A0A061AEB3_CAEEL Loading...

MIF4G domain-containing protein

AlphaFold DB , UniProt , Accession A0A061AEB3, Species CAEEL (Caenorhabditis elegans), Gene n/a, Length 429 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
1M35.1Very low28.9Very low237 Ų237140.5 Ų140.5100%1.16783%0.831SS**  081.20-160.5177.3-16300102.2
2D25.4Very low29.3Very low149 Ų149137.9 Ų137.980%0.79783%0.825SS**  trans-130.3120.3-169.5-66.8-70000106I4D2-I4 PolarHBondContact O-N 3.48Å
3D24.6Very low30.4Very low168 Ų168133.1 Ų133.190%0.89882%0.821SS**  trans-58.4117.7179.8-76.8-47.2000110A5D3-A5 PolarHBondContact O-N 3.15Å; D3-A5 VanDerWaalsContact O-N 3.09Å
4I27.6Very low31.8Very low160 Ų160137.5 Ų137.582%0.82183%0.828SS**  trans-7696.6166.5-61.7175.5000106.3D2 V6D2-I4 PolarHBondContact O-N 3.48Å; I4-V6 PolarHBondContact O-N 3.26Å
5A26.6Very low34Very low89 Ų89134.1 Ų134.174%0.73680%0.803SS**  trans-62.9113.3166.600000108.8D3D3-A5 PolarHBondContact O-N 3.15Å; D3-A5 VanDerWaalsContact O-N 3.09Å
6V29.6Very low37.2Very low120 Ų120129.2 Ų129.273%0.72778%0.777SS**  trans-66.6124.8166.3178.70000107.4I4 I8I4-V6 PolarHBondContact O-N 3.26Å; V6-I8 PolarHBondContact O-N 3.06Å; V6-I8 VanDerWaalsContact O-N 3.09Å
7P29.2Very low40.3Very low122 Ų122126.1 Ų126.179%0.79276%0.759SS**  trans-64.8114.9174.9-16.329.2000109.5
8I29.4Very low43.2Very low160 Ų160120.2 Ų120.282%0.82172%0.722SS**  trans-75.7119.7164.9-63.1172.6000106.2V6 S10V6-I8 PolarHBondContact O-N 3.06Å; V6-I8 VanDerWaalsContact O-N 3.09Å; I8-S10 PolarHBondContact O-N 2.93Å
9A26.9Very low45.8Very low92 Ų92114.3 Ų114.376%0.7669%0.687SS**  trans-58.2120.4177.500000110.6
10S26.7Very low48.2Very low108 Ų108108.7 Ų108.776%0.75565%0.654SS**  trans-106.697.8162.257.90000107.6I8 S12I8-S10 PolarHBondContact O-N 2.93Å; S10-S12 PolarHBondContact O-N 3.21Å
11T36.7Very low50.3Low141 Ų141107.2 Ų107.287%0.86564%0.64SS**  trans-73.9107.317149.90000109.1
12S34.3Very low53.1Low109 Ų10996.3 Ų96.376%0.76259%0.586SS**  trans-151.1105155.662.40000109.8S10S10-S12 PolarHBondContact O-N 3.21Å
13G42.6Very low56.4Low75 Ų7592.3 Ų92.377%0.77357%0.568SS**SBendtrans83.7122.915900000116.6
14E50.1Low59.7Low195 Ų19585.4 Ų85.491%0.91153%0.529SS*.  trans77.3104.9174.9-60.4-175.2173.300115.8S16E14-S16 PolarHBondContact O-N 3.1Å; E14-S16 VanDerWaalsContact O-N 3.1Å
15D65.6Low62.8Low86 Ų8682.1 Ų82.146%0.4652%0.517SS..PPolyproline II helixtrans-47.1117.1161.5-99-9.8000108.3V17 K161 S163D15-V17 PolarHBondContact O-N 2.83Å; D15-K161 HydrophobicContact CB-CB 4.39Å; D15-K161 HydrophobicContact CB-CD 4.12Å; D15-K161 HydrophobicContact CB-CG 4.08Å; D15-S163 WeakPolarHBondContact OD2-CB 3.23Å; D15-S163 PolarHBondContact OD2-OG 2.84Å
16S85.2Confident66Low56 Ų5678.4 Ų78.439%0.39248%0.484SS..PPolyproline II helixtrans-59.2140.4-179.9101.50000109.3E14 E162E14-S16 PolarHBondContact O-N 3.1Å; E14-S16 VanDerWaalsContact O-N 3.1Å; S16-E162 VanDerWaalsContact O-CB 3.29Å; S16-E162 WeakPolarHBondContact O-CB 3.45Å; S16-E162 PolarHBondContact O-N 3.33Å; S16-E162 WeakPolarHBondContact OG-CB 3.46Å; S16-E162 PolarHBondContact OG-OE2 2.92Å
17V90.1Very high69Low77 Ų7777.9 Ų77.947%0.46747%0.473SS..EExtended strand (participates in β ladder)trans-103.7128.8-178.6178.70000109.4D15 E96 K159D15-V17 PolarHBondContact O-N 2.83Å; V17-E96 HydrophobicContact CG2-CG 4.39Å; V17-K159 HydrophobicContact CG1-CB 3.7Å; V17-K159 HydrophobicContact CG1-CD 4.35Å; V17-K159 HydrophobicContact CG1-CG 4.32Å
18I91.9Very high71.9Confident19 Ų1972.1 Ų72.110%0.09744%0.435CS..EExtended strand (participates in β ladder)trans-100.5134178.6-51.3177.1000108.9F20 Y50 K159 M160 E162 F165 L386I18-F20 HydrophobicContact CB-CE2 3.89Å; I18-F20 HydrophobicContact CB-CZ 4.23Å; I18-F20 HydrophobicContact CG2-CD2 4.26Å; I18-F20 HydrophobicContact CG2-CE1 4.25Å; I18-F20 HydrophobicContact CG2-CE2 3.57Å; I18-F20 HydrophobicContact CG2-CZ 3.57Å; I18-Y50 HydrophobicContact CD1-CD1 3.22Å; I18-Y50 HydrophobicContact CD1-CD2 4.1Å; I18-Y50 HydrophobicContact CD1-CE1 3.35Å; I18-Y50 HydrophobicContact CD1-CE2 4.22Å; I18-Y50 HydrophobicContact CD1-CG 3.6Å; I18-K159 WeakPolarHBondContact O-CA 3.32Å; I18-M160 PolarHBondContact N-O 3.21Å; I18-M160 PolarHBondContact O-N 3.17Å; I18-E162 HydrophobicContact CD1-CB 3.88Å; I18-E162 HydrophobicContact CD1-CG 4.04Å; I18-E162 HydrophobicContact CG1-CB 4.07Å; I18-F165 HydrophobicContact CD1-CD2 3.99Å; I18-F165 HydrophobicContact CD1-CE2 4.32Å; I18-L386 HydrophobicContact CG2-CD2 3.69Å
19S92.7Very high74.7Confident8 Ų866.7 Ų66.76%0.05641%0.411CS..EExtended strand (participates in β ladder)trans-106.1129.8177.2-161.50000111.5E157 S387S19-E157 WeakPolarHBondContact OG-CG 3.43Å; S19-E157 PolarHBondContact OG-OE1 3.47Å; S19-S387 WeakPolarHBondContact CB-OG 3.25Å; S19-S387 PolarHBondContact O-N 3.15Å; S19-S387 PolarHBondContact OG-OG 3.38Å
20F93.6Very high77.6Confident3 Ų366.1 Ų66.11%0.01339%0.392CS..EExtended strand (participates in β ladder)trans-118.5128.6178.6-61.1-90.4000110.1I18 T48 E157 I158 M160 F165 V384 L386I18-F20 HydrophobicContact CB-CE2 3.89Å; I18-F20 HydrophobicContact CB-CZ 4.23Å; I18-F20 HydrophobicContact CG2-CD2 4.26Å; I18-F20 HydrophobicContact CG2-CE1 4.25Å; I18-F20 HydrophobicContact CG2-CE2 3.57Å; I18-F20 HydrophobicContact CG2-CZ 3.57Å; F20-T48 HydrophobicContact CB-CG2 3.53Å; F20-T48 HydrophobicContact CD1-CG2 3.82Å; F20-T48 HydrophobicContact CD2-CG2 3.8Å; F20-T48 HydrophobicContact CE1-CG2 4.46Å; F20-T48 HydrophobicContact CE2-CG2 4.47Å; F20-T48 HydrophobicContact CG-CG2 3.44Å; F20-T48 VanDerWaalsContact CG-CG2 3.44Å; F20-E157 CarbonylContact O-C 3.59Å; F20-E157 VanDerWaalsContact O-CA 3.29Å; F20-E157 WeakPolarHBondContact O-CA 3.46Å; F20-I158 PolarHBondContact N-O 3.25Å; F20-I158 PolarHBondContact O-N 3.37Å; F20-M160 HydrophobicContact CE2-CB 4.39Å; F20-M160 HydrophobicContact CE2-SD 4.45Å; F20-F165 HydrophobicContact CE1-CZ 4.41Å; F20-F165 HydrophobicContact CE2-CE1 4.41Å; F20-F165 AromaticContact CE2-CE2 3.79Å; F20-F165 HydrophobicContact CE2-CE2 3.79Å; F20-F165 AromaticContact CE2-CZ 3.46Å; F20-F165 HydrophobicContact CE2-CZ 3.46Å; F20-F165 VanDerWaalsContact CE2-CZ 3.46Å; F20-F165 AromaticContact CZ-CE1 3.86Å; F20-F165 HydrophobicContact CZ-CE1 3.86Å; F20-F165 AromaticContact CZ-CE2 3.84Å; F20-F165 HydrophobicContact CZ-CE2 3.84Å; F20-F165 AromaticContact CZ-CZ 3.32Å; F20-F165 HydrophobicContact CZ-CZ 3.32Å; F20-V384 HydrophobicContact CB-CG1 3.79Å; F20-V384 HydrophobicContact CD1-CG1 3.94Å; F20-V384 HydrophobicContact CG-CG1 4.34Å; F20-L386 HydrophobicContact CD1-CD2 3.54Å; F20-L386 HydrophobicContact CD1-CG 4.46Å; F20-L386 HydrophobicContact CE1-CD2 3.27Å; F20-L386 HydrophobicContact CE1-CG 4.35Å; F20-L386 HydrophobicContact CG-CD2 4.4Å; F20-L386 HydrophobicContact CZ-CD2 3.94Å
21Q93.2Very high80.3Confident78 Ų7867.9 Ų67.936%0.36438%0.383SS..EExtended strand (participates in β ladder)trans-109.7131.8177.4-168.5176.163.300111.5V155 V156 V384 S385Q21-V155 HydrophobicContact CG-CG1 3.58Å; Q21-V156 CarbonylContact C-O 3.56Å; Q21-V156 WeakPolarHBondContact CA-O 3.46Å; Q21-V384 WeakPolarHBondContact O-CA 3.47Å; Q21-S385 PolarHBondContact N-O 3.16Å; Q21-S385 PolarHBondContact O-N 3.32Å
22H93.6Very high82.4Confident7 Ų768.6 Ų68.63%0.03238%0.376CS..EExtended strand (participates in β ladder)trans-126.3114.9175.8-177.456.7000111.8F46 V156 R383 V384H22-F46 HydrophobicContact CB-CD2 3.84Å; H22-F46 HydrophobicContact CB-CE2 3.74Å; H22-F46 HydrophobicContact CB-CG 4.4Å; H22-F46 HydrophobicContact CB-CZ 4.26Å; H22-F46 AromaticContact CD2-CD1 3.4Å; H22-F46 WeakPolarHBondContact CD2-CD1 3.38Å; H22-F46 AromaticContact CD2-CD2 3.85Å; H22-F46 AromaticContact CD2-CE1 3.53Å; H22-F46 AromaticContact CD2-CE2 3.95Å; H22-F46 AromaticContact CD2-CG 3.56Å; H22-F46 AromaticContact CD2-CZ 3.8Å; H22-F46 AromaticContact CE1-CG 3.85Å; H22-F46 AromaticContact CG-CD1 3.99Å; H22-F46 AromaticContact CG-CD2 3.6Å; H22-F46 AromaticContact CG-CE2 3.85Å; H22-F46 AromaticContact CG-CG 3.66Å; H22-F46 AromaticContact ND1-CG 3.84Å; H22-F46 AromaticContact NE2-CD1 3.48Å; H22-F46 WeakPolarHBondContact NE2-CD1 3.37Å; H22-F46 AromaticContact NE2-CG 3.69Å; H22-V156 PolarHBondContact N-O 3.45Å; H22-V156 PolarHBondContact O-N 3.44Å; H22-R383 PolarHBondContact ND1-O 3.43Å; H22-V384 HydrophobicContact CB-CG2 4.49Å
23P93.5Very high84.4Confident65 Ų6567.4 Ų67.442%0.42236%0.36SS..EExtended strand (participates in β ladder)trans-84.4127.6168.631.4-30.8000111.4L153P23-L153 HydrophobicContact CB-CD1 3.93Å
24W94.7Very high86.2Confident24 Ų2472 Ų729%0.09136%0.362CS..EExtended strand (participates in β ladder)trans-119.6100.1174.4175.132.4000110.7L26 N41 S43 L59 L61 L81 V154W24-L26 HydrophobicContact CD2-CB 4.47Å; W24-L26 HydrophobicContact CD2-CD2 4.07Å; W24-L26 HydrophobicContact CE3-CD2 4.12Å; W24-L26 HydrophobicContact CH2-CD1 4.15Å; W24-L26 HydrophobicContact CH2-CD2 4.36Å; W24-L26 HydrophobicContact CZ2-CB 3.89Å; W24-L26 HydrophobicContact CZ2-CD1 4.1Å; W24-L26 HydrophobicContact CZ2-CD2 4.28Å; W24-L26 HydrophobicContact CZ2-CG 4.32Å; W24-L26 HydrophobicContact CZ3-CD2 4.27Å; W24-N41 HydrophobicContact CH2-CB 4.34Å; W24-N41 HydrophobicContact CZ2-CB 4.38Å; W24-S43 VanDerWaalsContact CE2-CB 3.47Å; W24-L59 HydrophobicContact CB-CD1 4.13Å; W24-L59 HydrophobicContact CD2-CB 4.39Å; W24-L59 HydrophobicContact CD2-CD1 4.27Å; W24-L59 HydrophobicContact CE3-CB 3.6Å; W24-L59 HydrophobicContact CE3-CD1 3.64Å; W24-L59 HydrophobicContact CE3-CG 4.27Å; W24-L59 HydrophobicContact CH2-CB 4.38Å; W24-L59 HydrophobicContact CZ3-CB 3.59Å; W24-L59 HydrophobicContact CZ3-CD1 4.43Å; W24-L61 HydrophobicContact CH2-CB 4.16Å; W24-L61 HydrophobicContact CZ3-CB 4.38Å; W24-L81 HydrophobicContact CZ3-CD1 4Å; W24-V154 HydrophobicContact CB-CB 4.32Å; W24-V154 HydrophobicContact CE3-CB 4.03Å; W24-V154 HydrophobicContact CE3-CG1 4.38Å; W24-V154 HydrophobicContact CE3-CG2 3.97Å; W24-V154 HydrophobicContact CZ3-CG2 4.43Å; W24-V154 PolarHBondContact N-O 3.34Å; W24-V154 PolarHBondContact O-N 2.97Å
