N 3.27Å; M315-A317 PolarHBondContact O-N 3.41Å; M315-F318 PolarHBondContact O-N 3.49Å; M315-F318 HydrophobicContact SD-CD2 4.03Å; M315-E319 WeakPolarHBondContact O-CG 3.41Å; M315-E319 PolarHBondContact O-N 3.01Å; M315-F354 HydrophobicContact CG-CD1 4.15Å; M315-F354 HydrophobicContact CG-CE1 4.05Å; M315-F354 HydrophobicContact SD-CD1 3.5Å; M315-F354 WeakPolarHBondContact SD-CD1 3.43Å; M315-F354 HydrophobicContact SD-CE1 3.94Å; M315-I362 HydrophobicContact CG-CD1 3.96Å; M315-I362 HydrophobicContact CG-CG2 3.97Å; M315-I362 HydrophobicContact SD-CG2 3.85Å; M315-R365 HydrophobicContact CE-CB 3.44Å; M315-R365 VanDerWaalsContact CE-CB 3.44Å; M315-A366 HydrophobicContact CE-CB 4.42Å; M315-A366 HydrophobicContact SD-CB 4.22Å
316V96.8Very high95.7Very high26 Ų2634.1 Ų34.116%0.15818%0.184CC..Hα-helixtrans-66.1-33.4177.5175.80000111.4P272 I275 N312 I313 E319 S320P272-V316 HydrophobicContact CB-CG1 4.35Å; P272-V316 HydrophobicContact CB-CG2 4.27Å; I275-V316 HydrophobicContact CB-CG1 4.14Å; I275-V316 HydrophobicContact CG2-CG1 3.82Å; N312-V316 WeakPolarHBondContact O-CG2 3.33Å; N312-V316 PolarHBondContact O-N 2.96Å; I313-V316 PolarHBondContact O-N 3.07Å; I313-V316 VanDerWaalsContact O-N 3.11Å; V316-E319 PolarHBondContact O-N 3.47Å; V316-S320 WeakPolarHBondContact O-CB 3.48Å; V316-S320 PolarHBondContact O-N 2.86Å; V316-S320 PolarHBondContact O-OG 3.32Å
317A98.3Very high95.7Very high0 Ų035.3 Ų35.30%019%0.191CC..Hα-helixtrans-64.5-46170.800000112I275 L302 A305 V306 I313 S314 M315 E319 S320 I321I275-A317 HydrophobicContact CD1-CB 4.48Å; L302-A317 HydrophobicContact CD1-CB 3.67Å; A305-A317 HydrophobicContact CB-CB 3.86Å; V306-A317 HydrophobicContact CG2-CB 3.59Å; I313-A317 PolarHBondContact O-N 3.35Å; S314-A317 WeakPolarHBondContact O-CB 3.35Å; S314-A317 PolarHBondContact O-N 3.44Å; M315-A317 VanDerWaalsContact C-N 3.27Å; M315-A317 PolarHBondContact O-N 3.41Å; A317-E319 VanDerWaalsContact C-N 3.35Å; A317-E319 PolarHBondContact O-N 2.88Å; A317-S320 PolarHBondContact O-N 2.69Å; A317-I321 VanDerWaalsContact O-CG1 3.3Å; A317-I321 WeakPolarHBondContact O-CG1 3.44Å; A317-I321 PolarHBondContact O-N 3.5Å
318F98.6Very high95.9Very high2 Ų235.5 Ų35.51%0.00919%0.194CC..Hα-helixtrans-60.7-42.2174.5-67.7-47.1000112.4V306 S314 M315 S320 I321 S322 V347 K350 L351 F354 C369V306-F318 HydrophobicContact CG1-CE1 3.68Å; V306-F318 HydrophobicContact CG1-CZ 3.78Å; V306-F318 HydrophobicContact CG2-CD1 4.32Å; V306-F318 HydrophobicContact CG2-CE1 4.09Å; S314-F318 WeakPolarHBondContact O-CD2 3.33Å; S314-F318 WeakPolarHBondContact O-CG 3.46Å; S314-F318 PolarHBondContact O-N 3.04Å; M315-F318 PolarHBondContact O-N 3.49Å; M315-F318 HydrophobicContact SD-CD2 4.03Å; F318-S320 VanDerWaalsContact C-N 3.3Å; F318-S320 PolarHBondContact O-N 3.22Å; F318-I321 PolarHBondContact O-N 3.28Å; F318-S322 VanDerWaalsContact O-CB 3.23Å; F318-S322 WeakPolarHBondContact O-CB 3.27Å; F318-S322 PolarHBondContact O-N 3.42Å; F318-S322 PolarHBondContact O-OG 3.45Å; F318-V347 HydrophobicContact CD1-CG1 3.98Å; F318-V347 HydrophobicContact CE1-CG1 3.84Å; F318-V347 WeakPolarHBondContact CE1-O 3.22Å; F318-K350 HydrophobicContact CE1-CB 4.4Å; F318-K350 HydrophobicContact CZ-CB 3.79Å; F318-L351 HydrophobicContact CB-CD1 4.21Å; F318-L351 HydrophobicContact CD1-CB 4.1Å; F318-L351 HydrophobicContact CD1-CD1 4.23Å; F318-L351 HydrophobicContact CD2-CD1 4.01Å; F318-L351 HydrophobicContact CE1-CB 3.89Å; F318-L351 HydrophobicContact CE2-CD1 4.46Å; F318-L351 HydrophobicContact CG-CD1 3.91Å; F318-L351 HydrophobicContact CZ-CB 4.2Å; F318-F354 HydrophobicContact CD2-CD1 4.34Å; F318-F354 HydrophobicContact CD2-CE1 4.38Å; F318-F354 AromaticContact CE2-CD1 3.89Å; F318-F354 HydrophobicContact CE2-CD1 3.89Å; F318-F354 HydrophobicContact CE2-CD2 4.21Å; F318-F354 AromaticContact CE2-CE1 3.82Å; F318-F354 HydrophobicContact CE2-CE1 3.82Å; F318-F354 HydrophobicContact CE2-CE2 4.17Å; F318-F354 HydrophobicContact CE2-CG 4.07Å; F318-F354 AromaticContact CE2-CZ 3.97Å; F318-F354 HydrophobicContact CE2-CZ 3.97Å; F318-C369 HydrophobicContact CB-CB 4.47Å
319E98.3Very high96.2Very high60 Ų6030.8 Ų30.828%0.2818%0.184SC..Hα-helixtrans-59.6-44176.7-74.5166174.200110.6M315 V316 A317 S322 C323 R365 C369M315-E319 WeakPolarHBondContact O-CG 3.41Å; M315-E319 PolarHBondContact O-N 3.01Å; V316-E319 PolarHBondContact O-N 3.47Å; A317-E319 VanDerWaalsContact C-N 3.35Å; A317-E319 PolarHBondContact O-N 2.88Å; E319-S322 PolarHBondContact O-N 3.43Å; E319-S322 PolarHBondContact O-OG 2.91Å; E319-C323 WeakPolarHBondContact O-CB 3.43Å; E319-C323 PolarHBondContact O-N 3.49Å; E319-C323 PolarHBondContact O-SG 3.04Å; E319-R365 IonicContact OE1-CZ 3.59Å; E319-R365 IonicContact OE1-NE 3.23Å; E319-R365 PolarHBondContact OE1-NE 2.83Å; E319-R365 IonicContact OE1-NH2 2.64Å; E319-R365 PolarHBondContact OE1-NH2 3Å; E319-R365 IonicContact OE2-NH2 3.19Å; E319-R365 PolarHBondContact OE2-NH2 3.33Å; E319-C369 WeakPolarHBondContact CG-SG 3.18Å
320S98.2Very high96.6Very high10 Ų1028.7 Ų28.77%0.0717%0.173CC..Hα-helixtrans-65.3-46.8177.3-60.60000112.4I275 V316 A317 F318 S322 C323 I324I275-S320 VanDerWaalsContact CG2-OG 3.23Å; I275-S320 WeakPolarHBondContact CG2-OG 3.42Å; V316-S320 WeakPolarHBondContact O-CB 3.48Å; V316-S320 PolarHBondContact O-N 2.86Å; V316-S320 PolarHBondContact O-OG 3.32Å; A317-S320 PolarHBondContact O-N 2.69Å; F318-S320 VanDerWaalsContact C-N 3.3Å; F318-S320 PolarHBondContact O-N 3.22Å; S320-S322 VanDerWaalsContact C-N 3.33Å; S320-S322 PolarHBondContact O-N 2.82Å; S320-C323 PolarHBondContact O-N 3.23Å; S320-I324 WeakPolarHBondContact O-CD1 3.09Å; S320-I324 VanDerWaalsContact O-CG1 3.27Å; S320-I324 WeakPolarHBondContact O-CG1 3.31Å; S320-I324 PolarHBondContact O-N 3.14Å; S320-I324 VanDerWaalsContact O-N 3.13Å
321I98.7Very high96.9Very high4 Ų426 Ų262%0.02115%0.151CC..Hα-helixtrans-61.3-43176.6-67.9170.3000110.8L302 V306 A317 F318 I324 A325 L334 F338 F344 V347L302-I321 HydrophobicContact CD1-CG1 4.46Å; L302-I321 HydrophobicContact CD2-CD1 4.29Å; L302-I321 HydrophobicContact CD2-CG1 3.73Å; L302-I321 HydrophobicContact CG-CD1 4.18Å; L302-I321 HydrophobicContact CG-CG1 4.1Å; V306-I321 HydrophobicContact CG2-CD1 4.11Å; A317-I321 VanDerWaalsContact O-CG1 3.3Å; A317-I321 WeakPolarHBondContact O-CG1 3.44Å; A317-I321 PolarHBondContact O-N 3.5Å; F318-I321 PolarHBondContact O-N 3.28Å; I321-I324 PolarHBondContact O-N 3.46Å; I321-A325 PolarHBondContact O-N 3.15Å; I321-A325 VanDerWaalsContact O-N 3.11Å; I321-L334 HydrophobicContact CG2-CD1 4.2Å; I321-L334 HydrophobicContact CG2-CD2 4.02Å; I321-L334 WeakPolarHBondContact O-CD1 3.38Å; I321-F338 HydrophobicContact CG2-CE1 4.2Å; I321-F338 HydrophobicContact CG2-CZ 3.75Å; I321-F344 HydrophobicContact CD1-CD2 4.46Å; I321-F344 HydrophobicContact CD1-CE2 4.36Å; I321-F344 HydrophobicContact CG1-CE2 4.42Å; I321-V347 HydrophobicContact CD1-CG1 3.75Å; I321-V347 HydrophobicContact CD1-CG2 4.11Å; I321-V347 HydrophobicContact CG2-CG1 4.39Å
322S98.3Very high97Very high3 Ų327.3 Ų27.32%0.02116%0.157CC..Hα-helixtrans-67.9-36.6-179.576.10000112.6F318 E319 S320 A325 C369F318-S322 VanDerWaalsContact O-CB 3.23Å; F318-S322 WeakPolarHBondContact O-CB 3.27Å; F318-S322 PolarHBondContact O-N 3.42Å; F318-S322 PolarHBondContact O-OG 3.45Å; E319-S322 PolarHBondContact O-N 3.43Å; E319-S322 PolarHBondContact O-OG 2.91Å; S320-S322 VanDerWaalsContact C-N 3.33Å; S320-S322 PolarHBondContact O-N 2.82Å; S322-A325 WeakPolarHBondContact O-CB 3.23Å; S322-A325 PolarHBondContact O-N 3.37Å; S322-C369 VanDerWaalsContact CB-O 3.27Å; S322-C369 WeakPolarHBondContact CB-O 3.24Å
323C97.6Very high97.2Very high59 Ų5923.3 Ų23.340%0.39914%0.136SC..Hα-helixtrans-60.1-47.4171.8-70.50000110.7N283 E319 S320 A325 T326N283-C323 PolarHBondContact OD1-O 3.37Å; E319-C323 WeakPolarHBondContact O-CB 3.43Å; E319-C323 PolarHBondContact O-N 3.49Å; E319-C323 PolarHBondContact O-SG 3.04Å; S320-C323 PolarHBondContact O-N 3.23Å; C323-A325 PolarHBondContact O-N 3.39Å; C323-T326 VanDerWaalsContact O-CB 3.3Å; C323-T326 WeakPolarHBondContact O-CB 3.31Å; C323-T326 WeakPolarHBondContact O-CG2 3.39Å; C323-T326 PolarHBondContact O-N 3.34Å; C323-T326 PolarHBondContact O-OG1 3.3Å
324I98.3Very high97.4Very high0 Ų022.9 Ų22.90%013%0.134CC..Hα-helixtrans-58-38.7178.6-64.2162.1000111.1A282 N283 P286 L290 S320 I321 T326 T327 G330 L334A282-I324 HydrophobicContact CB-CD1 3.64Å; A282-I324 HydrophobicContact CB-CG1 4.21Å; N283-I324 HydrophobicContact CB-CG1 4.17Å; N283-I324 WeakPolarHBondContact OD1-CA 3.47Å; P286-I324 HydrophobicContact CB-CG2 4.23Å; P286-I324 HydrophobicContact CG-CG2 4.28Å; L290-I324 HydrophobicContact CD1-CD1 3.68Å; S320-I324 WeakPolarHBondContact O-CD1 3.09Å; S320-I324 VanDerWaalsContact O-CG1 3.27Å; S320-I324 WeakPolarHBondContact O-CG1 3.31Å; S320-I324 PolarHBondContact O-N 3.14Å; S320-I324 VanDerWaalsContact O-N 3.13Å; I321-I324 PolarHBondContact O-N 3.46Å; I324-T326 PolarHBondContact O-N 2.83Å; I324-T326 VanDerWaalsContact O-N 3.11Å; I324-T327 PolarHBondContact O-N 3.12Å; I324-T327 PolarHBondContact O-OG1 3.19Å; I324-G330 WeakPolarHBondContact O-CA 3.3Å; I324-L334 HydrophobicContact CB-CD1 4.16Å; I324-L334 HydrophobicContact CG2-CD1 3.91Å; I324-L334 HydrophobicContact CG2-CG 4.1Å
325A97.8Very high97.3Very high0 Ų025.2 Ų25.20%015%0.146CC..THydrogen-bonded Turntrans-66.2-8.2178.300000114.9I321 S322 C323 T327 R331 L334 L373 W395I321-A325 PolarHBondContact O-N 3.15Å; I321-A325 VanDerWaalsContact O-N 3.11Å; S322-A325 WeakPolarHBondContact O-CB 3.23Å; S322-A325 PolarHBondContact O-N 3.37Å; C323-A325 PolarHBondContact O-N 3.39Å; A325-T327 VanDerWaalsContact C-N 3.25Å; A325-T327 PolarHBondContact O-N 3.44Å; A325-R331 VanDerWaalsContact O-CD 3.31Å; A325-R331 WeakPolarHBondContact O-CD 3.35Å; A325-R331 WeakPolarHBondContact O-CG 3.39Å; A325-R331 PolarHBondContact O-NH1 3.29Å; A325-L334 HydrophobicContact CB-CD1 3.72Å; A325-L373 HydrophobicContact CB-CD1 3.84Å; A325-W395 HydrophobicContact CB-CH2 4.31Å; A325-W395 HydrophobicContact CB-CZ3 4.07Å
326T96.6Very high97.2Very high51 Ų5131.7 Ų31.731%0.31317%0.174SC..THydrogen-bonded Turntrans-76.6-10.4176.367.50000113.5C323 I324 F372 P377C323-T326 VanDerWaalsContact O-CB 3.3Å; C323-T326 WeakPolarHBondContact O-CB 3.31Å; C323-T326 WeakPolarHBondContact O-CG2 3.39Å; C323-T326 PolarHBondContact O-N 3.34Å; C323-T326 PolarHBondContact O-OG1 3.3Å; I324-T326 PolarHBondContact O-N 2.83Å; I324-T326 VanDerWaalsContact O-N 3.11Å; T326-F372 HydrophobicContact CG2-CB 4.03Å; T326-F372 HydrophobicContact CG2-CD1 3.81Å; T326-F372 HydrophobicContact CG2-CG 4.3Å; T326-P377 WeakPolarHBondContact O-CB 3.38Å
327T95.6Very high97.2Very high29 Ų2931.2 Ų31.218%0.17817%0.171CC..SBendtrans-110.8147.4178.7670000111.6I324 A325 T329 G330 R331I324-T327 PolarHBondContact O-N 3.12Å; I324-T327 PolarHBondContact O-OG1 3.19Å; A325-T327 VanDerWaalsContact C-N 3.25Å; A325-T327 PolarHBondContact O-N 3.44Å; T327-T329 PolarHBondContact O-N 2.93Å; T327-G330 PolarHBondContact O-N 3.4Å; T327-G330 WeakPolarHBondContact OG1-CA 3.47Å; T327-G330 PolarHBondContact OG1-N 3.45Å; T327-G330 VanDerWaalsContact OG1-N 3.08Å; T327-R331 WeakPolarHBondContact O-CG 3.11Å; T327-R331 PolarHBondContact O-N 3.14Å
328P95.8Very high97.1Very high42 Ų4231.4 Ų31.427%0.27317%0.172SC..Hα-helixtrans-58.2-43.1178.4-24.833.5000113.6R331 I332 P377 E379 I380P328-R331 PolarHBondContact O-N 2.74Å; P328-I332 WeakPolarHBondContact O-CG1 3.44Å; P328-I332 PolarHBondContact O-N 2.6Å; P328-P377 HydrophobicContact CG-CB 4.23Å; P328-E379 HydrophobicContact CG-CB 4.1Å; P328-I380 HydrophobicContact CB-CG1 4.19Å; P328-I380 HydrophobicContact CG-CG1 3.8Å
329T95.5Very high96.7Very high82 Ų8232.8 Ų32.850%0.50318%0.183SC..Hα-helixtrans-67.2-37.5178.250.90000111.9T327 R331 I332 T333T327-T329 PolarHBondContact O-N 2.93Å; T329-R331 VanDerWaalsContact C-N 3.33Å; T329-R331 PolarHBondContact O-N 2.62Å; T329-I332 PolarHBondContact O-N 3.22Å; T329-T333 PolarHBondContact O-N 3.15Å; T329-T333 VanDerWaalsContact O-N 3.11Å; T329-T333 PolarHBondContact O-OG1 3.41Å
330G97.6Very high96.2Very high0 Ų036.8 Ų36.80%020%0.2CC..Hα-helixtrans-62.2-41.617500000111.8P286 I324 T327 T333 L334P286-G330 VanDerWaalsContact CG-CA 3.46Å; I324-G330 WeakPolarHBondContact O-CA 3.3Å; T327-G330 PolarHBondContact O-N 3.4Å; T327-G330 WeakPolarHBondContact OG1-CA 3.47Å; T327-G330 PolarHBondContact OG1-N 3.45Å; T327-G330 VanDerWaalsContact OG1-N 3.08Å; G330-T333 PolarHBondContact O-N 3.24Å; G330-L334 WeakPolarHBondContact O-CB 3.37Å; G330-L334 VanDerWaalsContact O-CG 3.26Å; G330-L334 WeakPolarHBondContact O-CG 3.18Å; G330-L334 PolarHBondContact O-N 3.02Å
331R97.3Very high95.6Very high2 Ų239.7 Ų39.71%0.00823%0.232CC..Hα-helixtrans-63.3-44.6177.1-65175.378.879.76.5113A325 T327 P328 T329 T333 L334 D335 L373 P377 D388 L391 W395A325-R331 VanDerWaalsContact O-CD 3.31Å; A325-R331 WeakPolarHBondContact O-CD 3.35Å; A325-R331 WeakPolarHBondContact O-CG 3.39Å; A325-R331 PolarHBondContact O-NH1 3.29Å; T327-R331 WeakPolarHBondContact O-CG 3.11Å; T327-R331 PolarHBondContact O-N 3.14Å; P328-R331 PolarHBondContact O-N 2.74Å; T329-R331 VanDerWaalsContact C-N 3.33Å; T329-R331 PolarHBondContact O-N 2.62Å; R331-T333 VanDerWaalsContact C-N 3.3Å; R331-T333 PolarHBondContact O-N 3.04Å; R331-L334 PolarHBondContact O-N 2.7Å; R331-D335 WeakPolarHBondContact O-CB 3.27Å; R331-D335 PolarHBondContact O-N 3.34Å; R331-L373 PolarHBondContact NH1-O 3.46Å; R331-P377 VanDerWaalsContact CD-CG 3.46Å; R331-D388 WeakPolarHBondContact CD-OD1 3.41Å; R331-D388 IonicContact CZ-OD1 3.16Å; R331-D388 IonicContact NE-OD1 3.67Å; R331-D388 PolarHBondContact NE-OD1 2.94Å; R331-D388 IonicContact NH2-OD1 2.61Å; R331-L391 HydrophobicContact CB-CD1 4.45Å; R331-L391 HydrophobicContact CB-CD2 4.35Å; R331-W395 HydrophobicContact CB-CH2 3.94Å; R331-W395 HydrophobicContact CB-CZ2 4.46Å; R331-W395 HydrophobicContact CG-CH2 3.91Å; R331-W395 HydrophobicContact CG-CZ3 4.35Å
332I95.5Very high95.2Very high96 Ų9640.7 Ų40.749%0.49224%0.243SC..Hα-helixtrans-60.7-41.9177-66.3165.6000111.1P328 T329P328-I332 WeakPolarHBondContact O-CG1 3.44Å; P328-I332 PolarHBondContact O-N 2.6Å; T329-I332 PolarHBondContact O-N 3.22Å
333T97.8Very high95Very high10 Ų1042.1 Ų42.16%0.06126%0.255CS..Hα-helixtrans-67.2-47.3177.6-64.70000111.3P286 L290 T329 G330 R331 D335 K336 L337P286-T333 HydrophobicContact CB-CG2 4.19Å; L290-T333 HydrophobicContact CB-CG2 4.06Å; T329-T333 PolarHBondContact O-N 3.15Å; T329-T333 VanDerWaalsContact O-N 3.11Å; T329-T333 PolarHBondContact O-OG1 3.41Å; G330-T333 PolarHBondContact O-N 3.24Å; R331-T333 VanDerWaalsContact C-N 3.3Å; R331-T333 PolarHBondContact O-N 3.04Å; T333-D335 PolarHBondContact O-N 2.82Å; T333-K336 PolarHBondContact O-N 3.03Å; T333-L337 HydrophobicContact CG2-CD1 4.2Å; T333-L337 WeakPolarHBondContact O-CG 3.49Å; T333-L337 PolarHBondContact O-N 3.38Å
334L98.3Very high94.9Very high0 Ų039.3 Ų39.30%024%0.236CC..Hα-helixtrans-64.5-37.2-179.7-72.6174.9000112.6I321 I324 A325 G330 R331 K336 L337 F338 F344 W395I321-L334 HydrophobicContact CG2-CD1 4.2Å; I321-L334 HydrophobicContact CG2-CD2 4.02Å; I321-L334 WeakPolarHBondContact O-CD1 3.38Å; I324-L334 HydrophobicContact CB-CD1 4.16Å; I324-L334 HydrophobicContact CG2-CD1 3.91Å; I324-L334 HydrophobicContact CG2-CG 4.1Å; A325-L334 HydrophobicContact CB-CD1 3.72Å; G330-L334 WeakPolarHBondContact O-CB 3.37Å; G330-L334 VanDerWaalsContact O-CG 3.26Å; G330-L334 WeakPolarHBondContact O-CG 3.18Å; G330-L334 PolarHBondContact O-N 3.02Å; R331-L334 PolarHBondContact O-N 2.7Å; L334-K336 VanDerWaalsContact C-N 3.27Å; L334-K336 PolarHBondContact O-N 3.22Å; L334-L337 CarbonylContact O-C 3.32Å; L334-L337 WeakPolarHBondContact O-CA 3.27Å; L334-L337 WeakPolarHBondContact O-CB 3.22Å; L334-L337 PolarHBondContact O-N 3.46Å; L334-F338 HydrophobicContact CB-CD2 4.19Å; L334-F338 HydrophobicContact CB-CE2 3.76Å; L334-F338 HydrophobicContact CB-CZ 4.13Å; L334-F338 HydrophobicContact CD1-CE2 4.46Å; L334-F338 HydrophobicContact CD1-CZ 4.41Å; L334-F338 HydrophobicContact CD2-CZ 4.21Å; L334-F338 HydrophobicContact CG-CZ 4.49Å; L334-F338 WeakPolarHBondContact O-CD2 3.28Å; L334-F338 WeakPolarHBondContact O-CG 3.38Å; L334-F338 PolarHBondContact O-N 3.36Å; L334-F344 HydrophobicContact CD2-CD2 3.96Å; L334-F344 HydrophobicContact CD2-CE2 3.92Å; L334-W395 HydrophobicContact CB-CH2 4.1Å; L334-W395 HydrophobicContact CB-CZ2 4Å; L334-W395 HydrophobicContact CD1-CH2 4.44Å
335D95.8Very high94.7Very high53 Ų5342.1 Ų42.128%0.28325%0.251SS..Hα-helixtrans-59.6-39.3179.2-172.764.6000112.4R331 T333 L337 A339 L391 W395R331-D335 WeakPolarHBondContact O-CB 3.27Å; R331-D335 PolarHBondContact O-N 3.34Å; T333-D335 PolarHBondContact O-N 2.82Å; D335-L337 VanDerWaalsContact C-N 3.27Å; D335-L337 PolarHBondContact O-N 3.11Å; D335-A339 PolarHBondContact O-N 3.06Å; D335-L391 HydrophobicContact CB-CD1 3.59Å; D335-L391 HydrophobicContact CB-CG 4.04Å; D335-W395 HydrophobicContact CB-CZ2 4.12Å; D335-W395 PolarHBondContact OD1-NE1 2.84Å
336K95.1Very high94.5Very high137 Ų13743.6 Ų43.660%0.59626%0.262SS*.Hα-helixtrans-65-32.5173.5-63.8173.6-174.5174.40112.2T333 L334T333-K336 PolarHBondContact O-N 3.03Å; L334-K336 VanDerWaalsContact C-N 3.27Å; L334-K336 PolarHBondContact O-N 3.22Å
337L97.1Very high94.5Very high16 Ų1641.3 Ų41.38%0.08425%0.247CC..Hα-helixtrans-83.1-31.7-178.4-62174.9000112.8L290 K299 T333 L334 D335 A339 G342 A343 F344L290-L337 HydrophobicContact CB-CD1 3.85Å; K299-L337 HydrophobicContact CD-CD2 3.72Å; T333-L337 HydrophobicContact CG2-CD1 4.2Å; T333-L337 WeakPolarHBondContact O-CG 3.49Å; T333-L337 PolarHBondContact O-N 3.38Å; L334-L337 CarbonylContact O-C 3.32Å; L334-L337 WeakPolarHBondContact O-CA 3.27Å; L334-L337 WeakPolarHBondContact O-CB 3.22Å; L334-L337 PolarHBondContact O-N 3.46Å; D335-L337 VanDerWaalsContact C-N 3.27Å; D335-L337 PolarHBondContact O-N 3.11Å; L337-A339 VanDerWaalsContact C-N 3.28Å; L337-G342 CarbonylContact O-C 3.45Å; L337-G342 WeakPolarHBondContact O-CA 3.23Å; L337-A343 HydrophobicContact CD2-CB 4.45Å; L337-F344 HydrophobicContact CB-CB 4.06Å; L337-F344 HydrophobicContact CB-CD2 3.7Å; L337-F344 HydrophobicContact CB-CE2 4.4Å; L337-F344 HydrophobicContact CB-CG 4.04Å; L337-F344 HydrophobicContact CD1-CD2 3.86Å; L337-F344 HydrophobicContact CD1-CE2 3.68Å; L337-F344 HydrophobicContact CD1-CZ 4.38Å; L337-F344 HydrophobicContact CG-CD2 4.41Å; L337-F344 CarbonylContact O-C 3.43Å; L337-F344 WeakPolarHBondContact O-CA 3.4Å; L337-F344 PolarHBondContact O-N 3.43Å
338F95.3Very high94.5Very high3 Ų340 Ų401%0.01324%0.239CC..Hα-helixtrans-77.2-12.4174-64.5-32.8000113.3I321 L334 F344 V347 L348 L373 W395I321-F338 HydrophobicContact CG2-CE1 4.2Å; I321-F338 HydrophobicContact CG2-CZ 3.75Å; L334-F338 HydrophobicContact CB-CD2 4.19Å; L334-F338 HydrophobicContact CB-CE2 3.76Å; L334-F338 HydrophobicContact CB-CZ 4.13Å; L334-F338 HydrophobicContact CD1-CE2 4.46Å; L334-F338 HydrophobicContact CD1-CZ 4.41Å; L334-F338 HydrophobicContact CD2-CZ 4.21Å; L334-F338 HydrophobicContact CG-CZ 4.49Å; L334-F338 WeakPolarHBondContact O-CD2 3.28Å; L334-F338 WeakPolarHBondContact O-CG 3.38Å; L334-F338 PolarHBondContact O-N 3.36Å; F338-F344 HydrophobicContact CD1-CB 3.54Å; F338-F344 WeakPolarHBondContact CD1-O 3.25Å; F338-F344 HydrophobicContact CE1-CB 3.8Å; F338-F344 HydrophobicContact CE1-CD2 4.16Å; F338-F344 HydrophobicContact CE1-CG 4.44Å; F338-V347 HydrophobicContact CD1-CB 4.33Å; F338-V347 HydrophobicContact CE1-CB 3.91Å; F338-V347 HydrophobicContact CE1-CG1 3.84Å; F338-L348 HydrophobicContact CB-CD1 4.09Å; F338-L348 HydrophobicContact CD1-CD1 4.39Å; F338-L348 HydrophobicContact CD1-CG 4.08Å; F338-L348 HydrophobicContact CD2-CD1 3.88Å; F338-L348 HydrophobicContact CD2-CD2 4.31Å; F338-L348 HydrophobicContact CD2-CG 4.19Å; F338-L348 HydrophobicContact CE1-CD2 4.3Å; F338-L348 HydrophobicContact CE1-CG 4.24Å; F338-L348 HydrophobicContact CE2-CD1 4.38Å; F338-L348 HydrophobicContact CE2-CD2 3.98Å; F338-L348 HydrophobicContact CE2-CG 4.32Å; F338-L348 HydrophobicContact CG-CD1 3.89Å; F338-L348 HydrophobicContact CG-CG 4.08Å; F338-L348 HydrophobicContact CZ-CD2 3.98Å; F338-L348 HydrophobicContact CZ-CG 4.35Å; F338-L373 HydrophobicContact CE2-CD1 4.1Å; F338-L373 HydrophobicContact CZ-CD1 4.24Å; F338-W395 HydrophobicContact CD2-CD2 4.03Å; F338-W395 AromaticContact CD2-CE2 3.55Å; F338-W395 HydrophobicContact CD2-CG 4.28Å; F338-W395 AromaticContact CD2-CZ2 3.81Å; F338-W395 HydrophobicContact CD2-CZ2 3.81Å; F338-W395 AromaticContact CD2-NE1 3.66Å; F338-W395 HydrophobicContact CE2-CD2 4.05Å; F338-W395 AromaticContact CE2-CE2 3.81Å; F338-W395 HydrophobicContact CE2-CE3 4.33Å; F338-W395 HydrophobicContact CE2-CH2 4.04Å; F338-W395 AromaticContact CE2-CZ2 3.78Å; F338-W395 HydrophobicContact CE2-CZ2 3.78Å; F338-W395 HydrophobicContact CE2-CZ3 4.34Å