25T92.9Very high87.5Confident91 Ų9170.5 Ų70.556%0.55836%0.36SS*.EExtended strand (participates in β ladder)trans-77.8121167.7-47.60000109.4L152T25-L152 WeakPolarHBondContact CA-O 3.49Å
26L93.1Very high88.1Confident10 Ų1071.2 Ų71.25%0.05236%0.36CS..EExtended strand (participates in β ladder)trans-125.6146.217473145.7000111.8W24 V28 N41 L61 N151 L152 V154W24-L26 HydrophobicContact CD2-CB 4.47Å; W24-L26 HydrophobicContact CD2-CD2 4.07Å; W24-L26 HydrophobicContact CE3-CD2 4.12Å; W24-L26 HydrophobicContact CH2-CD1 4.15Å; W24-L26 HydrophobicContact CH2-CD2 4.36Å; W24-L26 HydrophobicContact CZ2-CB 3.89Å; W24-L26 HydrophobicContact CZ2-CD1 4.1Å; W24-L26 HydrophobicContact CZ2-CD2 4.28Å; W24-L26 HydrophobicContact CZ2-CG 4.32Å; W24-L26 HydrophobicContact CZ3-CD2 4.27Å; L26-V28 HydrophobicContact CD1-CG2 4.09Å; L26-V28 HydrophobicContact CG-CG2 4.45Å; L26-N41 HydrophobicContact CD1-CB 3.84Å; L26-L61 HydrophobicContact CD1-CD2 3.94Å; L26-N151 CarbonylContact O-C 3.52Å; L26-N151 VanDerWaalsContact O-CA 3.28Å; L26-N151 WeakPolarHBondContact O-CA 3.14Å; L26-L152 HydrophobicContact CD2-CB 4.2Å; L26-L152 HydrophobicContact CG-CB 4.5Å; L26-L152 PolarHBondContact N-O 2.62Å; L26-L152 PolarHBondContact O-N 3.31Å; L26-V154 HydrophobicContact CD2-CB 4.47Å; L26-V154 HydrophobicContact CD2-CG2 3.39Å
27K92.4Very high87.8Confident110 Ų11071.9 Ų71.948%0.47836%0.362SS..EExtended strand (participates in β ladder)trans-86.9121.4157.9-171.8-179.6179.6-173.70107C29 N41 D149 S150 N151K27-C29 PolarHBondContact O-N 3.02Å; K27-C29 VanDerWaalsContact O-N 3.14Å; K27-N41 PolarHBondContact O-OD1 2.91Å; K27-D149 WeakPolarHBondContact CE-O 3.39Å; K27-S150 WeakPolarHBondContact CA-O 3.44Å; K27-N151 WeakPolarHBondContact CB-OD1 3.46Å
28V90.2Very high87.5Confident0 Ų069.8 Ų69.80%035%0.348CS..  trans-72.4109.4-179.1-176.90000108.6L26 L39 V144 K147 V148 D149 S150 L152L26-V28 HydrophobicContact CD1-CG2 4.09Å; L26-V28 HydrophobicContact CG-CG2 4.45Å; V28-L39 HydrophobicContact CG1-CD1 3.63Å; V28-L39 HydrophobicContact CG1-CG 4.38Å; V28-V144 HydrophobicContact CG1-CG1 4.07Å; V28-K147 WeakPolarHBondContact CB-O 3.46Å; V28-V148 HydrophobicContact CG1-CG2 4.12Å; V28-D149 PolarHBondContact O-N 3.17Å; V28-S150 PolarHBondContact N-O 3.34Å; V28-L152 HydrophobicContact CG2-CB 4.38Å; V28-L152 HydrophobicContact CG2-CD1 3.49Å; V28-L152 VanDerWaalsContact CG2-CD1 3.49Å; V28-L152 HydrophobicContact CG2-CG 3.82Å
29C88.3Confident87.3Confident47 Ų4768.9 Ų68.932%0.31834%0.343SS..  trans-111147.1177.9-630000110.7K27 N41K27-C29 PolarHBondContact O-N 3.02Å; K27-C29 VanDerWaalsContact O-N 3.14Å; C29-N41 PolarHBondContact N-ND2 3.27Å; C29-N41 PolarHBondContact N-OD1 3.37Å; C29-N41 VanDerWaalsContact N-OD1 3.11Å; C29-N41 PolarHBondContact O-ND2 3.18Å
30Q88.4Confident87.2Confident79 Ų7970 Ų7037%0.36935%0.349SS..EExtended strand (participates in β ladder)trans-102.7148.8164.8-68.1-178.7-34.400109.7T37 I38 V148Q30-T37 HydrophobicContact CB-CG2 3.51Å; Q30-T37 HydrophobicContact CG-CG2 4.09Å; Q30-I38 CarbonylContact C-O 3.46Å; Q30-I38 WeakPolarHBondContact CA-O 3.32Å; Q30-V148 HydrophobicContact CG-CG1 4.06Å; Q30-V148 HydrophobicContact CG-CG2 4.01Å
31R82.3Confident87.3Confident146 Ų14670.8 Ų70.855%0.55135%0.353SS*.EExtended strand (participates in β ladder)trans-117.4134.6174.7-66.1-173.9-178.2-170.7-0.8108.6I38R31-I38 PolarHBondContact N-O 3.3Å; R31-I38 PolarHBondContact O-N 3.4Å
32Q80.9Confident87.3Confident155 Ų15571.5 Ų71.572%0.72436%0.362SS*.EExtended strand (participates in β ladder)trans-81.1121.3167.8-169.2172.2-3.500108.3E34 E36Q32-E34 PolarHBondContact NE2-O 2.94Å; Q32-E36 WeakPolarHBondContact CA-O 3.4Å
33I76.9Confident87.4Confident84 Ų8471.5 Ų71.543%0.43136%0.363SS..EExtended strand (participates in β ladder)trans-121.6112.4172.1-58.3-171.1000105.8D35 E36 I38I33-D35 PolarHBondContact O-N 3.41Å; I33-E36 PolarHBondContact N-O 3.07Å; I33-E36 PolarHBondContact O-N 3.26Å; I33-E36 VanDerWaalsContact O-O 3.11Å; I33-I38 HydrophobicContact CD1-CD1 3.39Å; I33-I38 HydrophobicContact CD1-CG1 3.84Å; I33-I38 HydrophobicContact CG1-CD1 4.21Å; I33-I38 HydrophobicContact CG1-CG1 4.11Å
34E80.7Confident87.3Confident173 Ų17377 Ų7781%0.80838%0.376SS*.THydrogen-bonded Turntrans55.3-120.7-172.1-56.3177.9173.200110.9Q32Q32-E34 PolarHBondContact NE2-O 2.94Å
35D78.1Confident87.3Confident162 Ų16277.8 Ų77.887%0.86638%0.383SS*.THydrogen-bonded Turntrans-94.93.2-180-68.5-28.5000113.2I33I33-D35 PolarHBondContact O-N 3.41Å
36E76.9Confident87.3Confident101 Ų10173.5 Ų73.547%0.47236%0.357SS..EExtended strand (participates in β ladder)trans-115.4139.9-176.1-61.8-169.714800112.5Q32 I33 R77Q32-E36 WeakPolarHBondContact CA-O 3.4Å; I33-E36 PolarHBondContact N-O 3.07Å; I33-E36 PolarHBondContact O-N 3.26Å; I33-E36 VanDerWaalsContact O-O 3.11Å; E36-R77 IonicContact OE1-NH2 3.19Å; E36-R77 PolarHBondContact OE1-NH2 3.39Å; E36-R77 IonicContact OE2-CZ 2.75Å; E36-R77 IonicContact OE2-NH2 3.62Å; E36-R77 PolarHBondContact OE2-NH2 3.09Å
37T79.4Confident87.4Confident71 Ų7173 Ų7344%0.43636%0.355SS..EExtended strand (participates in β ladder)trans-95.8121170.9-58.80000108.6Q30 R77Q30-T37 HydrophobicContact CB-CG2 3.51Å; Q30-T37 HydrophobicContact CG-CG2 4.09Å; T37-R77 PolarHBondContact O-NH1 3.32Å
38I84.3Confident87.4Confident33 Ų3367.8 Ų67.817%0.16933%0.332CS..EExtended strand (participates in β ladder)trans-119.5142.5177.966.6158.9000111.2Q30 R31 I33 L40Q30-I38 CarbonylContact C-O 3.46Å; Q30-I38 WeakPolarHBondContact CA-O 3.32Å; R31-I38 PolarHBondContact N-O 3.3Å; R31-I38 PolarHBondContact O-N 3.4Å; I33-I38 HydrophobicContact CD1-CD1 3.39Å; I33-I38 HydrophobicContact CD1-CG1 3.84Å; I33-I38 HydrophobicContact CG1-CD1 4.21Å; I33-I38 HydrophobicContact CG1-CG1 4.11Å; I38-L40 HydrophobicContact CD1-CB 4.25Å
39L88.4Confident87.4Confident0 Ų068.6 Ų68.60%034%0.338CS..EExtended strand (participates in β ladder)trans-77.2122.4166.5-164.7141.2000109.2V28 L61 T62 D63 V79 V144V28-L39 HydrophobicContact CG1-CD1 3.63Å; V28-L39 HydrophobicContact CG1-CG 4.38Å; L39-L61 HydrophobicContact CD2-CB 4.21Å; L39-L61 HydrophobicContact CD2-CD2 3.9Å; L39-L61 HydrophobicContact CD2-CG 3.65Å; L39-T62 CarbonylContact O-C 3.56Å; L39-T62 VanDerWaalsContact O-CA 3.22Å; L39-T62 WeakPolarHBondContact O-CA 3.24Å; L39-D63 HydrophobicContact CB-CB 4.33Å; L39-D63 VanDerWaalsContact CB-CG 3.43Å; L39-D63 WeakPolarHBondContact CB-OD2 3.44Å; L39-D63 PolarHBondContact N-OD2 3.36Å; L39-D63 PolarHBondContact O-N 2.9Å; L39-V79 HydrophobicContact CD2-CG1 4.42Å; L39-V144 HydrophobicContact CD1-CG1 3.46Å; L39-V144 VanDerWaalsContact CD1-CG1 3.46Å; L39-V144 HydrophobicContact CD2-CG1 4.43Å
40L90.6Very high87.4Confident32 Ų3269.7 Ų69.717%0.16834%0.336CS..EExtended strand (participates in β ladder)trans-150.6102.3176.3-179.563.1000110.6I38 V42 R60 L61I38-L40 HydrophobicContact CD1-CB 4.25Å; L40-V42 HydrophobicContact CD1-CG2 4.47Å; L40-R60 HydrophobicContact CD1-CG 4.17Å; L40-R60 VanDerWaalsContact CD1-NE 3.28Å; L40-L61 WeakPolarHBondContact CA-O 3.24Å
41N94.2Very high87.4Confident18 Ų1870.4 Ų70.410%0.09634%0.337CS..EExtended strand (participates in β ladder)trans-126.9131179.2-62.5-86.9000109.1W24 L26 K27 C29 R60 L61W24-N41 HydrophobicContact CH2-CB 4.34Å; W24-N41 HydrophobicContact CZ2-CB 4.38Å; L26-N41 HydrophobicContact CD1-CB 3.84Å; K27-N41 PolarHBondContact O-OD1 2.91Å; C29-N41 PolarHBondContact N-ND2 3.27Å; C29-N41 PolarHBondContact N-OD1 3.37Å; C29-N41 VanDerWaalsContact N-OD1 3.11Å; C29-N41 PolarHBondContact O-ND2 3.18Å; N41-R60 CarbonylContact O-C 3.59Å; N41-R60 WeakPolarHBondContact O-CA 3.29Å; N41-L61 HydrophobicContact CB-CB 4.38Å; N41-L61 PolarHBondContact N-O 3.44Å; N41-L61 PolarHBondContact O-N 2.82Å
42V93.9Very high87.6Confident94 Ų9466.1 Ų66.157%0.5732%0.324SS*.EExtended strand (participates in β ladder)trans-124.1132.7-177.8-175.90000108.5L40 L59 R60L40-V42 HydrophobicContact CD1-CG2 4.47Å; V42-L59 CarbonylContact C-O 3.56Å; V42-L59 WeakPolarHBondContact CA-O 3.21Å; V42-R60 HydrophobicContact CG2-CB 4.44Å; V42-R60 HydrophobicContact CG2-CG 4.18Å
43S94.6Very high88.1Confident7 Ų758.8 Ų58.85%0.04929%0.289CS..PPolyproline II helixtrans-70.8159.6176.782.50000110.9W24 L59W24-S43 VanDerWaalsContact CE2-CB 3.47Å; S43-L59 PolarHBondContact N-O 2.9Å; S43-L59 PolarHBondContact OG-N 2.89Å
44R92.4Very high88.8Confident181 Ų18155.4 Ų55.468%0.68327%0.272SS*.PPolyproline II helixtrans-64.1147.3160-69-179.1177.5162.7-3108.6
45P94.3Very high89.4Confident39 Ų3947.2 Ų47.225%0.25323%0.233SC..PPolyproline II helixtrans-57.5144.7171.7-24.134.2000111.7T56 W57 K86 R380P45-T56 HydrophobicContact CB-CG2 3.83Å; P45-W57 VanDerWaalsContact CA-O 3.23Å; P45-W57 WeakPolarHBondContact CA-O 3.43Å; P45-K86 HydrophobicContact CB-CD 4.2Å; P45-K86 HydrophobicContact CG-CD 3.99Å; P45-R380 HydrophobicContact CB-CG 4.43Å
46F94.3Very high90.2Very high1 Ų139.8 Ų39.80%0.00419%0.194CC..EExtended strand (participates in β ladder)trans-136.4158.7175.663.5-84.7000109.1H22 T56 W57 L59 L83 I158 V384H22-F46 HydrophobicContact CB-CD2 3.84Å; H22-F46 HydrophobicContact CB-CE2 3.74Å; H22-F46 HydrophobicContact CB-CG 4.4Å; H22-F46 HydrophobicContact CB-CZ 4.26Å; H22-F46 AromaticContact CD2-CD1 3.4Å; H22-F46 WeakPolarHBondContact CD2-CD1 3.38Å; H22-F46 AromaticContact CD2-CD2 3.85Å; H22-F46 AromaticContact CD2-CE1 3.53Å; H22-F46 AromaticContact CD2-CE2 3.95Å; H22-F46 AromaticContact CD2-CG 3.56Å; H22-F46 AromaticContact CD2-CZ 3.8Å; H22-F46 AromaticContact CE1-CG 3.85Å; H22-F46 AromaticContact CG-CD1 3.99Å; H22-F46 AromaticContact CG-CD2 3.6Å; H22-F46 AromaticContact CG-CE2 3.85Å; H22-F46 AromaticContact CG-CG 3.66Å; H22-F46 AromaticContact ND1-CG 3.84Å; H22-F46 AromaticContact NE2-CD1 3.48Å; H22-F46 WeakPolarHBondContact NE2-CD1 3.37Å; H22-F46 AromaticContact NE2-CG 3.69Å; F46-T56 CarbonylContact O-C 3.57Å; F46-T56 WeakPolarHBondContact O-CA 3.49Å; F46-W57 HydrophobicContact CD1-CB 4.35Å; F46-W57 HydrophobicContact CD2-CB 4.21Å; F46-W57 HydrophobicContact CE1-CB 3.82Å; F46-W57 HydrophobicContact CE2-CB 3.69Å; F46-W57 HydrophobicContact CE2-CG 4.15Å; F46-W57 HydrophobicContact CZ-CB 3.48Å; F46-W57 VanDerWaalsContact CZ-CB 3.48Å; F46-W57 HydrophobicContact CZ-CG 4.31Å; F46-W57 PolarHBondContact N-O 3.38Å; F46-W57 PolarHBondContact O-N 3.38Å; F46-L59 HydrophobicContact CE1-CD1 4.31Å; F46-L59 HydrophobicContact CE1-CG 4Å; F46-L59 HydrophobicContact CZ-CG 4.38Å; F46-L83 HydrophobicContact CZ-CD1 4.03Å; F46-I158 HydrophobicContact CE2-CD1 3.84Å; F46-I158 HydrophobicContact CZ-CD1 4.14Å; F46-V384 HydrophobicContact CB-CG2 4.06Å; F46-V384 HydrophobicContact CD2-CG2 3.72Å; F46-V384 HydrophobicContact CG-CG2 4.36Å
47S93.3Very high91.1Very high0 Ų035 Ų350%017%0.171CC..EExtended strand (participates in β ladder)trans-127.9130.4-174.6-59.90000112.3F55 T56 R380 V384S47-F55 CarbonylContact C-O 3.59Å; S47-F55 WeakPolarHBondContact CA-O 3.36Å; S47-T56 PolarHBondContact OG-OG1 3.01Å; S47-R380 PolarHBondContact N-O 2.92Å; S47-R380 WeakPolarHBondContact OG-CB 3.31Å; S47-R380 WeakPolarHBondContact OG-CD 3.1Å; S47-V384 WeakPolarHBondContact O-CB 3.23Å; S47-V384 WeakPolarHBondContact O-CG2 3.32Å
48T92.8Very high92Very high0 Ų031.9 Ų31.90%015%0.153CC..EExtended strand (participates in β ladder)trans-78.5129.1162.8550000107.6F20 Q54 F55 W57 I158 V384F20-T48 HydrophobicContact CB-CG2 3.53Å; F20-T48 HydrophobicContact CD1-CG2 3.82Å; F20-T48 HydrophobicContact CD2-CG2 3.8Å; F20-T48 HydrophobicContact CE1-CG2 4.46Å; F20-T48 HydrophobicContact CE2-CG2 4.47Å; F20-T48 HydrophobicContact CG-CG2 3.44Å; F20-T48 VanDerWaalsContact CG-CG2 3.44Å; T48-Q54 VanDerWaalsContact O-CA 3.23Å; T48-Q54 WeakPolarHBondContact O-CA 3.41Å; T48-F55 PolarHBondContact N-O 2.73Å; T48-F55 PolarHBondContact O-N 3.41Å; T48-F55 PolarHBondContact OG1-O 2.84Å; T48-W57 PolarHBondContact OG1-NE1 3.21Å; T48-I158 HydrophobicContact CG2-CD1 4.4Å; T48-V384 HydrophobicContact CG2-CG1 4.32Å
49S90.7Very high92.5Very high18 Ų1830.3 Ų30.313%0.12615%0.145CC..EExtended strand (participates in β ladder)trans-135.1127.3-176.5-175.10000109.9V53S49-V53 WeakPolarHBondContact CA-O 3.32Å
50Y88.9Confident92.9Very high70 Ų7033.6 Ų33.628%0.27516%0.157SC..EExtended strand (participates in β ladder)trans-152.5142.6172.3-179.9-103.5000109I18 H52 V53 E162 F165 L386I18-Y50 HydrophobicContact CD1-CD1 3.22Å; I18-Y50 HydrophobicContact CD1-CD2 4.1Å; I18-Y50 HydrophobicContact CD1-CE1 3.35Å; I18-Y50 HydrophobicContact CD1-CE2 4.22Å; I18-Y50 HydrophobicContact CD1-CG 3.6Å; Y50-H52 PolarHBondContact O-N 3.02Å; Y50-H52 VanDerWaalsContact O-N 3.08Å; Y50-V53 PolarHBondContact N-O 3.14Å; Y50-V53 VanDerWaalsContact N-O 3.14Å; Y50-V53 PolarHBondContact O-N 3.45Å; Y50-E162 HydrophobicContact CE1-CG 3.87Å; Y50-E162 WeakPolarHBondContact CE1-OE1 3.18Å; Y50-E162 PolarHBondContact OH-OE1 3.02Å; Y50-F165 HydrophobicContact CD1-CB 3.63Å; Y50-F165 HydrophobicContact CD1-CD2 4.3Å; Y50-F165 AromaticContact CD1-CG 3.95Å; Y50-F165 HydrophobicContact CD1-CG 3.95Å; Y50-F165 HydrophobicContact CG-CB 4.42Å; Y50-F165 HydrophobicContact CG-CG 4.38Å; Y50-F165 WeakPolarHBondContact O-CD1 3.48Å; Y50-L386 HydrophobicContact CD2-CD1 4.48Å
51K86.9Confident93.1Very high93 Ų9332.2 Ų32.240%0.40415%0.15SC..THydrogen-bonded Turntrans44.741.8-174.7-69177.2-178.3168.60113.4V53 E162K51-V53 PolarHBondContact O-N 3.49Å; K51-V53 VanDerWaalsContact O-N 3.12Å; K51-E162 WeakPolarHBondContact CE-OE1 3.37Å; K51-E162 IonicContact NZ-OE1 2.66Å; K51-E162 PolarHBondContact NZ-OE1 3.33Å
52H87.1Confident93Very high57 Ų5731.4 Ų31.426%0.26415%0.146SC..THydrogen-bonded Turntrans62.610.3-179.5-41.8-55.7000116.4Y50 Q54 V324 F328 D331Y50-H52 PolarHBondContact O-N 3.02Å; Y50-H52 VanDerWaalsContact O-N 3.08Å; H52-Q54 PolarHBondContact O-NE2 3.06Å; H52-V324 HydrophobicContact CB-CG1 4.28Å; H52-V324 WeakPolarHBondContact CB-O 3.42Å; H52-F328 AromaticContact CE1-CD2 3.95Å; H52-F328 WeakPolarHBondContact ND1-CA 3.49Å; H52-D331 IonicContact CE1-OD2 2.74Å; H52-D331 PolarHBondContact CE1-OD2 3.3Å; H52-D331 IonicContact ND1-OD2 3.41Å; H52-D331 PolarHBondContact ND1-OD2 3.23Å
53V91.3Very high92.7Very high0 Ų027.8 Ų27.80%012%0.123CC..EExtended strand (participates in β ladder)trans-98.5137.6170.31770000109.2S49 Y50 K51 F55 P89 F165 P167 Y170 M323S49-V53 WeakPolarHBondContact CA-O 3.32Å; Y50-V53 PolarHBondContact N-O 3.14Å; Y50-V53 VanDerWaalsContact N-O 3.14Å; Y50-V53 PolarHBondContact O-N 3.45Å; K51-V53 PolarHBondContact O-N 3.49Å; K51-V53 VanDerWaalsContact O-N 3.12Å; V53-F55 HydrophobicContact CG1-CE2 4.07Å; V53-P89 HydrophobicContact CG1-CG 4.01Å; V53-F165 HydrophobicContact CB-CB 4.28Å; V53-F165 HydrophobicContact CB-CD1 4.01Å; V53-F165 HydrophobicContact CG1-CD1 4.21Å; V53-F165 WeakPolarHBondContact CG2-O 3.48Å; V53-F165 WeakPolarHBondContact O-CD1 3.41Å; V53-P167 HydrophobicContact CG2-CB 4.36Å; V53-P167 HydrophobicContact CG2-CG 3.66Å; V53-Y170 HydrophobicContact CG1-CE2 4.09Å; V53-M323 HydrophobicContact CB-CE 4.35Å; V53-M323 HydrophobicContact CB-SD 4.45Å; V53-M323 HydrophobicContact CG1-CE 4.04Å; V53-M323 HydrophobicContact CG1-SD 3.88Å; V53-M323 HydrophobicContact CG2-CE 3.86Å
54Q91.9Very high92.1Very high14 Ų1430.5 Ų30.57%0.06514%0.135CC..EExtended strand (participates in β ladder)trans-128.6144.5-179.2-50.684.122.700114.5T48 H52 P89 L377T48-Q54 VanDerWaalsContact O-CA 3.23Å; T48-Q54 WeakPolarHBondContact O-CA 3.41Å; H52-Q54 PolarHBondContact O-NE2 3.06Å; Q54-P89 WeakPolarHBondContact O-CD 3.41Å; Q54-L377 HydrophobicContact CB-CD1 4.17Å; Q54-L377 HydrophobicContact CG-CD1 3.98Å; Q54-L377 HydrophobicContact CG-CD2 4.27Å
55F93.8Very high91.1Very high0 Ų028.3 Ų28.30%013%0.128CC..EExtended strand (participates in β ladder)trans-120.4130.8166.6-59.5-100.2000109.1S47 T48 V53 W57 Y85 P89 V93 M160 L164 F165 Y170S47-F55 CarbonylContact C-O 3.59Å; S47-F55 WeakPolarHBondContact CA-O 3.36Å; T48-F55 PolarHBondContact N-O 2.73Å; T48-F55 PolarHBondContact O-N 3.41Å; T48-F55 PolarHBondContact OG1-O 2.84Å; V53-F55 HydrophobicContact CG1-CE2 4.07Å; F55-W57 HydrophobicContact CB-CZ2 3.78Å; F55-W57 HydrophobicContact CG-CZ2 4.36Å; F55-W57 VanDerWaalsContact O-CD1 3.26Å; F55-W57 PolarHBondContact O-NE1 2.87Å; F55-Y85 HydrophobicContact CB-CE2 4.37Å; F55-Y85 AromaticContact CD1-CE2 3.84Å; F55-Y85 HydrophobicContact CD1-CE2 3.84Å; F55-P89 HydrophobicContact CD1-CG 4.49Å; F55-P89 HydrophobicContact CE1-CG 3.79Å; F55-P89 HydrophobicContact CE2-CG 4.38Å; F55-P89 HydrophobicContact CZ-CG 3.75Å; F55-V93 HydrophobicContact CD1-CB 4.4Å; F55-V93 HydrophobicContact CD1-CG1 4.49Å; F55-V93 HydrophobicContact CD1-CG2 4.07Å; F55-V93 HydrophobicContact CE1-CB 4.03Å; F55-V93 HydrophobicContact CE1-CG2 3.6Å; F55-V93 HydrophobicContact CZ-CG2 4.18Å; F55-M160 HydrophobicContact CB-CE 4.48Å; F55-M160 HydrophobicContact CD1-CE 4.12Å; F55-M160 HydrophobicContact CD2-CE 3.67Å; F55-M160 HydrophobicContact CD2-SD 4.46Å; F55-M160 HydrophobicContact CE1-CE 4.21Å; F55-M160 HydrophobicContact CE2-CE 3.77Å; F55-M160 HydrophobicContact CG-CE 3.84Å; F55-M160 HydrophobicContact CZ-CE 4.03Å; F55-L164 HydrophobicContact CE2-CB 4.18Å; F55-L164 HydrophobicContact CZ-CB 3.98Å; F55-F165 HydrophobicContact CD2-CD1 4.47Å; F55-F165 AromaticContact CD2-CE1 3.76Å; F55-F165 HydrophobicContact CD2-CE1 3.76Å; F55-F165 HydrophobicContact CD2-CZ 4Å; F55-F165 HydrophobicContact CE2-CD1 4.18Å; F55-F165 AromaticContact CE2-CE1 3.84Å; F55-F165 HydrophobicContact CE2-CE1 3.84Å; F55-F165 HydrophobicContact CE2-CZ 4.04Å; F55-Y170 VanDerWaalsContact CZ-OH 3.26Å; F55-Y170 WeakPolarHBondContact CZ-OH 3.45Å
56T94.8Very high89.6Confident6 Ų629 Ų294%0.03713%0.131CC..EExtended strand (participates in β ladder)trans-101.2131.3179.6-59.20000110.6P45 F46 S47 K86 E87 R380P45-T56 HydrophobicContact CB-CG2 3.83Å; F46-T56 CarbonylContact O-C 3.57Å; F46-T56 WeakPolarHBondContact O-CA 3.49Å; S47-T56 PolarHBondContact OG-OG1 3.01Å; T56-K86 HydrophobicContact CG2-CB 4.14Å; T56-K86 PolarHBondContact O-N 3.35Å; T56-E87 PolarHBondContact N-O 2.81Å; T56-E87 PolarHBondContact O-N 3.12Å; T56-R380 PolarHBondContact OG1-NH1 3.41Å; T56-R380 VanDerWaalsContact OG1-NH1 3.16Å
57W96.3Very high87.6Confident0 Ų036.6 Ų36.60%017%0.171CC..EExtended strand (participates in β ladder)trans-125.2163.1-175.3-51.292.9000111.3P45 F46 T48 F55 L83 Y84 Y85 V93 V95 F122 I158 M160P45-W57 VanDerWaalsContact CA-O 3.23Å; P45-W57 WeakPolarHBondContact CA-O 3.43Å; F46-W57 HydrophobicContact CD1-CB 4.35Å; F46-W57 HydrophobicContact CD2-CB 4.21Å; F46-W57 HydrophobicContact CE1-CB 3.82Å; F46-W57 HydrophobicContact CE2-CB 3.69Å; F46-W57 HydrophobicContact CE2-CG 4.15Å; F46-W57 HydrophobicContact CZ-CB 3.48Å; F46-W57 VanDerWaalsContact CZ-CB 3.48Å; F46-W57 HydrophobicContact CZ-CG 4.31Å; F46-W57 PolarHBondContact N-O 3.38Å; F46-W57 PolarHBondContact O-N 3.38Å; T48-W57 PolarHBondContact OG1-NE1 3.21Å; F55-W57 HydrophobicContact CB-CZ2 3.78Å; F55-W57 HydrophobicContact CG-CZ2 4.36Å; F55-W57 VanDerWaalsContact O-CD1 3.26Å; F55-W57 PolarHBondContact O-NE1 2.87Å; W57-L83 HydrophobicContact CB-CD1 4.03Å; W57-L83 HydrophobicContact CE3-CD1 4.22Å; W57-L83 HydrophobicContact CE3-CD2 3.98Å; W57-L83 HydrophobicContact CE3-CG 3.97Å; W57-L83 HydrophobicContact CZ3-CD2 4.23Å; W57-Y84 CarbonylContact C-O 3.6Å; W57-Y84 WeakPolarHBondContact CA-O 3.43Å; W57-Y85 HydrophobicContact CE3-CD2 4.34Å; W57-Y85 HydrophobicContact CH2-CD2 4.17Å; W57-Y85 HydrophobicContact CH2-CG 4.44Å; W57-Y85 HydrophobicContact CZ2-CD2 4.49Å; W57-Y85 HydrophobicContact CZ3-CD2 4.1Å; W57-Y85 HydrophobicContact CZ3-CG 4.16Å; W57-V93 HydrophobicContact CH2-CG1 3.81Å; W57-V95 HydrophobicContact CH2-CG2 3.57Å; W57-V95 HydrophobicContact CZ2-CG2 4.33Å; W57-V95 HydrophobicContact CZ3-CG2 4.24Å; W57-F122 HydrophobicContact CZ3-CD1 4Å; W57-F122 HydrophobicContact CZ3-CE1 4.37Å; W57-F122 HydrophobicContact CZ3-CG 4.11Å; W57-I158 HydrophobicContact CD2-CD1 4.25Å; W57-I158 HydrophobicContact CG-CD1 4.12Å; W57-M160 HydrophobicContact CZ2-CE 3.9Å; W57-M160 HydrophobicContact CZ2-SD 3.86Å