339A90.3Very high94.5Very high31 Ų3139.3 Ų39.326%0.25623%0.233SC..SBendtrans-59.2148.7173.700000111D335 L337 G341 G342D335-A339 PolarHBondContact O-N 3.06Å; L337-A339 VanDerWaalsContact C-N 3.28Å; A339-G341 PolarHBondContact O-N 2.93Å; A339-G342 WeakPolarHBondContact O-CA 3.02Å; A339-G342 PolarHBondContact O-N 3.22Å
340K87.1Confident94.5Very high144 Ų14438.4 Ų38.463%0.62622%0.222SC*.THydrogen-bonded Turntrans-51.9127.9178.7-172.1174.4-178.4174.50111.4G342 D405K340-G342 PolarHBondContact O-N 2.89Å; K340-D405 IonicContact NZ-OD1 3.39Å; K340-D405 PolarHBondContact NZ-OD1 3.32Å
341G86.2Confident94.5Very high72 Ų7238.7 Ų38.774%0.74222%0.224SC*.THydrogen-bonded Turntrans75.90.9-174.100000115.3A339 D345A339-G341 PolarHBondContact O-N 2.93Å; G341-D345 PolarHBondContact N-OD2 3.41Å
342G90.9Very high94.4Very high25 Ų2540 Ų4026%0.25823%0.23SC..SBendtrans-74165.1168.800000111.6L337 A339 K340 F344 D345L337-G342 CarbonylContact O-C 3.45Å; L337-G342 WeakPolarHBondContact O-CA 3.23Å; A339-G342 WeakPolarHBondContact O-CA 3.02Å; A339-G342 PolarHBondContact O-N 3.22Å; K340-G342 PolarHBondContact O-N 2.89Å; G342-F344 PolarHBondContact O-N 3.25Å; G342-F344 VanDerWaalsContact O-N 3.12Å; G342-D345 WeakPolarHBondContact O-CB 3.37Å; G342-D345 PolarHBondContact O-N 3.03Å
343A93.8Very high94.4Very high33 Ų3338.9 Ų38.927%0.27323%0.227SC..THydrogen-bonded Turntrans-59.9-26.3-177.700000113K299 S303 L337K299-A343 HydrophobicContact CD-CB 3.76Å; K299-A343 HydrophobicContact CG-CB 3.77Å; S303-A343 PolarHBondContact OG-O 3.29Å; L337-A343 HydrophobicContact CD2-CB 4.45Å
344F96.3Very high94.4Very high0 Ų039.7 Ų39.70%023%0.23CC..THydrogen-bonded Turntrans-111.323.5-176.8-64.3-15.1000113.3L290 K299 L302 I321 L334 L337 F338 G342 S346 V347L290-F344 HydrophobicContact CD1-CE2 4.31Å; L290-F344 HydrophobicContact CD2-CZ 4.19Å; K299-F344 HydrophobicContact CG-CE1 4.34Å; K299-F344 HydrophobicContact CG-CZ 4.4Å; L302-F344 HydrophobicContact CB-CE1 4.33Å; L302-F344 HydrophobicContact CB-CZ 4.16Å; L302-F344 HydrophobicContact CD2-CE2 4.34Å; L302-F344 HydrophobicContact CD2-CZ 3.81Å; L302-F344 HydrophobicContact CG-CE1 4.45Å; L302-F344 HydrophobicContact CG-CZ 4.07Å; I321-F344 HydrophobicContact CD1-CD2 4.46Å; I321-F344 HydrophobicContact CD1-CE2 4.36Å; I321-F344 HydrophobicContact CG1-CE2 4.42Å; L334-F344 HydrophobicContact CD2-CD2 3.96Å; L334-F344 HydrophobicContact CD2-CE2 3.92Å; L337-F344 HydrophobicContact CB-CB 4.06Å; L337-F344 HydrophobicContact CB-CD2 3.7Å; L337-F344 HydrophobicContact CB-CE2 4.4Å; L337-F344 HydrophobicContact CB-CG 4.04Å; L337-F344 HydrophobicContact CD1-CD2 3.86Å; L337-F344 HydrophobicContact CD1-CE2 3.68Å; L337-F344 HydrophobicContact CD1-CZ 4.38Å; L337-F344 HydrophobicContact CG-CD2 4.41Å; L337-F344 CarbonylContact O-C 3.43Å; L337-F344 WeakPolarHBondContact O-CA 3.4Å; L337-F344 PolarHBondContact O-N 3.43Å; F338-F344 HydrophobicContact CD1-CB 3.54Å; F338-F344 WeakPolarHBondContact CD1-O 3.25Å; F338-F344 HydrophobicContact CE1-CB 3.8Å; F338-F344 HydrophobicContact CE1-CD2 4.16Å; F338-F344 HydrophobicContact CE1-CG 4.44Å; G342-F344 PolarHBondContact O-N 3.25Å; G342-F344 VanDerWaalsContact O-N 3.12Å; F344-S346 PolarHBondContact O-N 3.3Å; F344-S346 VanDerWaalsContact O-N 3.16Å; F344-V347 HydrophobicContact CB-CB 4.16Å; F344-V347 HydrophobicContact CB-CG2 3.5Å; F344-V347 HydrophobicContact CD1-CG2 4.06Å; F344-V347 HydrophobicContact CG-CG2 3.87Å; F344-V347 WeakPolarHBondContact O-CB 3.35Å; F344-V347 PolarHBondContact O-N 3.46Å
345D92.5Very high94.3Very high58 Ų5839.7 Ų39.731%0.3123%0.23SC..THydrogen-bonded Turntrans-54.5-35-179.1-168.711.3000112.9G341 G342G341-D345 PolarHBondContact N-OD2 3.41Å; G342-D345 WeakPolarHBondContact O-CB 3.37Å; G342-D345 PolarHBondContact O-N 3.03Å
346S93.2Very high94.3Very high32 Ų3238.5 Ų38.522%0.22423%0.226CC..THydrogen-bonded Turntrans-81.8-20.1179.967.70000114.4D307 F344 L348 N349 K350D307-S346 VanDerWaalsContact CG-OG 3.3Å; D307-S346 WeakPolarHBondContact OD1-CB 3.36Å; D307-S346 PolarHBondContact OD1-OG 3.26Å; D307-S346 PolarHBondContact OD2-OG 3.2Å; F344-S346 PolarHBondContact O-N 3.3Å; F344-S346 VanDerWaalsContact O-N 3.16Å; S346-L348 PolarHBondContact O-N 3.18Å; S346-N349 PolarHBondContact O-N 3.26Å; S346-K350 WeakPolarHBondContact O-CB 3.36Å; S346-K350 WeakPolarHBondContact O-CG 3.23Å; S346-K350 PolarHBondContact O-N 3.17Å
347V96.9Very high94.2Very high2 Ų238 Ų381%0.01223%0.229CC..Hα-helixtrans-61.4-51.3-162.9172.40000112V306 F318 I321 F338 F344 N349 K350 L351V306-V347 HydrophobicContact CB-CG2 4.4Å; V306-V347 HydrophobicContact CG1-CG2 4.07Å; V306-V347 HydrophobicContact CG2-CG2 4.23Å; F318-V347 HydrophobicContact CD1-CG1 3.98Å; F318-V347 HydrophobicContact CE1-CG1 3.84Å; F318-V347 WeakPolarHBondContact CE1-O 3.22Å; I321-V347 HydrophobicContact CD1-CG1 3.75Å; I321-V347 HydrophobicContact CD1-CG2 4.11Å; I321-V347 HydrophobicContact CG2-CG1 4.39Å; F338-V347 HydrophobicContact CD1-CB 4.33Å; F338-V347 HydrophobicContact CE1-CB 3.91Å; F338-V347 HydrophobicContact CE1-CG1 3.84Å; F344-V347 HydrophobicContact CB-CB 4.16Å; F344-V347 HydrophobicContact CB-CG2 3.5Å; F344-V347 HydrophobicContact CD1-CG2 4.06Å; F344-V347 HydrophobicContact CG-CG2 3.87Å; F344-V347 WeakPolarHBondContact O-CB 3.35Å; F344-V347 PolarHBondContact O-N 3.46Å; V347-N349 PolarHBondContact O-N 3.3Å; V347-K350 PolarHBondContact O-N 3.11Å; V347-L351 WeakPolarHBondContact O-CB 3.46Å; V347-L351 PolarHBondContact O-N 3Å
348L96.6Very high94Very high2 Ų238.3 Ų38.31%0.0123%0.233CC..Hα-helixtrans-64-41.9-177-65.7-179.8000112F338 S346 L351 F352 L373 W395 I398F338-L348 HydrophobicContact CB-CD1 4.09Å; F338-L348 HydrophobicContact CD1-CD1 4.39Å; F338-L348 HydrophobicContact CD1-CG 4.08Å; F338-L348 HydrophobicContact CD2-CD1 3.88Å; F338-L348 HydrophobicContact CD2-CD2 4.31Å; F338-L348 HydrophobicContact CD2-CG 4.19Å; F338-L348 HydrophobicContact CE1-CD2 4.3Å; F338-L348 HydrophobicContact CE1-CG 4.24Å; F338-L348 HydrophobicContact CE2-CD1 4.38Å; F338-L348 HydrophobicContact CE2-CD2 3.98Å; F338-L348 HydrophobicContact CE2-CG 4.32Å; F338-L348 HydrophobicContact CG-CD1 3.89Å; F338-L348 HydrophobicContact CG-CG 4.08Å; F338-L348 HydrophobicContact CZ-CD2 3.98Å; F338-L348 HydrophobicContact CZ-CG 4.35Å; S346-L348 PolarHBondContact O-N 3.18Å; L348-L351 PolarHBondContact O-N 3.11Å; L348-F352 PolarHBondContact O-N 2.74Å; L348-F352 VanDerWaalsContact O-N 3.09Å; L348-L373 HydrophobicContact CD2-CD1 4.33Å; L348-L373 HydrophobicContact CD2-CD2 3.43Å; L348-L373 VanDerWaalsContact CD2-CD2 3.43Å; L348-L373 HydrophobicContact CD2-CG 4.47Å; L348-W395 HydrophobicContact CD1-CB 3.88Å; L348-W395 HydrophobicContact CD1-CG 4.08Å; L348-I398 HydrophobicContact CB-CG2 4.09Å; L348-I398 HydrophobicContact CD1-CB 3.95Å; L348-I398 HydrophobicContact CD1-CD1 4.43Å; L348-I398 HydrophobicContact CD1-CG2 3.87Å
349N94.8Very high94Very high28 Ų2842.4 Ų42.415%0.1526%0.26CS..Hα-helixtrans-63.3-44.6175.8-80.2-72.5000111.2S346 V347 F352 V353 I398S346-N349 PolarHBondContact O-N 3.26Å; V347-N349 PolarHBondContact O-N 3.3Å; N349-F352 PolarHBondContact O-N 3.49Å; N349-V353 WeakPolarHBondContact O-CG2 3.38Å; N349-V353 PolarHBondContact O-N 3.27Å; N349-I398 VanDerWaalsContact CG-O 3.3Å; N349-I398 PolarHBondContact ND2-O 3.02Å; N349-I398 PolarHBondContact OD1-O 3.41Å
350K95.7Very high94.1Very high62 Ų6244.5 Ų44.527%0.2727%0.27SS..Hα-helixtrans-66.7-40.8178.4-76.4-173.4162-177.60112.3V306 D307 F318 S346 V347 F352 V353 F354V306-K350 HydrophobicContact CG1-CB 4.38Å; V306-K350 HydrophobicContact CG1-CD 3.85Å; V306-K350 PolarHBondContact O-NZ 3.13Å; D307-K350 PolarHBondContact O-NZ 3.29Å; D307-K350 WeakPolarHBondContact OD1-CE 3.09Å; D307-K350 IonicContact OD1-NZ 2.72Å; D307-K350 PolarHBondContact OD1-NZ 3.15Å; F318-K350 HydrophobicContact CE1-CB 4.4Å; F318-K350 HydrophobicContact CZ-CB 3.79Å; S346-K350 WeakPolarHBondContact O-CB 3.36Å; S346-K350 WeakPolarHBondContact O-CG 3.23Å; S346-K350 PolarHBondContact O-N 3.17Å; V347-K350 PolarHBondContact O-N 3.11Å; K350-F352 VanDerWaalsContact C-N 3.28Å; K350-F352 PolarHBondContact O-N 2.83Å; K350-V353 WeakPolarHBondContact O-CA 3.2Å; K350-V353 WeakPolarHBondContact O-CB 3.33Å; K350-V353 PolarHBondContact O-N 3.37Å; K350-V353 VanDerWaalsContact O-N 3.1Å; K350-F354 WeakPolarHBondContact O-CD2 3.26Å; K350-F354 PolarHBondContact O-N 2.96Å
351L97.4Very high94.4Very high6 Ų644.5 Ų44.53%0.03127%0.272CS..Hα-helixtrans-59-42.3174.9-177.955.8000111.1F318 V347 L348 V353 F354 I355 A366 C369 Y370 L373F318-L351 HydrophobicContact CB-CD1 4.21Å; F318-L351 HydrophobicContact CD1-CB 4.1Å; F318-L351 HydrophobicContact CD1-CD1 4.23Å; F318-L351 HydrophobicContact CD2-CD1 4.01Å; F318-L351 HydrophobicContact CE1-CB 3.89Å; F318-L351 HydrophobicContact CE2-CD1 4.46Å; F318-L351 HydrophobicContact CG-CD1 3.91Å; F318-L351 HydrophobicContact CZ-CB 4.2Å; V347-L351 WeakPolarHBondContact O-CB 3.46Å; V347-L351 PolarHBondContact O-N 3Å; L348-L351 PolarHBondContact O-N 3.11Å; L351-V353 PolarHBondContact O-N 3.45Å; L351-F354 WeakPolarHBondContact O-CB 3.38Å; L351-F354 PolarHBondContact O-N 3.48Å; L351-F354 VanDerWaalsContact O-N 3.16Å; L351-I355 WeakPolarHBondContact O-CG1 3.47Å; L351-I355 PolarHBondContact O-N 2.92Å; L351-A366 HydrophobicContact CD1-CB 3.91Å; L351-C369 HydrophobicContact CD1-CB 4.19Å; L351-C369 HydrophobicContact CD2-CB 4.43Å; L351-Y370 HydrophobicContact CD2-CD2 3.68Å; L351-Y370 HydrophobicContact CD2-CE2 4.43Å; L351-Y370 HydrophobicContact CG-CD2 3.98Å; L351-L373 HydrophobicContact CD2-CD2 4.35Å
352F96.5Very high94.9Very high31 Ų3141.6 Ų41.614%0.13624%0.239CC..Hα-helixtrans-65.4-36.7174.5-176.8-114.1000113.4L348 N349 K350 F354 I355 S356 S399 P421 L422 R425L348-F352 PolarHBondContact O-N 2.74Å; L348-F352 VanDerWaalsContact O-N 3.09Å; N349-F352 PolarHBondContact O-N 3.49Å; K350-F352 VanDerWaalsContact C-N 3.28Å; K350-F352 PolarHBondContact O-N 2.83Å; F352-F354 VanDerWaalsContact C-N 3.28Å; F352-F354 PolarHBondContact O-N 3.29Å; F352-I355 PolarHBondContact O-N 2.82Å; F352-S356 WeakPolarHBondContact O-CB 3.42Å; F352-S356 PolarHBondContact O-N 3.33Å; F352-S356 PolarHBondContact O-OG 3.19Å; F352-S399 VanDerWaalsContact CB-O 3.24Å; F352-S399 WeakPolarHBondContact CB-O 3.47Å; F352-S399 WeakPolarHBondContact CD1-O 3.04Å; F352-S399 WeakPolarHBondContact CG-O 3.48Å; F352-P421 HydrophobicContact CZ-CB 4.35Å; F352-L422 HydrophobicContact CD2-CD1 4.15Å; F352-L422 HydrophobicContact CE2-CB 4.21Å; F352-L422 HydrophobicContact CE2-CD1 4.08Å; F352-R425 HydrophobicContact CE2-CB 4.46Å
353V95.5Very high95.2Very high71 Ų7140.6 Ų40.643%0.4323%0.228SC..Hα-helixtrans-59.9-40.3171.5169.50000110.7N349 K350 L351 S356 N357N349-V353 WeakPolarHBondContact O-CG2 3.38Å; N349-V353 PolarHBondContact O-N 3.27Å; K350-V353 WeakPolarHBondContact O-CA 3.2Å; K350-V353 WeakPolarHBondContact O-CB 3.33Å; K350-V353 PolarHBondContact O-N 3.37Å; K350-V353 VanDerWaalsContact O-N 3.1Å; L351-V353 PolarHBondContact O-N 3.45Å; V353-S356 PolarHBondContact O-N 3.37Å; V353-S356 VanDerWaalsContact O-N 3.14Å; V353-N357 HydrophobicContact CG1-CB 4.48Å; V353-N357 WeakPolarHBondContact O-CB 3.39Å; V353-N357 PolarHBondContact O-N 3.34Å
354F96.7Very high95.4Very high27 Ų2740 Ų4012%0.11822%0.221CC..Hα-helixtrans-67.3-38.8178.4-81.3-136.2000112.3I311 M315 F318 K350 L351 F352 S356 S358 I362 A366I311-F354 HydrophobicContact CD1-CE1 4.24Å; I311-F354 HydrophobicContact CG1-CD1 4.16Å; I311-F354 HydrophobicContact CG1-CE1 3.39Å; I311-F354 HydrophobicContact CG1-CZ 3.74Å; M315-F354 HydrophobicContact CG-CD1 4.15Å; M315-F354 HydrophobicContact CG-CE1 4.05Å; M315-F354 HydrophobicContact SD-CD1 3.5Å; M315-F354 WeakPolarHBondContact SD-CD1 3.43Å; M315-F354 HydrophobicContact SD-CE1 3.94Å; F318-F354 HydrophobicContact CD2-CD1 4.34Å; F318-F354 HydrophobicContact CD2-CE1 4.38Å; F318-F354 AromaticContact CE2-CD1 3.89Å; F318-F354 HydrophobicContact CE2-CD1 3.89Å; F318-F354 HydrophobicContact CE2-CD2 4.21Å; F318-F354 AromaticContact CE2-CE1 3.82Å; F318-F354 HydrophobicContact CE2-CE1 3.82Å; F318-F354 HydrophobicContact CE2-CE2 4.17Å; F318-F354 HydrophobicContact CE2-CG 4.07Å; F318-F354 AromaticContact CE2-CZ 3.97Å; F318-F354 HydrophobicContact CE2-CZ 3.97Å; K350-F354 WeakPolarHBondContact O-CD2 3.26Å; K350-F354 PolarHBondContact O-N 2.96Å; L351-F354 WeakPolarHBondContact O-CB 3.38Å; L351-F354 PolarHBondContact O-N 3.48Å; L351-F354 VanDerWaalsContact O-N 3.16Å; F352-F354 VanDerWaalsContact C-N 3.28Å; F352-F354 PolarHBondContact O-N 3.29Å; F354-S356 PolarHBondContact O-N 2.8Å; F354-S358 WeakPolarHBondContact CA-OG 3.29Å; F354-S358 VanDerWaalsContact O-CB 3.22Å; F354-S358 WeakPolarHBondContact O-CB 3.13Å; F354-S358 PolarHBondContact O-N 3Å; F354-S358 PolarHBondContact O-OG 3.14Å; F354-I362 HydrophobicContact CD1-CG2 3.61Å; F354-I362 HydrophobicContact CE1-CG2 4.23Å; F354-I362 HydrophobicContact CG-CG2 4.43Å; F354-A366 HydrophobicContact CB-CB 3.81Å
355I97.1Very high95.5Very high0 Ų042.6 Ų42.60%023%0.231CC..Hα-helixtrans-62.5-34172.3-65.4168.9000111.2L351 F352 C363 A366 V367 Y370 R425 L429L351-I355 WeakPolarHBondContact O-CG1 3.47Å; L351-I355 PolarHBondContact O-N 2.92Å; F352-I355 PolarHBondContact O-N 2.82Å; I355-C363 PolarHBondContact O-SG 3.29Å; I355-A366 HydrophobicContact CG1-CB 3.8Å; I355-V367 HydrophobicContact CB-CG2 4.35Å; I355-V367 HydrophobicContact CD1-CG2 4.47Å; I355-V367 HydrophobicContact CG1-CG2 3.94Å; I355-V367 HydrophobicContact CG2-CG2 3.77Å; I355-Y370 HydrophobicContact CD1-CD1 4.32Å; I355-Y370 HydrophobicContact CD1-CD2 3.78Å; I355-Y370 HydrophobicContact CD1-CE2 4.47Å; I355-Y370 HydrophobicContact CD1-CG 3.7Å; I355-R425 HydrophobicContact CG2-CG 4.04Å; I355-R425 PolarHBondContact O-NE 3.42Å; I355-R425 VanDerWaalsContact O-NE 3.16Å; I355-R425 PolarHBondContact O-NH2 3.32Å; I355-R425 VanDerWaalsContact O-NH2 3.13Å; I355-L429 HydrophobicContact CG2-CD1 4.08Å
356S94.3Very high95.7Very high29 Ų2939.9 Ų39.920%0.20322%0.216CC..Hα-helixtrans-86-40.8-173.3-59.50000113.2F352 V353 F354 R425F352-S356 WeakPolarHBondContact O-CB 3.42Å; F352-S356 PolarHBondContact O-N 3.33Å; F352-S356 PolarHBondContact O-OG 3.19Å; V353-S356 PolarHBondContact O-N 3.37Å; V353-S356 VanDerWaalsContact O-N 3.14Å; F354-S356 PolarHBondContact O-N 2.8Å; S356-R425 PolarHBondContact O-NH2 2.99Å; S356-R425 VanDerWaalsContact O-NH2 3.13Å
357N93.2Very high96Very high125 Ų12538.4 Ų38.467%0.66821%0.206SC*.Hα-helixtrans-125.7-3.5-159.8-61-17.9000115.1V353V353-N357 HydrophobicContact CG1-CB 4.48Å; V353-N357 WeakPolarHBondContact O-CB 3.39Å; V353-N357 PolarHBondContact O-N 3.34Å
358S94.6Very high96.1Very high23 Ų2341 Ų4116%0.16122%0.218CC..SBendtrans-89.9161.3-177.7-60.30000113F354 I362F354-S358 WeakPolarHBondContact CA-OG 3.29Å; F354-S358 VanDerWaalsContact O-CB 3.22Å; F354-S358 WeakPolarHBondContact O-CB 3.13Å; F354-S358 PolarHBondContact O-N 3Å; F354-S358 PolarHBondContact O-OG 3.14Å; S358-I362 VanDerWaalsContact CB-CG2 3.46Å
359P93.9Very high96.2Very high89 Ų8941 Ų4158%0.57822%0.218SC*.  trans-55.6157.7171.3-24.734.6000112.7E361 I362 C363P359-E361 VanDerWaalsContact C-N 3.29Å; P359-E361 PolarHBondContact O-N 3.08Å; P359-E361 VanDerWaalsContact O-N 3.1Å; P359-I362 PolarHBondContact O-N 3.22Å; P359-C363 WeakPolarHBondContact O-CB 3.45Å; P359-C363 PolarHBondContact O-N 3.11Å
360T92.9Very high96.3Very high75 Ų7539.8 Ų39.846%0.4621%0.212SC..Hα-helixtrans-46.7-45.8-172.9-52.30000113.9C363 T364 V437T360-C363 PolarHBondContact O-N 3.49Å; T360-T364 WeakPolarHBondContact O-CB 3.23Å; T360-T364 PolarHBondContact O-N 3.02Å; T360-T364 PolarHBondContact O-OG1 3.2Å; T360-V437 HydrophobicContact CG2-CG2 3.39Å
361E94Very high96.4Very high144 Ų14437.1 Ų37.167%0.67320%0.201SC*.Hα-helixtrans-63.2-49.1-179.9-173.4-175165.300112.5P359 T364 R365P359-E361 VanDerWaalsContact C-N 3.29Å; P359-E361 PolarHBondContact O-N 3.08Å; P359-E361 VanDerWaalsContact O-N 3.1Å; E361-T364 PolarHBondContact O-N 3.13Å; E361-R365 PolarHBondContact O-N 2.91Å; E361-R365 VanDerWaalsContact O-N 3.09Å
362I96.5Very high96.5Very high12 Ų1241.5 Ų41.56%0.06222%0.22CC..Hα-helixtrans-67.5-41.1178.8-59.9-64.2000110.8I311 M315 F354 S358 P359 T364 R365 A366I311-I362 HydrophobicContact CD1-CB 4.47Å; I311-I362 HydrophobicContact CD1-CG1 4.14Å; I311-I362 HydrophobicContact CD1-CG2 3.91Å; I311-I362 HydrophobicContact CG1-CG2 4.12Å; M315-I362 HydrophobicContact CG-CD1 3.96Å; M315-I362 HydrophobicContact CG-CG2 3.97Å; M315-I362 HydrophobicContact SD-CG2 3.85Å; F354-I362 HydrophobicContact CD1-CG2 3.61Å; F354-I362 HydrophobicContact CE1-CG2 4.23Å; F354-I362 HydrophobicContact CG-CG2 4.43Å; S358-I362 VanDerWaalsContact CB-CG2 3.46Å; P359-I362 PolarHBondContact O-N 3.22Å; I362-T364 VanDerWaalsContact C-N 3.32Å; I362-T364 PolarHBondContact O-N 2.89Å; I362-R365 PolarHBondContact O-N 3.43Å; I362-A366 VanDerWaalsContact O-CB 3.24Å; I362-A366 WeakPolarHBondContact O-CB 3.49Å; I362-A366 PolarHBondContact O-N 3.26Å
363C97Very high96.5Very high4 Ų440.2 Ų40.23%0.02721%0.214CC..Hα-helixtrans-57.9-46174.4179.20000110.8I355 P359 T360 A366 V367I355-C363 PolarHBondContact O-SG 3.29Å; P359-C363 WeakPolarHBondContact O-CB 3.45Å; P359-C363 PolarHBondContact O-N 3.11Å; T360-C363 PolarHBondContact O-N 3.49Å; C363-A366 PolarHBondContact O-N 3.42Å; C363-V367 VanDerWaalsContact O-CG2 3.28Å; C363-V367 WeakPolarHBondContact O-CG2 3.49Å; C363-V367 PolarHBondContact O-N 3.34Å
364T97.5Very high96.6Very high19 Ų1936.8 Ų36.812%0.11719%0.194CC..Hα-helixtrans-58.7-52.1178.5-56.90000110.9T360 E361 I362 A366 V367 E368 E436 V437 A440T360-T364 WeakPolarHBondContact O-CB 3.23Å; T360-T364 PolarHBondContact O-N 3.02Å; T360-T364 PolarHBondContact O-OG1 3.2Å; E361-T364 PolarHBondContact O-N 3.13Å; I362-T364 VanDerWaalsContact C-N 3.32Å; I362-T364 PolarHBondContact O-N 2.89Å; T364-A366 VanDerWaalsContact C-N 3.34Å; T364-A366 PolarHBondContact O-N 3.46Å; T364-V367 PolarHBondContact O-N 3.09Å; T364-E368 WeakPolarHBondContact O-CG 3.28Å; T364-E368 PolarHBondContact O-N 3.35Å; T364-E436 HydrophobicContact CG2-CB 4.47Å; T364-V437 WeakPolarHBondContact OG1-CG2 3.23Å; T364-A440 HydrophobicContact CG2-CB 3.7Å
365R97.8Very high96.7Very high56 Ų5639.6 Ų39.621%0.21120%0.203CC..Hα-helixtrans-61.8-40.2177.8-67.5172.762.3-170.42.9112.6M315 E319 E361 I362 V367 E368 C369M315-R365 HydrophobicContact CE-CB 3.44Å; M315-R365 VanDerWaalsContact CE-CB 3.44Å; E319-R365 IonicContact OE1-CZ 3.59Å; E319-R365 IonicContact OE1-NE 3.23Å; E319-R365 PolarHBondContact OE1-NE 2.83Å; E319-R365 IonicContact OE1-NH2 2.64Å; E319-R365 PolarHBondContact OE1-NH2 3Å; E319-R365 IonicContact OE2-NH2 3.19Å; E319-R365 PolarHBondContact OE2-NH2 3.33Å; E361-R365 PolarHBondContact O-N 2.91Å; E361-R365 VanDerWaalsContact O-N 3.09Å; I362-R365 PolarHBondContact O-N 3.43Å; R365-V367 VanDerWaalsContact C-N 3.34Å; R365-V367 PolarHBondContact O-N 2.87Å; R365-E368 PolarHBondContact O-N 3.32Å; R365-C369 PolarHBondContact O-N 3.38Å; R365-C369 PolarHBondContact O-SG 3.38Å
366A98.5Very high96.7Very high0 Ų041.1 Ų41.10%021%0.209CC..Hα-helixtrans-64.3-39.8178.400000111.5M315 L351 F354 I355 I362 C363 T364 C369 Y370M315-A366 HydrophobicContact CE-CB 4.42Å; M315-A366 HydrophobicContact SD-CB 4.22Å; L351-A366 HydrophobicContact CD1-CB 3.91Å; F354-A366 HydrophobicContact CB-CB 3.81Å; I355-A366 HydrophobicContact CG1-CB 3.8Å; I362-A366 VanDerWaalsContact O-CB 3.24Å; I362-A366 WeakPolarHBondContact O-CB 3.49Å; I362-A366 PolarHBondContact O-N 3.26Å; C363-A366 PolarHBondContact O-N 3.42Å; T364-A366 VanDerWaalsContact C-N 3.34Å; T364-A366 PolarHBondContact O-N 3.46Å; A366-C369 PolarHBondContact O-N 3.26Å; A366-Y370 WeakPolarHBondContact O-CB 3.47Å; A366-Y370 PolarHBondContact O-N 2.91Å