58A96.5Very high85.5Confident6 Ų639.2 Ų39.25%0.0519%0.19CC..EExtended strand (participates in β ladder)trans-145.2153.9164.400000110.9Y84 K86A58-Y84 PolarHBondContact N-O 3.26Å; A58-Y84 PolarHBondContact O-N 3.33Å; A58-K86 HydrophobicContact CB-CD 3.84Å; A58-K86 HydrophobicContact CB-CG 4.2Å
59L96.7Very high83.4Confident0 Ų047.1 Ų47.10%023%0.232CC..EExtended strand (participates in β ladder)trans-105147174.4-63.2165.5000110.2W24 V42 S43 F46 L81 H82 L83 V156W24-L59 HydrophobicContact CB-CD1 4.13Å; W24-L59 HydrophobicContact CD2-CB 4.39Å; W24-L59 HydrophobicContact CD2-CD1 4.27Å; W24-L59 HydrophobicContact CE3-CB 3.6Å; W24-L59 HydrophobicContact CE3-CD1 3.64Å; W24-L59 HydrophobicContact CE3-CG 4.27Å; W24-L59 HydrophobicContact CH2-CB 4.38Å; W24-L59 HydrophobicContact CZ3-CB 3.59Å; W24-L59 HydrophobicContact CZ3-CD1 4.43Å; V42-L59 CarbonylContact C-O 3.56Å; V42-L59 WeakPolarHBondContact CA-O 3.21Å; S43-L59 PolarHBondContact N-O 2.9Å; S43-L59 PolarHBondContact OG-N 2.89Å; F46-L59 HydrophobicContact CE1-CD1 4.31Å; F46-L59 HydrophobicContact CE1-CG 4Å; F46-L59 HydrophobicContact CZ-CG 4.38Å; L59-L81 HydrophobicContact CB-CD1 4.33Å; L59-L81 HydrophobicContact CD2-CD1 4.42Å; L59-H82 CarbonylContact C-O 3.45Å; L59-H82 VanDerWaalsContact CA-O 3.26Å; L59-H82 WeakPolarHBondContact CA-O 3.41Å; L59-L83 HydrophobicContact CD2-CB 4.32Å; L59-L83 HydrophobicContact CD2-CD1 3.7Å; L59-V156 HydrophobicContact CD1-CB 4.38Å; L59-V156 HydrophobicContact CD1-CG2 3.5Å; L59-V156 HydrophobicContact CD2-CG2 3.83Å; L59-V156 HydrophobicContact CG-CG2 4.31Å
60R95.5Very high81.4Confident69 Ų6952.7 Ų52.726%0.2626%0.26SS..EExtended strand (participates in β ladder)trans-135.4124.5172.5174.3-176.3172.5-164-6.7109.8L40 N41 V42 T62 L81 H82 Y84L40-R60 HydrophobicContact CD1-CG 4.17Å; L40-R60 VanDerWaalsContact CD1-NE 3.28Å; N41-R60 CarbonylContact O-C 3.59Å; N41-R60 WeakPolarHBondContact O-CA 3.29Å; V42-R60 HydrophobicContact CG2-CB 4.44Å; V42-R60 HydrophobicContact CG2-CG 4.18Å; R60-T62 HydrophobicContact CG-CG2 4.29Å; R60-T62 PolarHBondContact NH2-OG1 2.93Å; R60-T62 VanDerWaalsContact NH2-OG1 3.12Å; R60-L81 CarbonylContact O-C 3.57Å; R60-L81 WeakPolarHBondContact O-CA 3.49Å; R60-H82 HydrophobicContact CB-CB 4.28Å; R60-H82 PolarHBondContact N-O 3.21Å; R60-H82 PolarHBondContact O-N 2.83Å; R60-Y84 HydrophobicContact CB-CD2 4.17Å; R60-Y84 HydrophobicContact CB-CE2 3.7Å; R60-Y84 HydrophobicContact CG-CE2 4.43Å; R60-Y84 PolarHBondContact NH1-OH 2.93Å
61L94.7Very high79.2Confident3 Ų354.9 Ų54.92%0.01629%0.292CS..EExtended strand (participates in β ladder)trans-102.7120170.4-169.471.5000107.9W24 L26 L39 L40 N41 V79 L80 L81 F140 V144W24-L61 HydrophobicContact CH2-CB 4.16Å; W24-L61 HydrophobicContact CZ3-CB 4.38Å; L26-L61 HydrophobicContact CD1-CD2 3.94Å; L39-L61 HydrophobicContact CD2-CB 4.21Å; L39-L61 HydrophobicContact CD2-CD2 3.9Å; L39-L61 HydrophobicContact CD2-CG 3.65Å; L40-L61 WeakPolarHBondContact CA-O 3.24Å; N41-L61 HydrophobicContact CB-CB 4.38Å; N41-L61 PolarHBondContact N-O 3.44Å; N41-L61 PolarHBondContact O-N 2.82Å; L61-V79 HydrophobicContact CD1-CG1 3.52Å; L61-V79 HydrophobicContact CG-CG1 3.89Å; L61-L80 WeakPolarHBondContact CA-O 3.43Å; L61-L81 HydrophobicContact CD1-CB 4.16Å; L61-L81 HydrophobicContact CD1-CD1 4.33Å; L61-F140 HydrophobicContact CD1-CE1 4.31Å; L61-F140 HydrophobicContact CD1-CZ 3.97Å; L61-V144 HydrophobicContact CD2-CG1 3.9Å
62T91.8Very high77.1Confident2 Ų254.3 Ų54.31%0.01231%0.305CS..EExtended strand (participates in β ladder)trans-144.3149.1-171.8-171.50000112.2L39 R60 E64 V79 L80L39-T62 CarbonylContact O-C 3.56Å; L39-T62 VanDerWaalsContact O-CA 3.22Å; L39-T62 WeakPolarHBondContact O-CA 3.24Å; R60-T62 HydrophobicContact CG-CG2 4.29Å; R60-T62 PolarHBondContact NH2-OG1 2.93Å; R60-T62 VanDerWaalsContact NH2-OG1 3.12Å; T62-E64 HydrophobicContact CG2-CG 3.85Å; T62-E64 WeakPolarHBondContact CG2-OE1 3.39Å; T62-V79 CarbonylContact O-C 3.56Å; T62-V79 WeakPolarHBondContact O-CA 3.25Å; T62-L80 PolarHBondContact N-O 3.04Å; T62-L80 PolarHBondContact O-N 2.98Å
63D88Confident75Confident17 Ų1757.4 Ų57.49%0.09133%0.328CS..EExtended strand (participates in β ladder)trans-78.7129.5162.6-71.8-27.4000109L39 V79 H145L39-D63 HydrophobicContact CB-CB 4.33Å; L39-D63 VanDerWaalsContact CB-CG 3.43Å; L39-D63 WeakPolarHBondContact CB-OD2 3.44Å; L39-D63 PolarHBondContact N-OD2 3.36Å; L39-D63 PolarHBondContact O-N 2.9Å; D63-V79 WeakPolarHBondContact OD1-CG2 3.48Å; D63-H145 IonicContact OD1-CE1 2.8Å; D63-H145 IonicContact OD1-NE2 2.68Å; D63-H145 IonicContact OD2-CE1 3.33Å
64E82.8Confident72.7Confident64 Ų6464.2 Ų64.230%0.29936%0.364SS..EExtended strand (participates in β ladder)trans-128139.6172.1-68.2-168.4-176.500111.5T62 V66 R77 H78 L80 H82T62-E64 HydrophobicContact CG2-CG 3.85Å; T62-E64 WeakPolarHBondContact CG2-OE1 3.39Å; E64-V66 PolarHBondContact O-N 3.38Å; E64-R77 CarbonylContact O-C 3.46Å; E64-R77 WeakPolarHBondContact O-CA 3.28Å; E64-H78 PolarHBondContact N-O 3.29Å; E64-H78 PolarHBondContact O-N 2.9Å; E64-L80 HydrophobicContact CB-CD1 3.93Å; E64-L80 HydrophobicContact CG-CD1 4.12Å; E64-L80 WeakPolarHBondContact OE2-CD1 3.32Å; E64-H82 IonicContact OE1-CE1 3.26Å; E64-H82 PolarHBondContact OE1-CE1 3.29Å; E64-H82 IonicContact OE1-NE2 3.34Å; E64-H82 PolarHBondContact OE1-NE2 3.25Å
65Y71.1Confident70.8Confident136 Ų13667.9 Ų67.953%0.53339%0.392SS..EExtended strand (participates in β ladder)trans-75.3117170.9-102.3-78.5000109.8N76 R77Y65-N76 WeakPolarHBondContact CA-O 3.4Å; Y65-N76 HydrophobicContact CD1-CB 3.7Å; Y65-N76 HydrophobicContact CE1-CB 3.88Å; Y65-R77 HydrophobicContact CD1-CG 4.35Å; Y65-R77 HydrophobicContact CD2-CG 3.82Å; Y65-R77 HydrophobicContact CE1-CG 4.24Å; Y65-R77 HydrophobicContact CE2-CG 3.74Å; Y65-R77 HydrophobicContact CG-CG 4.14Å
66V61.8Low69.3Low52 Ų5270.6 Ų70.632%0.31541%0.406SS..  trans-95.7112169.5-179.50000107.8E64 S68 N76 H78E64-V66 PolarHBondContact O-N 3.38Å; V66-S68 PolarHBondContact O-N 3.27Å; V66-N76 PolarHBondContact N-O 2.58Å; V66-N76 WeakPolarHBondContact O-CB 3.49Å; V66-H78 HydrophobicContact CG2-CB 4.5Å
67L52.6Low68.4Low162 Ų16272.1 Ų72.185%0.84841%0.411SS*.  trans-61.6103.8173.8-70.6167.9000108.9
68S49.8Very low67.9Low55 Ų5574.2 Ų74.239%0.38542%0.421SS..  trans-92128.4170.366.30000109V66 N70 N76V66-S68 PolarHBondContact O-N 3.27Å; S68-N70 PolarHBondContact O-N 2.9Å; S68-N76 PolarHBondContact OG-ND2 3.4Å; S68-N76 VanDerWaalsContact OG-ND2 3.11Å; S68-N76 PolarHBondContact OG-OD1 3.23Å
69N49.4Very low67.6Low165 Ų16574 Ų7488%0.88242%0.419SS*.SBendtrans-69.47.1178.1-83.3-7.1000114
70N48.1Very low67.4Low136 Ų13675.2 Ų75.273%0.72743%0.425SS*.  trans-109.1111.5-178.5-74.4-9.7000109.6S68 A72S68-N70 PolarHBondContact O-N 2.9Å; N70-A72 PolarHBondContact O-N 2.86Å
71A43.5Very low67.4Low115 Ų11571.9 Ų71.995%0.9541%0.413SS*.  trans-74.739.1-170.200000115.4
72A42.6Very low67.5Low81 Ų8172.1 Ų72.167%0.66941%0.413SS*.  trans-146.1109.4-178.800000114N70N70-A72 PolarHBondContact O-N 2.86Å
73V42.3Very low67.7Low123 Ų12372 Ų7275%0.74541%0.413SS*.SBendtrans83.5129.2151.2-1670000119.1
74D42Very low68.1Low142 Ų14273.9 Ų73.976%0.75942%0.419SS*.SBendtrans56.3123.1161.8-65.5-18.1000120.3N76D74-N76 PolarHBondContact O-N 3.24Å
75S52.8Low68.8Low92 Ų9270.9 Ų70.964%0.64341%0.405SS*.  trans893.817661.40000115.6R77S75-R77 PolarHBondContact O-N 3.2Å
76N62.6Low69.9Low56 Ų5669.4 Ų69.430%0.29940%0.401SS..  trans-64.121.6170.6-86-22.5000113.8Y65 V66 S68 D74Y65-N76 WeakPolarHBondContact CA-O 3.4Å; Y65-N76 HydrophobicContact CD1-CB 3.7Å; Y65-N76 HydrophobicContact CE1-CB 3.88Å; V66-N76 PolarHBondContact N-O 2.58Å; V66-N76 WeakPolarHBondContact O-CB 3.49Å; S68-N76 PolarHBondContact OG-ND2 3.4Å; S68-N76 VanDerWaalsContact OG-ND2 3.11Å; S68-N76 PolarHBondContact OG-OD1 3.23Å; D74-N76 PolarHBondContact O-N 3.24Å
77R74.6Confident71.3Confident38 Ų3871.7 Ų71.714%0.14341%0.409CS..EExtended strand (participates in β ladder)trans-90.6125.7179.6-68.2-173.6-174.5-162.4-5.6109.6E36 T37 E64 Y65 S75E36-R77 IonicContact OE1-NH2 3.19Å; E36-R77 PolarHBondContact OE1-NH2 3.39Å; E36-R77 IonicContact OE2-CZ 2.75Å; E36-R77 IonicContact OE2-NH2 3.62Å; E36-R77 PolarHBondContact OE2-NH2 3.09Å; T37-R77 PolarHBondContact O-NH1 3.32Å; E64-R77 CarbonylContact O-C 3.46Å; E64-R77 WeakPolarHBondContact O-CA 3.28Å; Y65-R77 HydrophobicContact CD1-CG 4.35Å; Y65-R77 HydrophobicContact CD2-CG 3.82Å; Y65-R77 HydrophobicContact CE1-CG 4.24Å; Y65-R77 HydrophobicContact CE2-CG 3.74Å; Y65-R77 HydrophobicContact CG-CG 4.14Å; S75-R77 PolarHBondContact O-N 3.2Å
78H86.9Confident73.1Confident44 Ų4464.7 Ų64.720%0.20438%0.375CS..EExtended strand (participates in β ladder)trans-119.5139.1173.6-63.4-48.5000109.6E64 V66E64-H78 PolarHBondContact N-O 3.29Å; E64-H78 PolarHBondContact O-N 2.9Å; V66-H78 HydrophobicContact CG2-CB 4.5Å
79V90.6Very high75Confident1 Ų163.2 Ų63.21%0.00637%0.365CS..EExtended strand (participates in β ladder)trans-75.7128.3172178.70000108.3L39 L61 T62 D63 F140 T141 V144L39-V79 HydrophobicContact CD2-CG1 4.42Å; L61-V79 HydrophobicContact CD1-CG1 3.52Å; L61-V79 HydrophobicContact CG-CG1 3.89Å; T62-V79 CarbonylContact O-C 3.56Å; T62-V79 WeakPolarHBondContact O-CA 3.25Å; D63-V79 WeakPolarHBondContact OD1-CG2 3.48Å; V79-F140 HydrophobicContact CB-CD1 4.23Å; V79-F140 HydrophobicContact CB-CE1 4.1Å; V79-F140 HydrophobicContact CG1-CD1 4.32Å; V79-F140 HydrophobicContact CG1-CE1 3.71Å; V79-F140 HydrophobicContact CG1-CZ 4.36Å; V79-F140 WeakPolarHBondContact O-CD1 3.41Å; V79-F140 WeakPolarHBondContact O-CE1 3.23Å; V79-T141 HydrophobicContact CG2-CG2 4.07Å; V79-T141 PolarHBondContact N-OG1 3.21Å; V79-T141 VanDerWaalsContact N-OG1 3.13Å; V79-V144 HydrophobicContact CG1-CB 4.19Å; V79-V144 HydrophobicContact CG1-CG1 4.05Å; V79-V144 HydrophobicContact CG1-CG2 4.13Å; V79-V144 HydrophobicContact CG2-CB 4.2Å; V79-V144 HydrophobicContact CG2-CG1 4.23Å