367V98.5Very high96.7Very high1 Ų140.1 Ų40.11%0.00620%0.202CC..Hα-helixtrans-64.7-39.6173.7173.30000111.1I355 C363 T364 R365 Y370 S371 L426 L429 A440 V441 A444I355-V367 HydrophobicContact CB-CG2 4.35Å; I355-V367 HydrophobicContact CD1-CG2 4.47Å; I355-V367 HydrophobicContact CG1-CG2 3.94Å; I355-V367 HydrophobicContact CG2-CG2 3.77Å; C363-V367 VanDerWaalsContact O-CG2 3.28Å; C363-V367 WeakPolarHBondContact O-CG2 3.49Å; C363-V367 PolarHBondContact O-N 3.34Å; T364-V367 PolarHBondContact O-N 3.09Å; R365-V367 VanDerWaalsContact C-N 3.34Å; R365-V367 PolarHBondContact O-N 2.87Å; V367-Y370 WeakPolarHBondContact O-CB 3.38Å; V367-Y370 PolarHBondContact O-N 2.64Å; V367-S371 PolarHBondContact O-N 2.85Å; V367-L426 HydrophobicContact CG1-CD2 4.44Å; V367-L429 HydrophobicContact CG2-CD1 4.07Å; V367-A440 HydrophobicContact CB-CB 4.22Å; V367-A440 VanDerWaalsContact CG1-C 3.48Å; V367-A440 HydrophobicContact CG1-CB 4Å; V367-A440 WeakPolarHBondContact CG1-O 3.14Å; V367-V441 HydrophobicContact CG1-CB 4.49Å; V367-V441 HydrophobicContact CG1-CG2 4.04Å; V367-A444 HydrophobicContact CG1-CB 3.72Å
368E98.4Very high96.6Very high57 Ų5741.1 Ų41.127%0.26621%0.207SC..Hα-helixtrans-63.9-44.2174.6-67.8-168141.600112.3T364 R365 Y370 S371 F372 A440 K443T364-E368 WeakPolarHBondContact O-CG 3.28Å; T364-E368 PolarHBondContact O-N 3.35Å; R365-E368 PolarHBondContact O-N 3.32Å; E368-Y370 VanDerWaalsContact C-N 3.25Å; E368-Y370 PolarHBondContact O-N 3.47Å; E368-S371 WeakPolarHBondContact O-CA 3.38Å; E368-S371 VanDerWaalsContact O-CB 3.32Å; E368-S371 WeakPolarHBondContact O-CB 3.44Å; E368-S371 PolarHBondContact O-N 2.87Å; E368-S371 PolarHBondContact O-OG 2.92Å; E368-F372 VanDerWaalsContact O-CD2 3.31Å; E368-F372 WeakPolarHBondContact O-CD2 3.35Å; E368-F372 PolarHBondContact O-N 3.04Å; E368-F372 VanDerWaalsContact O-N 3.14Å; E368-A440 HydrophobicContact CG-CB 3.71Å; E368-K443 IonicContact OE1-NZ 2.9Å; E368-K443 PolarHBondContact OE1-NZ 3.22Å
369C98.6Very high96.4Very high3 Ų346.4 Ų46.42%0.0223%0.229CC..Hα-helixtrans-56.7-42.7172.3-66.60000111.2F318 E319 S322 L351 R365 A366 S371 F372 L373F318-C369 HydrophobicContact CB-CB 4.47Å; E319-C369 WeakPolarHBondContact CG-SG 3.18Å; S322-C369 VanDerWaalsContact CB-O 3.27Å; S322-C369 WeakPolarHBondContact CB-O 3.24Å; L351-C369 HydrophobicContact CD1-CB 4.19Å; L351-C369 HydrophobicContact CD2-CB 4.43Å; R365-C369 PolarHBondContact O-N 3.38Å; R365-C369 PolarHBondContact O-SG 3.38Å; A366-C369 PolarHBondContact O-N 3.26Å; C369-S371 VanDerWaalsContact C-N 3.26Å; C369-S371 PolarHBondContact O-N 3.09Å; C369-F372 PolarHBondContact O-N 2.92Å; C369-L373 WeakPolarHBondContact O-CB 3.41Å; C369-L373 PolarHBondContact O-N 2.8Å
370Y98Very high96.2Very high1 Ų143.5 Ų43.50%0.00421%0.209CC..Hα-helixtrans-63-33.5176.7-148.3-106.4000112.6L351 I355 A366 V367 E368 L373 L374 S399 L422L351-Y370 HydrophobicContact CD2-CD2 3.68Å; L351-Y370 HydrophobicContact CD2-CE2 4.43Å; L351-Y370 HydrophobicContact CG-CD2 3.98Å; I355-Y370 HydrophobicContact CD1-CD1 4.32Å; I355-Y370 HydrophobicContact CD1-CD2 3.78Å; I355-Y370 HydrophobicContact CD1-CE2 4.47Å; I355-Y370 HydrophobicContact CD1-CG 3.7Å; A366-Y370 WeakPolarHBondContact O-CB 3.47Å; A366-Y370 PolarHBondContact O-N 2.91Å; V367-Y370 WeakPolarHBondContact O-CB 3.38Å; V367-Y370 PolarHBondContact O-N 2.64Å; E368-Y370 VanDerWaalsContact C-N 3.25Å; E368-Y370 PolarHBondContact O-N 3.47Å; Y370-L373 HydrophobicContact CD2-CD2 4.14Å; Y370-L373 HydrophobicContact CE2-CD2 4.11Å; Y370-L373 PolarHBondContact O-N 2.87Å; Y370-L374 HydrophobicContact CD1-CD1 3.6Å; Y370-L374 HydrophobicContact CD1-CG 4.19Å; Y370-L374 HydrophobicContact CE1-CD1 3.15Å; Y370-L374 HydrophobicContact CE1-CG 3.98Å; Y370-L374 PolarHBondContact O-N 3.29Å; Y370-S399 WeakPolarHBondContact CE2-OG 3.38Å; Y370-S399 WeakPolarHBondContact OH-CB 3.47Å; Y370-S399 PolarHBondContact OH-OG 3.17Å; Y370-L422 HydrophobicContact CD1-CD1 4.11Å; Y370-L422 HydrophobicContact CE1-CD1 3.42Å; Y370-L422 VanDerWaalsContact CE1-CD1 3.42Å; Y370-L422 HydrophobicContact CE1-CD2 3.59Å; Y370-L422 HydrophobicContact CE1-CG 4.12Å
371S98.4Very high96Very high6 Ų644.5 Ų44.54%0.04221%0.211CC..Hα-helixtrans-64.9-44174.684.20000112.2V367 E368 C369 L373 R375 A447V367-S371 PolarHBondContact O-N 2.85Å; E368-S371 WeakPolarHBondContact O-CA 3.38Å; E368-S371 VanDerWaalsContact O-CB 3.32Å; E368-S371 WeakPolarHBondContact O-CB 3.44Å; E368-S371 PolarHBondContact O-N 2.87Å; E368-S371 PolarHBondContact O-OG 2.92Å; C369-S371 VanDerWaalsContact C-N 3.26Å; C369-S371 PolarHBondContact O-N 3.09Å; S371-L373 VanDerWaalsContact C-N 3.34Å; S371-R375 VanDerWaalsContact O-CB 3.25Å; S371-R375 WeakPolarHBondContact O-CB 3.5Å; S371-R375 PolarHBondContact O-N 3.2Å; S371-A447 WeakPolarHBondContact O-CB 3.2Å
372F98.2Very high95.5Very high99 Ų9942 Ų4243%0.43421%0.21SC..Hα-helixtrans-65.7-39.8175.2-71.6-65.1000111.6T326 E368 C369 L374T326-F372 HydrophobicContact CG2-CB 4.03Å; T326-F372 HydrophobicContact CG2-CD1 3.81Å; T326-F372 HydrophobicContact CG2-CG 4.3Å; E368-F372 VanDerWaalsContact O-CD2 3.31Å; E368-F372 WeakPolarHBondContact O-CD2 3.35Å; E368-F372 PolarHBondContact O-N 3.04Å; E368-F372 VanDerWaalsContact O-N 3.14Å; C369-F372 PolarHBondContact O-N 2.92Å; F372-L374 PolarHBondContact O-N 2.69Å
373L97.9Very high95Very high3 Ų348.9 Ų48.92%0.01624%0.242CC..Hα-helixtrans-61.9-41.2178.7-175.278000112.9A325 R331 F338 L348 L351 C369 Y370 S371 W395A325-L373 HydrophobicContact CB-CD1 3.84Å; R331-L373 PolarHBondContact NH1-O 3.46Å; F338-L373 HydrophobicContact CE2-CD1 4.1Å; F338-L373 HydrophobicContact CZ-CD1 4.24Å; L348-L373 HydrophobicContact CD2-CD1 4.33Å; L348-L373 HydrophobicContact CD2-CD2 3.43Å; L348-L373 VanDerWaalsContact CD2-CD2 3.43Å; L348-L373 HydrophobicContact CD2-CG 4.47Å; L351-L373 HydrophobicContact CD2-CD2 4.35Å; C369-L373 WeakPolarHBondContact O-CB 3.41Å; C369-L373 PolarHBondContact O-N 2.8Å; Y370-L373 HydrophobicContact CD2-CD2 4.14Å; Y370-L373 HydrophobicContact CE2-CD2 4.11Å; Y370-L373 PolarHBondContact O-N 2.87Å; S371-L373 VanDerWaalsContact C-N 3.34Å; L373-W395 HydrophobicContact CD1-CE3 3.72Å; L373-W395 HydrophobicContact CD1-CH2 4.44Å; L373-W395 HydrophobicContact CD1-CZ3 3.59Å; L373-W395 HydrophobicContact CG-CE3 3.83Å; L373-W395 HydrophobicContact CG-CZ3 4.06Å
374L97.6Very high94.8Very high0 Ų049.8 Ų49.80%025%0.252CS..Hα-helixtrans-96.6-16.6-173.6-66.2-173.4000114.7Y370 F372 R376 A396 I448 Q451 W453Y370-L374 HydrophobicContact CD1-CD1 3.6Å; Y370-L374 HydrophobicContact CD1-CG 4.19Å; Y370-L374 HydrophobicContact CE1-CD1 3.15Å; Y370-L374 HydrophobicContact CE1-CG 3.98Å; Y370-L374 PolarHBondContact O-N 3.29Å; F372-L374 PolarHBondContact O-N 2.69Å; L374-R376 PolarHBondContact O-N 3.06Å; L374-A396 HydrophobicContact CD1-CB 4.45Å; L374-A396 HydrophobicContact CD2-CB 4.33Å; L374-I448 HydrophobicContact CB-CG1 4.41Å; L374-I448 HydrophobicContact CD1-CD1 4.2Å; L374-I448 HydrophobicContact CD1-CG1 3.78Å; L374-Q451 PolarHBondContact O-NE2 3.14Å; L374-W453 HydrophobicContact CD1-CH2 4.14Å; L374-W453 HydrophobicContact CD2-CZ2 4.49Å
375R97.8Very high94.5Very high85 Ų8550.1 Ų50.132%0.32125%0.253SS..SBendtrans-61.9131.4177.2-174.8167.4-67-116-7.7109.8S371 P377 K443 D446 A447 T450S371-R375 VanDerWaalsContact O-CB 3.25Å; S371-R375 WeakPolarHBondContact O-CB 3.5Å; S371-R375 PolarHBondContact O-N 3.2Å; R375-P377 VanDerWaalsContact O-CD 3.31Å; R375-P377 WeakPolarHBondContact O-CD 3.39Å; R375-K443 PolarHBondContact NH2-O 2.8Å; R375-D446 IonicContact CZ-OD2 3.04Å; R375-D446 IonicContact NH1-OD2 3.43Å; R375-D446 PolarHBondContact NH1-OD2 2.79Å; R375-D446 IonicContact NH2-OD2 2.92Å; R375-D446 PolarHBondContact NH2-OD2 2.81Å; R375-A447 HydrophobicContact CB-CB 3.72Å; R375-A447 HydrophobicContact CG-CB 4.42Å; R375-T450 HydrophobicContact CG-CG2 4.4Å
376R96.7Very high94.3Very high33 Ų3350.3 Ų50.313%0.12526%0.255CS..PPolyproline II helixtrans-64.2122.6170.5-173.5-179.259.6-171.5-13.6109.4L374 I380 T450L374-R376 PolarHBondContact O-N 3.06Å; R376-I380 HydrophobicContact CG-CD1 4.36Å; R376-T450 WeakPolarHBondContact CB-OG1 3.22Å; R376-T450 PolarHBondContact N-OG1 3.19Å
377P95.7Very high94.1Very high8 Ų853.4 Ų53.45%0.05228%0.28CS..PPolyproline II helixtrans-56.7147.5171.6-2330.7000112.3T326 P328 R331 R375 E379 I380T326-P377 WeakPolarHBondContact O-CB 3.38Å; P328-P377 HydrophobicContact CG-CB 4.23Å; R331-P377 VanDerWaalsContact CD-CG 3.46Å; R375-P377 VanDerWaalsContact O-CD 3.31Å; R375-P377 WeakPolarHBondContact O-CD 3.39Å; P377-E379 VanDerWaalsContact C-N 3.29Å; P377-E379 PolarHBondContact O-N 3.15Å; P377-I380 HydrophobicContact CB-CD1 4.14Å; P377-I380 HydrophobicContact CB-CG1 4.05Å; P377-I380 HydrophobicContact CG-CD1 3.87Å; P377-I380 HydrophobicContact CG-CG1 4.29Å
378N89.2Confident94Very high145 Ų14553.8 Ų53.878%0.77528%0.282SS*.THydrogen-bonded Turntrans-74.9-24.3-178.2-71.3-38.7000112.2I380N378-I380 VanDerWaalsContact C-N 3.3Å; N378-I380 PolarHBondContact O-N 3.49Å
379E90.4Very high93.8Very high134 Ų13451.1 Ų51.163%0.62627%0.27SS*.THydrogen-bonded Turntrans-84.9-0.1-173.4-56.475.6-165.700113.2P328 P377 D381P328-E379 HydrophobicContact CG-CB 4.1Å; P377-E379 VanDerWaalsContact C-N 3.29Å; P377-E379 PolarHBondContact O-N 3.15Å; E379-D381 PolarHBondContact O-N 3.42Å
380I90.7Very high93.6Very high29 Ų2953 Ų5315%0.14928%0.279CS..  trans-73.8123177-67.5-179.1000109.7P328 R376 P377 N378 L385 D388P328-I380 HydrophobicContact CB-CG1 4.19Å; P328-I380 HydrophobicContact CG-CG1 3.8Å; R376-I380 HydrophobicContact CG-CD1 4.36Å; P377-I380 HydrophobicContact CB-CD1 4.14Å; P377-I380 HydrophobicContact CB-CG1 4.05Å; P377-I380 HydrophobicContact CG-CD1 3.87Å; P377-I380 HydrophobicContact CG-CG1 4.29Å; N378-I380 VanDerWaalsContact C-N 3.3Å; N378-I380 PolarHBondContact O-N 3.49Å; I380-L385 HydrophobicContact CG2-CD2 3.99Å; I380-L385 HydrophobicContact CG2-CG 4.28Å; I380-D388 HydrophobicContact CD1-CB 3.58Å
381D88.2Confident93.5Very high96 Ų9653.8 Ų53.851%0.51328%0.284SS..  trans-74.5172.317362.716.9000112.2E379 E383 G384 L385E379-D381 PolarHBondContact O-N 3.42Å; D381-E383 PolarHBondContact O-N 3.2Å; D381-E383 PolarHBondContact OD1-N 3.3Å; D381-G384 PolarHBondContact O-N 3.46Å; D381-G384 PolarHBondContact OD1-N 3.02Å; D381-L385 WeakPolarHBondContact O-CG 3.47Å; D381-L385 PolarHBondContact O-N 3.21Å
382S84.7Confident93.4Very high91 Ų9153.5 Ų53.564%0.63628%0.282SS*.THydrogen-bonded Turntrans-59.5-29.8-178.946.80000113.7
383E85.5Confident93.3Very high157 Ų15748.9 Ų48.973%0.73426%0.261SS*.THydrogen-bonded Turntrans-75-37.9-178.6-62.4-176.4-17500111.4D381D381-E383 PolarHBondContact O-N 3.2Å; D381-E383 PolarHBondContact OD1-N 3.3Å
384G91.4Very high93Very high23 Ų2351.3 Ų51.324%0.23727%0.274CS..Hα-helixtrans-77-16.7178.600000114.9D381 F386 A387 D388D381-G384 PolarHBondContact O-N 3.46Å; D381-G384 PolarHBondContact OD1-N 3.02Å; G384-F386 VanDerWaalsContact C-N 3.34Å; G384-F386 PolarHBondContact O-N 2.76Å; G384-A387 PolarHBondContact O-N 3.29Å; G384-D388 WeakPolarHBondContact O-CB 3.27Å; G384-D388 PolarHBondContact O-N 3.35Å
385L92.7Very high92.9Very high26 Ų2651.3 Ų51.314%0.13627%0.274CS..Hα-helixtrans-54.7-44.5-174.5-78178.5000113.7I380 D381 A389 V500 W501I380-L385 HydrophobicContact CG2-CD2 3.99Å; I380-L385 HydrophobicContact CG2-CG 4.28Å; D381-L385 WeakPolarHBondContact O-CG 3.47Å; D381-L385 PolarHBondContact O-N 3.21Å; L385-A389 WeakPolarHBondContact O-CB 3.23Å; L385-A389 PolarHBondContact O-N 3.06Å; L385-V500 HydrophobicContact CD1-CG1 3.83Å; L385-W501 HydrophobicContact CB-CH2 4Å; L385-W501 HydrophobicContact CB-CZ2 3.96Å
386F93.9Very high92.8Very high60 Ų6047.2 Ų47.226%0.26326%0.259SS..Hα-helixtrans-70.9-45.2-178.4-178-98.2000112.2G384 D388 A389 I390 W501 Y506 F509G384-F386 VanDerWaalsContact C-N 3.34Å; G384-F386 PolarHBondContact O-N 2.76Å; F386-D388 VanDerWaalsContact C-N 3.26Å; F386-D388 PolarHBondContact O-N 3.44Å; F386-A389 PolarHBondContact O-N 2.66Å; F386-I390 HydrophobicContact CD1-CG1 4.23Å; F386-I390 HydrophobicContact CE1-CD1 4.46Å; F386-I390 HydrophobicContact CE1-CG1 3.82Å; F386-I390 HydrophobicContact CE2-CD1 4.28Å; F386-I390 HydrophobicContact CE2-CG1 4.23Å; F386-I390 HydrophobicContact CZ-CD1 3.97Å; F386-I390 HydrophobicContact CZ-CG1 3.82Å; F386-I390 WeakPolarHBondContact O-CG1 3.35Å; F386-I390 PolarHBondContact O-N 2.8Å; F386-W501 HydrophobicContact CB-CH2 4.32Å; F386-W501 HydrophobicContact CD2-CZ3 4.34Å; F386-Y506 HydrophobicContact CB-CD1 3.91Å; F386-Y506 HydrophobicContact CB-CD2 3.98Å; F386-Y506 HydrophobicContact CB-CE1 3.57Å; F386-Y506 HydrophobicContact CB-CE2 3.65Å; F386-Y506 HydrophobicContact CB-CG 4.1Å; F386-Y506 VanDerWaalsContact CB-CZ 3.43Å; F386-Y506 HydrophobicContact CD1-CD1 4.19Å; F386-Y506 HydrophobicContact CD1-CE1 4.01Å; F386-Y506 AromaticContact CD2-CD1 3.35Å; F386-Y506 HydrophobicContact CD2-CD1 3.35Å; F386-Y506 HydrophobicContact CD2-CD2 4.11Å; F386-Y506 AromaticContact CD2-CE1 3.9Å; F386-Y506 HydrophobicContact CD2-CE1 3.9Å; F386-Y506 AromaticContact CD2-CG 3.47Å; F386-Y506 HydrophobicContact CD2-CG 3.47Å; F386-Y506 VanDerWaalsContact CD2-CG 3.47Å; F386-Y506 AromaticContact CE2-CD1 3.85Å; F386-Y506 HydrophobicContact CE2-CD1 3.85Å; F386-Y506 HydrophobicContact CE2-CG 4.14Å; F386-Y506 AromaticContact CG-CD1 3.54Å; F386-Y506 HydrophobicContact CG-CD1 3.54Å; F386-Y506 HydrophobicContact CG-CD2 4.36Å; F386-Y506 AromaticContact CG-CE1 3.55Å; F386-Y506 HydrophobicContact CG-CE1 3.55Å; F386-Y506 HydrophobicContact CG-CE2 4.36Å; F386-Y506 AromaticContact CG-CG 3.96Å; F386-Y506 HydrophobicContact CG-CG 3.96Å; F386-Y506 AromaticContact CG-CZ 3.98Å; F386-Y506 HydrophobicContact CZ-CD1 4.45Å; F386-F509 AromaticContact CD2-CD2 3.94Å; F386-F509 HydrophobicContact CD2-CD2 3.94Å; F386-F509 AromaticContact CD2-CE2 3.84Å; F386-F509 HydrophobicContact CD2-CE2 3.84Å; F386-F509 AromaticContact CE2-CD2 3.96Å; F386-F509 HydrophobicContact CE2-CD2 3.96Å; F386-F509 AromaticContact CE2-CE2 3.69Å; F386-F509 HydrophobicContact CE2-CE2 3.69Å
387A93.6Very high92.7Very high64 Ų6445.8 Ų45.853%0.52925%0.254SS..Hα-helixtrans-58.4-42.9176.800000110.9G384 I390 L391G384-A387 PolarHBondContact O-N 3.29Å; A387-I390 PolarHBondContact O-N 3.17Å; A387-L391 VanDerWaalsContact O-CB 3.27Å; A387-L391 WeakPolarHBondContact O-CB 3.41Å; A387-L391 PolarHBondContact O-N 3.48Å
388D95.7Very high92.5Very high10 Ų1047.4 Ų47.45%0.05326%0.262CS..Hα-helixtrans-66-41.7177.8-172.764.3000113.7R331 I380 G384 F386 I390 L391 S392 Q451R331-D388 WeakPolarHBondContact CD-OD1 3.41Å; R331-D388 IonicContact CZ-OD1 3.16Å; R331-D388 IonicContact NE-OD1 3.67Å; R331-D388 PolarHBondContact NE-OD1 2.94Å; R331-D388 IonicContact NH2-OD1 2.61Å; I380-D388 HydrophobicContact CD1-CB 3.58Å; G384-D388 WeakPolarHBondContact O-CB 3.27Å; G384-D388 PolarHBondContact O-N 3.35Å; F386-D388 VanDerWaalsContact C-N 3.26Å; F386-D388 PolarHBondContact O-N 3.44Å; D388-I390 VanDerWaalsContact C-N 3.31Å; D388-I390 PolarHBondContact O-N 3.4Å; D388-L391 PolarHBondContact O-N 3.3Å; D388-S392 WeakPolarHBondContact O-CB 3.12Å; D388-S392 PolarHBondContact O-N 2.8Å; D388-S392 PolarHBondContact O-OG 2.91Å; D388-Q451 PolarHBondContact OD2-NE2 3.5Å
389A95.7Very high92.7Very high0 Ų040.5 Ų40.50%023%0.225CC..Hα-helixtrans-61.2-40.7175.900000111.6L385 F386 S392 L393 P452 W453 W501 F509L385-A389 WeakPolarHBondContact O-CB 3.23Å; L385-A389 PolarHBondContact O-N 3.06Å; F386-A389 PolarHBondContact O-N 2.66Å; A389-S392 WeakPolarHBondContact CA-OG 3.36Å; A389-S392 PolarHBondContact O-OG 2.69Å; A389-L393 VanDerWaalsContact O-CB 3.3Å; A389-L393 WeakPolarHBondContact O-CB 3.44Å; A389-L393 PolarHBondContact O-N 2.9Å; A389-L393 VanDerWaalsContact O-N 3.09Å; A389-P452 HydrophobicContact CB-CG 3.68Å; A389-W453 PolarHBondContact O-NE1 3.29Å; A389-W501 HydrophobicContact CB-CH2 4.13Å; A389-W501 HydrophobicContact CB-CZ2 4.07Å; A389-F509 HydrophobicContact CB-CE2 3.99Å; A389-F509 HydrophobicContact CB-CZ 4.25Å
390I94.1Very high92.7Very high42 Ų4235.4 Ų35.422%0.21520%0.203CC..Hα-helixtrans-69.6-44.4177.2-65.3-60.5000111.4F386 A387 D388 L393 N394 V412 F509F386-I390 HydrophobicContact CD1-CG1 4.23Å; F386-I390 HydrophobicContact CE1-CD1 4.46Å; F386-I390 HydrophobicContact CE1-CG1 3.82Å; F386-I390 HydrophobicContact CE2-CD1 4.28Å; F386-I390 HydrophobicContact CE2-CG1 4.23Å; F386-I390 HydrophobicContact CZ-CD1 3.97Å; F386-I390 HydrophobicContact CZ-CG1 3.82Å; F386-I390 WeakPolarHBondContact O-CG1 3.35Å; F386-I390 PolarHBondContact O-N 2.8Å; A387-I390 PolarHBondContact O-N 3.17Å; D388-I390 VanDerWaalsContact C-N 3.31Å; D388-I390 PolarHBondContact O-N 3.4Å; I390-L393 PolarHBondContact O-N 3.1Å; I390-N394 WeakPolarHBondContact O-CB 3.48Å; I390-N394 PolarHBondContact O-N 3.47Å; I390-N394 PolarHBondContact O-ND2 2.8Å; I390-V412 HydrophobicContact CD1-CG1 4.48Å; I390-V412 HydrophobicContact CD1-CG2 4.09Å; I390-F509 HydrophobicContact CD1-CE2 4.17Å; I390-F509 HydrophobicContact CD1-CZ 4.11Å
391L95Very high92.3Very high19 Ų1936.7 Ų36.710%0.09921%0.209CC..Hα-helixtrans-61.7-48.2178.2173161.5000111.3R331 D335 A387 D388 L393 N394 W395R331-L391 HydrophobicContact CB-CD1 4.45Å; R331-L391 HydrophobicContact CB-CD2 4.35Å; D335-L391 HydrophobicContact CB-CD1 3.59Å; D335-L391 HydrophobicContact CB-CG 4.04Å; A387-L391 VanDerWaalsContact O-CB 3.27Å; A387-L391 WeakPolarHBondContact O-CB 3.41Å; A387-L391 PolarHBondContact O-N 3.48Å; D388-L391 PolarHBondContact O-N 3.3Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 3.13Å; L391-N394 WeakPolarHBondContact O-CB 3.44Å; L391-N394 PolarHBondContact O-N 2.83Å; L391-W395 HydrophobicContact CD1-CZ2 4.33Å; L391-W395 HydrophobicContact CD2-CD2 3.69Å; L391-W395 HydrophobicContact CD2-CE3 3.97Å; L391-W395 HydrophobicContact CD2-CG 4.43Å; L391-W395 HydrophobicContact CD2-CH2 3.69Å; L391-W395 HydrophobicContact CD2-CZ2 3.33Å; L391-W395 HydrophobicContact CD2-CZ3 3.97Å; L391-W395 HydrophobicContact CG-CZ2 3.98Å; L391-W395 VanDerWaalsContact O-CD1 3.23Å; L391-W395 VanDerWaalsContact O-CG 3.31Å; L391-W395 PolarHBondContact O-N 2.92Å
392S96.3Very high91.2Very high0 Ų041.4 Ų41.40%022%0.224CC..Hα-helixtrans-62.7-38.7177.155.90000112.8D388 A389 W395 A396 Q451 W453D388-S392 WeakPolarHBondContact O-CB 3.12Å; D388-S392 PolarHBondContact O-N 2.8Å; D388-S392 PolarHBondContact O-OG 2.91Å; A389-S392 WeakPolarHBondContact CA-OG 3.36Å; A389-S392 PolarHBondContact O-OG 2.69Å; S392-W395 PolarHBondContact O-N 3.3Å; S392-A396 PolarHBondContact O-N 2.9Å; S392-Q451 VanDerWaalsContact OG-CD 3.28Å; S392-Q451 PolarHBondContact OG-NE2 3.21Å; S392-Q451 PolarHBondContact OG-OE1 2.84Å; S392-W453 PolarHBondContact OG-NE1 3.49Å
393L95.6Very high89.8Confident2 Ų240.8 Ų40.81%0.0122%0.22CC..Hα-helixtrans-61.8-48.4173.1176.457.4000110.7A389 I390 L391 W395 A396 I397 V412 E416 I419 W453A389-L393 VanDerWaalsContact O-CB 3.3Å; A389-L393 WeakPolarHBondContact O-CB 3.44Å; A389-L393 PolarHBondContact O-N 2.9Å; A389-L393 VanDerWaalsContact O-N 3.09Å; I390-L393 PolarHBondContact O-N 3.1Å; L391-L393 VanDerWaalsContact C-N 3.34Å; L391-L393 PolarHBondContact O-N 3.13Å; L393-W395 VanDerWaalsContact C-N 3.28Å; L393-W395 PolarHBondContact O-N 3.41Å; L393-A396 PolarHBondContact O-N 3.35Å; L393-I397 HydrophobicContact CD1-CD1 3.81Å; L393-I397 HydrophobicContact CD1-CG1 4.05Å; L393-I397 HydrophobicContact CG-CD1 3.74Å; L393-I397 HydrophobicContact CG-CG1 4.41Å; L393-I397 WeakPolarHBondContact O-CG1 3.31Å; L393-I397 PolarHBondContact O-N 3.19Å; L393-V412 HydrophobicContact CD2-CG1 3.91Å; L393-E416 HydrophobicContact CD1-CB 4.48Å; L393-E416 HydrophobicContact CD1-CG 3.85Å; L393-E416 HydrophobicContact CD2-CG 3.86Å; L393-I419 HydrophobicContact CD1-CG2 4.2Å; L393-W453 HydrophobicContact CB-CD2 4.28Å; L393-W453 HydrophobicContact CB-CG 4.01Å; L393-W453 HydrophobicContact CD1-CB 4.29Å; L393-W453 HydrophobicContact CD1-CD2 4.03Å; L393-W453 HydrophobicContact CD1-CE3 4.23Å; L393-W453 HydrophobicContact CD1-CG 4.07Å; L393-W453 HydrophobicContact CD2-CB 4.46Å; L393-W453 HydrophobicContact CG-CG 4.45Å
394N93.3Very high88.5Confident53 Ų5336.3 Ų36.328%0.28320%0.201SC..Hα-helixtrans-58.4-41.6178.2-70.5-25.9000111.4I390 L391 I397 I398I390-N394 WeakPolarHBondContact O-CB 3.48Å; I390-N394 PolarHBondContact O-N 3.47Å; I390-N394 PolarHBondContact O-ND2 2.8Å; L391-N394 WeakPolarHBondContact O-CB 3.44Å; L391-N394 PolarHBondContact O-N 2.83Å; N394-I397 PolarHBondContact O-N 2.96Å; N394-I398 VanDerWaalsContact O-CG1 3.22Å; N394-I398 WeakPolarHBondContact O-CG1 3.45Å; N394-I398 PolarHBondContact O-N 3.48Å
395W95.6Very high86.8Confident0 Ų039.9 Ų39.90%021%0.214CC..Hα-helixtrans-63.8-44176.9-65.3-0000112.6A325 R331 L334 D335 F338 L348 L373 L391 S392 L393 I397 I398 S399A325-W395 HydrophobicContact CB-CH2 4.31Å; A325-W395 HydrophobicContact CB-CZ3 4.07Å; R331-W395 HydrophobicContact CB-CH2 3.94Å; R331-W395 HydrophobicContact CB-CZ2 4.46Å; R331-W395 HydrophobicContact CG-CH2 3.91Å; R331-W395 HydrophobicContact CG-CZ3 4.35Å; L334-W395 HydrophobicContact CB-CH2 4.1Å; L334-W395 HydrophobicContact CB-CZ2 4Å; L334-W395 HydrophobicContact CD1-CH2 4.44Å; D335-W395 HydrophobicContact CB-CZ2 4.12Å; D335-W395 PolarHBondContact OD1-NE1 2.84Å; F338-W395 HydrophobicContact CD2-CD2 4.03Å; F338-W395 AromaticContact CD2-CE2 3.55Å; F338-W395 HydrophobicContact CD2-CG 4.28Å; F338-W395 AromaticContact CD2-CZ2 3.81Å; F338-W395 HydrophobicContact CD2-CZ2 3.81Å; F338-W395 AromaticContact CD2-NE1 3.66Å; F338-W395 HydrophobicContact CE2-CD2 4.05Å; F338-W395 AromaticContact CE2-CE2 3.81Å; F338-W395 HydrophobicContact CE2-CE3 4.33Å; F338-W395 HydrophobicContact CE2-CH2 4.04Å; F338-W395 AromaticContact CE2-CZ2 3.78Å; F338-W395 HydrophobicContact CE2-CZ2 3.78Å; F338-W395 HydrophobicContact CE2-CZ3 4.34Å; L348-W395 HydrophobicContact CD1-CB 3.88Å; L348-W395 HydrophobicContact CD1-CG 4.08Å; L373-W395 HydrophobicContact CD1-CE3 3.72Å; L373-W395 HydrophobicContact CD1-CH2 4.44Å; L373-W395 HydrophobicContact CD1-CZ3 3.59Å; L373-W395 HydrophobicContact CG-CE3 3.83Å; L373-W395 HydrophobicContact CG-CZ3 4.06Å; L391-W395 HydrophobicContact CD1-CZ2 4.33Å; L391-W395 HydrophobicContact CD2-CD2 3.69Å; L391-W395 HydrophobicContact CD2-CE3 3.97Å; L391-W395 HydrophobicContact CD2-CG 4.43Å; L391-W395 HydrophobicContact CD2-CH2 3.69Å; L391-W395 HydrophobicContact CD2-CZ2 3.33Å; L391-W395 HydrophobicContact CD2-CZ3 3.97Å; L391-W395 HydrophobicContact CG-CZ2 3.98Å; L391-W395 VanDerWaalsContact O-CD1 3.23Å; L391-W395 VanDerWaalsContact O-CG 3.31Å; L391-W395 PolarHBondContact O-N 2.92Å; S392-W395 PolarHBondContact O-N 3.3Å; L393-W395 VanDerWaalsContact C-N 3.28Å; L393-W395 PolarHBondContact O-N 3.41Å; W395-I397 PolarHBondContact O-N 3.25Å; W395-I398 PolarHBondContact O-N 2.93Å; W395-S399 PolarHBondContact O-N 3.09Å; W395-S399 PolarHBondContact O-OG 3.32Å
396A95.7Very high84.9Confident0 Ų046.9 Ų46.90%024%0.244CC..Hα-helixtrans-60.3-38.9176.100000111.7L374 S392 L393 S399 C400 I419 L422 W453L374-A396 HydrophobicContact CD1-CB 4.45Å; L374-A396 HydrophobicContact CD2-CB 4.33Å; S392-A396 PolarHBondContact O-N 2.9Å; L393-A396 PolarHBondContact O-N 3.35Å; A396-S399 WeakPolarHBondContact O-CB 3.49Å; A396-C400 PolarHBondContact O-SG 3.05Å; A396-I419 HydrophobicContact CB-CG2 4.05Å; A396-L422 HydrophobicContact CB-CD2 4.31Å; A396-W453 HydrophobicContact CB-CH2 3.87Å; A396-W453 HydrophobicContact CB-CZ2 4.32Å; A396-W453 HydrophobicContact CB-CZ3 4.37Å
397I93.8Very high82.8Confident3 Ų348 Ų482%0.01526%0.255CS..Hα-helixtrans-68.6-50.2176.8-64.4167.2000111.4L393 N394 W395 S399 C400 Q401 I404 K415 L418 I419L393-I397 HydrophobicContact CD1-CD1 3.81Å; L393-I397 HydrophobicContact CD1-CG1 4.05Å; L393-I397 HydrophobicContact CG-CD1 3.74Å; L393-I397 HydrophobicContact CG-CG1 4.41Å; L393-I397 WeakPolarHBondContact O-CG1 3.31Å; L393-I397 PolarHBondContact O-N 3.19Å; N394-I397 PolarHBondContact O-N 2.96Å; W395-I397 PolarHBondContact O-N 3.25Å; I397-S399 PolarHBondContact O-N 3.46Å; I397-C400 PolarHBondContact O-N 3.29Å; I397-Q401 HydrophobicContact CG2-CG 4.49Å; I397-Q401 PolarHBondContact O-N 3.35Å; I397-I404 HydrophobicContact CB-CD1 4.32Å; I397-I404 HydrophobicContact CG2-CD1 2.99Å; I397-I404 HydrophobicContact CG2-CG1 4.34Å; I397-K415 HydrophobicContact CD1-CB 3.84Å; I397-K415 VanDerWaalsContact CD1-O 3.29Å; I397-K415 WeakPolarHBondContact CD1-O 3.4Å; I397-L418 HydrophobicContact CG1-CB 4.26Å; I397-L418 HydrophobicContact CG2-CB 3.85Å; I397-L418 HydrophobicContact CG2-CD1 3.97Å; I397-I419 HydrophobicContact CB-CG2 4.35Å; I397-I419 HydrophobicContact CG1-CG2 3.44Å; I397-I419 VanDerWaalsContact CG1-CG2 3.44Å
398I92.3Very high81Confident42 Ų4252.5 Ų52.522%0.21527%0.271CS..Hα-helixtrans-57.2-36.2178.8-68.2162.9000110.7L348 N349 N394 W395 C400 Q401L348-I398 HydrophobicContact CB-CG2 4.09Å; L348-I398 HydrophobicContact CD1-CB 3.95Å; L348-I398 HydrophobicContact CD1-CD1 4.43Å; L348-I398 HydrophobicContact CD1-CG2 3.87Å; N349-I398 VanDerWaalsContact CG-O 3.3Å; N349-I398 PolarHBondContact ND2-O 3.02Å; N349-I398 PolarHBondContact OD1-O 3.41Å; N394-I398 VanDerWaalsContact O-CG1 3.22Å; N394-I398 WeakPolarHBondContact O-CG1 3.45Å; N394-I398 PolarHBondContact O-N 3.48Å; W395-I398 PolarHBondContact O-N 2.93Å; I398-C400 PolarHBondContact O-N 2.87Å; I398-Q401 PolarHBondContact O-N 3.41Å; I398-Q401 VanDerWaalsContact O-O 3.09Å
399S93.6Very high79.2Confident0 Ų056.9 Ų56.90%030%0.302CS..Hα-helixtrans-57.5-35.4176.2-55.70000113F352 Y370 W395 A396 I397F352-S399 VanDerWaalsContact CB-O 3.24Å; F352-S399 WeakPolarHBondContact CB-O 3.47Å; F352-S399 WeakPolarHBondContact CD1-O 3.04Å; F352-S399 WeakPolarHBondContact CG-O 3.48Å; Y370-S399 WeakPolarHBondContact CE2-OG 3.38Å; Y370-S399 WeakPolarHBondContact OH-CB 3.47Å; Y370-S399 PolarHBondContact OH-OG 3.17Å; W395-S399 PolarHBondContact O-N 3.09Å; W395-S399 PolarHBondContact O-OG 3.32Å; A396-S399 WeakPolarHBondContact O-CB 3.49Å; I397-S399 PolarHBondContact O-N 3.46Å
400C88.7Confident77.9Confident26 Ų2660.7 Ų60.718%0.17632%0.322CS..Hα-helixtrans-96.8-15.7-176.4-59.70000113.4A396 I397 I398 P421 L422A396-C400 PolarHBondContact O-SG 3.05Å; I397-C400 PolarHBondContact O-N 3.29Å; I398-C400 PolarHBondContact O-N 2.87Å; C400-P421 HydrophobicContact CB-CB 4.42Å; C400-P421 HydrophobicContact CB-CG 4.39Å; C400-L422 WeakPolarHBondContact SG-CB 3.39Å
401Q82.3Confident77.4Confident57 Ų5761 Ų6127%0.26633%0.328SS..  trans-134.5115.8-169.3-58.2-158.5-15.800110.8I397 I398 S403 I404 L418I397-Q401 HydrophobicContact CG2-CG 4.49Å; I397-Q401 PolarHBondContact O-N 3.35Å; I398-Q401 PolarHBondContact O-N 3.41Å; I398-Q401 VanDerWaalsContact O-O 3.09Å; Q401-S403 PolarHBondContact O-N 3.11Å; Q401-I404 HydrophobicContact CB-CD1 4.34Å; Q401-I404 HydrophobicContact CB-CG1 4.21Å; Q401-I404 VanDerWaalsContact OE1-CD1 3.29Å; Q401-L418 VanDerWaalsContact NE2-CD2 3.31Å
402K65.4Low77Confident194 Ų19461.3 Ų61.384%0.84333%0.331SS*.SBendtrans-67.2-20.6-178.8-71.4-172176.3-175.30114.5
403S56Low76.5Confident78 Ų7864 Ų6455%0.54534%0.344SS..  trans-147.8103.5-177-172.60000110.2Q401Q401-S403 PolarHBondContact O-N 3.11Å
404I57.7Low76Confident64 Ų6467.5 Ų67.533%0.32836%0.362SS..  trans-112.1106.3156.4-64.9-176.4000105.6I397 Q401 K406 L418I397-I404 HydrophobicContact CB-CD1 4.32Å; I397-I404 HydrophobicContact CG2-CD1 2.99Å; I397-I404 HydrophobicContact CG2-CG1 4.34Å; Q401-I404 HydrophobicContact CB-CD1 4.34Å; Q401-I404 HydrophobicContact CB-CG1 4.21Å; Q401-I404 VanDerWaalsContact OE1-CD1 3.29Å; I404-K406 PolarHBondContact O-N 3.12Å; I404-K406 VanDerWaalsContact O-N 3.16Å; I404-L418 HydrophobicContact CD1-CD1 3.78Å
405D56Low75.8Confident98 Ų9867.9 Ų67.952%0.52436%0.362SS..  trans-59.2121.3154.2-68-28.4000104.7K340 T407K340-D405 IonicContact NZ-OD1 3.39Å; K340-D405 PolarHBondContact NZ-OD1 3.32Å; D405-T407 HydrophobicContact CB-CG2 4.03Å; D405-T407 PolarHBondContact O-N 3.48Å; D405-T407 PolarHBondContact O-OG1 2.98Å
406K53.6Low75.6Confident173 Ų17367.9 Ų67.975%0.75236%0.362SS*.  trans-57.773.2171.9-68.1-179178.6-179.20107.8I404I404-K406 PolarHBondContact O-N 3.12Å; I404-K406 VanDerWaalsContact O-N 3.16Å
407T50Low75.3Confident82 Ų8273 Ų7350%0.50339%0.388SS..  trans-88.511317935.90000104.2D405 S409D405-T407 HydrophobicContact CB-CG2 4.03Å; D405-T407 PolarHBondContact O-N 3.48Å; D405-T407 PolarHBondContact O-OG1 2.98Å; T407-S409 PolarHBondContact O-N 3.41Å
408D54.4Low75.2Confident160 Ų16075.1 Ų75.186%0.85640%0.399SS*.THydrogen-bonded Turntrans-71.717.3-165.3-83.5-33.6000114.7
409S57.5Low75.2Confident101 Ų10173.1 Ų73.171%0.70639%0.389SS*.THydrogen-bonded Turntrans-111-7-167.461.10000116.4T407T407-S409 PolarHBondContact O-N 3.41Å
410N69.1Low75.1Confident80 Ų8074.3 Ų74.343%0.42840%0.399SS..  trans-94.1135.2-176.8-70.84.5000111.3D414 K415N410-D414 HydrophobicContact CB-CB 4.03Å; N410-K415 HydrophobicContact CB-CG 4.1Å
411S83.6Confident75.3Confident48 Ų4876 Ų7634%0.33641%0.409SS..  trans-59.3159.5172.4710000110.4E413 D414 K415S411-E413 PolarHBondContact O-N 2.96Å; S411-D414 WeakPolarHBondContact CB-OD2 3.36Å; S411-D414 PolarHBondContact N-OD2 3.21Å; S411-D414 PolarHBondContact O-N 2.92Å; S411-D414 VanDerWaalsContact O-N 3.14Å; S411-D414 PolarHBondContact OG-N 3.36Å; S411-D414 VanDerWaalsContact OG-N 3.14Å; S411-D414 PolarHBondContact OG-OD2 2.95Å; S411-K415 PolarHBondContact O-N 3.28Å
412V86.6Confident75.9Confident27 Ų2773.3 Ų73.316%0.16440%0.397CS..Hα-helixtrans-57.4-41.7177175.20000109.8I390 L393 D414 K415 E416 F509I390-V412 HydrophobicContact CD1-CG1 4.48Å; I390-V412 HydrophobicContact CD1-CG2 4.09Å; L393-V412 HydrophobicContact CD2-CG1 3.91Å; V412-D414 PolarHBondContact O-N 3.04Å; V412-K415 WeakPolarHBondContact O-CB 3.45Å; V412-K415 PolarHBondContact O-N 3.42Å; V412-E416 WeakPolarHBondContact O-CG 3.5Å; V412-E416 PolarHBondContact O-N 3.24Å; V412-F509 HydrophobicContact CG1-CE1 3.68Å; V412-F509 HydrophobicContact CG1-CZ 3.65Å
413E85.1Confident77.2Confident56 Ų5664.1 Ų64.126%0.26236%0.357SS..Hα-helixtrans-60.9-39.8177.2-68.377.3-17500112.8S411 E416 R456 S508S411-E413 PolarHBondContact O-N 2.96Å; E413-E416 PolarHBondContact O-N 3.4Å; E413-R456 IonicContact OE1-CZ 2.63Å; E413-R456 IonicContact OE1-NH1 2.74Å; E413-R456 PolarHBondContact OE1-NH1 3.31Å; E413-R456 IonicContact OE1-NH2 3.78Å; E413-S508 VanDerWaalsContact OE1-O 3.12Å
414D86.8Confident79.1Confident76 Ų7667 Ų6741%0.40636%0.36SS..Hα-helixtrans-66.9-40.1175.8-63.2-41.1000111.3N410 S411 V412 E416 L417N410-D414 HydrophobicContact CB-CB 4.03Å; S411-D414 WeakPolarHBondContact CB-OD2 3.36Å; S411-D414 PolarHBondContact N-OD2 3.21Å; S411-D414 PolarHBondContact O-N 2.92Å; S411-D414 VanDerWaalsContact O-N 3.14Å; S411-D414 PolarHBondContact OG-N 3.36Å; S411-D414 VanDerWaalsContact OG-N 3.14Å; S411-D414 PolarHBondContact OG-OD2 2.95Å; V412-D414 PolarHBondContact O-N 3.04Å; D414-E416 VanDerWaalsContact C-N 3.3Å; D414-E416 PolarHBondContact O-N 2.78Å; D414-L417 WeakPolarHBondContact O-CB 3.23Å; D414-L417 PolarHBondContact O-N 3.49Å
415K89.2Confident80.8Confident61 Ų6166.7 Ų66.727%0.26535%0.354SS..Hα-helixtrans-63.6-36.8176.1-72-176.3-179.4-178.60111.7I397 N410 S411 V412 L417 L418I397-K415 HydrophobicContact CD1-CB 3.84Å; I397-K415 VanDerWaalsContact CD1-O 3.29Å; I397-K415 WeakPolarHBondContact CD1-O 3.4Å; N410-K415 HydrophobicContact CB-CG 4.1Å; S411-K415 PolarHBondContact O-N 3.28Å; V412-K415 WeakPolarHBondContact O-CB 3.45Å; V412-K415 PolarHBondContact O-N 3.42Å; K415-L417 VanDerWaalsContact C-N 3.26Å; K415-L417 PolarHBondContact O-N 2.86Å; K415-L418 WeakPolarHBondContact O-CB 3.27Å; K415-L418 WeakPolarHBondContact O-CG 3.39Å; K415-L418 PolarHBondContact O-N 2.99Å; K415-L418 VanDerWaalsContact O-N 3.15Å
416E91.4Very high82.8Confident0 Ų062 Ų620%033%0.329CS..Hα-helixtrans-62.8-30.5177.8-70.2177.217900113.7L393 V412 E413 D414 L418 I419 W453 R456 Q457L393-E416 HydrophobicContact CD1-CB 4.48Å; L393-E416 HydrophobicContact CD1-CG 3.85Å; L393-E416 HydrophobicContact CD2-CG 3.86Å; V412-E416 WeakPolarHBondContact O-CG 3.5Å; V412-E416 PolarHBondContact O-N 3.24Å; E413-E416 PolarHBondContact O-N 3.4Å; D414-E416 VanDerWaalsContact C-N 3.3Å; D414-E416 PolarHBondContact O-N 2.78Å; E416-L418 PolarHBondContact O-N 2.78Å; E416-L418 VanDerWaalsContact O-N 3.1Å; E416-I419 VanDerWaalsContact O-CG1 3.28Å; E416-I419 WeakPolarHBondContact O-CG1 3.32Å; E416-I419 PolarHBondContact O-N 3.48Å; E416-I419 VanDerWaalsContact O-N 3.17Å; E416-W453 HydrophobicContact CG-CB 3.96Å; E416-W453 VanDerWaalsContact OE1-CA 3.23Å; E416-W453 WeakPolarHBondContact OE1-CA 3.23Å; E416-W453 WeakPolarHBondContact OE1-CB 3.3Å; E416-R456 VanDerWaalsContact CD-NH2 3.35Å; E416-R456 IonicContact OE1-CZ 3.08Å; E416-R456 VanDerWaalsContact OE1-CZ 3.24Å; E416-R456 IonicContact OE1-NE 3.95Å; E416-R456 PolarHBondContact OE1-NE 3.39Å; E416-R456 VanDerWaalsContact OE1-NE 3.16Å; E416-R456 IonicContact OE1-NH2 3.55Å; E416-R456 PolarHBondContact OE1-NH2 3.44Å; E416-R456 IonicContact OE2-CZ 3.3Å; E416-R456 IonicContact OE2-NE 3.25Å; E416-R456 PolarHBondContact OE2-NE 2.84Å; E416-R456 IonicContact OE2-NH2 3.56Å; E416-Q457 HydrophobicContact CB-CG 3.84Å; E416-Q457 HydrophobicContact CG-CG 4.28Å; E416-Q457 PolarHBondContact OE2-NE2 3.18Å
417L89Confident84.8Confident107 Ų10757.4 Ų57.456%0.5631%0.308SS*.G310 helixtrans-61.3-22.7177.8-63.2175000112.5D414 K415 I419 A420D414-L417 WeakPolarHBondContact O-CB 3.23Å; D414-L417 PolarHBondContact O-N 3.49Å; K415-L417 VanDerWaalsContact C-N 3.26Å; K415-L417 PolarHBondContact O-N 2.86Å; L417-I419 PolarHBondContact O-N 3.47Å; L417-A420 PolarHBondContact O-N 2.88Å
418L91.2Very high87Confident48 Ų4855.9 Ų55.925%0.25130%0.3SS..G310 helixtrans-69.2-16.1-179.4-56.5176.4000113.2I397 Q401 I404 K415 E416I397-L418 HydrophobicContact CG1-CB 4.26Å; I397-L418 HydrophobicContact CG2-CB 3.85Å; I397-L418 HydrophobicContact CG2-CD1 3.97Å; Q401-L418 VanDerWaalsContact NE2-CD2 3.31Å; I404-L418 HydrophobicContact CD1-CD1 3.78Å; K415-L418 WeakPolarHBondContact O-CB 3.27Å; K415-L418 WeakPolarHBondContact O-CG 3.39Å; K415-L418 PolarHBondContact O-N 2.99Å; K415-L418 VanDerWaalsContact O-N 3.15Å; E416-L418 PolarHBondContact O-N 2.78Å; E416-L418 VanDerWaalsContact O-N 3.1Å
419I92.9Very high88.9Confident0 Ų048.3 Ų48.30%026%0.26CS..G310 helixtrans-892179.883.2-170.8000113.7L393 A396 I397 E416 L417 P421 L422 L423 W453 Q457L393-I419 HydrophobicContact CD1-CG2 4.2Å; A396-I419 HydrophobicContact CB-CG2 4.05Å; I397-I419 HydrophobicContact CB-CG2 4.35Å; I397-I419 HydrophobicContact CG1-CG2 3.44Å; I397-I419 VanDerWaalsContact CG1-CG2 3.44Å; E416-I419 VanDerWaalsContact O-CG1 3.28Å; E416-I419 WeakPolarHBondContact O-CG1 3.32Å; E416-I419 PolarHBondContact O-N 3.48Å; E416-I419 VanDerWaalsContact O-N 3.17Å; L417-I419 PolarHBondContact O-N 3.47Å; I419-P421 VanDerWaalsContact C-N 3.31Å; I419-L422 WeakPolarHBondContact O-CB 3.37Å; I419-L422 PolarHBondContact O-N 2.73Å; I419-L422 VanDerWaalsContact O-N 3.07Å; I419-L423 HydrophobicContact CD1-CD1 4.02Å; I419-L423 HydrophobicContact CD1-CG 4.48Å; I419-L423 HydrophobicContact CG1-CD1 3.76Å; I419-L423 HydrophobicContact CG1-CG 4.12Å; I419-L423 PolarHBondContact O-N 2.96Å; I419-W453 HydrophobicContact CD1-CE3 3.6Å; I419-W453 HydrophobicContact CD1-CZ3 3.5Å; I419-Q457 HydrophobicContact CD1-CB 4.08Å; I419-Q457 HydrophobicContact CD1-CG 3.78Å; I419-Q457 HydrophobicContact CG1-CG 4.44Å
420A91.7Very high90.7Very high24 Ų2443.5 Ų43.520%0.19823%0.226CC..Hα-helixtrans-51.9-38.1-178.900000114.7L417 L422 L423 K424L417-A420 PolarHBondContact O-N 2.88Å; A420-L422 PolarHBondContact O-N 2.85Å; A420-L423 PolarHBondContact O-N 2.88Å; A420-K424 WeakPolarHBondContact O-CB 3.26Å; A420-K424 VanDerWaalsContact O-CG 3.29Å; A420-K424 WeakPolarHBondContact O-CG 3.26Å; A420-K424 PolarHBondContact O-N 3.35Å
421P92.6Very high91.8Very high62 Ų6243 Ų4340%0.40323%0.226SC..Hα-helixtrans-59.5-42.7176-2536000113.4F352 C400 I419 R425F352-P421 HydrophobicContact CZ-CB 4.35Å; C400-P421 HydrophobicContact CB-CB 4.42Å; C400-P421 HydrophobicContact CB-CG 4.39Å; I419-P421 VanDerWaalsContact C-N 3.31Å; P421-R425 WeakPolarHBondContact O-CB 3.19Å; P421-R425 PolarHBondContact O-N 3.19Å
422L93.3Very high92.2Very high0 Ų043.1 Ų43.10%022%0.221CC..Hα-helixtrans-60.5-50.9175.8168.571.4000111.1F352 Y370 A396 C400 I419 A420 K424 R425 L426F352-L422 HydrophobicContact CD2-CD1 4.15Å; F352-L422 HydrophobicContact CE2-CB 4.21Å; F352-L422 HydrophobicContact CE2-CD1 4.08Å; Y370-L422 HydrophobicContact CD1-CD1 4.11Å; Y370-L422 HydrophobicContact CE1-CD1 3.42Å; Y370-L422 VanDerWaalsContact CE1-CD1 3.42Å; Y370-L422 HydrophobicContact CE1-CD2 3.59Å; Y370-L422 HydrophobicContact CE1-CG 4.12Å; A396-L422 HydrophobicContact CB-CD2 4.31Å; C400-L422 WeakPolarHBondContact SG-CB 3.39Å; I419-L422 WeakPolarHBondContact O-CB 3.37Å; I419-L422 PolarHBondContact O-N 2.73Å; I419-L422 VanDerWaalsContact O-N 3.07Å; A420-L422 PolarHBondContact O-N 2.85Å; L422-K424 VanDerWaalsContact C-N 3.34Å; L422-K424 PolarHBondContact O-N 2.8Å; L422-R425 PolarHBondContact O-N 2.89Å; L422-R425 VanDerWaalsContact O-N 3.11Å; L422-L426 HydrophobicContact CD1-CD1 4Å; L422-L426 HydrophobicContact CD1-CG 4.07Å; L422-L426 HydrophobicContact CG-CD1 4.08Å; L422-L426 HydrophobicContact CG-CG 4.43Å; L422-L426 WeakPolarHBondContact O-CG 2.89Å; L422-L426 PolarHBondContact O-N 2.92Å
423L94.5Very high92.2Very high1 Ų146.5 Ų46.51%0.00524%0.244CC..Hα-helixtrans-65.7-38.3-176.1-64174.6000112.2I419 A420 R425 L426 Y427 Q457 Q461 F464I419-L423 HydrophobicContact CD1-CD1 4.02Å; I419-L423 HydrophobicContact CD1-CG 4.48Å; I419-L423 HydrophobicContact CG1-CD1 3.76Å; I419-L423 HydrophobicContact CG1-CG 4.12Å; I419-L423 PolarHBondContact O-N 2.96Å; A420-L423 PolarHBondContact O-N 2.88Å; L423-R425 VanDerWaalsContact C-N 3.3Å; L423-R425 PolarHBondContact O-N 3.46Å; L423-L426 PolarHBondContact O-N 3.5Å; L423-Y427 VanDerWaalsContact O-CB 3.28Å; L423-Y427 WeakPolarHBondContact O-CB 3.48Å; L423-Y427 PolarHBondContact O-N 3.2Å; L423-Q457 HydrophobicContact CD1-CB 3.62Å; L423-Q461 HydrophobicContact CB-CG 3.86Å; L423-Q461 HydrophobicContact CD1-CG 3.49Å; L423-Q461 VanDerWaalsContact CD1-CG 3.49Å; L423-Q461 HydrophobicContact CG-CG 4.29Å; L423-F464 HydrophobicContact CB-CE2 4.26Å; L423-F464 HydrophobicContact CD2-CE2 4.22Å
424K94.3Very high92.4Very high140 Ų14048.7 Ų48.761%0.60925%0.253SS*.Hα-helixtrans-60.3-41.5172.6-74.9175.5-178.9-179.70111.7A420 L422 S428A420-K424 WeakPolarHBondContact O-CB 3.26Å; A420-K424 VanDerWaalsContact O-CG 3.29Å; A420-K424 WeakPolarHBondContact O-CG 3.26Å; A420-K424 PolarHBondContact O-N 3.35Å; L422-K424 VanDerWaalsContact C-N 3.34Å; L422-K424 PolarHBondContact O-N 2.8Å; K424-S428 WeakPolarHBondContact O-CB 3.3Å; K424-S428 PolarHBondContact O-N 3.36Å
425R95.1Very high92.6Very high57 Ų5747.3 Ų47.322%0.21524%0.243CC..Hα-helixtrans-67.7-47.5178.4-179.753.7179.3170.5-7.3111.7F352 I355 S356 P421 L422 L423 Y427 S428 L429F352-R425 HydrophobicContact CE2-CB 4.46Å; I355-R425 HydrophobicContact CG2-CG 4.04Å; I355-R425 PolarHBondContact O-NE 3.42Å; I355-R425 VanDerWaalsContact O-NE 3.16Å; I355-R425 PolarHBondContact O-NH2 3.32Å; I355-R425 VanDerWaalsContact O-NH2 3.13Å; S356-R425 PolarHBondContact O-NH2 2.99Å; S356-R425 VanDerWaalsContact O-NH2 3.13Å; P421-R425 WeakPolarHBondContact O-CB 3.19Å; P421-R425 PolarHBondContact O-N 3.19Å; L422-R425 PolarHBondContact O-N 2.89Å; L422-R425 VanDerWaalsContact O-N 3.11Å; L423-R425 VanDerWaalsContact C-N 3.3Å; L423-R425 PolarHBondContact O-N 3.46Å; R425-Y427 VanDerWaalsContact C-N 3.32Å; R425-Y427 PolarHBondContact O-N 3.3Å; R425-S428 WeakPolarHBondContact O-CB 3.42Å; R425-S428 PolarHBondContact O-N 3.15Å; R425-L429 HydrophobicContact CG-CD1 4.26Å; R425-L429 WeakPolarHBondContact O-CG 3.46Å; R425-L429 PolarHBondContact O-N 3.03Å
426L96.6Very high92.7Very high0 Ų050.1 Ų50.10%026%0.258CS..Hα-helixtrans-59.6-44176.2-67.7179.5000111V367 L422 L423 S428 L429 A430 V441 A444 I448V367-L426 HydrophobicContact CG1-CD2 4.44Å; L422-L426 HydrophobicContact CD1-CD1 4Å; L422-L426 HydrophobicContact CD1-CG 4.07Å; L422-L426 HydrophobicContact CG-CD1 4.08Å; L422-L426 HydrophobicContact CG-CG 4.43Å; L422-L426 WeakPolarHBondContact O-CG 2.89Å; L422-L426 PolarHBondContact O-N 2.92Å; L423-L426 PolarHBondContact O-N 3.5Å; L426-S428 PolarHBondContact O-N 3.11Å; L426-L429 PolarHBondContact O-N 3.27Å; L426-A430 WeakPolarHBondContact O-CB 3.44Å; L426-A430 PolarHBondContact O-N 3.37Å; L426-V441 HydrophobicContact CB-CG1 4.32Å; L426-V441 HydrophobicContact CD2-CG1 4.44Å; L426-V441 VanDerWaalsContact O-CG1 3.26Å; L426-V441 WeakPolarHBondContact O-CG1 3.41Å; L426-A444 HydrophobicContact CD2-CB 4.43Å; L426-I448 HydrophobicContact CD1-CD1 3.47Å; L426-I448 VanDerWaalsContact CD1-CD1 3.47Å
427Y96Very high92.8Very high75 Ų7550.2 Ų50.229%0.29426%0.258SS..Hα-helixtrans-60.1-47.2175.3-179.2-111.5000112.1L423 R425 L429 A430 T431 F464 Y467L423-Y427 VanDerWaalsContact O-CB 3.28Å; L423-Y427 WeakPolarHBondContact O-CB 3.48Å; L423-Y427 PolarHBondContact O-N 3.2Å; R425-Y427 VanDerWaalsContact C-N 3.32Å; R425-Y427 PolarHBondContact O-N 3.3Å; Y427-L429 VanDerWaalsContact C-N 3.34Å; Y427-L429 PolarHBondContact O-N 3.47Å; Y427-A430 WeakPolarHBondContact O-CB 3.42Å; Y427-A430 PolarHBondContact O-N 2.86Å; Y427-T431 HydrophobicContact CD2-CG2 4.4Å; Y427-T431 HydrophobicContact CE1-CG2 4.39Å; Y427-T431 HydrophobicContact CE2-CG2 3.99Å; Y427-T431 WeakPolarHBondContact O-CG2 3.49Å; Y427-T431 PolarHBondContact O-N 3.27Å; Y427-T431 VanDerWaalsContact O-N 3.16Å; Y427-T431 PolarHBondContact O-OG1 3.43Å; Y427-F464 HydrophobicContact CD2-CB 4.22Å; Y427-F464 AromaticContact CD2-CD1 3.79Å; Y427-F464 HydrophobicContact CD2-CD1 3.79Å; Y427-F464 HydrophobicContact CD2-CD2 4.45Å; Y427-F464 HydrophobicContact CD2-CE1 4.23Å; Y427-F464 AromaticContact CD2-CG 3.91Å; Y427-F464 HydrophobicContact CD2-CG 3.91Å; Y427-F464 HydrophobicContact CG-CG 4.47Å; Y427-Y467 HydrophobicContact CD2-CD1 4.46Å; Y427-Y467 HydrophobicContact CE2-CD1 4.09Å; Y427-Y467 AromaticContact CE2-CG 3.86Å; Y427-Y467 HydrophobicContact CE2-CG 3.86Å