80L92.7Very high76.9Confident26 Ų2656.2 Ų56.214%0.13633%0.329CS..EExtended strand (participates in β ladder)trans-121.7137.2176.8-61.9-179.6000110.5L61 T62 E64 H82 P129L61-L80 WeakPolarHBondContact CA-O 3.43Å; T62-L80 PolarHBondContact N-O 3.04Å; T62-L80 PolarHBondContact O-N 2.98Å; E64-L80 HydrophobicContact CB-CD1 3.93Å; E64-L80 HydrophobicContact CG-CD1 4.12Å; E64-L80 WeakPolarHBondContact OE2-CD1 3.32Å; L80-H82 VanDerWaalsContact CB-CE1 3.43Å; L80-H82 WeakPolarHBondContact CB-CE1 3.47Å; L80-P129 HydrophobicContact CD1-CB 4.42Å
81L95.3Very high78.9Confident0 Ų053.8 Ų53.80%032%0.32CS..EExtended strand (participates in β ladder)trans-99.2121.7168.3178.563.4000108.5W24 L59 R60 L61 A100 L115 I130 V154W24-L81 HydrophobicContact CZ3-CD1 4Å; L59-L81 HydrophobicContact CB-CD1 4.33Å; L59-L81 HydrophobicContact CD2-CD1 4.42Å; R60-L81 CarbonylContact O-C 3.57Å; R60-L81 WeakPolarHBondContact O-CA 3.49Å; L61-L81 HydrophobicContact CD1-CB 4.16Å; L61-L81 HydrophobicContact CD1-CD1 4.33Å; L81-A100 HydrophobicContact CD2-CB 3.8Å; L81-L115 HydrophobicContact CB-CD2 4.31Å; L81-L115 HydrophobicContact CD2-CD2 4.49Å; L81-I130 HydrophobicContact CD2-CD1 3.93Å; L81-I130 HydrophobicContact CG-CD1 4.01Å; L81-I130 PolarHBondContact O-N 2.87Å; L81-V154 HydrophobicContact CD2-CG1 3.79Å
82H95.6Very high81.3Confident7 Ų753.7 Ų53.73%0.03230%0.3CS..EExtended strand (participates in β ladder)trans-110.6144.6179.4-65.180.4000110.9L59 R60 E64 L80 Y84 W128L59-H82 CarbonylContact C-O 3.45Å; L59-H82 VanDerWaalsContact CA-O 3.26Å; L59-H82 WeakPolarHBondContact CA-O 3.41Å; R60-H82 HydrophobicContact CB-CB 4.28Å; R60-H82 PolarHBondContact N-O 3.21Å; R60-H82 PolarHBondContact O-N 2.83Å; E64-H82 IonicContact OE1-CE1 3.26Å; E64-H82 PolarHBondContact OE1-CE1 3.29Å; E64-H82 IonicContact OE1-NE2 3.34Å; E64-H82 PolarHBondContact OE1-NE2 3.25Å; L80-H82 VanDerWaalsContact CB-CE1 3.43Å; L80-H82 WeakPolarHBondContact CB-CE1 3.47Å; H82-Y84 HydrophobicContact CB-CD2 4.02Å; H82-Y84 HydrophobicContact CB-CE2 3.52Å; H82-W128 VanDerWaalsContact CA-O 3.28Å; H82-W128 WeakPolarHBondContact CA-O 3.21Å
83L97.1Very high83.7Confident0 Ų049.9 Ų49.90%027%0.269CS..EExtended strand (participates in β ladder)trans-103.5132.7163.4-177.668.2000108.5F46 W57 L59 V98 F122 G127 W128 I158F46-L83 HydrophobicContact CZ-CD1 4.03Å; W57-L83 HydrophobicContact CB-CD1 4.03Å; W57-L83 HydrophobicContact CE3-CD1 4.22Å; W57-L83 HydrophobicContact CE3-CD2 3.98Å; W57-L83 HydrophobicContact CE3-CG 3.97Å; W57-L83 HydrophobicContact CZ3-CD2 4.23Å; L59-L83 HydrophobicContact CD2-CB 4.32Å; L59-L83 HydrophobicContact CD2-CD1 3.7Å; L83-V98 HydrophobicContact CD2-CG1 4.15Å; L83-V98 HydrophobicContact CD2-CG2 3.74Å; L83-F122 HydrophobicContact CB-CE1 4.19Å; L83-F122 HydrophobicContact CB-CZ 4.44Å; L83-F122 HydrophobicContact CD2-CE1 4.15Å; L83-F122 HydrophobicContact CD2-CZ 4Å; L83-F122 HydrophobicContact CG-CE1 4.15Å; L83-F122 HydrophobicContact CG-CZ 4.45Å; L83-F122 WeakPolarHBondContact O-CE1 3.42Å; L83-G127 CarbonylContact O-C 3.55Å; L83-G127 WeakPolarHBondContact O-CA 3.47Å; L83-W128 PolarHBondContact N-O 3.41Å; L83-W128 PolarHBondContact O-N 3.21Å; L83-I158 HydrophobicContact CD1-CD1 4.09Å; L83-I158 HydrophobicContact CD2-CD1 4.02Å; L83-I158 HydrophobicContact CD2-CG1 4.35Å
84Y96.6Very high86.1Confident57 Ų5746.4 Ų46.422%0.22425%0.253CS..EExtended strand (participates in β ladder)trans-115131.9178-78.2-98.8000110.4W57 A58 R60 H82 S126 G127W57-Y84 CarbonylContact C-O 3.6Å; W57-Y84 WeakPolarHBondContact CA-O 3.43Å; A58-Y84 PolarHBondContact N-O 3.26Å; A58-Y84 PolarHBondContact O-N 3.33Å; R60-Y84 HydrophobicContact CB-CD2 4.17Å; R60-Y84 HydrophobicContact CB-CE2 3.7Å; R60-Y84 HydrophobicContact CG-CE2 4.43Å; R60-Y84 PolarHBondContact NH1-OH 2.93Å; H82-Y84 HydrophobicContact CB-CD2 4.02Å; H82-Y84 HydrophobicContact CB-CE2 3.52Å; Y84-S126 VanDerWaalsContact CA-O 3.32Å; Y84-S126 WeakPolarHBondContact CA-O 3.38Å; Y84-S126 WeakPolarHBondContact CD1-O 3.21Å; Y84-G127 VanDerWaalsContact CD1-CA 3.41Å
85Y96.4Very high88.5Confident0 Ų039.7 Ų39.70%022%0.217CC..EExtended strand (participates in β ladder)trans-87110.1168.2176.8-142.4000108.6F55 W57 E87 G88 C90 V93 F122 R124 G125 S126F55-Y85 HydrophobicContact CB-CE2 4.37Å; F55-Y85 AromaticContact CD1-CE2 3.84Å; F55-Y85 HydrophobicContact CD1-CE2 3.84Å; W57-Y85 HydrophobicContact CE3-CD2 4.34Å; W57-Y85 HydrophobicContact CH2-CD2 4.17Å; W57-Y85 HydrophobicContact CH2-CG 4.44Å; W57-Y85 HydrophobicContact CZ2-CD2 4.49Å; W57-Y85 HydrophobicContact CZ3-CD2 4.1Å; W57-Y85 HydrophobicContact CZ3-CG 4.16Å; Y85-E87 VanDerWaalsContact CE2-C 3.44Å; Y85-E87 WeakPolarHBondContact CE2-O 3.41Å; Y85-G88 WeakPolarHBondContact OH-CA 3.32Å; Y85-G88 PolarHBondContact OH-N 2.93Å; Y85-C90 PolarHBondContact OH-O 2.78Å; Y85-V93 HydrophobicContact CD1-CG1 3.66Å; Y85-V93 HydrophobicContact CD2-CG1 4.19Å; Y85-V93 HydrophobicContact CE1-CB 4.39Å; Y85-V93 HydrophobicContact CE1-CG1 3.69Å; Y85-V93 HydrophobicContact CE2-CG1 4.21Å; Y85-V93 HydrophobicContact CG-CG1 3.94Å; Y85-F122 HydrophobicContact CD1-CB 4.13Å; Y85-F122 HydrophobicContact CG-CB 4.22Å; Y85-R124 HydrophobicContact CD1-CB 4.13Å; Y85-R124 HydrophobicContact CE1-CB 3.92Å; Y85-R124 HydrophobicContact CE1-CG 4.4Å; Y85-G125 WeakPolarHBondContact O-CA 3.47Å; Y85-G125 PolarHBondContact O-N 2.89Å; Y85-S126 PolarHBondContact N-O 3.42Å
86K94.4Very high90.5Very high106 Ų10637.7 Ų37.746%0.46120%0.197SC..EExtended strand (participates in β ladder)trans-88.8-49-175.8-64.5-15974.7179.40112.3P45 T56 A58 R124P45-K86 HydrophobicContact CB-CD 4.2Å; P45-K86 HydrophobicContact CG-CD 3.99Å; T56-K86 HydrophobicContact CG2-CB 4.14Å; T56-K86 PolarHBondContact O-N 3.35Å; A58-K86 HydrophobicContact CB-CD 3.84Å; A58-K86 HydrophobicContact CB-CG 4.2Å; K86-R124 VanDerWaalsContact O-CG 3.22Å; K86-R124 WeakPolarHBondContact O-CG 3.36Å
87E91.8Very high92Very high99 Ų9937.2 Ų37.246%0.46319%0.193SC..EExtended strand (participates in β ladder)trans-161.3147-166.8179.8177.4-149.800109.9T56 Y85 R380T56-E87 PolarHBondContact N-O 2.81Å; T56-E87 PolarHBondContact O-N 3.12Å; Y85-E87 VanDerWaalsContact CE2-C 3.44Å; Y85-E87 WeakPolarHBondContact CE2-O 3.41Å; E87-R380 IonicContact OE2-CZ 2.58Å; E87-R380 IonicContact OE2-NH1 2.62Å; E87-R380 PolarHBondContact OE2-NH1 3.03Å; E87-R380 IonicContact OE2-NH2 3.09Å
88G90.9Very high93Very high15 Ų1535.4 Ų35.416%0.15519%0.187CC..  trans174.3-175.5177.700000110.4Y85 C90 R124Y85-G88 WeakPolarHBondContact OH-CA 3.32Å; Y85-G88 PolarHBondContact OH-N 2.93Å; G88-C90 VanDerWaalsContact C-N 3.29Å; G88-C90 PolarHBondContact O-N 2.74Å; G88-R124 PolarHBondContact O-NH2 3.17Å
89P89.2Confident93.4Very high24 Ų2439.2 Ų39.216%0.15620%0.199CC..SBendtrans-65.3-27.7-171.522.7-33.9000114.5V53 Q54 F55 Y170 M323V53-P89 HydrophobicContact CG1-CG 4.01Å; Q54-P89 WeakPolarHBondContact O-CD 3.41Å; F55-P89 HydrophobicContact CD1-CG 4.49Å; F55-P89 HydrophobicContact CE1-CG 3.79Å; F55-P89 HydrophobicContact CE2-CG 4.38Å; F55-P89 HydrophobicContact CZ-CG 3.75Å; P89-Y170 HydrophobicContact CB-CD1 3.65Å; P89-Y170 HydrophobicContact CB-CD2 3.7Å; P89-Y170 HydrophobicContact CB-CE1 3.6Å; P89-Y170 HydrophobicContact CB-CE2 3.67Å; P89-Y170 HydrophobicContact CB-CG 3.69Å; P89-Y170 HydrophobicContact CG-CD1 4.12Å; P89-Y170 HydrophobicContact CG-CD2 4.17Å; P89-Y170 HydrophobicContact CG-CE1 3.52Å; P89-Y170 HydrophobicContact CG-CE2 3.59Å; P89-Y170 HydrophobicContact CG-CG 4.4Å; P89-Y170 WeakPolarHBondContact CG-OH 3.32Å; P89-M323 HydrophobicContact CB-CE 4.01Å; P89-M323 HydrophobicContact CB-SD 3.64Å; P89-M323 HydrophobicContact CG-SD 4.06Å
90C89.8Confident93.7Very high19 Ų1939.5 Ų39.513%0.12820%0.202CC..SBendtrans-123.3157.5-176.451.90000111.6Y85 G88 E92 R124 Y170Y85-C90 PolarHBondContact OH-O 2.78Å; G88-C90 VanDerWaalsContact C-N 3.29Å; G88-C90 PolarHBondContact O-N 2.74Å; C90-E92 VanDerWaalsContact C-N 3.32Å; C90-E92 PolarHBondContact SG-O 3.08Å; C90-R124 VanDerWaalsContact C-NH2 3.28Å; C90-R124 PolarHBondContact O-NH2 3.47Å; C90-Y170 HydrophobicContact CB-CD1 4.11Å; C90-Y170 HydrophobicContact CB-CE1 3.87Å
91P89.7Confident93.8Very high85 Ų8541.4 Ų41.455%0.55221%0.21SC*.SBendtrans-70.2-30.5174.427.8-33.9000112.2S123 R124P91-S123 CarbonylContact O-C 3.56Å; P91-S123 WeakPolarHBondContact O-CA 3.05Å; P91-R124 PolarHBondContact O-N 2.97Å
92E92.6Very high93.8Very high112 Ų11241.5 Ų41.552%0.52321%0.21SC..EExtended strand (participates in β ladder)trans-124.9134.7-177-71.4167.4178.700109.9C90 E121 F122C90-E92 VanDerWaalsContact C-N 3.32Å; C90-E92 PolarHBondContact SG-O 3.08Å; E92-E121 HydrophobicContact CB-CG 4.36Å; E92-F122 CarbonylContact C-O 3.58Å; E92-F122 VanDerWaalsContact CA-O 3.32Å; E92-F122 WeakPolarHBondContact CA-O 3.27Å
93V93.4Very high93.8Very high2 Ų241.5 Ų41.51%0.01221%0.211CC..EExtended strand (participates in β ladder)trans-135.8127.7178.561.30000110.6F55 W57 Y85 E121 F122 M160 L164F55-V93 HydrophobicContact CD1-CB 4.4Å; F55-V93 HydrophobicContact CD1-CG1 4.49Å; F55-V93 HydrophobicContact CD1-CG2 4.07Å; F55-V93 HydrophobicContact CE1-CB 4.03Å; F55-V93 HydrophobicContact CE1-CG2 3.6Å; F55-V93 HydrophobicContact CZ-CG2 4.18Å; W57-V93 HydrophobicContact CH2-CG1 3.81Å; Y85-V93 HydrophobicContact CD1-CG1 3.66Å; Y85-V93 HydrophobicContact CD2-CG1 4.19Å; Y85-V93 HydrophobicContact CE1-CB 4.39Å; Y85-V93 HydrophobicContact CE1-CG1 3.69Å; Y85-V93 HydrophobicContact CE2-CG1 4.21Å; Y85-V93 HydrophobicContact CG-CG1 3.94Å; V93-E121 WeakPolarHBondContact O-CA 3.5Å; V93-F122 HydrophobicContact CG1-CB 3.91Å; V93-F122 PolarHBondContact N-O 3.04Å; V93-F122 PolarHBondContact O-N 2.7Å; V93-M160 HydrophobicContact CG2-CE 3.72Å; V93-L164 HydrophobicContact CG2-CD1 3.91Å; V93-L164 HydrophobicContact CG2-CD2 4.3Å