428S95.4Very high93.1Very high50 Ų5045.7 Ų45.735%0.3523%0.233SC..Hα-helixtrans-55.1-48.8175.7171.20000111.7K424 R425 L426 T431 Q432K424-S428 WeakPolarHBondContact O-CB 3.3Å; K424-S428 PolarHBondContact O-N 3.36Å; R425-S428 WeakPolarHBondContact O-CB 3.42Å; R425-S428 PolarHBondContact O-N 3.15Å; L426-S428 PolarHBondContact O-N 3.11Å; S428-T431 PolarHBondContact O-N 3.03Å; S428-T431 PolarHBondContact O-OG1 2.84Å; S428-Q432 WeakPolarHBondContact O-CG 3.31Å; S428-Q432 PolarHBondContact O-N 2.97Å
429L95.7Very high93.3Very high2 Ų244.9 Ų44.91%0.0123%0.231CC..Hα-helixtrans-65.1-39.1178.2-67.3172.8000112.2I355 V367 R425 L426 Y427 T431 Q432 V437 V441I355-L429 HydrophobicContact CG2-CD1 4.08Å; V367-L429 HydrophobicContact CG2-CD1 4.07Å; R425-L429 HydrophobicContact CG-CD1 4.26Å; R425-L429 WeakPolarHBondContact O-CG 3.46Å; R425-L429 PolarHBondContact O-N 3.03Å; L426-L429 PolarHBondContact O-N 3.27Å; Y427-L429 VanDerWaalsContact C-N 3.34Å; Y427-L429 PolarHBondContact O-N 3.47Å; L429-T431 PolarHBondContact O-N 3.37Å; L429-Q432 WeakPolarHBondContact O-CB 3.38Å; L429-Q432 PolarHBondContact O-N 2.93Å; L429-V437 HydrophobicContact CB-CG1 4.04Å; L429-V437 HydrophobicContact CD2-CG1 3.9Å; L429-V437 HydrophobicContact CG-CG1 4.45Å; L429-V441 HydrophobicContact CB-CG2 3.44Å; L429-V441 VanDerWaalsContact CB-CG2 3.44Å; L429-V441 HydrophobicContact CD1-CG2 4.04Å; L429-V441 HydrophobicContact CG-CG2 4.39Å
430A94.4Very high93.5Very high0 Ų044.9 Ų44.90%023%0.231CC..Hα-helixtrans-60.7-28.9178.500000112.5L426 Y427 R438 V441 F442 I445 Y467L426-A430 WeakPolarHBondContact O-CB 3.44Å; L426-A430 PolarHBondContact O-N 3.37Å; Y427-A430 WeakPolarHBondContact O-CB 3.42Å; Y427-A430 PolarHBondContact O-N 2.86Å; A430-R438 PolarHBondContact O-NE 3.05Å; A430-V441 HydrophobicContact CB-CG1 3.7Å; A430-F442 HydrophobicContact CB-CE1 4.33Å; A430-I445 HydrophobicContact CB-CD1 4.49Å; A430-Y467 HydrophobicContact CB-CE1 3.9Å; A430-Y467 PolarHBondContact O-OH 3.16Å
431T92.8Very high93.8Very high68 Ų6843.8 Ų43.842%0.41722%0.221SC..THydrogen-bonded Turntrans-92.8-2.4-177.861.10000114.6Y427 S428 L429 Y467Y427-T431 HydrophobicContact CD2-CG2 4.4Å; Y427-T431 HydrophobicContact CE1-CG2 4.39Å; Y427-T431 HydrophobicContact CE2-CG2 3.99Å; Y427-T431 WeakPolarHBondContact O-CG2 3.49Å; Y427-T431 PolarHBondContact O-N 3.27Å; Y427-T431 VanDerWaalsContact O-N 3.16Å; Y427-T431 PolarHBondContact O-OG1 3.43Å; S428-T431 PolarHBondContact O-N 3.03Å; S428-T431 PolarHBondContact O-OG1 2.84Å; L429-T431 PolarHBondContact O-N 3.37Å; T431-Y467 HydrophobicContact CG2-CD2 4.19Å; T431-Y467 HydrophobicContact CG2-CE2 3.91Å
432Q91.2Very high94Very high51 Ų5140.9 Ų40.924%0.23820%0.202CC..SBendtrans-71162.4175.6-71.3-178-2.100111.5S428 L429 F434 R438S428-Q432 WeakPolarHBondContact O-CG 3.31Å; S428-Q432 PolarHBondContact O-N 2.97Å; L429-Q432 WeakPolarHBondContact O-CB 3.38Å; L429-Q432 PolarHBondContact O-N 2.93Å; Q432-F434 VanDerWaalsContact C-N 3.31Å; Q432-F434 HydrophobicContact CB-CD2 4.12Å; Q432-F434 PolarHBondContact O-N 2.64Å; Q432-R438 WeakPolarHBondContact O-CD 3.1Å; Q432-R438 PolarHBondContact O-NE 3.29Å
433P87Confident94.3Very high99 Ų9945.1 Ų45.164%0.64322%0.221SC*.SBendtrans-80.8-6.1178.432.3-36000114.1F435P433-F435 PolarHBondContact O-N 3.37Å
434F89.8Confident94.4Very high102 Ų10245.1 Ų45.145%0.44722%0.221SC..  trans-81.5115.7-173.9-54.7-63.1000112Q432 E436 V437 R438Q432-F434 VanDerWaalsContact C-N 3.31Å; Q432-F434 HydrophobicContact CB-CD2 4.12Å; Q432-F434 PolarHBondContact O-N 2.64Å; F434-E436 PolarHBondContact O-N 3.05Å; F434-V437 HydrophobicContact CB-CB 4.21Å; F434-V437 HydrophobicContact CB-CG2 4.04Å; F434-R438 WeakPolarHBondContact O-CG 3.4Å; F434-R438 PolarHBondContact O-N 2.91Å; F434-R438 VanDerWaalsContact O-N 3.17Å
435F90.7Very high94.6Very high46 Ų4638.5 Ų38.520%0.20219%0.192CC..Hα-helixtrans-60.1-49.5-172.2174.6-107000113.1P433 V437 R438 V439 D479 Q482 L483P433-F435 PolarHBondContact O-N 3.37Å; F435-V437 PolarHBondContact O-N 3.21Å; F435-R438 PolarHBondContact O-N 2.94Å; F435-R438 VanDerWaalsContact O-N 3.15Å; F435-V439 HydrophobicContact CD1-CG2 4.42Å; F435-V439 HydrophobicContact CD2-CG2 4.18Å; F435-V439 HydrophobicContact CE1-CG2 3.94Å; F435-V439 HydrophobicContact CE2-CG2 3.65Å; F435-V439 HydrophobicContact CZ-CG2 3.53Å; F435-V439 WeakPolarHBondContact O-CG2 3.46Å; F435-V439 PolarHBondContact O-N 3.21Å; F435-D479 HydrophobicContact CD2-CB 3.6Å; F435-D479 HydrophobicContact CE1-CB 4.23Å; F435-D479 HydrophobicContact CE2-CB 3.17Å; F435-D479 HydrophobicContact CG-CB 4.28Å; F435-D479 HydrophobicContact CZ-CB 3.53Å; F435-Q482 HydrophobicContact CE2-CB 4.4Å; F435-Q482 HydrophobicContact CZ-CB 4.26Å; F435-L483 HydrophobicContact CD2-CD1 4.11Å; F435-L483 HydrophobicContact CD2-CD2 4.16Å; F435-L483 HydrophobicContact CD2-CG 4.13Å; F435-L483 HydrophobicContact CE2-CD1 4.37Å; F435-L483 HydrophobicContact CE2-CD2 3.98Å; F435-L483 HydrophobicContact CE2-CG 3.91Å
436E92Very high94.8Very high121 Ų12136.6 Ų36.657%0.56519%0.186SC*.Hα-helixtrans-62.3-45-174.6-6178.7-174.700111.5T364 F434 R438 V439 A440T364-E436 HydrophobicContact CG2-CB 4.47Å; F434-E436 PolarHBondContact O-N 3.05Å; E436-R438 VanDerWaalsContact C-N 3.33Å; E436-R438 PolarHBondContact O-N 2.83Å; E436-V439 PolarHBondContact O-N 2.87Å; E436-A440 PolarHBondContact O-N 2.85Å
437V93.6Very high94.9Very high2 Ų236.6 Ų36.61%0.01219%0.186CC..Hα-helixtrans-59.9-45.3176176.40000110.4T360 T364 L429 F434 F435 A440 V441T360-V437 HydrophobicContact CG2-CG2 3.39Å; T364-V437 WeakPolarHBondContact OG1-CG2 3.23Å; L429-V437 HydrophobicContact CB-CG1 4.04Å; L429-V437 HydrophobicContact CD2-CG1 3.9Å; L429-V437 HydrophobicContact CG-CG1 4.45Å; F434-V437 HydrophobicContact CB-CB 4.21Å; F434-V437 HydrophobicContact CB-CG2 4.04Å; F435-V437 PolarHBondContact O-N 3.21Å; V437-A440 PolarHBondContact O-N 3.33Å; V437-V441 HydrophobicContact CG1-CG2 4.23Å; V437-V441 WeakPolarHBondContact O-CB 3.45Å; V437-V441 WeakPolarHBondContact O-CG2 3.5Å; V437-V441 PolarHBondContact O-N 3.43Å
438R94.5Very high95Very high11 Ų1133.1 Ų33.14%0.04217%0.173CC..Hα-helixtrans-65.7-40-179-67.7176.195.7-169-11.7112.4A430 Q432 F434 F435 E436 V441 F442 Y467 E474 L483A430-R438 PolarHBondContact O-NE 3.05Å; Q432-R438 WeakPolarHBondContact O-CD 3.1Å; Q432-R438 PolarHBondContact O-NE 3.29Å; F434-R438 WeakPolarHBondContact O-CG 3.4Å; F434-R438 PolarHBondContact O-N 2.91Å; F434-R438 VanDerWaalsContact O-N 3.17Å; F435-R438 PolarHBondContact O-N 2.94Å; F435-R438 VanDerWaalsContact O-N 3.15Å; E436-R438 VanDerWaalsContact C-N 3.33Å; E436-R438 PolarHBondContact O-N 2.83Å; R438-V441 PolarHBondContact O-N 3.38Å; R438-F442 WeakPolarHBondContact O-CG 3.47Å; R438-F442 PolarHBondContact O-N 3.46Å; R438-Y467 PolarHBondContact NH2-OH 3.33Å; R438-E474 IonicContact CZ-OE2 2.64Å; R438-E474 IonicContact NH1-OE2 2.91Å; R438-E474 PolarHBondContact NH1-OE2 3.19Å; R438-E474 VanDerWaalsContact NH1-OE2 3.13Å; R438-E474 IonicContact NH2-OE1 2.78Å; R438-E474 PolarHBondContact NH2-OE1 3.42Å; R438-E474 IonicContact NH2-OE2 3.7Å; R438-E474 PolarHBondContact NH2-OE2 3.4Å; R438-L483 HydrophobicContact CB-CD2 4.01Å
439V94.8Very high95.2Very high32 Ų3230.7 Ų30.719%0.19416%0.156CC..Hα-helixtrans-59.6-48.9174.6170.40000110.1F435 E436 V441 F442 K443 L483F435-V439 HydrophobicContact CD1-CG2 4.42Å; F435-V439 HydrophobicContact CD2-CG2 4.18Å; F435-V439 HydrophobicContact CE1-CG2 3.94Å; F435-V439 HydrophobicContact CE2-CG2 3.65Å; F435-V439 HydrophobicContact CZ-CG2 3.53Å; F435-V439 WeakPolarHBondContact O-CG2 3.46Å; F435-V439 PolarHBondContact O-N 3.21Å; E436-V439 PolarHBondContact O-N 2.87Å; V439-V441 VanDerWaalsContact C-N 3.32Å; V439-V441 PolarHBondContact O-N 2.88Å; V439-F442 PolarHBondContact O-N 3.41Å; V439-K443 WeakPolarHBondContact O-CG 3.46Å; V439-K443 PolarHBondContact O-N 3.32Å; V439-L483 HydrophobicContact CG2-CD2 3.8Å
440A96.9Very high95.2Very high0 Ų031.1 Ų31.10%016%0.158CC..Hα-helixtrans-59.2-43.7176.800000111.8T364 V367 E368 E436 V437 K443 A444T364-A440 HydrophobicContact CG2-CB 3.7Å; V367-A440 HydrophobicContact CB-CB 4.22Å; V367-A440 VanDerWaalsContact CG1-C 3.48Å; V367-A440 HydrophobicContact CG1-CB 4Å; V367-A440 WeakPolarHBondContact CG1-O 3.14Å; E368-A440 HydrophobicContact CG-CB 3.71Å; E436-A440 PolarHBondContact O-N 2.85Å; V437-A440 PolarHBondContact O-N 3.33Å; A440-K443 WeakPolarHBondContact O-CB 3.48Å; A440-K443 PolarHBondContact O-N 2.76Å; A440-A444 PolarHBondContact O-N 3.41Å
441V98.1Very high95.4Very high0 Ų031.1 Ų31.10%016%0.158CC..Hα-helixtrans-65.1-40.5178.3173.80000112V367 L426 L429 A430 V437 R438 V439 K443 A444 I445V367-V441 HydrophobicContact CG1-CB 4.49Å; V367-V441 HydrophobicContact CG1-CG2 4.04Å; L426-V441 HydrophobicContact CB-CG1 4.32Å; L426-V441 HydrophobicContact CD2-CG1 4.44Å; L426-V441 VanDerWaalsContact O-CG1 3.26Å; L426-V441 WeakPolarHBondContact O-CG1 3.41Å; L429-V441 HydrophobicContact CB-CG2 3.44Å; L429-V441 VanDerWaalsContact CB-CG2 3.44Å; L429-V441 HydrophobicContact CD1-CG2 4.04Å; L429-V441 HydrophobicContact CG-CG2 4.39Å; A430-V441 HydrophobicContact CB-CG1 3.7Å; V437-V441 HydrophobicContact CG1-CG2 4.23Å; V437-V441 WeakPolarHBondContact O-CB 3.45Å; V437-V441 WeakPolarHBondContact O-CG2 3.5Å; V437-V441 PolarHBondContact O-N 3.43Å; R438-V441 PolarHBondContact O-N 3.38Å; V439-V441 VanDerWaalsContact C-N 3.32Å; V439-V441 PolarHBondContact O-N 2.88Å; V441-K443 VanDerWaalsContact C-N 3.35Å; V441-A444 WeakPolarHBondContact O-CB 3.39Å; V441-A444 PolarHBondContact O-N 3.38Å; V441-I445 HydrophobicContact CG1-CD1 3.75Å; V441-I445 HydrophobicContact CG1-CG1 4.37Å; V441-I445 VanDerWaalsContact O-CG1 3.29Å; V441-I445 WeakPolarHBondContact O-CG1 3.42Å; V441-I445 PolarHBondContact O-N 3.35Å
442F97.9Very high95.6Very high1 Ų127.9 Ų27.90%0.00414%0.138CC..Hα-helixtrans-66.2-35.9174.1-72.3-34.3000112.3A430 R438 V439 A444 I445 D446 Y467 L468 L483 A486 K487 I490A430-F442 HydrophobicContact CB-CE1 4.33Å; R438-F442 WeakPolarHBondContact O-CG 3.47Å; R438-F442 PolarHBondContact O-N 3.46Å; V439-F442 PolarHBondContact O-N 3.41Å; F442-A444 VanDerWaalsContact C-N 3.31Å; F442-A444 PolarHBondContact O-N 2.71Å; F442-I445 HydrophobicContact CD1-CD1 3.94Å; F442-I445 HydrophobicContact CE1-CD1 4.43Å; F442-I445 PolarHBondContact O-N 3.31Å; F442-D446 VanDerWaalsContact O-CB 3.24Å; F442-D446 WeakPolarHBondContact O-CB 3.42Å; F442-D446 PolarHBondContact O-N 3.23Å; F442-Y467 AromaticContact CE1-CE1 3.96Å; F442-Y467 HydrophobicContact CE1-CE1 3.96Å; F442-Y467 HydrophobicContact CZ-CE1 4.06Å; F442-L468 HydrophobicContact CD1-CD2 4.36Å; F442-L468 HydrophobicContact CE1-CD2 3.97Å; F442-L483 HydrophobicContact CD2-CD2 3.79Å; F442-L483 HydrophobicContact CE2-CB 4.03Å; F442-L483 HydrophobicContact CE2-CD2 3.79Å; F442-L483 HydrophobicContact CE2-CG 4.41Å; F442-A486 HydrophobicContact CB-CB 3.8Å; F442-A486 HydrophobicContact CD2-CB 4Å; F442-A486 HydrophobicContact CG-CB 4.19Å; F442-K487 HydrophobicContact CE1-CG 4.39Å; F442-K487 HydrophobicContact CE2-CG 4.46Å; F442-K487 HydrophobicContact CZ-CG 4.16Å; F442-I490 HydrophobicContact CB-CD1 4.19Å; F442-I490 HydrophobicContact CD1-CD1 3.98Å; F442-I490 HydrophobicContact CG-CD1 4.36Å
443K98.2Very high95.8Very high90 Ų9025.4 Ų25.439%0.39113%0.127SC..Hα-helixtrans-61-40.1169.9-68.2175.2-174173.10112E368 R375 V439 A440 V441 D446 A447E368-K443 IonicContact OE1-NZ 2.9Å; E368-K443 PolarHBondContact OE1-NZ 3.22Å; R375-K443 PolarHBondContact NH2-O 2.8Å; V439-K443 WeakPolarHBondContact O-CG 3.46Å; V439-K443 PolarHBondContact O-N 3.32Å; A440-K443 WeakPolarHBondContact O-CB 3.48Å; A440-K443 PolarHBondContact O-N 2.76Å; V441-K443 VanDerWaalsContact C-N 3.35Å; K443-D446 PolarHBondContact O-N 3.47Å; K443-A447 WeakPolarHBondContact O-CB 3.46Å; K443-A447 PolarHBondContact O-N 3.15Å
444A98.5Very high96.3Very high0 Ų020.7 Ų20.70%010%0.096CC..Hα-helixtrans-68.1-41.7176.700000112.4V367 L426 A440 V441 F442 A447 I448V367-A444 HydrophobicContact CG1-CB 3.72Å; L426-A444 HydrophobicContact CD2-CB 4.43Å; A440-A444 PolarHBondContact O-N 3.41Å; V441-A444 WeakPolarHBondContact O-CB 3.39Å; V441-A444 PolarHBondContact O-N 3.38Å; F442-A444 VanDerWaalsContact C-N 3.31Å; F442-A444 PolarHBondContact O-N 2.71Å; A444-A447 WeakPolarHBondContact O-CB 3.44Å; A444-A447 PolarHBondContact O-N 2.75Å; A444-I448 WeakPolarHBondContact O-CB 3.36Å; A444-I448 VanDerWaalsContact O-CG1 3.23Å; A444-I448 WeakPolarHBondContact O-CG1 3.4Å; A444-I448 PolarHBondContact O-N 3.21Å
445I98.5Very high96.6Very high1 Ų115.9 Ų15.91%0.0058%0.075CC..Hα-helixtrans-63.3-45.3173.8-67.9161.2000110.2A430 V441 F442 A447 I448 V449 I458 F464 L468 I490A430-I445 HydrophobicContact CB-CD1 4.49Å; V441-I445 HydrophobicContact CG1-CD1 3.75Å; V441-I445 HydrophobicContact CG1-CG1 4.37Å; V441-I445 VanDerWaalsContact O-CG1 3.29Å; V441-I445 WeakPolarHBondContact O-CG1 3.42Å; V441-I445 PolarHBondContact O-N 3.35Å; F442-I445 HydrophobicContact CD1-CD1 3.94Å; F442-I445 HydrophobicContact CE1-CD1 4.43Å; F442-I445 PolarHBondContact O-N 3.31Å; I445-A447 VanDerWaalsContact C-N 3.3Å; I445-A447 PolarHBondContact O-N 2.95Å; I445-I448 PolarHBondContact O-N 3.48Å; I445-I448 VanDerWaalsContact O-N 3.13Å; I445-V449 PolarHBondContact O-N 3.27Å; I445-I458 HydrophobicContact CG2-CD1 3.8Å; I445-F464 HydrophobicContact CD1-CE1 3.61Å; I445-F464 HydrophobicContact CD1-CZ 3.64Å; I445-F464 HydrophobicContact CG1-CE1 4.2Å; I445-F464 HydrophobicContact CG1-CZ 3.84Å; I445-L468 HydrophobicContact CG2-CD1 4.17Å; I445-L468 HydrophobicContact CG2-CD2 4.48Å; I445-I490 HydrophobicContact CB-CD1 4.03Å; I445-I490 HydrophobicContact CG2-CD1 3.69Å; I445-I490 HydrophobicContact CG2-CG1 4.11Å; I445-I490 HydrophobicContact CG2-CG2 3.98Å
446D98.6Very high96.9Very high18 Ų1813.8 Ų13.810%0.0967%0.066CC..Hα-helixtrans-57.6-43.9176-174.760.6000111.4R375 F442 K443 V449 T450 I490 N493R375-D446 IonicContact CZ-OD2 3.04Å; R375-D446 IonicContact NH1-OD2 3.43Å; R375-D446 PolarHBondContact NH1-OD2 2.79Å; R375-D446 IonicContact NH2-OD2 2.92Å; R375-D446 PolarHBondContact NH2-OD2 2.81Å; F442-D446 VanDerWaalsContact O-CB 3.24Å; F442-D446 WeakPolarHBondContact O-CB 3.42Å; F442-D446 PolarHBondContact O-N 3.23Å; K443-D446 PolarHBondContact O-N 3.47Å; D446-V449 WeakPolarHBondContact O-CG2 3.34Å; D446-V449 PolarHBondContact O-N 2.89Å; D446-T450 WeakPolarHBondContact O-CG2 3.43Å; D446-T450 PolarHBondContact O-N 3.02Å; D446-I490 HydrophobicContact CB-CG1 3.78Å; D446-N493 PolarHBondContact OD1-ND2 2.94Å; D446-N493 PolarHBondContact OD2-ND2 3.11Å
447A98.6Very high97Very high0 Ų08.1 Ų8.10%04%0.039CC..Hα-helixtrans-60.9-47.2173.100000112.2S371 R375 K443 A444 I445 V449 T450S371-A447 WeakPolarHBondContact O-CB 3.2Å; R375-A447 HydrophobicContact CB-CB 3.72Å; R375-A447 HydrophobicContact CG-CB 4.42Å; K443-A447 WeakPolarHBondContact O-CB 3.46Å; K443-A447 PolarHBondContact O-N 3.15Å; A444-A447 WeakPolarHBondContact O-CB 3.44Å; A444-A447 PolarHBondContact O-N 2.75Å; I445-A447 VanDerWaalsContact C-N 3.3Å; I445-A447 PolarHBondContact O-N 2.95Å; A447-V449 VanDerWaalsContact C-N 3.35Å; A447-V449 PolarHBondContact O-N 2.97Å; A447-T450 WeakPolarHBondContact O-CB 3.44Å; A447-T450 PolarHBondContact O-N 3.38Å; A447-T450 VanDerWaalsContact O-N 3.15Å; A447-T450 PolarHBondContact O-OG1 3.29Å
448I98.4Very high97.1Very high1 Ų18 Ų81%0.0054%0.039CC..Hα-helixtrans-60.5-41.9179.3-72.2164.9000111.2L374 L426 A444 I445 T450 Q451 W453 G454 I458L374-I448 HydrophobicContact CB-CG1 4.41Å; L374-I448 HydrophobicContact CD1-CD1 4.2Å; L374-I448 HydrophobicContact CD1-CG1 3.78Å; L426-I448 HydrophobicContact CD1-CD1 3.47Å; L426-I448 VanDerWaalsContact CD1-CD1 3.47Å; A444-I448 WeakPolarHBondContact O-CB 3.36Å; A444-I448 VanDerWaalsContact O-CG1 3.23Å; A444-I448 WeakPolarHBondContact O-CG1 3.4Å; A444-I448 PolarHBondContact O-N 3.21Å; I445-I448 PolarHBondContact O-N 3.48Å; I445-I448 VanDerWaalsContact O-N 3.13Å; I448-T450 PolarHBondContact O-N 2.71Å; I448-Q451 WeakPolarHBondContact O-CB 3.4Å; I448-Q451 PolarHBondContact O-N 2.94Å; I448-W453 HydrophobicContact CG1-CH2 4.31Å; I448-W453 HydrophobicContact CG2-CH2 4.07Å; I448-W453 HydrophobicContact CG2-CZ3 3.86Å; I448-G454 WeakPolarHBondContact O-CA 3.45Å; I448-I458 HydrophobicContact CB-CD1 4.49Å; I448-I458 HydrophobicContact CG2-CD1 3.91Å
449V98.2Very high97.1Very high0 Ų08 Ų80%04%0.04CC..Hα-helixtrans-72.8-7.7179.9-60.80000114.1I445 D446 A447 Q451 V455 I458 I490 N493 M494 T497I445-V449 PolarHBondContact O-N 3.27Å; D446-V449 WeakPolarHBondContact O-CG2 3.34Å; D446-V449 PolarHBondContact O-N 2.89Å; A447-V449 VanDerWaalsContact C-N 3.35Å; A447-V449 PolarHBondContact O-N 2.97Å; V449-Q451 PolarHBondContact O-N 3.37Å; V449-V455 HydrophobicContact CB-CG2 4.13Å; V449-V455 VanDerWaalsContact O-CG2 3.23Å; V449-V455 WeakPolarHBondContact O-CG2 3.45Å; V449-I458 HydrophobicContact CG1-CD1 3.28Å; V449-I490 HydrophobicContact CG1-CG2 4.14Å; V449-I490 HydrophobicContact CG2-CG2 4.11Å; V449-N493 HydrophobicContact CG2-CB 3.85Å; V449-M494 HydrophobicContact CB-CG 3.55Å; V449-M494 HydrophobicContact CG1-CG 3.46Å; V449-M494 VanDerWaalsContact CG1-CG 3.46Å; V449-M494 HydrophobicContact CG1-SD 4.08Å; V449-M494 HydrophobicContact CG2-CG 4.05Å; V449-T497 WeakPolarHBondContact O-CB 3.42Å; V449-T497 PolarHBondContact O-OG1 3.07Å
450T97.4Very high96.9Very high10 Ų1012.8 Ų12.86%0.0616%0.055CC..THydrogen-bonded Turntrans-69.9-15.7166.171.10000112.6R375 R376 D446 A447 I448 T497R375-T450 HydrophobicContact CG-CG2 4.4Å; R376-T450 WeakPolarHBondContact CB-OG1 3.22Å; R376-T450 PolarHBondContact N-OG1 3.19Å; D446-T450 WeakPolarHBondContact O-CG2 3.43Å; D446-T450 PolarHBondContact O-N 3.02Å; A447-T450 WeakPolarHBondContact O-CB 3.44Å; A447-T450 PolarHBondContact O-N 3.38Å; A447-T450 VanDerWaalsContact O-N 3.15Å; A447-T450 PolarHBondContact O-OG1 3.29Å; I448-T450 PolarHBondContact O-N 2.71Å; T450-T497 PolarHBondContact O-OG1 2.85Å
451Q97Very high96.7Very high0 Ų014.2 Ų14.20%06%0.061CC..SBendtrans-102.4142.5177.6-59.5-67.9-3.700111.4L374 D388 S392 I448 V449 W453 G454 V455L374-Q451 PolarHBondContact O-NE2 3.14Å; D388-Q451 PolarHBondContact OD2-NE2 3.5Å; S392-Q451 VanDerWaalsContact OG-CD 3.28Å; S392-Q451 PolarHBondContact OG-NE2 3.21Å; S392-Q451 PolarHBondContact OG-OE1 2.84Å; I448-Q451 WeakPolarHBondContact O-CB 3.4Å; I448-Q451 PolarHBondContact O-N 2.94Å; V449-Q451 PolarHBondContact O-N 3.37Å; Q451-W453 HydrophobicContact CB-CD2 4.29Å; Q451-W453 HydrophobicContact CB-CG 4.37Å; Q451-W453 HydrophobicContact CB-CZ2 4.15Å; Q451-W453 HydrophobicContact CG-CZ2 4.19Å; Q451-W453 PolarHBondContact O-N 3.47Å; Q451-G454 PolarHBondContact O-N 3.16Å; Q451-G454 VanDerWaalsContact O-N 3.12Å; Q451-V455 PolarHBondContact O-N 3.16Å; Q451-V455 VanDerWaalsContact O-N 3.11Å
452P96.8Very high96.3Very high0 Ų019.7 Ų19.70%010%0.097CC..Hα-helixtrans-64.2-43.8-176.225.6-34.6000112.8A389 G454 V455 R456 W501 F509 L512A389-P452 HydrophobicContact CB-CG 3.68Å; P452-G454 PolarHBondContact O-N 3.35Å; P452-V455 PolarHBondContact O-N 3.2Å; P452-R456 PolarHBondContact O-N 3.38Å; P452-R456 VanDerWaalsContact O-N 3.11Å; P452-W501 HydrophobicContact CB-CD2 3.89Å; P452-W501 HydrophobicContact CB-CG 3.86Å; P452-W501 HydrophobicContact CB-CZ2 4.47Å; P452-W501 HydrophobicContact CG-CD2 3.98Å; P452-W501 HydrophobicContact CG-CG 4.43Å; P452-W501 HydrophobicContact CG-CH2 4.25Å; P452-W501 HydrophobicContact CG-CZ2 3.68Å; P452-F509 HydrophobicContact CB-CB 3.93Å; P452-F509 HydrophobicContact CB-CD1 3.65Å; P452-F509 HydrophobicContact CB-CD2 4.48Å; P452-F509 HydrophobicContact CB-CE1 4.26Å; P452-F509 HydrophobicContact CB-CG 3.78Å; P452-F509 HydrophobicContact CG-CB 4.33Å; P452-F509 HydrophobicContact CG-CD1 3.74Å; P452-F509 HydrophobicContact CG-CD2 3.99Å; P452-F509 HydrophobicContact CG-CE1 3.94Å; P452-F509 HydrophobicContact CG-CE2 4.17Å; P452-F509 HydrophobicContact CG-CG 3.76Å; P452-F509 HydrophobicContact CG-CZ 4.15Å; P452-L512 HydrophobicContact CB-CD1 3.72Å; P452-L512 HydrophobicContact CB-CD2 3.89Å; P452-L512 HydrophobicContact CB-CG 4.46Å; P452-L512 WeakPolarHBondContact O-CD2 3.38Å
453W95.8Very high96Very high0 Ų021 Ų210%011%0.111CC..Hα-helixtrans-59.6-35.917561.8-100.9000111.3L374 A389 S392 L393 A396 E416 I419 I448 Q451 R456 Q457 F509L374-W453 HydrophobicContact CD1-CH2 4.14Å; L374-W453 HydrophobicContact CD2-CZ2 4.49Å; A389-W453 PolarHBondContact O-NE1 3.29Å; S392-W453 PolarHBondContact OG-NE1 3.49Å; L393-W453 HydrophobicContact CB-CD2 4.28Å; L393-W453 HydrophobicContact CB-CG 4.01Å; L393-W453 HydrophobicContact CD1-CB 4.29Å; L393-W453 HydrophobicContact CD1-CD2 4.03Å; L393-W453 HydrophobicContact CD1-CE3 4.23Å; L393-W453 HydrophobicContact CD1-CG 4.07Å; L393-W453 HydrophobicContact CD2-CB 4.46Å; L393-W453 HydrophobicContact CG-CG 4.45Å; A396-W453 HydrophobicContact CB-CH2 3.87Å; A396-W453 HydrophobicContact CB-CZ2 4.32Å; A396-W453 HydrophobicContact CB-CZ3 4.37Å; E416-W453 HydrophobicContact CG-CB 3.96Å; E416-W453 VanDerWaalsContact OE1-CA 3.23Å; E416-W453 WeakPolarHBondContact OE1-CA 3.23Å; E416-W453 WeakPolarHBondContact OE1-CB 3.3Å; I419-W453 HydrophobicContact CD1-CE3 3.6Å; I419-W453 HydrophobicContact CD1-CZ3 3.5Å; I448-W453 HydrophobicContact CG1-CH2 4.31Å; I448-W453 HydrophobicContact CG2-CH2 4.07Å; I448-W453 HydrophobicContact CG2-CZ3 3.86Å; Q451-W453 HydrophobicContact CB-CD2 4.29Å; Q451-W453 HydrophobicContact CB-CG 4.37Å; Q451-W453 HydrophobicContact CB-CZ2 4.15Å; Q451-W453 HydrophobicContact CG-CZ2 4.19Å; Q451-W453 PolarHBondContact O-N 3.47Å; W453-R456 PolarHBondContact O-N 3.32Å; W453-Q457 WeakPolarHBondContact O-CB 3.45Å; W453-Q457 VanDerWaalsContact O-CG 3.23Å; W453-Q457 WeakPolarHBondContact O-CG 3.48Å; W453-Q457 PolarHBondContact O-N 2.86Å; W453-F509 HydrophobicContact CB-CE1 4.11Å
454G97Very high95.9Very high0 Ų016.9 Ų16.90%09%0.093CC..Hα-helixtrans-66.4-45.1179.800000112.3I448 Q451 P452 Q457 I458I448-G454 WeakPolarHBondContact O-CA 3.45Å; Q451-G454 PolarHBondContact O-N 3.16Å; Q451-G454 VanDerWaalsContact O-N 3.12Å; P452-G454 PolarHBondContact O-N 3.35Å; G454-Q457 PolarHBondContact O-N 3.48Å; G454-I458 WeakPolarHBondContact O-CB 3.41Å; G454-I458 WeakPolarHBondContact O-CG1 3.48Å; G454-I458 PolarHBondContact O-N 3.13Å
455V97.6Very high95.7Very high0 Ų017 Ų170%09%0.094CC..Hα-helixtrans-55.9-52.5172.6174.70000110.7V449 Q451 P452 Q457 I458 T459 M494 T497 L512 I513V449-V455 HydrophobicContact CB-CG2 4.13Å; V449-V455 VanDerWaalsContact O-CG2 3.23Å; V449-V455 WeakPolarHBondContact O-CG2 3.45Å; Q451-V455 PolarHBondContact O-N 3.16Å; Q451-V455 VanDerWaalsContact O-N 3.11Å; P452-V455 PolarHBondContact O-N 3.2Å; V455-Q457 VanDerWaalsContact C-N 3.33Å; V455-Q457 PolarHBondContact O-N 2.97Å; V455-I458 PolarHBondContact O-N 3.17Å; V455-T459 WeakPolarHBondContact O-CG2 3Å; V455-T459 PolarHBondContact O-N 3.41Å; V455-T459 VanDerWaalsContact O-N 3.13Å; V455-T459 PolarHBondContact O-OG1 3.39Å; V455-M494 HydrophobicContact CG1-CE 4.06Å; V455-M494 HydrophobicContact CG2-CB 4.5Å; V455-M494 HydrophobicContact CG2-CG 4.33Å; V455-T497 HydrophobicContact CG2-CG2 3.66Å; V455-L512 HydrophobicContact CG1-CB 4.15Å; V455-I513 HydrophobicContact CG1-CD1 3.52Å; V455-I513 HydrophobicContact CG1-CG1 3.48Å; V455-I513 VanDerWaalsContact CG1-CG1 3.48Å
456R95.5Very high95.6Very high2 Ų222.2 Ų22.21%0.00812%0.118CC..Hα-helixtrans-63.1-37.9-177.8176.3163.360.5-157.91.1112.8E413 E416 P452 W453 T459 R460 S508 L512E413-R456 IonicContact OE1-CZ 2.63Å; E413-R456 IonicContact OE1-NH1 2.74Å; E413-R456 PolarHBondContact OE1-NH1 3.31Å; E413-R456 IonicContact OE1-NH2 3.78Å; E416-R456 VanDerWaalsContact CD-NH2 3.35Å; E416-R456 IonicContact OE1-CZ 3.08Å; E416-R456 VanDerWaalsContact OE1-CZ 3.24Å; E416-R456 IonicContact OE1-NE 3.95Å; E416-R456 PolarHBondContact OE1-NE 3.39Å; E416-R456 VanDerWaalsContact OE1-NE 3.16Å; E416-R456 IonicContact OE1-NH2 3.55Å; E416-R456 PolarHBondContact OE1-NH2 3.44Å; E416-R456 IonicContact OE2-CZ 3.3Å; E416-R456 IonicContact OE2-NE 3.25Å; E416-R456 PolarHBondContact OE2-NE 2.84Å; E416-R456 IonicContact OE2-NH2 3.56Å; P452-R456 PolarHBondContact O-N 3.38Å; P452-R456 VanDerWaalsContact O-N 3.11Å; W453-R456 PolarHBondContact O-N 3.32Å; R456-T459 PolarHBondContact O-OG1 3.26Å; R456-R460 WeakPolarHBondContact O-CB 3.23Å; R456-R460 WeakPolarHBondContact O-CD 3.16Å; R456-R460 WeakPolarHBondContact O-CG 3.23Å; R456-R460 PolarHBondContact O-N 3.09Å; R456-S508 PolarHBondContact NH1-O 2.95Å; R456-S508 PolarHBondContact NH2-O 3.45Å; R456-L512 HydrophobicContact CB-CD2 4.22Å
457Q95Very high95.5Very high2 Ų222.3 Ų22.31%0.00912%0.117CC..Hα-helixtrans-74.7-41.5-179.4-70.8-61.9-45.500111.5E416 I419 L423 W453 G454 V455 T459 R460 Q461E416-Q457 HydrophobicContact CB-CG 3.84Å; E416-Q457 HydrophobicContact CG-CG 4.28Å; E416-Q457 PolarHBondContact OE2-NE2 3.18Å; I419-Q457 HydrophobicContact CD1-CB 4.08Å; I419-Q457 HydrophobicContact CD1-CG 3.78Å; I419-Q457 HydrophobicContact CG1-CG 4.44Å; L423-Q457 HydrophobicContact CD1-CB 3.62Å; W453-Q457 WeakPolarHBondContact O-CB 3.45Å; W453-Q457 VanDerWaalsContact O-CG 3.23Å; W453-Q457 WeakPolarHBondContact O-CG 3.48Å; W453-Q457 PolarHBondContact O-N 2.86Å; G454-Q457 PolarHBondContact O-N 3.48Å; V455-Q457 VanDerWaalsContact C-N 3.33Å; V455-Q457 PolarHBondContact O-N 2.97Å; Q457-T459 VanDerWaalsContact C-N 3.29Å; Q457-T459 PolarHBondContact O-N 2.88Å; Q457-R460 PolarHBondContact O-N 3.44Å; Q457-Q461 VanDerWaalsContact O-CG 3.29Å; Q457-Q461 WeakPolarHBondContact O-CG 3.42Å; Q457-Q461 PolarHBondContact O-N 2.97Å
458I95.8Very high95.4Very high0 Ų022.3 Ų22.30%012%0.117CC..Hα-helixtrans-59.7-40.2175.4-76.5163.4000111.8I445 I448 V449 G454 V455 R460 F464 L468 M494I445-I458 HydrophobicContact CG2-CD1 3.8Å; I448-I458 HydrophobicContact CB-CD1 4.49Å; I448-I458 HydrophobicContact CG2-CD1 3.91Å; V449-I458 HydrophobicContact CG1-CD1 3.28Å; G454-I458 WeakPolarHBondContact O-CB 3.41Å; G454-I458 WeakPolarHBondContact O-CG1 3.48Å; G454-I458 PolarHBondContact O-N 3.13Å; V455-I458 PolarHBondContact O-N 3.17Å; I458-R460 VanDerWaalsContact C-N 3.26Å; I458-R460 PolarHBondContact O-N 3.35Å; I458-F464 HydrophobicContact CG1-CE2 4.45Å; I458-L468 HydrophobicContact CG2-CD1 3.68Å; I458-M494 HydrophobicContact CG2-CE 4.32Å
459T94Very high95.3Very high12 Ų1223.7 Ų23.77%0.07413%0.125CC..Hα-helixtrans-71.5-19177.156.90000113.9V455 R456 Q457 F465 M494 I513 Q517V455-T459 WeakPolarHBondContact O-CG2 3Å; V455-T459 PolarHBondContact O-N 3.41Å; V455-T459 VanDerWaalsContact O-N 3.13Å; V455-T459 PolarHBondContact O-OG1 3.39Å; R456-T459 PolarHBondContact O-OG1 3.26Å; Q457-T459 VanDerWaalsContact C-N 3.29Å; Q457-T459 PolarHBondContact O-N 2.88Å; T459-F465 HydrophobicContact CG2-CD2 4.15Å; T459-F465 HydrophobicContact CG2-CE2 4.4Å; T459-M494 HydrophobicContact CG2-CE 3.5Å; T459-I513 HydrophobicContact CG2-CG1 4.47Å; T459-Q517 PolarHBondContact O-NE2 3.01Å; T459-Q517 VanDerWaalsContact O-NE2 3.09Å
460R92.2Very high95.1Very high132 Ų13226.7 Ų26.750%0.49814%0.14SC..Hα-helixtrans-97.5-20.2178.7-73.4175.6175.3-176.2-3113.8R456 Q457 I458 P462R456-R460 WeakPolarHBondContact O-CB 3.23Å; R456-R460 WeakPolarHBondContact O-CD 3.16Å; R456-R460 WeakPolarHBondContact O-CG 3.23Å; R456-R460 PolarHBondContact O-N 3.09Å; Q457-R460 PolarHBondContact O-N 3.44Å; I458-R460 VanDerWaalsContact C-N 3.26Å; I458-R460 PolarHBondContact O-N 3.35Å; R460-P462 WeakPolarHBondContact O-CD 3.3Å
461Q90.7Very high94.7Very high29 Ų2927.7 Ų27.714%0.13614%0.143CC..SBendtrans-71.9121.2178.1-72.4-55.2-35.800110.4L423 Q457 G463 F464L423-Q461 HydrophobicContact CB-CG 3.86Å; L423-Q461 HydrophobicContact CD1-CG 3.49Å; L423-Q461 VanDerWaalsContact CD1-CG 3.49Å; L423-Q461 HydrophobicContact CG-CG 4.29Å; Q457-Q461 VanDerWaalsContact O-CG 3.29Å; Q457-Q461 WeakPolarHBondContact O-CG 3.42Å; Q457-Q461 PolarHBondContact O-N 2.97Å; Q461-G463 PolarHBondContact O-N 2.88Å; Q461-F464 HydrophobicContact CB-CB 3.76Å; Q461-F464 HydrophobicContact CB-CD2 3.89Å; Q461-F464 HydrophobicContact CB-CG 4.35Å; Q461-F464 HydrophobicContact CG-CD2 4.29Å; Q461-F464 WeakPolarHBondContact O-CB 3.46Å; Q461-F464 PolarHBondContact O-N 3.21Å; Q461-F464 VanDerWaalsContact O-N 3.14Å
462P89.9Confident94.4Very high116 Ų11634.4 Ų34.475%0.75317%0.174SC*.THydrogen-bonded Turntrans-56126.5-176-2734.9000113.1R460 F464R460-P462 WeakPolarHBondContact O-CD 3.3Å; P462-F464 PolarHBondContact O-N 2.85Å; P462-F464 VanDerWaalsContact O-N 3.16Å
463G92.2Very high94.1Very high29 Ų2936.5 Ų36.530%0.29919%0.187SC..THydrogen-bonded Turntrans77.5-13.8177.200000114.7Q461 E466 Y467Q461-G463 PolarHBondContact O-N 2.88Å; G463-E466 VanDerWaalsContact C-OE2 3.27Å; G463-E466 WeakPolarHBondContact CA-OE2 3.23Å; G463-E466 PolarHBondContact N-OE2 3.27Å; G463-Y467 WeakPolarHBondContact O-CB 3.48Å; G463-Y467 PolarHBondContact O-N 3.23Å
464F95.4Very high93.8Very high2 Ų236.5 Ų36.51%0.00919%0.187CC..Hα-helixtrans-70.7-50.6-175.5-157.6-18.1000110.4L423 Y427 I445 I458 Q461 P462 E466 Y467 L468L423-F464 HydrophobicContact CB-CE2 4.26Å; L423-F464 HydrophobicContact CD2-CE2 4.22Å; Y427-F464 HydrophobicContact CD2-CB 4.22Å; Y427-F464 AromaticContact CD2-CD1 3.79Å; Y427-F464 HydrophobicContact CD2-CD1 3.79Å; Y427-F464 HydrophobicContact CD2-CD2 4.45Å; Y427-F464 HydrophobicContact CD2-CE1 4.23Å; Y427-F464 AromaticContact CD2-CG 3.91Å; Y427-F464 HydrophobicContact CD2-CG 3.91Å; Y427-F464 HydrophobicContact CG-CG 4.47Å; I445-F464 HydrophobicContact CD1-CE1 3.61Å; I445-F464 HydrophobicContact CD1-CZ 3.64Å; I445-F464 HydrophobicContact CG1-CE1 4.2Å; I445-F464 HydrophobicContact CG1-CZ 3.84Å; I458-F464 HydrophobicContact CG1-CE2 4.45Å; Q461-F464 HydrophobicContact CB-CB 3.76Å; Q461-F464 HydrophobicContact CB-CD2 3.89Å; Q461-F464 HydrophobicContact CB-CG 4.35Å; Q461-F464 HydrophobicContact CG-CD2 4.29Å; Q461-F464 WeakPolarHBondContact O-CB 3.46Å; Q461-F464 PolarHBondContact O-N 3.21Å; Q461-F464 VanDerWaalsContact O-N 3.14Å; P462-F464 PolarHBondContact O-N 2.85Å; P462-F464 VanDerWaalsContact O-N 3.16Å; F464-E466 PolarHBondContact O-N 3.38Å; F464-Y467 WeakPolarHBondContact O-CB 3.49Å; F464-Y467 PolarHBondContact O-N 2.71Å; F464-L468 HydrophobicContact CD1-CD1 4.14Å; F464-L468 HydrophobicContact CD1-CG 4.2Å; F464-L468 HydrophobicContact CE1-CD1 4.23Å; F464-L468 HydrophobicContact CE1-CG 4.35Å; F464-L468 WeakPolarHBondContact O-CG 3.47Å; F464-L468 PolarHBondContact O-N 3.11Å
465F96Very high93.1Very high3 Ų341 Ų411%0.01321%0.211CC..Hα-helixtrans-63.5-42.5178.5179.4-117.1000112.2T459 Y467 L468 L469 M491 M494 Q517 L520 I521T459-F465 HydrophobicContact CG2-CD2 4.15Å; T459-F465 HydrophobicContact CG2-CE2 4.4Å; F465-Y467 VanDerWaalsContact C-N 3.32Å; F465-Y467 PolarHBondContact O-N 3.33Å; F465-L468 PolarHBondContact O-N 3.4Å; F465-L469 HydrophobicContact CD1-CD1 3.93Å; F465-L469 HydrophobicContact CE1-CD1 3.41Å; F465-L469 VanDerWaalsContact CE1-CD1 3.41Å; F465-L469 HydrophobicContact CE1-CG 4.33Å; F465-L469 HydrophobicContact CE2-CD1 4.11Å; F465-L469 HydrophobicContact CE2-CD2 4.46Å; F465-L469 HydrophobicContact CE2-CG 4.19Å; F465-L469 HydrophobicContact CG-CD1 4.49Å; F465-L469 HydrophobicContact CZ-CD1 3.52Å; F465-L469 HydrophobicContact CZ-CD2 4.34Å; F465-L469 HydrophobicContact CZ-CG 4.07Å; F465-L469 WeakPolarHBondContact O-CG 3.33Å; F465-L469 PolarHBondContact O-N 3.32Å; F465-M491 HydrophobicContact CE2-CE 4.34Å; F465-M491 HydrophobicContact CE2-SD 4.4Å; F465-M494 HydrophobicContact CD2-CE 4.27Å; F465-M494 HydrophobicContact CE2-CE 4.24Å; F465-Q517 HydrophobicContact CD1-CG 4.38Å; F465-Q517 HydrophobicContact CE1-CB 4.06Å; F465-Q517 HydrophobicContact CE1-CG 3.88Å; F465-Q517 HydrophobicContact CZ-CB 4.14Å; F465-Q517 HydrophobicContact CZ-CG 4.43Å; F465-L520 HydrophobicContact CE1-CD1 4.17Å; F465-L520 HydrophobicContact CZ-CB 4.39Å; F465-I521 HydrophobicContact CE2-CD1 3.96Å; F465-I521 HydrophobicContact CE2-CG1 3.73Å; F465-I521 HydrophobicContact CZ-CD1 4.18Å; F465-I521 HydrophobicContact CZ-CG1 3.79Å
466E95.8Very high92.3Very high111 Ų11144.6 Ų44.652%0.51925%0.247SC..Hα-helixtrans-62.3-40.4176.7-64.175.7-166.300111.5G463 F464 L469 N470G463-E466 VanDerWaalsContact C-OE2 3.27Å; G463-E466 WeakPolarHBondContact CA-OE2 3.23Å; G463-E466 PolarHBondContact N-OE2 3.27Å; F464-E466 PolarHBondContact O-N 3.38Å; E466-L469 PolarHBondContact O-N 2.84Å; E466-N470 WeakPolarHBondContact O-CB 3.41Å; E466-N470 PolarHBondContact O-N 3.16Å
467Y96.4Very high91.7Very high19 Ų1946.8 Ų46.88%0.07526%0.259CS..Hα-helixtrans-61.4-43.3174.8172.2-101.3000112.1Y427 A430 T431 R438 F442 G463 F464 F465 L469 N470 T473 K487Y427-Y467 HydrophobicContact CD2-CD1 4.46Å; Y427-Y467 HydrophobicContact CE2-CD1 4.09Å; Y427-Y467 AromaticContact CE2-CG 3.86Å; Y427-Y467 HydrophobicContact CE2-CG 3.86Å; A430-Y467 HydrophobicContact CB-CE1 3.9Å; A430-Y467 PolarHBondContact O-OH 3.16Å; T431-Y467 HydrophobicContact CG2-CD2 4.19Å; T431-Y467 HydrophobicContact CG2-CE2 3.91Å; R438-Y467 PolarHBondContact NH2-OH 3.33Å; F442-Y467 AromaticContact CE1-CE1 3.96Å; F442-Y467 HydrophobicContact CE1-CE1 3.96Å; F442-Y467 HydrophobicContact CZ-CE1 4.06Å; G463-Y467 WeakPolarHBondContact O-CB 3.48Å; G463-Y467 PolarHBondContact O-N 3.23Å; F464-Y467 WeakPolarHBondContact O-CB 3.49Å; F464-Y467 PolarHBondContact O-N 2.71Å; F465-Y467 VanDerWaalsContact C-N 3.32Å; F465-Y467 PolarHBondContact O-N 3.33Å; Y467-L469 VanDerWaalsContact C-N 3.32Å; Y467-L469 PolarHBondContact O-N 3.49Å; Y467-N470 PolarHBondContact O-N 3.07Å; Y467-T473 HydrophobicContact CD2-CG2 3.78Å; Y467-T473 HydrophobicContact CE2-CG2 3.73Å; Y467-K487 PolarHBondContact O-NZ 2.78Å
468L96.7Very high90.9Very high0 Ų052.5 Ų52.50%030%0.296CS..Hα-helixtrans-66.3-34.1177.2-66.3172.8000112.3F442 I445 I458 F464 F465 N470 K487 I490 M491F442-L468 HydrophobicContact CD1-CD2 4.36Å; F442-L468 HydrophobicContact CE1-CD2 3.97Å; I445-L468 HydrophobicContact CG2-CD1 4.17Å; I445-L468 HydrophobicContact CG2-CD2 4.48Å; I458-L468 HydrophobicContact CG2-CD1 3.68Å; F464-L468 HydrophobicContact CD1-CD1 4.14Å; F464-L468 HydrophobicContact CD1-CG 4.2Å; F464-L468 HydrophobicContact CE1-CD1 4.23Å; F464-L468 HydrophobicContact CE1-CG 4.35Å; F464-L468 WeakPolarHBondContact O-CG 3.47Å; F464-L468 PolarHBondContact O-N 3.11Å; F465-L468 PolarHBondContact O-N 3.4Å; L468-N470 VanDerWaalsContact C-N 3.34Å; L468-K487 WeakPolarHBondContact O-CD 3.48Å; L468-I490 HydrophobicContact CD1-CG2 4.16Å; L468-I490 HydrophobicContact CD2-CD1 4.14Å; L468-M491 HydrophobicContact CB-CE 3.48Å; L468-M491 VanDerWaalsContact CB-CE 3.48Å
469L95.4Very high90.2Very high31 Ų3155.6 Ų55.616%0.16231%0.313CS..Hα-helixtrans-74.9-22.9173.9-70.6175.1000113.3F465 E466 Y467 R471 M491 L520 Y524F465-L469 HydrophobicContact CD1-CD1 3.93Å; F465-L469 HydrophobicContact CE1-CD1 3.41Å; F465-L469 VanDerWaalsContact CE1-CD1 3.41Å; F465-L469 HydrophobicContact CE1-CG 4.33Å; F465-L469 HydrophobicContact CE2-CD1 4.11Å; F465-L469 HydrophobicContact CE2-CD2 4.46Å; F465-L469 HydrophobicContact CE2-CG 4.19Å; F465-L469 HydrophobicContact CG-CD1 4.49Å; F465-L469 HydrophobicContact CZ-CD1 3.52Å; F465-L469 HydrophobicContact CZ-CD2 4.34Å; F465-L469 HydrophobicContact CZ-CG 4.07Å; F465-L469 WeakPolarHBondContact O-CG 3.33Å; F465-L469 PolarHBondContact O-N 3.32Å; E466-L469 PolarHBondContact O-N 2.84Å; Y467-L469 VanDerWaalsContact C-N 3.32Å; Y467-L469 PolarHBondContact O-N 3.49Å; L469-R471 PolarHBondContact O-N 2.99Å; L469-M491 HydrophobicContact CD2-CE 3.6Å; L469-M491 HydrophobicContact CD2-SD 3.84Å; L469-M491 HydrophobicContact CG-CE 3.88Å; L469-L520 HydrophobicContact CD1-CB 3.9Å; L469-L520 HydrophobicContact CD1-CD1 4.02Å; L469-L520 HydrophobicContact CD1-CG 4.48Å; L469-Y524 HydrophobicContact CD2-CD2 3.8Å; L469-Y524 HydrophobicContact CD2-CG 4.06Å; L469-Y524 VanDerWaalsContact O-CE2 3.23Å; L469-Y524 WeakPolarHBondContact O-CE2 3.39Å
470N94.1Very high89.8Confident62 Ų6258.7 Ų58.733%0.33233%0.325SS..  trans-81.1105.5-177.1-169.3-4.9000111.2E466 Y467 L468 Q472 T473 K487E466-N470 WeakPolarHBondContact O-CB 3.41Å; E466-N470 PolarHBondContact O-N 3.16Å; Y467-N470 PolarHBondContact O-N 3.07Å; L468-N470 VanDerWaalsContact C-N 3.34Å; N470-Q472 VanDerWaalsContact C-N 3.26Å; N470-Q472 PolarHBondContact O-N 3.07Å; N470-Q472 WeakPolarHBondContact OD1-CB 3.5Å; N470-Q472 PolarHBondContact OD1-N 2.61Å; N470-T473 HydrophobicContact CB-CG2 4.01Å; N470-T473 PolarHBondContact O-OG1 3.32Å; N470-T473 VanDerWaalsContact O-OG1 3.09Å; N470-K487 PolarHBondContact O-NZ 2.98Å
471R90.2Very high89.8Confident32 Ų3257 Ų5712%0.12133%0.326CS..G310 helixtrans-67.8-27.3174.4-64.4179.7177.894.6-4112.7L469 T473 E474 M484 Y524 E527 G528 L529L469-R471 PolarHBondContact O-N 2.99Å; R471-T473 PolarHBondContact O-N 3.32Å; R471-E474 PolarHBondContact O-N 3.09Å; R471-M484 HydrophobicContact CB-CE 4.29Å; R471-M484 HydrophobicContact CG-CE 4.45Å; R471-Y524 HydrophobicContact CG-CE2 3.8Å; R471-Y524 VanDerWaalsContact CZ-CE2 3.49Å; R471-Y524 PolarHBondContact NH2-O 2.93Å; R471-E527 IonicContact CZ-OE2 3.22Å; R471-E527 IonicContact NH1-OE2 3.16Å; R471-E527 PolarHBondContact NH1-OE2 3.28Å; R471-E527 IonicContact NH2-OE2 2.69Å; R471-G528 PolarHBondContact NE-O 3.09Å; R471-G528 PolarHBondContact NH2-O 2.98Å; R471-L529 WeakPolarHBondContact CD-O 3.35Å; R471-L529 PolarHBondContact NE-O 2.62Å
472Q90.6Very high89.9Confident140 Ų14061 Ų6165%0.65434%0.344SS*.G310 helixtrans-66.5-22.2-174.4-58.6-178.2-21.100113.1N470 E474 L475N470-Q472 VanDerWaalsContact C-N 3.26Å; N470-Q472 PolarHBondContact O-N 3.07Å; N470-Q472 WeakPolarHBondContact OD1-CB 3.5Å; N470-Q472 PolarHBondContact OD1-N 2.61Å; Q472-E474 PolarHBondContact O-N 3.26Å; Q472-L475 HydrophobicContact CB-CD1 4.23Å; Q472-L475 HydrophobicContact CG-CD1 4.06Å; Q472-L475 PolarHBondContact O-N 3.27Å; Q472-L475 VanDerWaalsContact O-N 3.14Å
473T90.1Very high90.1Very high45 Ų4555.4 Ų55.428%0.27631%0.308SS..G310 helixtrans-67-16.5178.4640000113Y467 N470 R471 K487Y467-T473 HydrophobicContact CD2-CG2 3.78Å; Y467-T473 HydrophobicContact CE2-CG2 3.73Å; N470-T473 HydrophobicContact CB-CG2 4.01Å; N470-T473 PolarHBondContact O-OG1 3.32Å; N470-T473 VanDerWaalsContact O-OG1 3.09Å; R471-T473 PolarHBondContact O-N 3.32Å; T473-K487 PolarHBondContact OG1-NZ 3.39Å
474E89.1Confident90.2Very high0 Ų054.1 Ų54.10%029%0.294CS..G310 helixtrans-102.5-14.6176.4-44.5-42.6141.100112.5R438 R471 Q472 G476 L477 K480 L483 M484 K487R438-E474 IonicContact CZ-OE2 2.64Å; R438-E474 IonicContact NH1-OE2 2.91Å; R438-E474 PolarHBondContact NH1-OE2 3.19Å; R438-E474 VanDerWaalsContact NH1-OE2 3.13Å; R438-E474 IonicContact NH2-OE1 2.78Å; R438-E474 PolarHBondContact NH2-OE1 3.42Å; R438-E474 IonicContact NH2-OE2 3.7Å; R438-E474 PolarHBondContact NH2-OE2 3.4Å; R471-E474 PolarHBondContact O-N 3.09Å; Q472-E474 PolarHBondContact O-N 3.26Å; E474-G476 PolarHBondContact O-N 3.46Å; E474-G476 VanDerWaalsContact O-N 3.16Å; E474-L477 PolarHBondContact O-N 2.87Å; E474-K480 HydrophobicContact CB-CB 4.38Å; E474-K480 WeakPolarHBondContact O-CB 3.48Å; E474-L483 HydrophobicContact CB-CB 4.46Å; E474-L483 HydrophobicContact CG-CB 4.02Å; E474-L483 VanDerWaalsContact OE2-CD1 3.28Å; E474-L483 WeakPolarHBondContact OE2-CD1 3.32Å; E474-M484 HydrophobicContact CB-CG 3.72Å; E474-M484 HydrophobicContact CB-SD 4.37Å; E474-M484 HydrophobicContact CG-CG 3.94Å; E474-K487 HydrophobicContact CG-CD 4.35Å; E474-K487 WeakPolarHBondContact OE1-CE 3.26Å; E474-K487 IonicContact OE1-NZ 3.73Å; E474-K487 PolarHBondContact OE1-NZ 3.03Å
475L83.5Confident90.2Very high95 Ų9557.6 Ų57.650%0.49731%0.31SS..THydrogen-bonded Turntrans-69.1113.9178.8-63.7178.7000108.9Q472 M484Q472-L475 HydrophobicContact CB-CD1 4.23Å; Q472-L475 HydrophobicContact CG-CD1 4.06Å; Q472-L475 PolarHBondContact O-N 3.27Å; Q472-L475 VanDerWaalsContact O-N 3.14Å; L475-M484 HydrophobicContact CD2-SD 4.42Å
476G79.6Confident90.2Very high74 Ų7458.5 Ų58.576%0.76332%0.319SS*.THydrogen-bonded Turntrans123.3-12.1-179.200000113.9E474E474-G476 PolarHBondContact O-N 3.46Å; E474-G476 VanDerWaalsContact O-N 3.16Å
477L82.7Confident90.3Very high49 Ų4953.2 Ų53.226%0.25729%0.294SS..  trans-92144.9179.5-59.4165.8000111.2E474 D479 K480 L483E474-L477 PolarHBondContact O-N 2.87Å; L477-D479 VanDerWaalsContact C-N 3.29Å; L477-D479 PolarHBondContact O-N 2.86Å; L477-K480 WeakPolarHBondContact O-CB 3.46Å; L477-K480 PolarHBondContact O-N 3.44Å; L477-L483 HydrophobicContact CD1-CD1 3.85Å
478P78.1Confident90.3Very high121 Ų12153.2 Ų53.279%0.78630%0.295SS*.THydrogen-bonded Turntrans-57.6-42.9178.821.1-30.9000111.7K480P478-K480 PolarHBondContact O-N 3.06Å