94A92.4Very high93.5Very high50 Ų5043 Ų4341%0.41322%0.219SC..EExtended strand (participates in β ladder)trans-84.7122.2172.500000109.9L164A94-L164 WeakPolarHBondContact O-CD1 3.49Å
95V93.3Very high93.2Very high1 Ų142.7 Ų42.71%0.00622%0.224CC..EExtended strand (participates in β ladder)trans-104.3128.7174.2179.80000107.9W57 V98 P119 T120 F122 I158 K159W57-V95 HydrophobicContact CH2-CG2 3.57Å; W57-V95 HydrophobicContact CZ2-CG2 4.33Å; W57-V95 HydrophobicContact CZ3-CG2 4.24Å; V95-V98 HydrophobicContact CG1-CG2 3.67Å; V95-P119 VanDerWaalsContact O-CA 3.29Å; V95-P119 WeakPolarHBondContact O-CA 3.49Å; V95-T120 PolarHBondContact N-O 3.37Å; V95-T120 PolarHBondContact O-N 3.21Å; V95-T120 VanDerWaalsContact O-N 3.08Å; V95-F122 HydrophobicContact CB-CD2 4.26Å; V95-F122 HydrophobicContact CB-CE2 4.07Å; V95-F122 HydrophobicContact CG2-CD2 3.78Å; V95-F122 HydrophobicContact CG2-CE2 3.94Å; V95-I158 HydrophobicContact CG1-CG2 3.78Å; V95-K159 WeakPolarHBondContact CG1-O 3.28Å
96E93.8Very high92.9Very high50 Ų5048.9 Ų48.923%0.23426%0.261CS..SBendtrans-71.8-42.6-175.6-68.2-62.4145.400111.5V17 P119 K159 K161V17-E96 HydrophobicContact CG2-CG 4.39Å; E96-P119 WeakPolarHBondContact O-CA 3.49Å; E96-P119 VanDerWaalsContact O-CD 3.3Å; E96-P119 WeakPolarHBondContact O-CD 3.45Å; E96-P119 VanDerWaalsContact O-CG 3.25Å; E96-P119 WeakPolarHBondContact O-CG 3.45Å; E96-K159 HydrophobicContact CB-CB 4.44Å; E96-K159 PolarHBondContact N-O 2.87Å; E96-K161 HydrophobicContact CG-CG 4Å; E96-K161 WeakPolarHBondContact OE1-CD 3.37Å; E96-K161 WeakPolarHBondContact OE1-CE 3.32Å; E96-K161 WeakPolarHBondContact OE1-CG 3.29Å; E96-K161 IonicContact OE1-NZ 3.67Å; E96-K161 PolarHBondContact OE1-NZ 2.99Å
97E94.6Very high92.7Very high45 Ų4547.5 Ų47.521%0.2126%0.262CS..EExtended strand (participates in β ladder)trans-158.1142.6179.5-170.5177.9-149.600110.3R99 K159E97-R99 HydrophobicContact CG-CG 4.17Å; E97-R99 IonicContact OE1-CZ 3.89Å; E97-R99 IonicContact OE1-NE 2.92Å; E97-R99 PolarHBondContact OE1-NE 3.09Å; E97-R99 IonicContact OE1-NH2 3.68Å; E97-R99 PolarHBondContact OE1-NH2 3.08Å; E97-R99 IonicContact OE2-CZ 3.86Å; E97-R99 IonicContact OE2-NE 3.62Å; E97-R99 PolarHBondContact OE2-NE 3.19Å; E97-R99 IonicContact OE2-NH2 2.63Å; E97-R99 PolarHBondContact OE2-NH2 2.8Å; E97-K159 HydrophobicContact CB-CB 4.11Å; E97-K159 HydrophobicContact CB-CD 4.19Å; E97-K159 HydrophobicContact CB-CG 4.46Å; E97-K159 PolarHBondContact N-O 3.4Å; E97-K159 PolarHBondContact O-N 2.96Å; E97-K159 WeakPolarHBondContact OE2-CD 3.26Å; E97-K159 WeakPolarHBondContact OE2-CE 3.41Å; E97-K159 IonicContact OE2-NZ 3.87Å; E97-K159 PolarHBondContact OE2-NZ 3.08Å
98V95.7Very high92.5Very high1 Ų147.8 Ų47.81%0.00627%0.267CS..EExtended strand (participates in β ladder)trans-122.8131.5164.4-174.30000108.5L83 V95 A116 L117 I130 V156 E157 I158L83-V98 HydrophobicContact CD2-CG1 4.15Å; L83-V98 HydrophobicContact CD2-CG2 3.74Å; V95-V98 HydrophobicContact CG1-CG2 3.67Å; V98-A116 CarbonylContact O-C 3.58Å; V98-A116 VanDerWaalsContact O-CA 3.25Å; V98-A116 WeakPolarHBondContact O-CA 3.43Å; V98-L117 HydrophobicContact CB-CB 3.83Å; V98-L117 HydrophobicContact CG2-CB 4.26Å; V98-L117 HydrophobicContact CG2-CD2 4.12Å; V98-L117 PolarHBondContact N-O 3.5Å; V98-L117 PolarHBondContact O-N 3.37Å; V98-I130 HydrophobicContact CG1-CD1 3.97Å; V98-V156 HydrophobicContact CG1-CG1 3.62Å; V98-E157 CarbonylContact C-O 3.53Å; V98-E157 VanDerWaalsContact CA-O 3.3Å; V98-E157 WeakPolarHBondContact CA-O 3.34Å; V98-I158 HydrophobicContact CG1-CG1 4.48Å; V98-I158 HydrophobicContact CG2-CG2 4.48Å
99R95.9Very high92.7Very high123 Ų12353.3 Ų53.346%0.46429%0.288SS..EExtended strand (participates in β ladder)trans-120.8143.3170.8-64.8-177.1-178.8-170.73.3109.9E97 L115 V156 E157E97-R99 HydrophobicContact CG-CG 4.17Å; E97-R99 IonicContact OE1-CZ 3.89Å; E97-R99 IonicContact OE1-NE 2.92Å; E97-R99 PolarHBondContact OE1-NE 3.09Å; E97-R99 IonicContact OE1-NH2 3.68Å; E97-R99 PolarHBondContact OE1-NH2 3.08Å; E97-R99 IonicContact OE2-CZ 3.86Å; E97-R99 IonicContact OE2-NE 3.62Å; E97-R99 PolarHBondContact OE2-NE 3.19Å; E97-R99 IonicContact OE2-NH2 2.63Å; E97-R99 PolarHBondContact OE2-NH2 2.8Å; R99-L115 WeakPolarHBondContact CA-O 3.42Å; R99-V156 CarbonylContact O-C 3.59Å; R99-V156 WeakPolarHBondContact O-CA 3.5Å; R99-E157 HydrophobicContact CB-CB 4.4Å; R99-E157 PolarHBondContact N-O 2.94Å; R99-E157 PolarHBondContact O-N 3.36Å
100A96.4Very high92.9Very high7 Ų756.1 Ų56.16%0.05831%0.305CS..EExtended strand (participates in β ladder)trans-134150172.900000112L81 L115 I130 V155 V156L81-A100 HydrophobicContact CD2-CB 3.8Å; A100-L115 HydrophobicContact CB-CB 3.8Å; A100-L115 HydrophobicContact CB-CD1 4.15Å; A100-L115 PolarHBondContact N-O 2.86Å; A100-L115 WeakPolarHBondContact O-CB 3.44Å; A100-I130 HydrophobicContact CB-CD1 4.05Å; A100-V155 WeakPolarHBondContact CA-O 3.49Å; A100-V156 HydrophobicContact CB-CG2 3.99Å
101Q95.6Very high93.1Very high66 Ų6657.7 Ų57.731%0.30831%0.312SS..EExtended strand (participates in β ladder)trans-140.6150.9172.861.2-176.13.500110.2L103 F112 V154 V155Q101-L103 HydrophobicContact CG-CD2 4.11Å; Q101-L103 HydrophobicContact CG-CG 4.33Å; Q101-F112 WeakPolarHBondContact CA-O 3.46Å; Q101-V154 WeakPolarHBondContact O-CA 3.36Å; Q101-V155 HydrophobicContact CG-CB 3.95Å; Q101-V155 PolarHBondContact N-O 2.97Å; Q101-V155 PolarHBondContact O-N 2.91Å
102I95.7Very high93.3Very high2 Ų253.8 Ų53.81%0.0129%0.286CS..EExtended strand (participates in β ladder)trans-107.6123.4175.9-45.8-61.6000107.6L111 F112 L115 F140 L152 L153 V154I102-L111 HydrophobicContact CG2-CB 4.4Å; I102-L111 PolarHBondContact O-N 3.28Å; I102-F112 HydrophobicContact CB-CB 4.01Å; I102-F112 HydrophobicContact CG1-CB 3.95Å; I102-F112 PolarHBondContact N-O 2.9Å; I102-F112 PolarHBondContact O-N 2.7Å; I102-F112 VanDerWaalsContact O-N 3.08Å; I102-L115 HydrophobicContact CD1-CD1 4.47Å; I102-L115 HydrophobicContact CG1-CD1 4.38Å; I102-F140 HydrophobicContact CD1-CE2 4.13Å; I102-F140 HydrophobicContact CG1-CE2 3.87Å; I102-L152 HydrophobicContact CG2-CB 4.37Å; I102-L152 HydrophobicContact CG2-CD1 4.21Å; I102-L152 HydrophobicContact CG2-CD2 4.08Å; I102-L152 HydrophobicContact CG2-CG 4.47Å; I102-L153 CarbonylContact C-O 3.47Å; I102-L153 WeakPolarHBondContact CA-O 3.08Å; I102-V154 HydrophobicContact CD1-CB 4.31Å; I102-V154 HydrophobicContact CD1-CG1 4.15Å; I102-V154 HydrophobicContact CD1-CG2 3.72Å
103L94.3Very high93.3Very high8 Ų850.1 Ų50.14%0.04228%0.275CS..EExtended strand (participates in β ladder)trans-115.5153.3179.4-50.6-179000109.9Q101 N108 E109 T110 L153 V155Q101-L103 HydrophobicContact CG-CD2 4.11Å; Q101-L103 HydrophobicContact CG-CG 4.33Å; L103-N108 WeakPolarHBondContact CD1-OD1 3.19Å; L103-E109 CarbonylContact C-O 3.56Å; L103-E109 VanDerWaalsContact CA-O 3.28Å; L103-E109 WeakPolarHBondContact CA-O 3.28Å; L103-T110 HydrophobicContact CD2-CG2 4.23Å; L103-T110 WeakPolarHBondContact CD2-OG1 3.43Å; L103-L153 HydrophobicContact CB-CB 4.23Å; L103-L153 HydrophobicContact CB-CD2 4.24Å; L103-L153 HydrophobicContact CB-CG 4.36Å; L103-L153 HydrophobicContact CD1-CD2 4.21Å; L103-L153 PolarHBondContact N-O 3.11Å; L103-L153 PolarHBondContact O-N 2.91Å; L103-L153 VanDerWaalsContact O-N 3.08Å; L103-V155 HydrophobicContact CD1-CG2 3.69Å; L103-V155 HydrophobicContact CG-CG2 4.29Å
104D91.6Very high93.1Very high31 Ų3152.4 Ų52.417%0.16630%0.299CS..  trans-70.5128.1164.1-172-77.1000109.1V106 T107 N108 E109 L111D104-V106 PolarHBondContact O-N 3.08Å; D104-V106 WeakPolarHBondContact OD1-CA 3.48Å; D104-V106 WeakPolarHBondContact OD1-CB 3.23Å; D104-V106 PolarHBondContact OD1-N 3.32Å; D104-T107 WeakPolarHBondContact CB-OG1 3.23Å; D104-T107 PolarHBondContact OD1-N 3.17Å; D104-T107 VanDerWaalsContact OD1-N 3.1Å; D104-N108 WeakPolarHBondContact O-CA 3.38Å; D104-N108 PolarHBondContact O-N 2.82Å; D104-E109 PolarHBondContact N-O 2.82Å; D104-L111 HydrophobicContact CB-CD1 4.1Å; D104-L111 HydrophobicContact CB-CD2 4.28Å; D104-L111 HydrophobicContact CB-CG 4.19Å
105P89.9Confident93.2Very high51 Ų5150.1 Ų50.133%0.33128%0.28SS..THydrogen-bonded Turntrans-68.6-16.3-17528.1-35.3000114N151 L153P105-N151 HydrophobicContact CG-CB 3.9Å; P105-L153 HydrophobicContact CB-CB 4.31Å
106V89.4Confident93.2Very high130 Ų13052 Ų5279%0.78830%0.296SS*.THydrogen-bonded Turntrans-99.2-50.1-178.6-1770000111D104D104-V106 PolarHBondContact O-N 3.08Å; D104-V106 WeakPolarHBondContact OD1-CA 3.48Å; D104-V106 WeakPolarHBondContact OD1-CB 3.23Å; D104-V106 PolarHBondContact OD1-N 3.32Å
107T90.5Very high93.1Very high77 Ų7749.8 Ų49.847%0.47229%0.285SS..THydrogen-bonded Turntrans-87.7-15.5-176.865.80000113D104 E109D104-T107 WeakPolarHBondContact CB-OG1 3.23Å; D104-T107 PolarHBondContact OD1-N 3.17Å; D104-T107 VanDerWaalsContact OD1-N 3.1Å; T107-E109 PolarHBondContact O-N 3.46Å; T107-E109 WeakPolarHBondContact OG1-CB 3.31Å; T107-E109 WeakPolarHBondContact OG1-CG 3.31Å; T107-E109 PolarHBondContact OG1-N 3.36Å; T107-E109 PolarHBondContact OG1-OE2 3.37Å
108N89.1Confident92.8Very high105 Ų10551.8 Ų51.856%0.56130%0.304SS*.  trans58.217.9-171.8-15346.2000113.4L103 D104L103-N108 WeakPolarHBondContact CD1-OD1 3.19Å; D104-N108 WeakPolarHBondContact O-CA 3.38Å; D104-N108 PolarHBondContact O-N 2.82Å