479D81.7Confident90.4Very high66 Ų6656.3 Ų56.335%0.35331%0.312SS..THydrogen-bonded Turntrans-98.828.3-176.2-58.6-68.4000113.9F435 L477 I481 Q482F435-D479 HydrophobicContact CD2-CB 3.6Å; F435-D479 HydrophobicContact CE1-CB 4.23Å; F435-D479 HydrophobicContact CE2-CB 3.17Å; F435-D479 HydrophobicContact CG-CB 4.28Å; F435-D479 HydrophobicContact CZ-CB 3.53Å; L477-D479 VanDerWaalsContact C-N 3.29Å; L477-D479 PolarHBondContact O-N 2.86Å; D479-I481 PolarHBondContact O-N 3.2Å; D479-Q482 PolarHBondContact O-N 3.44Å; D479-Q482 VanDerWaalsContact O-N 3.13Å
480K86.3Confident90.5Very high76 Ų7654.9 Ų54.933%0.3330%0.304SS..Hα-helixtrans-51.4-33.6-177.265.2-173.2178-175.80114.2E474 L477 P478 Q482 L483 M484 W530E474-K480 HydrophobicContact CB-CB 4.38Å; E474-K480 WeakPolarHBondContact O-CB 3.48Å; L477-K480 WeakPolarHBondContact O-CB 3.46Å; L477-K480 PolarHBondContact O-N 3.44Å; P478-K480 PolarHBondContact O-N 3.06Å; K480-Q482 VanDerWaalsContact C-N 3.34Å; K480-Q482 PolarHBondContact O-N 3.26Å; K480-L483 PolarHBondContact O-N 2.91Å; K480-M484 HydrophobicContact CB-SD 4.46Å; K480-M484 VanDerWaalsContact O-CB 3.31Å; K480-M484 WeakPolarHBondContact O-CB 3.41Å; K480-M484 WeakPolarHBondContact O-CG 3.39Å; K480-M484 PolarHBondContact O-N 2.95Å; K480-W530 HydrophobicContact CD-CH2 4.47Å; K480-W530 HydrophobicContact CD-CZ3 4.45Å; K480-W530 HydrophobicContact CG-CH2 4.44Å
481I91.9Very high90.7Very high98 Ų9851.9 Ų51.950%0.50329%0.288SS..Hα-helixtrans-60.4-45-177.6-63.1175.9000110.6D479 M484 Q485 L529 W530D479-I481 PolarHBondContact O-N 3.2Å; I481-M484 PolarHBondContact O-N 3.34Å; I481-Q485 WeakPolarHBondContact O-CB 3.4Å; I481-Q485 PolarHBondContact O-N 2.81Å; I481-L529 HydrophobicContact CG2-CD2 4.25Å; I481-W530 HydrophobicContact CD1-CZ2 4.49Å; I481-W530 HydrophobicContact CG1-CH2 3.88Å; I481-W530 HydrophobicContact CG1-CZ2 3.98Å
482Q93.2Very high91.1Very high111 Ų11153.4 Ų53.452%0.51930%0.298SS..Hα-helixtrans-67.9-42.9-178-62.7-17431.100111.5F435 D479 K480 Q485 A486F435-Q482 HydrophobicContact CE2-CB 4.4Å; F435-Q482 HydrophobicContact CZ-CB 4.26Å; D479-Q482 PolarHBondContact O-N 3.44Å; D479-Q482 VanDerWaalsContact O-N 3.13Å; K480-Q482 VanDerWaalsContact C-N 3.34Å; K480-Q482 PolarHBondContact O-N 3.26Å; Q482-Q485 PolarHBondContact O-N 2.97Å; Q482-A486 WeakPolarHBondContact O-CB 3.43Å; Q482-A486 PolarHBondContact O-N 2.94Å
483L93.4Very high91.5Very high0 Ų048.6 Ų48.60%028%0.277CS..Hα-helixtrans-66.3-39.9177.7-63.1-179.8000112.1F435 R438 V439 F442 E474 L477 K480 A486 K487F435-L483 HydrophobicContact CD2-CD1 4.11Å; F435-L483 HydrophobicContact CD2-CD2 4.16Å; F435-L483 HydrophobicContact CD2-CG 4.13Å; F435-L483 HydrophobicContact CE2-CD1 4.37Å; F435-L483 HydrophobicContact CE2-CD2 3.98Å; F435-L483 HydrophobicContact CE2-CG 3.91Å; R438-L483 HydrophobicContact CB-CD2 4.01Å; V439-L483 HydrophobicContact CG2-CD2 3.8Å; F442-L483 HydrophobicContact CD2-CD2 3.79Å; F442-L483 HydrophobicContact CE2-CB 4.03Å; F442-L483 HydrophobicContact CE2-CD2 3.79Å; F442-L483 HydrophobicContact CE2-CG 4.41Å; E474-L483 HydrophobicContact CB-CB 4.46Å; E474-L483 HydrophobicContact CG-CB 4.02Å; E474-L483 VanDerWaalsContact OE2-CD1 3.28Å; E474-L483 WeakPolarHBondContact OE2-CD1 3.32Å; L477-L483 HydrophobicContact CD1-CD1 3.85Å; K480-L483 PolarHBondContact O-N 2.91Å; L483-A486 PolarHBondContact O-N 3.34Å; L483-K487 PolarHBondContact O-N 3.11Å; L483-K487 VanDerWaalsContact O-N 3.11Å
484M94.1Very high91.9Very high2 Ų246.4 Ų46.41%0.0126%0.264CS..Hα-helixtrans-66.6-38.3174.8-69.8176.865.900111.5R471 E474 L475 K480 I481 K487 L488 L529 W530R471-M484 HydrophobicContact CB-CE 4.29Å; R471-M484 HydrophobicContact CG-CE 4.45Å; E474-M484 HydrophobicContact CB-CG 3.72Å; E474-M484 HydrophobicContact CB-SD 4.37Å; E474-M484 HydrophobicContact CG-CG 3.94Å; L475-M484 HydrophobicContact CD2-SD 4.42Å; K480-M484 HydrophobicContact CB-SD 4.46Å; K480-M484 VanDerWaalsContact O-CB 3.31Å; K480-M484 WeakPolarHBondContact O-CB 3.41Å; K480-M484 WeakPolarHBondContact O-CG 3.39Å; K480-M484 PolarHBondContact O-N 2.95Å; I481-M484 PolarHBondContact O-N 3.34Å; M484-K487 PolarHBondContact O-N 3.38Å; M484-L488 PolarHBondContact O-N 2.94Å; M484-L488 VanDerWaalsContact O-N 3.09Å; M484-L529 HydrophobicContact CB-CD1 3.51Å; M484-L529 HydrophobicContact CB-CG 4.11Å; M484-L529 HydrophobicContact CE-CG 4.42Å; M484-L529 WeakPolarHBondContact CE-O 3.21Å; M484-W530 HydrophobicContact CE-CD2 4.22Å; M484-W530 HydrophobicContact CE-CE3 3.46Å; M484-W530 VanDerWaalsContact CE-CE3 3.46Å; M484-W530 HydrophobicContact CE-CZ3 3.68Å; M484-W530 HydrophobicContact SD-CE3 3.99Å; M484-W530 HydrophobicContact SD-CH2 4.21Å; M484-W530 HydrophobicContact SD-CZ3 3.53Å; M484-W530 VanDerWaalsContact SD-CZ3 3.53Å
485Q95.6Very high92.3Very high74 Ų7447.4 Ų47.435%0.34627%0.269SS..Hα-helixtrans-64.7-43.7176.3-176.659.55200110.4I481 Q482 K487 L488 D489 L529I481-Q485 WeakPolarHBondContact O-CB 3.4Å; I481-Q485 PolarHBondContact O-N 2.81Å; Q482-Q485 PolarHBondContact O-N 2.97Å; Q485-K487 VanDerWaalsContact C-N 3.31Å; Q485-K487 PolarHBondContact O-N 3.07Å; Q485-L488 WeakPolarHBondContact O-CB 3.39Å; Q485-L488 PolarHBondContact O-N 2.91Å; Q485-D489 PolarHBondContact NE2-OD1 2.9Å; Q485-D489 VanDerWaalsContact O-CG 3.26Å; Q485-D489 PolarHBondContact O-N 2.92Å; Q485-L529 HydrophobicContact CB-CD1 4.09Å; Q485-L529 VanDerWaalsContact N-CD1 3.26Å
486A96Very high92.9Very high23 Ų2348.4 Ų48.419%0.1927%0.269CS..Hα-helixtrans-59.5-40.5176.500000112.3F442 Q482 L483 L488 D489 I490F442-A486 HydrophobicContact CB-CB 3.8Å; F442-A486 HydrophobicContact CD2-CB 4Å; F442-A486 HydrophobicContact CG-CB 4.19Å; Q482-A486 WeakPolarHBondContact O-CB 3.43Å; Q482-A486 PolarHBondContact O-N 2.94Å; L483-A486 PolarHBondContact O-N 3.34Å; A486-L488 PolarHBondContact O-N 2.8Å; A486-D489 PolarHBondContact O-N 3.4Å; A486-I490 WeakPolarHBondContact O-CD1 3.38Å; A486-I490 VanDerWaalsContact O-CG1 3.23Å; A486-I490 WeakPolarHBondContact O-CG1 3.45Å; A486-I490 PolarHBondContact O-N 3.31Å
487K96.8Very high93.7Very high0 Ų044.9 Ų44.90%023%0.233CC..Hα-helixtrans-62-40.8173.1-73.6-177.5173.9-160.50112.6F442 Y467 L468 N470 T473 E474 L483 M484 Q485 I490 M491 Y524F442-K487 HydrophobicContact CE1-CG 4.39Å; F442-K487 HydrophobicContact CE2-CG 4.46Å; F442-K487 HydrophobicContact CZ-CG 4.16Å; Y467-K487 PolarHBondContact O-NZ 2.78Å; L468-K487 WeakPolarHBondContact O-CD 3.48Å; N470-K487 PolarHBondContact O-NZ 2.98Å; T473-K487 PolarHBondContact OG1-NZ 3.39Å; E474-K487 HydrophobicContact CG-CD 4.35Å; E474-K487 WeakPolarHBondContact OE1-CE 3.26Å; E474-K487 IonicContact OE1-NZ 3.73Å; E474-K487 PolarHBondContact OE1-NZ 3.03Å; L483-K487 PolarHBondContact O-N 3.11Å; L483-K487 VanDerWaalsContact O-N 3.11Å; M484-K487 PolarHBondContact O-N 3.38Å; Q485-K487 VanDerWaalsContact C-N 3.31Å; Q485-K487 PolarHBondContact O-N 3.07Å; K487-I490 PolarHBondContact O-N 3.37Å; K487-M491 VanDerWaalsContact O-CG 3.29Å; K487-M491 WeakPolarHBondContact O-CG 3.29Å; K487-M491 PolarHBondContact O-N 3.21Å; K487-M491 VanDerWaalsContact O-N 3.09Å; K487-Y524 WeakPolarHBondContact CB-OH 3.45Å
488L97.3Very high94.4Very high19 Ų1945.1 Ų45.110%0.09923%0.231CC..Hα-helixtrans-64.8-41.4176-178.860.6000111.9M484 Q485 A486 M491 N492 Y524 I525M484-L488 PolarHBondContact O-N 2.94Å; M484-L488 VanDerWaalsContact O-N 3.09Å; Q485-L488 WeakPolarHBondContact O-CB 3.39Å; Q485-L488 PolarHBondContact O-N 2.91Å; A486-L488 PolarHBondContact O-N 2.8Å; L488-M491 PolarHBondContact O-N 3.41Å; L488-N492 PolarHBondContact O-N 2.92Å; L488-N492 PolarHBondContact O-ND2 3.28Å; L488-N492 VanDerWaalsContact O-ND2 3.07Å; L488-Y524 HydrophobicContact CB-CE1 4.27Å; L488-Y524 HydrophobicContact CD1-CD1 4.1Å; L488-Y524 HydrophobicContact CD1-CE1 4.04Å; L488-I525 HydrophobicContact CD1-CG1 4.41Å
489D98.1Very high95.1Very high65 Ų6545.3 Ų45.335%0.34822%0.22SC..Hα-helixtrans-63.1-43.6177.1-63.7-22.4000111.3Q485 A486 M491 N492 N493Q485-D489 PolarHBondContact NE2-OD1 2.9Å; Q485-D489 VanDerWaalsContact O-CG 3.26Å; Q485-D489 PolarHBondContact O-N 2.92Å; A486-D489 PolarHBondContact O-N 3.4Å; D489-M491 VanDerWaalsContact C-N 3.34Å; D489-M491 PolarHBondContact O-N 3.46Å; D489-N492 WeakPolarHBondContact O-CB 3.48Å; D489-N492 PolarHBondContact O-N 3.45Å; D489-N493 WeakPolarHBondContact O-CB 3.28Å; D489-N493 PolarHBondContact O-N 2.9Å
490I98.6Very high95.7Very high0 Ų044.9 Ų44.90%022%0.219CC..Hα-helixtrans-55.9-48.4173-69.7161.6000110.5F442 I445 D446 V449 L468 A486 K487 N492 N493 M494F442-I490 HydrophobicContact CB-CD1 4.19Å; F442-I490 HydrophobicContact CD1-CD1 3.98Å; F442-I490 HydrophobicContact CG-CD1 4.36Å; I445-I490 HydrophobicContact CB-CD1 4.03Å; I445-I490 HydrophobicContact CG2-CD1 3.69Å; I445-I490 HydrophobicContact CG2-CG1 4.11Å; I445-I490 HydrophobicContact CG2-CG2 3.98Å; D446-I490 HydrophobicContact CB-CG1 3.78Å; V449-I490 HydrophobicContact CG1-CG2 4.14Å; V449-I490 HydrophobicContact CG2-CG2 4.11Å; L468-I490 HydrophobicContact CD1-CG2 4.16Å; L468-I490 HydrophobicContact CD2-CD1 4.14Å; A486-I490 WeakPolarHBondContact O-CD1 3.38Å; A486-I490 VanDerWaalsContact O-CG1 3.23Å; A486-I490 WeakPolarHBondContact O-CG1 3.45Å; A486-I490 PolarHBondContact O-N 3.31Å; K487-I490 PolarHBondContact O-N 3.37Å; I490-N492 PolarHBondContact O-N 2.84Å; I490-N493 PolarHBondContact O-N 3.44Å; I490-M494 HydrophobicContact CG2-CG 4.39Å; I490-M494 HydrophobicContact CG2-SD 4.15Å; I490-M494 VanDerWaalsContact O-CG 3.3Å; I490-M494 WeakPolarHBondContact O-CG 3.44Å; I490-M494 PolarHBondContact O-N 3.05Å
491M98.3Very high96Very high0 Ų041.4 Ų41.40%020%0.204CC..Hα-helixtrans-63.1-41.8179.7-67.7-67.116200112F465 L468 L469 K487 L488 D489 M494 L495 I521 Y524 I525F465-M491 HydrophobicContact CE2-CE 4.34Å; F465-M491 HydrophobicContact CE2-SD 4.4Å; L468-M491 HydrophobicContact CB-CE 3.48Å; L468-M491 VanDerWaalsContact CB-CE 3.48Å; L469-M491 HydrophobicContact CD2-CE 3.6Å; L469-M491 HydrophobicContact CD2-SD 3.84Å; L469-M491 HydrophobicContact CG-CE 3.88Å; K487-M491 VanDerWaalsContact O-CG 3.29Å; K487-M491 WeakPolarHBondContact O-CG 3.29Å; K487-M491 PolarHBondContact O-N 3.21Å; K487-M491 VanDerWaalsContact O-N 3.09Å; L488-M491 PolarHBondContact O-N 3.41Å; D489-M491 VanDerWaalsContact C-N 3.34Å; D489-M491 PolarHBondContact O-N 3.46Å; M491-M494 PolarHBondContact O-N 3.13Å; M491-M494 HydrophobicContact SD-SD 4.3Å; M491-L495 PolarHBondContact O-N 3.05Å; M491-I521 HydrophobicContact CB-CG2 4.4Å; M491-I521 HydrophobicContact SD-CG1 3.94Å; M491-I521 HydrophobicContact SD-CG2 4.39Å; M491-Y524 HydrophobicContact CB-CD1 4.14Å; M491-Y524 HydrophobicContact CG-CD1 3.72Å; M491-Y524 HydrophobicContact CG-CE1 4.03Å; M491-Y524 HydrophobicContact CG-CG 4.21Å; M491-I525 HydrophobicContact CB-CD1 4.31Å; M491-I525 HydrophobicContact CB-CG1 3.95Å
492N98.4Very high95.9Very high63 Ų6338.7 Ų38.734%0.33719%0.194SC..Hα-helixtrans-61.2-44.7175.2-79.8-51.4000111.8L488 D489 I490 L495 K496 I525L488-N492 PolarHBondContact O-N 2.92Å; L488-N492 PolarHBondContact O-ND2 3.28Å; L488-N492 VanDerWaalsContact O-ND2 3.07Å; D489-N492 WeakPolarHBondContact O-CB 3.48Å; D489-N492 PolarHBondContact O-N 3.45Å; I490-N492 PolarHBondContact O-N 2.84Å; N492-L495 PolarHBondContact O-N 3.16Å; N492-K496 WeakPolarHBondContact O-CB 3.37Å; N492-K496 PolarHBondContact O-N 2.96Å; N492-I525 WeakPolarHBondContact OD1-CG2 3.5Å
493N98.4Very high95.5Very high39 Ų3939 Ų3921%0.20921%0.207CC..Hα-helixtrans-69-38.2178.4-79.2-33.4000112.4D446 V449 D489 I490 L495 K496 T497D446-N493 PolarHBondContact OD1-ND2 2.94Å; D446-N493 PolarHBondContact OD2-ND2 3.11Å; V449-N493 HydrophobicContact CG2-CB 3.85Å; D489-N493 WeakPolarHBondContact O-CB 3.28Å; D489-N493 PolarHBondContact O-N 2.9Å; I490-N493 PolarHBondContact O-N 3.44Å; N493-L495 VanDerWaalsContact C-N 3.33Å; N493-L495 PolarHBondContact O-N 2.97Å; N493-K496 PolarHBondContact O-N 3.24Å; N493-T497 WeakPolarHBondContact O-CB 3.41Å; N493-T497 PolarHBondContact O-N 3.45Å; N493-T497 PolarHBondContact O-OG1 3.24Å
494M98.3Very high95.2Very high0 Ų040 Ų400%021%0.214CC..Hα-helixtrans-57-46.2170.3-73.6-179.679.100111.7V449 V455 I458 T459 F465 I490 M491 T497 Y498 I521V449-M494 HydrophobicContact CB-CG 3.55Å; V449-M494 HydrophobicContact CG1-CG 3.46Å; V449-M494 VanDerWaalsContact CG1-CG 3.46Å; V449-M494 HydrophobicContact CG1-SD 4.08Å; V449-M494 HydrophobicContact CG2-CG 4.05Å; V455-M494 HydrophobicContact CG1-CE 4.06Å; V455-M494 HydrophobicContact CG2-CB 4.5Å; V455-M494 HydrophobicContact CG2-CG 4.33Å; I458-M494 HydrophobicContact CG2-CE 4.32Å; T459-M494 HydrophobicContact CG2-CE 3.5Å; F465-M494 HydrophobicContact CD2-CE 4.27Å; F465-M494 HydrophobicContact CE2-CE 4.24Å; I490-M494 HydrophobicContact CG2-CG 4.39Å; I490-M494 HydrophobicContact CG2-SD 4.15Å; I490-M494 VanDerWaalsContact O-CG 3.3Å; I490-M494 WeakPolarHBondContact O-CG 3.44Å; I490-M494 PolarHBondContact O-N 3.05Å; M491-M494 PolarHBondContact O-N 3.13Å; M491-M494 HydrophobicContact SD-SD 4.3Å; M494-T497 PolarHBondContact O-N 3.13Å; M494-Y498 WeakPolarHBondContact O-CB 3.42Å; M494-Y498 PolarHBondContact O-N 3.16Å; M494-I521 HydrophobicContact CB-CD1 4.45Å; M494-I521 HydrophobicContact CE-CD1 4.06Å
495L97.9Very high94.8Very high21 Ų2148.4 Ų48.411%0.1125%0.253CS..Hα-helixtrans-66.3-41178.4-178.960.9000112M491 N492 N493 Y498 K499 L518 I521 Q522 I525M491-L495 PolarHBondContact O-N 3.05Å; N492-L495 PolarHBondContact O-N 3.16Å; N493-L495 VanDerWaalsContact C-N 3.33Å; N493-L495 PolarHBondContact O-N 2.97Å; L495-Y498 PolarHBondContact O-N 3.42Å; L495-K499 HydrophobicContact CG-CD 4.43Å; L495-K499 WeakPolarHBondContact O-CG 3.33Å; L495-K499 PolarHBondContact O-N 3.36Å; L495-L518 HydrophobicContact CD1-CD1 3.8Å; L495-I521 HydrophobicContact CB-CG2 4.1Å; L495-Q522 HydrophobicContact CD1-CG 4.37Å; L495-I525 HydrophobicContact CB-CD1 3.98Å; L495-I525 HydrophobicContact CD2-CD1 3.66Å; L495-I525 HydrophobicContact CG-CD1 4.46Å
496K96.1Very high94.4Very high115 Ų11548.6 Ų48.650%0.525%0.251SS..Hα-helixtrans-61-48.6175.9-176.7-179.5178.5-1780110.7N492 N493 K499 V500N492-K496 WeakPolarHBondContact O-CB 3.37Å; N492-K496 PolarHBondContact O-N 2.96Å; N493-K496 PolarHBondContact O-N 3.24Å; K496-K499 PolarHBondContact O-N 2.81Å; K496-V500 WeakPolarHBondContact O-CG2 3.28Å; K496-V500 PolarHBondContact O-N 3.17Å; K496-V500 VanDerWaalsContact O-N 3.15Å
497T96.6Very high94Very high1 Ų155.4 Ų55.41%0.00628%0.276CS..Hα-helixtrans-61.7-48.3177.5-60.20000110.8V449 T450 V455 N493 M494 K499 V500 W501 L512V449-T497 WeakPolarHBondContact O-CB 3.42Å; V449-T497 PolarHBondContact O-OG1 3.07Å; T450-T497 PolarHBondContact O-OG1 2.85Å; V455-T497 HydrophobicContact CG2-CG2 3.66Å; N493-T497 WeakPolarHBondContact O-CB 3.41Å; N493-T497 PolarHBondContact O-N 3.45Å; N493-T497 PolarHBondContact O-OG1 3.24Å; M494-T497 PolarHBondContact O-N 3.13Å; T497-K499 VanDerWaalsContact C-N 3.31Å; T497-K499 PolarHBondContact O-N 2.81Å; T497-V500 PolarHBondContact O-N 3.49Å; T497-W501 PolarHBondContact O-N 3.45Å; T497-W501 VanDerWaalsContact O-N 3.12Å; T497-L512 HydrophobicContact CG2-CD1 4.46Å
498Y96.5Very high93.5Very high54 Ų5456.8 Ų56.821%0.21229%0.286CS..Hα-helixtrans-52.5-47.8175.5171.7-98.4000112.4M494 L495 V500 W501 S502 L512 I513 L518M494-Y498 WeakPolarHBondContact O-CB 3.42Å; M494-Y498 PolarHBondContact O-N 3.16Å; L495-Y498 PolarHBondContact O-N 3.42Å; Y498-V500 PolarHBondContact O-N 3Å; Y498-W501 PolarHBondContact O-N 2.99Å; Y498-S502 WeakPolarHBondContact O-CB 3.44Å; Y498-S502 PolarHBondContact O-N 3.14Å; Y498-S502 PolarHBondContact O-OG 3.1Å; Y498-L512 HydrophobicContact CD2-CB 4.5Å; Y498-I513 HydrophobicContact CD2-CB 3.95Å; Y498-I513 HydrophobicContact CD2-CD1 4.06Å; Y498-I513 HydrophobicContact CD2-CG1 3.95Å; Y498-I513 HydrophobicContact CE2-CB 4.25Å; Y498-I513 HydrophobicContact CG-CD1 4.1Å; Y498-L518 HydrophobicContact CD1-CD1 3.82Å; Y498-L518 HydrophobicContact CE1-CD1 3.82Å; Y498-L518 HydrophobicContact CE1-CD2 3.73Å; Y498-L518 HydrophobicContact CE1-CG 4.43Å; Y498-L518 HydrophobicContact CG-CD1 4.41Å
499K94.5Very high93.2Very high125 Ų12555.9 Ų55.954%0.54328%0.281SS..Hα-helixtrans-60.2-46.4179.8-74.6173.6178.4178.90112.2L495 K496 T497 W501 S502L495-K499 HydrophobicContact CG-CD 4.43Å; L495-K499 WeakPolarHBondContact O-CG 3.33Å; L495-K499 PolarHBondContact O-N 3.36Å; K496-K499 PolarHBondContact O-N 2.81Å; T497-K499 VanDerWaalsContact C-N 3.31Å; T497-K499 PolarHBondContact O-N 2.81Å; K499-W501 VanDerWaalsContact C-N 3.31Å; K499-W501 PolarHBondContact O-N 3.1Å; K499-S502 PolarHBondContact O-OG 3.44Å; K499-S502 VanDerWaalsContact O-OG 3.04Å
500V92.5Very high92.7Very high57 Ų5756 Ų5635%0.34528%0.28SS..Hα-helixtrans-57.8-44178.81710000111.3L385 K496 T497 Y498L385-V500 HydrophobicContact CD1-CG1 3.83Å; K496-V500 WeakPolarHBondContact O-CG2 3.28Å; K496-V500 PolarHBondContact O-N 3.17Å; K496-V500 VanDerWaalsContact O-N 3.15Å; T497-V500 PolarHBondContact O-N 3.49Å; Y498-V500 PolarHBondContact O-N 3Å
501W94.1Very high92.1Very high3 Ų362.2 Ų62.21%0.01131%0.313CS..Hα-helixtrans-89.8-26.1-172.3-69.799.6000114.6L385 F386 A389 P452 T497 Y498 K499 C503 S504 Y506 F509 L512L385-W501 HydrophobicContact CB-CH2 4Å; L385-W501 HydrophobicContact CB-CZ2 3.96Å; F386-W501 HydrophobicContact CB-CH2 4.32Å; F386-W501 HydrophobicContact CD2-CZ3 4.34Å; A389-W501 HydrophobicContact CB-CH2 4.13Å; A389-W501 HydrophobicContact CB-CZ2 4.07Å; P452-W501 HydrophobicContact CB-CD2 3.89Å; P452-W501 HydrophobicContact CB-CG 3.86Å; P452-W501 HydrophobicContact CB-CZ2 4.47Å; P452-W501 HydrophobicContact CG-CD2 3.98Å; P452-W501 HydrophobicContact CG-CG 4.43Å; P452-W501 HydrophobicContact CG-CH2 4.25Å; P452-W501 HydrophobicContact CG-CZ2 3.68Å; T497-W501 PolarHBondContact O-N 3.45Å; T497-W501 VanDerWaalsContact O-N 3.12Å; Y498-W501 PolarHBondContact O-N 2.99Å; K499-W501 VanDerWaalsContact C-N 3.31Å; K499-W501 PolarHBondContact O-N 3.1Å; W501-C503 PolarHBondContact O-N 3.34Å; W501-S504 WeakPolarHBondContact O-CB 3.33Å; W501-S504 PolarHBondContact O-N 3.09Å; W501-S504 PolarHBondContact O-OG 3.38Å; W501-Y506 HydrophobicContact CE3-CD2 4.42Å; W501-Y506 HydrophobicContact CH2-CD2 4.49Å; W501-Y506 AromaticContact CZ3-CD2 3.67Å; W501-Y506 HydrophobicContact CZ3-CD2 3.67Å; W501-Y506 HydrophobicContact CZ3-CE2 4.5Å; W501-Y506 HydrophobicContact CZ3-CG 4.18Å; W501-F509 HydrophobicContact CB-CB 4.47Å; W501-F509 WeakPolarHBondContact CB-O 3.24Å; W501-F509 HydrophobicContact CD2-CB 4.05Å; W501-F509 HydrophobicContact CE3-CB 3.51Å; W501-F509 HydrophobicContact CE3-CD2 4.02Å; W501-F509 HydrophobicContact CE3-CG 4.14Å; W501-F509 HydrophobicContact CG-CB 4.47Å; W501-F509 HydrophobicContact CH2-CD2 4.14Å; W501-F509 HydrophobicContact CZ3-CB 4.06Å; W501-F509 AromaticContact CZ3-CD2 3.65Å; W501-F509 HydrophobicContact CZ3-CD2 3.65Å; W501-F509 HydrophobicContact CZ3-CG 4.25Å; W501-L512 HydrophobicContact CB-CD1 3.83Å; W501-L512 HydrophobicContact CG-CD1 4.25Å
502S90.2Very high91.9Very high40 Ų4062.4 Ų62.428%0.2831%0.314SS..Hα-helixtrans-61.1-27.6177.565.10000113.3Y498 K499Y498-S502 WeakPolarHBondContact O-CB 3.44Å; Y498-S502 PolarHBondContact O-N 3.14Å; Y498-S502 PolarHBondContact O-OG 3.1Å; K499-S502 PolarHBondContact O-OG 3.44Å; K499-S502 VanDerWaalsContact O-OG 3.04Å
503C84.3Confident91.7Very high117 Ų11760 Ų6079%0.79130%0.301SS*.THydrogen-bonded Turntrans-102.84.2176.8-60.40000113.2W501W501-C503 PolarHBondContact O-N 3.34Å
504S86.3Confident91.4Very high21 Ų2162.1 Ų62.115%0.14731%0.312CS..SBendtrans-78.7157.3-176.8750000112.4W501 Y506 Q510W501-S504 WeakPolarHBondContact O-CB 3.33Å; W501-S504 PolarHBondContact O-N 3.09Å; W501-S504 PolarHBondContact O-OG 3.38Å; S504-Y506 PolarHBondContact O-N 3.31Å; S504-Q510 PolarHBondContact O-NE2 3.37Å
505E86.4Confident91.2Very high179 Ų17972.7 Ų72.784%0.83635%0.352SS*.SBendtrans-72.7-14.7175.8-59.7-176.3170.900112.8K507E505-K507 PolarHBondContact O-N 2.95Å; E505-K507 VanDerWaalsContact O-N 3.15Å