109E93.2Very high92.2Very high130 Ų13056.3 Ų56.361%0.60733%0.334SS*.  trans-76.4142.4175.6-70.1177.3156.100110.6L103 D104 T107 L111L103-E109 CarbonylContact C-O 3.56Å; L103-E109 VanDerWaalsContact CA-O 3.28Å; L103-E109 WeakPolarHBondContact CA-O 3.28Å; D104-E109 PolarHBondContact N-O 2.82Å; T107-E109 PolarHBondContact O-N 3.46Å; T107-E109 WeakPolarHBondContact OG1-CB 3.31Å; T107-E109 WeakPolarHBondContact OG1-CG 3.31Å; T107-E109 PolarHBondContact OG1-N 3.36Å; T107-E109 PolarHBondContact OG1-OE2 3.37Å; E109-L111 PolarHBondContact O-N 3.39Å
110T94.6Very high91.9Very high84 Ų8452 Ų5252%0.51532%0.321SS..EExtended strand (participates in β ladder)trans-71.8112.5179.1-54.70000111L103 A113L103-T110 HydrophobicContact CD2-CG2 4.23Å; L103-T110 WeakPolarHBondContact CD2-OG1 3.43Å; T110-A113 HydrophobicContact CG2-CB 3.91Å
111L93.3Very high91.7Very high51 Ų5156.5 Ų56.527%0.26734%0.341SS..EExtended strand (participates in β ladder)trans-84.5-34.3174-60.8178000111.7I102 D104 E109 L143 L152I102-L111 HydrophobicContact CG2-CB 4.4Å; I102-L111 PolarHBondContact O-N 3.28Å; D104-L111 HydrophobicContact CB-CD1 4.1Å; D104-L111 HydrophobicContact CB-CD2 4.28Å; D104-L111 HydrophobicContact CB-CG 4.19Å; E109-L111 PolarHBondContact O-N 3.39Å; L111-L143 HydrophobicContact CB-CD2 4.22Å; L111-L152 HydrophobicContact CD1-CD2 3.81Å
112F94.9Very high91.6Very high3 Ų353.4 Ų53.41%0.01333%0.327CS..EExtended strand (participates in β ladder)trans-154.5144.7176.4-167-91.5000110.9Q101 I102 L115 M132 R136 E139 F140 L143Q101-F112 WeakPolarHBondContact CA-O 3.46Å; I102-F112 HydrophobicContact CB-CB 4.01Å; I102-F112 HydrophobicContact CG1-CB 3.95Å; I102-F112 PolarHBondContact N-O 2.9Å; I102-F112 PolarHBondContact O-N 2.7Å; I102-F112 VanDerWaalsContact O-N 3.08Å; F112-L115 HydrophobicContact CD1-CD1 3.71Å; F112-L115 HydrophobicContact CD1-CG 4.25Å; F112-L115 HydrophobicContact CE1-CD1 3.96Å; F112-L115 HydrophobicContact CE1-CG 3.98Å; F112-M132 HydrophobicContact CE1-SD 4.23Å; F112-M132 HydrophobicContact CZ-SD 3.95Å; F112-R136 HydrophobicContact CE2-CB 4.47Å; F112-R136 VanDerWaalsContact CE2-NH2 3.29Å; F112-R136 HydrophobicContact CZ-CB 4.18Å; F112-E139 HydrophobicContact CE2-CB 4.43Å; F112-E139 HydrophobicContact CE2-CG 4.2Å; F112-F140 HydrophobicContact CB-CD2 4.49Å; F112-F140 AromaticContact CD1-CD2 3.63Å; F112-F140 HydrophobicContact CD1-CD2 3.63Å; F112-F140 HydrophobicContact CD1-CE2 4.2Å; F112-F140 HydrophobicContact CD1-CG 4.47Å; F112-F140 HydrophobicContact CD2-CB 4.3Å; F112-F140 HydrophobicContact CD2-CD2 4.17Å; F112-F140 HydrophobicContact CE1-CB 4.15Å; F112-F140 AromaticContact CE1-CD2 3.78Å; F112-F140 HydrophobicContact CE1-CD2 3.78Å; F112-F140 HydrophobicContact CE1-CG 4.2Å; F112-F140 HydrophobicContact CE2-CB 3.73Å; F112-F140 HydrophobicContact CE2-CD2 4.3Å; F112-F140 HydrophobicContact CE2-CG 4.48Å; F112-F140 AromaticContact CG-CD2 3.84Å; F112-F140 HydrophobicContact CG-CD2 3.84Å; F112-F140 HydrophobicContact CZ-CB 3.66Å; F112-F140 HydrophobicContact CZ-CD2 4.12Å; F112-F140 HydrophobicContact CZ-CG 4.21Å; F112-L143 HydrophobicContact CB-CD2 3.61Å; F112-L143 HydrophobicContact CD2-CD2 4.38Å; F112-L143 HydrophobicContact CG-CD2 4.32Å
113A92.4Very high91.6Very high36 Ų3655.8 Ų55.830%0.29834%0.344SS..EExtended strand (participates in β ladder)trans-143.5176.417800000110.2T110 R136T110-A113 HydrophobicContact CG2-CB 3.91Å; A113-R136 PolarHBondContact O-NH1 2.84Å
114G89.1Confident91.5Very high50 Ų5061.3 Ų61.352%0.51536%0.364SS..EExtended strand (participates in β ladder)trans85.817.417800000114.2
115L94.2Very high91.6Very high2 Ų262.7 Ų62.71%0.0139%0.386CS..EExtended strand (participates in β ladder)trans-78.9119.5163.3-67.5129.8000107.9L81 R99 A100 I102 F112 I130 H131 M132 F140L81-L115 HydrophobicContact CB-CD2 4.31Å; L81-L115 HydrophobicContact CD2-CD2 4.49Å; R99-L115 WeakPolarHBondContact CA-O 3.42Å; A100-L115 HydrophobicContact CB-CB 3.8Å; A100-L115 HydrophobicContact CB-CD1 4.15Å; A100-L115 PolarHBondContact N-O 2.86Å; A100-L115 WeakPolarHBondContact O-CB 3.44Å; I102-L115 HydrophobicContact CD1-CD1 4.47Å; I102-L115 HydrophobicContact CG1-CD1 4.38Å; F112-L115 HydrophobicContact CD1-CD1 3.71Å; F112-L115 HydrophobicContact CD1-CG 4.25Å; F112-L115 HydrophobicContact CE1-CD1 3.96Å; F112-L115 HydrophobicContact CE1-CG 3.98Å; L115-I130 HydrophobicContact CB-CG2 3.74Å; L115-I130 HydrophobicContact CD2-CB 4.48Å; L115-I130 HydrophobicContact CD2-CG2 4.46Å; L115-H131 CarbonylContact C-O 3.49Å; L115-H131 WeakPolarHBondContact CA-O 3.45Å; L115-M132 HydrophobicContact CD2-CE 3.49Å; L115-M132 VanDerWaalsContact CD2-CE 3.49Å; L115-M132 HydrophobicContact CG-CE 4.36Å; L115-F140 HydrophobicContact CD1-CE2 4.33Å; L115-F140 HydrophobicContact CD2-CZ 4.43Å
116A94Very high91.7Very high41 Ų4162 Ų6234%0.33938%0.382SS..EExtended strand (participates in β ladder)trans-142.1147.6178.400000112.1V98 H131V98-A116 CarbonylContact O-C 3.58Å; V98-A116 VanDerWaalsContact O-CA 3.25Å; V98-A116 WeakPolarHBondContact O-CA 3.43Å; A116-H131 PolarHBondContact N-O 2.9Å; A116-H131 WeakPolarHBondContact O-CA 3.26Å; A116-H131 WeakPolarHBondContact O-CB 3.31Å; A116-H131 PolarHBondContact O-N 3.46Å; A116-H131 VanDerWaalsContact O-O 3.14Å
117L91.6Very high91.8Very high2 Ų256.9 Ų56.91%0.0136%0.355CS..EExtended strand (participates in β ladder)trans-122.5118.3169.7-163.7116.5000107V98 T120 F122 W128 P129V98-L117 HydrophobicContact CB-CB 3.83Å; V98-L117 HydrophobicContact CG2-CB 4.26Å; V98-L117 HydrophobicContact CG2-CD2 4.12Å; V98-L117 PolarHBondContact N-O 3.5Å; V98-L117 PolarHBondContact O-N 3.37Å; L117-T120 VanDerWaalsContact CD2-CB 3.42Å; L117-T120 HydrophobicContact CD2-CG2 4.09Å; L117-T120 VanDerWaalsContact CD2-OG1 3.25Å; L117-T120 WeakPolarHBondContact CD2-OG1 3.15Å; L117-F122 HydrophobicContact CD2-CE2 3.73Å; L117-F122 HydrophobicContact CD2-CZ 3.78Å; L117-W128 HydrophobicContact CD1-CB 3.91Å; L117-P129 WeakPolarHBondContact CD1-O 3.26Å
118S86.6Confident91.9Very high87 Ų8758.4 Ų58.461%0.60835%0.352SS*.  trans-65.4170.3171.9-60.20000110.7T120S118-T120 PolarHBondContact O-N 3.49Å; S118-T120 PolarHBondContact O-OG1 3.45Å
119P84.5Confident92.1Very high97 Ų9754.8 Ų54.863%0.6334%0.335SS*.SBendtrans-46.1120.2179-2931.9000111.9V95 E96V95-P119 VanDerWaalsContact O-CA 3.29Å; V95-P119 WeakPolarHBondContact O-CA 3.49Å; E96-P119 WeakPolarHBondContact O-CA 3.49Å; E96-P119 VanDerWaalsContact O-CD 3.3Å; E96-P119 WeakPolarHBondContact O-CD 3.45Å; E96-P119 VanDerWaalsContact O-CG 3.25Å; E96-P119 WeakPolarHBondContact O-CG 3.45Å
120T88.7Confident92.1Very high32 Ų3248.7 Ų48.720%0.19631%0.306CS..EExtended strand (participates in β ladder)trans-143.3143.5-172.3-59.10000109.8V95 L117 S118 F122 W128V95-T120 PolarHBondContact N-O 3.37Å; V95-T120 PolarHBondContact O-N 3.21Å; V95-T120 VanDerWaalsContact O-N 3.08Å; L117-T120 VanDerWaalsContact CD2-CB 3.42Å; L117-T120 HydrophobicContact CD2-CG2 4.09Å; L117-T120 VanDerWaalsContact CD2-OG1 3.25Å; L117-T120 WeakPolarHBondContact CD2-OG1 3.15Å; S118-T120 PolarHBondContact O-N 3.49Å; S118-T120 PolarHBondContact O-OG1 3.45Å; T120-F122 HydrophobicContact CG2-CD2 4.43Å; T120-F122 HydrophobicContact CG2-CE2 4.13Å; T120-W128 HydrophobicContact CG2-CD2 3.92Å; T120-W128 HydrophobicContact CG2-CE3 4.48Å; T120-W128 HydrophobicContact CG2-CG 4.01Å; T120-W128 HydrophobicContact CG2-CZ2 4.41Å
121E92.6Very high91.9Very high102 Ų10250 Ų5048%0.47731%0.306SS..EExtended strand (participates in β ladder)trans-93.5127.9174.9-161.7-179117.700110.8E92 V93 W128E92-E121 HydrophobicContact CB-CG 4.36Å; V93-E121 WeakPolarHBondContact O-CA 3.5Å; E121-W128 PolarHBondContact O-NE1 3.26Å
122F93.5Very high91.7Very high0 Ų048.8 Ų48.80%030%0.3CS..EExtended strand (participates in β ladder)trans-105.4123.4177.3-72.7-110.4000109.4W57 L83 Y85 E92 V93 V95 L117 T120 W128W57-F122 HydrophobicContact CZ3-CD1 4Å; W57-F122 HydrophobicContact CZ3-CE1 4.37Å; W57-F122 HydrophobicContact CZ3-CG 4.11Å; L83-F122 HydrophobicContact CB-CE1 4.19Å; L83-F122 HydrophobicContact CB-CZ 4.44Å; L83-F122 HydrophobicContact CD2-CE1 4.15Å; L83-F122 HydrophobicContact CD2-CZ 4Å; L83-F122 HydrophobicContact CG-CE1 4.15Å; L83-F122 HydrophobicContact CG-CZ 4.45Å; L83-F122 WeakPolarHBondContact O-CE1 3.42Å; Y85-F122 HydrophobicContact CD1-CB 4.13Å; Y85-F122 HydrophobicContact CG-CB 4.22Å; E92-F122 CarbonylContact C-O 3.58Å; E92-F122 VanDerWaalsContact CA-O 3.32Å; E92-F122 WeakPolarHBondContact CA-O 3.27Å; V93-F122 HydrophobicContact CG1-CB 3.91Å; V93-F122 PolarHBondContact N-O 3.04Å; V93-F122 PolarHBondContact O-N 2.7Å; V95-F122 HydrophobicContact CB-CD2 4.26Å; V95-F122 HydrophobicContact CB-CE2 4.07Å; V95-F122 HydrophobicContact CG2-CD2 3.78Å; V95-F122 HydrophobicContact CG2-CE2 3.94Å; L117-F122 HydrophobicContact CD2-CE2 3.73Å; L117-F122 HydrophobicContact CD2-CZ 3.78Å; T120-F122 HydrophobicContact CG2-CD2 4.43Å; T120-F122 HydrophobicContact CG2-CE2 4.13Å; F122-W128 AromaticContact CD1-CD1 3.48Å; F122-W128 VanDerWaalsContact CD1-CD1 3.48Å; F122-W128 HydrophobicContact CE1-CB 4Å; F122-W128 AromaticContact CE1-CD1 3.48Å; F122-W128 VanDerWaalsContact CE1-CD1 3.48Å; F122-W128 HydrophobicContact CE1-CG 4.13Å; F122-W128 AromaticContact CG-CD1 3.8Å; F122-W128 HydrophobicContact CZ-CB 4.02Å; F122-W128 AromaticContact CZ-CD1 3.79Å; F122-W128 HydrophobicContact CZ-CG 4.24Å
123S94.8Very high91.3Very high53 Ų5355 Ų5537%0.37133%0.328SS..EExtended strand (participates in β ladder)trans-85.2144166-44.20000110.1P91 G125 S126P91-S123 CarbonylContact O-C 3.56Å; P91-S123 WeakPolarHBondContact O-CA 3.05Å; S123-G125 PolarHBondContact O-N 3.5Å; S123-S126 PolarHBondContact N-OG 3.14Å; S123-S126 WeakPolarHBondContact O-CB 3.35Å; S123-S126 PolarHBondContact O-N 3.11Å; S123-S126 PolarHBondContact O-OG 3.09Å
124R94.1Very high90.9Very high124 Ų12460.1 Ų60.147%0.46834%0.344SS..THydrogen-bonded Turntrans-58.8128.7-179.8-169.3-173.9-61.9172.41110.4Y85 K86 G88 C90 P91 S126Y85-R124 HydrophobicContact CD1-CB 4.13Å; Y85-R124 HydrophobicContact CE1-CB 3.92Å; Y85-R124 HydrophobicContact CE1-CG 4.4Å; K86-R124 VanDerWaalsContact O-CG 3.22Å; K86-R124 WeakPolarHBondContact O-CG 3.36Å; G88-R124 PolarHBondContact O-NH2 3.17Å; C90-R124 VanDerWaalsContact C-NH2 3.28Å; C90-R124 PolarHBondContact O-NH2 3.47Å; P91-R124 PolarHBondContact O-N 2.97Å; R124-S126 VanDerWaalsContact C-N 3.31Å