506Y87.4Confident91.2Very high79 Ų7978.5 Ų78.531%0.3138%0.379SS..  trans-83.790.6-175.6-53.7-72.9000111.8F386 W501 S504 S508 F509F386-Y506 HydrophobicContact CB-CD1 3.91Å; F386-Y506 HydrophobicContact CB-CD2 3.98Å; F386-Y506 HydrophobicContact CB-CE1 3.57Å; F386-Y506 HydrophobicContact CB-CE2 3.65Å; F386-Y506 HydrophobicContact CB-CG 4.1Å; F386-Y506 VanDerWaalsContact CB-CZ 3.43Å; F386-Y506 HydrophobicContact CD1-CD1 4.19Å; F386-Y506 HydrophobicContact CD1-CE1 4.01Å; F386-Y506 AromaticContact CD2-CD1 3.35Å; F386-Y506 HydrophobicContact CD2-CD1 3.35Å; F386-Y506 HydrophobicContact CD2-CD2 4.11Å; F386-Y506 AromaticContact CD2-CE1 3.9Å; F386-Y506 HydrophobicContact CD2-CE1 3.9Å; F386-Y506 AromaticContact CD2-CG 3.47Å; F386-Y506 HydrophobicContact CD2-CG 3.47Å; F386-Y506 VanDerWaalsContact CD2-CG 3.47Å; F386-Y506 AromaticContact CE2-CD1 3.85Å; F386-Y506 HydrophobicContact CE2-CD1 3.85Å; F386-Y506 HydrophobicContact CE2-CG 4.14Å; F386-Y506 AromaticContact CG-CD1 3.54Å; F386-Y506 HydrophobicContact CG-CD1 3.54Å; F386-Y506 HydrophobicContact CG-CD2 4.36Å; F386-Y506 AromaticContact CG-CE1 3.55Å; F386-Y506 HydrophobicContact CG-CE1 3.55Å; F386-Y506 HydrophobicContact CG-CE2 4.36Å; F386-Y506 AromaticContact CG-CG 3.96Å; F386-Y506 HydrophobicContact CG-CG 3.96Å; F386-Y506 AromaticContact CG-CZ 3.98Å; F386-Y506 HydrophobicContact CZ-CD1 4.45Å; W501-Y506 HydrophobicContact CE3-CD2 4.42Å; W501-Y506 HydrophobicContact CH2-CD2 4.49Å; W501-Y506 AromaticContact CZ3-CD2 3.67Å; W501-Y506 HydrophobicContact CZ3-CD2 3.67Å; W501-Y506 HydrophobicContact CZ3-CE2 4.5Å; W501-Y506 HydrophobicContact CZ3-CG 4.18Å; S504-Y506 PolarHBondContact O-N 3.31Å; Y506-S508 PolarHBondContact O-N 2.99Å; Y506-F509 PolarHBondContact O-N 2.95Å
507K86.2Confident91.2Very high166 Ų16674.6 Ų74.672%0.72236%0.362SS*.G310 helixtrans-52.1-33.2-177.9-67-176.9-179.6177.40114.4E505 F509 Q510E505-K507 PolarHBondContact O-N 2.95Å; E505-K507 VanDerWaalsContact O-N 3.15Å; K507-F509 PolarHBondContact O-N 3.21Å; K507-F509 VanDerWaalsContact O-N 3.09Å; K507-Q510 PolarHBondContact O-N 3.44Å
508S86.7Confident91.2Very high29 Ų2975.7 Ų75.720%0.20337%0.368CS..G310 helixtrans-62.2-13.9177.658.10000113.8E413 R456 Y506E413-S508 VanDerWaalsContact OE1-O 3.12Å; R456-S508 PolarHBondContact NH1-O 2.95Å; R456-S508 PolarHBondContact NH2-O 3.45Å; Y506-S508 PolarHBondContact O-N 2.99Å
509F91.3Very high91.2Very high0 Ų080.3 Ų80.30%039%0.389CS..G310 helixtrans-126.912-180-64.4-53.2000113.9F386 A389 I390 V412 P452 W453 W501 Y506 K507 L512F386-F509 AromaticContact CD2-CD2 3.94Å; F386-F509 HydrophobicContact CD2-CD2 3.94Å; F386-F509 AromaticContact CD2-CE2 3.84Å; F386-F509 HydrophobicContact CD2-CE2 3.84Å; F386-F509 AromaticContact CE2-CD2 3.96Å; F386-F509 HydrophobicContact CE2-CD2 3.96Å; F386-F509 AromaticContact CE2-CE2 3.69Å; F386-F509 HydrophobicContact CE2-CE2 3.69Å; A389-F509 HydrophobicContact CB-CE2 3.99Å; A389-F509 HydrophobicContact CB-CZ 4.25Å; I390-F509 HydrophobicContact CD1-CE2 4.17Å; I390-F509 HydrophobicContact CD1-CZ 4.11Å; V412-F509 HydrophobicContact CG1-CE1 3.68Å; V412-F509 HydrophobicContact CG1-CZ 3.65Å; P452-F509 HydrophobicContact CB-CB 3.93Å; P452-F509 HydrophobicContact CB-CD1 3.65Å; P452-F509 HydrophobicContact CB-CD2 4.48Å; P452-F509 HydrophobicContact CB-CE1 4.26Å; P452-F509 HydrophobicContact CB-CG 3.78Å; P452-F509 HydrophobicContact CG-CB 4.33Å; P452-F509 HydrophobicContact CG-CD1 3.74Å; P452-F509 HydrophobicContact CG-CD2 3.99Å; P452-F509 HydrophobicContact CG-CE1 3.94Å; P452-F509 HydrophobicContact CG-CE2 4.17Å; P452-F509 HydrophobicContact CG-CG 3.76Å; P452-F509 HydrophobicContact CG-CZ 4.15Å; W453-F509 HydrophobicContact CB-CE1 4.11Å; W501-F509 HydrophobicContact CB-CB 4.47Å; W501-F509 WeakPolarHBondContact CB-O 3.24Å; W501-F509 HydrophobicContact CD2-CB 4.05Å; W501-F509 HydrophobicContact CE3-CB 3.51Å; W501-F509 HydrophobicContact CE3-CD2 4.02Å; W501-F509 HydrophobicContact CE3-CG 4.14Å; W501-F509 HydrophobicContact CG-CB 4.47Å; W501-F509 HydrophobicContact CH2-CD2 4.14Å; W501-F509 HydrophobicContact CZ3-CB 4.06Å; W501-F509 AromaticContact CZ3-CD2 3.65Å; W501-F509 HydrophobicContact CZ3-CD2 3.65Å; W501-F509 HydrophobicContact CZ3-CG 4.25Å; Y506-F509 PolarHBondContact O-N 2.95Å; K507-F509 PolarHBondContact O-N 3.21Å; K507-F509 VanDerWaalsContact O-N 3.09Å; F509-L512 HydrophobicContact CB-CD2 4.15Å; F509-L512 HydrophobicContact CD1-CD2 4.22Å; F509-L512 VanDerWaalsContact O-CD2 3.23Å; F509-L512 WeakPolarHBondContact O-CD2 3.5Å; F509-L512 WeakPolarHBondContact O-CG 3.19Å
510Q87.6Confident91.4Very high66 Ų6677.7 Ų77.731%0.30838%0.381SS..THydrogen-bonded Turntrans-74.2-37.6176.4-73.6178.2-8.900112.6S504 K507 L512S504-Q510 PolarHBondContact O-NE2 3.37Å; K507-Q510 PolarHBondContact O-N 3.44Å; Q510-L512 PolarHBondContact O-N 3.29Å
511N87.1Confident91.7Very high131 Ų13175 Ų7570%0.70136%0.364SS*.  trans-99.164.1-173.8-66.1-37.2000112.1
512L92.9Very high91.8Very high5 Ų579.2 Ų79.23%0.02638%0.384CS..SBendtrans-81.6-39.8-178-53.9-176.4000113.6P452 V455 R456 T497 Y498 W501 F509 Q510P452-L512 HydrophobicContact CB-CD1 3.72Å; P452-L512 HydrophobicContact CB-CD2 3.89Å; P452-L512 HydrophobicContact CB-CG 4.46Å; P452-L512 WeakPolarHBondContact O-CD2 3.38Å; V455-L512 HydrophobicContact CG1-CB 4.15Å; R456-L512 HydrophobicContact CB-CD2 4.22Å; T497-L512 HydrophobicContact CG2-CD1 4.46Å; Y498-L512 HydrophobicContact CD2-CB 4.5Å; W501-L512 HydrophobicContact CB-CD1 3.83Å; W501-L512 HydrophobicContact CG-CD1 4.25Å; F509-L512 HydrophobicContact CB-CD2 4.15Å; F509-L512 HydrophobicContact CD1-CD2 4.22Å; F509-L512 VanDerWaalsContact O-CD2 3.23Å; F509-L512 WeakPolarHBondContact O-CD2 3.5Å; F509-L512 WeakPolarHBondContact O-CG 3.19Å; Q510-L512 PolarHBondContact O-N 3.29Å
513I93.9Very high92.2Very high13 Ų1381.3 Ų81.37%0.06739%0.392CS..SBendtrans-134.7134.5-171.4-50.8-177.8000108.4V455 T459 Y498 Q517 L518 I521V455-I513 HydrophobicContact CG1-CD1 3.52Å; V455-I513 HydrophobicContact CG1-CG1 3.48Å; V455-I513 VanDerWaalsContact CG1-CG1 3.48Å; T459-I513 HydrophobicContact CG2-CG1 4.47Å; Y498-I513 HydrophobicContact CD2-CB 3.95Å; Y498-I513 HydrophobicContact CD2-CD1 4.06Å; Y498-I513 HydrophobicContact CD2-CG1 3.95Å; Y498-I513 HydrophobicContact CE2-CB 4.25Å; Y498-I513 HydrophobicContact CG-CD1 4.1Å; I513-Q517 HydrophobicContact CG2-CB 3.37Å; I513-L518 HydrophobicContact CG2-CB 4.15Å; I513-I521 HydrophobicContact CD1-CD1 3.63Å; I513-I521 HydrophobicContact CG2-CD1 4.18Å
514D93.7Very high92.8Very high82 Ų8276 Ų7644%0.43936%0.355SS..  trans-76.9170.4174.573.551.1000112.7Q516 Q517 L518D514-Q516 VanDerWaalsContact C-N 3.29Å; D514-Q516 PolarHBondContact O-N 2.96Å; D514-Q516 WeakPolarHBondContact OD1-CA 3.47Å; D514-Q516 WeakPolarHBondContact OD1-CB 3.29Å; D514-Q516 PolarHBondContact OD1-N 2.72Å; D514-Q517 PolarHBondContact O-N 3.34Å; D514-Q517 WeakPolarHBondContact OD1-CG 3.37Å; D514-Q517 PolarHBondContact OD1-N 3.34Å; D514-Q517 WeakPolarHBondContact OD2-CG 3.44Å; D514-Q517 PolarHBondContact OD2-OE1 3.23Å; D514-L518 WeakPolarHBondContact O-CB 3.35Å; D514-L518 PolarHBondContact O-N 3.26Å
515R94.1Very high93.3Very high223 Ų22376.9 Ų76.984%0.84236%0.358SS*.Hα-helixtrans-63.5-31-176.9-69.7-176.5179.1-179.80.1113.6K519R515-K519 VanDerWaalsContact O-CG 3.31Å; R515-K519 WeakPolarHBondContact O-CG 3.48Å; R515-K519 PolarHBondContact O-N 3.36Å
516Q96.2Very high93.8Very high143 Ų14376.9 Ų76.967%0.66836%0.355SS*.Hα-helixtrans-77.5-47.4-179.4179175.7-14.500110.3D514 L518 K519 L520D514-Q516 VanDerWaalsContact C-N 3.29Å; D514-Q516 PolarHBondContact O-N 2.96Å; D514-Q516 WeakPolarHBondContact OD1-CA 3.47Å; D514-Q516 WeakPolarHBondContact OD1-CB 3.29Å; D514-Q516 PolarHBondContact OD1-N 2.72Å; Q516-L518 VanDerWaalsContact C-N 3.31Å; Q516-L518 PolarHBondContact O-N 2.98Å; Q516-K519 WeakPolarHBondContact O-CB 3.47Å; Q516-K519 PolarHBondContact O-N 3.23Å; Q516-L520 WeakPolarHBondContact O-CG 3.41Å; Q516-L520 PolarHBondContact O-N 3.33Å
517Q96.4Very high94.1Very high32 Ų3276 Ų7615%0.1535%0.354CS..Hα-helixtrans-58.4-43.3175.1-68.2174.5-20.700111.4T459 F465 I513 D514 K519 L520 I521T459-Q517 PolarHBondContact O-NE2 3.01Å; T459-Q517 VanDerWaalsContact O-NE2 3.09Å; F465-Q517 HydrophobicContact CD1-CG 4.38Å; F465-Q517 HydrophobicContact CE1-CB 4.06Å; F465-Q517 HydrophobicContact CE1-CG 3.88Å; F465-Q517 HydrophobicContact CZ-CB 4.14Å; F465-Q517 HydrophobicContact CZ-CG 4.43Å; I513-Q517 HydrophobicContact CG2-CB 3.37Å; D514-Q517 PolarHBondContact O-N 3.34Å; D514-Q517 WeakPolarHBondContact OD1-CG 3.37Å; D514-Q517 PolarHBondContact OD1-N 3.34Å; D514-Q517 WeakPolarHBondContact OD2-CG 3.44Å; D514-Q517 PolarHBondContact OD2-OE1 3.23Å; Q517-K519 VanDerWaalsContact C-N 3.34Å; Q517-K519 PolarHBondContact O-N 2.85Å; Q517-L520 PolarHBondContact O-N 3.48Å; Q517-L520 VanDerWaalsContact O-N 3.15Å; Q517-I521 WeakPolarHBondContact O-CG1 3.2Å; Q517-I521 PolarHBondContact O-N 3.05Å
518L96.9Very high94.4Very high25 Ų2569.1 Ų69.113%0.13133%0.33CS..Hα-helixtrans-60-42.6176.8-179.563.8000112.1L495 Y498 I513 D514 Q516 L520 I521 Q522L495-L518 HydrophobicContact CD1-CD1 3.8Å; Y498-L518 HydrophobicContact CD1-CD1 3.82Å; Y498-L518 HydrophobicContact CE1-CD1 3.82Å; Y498-L518 HydrophobicContact CE1-CD2 3.73Å; Y498-L518 HydrophobicContact CE1-CG 4.43Å; Y498-L518 HydrophobicContact CG-CD1 4.41Å; I513-L518 HydrophobicContact CG2-CB 4.15Å; D514-L518 WeakPolarHBondContact O-CB 3.35Å; D514-L518 PolarHBondContact O-N 3.26Å; Q516-L518 VanDerWaalsContact C-N 3.31Å; Q516-L518 PolarHBondContact O-N 2.98Å; L518-L520 VanDerWaalsContact C-N 3.33Å; L518-L520 PolarHBondContact O-N 3.43Å; L518-I521 PolarHBondContact O-N 3.16Å; L518-Q522 HydrophobicContact CD1-CG 4.37Å; L518-Q522 WeakPolarHBondContact O-CB 3.33Å; L518-Q522 VanDerWaalsContact O-CG 3.28Å; L518-Q522 WeakPolarHBondContact O-CG 3.45Å; L518-Q522 PolarHBondContact O-N 3.16Å
519K97.6Very high94.5Very high150 Ų15069.1 Ų69.165%0.65233%0.327SS*.Hα-helixtrans-62-41.1175.6-75.8173.7-179.1-176.90111.7R515 Q516 Q517 Q522 L523R515-K519 VanDerWaalsContact O-CG 3.31Å; R515-K519 WeakPolarHBondContact O-CG 3.48Å; R515-K519 PolarHBondContact O-N 3.36Å; Q516-K519 WeakPolarHBondContact O-CB 3.47Å; Q516-K519 PolarHBondContact O-N 3.23Å; Q517-K519 VanDerWaalsContact C-N 3.34Å; Q517-K519 PolarHBondContact O-N 2.85Å; K519-Q522 PolarHBondContact O-N 2.9Å; K519-L523 VanDerWaalsContact O-CB 3.24Å; K519-L523 WeakPolarHBondContact O-CB 3.49Å; K519-L523 PolarHBondContact O-N 2.71Å
520L97.7Very high94.3Very high71 Ų7175.1 Ų75.137%0.37235%0.35SS..Hα-helixtrans-64.9-43.2177.9-68.6172.2000111.9F465 L469 Q516 Q517 L518 L523 Y524F465-L520 HydrophobicContact CE1-CD1 4.17Å; F465-L520 HydrophobicContact CZ-CB 4.39Å; L469-L520 HydrophobicContact CD1-CB 3.9Å; L469-L520 HydrophobicContact CD1-CD1 4.02Å; L469-L520 HydrophobicContact CD1-CG 4.48Å; Q516-L520 WeakPolarHBondContact O-CG 3.41Å; Q516-L520 PolarHBondContact O-N 3.33Å; Q517-L520 PolarHBondContact O-N 3.48Å; Q517-L520 VanDerWaalsContact O-N 3.15Å; L518-L520 VanDerWaalsContact C-N 3.33Å; L518-L520 PolarHBondContact O-N 3.43Å; L520-L523 PolarHBondContact O-N 2.72Å; L520-Y524 WeakPolarHBondContact O-CB 3.22Å; L520-Y524 PolarHBondContact O-N 2.78Å
521I97.9Very high94.2Very high0 Ų072.6 Ų72.60%034%0.342CS..Hα-helixtrans-61.4-49.2175.8-66.5167.7000110.5F465 M491 M494 L495 I513 Q517 L518 L523 Y524 I525F465-I521 HydrophobicContact CE2-CD1 3.96Å; F465-I521 HydrophobicContact CE2-CG1 3.73Å; F465-I521 HydrophobicContact CZ-CD1 4.18Å; F465-I521 HydrophobicContact CZ-CG1 3.79Å; M491-I521 HydrophobicContact CB-CG2 4.4Å; M491-I521 HydrophobicContact SD-CG1 3.94Å; M491-I521 HydrophobicContact SD-CG2 4.39Å; M494-I521 HydrophobicContact CB-CD1 4.45Å; M494-I521 HydrophobicContact CE-CD1 4.06Å; L495-I521 HydrophobicContact CB-CG2 4.1Å; I513-I521 HydrophobicContact CD1-CD1 3.63Å; I513-I521 HydrophobicContact CG2-CD1 4.18Å; Q517-I521 WeakPolarHBondContact O-CG1 3.2Å; Q517-I521 PolarHBondContact O-N 3.05Å; L518-I521 PolarHBondContact O-N 3.16Å; I521-L523 VanDerWaalsContact C-N 3.32Å; I521-L523 PolarHBondContact O-N 2.95Å; I521-Y524 PolarHBondContact O-N 3.25Å; I521-I525 HydrophobicContact CG2-CD1 3.8Å; I521-I525 WeakPolarHBondContact O-CG1 3.29Å; I521-I525 PolarHBondContact O-N 3.12Å
522Q97.9Very high93.8Very high92 Ų9271.2 Ų71.243%0.4334%0.338SS..Hα-helixtrans-61.6-40.8179.1-73.3174.9-16.300112.1L495 L518 K519 K526L495-Q522 HydrophobicContact CD1-CG 4.37Å; L518-Q522 HydrophobicContact CD1-CG 4.37Å; L518-Q522 WeakPolarHBondContact O-CB 3.33Å; L518-Q522 VanDerWaalsContact O-CG 3.28Å; L518-Q522 WeakPolarHBondContact O-CG 3.45Å; L518-Q522 PolarHBondContact O-N 3.16Å; K519-Q522 PolarHBondContact O-N 2.9Å; Q522-K526 VanDerWaalsContact O-CB 3.28Å; Q522-K526 WeakPolarHBondContact O-CB 3.39Å; Q522-K526 PolarHBondContact O-N 2.93Å
523L97Very high92.2Very high84 Ų8476.6 Ų76.644%0.4437%0.371SS..Hα-helixtrans-64.9-47.7176-177.862.7000110.8K519 L520 I521 I525 K526 E527K519-L523 VanDerWaalsContact O-CB 3.24Å; K519-L523 WeakPolarHBondContact O-CB 3.49Å; K519-L523 PolarHBondContact O-N 2.71Å; L520-L523 PolarHBondContact O-N 2.72Å; I521-L523 VanDerWaalsContact C-N 3.32Å; I521-L523 PolarHBondContact O-N 2.95Å; L523-I525 VanDerWaalsContact C-N 3.33Å; L523-I525 PolarHBondContact O-N 3.42Å; L523-K526 PolarHBondContact O-N 2.91Å; L523-K526 VanDerWaalsContact O-N 3.16Å; L523-E527 HydrophobicContact CD1-CG 4.12Å; L523-E527 HydrophobicContact CG-CG 4.36Å; L523-E527 VanDerWaalsContact O-CG 3.29Å; L523-E527 WeakPolarHBondContact O-CG 3.41Å; L523-E527 PolarHBondContact O-N 3.31Å
524Y96.9Very high90.1Very high5 Ų584.8 Ų84.82%0.0241%0.406CS..Hα-helixtrans-55.5-48.4178.1-172.2-78.2000111.5L469 R471 K487 L488 M491 L520 I521 K526 E527 G528L469-Y524 HydrophobicContact CD2-CD2 3.8Å; L469-Y524 HydrophobicContact CD2-CG 4.06Å; L469-Y524 VanDerWaalsContact O-CE2 3.23Å; L469-Y524 WeakPolarHBondContact O-CE2 3.39Å; R471-Y524 HydrophobicContact CG-CE2 3.8Å; R471-Y524 VanDerWaalsContact CZ-CE2 3.49Å; R471-Y524 PolarHBondContact NH2-O 2.93Å; K487-Y524 WeakPolarHBondContact CB-OH 3.45Å; L488-Y524 HydrophobicContact CB-CE1 4.27Å; L488-Y524 HydrophobicContact CD1-CD1 4.1Å; L488-Y524 HydrophobicContact CD1-CE1 4.04Å; M491-Y524 HydrophobicContact CB-CD1 4.14Å; M491-Y524 HydrophobicContact CG-CD1 3.72Å; M491-Y524 HydrophobicContact CG-CE1 4.03Å; M491-Y524 HydrophobicContact CG-CG 4.21Å; L520-Y524 WeakPolarHBondContact O-CB 3.22Å; L520-Y524 PolarHBondContact O-N 2.78Å; I521-Y524 PolarHBondContact O-N 3.25Å; Y524-K526 PolarHBondContact O-N 3.42Å; Y524-E527 PolarHBondContact O-N 3.15Å; Y524-G528 PolarHBondContact O-N 3.31Å
525I97.2Very high87.8Confident39 Ų3985.9 Ų85.920%0.242%0.42CS..Hα-helixtrans-62-44.9177.9-66.4164.4000110.9L488 M491 N492 L495 I521 L523 E527 G528L488-I525 HydrophobicContact CD1-CG1 4.41Å; M491-I525 HydrophobicContact CB-CD1 4.31Å; M491-I525 HydrophobicContact CB-CG1 3.95Å; N492-I525 WeakPolarHBondContact OD1-CG2 3.5Å; L495-I525 HydrophobicContact CB-CD1 3.98Å; L495-I525 HydrophobicContact CD2-CD1 3.66Å; L495-I525 HydrophobicContact CG-CD1 4.46Å; I521-I525 HydrophobicContact CG2-CD1 3.8Å; I521-I525 WeakPolarHBondContact O-CG1 3.29Å; I521-I525 PolarHBondContact O-N 3.12Å; L523-I525 VanDerWaalsContact C-N 3.33Å; L523-I525 PolarHBondContact O-N 3.42Å; I525-E527 VanDerWaalsContact C-N 3.31Å; I525-E527 PolarHBondContact O-N 3.38Å; I525-G528 PolarHBondContact O-N 3.29Å; I525-G528 VanDerWaalsContact O-N 3.1Å
526K96.4Very high85.4Confident180 Ų18084.1 Ų84.178%0.78342%0.421SS*.Hα-helixtrans-61.3-39.3179.9-178.5-176.2176-174.30112.3Q522 L523 Y524 G528Q522-K526 VanDerWaalsContact O-CB 3.28Å; Q522-K526 WeakPolarHBondContact O-CB 3.39Å; Q522-K526 PolarHBondContact O-N 2.93Å; L523-K526 PolarHBondContact O-N 2.91Å; L523-K526 VanDerWaalsContact O-N 3.16Å; Y524-K526 PolarHBondContact O-N 3.42Å; K526-G528 PolarHBondContact O-N 3.38Å
527E94.8Very high82.9Confident60 Ų6081.1 Ų81.128%0.2842%0.421SS..Hα-helixtrans-75.9-13178.2-63.2176.216400113.2R471 L523 Y524 I525 V532R471-E527 IonicContact CZ-OE2 3.22Å; R471-E527 IonicContact NH1-OE2 3.16Å; R471-E527 PolarHBondContact NH1-OE2 3.28Å; R471-E527 IonicContact NH2-OE2 2.69Å; L523-E527 HydrophobicContact CD1-CG 4.12Å; L523-E527 HydrophobicContact CG-CG 4.36Å; L523-E527 VanDerWaalsContact O-CG 3.29Å; L523-E527 WeakPolarHBondContact O-CG 3.41Å; L523-E527 PolarHBondContact O-N 3.31Å; Y524-E527 PolarHBondContact O-N 3.15Å; I525-E527 VanDerWaalsContact C-N 3.31Å; I525-E527 PolarHBondContact O-N 3.38Å; E527-V532 HydrophobicContact CG-CG2 3.8Å
528G92Very high80.3Confident21 Ų2184.3 Ų84.322%0.21645%0.453CS..THydrogen-bonded Turntrans68.5-159.6177.700000114R471 Y524 I525 K526 W530R471-G528 PolarHBondContact NE-O 3.09Å; R471-G528 PolarHBondContact NH2-O 2.98Å; Y524-G528 PolarHBondContact O-N 3.31Å; I525-G528 PolarHBondContact O-N 3.29Å; I525-G528 VanDerWaalsContact O-N 3.1Å; K526-G528 PolarHBondContact O-N 3.38Å; G528-W530 PolarHBondContact O-N 3.14Å
529L89.8Confident77.8Confident29 Ų2989.2 Ų89.215%0.15248%0.484CS..THydrogen-bonded Turntrans-57.5-50.7-170.4-169.369.6000112.3R471 I481 M484 Q485R471-L529 WeakPolarHBondContact CD-O 3.35Å; R471-L529 PolarHBondContact NE-O 2.62Å; I481-L529 HydrophobicContact CG2-CD2 4.25Å; M484-L529 HydrophobicContact CB-CD1 3.51Å; M484-L529 HydrophobicContact CB-CG 4.11Å; M484-L529 HydrophobicContact CE-CG 4.42Å; M484-L529 WeakPolarHBondContact CE-O 3.21Å; Q485-L529 HydrophobicContact CB-CD1 4.09Å; Q485-L529 VanDerWaalsContact N-CD1 3.26Å
530W86.5Confident75.2Confident126 Ų12686 Ų8648%0.47749%0.485SS..THydrogen-bonded Turntrans-89.7-9.1-170.9-59.5111.2000114.9K480 I481 M484 G528K480-W530 HydrophobicContact CD-CH2 4.47Å; K480-W530 HydrophobicContact CD-CZ3 4.45Å; K480-W530 HydrophobicContact CG-CH2 4.44Å; I481-W530 HydrophobicContact CD1-CZ2 4.49Å; I481-W530 HydrophobicContact CG1-CH2 3.88Å; I481-W530 HydrophobicContact CG1-CZ2 3.98Å; M484-W530 HydrophobicContact CE-CD2 4.22Å; M484-W530 HydrophobicContact CE-CE3 3.46Å; M484-W530 VanDerWaalsContact CE-CE3 3.46Å; M484-W530 HydrophobicContact CE-CZ3 3.68Å; M484-W530 HydrophobicContact SD-CE3 3.99Å; M484-W530 HydrophobicContact SD-CH2 4.21Å; M484-W530 HydrophobicContact SD-CZ3 3.53Å; M484-W530 VanDerWaalsContact SD-CZ3 3.53Å; G528-W530 PolarHBondContact O-N 3.14Å
531G84.8Confident72.6Confident13 Ų1390.5 Ų90.513%0.13451%0.509CS..  trans78.3-173.8-170.200000112.1V533G531-V533 PolarHBondContact O-N 3.05Å; G531-V533 VanDerWaalsContact O-N 3.12Å
532V78Confident70Confident102 Ų10298.8 Ų98.862%0.61855%0.547SS*.  trans-67.9110.5166.2-175.70000108E527 K534E527-V532 HydrophobicContact CG-CG2 3.8Å; V532-K534 VanDerWaalsContact C-N 3.3Å; V532-K534 PolarHBondContact O-N 3.2Å
533V60.3Low67.8Low118 Ų118100.7 Ų100.772%0.71557%0.568SS**  trans-62.6100163.9-176.50000105.6G531 S535G531-V533 PolarHBondContact O-N 3.05Å; G531-V533 VanDerWaalsContact O-N 3.12Å; V533-S535 PolarHBondContact O-N 3.14Å
534K50.5Low65.3Low185 Ų185103.9 Ų103.980%0.80462%0.62SS**  trans-56.9114.6160.7-78.8-174.5177.7-179.60104V532 E536V532-K534 VanDerWaalsContact C-N 3.3Å; V532-K534 PolarHBondContact O-N 3.2Å; K534-E536 VanDerWaalsContact C-N 3.29Å; K534-E536 PolarHBondContact O-N 3.27Å
535S44.3Very low63.7Low105 Ų105108.8 Ų108.873%0.73465%0.65SS**  trans-50104.3167.152.20000105.8V533 A537V533-S535 PolarHBondContact O-N 3.14Å; S535-A537 VanDerWaalsContact C-N 3.33Å; S535-A537 PolarHBondContact O-N 3Å
536E44.8Very low61.9Low186 Ų186112.5 Ų112.587%0.86967%0.674SS**  trans-57.6111.5164.6-77.2-178.1163.700103.7K534 A538K534-E536 VanDerWaalsContact C-N 3.29Å; K534-E536 PolarHBondContact O-N 3.27Å; E536-A538 PolarHBondContact O-N 3.16Å
537A42.8Very low60Low81 Ų81108.7 Ų108.767%0.66967%0.668SS**  trans-50.9113.9171.400000104.7S535 V539S535-A537 VanDerWaalsContact C-N 3.33Å; S535-A537 PolarHBondContact O-N 3Å; A537-V539 PolarHBondContact O-N 2.93Å
538A42.7Very low58Low99 Ų99111.6 Ų111.682%0.81869%0.691SS**  trans-56.198168.400000104.9E536 A540E536-A538 PolarHBondContact O-N 3.16Å; A538-A540 PolarHBondContact O-N 2.96Å
539V43.4Very low55.9Low128 Ų128117.3 Ų117.378%0.77672%0.72SS**  trans-63.1102.6169.31770000102.6A537 L541A537-V539 PolarHBondContact O-N 2.93Å; V539-L541 PolarHBondContact O-N 2.94Å
540A43.8Very low53.6Low81 Ų81123.1 Ų123.167%0.66976%0.758SS**  trans-52109.5170.100000105.5A538 E542A538-A540 PolarHBondContact O-N 2.96Å; A540-E542 PolarHBondContact O-N 2.58Å
541L42.7Very low51.2Low167 Ų167122.9 Ų122.987%0.87478%0.778SS**  trans-59.898.1162.4-82.9152.2000104.7V539V539-L541 PolarHBondContact O-N 2.94Å
542E43.1Very low48.7Very low174 Ų174131.4 Ų131.481%0.81383%0.828SS**  trans-59.2127.3167.4-76-172.116300107.1A540 G544A540-E542 PolarHBondContact O-N 2.58Å; E542-G544 PolarHBondContact O-N 3.39Å
543P52.6Low46.2Very low132 Ų132133.8 Ų133.886%0.85785%0.846SS**  trans-67.6106.1175.126.2-29.9000108.3
544G43.4Very low44.9Very low150 Ų150135.3 Ų135.3100%1.54686%0.857SS**  trans-87.70164.300000111.1E542E542-G544 PolarHBondContact O-N 3.39Å

Retrieved 544 of 544 residues in 1264.5 ms (Link to these results)

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