125G92.3Very high90.7Very high60 Ų6065 Ų6562%0.61935%0.353SS*.THydrogen-bonded Turntrans86.4-7.1-175.300000114.5Y85 S123Y85-G125 WeakPolarHBondContact O-CA 3.47Å; Y85-G125 PolarHBondContact O-N 2.89Å; S123-G125 PolarHBondContact O-N 3.5Å
126S91.4Very high90.5Very high36 Ų3668 Ų6825%0.25236%0.364SS..  trans-93.1161.9176.985.60000112.1Y84 Y85 S123 R124Y84-S126 VanDerWaalsContact CA-O 3.32Å; Y84-S126 WeakPolarHBondContact CA-O 3.38Å; Y84-S126 WeakPolarHBondContact CD1-O 3.21Å; Y85-S126 PolarHBondContact N-O 3.42Å; S123-S126 PolarHBondContact N-OG 3.14Å; S123-S126 WeakPolarHBondContact O-CB 3.35Å; S123-S126 PolarHBondContact O-N 3.11Å; S123-S126 PolarHBondContact O-OG 3.09Å; R124-S126 VanDerWaalsContact C-N 3.31Å
127G91.8Very high90.1Very high22 Ų2269.6 Ų69.623%0.22736%0.362CS..EExtended strand (participates in β ladder)trans-142.1146.6173.900000111.9L83 Y84L83-G127 CarbonylContact O-C 3.55Å; L83-G127 WeakPolarHBondContact O-CA 3.47Å; Y84-G127 VanDerWaalsContact CD1-CA 3.41Å
128W93.1Very high89.9Confident109 Ų10972.5 Ų72.541%0.41339%0.386SS..EExtended strand (participates in β ladder)trans-118.4136.8-175.5-69.497.9000110.4H82 L83 L117 T120 E121 F122 I130H82-W128 VanDerWaalsContact CA-O 3.28Å; H82-W128 WeakPolarHBondContact CA-O 3.21Å; L83-W128 PolarHBondContact N-O 3.41Å; L83-W128 PolarHBondContact O-N 3.21Å; L117-W128 HydrophobicContact CD1-CB 3.91Å; T120-W128 HydrophobicContact CG2-CD2 3.92Å; T120-W128 HydrophobicContact CG2-CE3 4.48Å; T120-W128 HydrophobicContact CG2-CG 4.01Å; T120-W128 HydrophobicContact CG2-CZ2 4.41Å; E121-W128 PolarHBondContact O-NE1 3.26Å; F122-W128 AromaticContact CD1-CD1 3.48Å; F122-W128 VanDerWaalsContact CD1-CD1 3.48Å; F122-W128 HydrophobicContact CE1-CB 4Å; F122-W128 AromaticContact CE1-CD1 3.48Å; F122-W128 VanDerWaalsContact CE1-CD1 3.48Å; F122-W128 HydrophobicContact CE1-CG 4.13Å; F122-W128 AromaticContact CG-CD1 3.8Å; F122-W128 HydrophobicContact CZ-CB 4.02Å; F122-W128 AromaticContact CZ-CD1 3.79Å; F122-W128 HydrophobicContact CZ-CG 4.24Å; W128-I130 PolarHBondContact O-N 3.29Å
129P92.9Very high90.1Very high30 Ų3072.7 Ų72.720%0.19538%0.377CS..EExtended strand (participates in β ladder)trans-69.9127.917527.5-32.1000110L80 L117 H131L80-P129 HydrophobicContact CD1-CB 4.42Å; L117-P129 WeakPolarHBondContact CD1-O 3.26Å; P129-H131 PolarHBondContact O-N 3.26Å
130I93.3Very high90.5Very high2 Ų268 Ų681%0.0135%0.347CS..PPolyproline II helixtrans-71.7117.5171.7-51.1179.7000107.4L81 V98 A100 L115 W128L81-I130 HydrophobicContact CD2-CD1 3.93Å; L81-I130 HydrophobicContact CG-CD1 4.01Å; L81-I130 PolarHBondContact O-N 2.87Å; V98-I130 HydrophobicContact CG1-CD1 3.97Å; A100-I130 HydrophobicContact CB-CD1 4.05Å; L115-I130 HydrophobicContact CB-CG2 3.74Å; L115-I130 HydrophobicContact CD2-CB 4.48Å; L115-I130 HydrophobicContact CD2-CG2 4.46Å; W128-I130 PolarHBondContact O-N 3.29Å
131H89.9Confident90.6Very high111 Ų11167.2 Ų67.251%0.51434%0.342SS..BIsolated β-bridgetrans-78.1157.4-170.5-61.9-61.1000112.1L115 A116 P129L115-H131 CarbonylContact C-O 3.49Å; L115-H131 WeakPolarHBondContact CA-O 3.45Å; A116-H131 PolarHBondContact N-O 2.9Å; A116-H131 WeakPolarHBondContact O-CA 3.26Å; A116-H131 WeakPolarHBondContact O-CB 3.31Å; A116-H131 PolarHBondContact O-N 3.46Å; A116-H131 VanDerWaalsContact O-O 3.14Å; P129-H131 PolarHBondContact O-N 3.26Å
132M89.6Confident90.6Very high26 Ų2667.3 Ų67.313%0.12834%0.343CS..  trans-143.8162170.268-168.178.800108.9F112 L115 R137 F140F112-M132 HydrophobicContact CE1-SD 4.23Å; F112-M132 HydrophobicContact CZ-SD 3.95Å; L115-M132 HydrophobicContact CD2-CE 3.49Å; L115-M132 VanDerWaalsContact CD2-CE 3.49Å; L115-M132 HydrophobicContact CG-CE 4.36Å; M132-R137 HydrophobicContact CG-CG 3.65Å; M132-R137 HydrophobicContact SD-CB 4.45Å; M132-R137 HydrophobicContact SD-CG 3.99Å; M132-F140 HydrophobicContact CE-CB 4.19Å; M132-F140 HydrophobicContact CE-CD1 3.44Å; M132-F140 VanDerWaalsContact CE-CD1 3.44Å; M132-F140 HydrophobicContact CE-CE1 3.87Å; M132-F140 HydrophobicContact CE-CG 3.82Å; M132-F140 HydrophobicContact SD-CB 3.62Å; M132-F140 HydrophobicContact SD-CD1 4.02Å; M132-F140 HydrophobicContact SD-CG 3.94Å
133E87.4Confident90.5Very high132 Ų13269 Ų6962%0.61735%0.352SS*.  trans-55.3143.6174.5-66178.4171.100111.3E135 R136 R137E133-E135 PolarHBondContact O-N 2.67Å; E133-R136 HydrophobicContact CB-CG 4.27Å; E133-R136 PolarHBondContact O-N 2.92Å; E133-R137 PolarHBondContact O-N 3.31Å
134K84.1Confident90.4Very high145 Ų14566.5 Ų66.563%0.6333%0.334SS*.G310 helixtrans-61-36.5-172.4179.9172.8-179.9-172.70111.9R136 R137K134-R136 PolarHBondContact O-N 3.47Å; K134-R137 PolarHBondContact O-N 2.88Å
135E85.2Confident90.3Very high151 Ų15163.9 Ų63.971%0.70633%0.327SS*.G310 helixtrans-65.9-27.4-179.2-6167.8-14600111.5E133E133-E135 PolarHBondContact O-N 2.67Å
136R88.4Confident90.2Very high65 Ų6568 Ų6825%0.24533%0.328CS..G310 helixtrans-96.4-6.2-176-57.9-163.666.3-149.4-5.4114.2F112 A113 E133 K134 A138 E139 F140F112-R136 HydrophobicContact CE2-CB 4.47Å; F112-R136 VanDerWaalsContact CE2-NH2 3.29Å; F112-R136 HydrophobicContact CZ-CB 4.18Å; A113-R136 PolarHBondContact O-NH1 2.84Å; E133-R136 HydrophobicContact CB-CG 4.27Å; E133-R136 PolarHBondContact O-N 2.92Å; K134-R136 PolarHBondContact O-N 3.47Å; R136-A138 PolarHBondContact O-N 3.48Å; R136-E139 IonicContact CZ-OE2 3.26Å; R136-E139 IonicContact NE-OE2 3.72Å; R136-E139 PolarHBondContact NE-OE2 2.98Å; R136-E139 IonicContact NH2-OE1 2.72Å; R136-E139 PolarHBondContact NH2-OE1 3.14Å; R136-E139 IonicContact NH2-OE2 2.63Å; R136-E139 PolarHBondContact NH2-OE2 3.31Å; R136-E139 WeakPolarHBondContact O-CB 3.49Å; R136-E139 PolarHBondContact O-N 3.44Å; R136-F140 PolarHBondContact O-N 3.11Å
137R86.9Confident90.2Very high76 Ų7668.9 Ų68.929%0.28733%0.327SS..Hα-helixtrans-62.6-40.7177.7-73.4-170.9-119.8157.4-5.5113M132 E133 K134 T141M132-R137 HydrophobicContact CG-CG 3.65Å; M132-R137 HydrophobicContact SD-CB 4.45Å; M132-R137 HydrophobicContact SD-CG 3.99Å; E133-R137 PolarHBondContact O-N 3.31Å; K134-R137 PolarHBondContact O-N 2.88Å; R137-T141 WeakPolarHBondContact O-CB 3.46Å; R137-T141 PolarHBondContact O-N 3.04Å; R137-T141 PolarHBondContact O-OG1 3.1Å
138A87.6Confident90.1Very high63 Ų6369.2 Ų69.252%0.52133%0.325SS..Hα-helixtrans-66.1-44177.500000111R136 F140 T141 E142R136-A138 PolarHBondContact O-N 3.48Å; A138-F140 PolarHBondContact O-N 2.82Å; A138-T141 PolarHBondContact O-N 3.46Å; A138-E142 WeakPolarHBondContact O-CB 3.31Å; A138-E142 PolarHBondContact O-N 3.24Å
139E91.3Very high90Very high90 Ų9069.2 Ų69.242%0.42133%0.333SS..Hα-helixtrans-56.4-49.2175.3-176.6-161.4163.700111.4F112 R136 E142 L143F112-E139 HydrophobicContact CE2-CB 4.43Å; F112-E139 HydrophobicContact CE2-CG 4.2Å; R136-E139 IonicContact CZ-OE2 3.26Å; R136-E139 IonicContact NE-OE2 3.72Å; R136-E139 PolarHBondContact NE-OE2 2.98Å; R136-E139 IonicContact NH2-OE1 2.72Å; R136-E139 PolarHBondContact NH2-OE1 3.14Å; R136-E139 IonicContact NH2-OE2 2.63Å; R136-E139 PolarHBondContact NH2-OE2 3.31Å; R136-E139 WeakPolarHBondContact O-CB 3.49Å; R136-E139 PolarHBondContact O-N 3.44Å; E139-E142 PolarHBondContact O-N 3.45Å; E139-L143 WeakPolarHBondContact O-CB 3.23Å; E139-L143 PolarHBondContact O-N 3.45Å
140F92.5Very high89.9Confident0 Ų070.2 Ų70.20%034%0.341CS..Hα-helixtrans-63.1-45.2178.3-178.5-114.7000112.7L61 V79 I102 F112 L115 M132 R136 A138 L143 V144L61-F140 HydrophobicContact CD1-CE1 4.31Å; L61-F140 HydrophobicContact CD1-CZ 3.97Å; V79-F140 HydrophobicContact CB-CD1 4.23Å; V79-F140 HydrophobicContact CB-CE1 4.1Å; V79-F140 HydrophobicContact CG1-CD1 4.32Å; V79-F140 HydrophobicContact CG1-CE1 3.71Å; V79-F140 HydrophobicContact CG1-CZ 4.36Å; V79-F140 WeakPolarHBondContact O-CD1 3.41Å; V79-F140 WeakPolarHBondContact O-CE1 3.23Å; I102-F140 HydrophobicContact CD1-CE2 4.13Å; I102-F140 HydrophobicContact CG1-CE2 3.87Å; F112-F140 HydrophobicContact CB-CD2 4.49Å; F112-F140 AromaticContact CD1-CD2 3.63Å; F112-F140 HydrophobicContact CD1-CD2 3.63Å; F112-F140 HydrophobicContact CD1-CE2 4.2Å; F112-F140 HydrophobicContact CD1-CG 4.47Å; F112-F140 HydrophobicContact CD2-CB 4.3Å; F112-F140 HydrophobicContact CD2-CD2 4.17Å; F112-F140 HydrophobicContact CE1-CB 4.15Å; F112-F140 AromaticContact CE1-CD2 3.78Å; F112-F140 HydrophobicContact CE1-CD2 3.78Å; F112-F140 HydrophobicContact CE1-CG 4.2Å; F112-F140 HydrophobicContact CE2-CB 3.73Å; F112-F140 HydrophobicContact CE2-CD2 4.3Å; F112-F140 HydrophobicContact CE2-CG 4.48Å; F112-F140 AromaticContact CG-CD2 3.84Å; F112-F140 HydrophobicContact CG-CD2 3.84Å; F112-F140 HydrophobicContact CZ-CB 3.66Å; F112-F140 HydrophobicContact CZ-CD2 4.12Å; F112-F140 HydrophobicContact CZ-CG 4.21Å; L115-F140 HydrophobicContact CD1-CE2 4.33Å; L115-F140 HydrophobicContact CD2-CZ 4.43Å; M132-F140 HydrophobicContact CE-CB 4.19Å; M132-F140 HydrophobicContact CE-CD1 3.44Å; M132-F140 VanDerWaalsContact CE-CD1 3.44Å; M132-F140 HydrophobicContact CE-CE1 3.87Å; M132-F140 HydrophobicContact CE-CG 3.82Å; M132-F140 HydrophobicContact SD-CB 3.62Å; M132-F140 HydrophobicContact SD-CD1 4.02Å; M132-F140 HydrophobicContact SD-CG 3.94Å; R136-F140 PolarHBondContact O-N 3.11Å; A138-F140 PolarHBondContact O-N 2.82Å; F140-L143 PolarHBondContact O-N 3.28Å; F140-V144 HydrophobicContact CD2-CG2 4.31Å; F140-V144 HydrophobicContact CE1-CG2 4.36Å; F140-V144 HydrophobicContact CE2-CG2 3.93Å; F140-V144 HydrophobicContact CZ-CG2 3.96Å; F140-V144 WeakPolarHBondContact O-CG2 3.47Å; F140-V144 PolarHBondContact O-N 3.43Å
141T91.3Very high89.8Confident14 Ų1474.3 Ų74.39%0.08636%0.363CS..Hα-helixtrans-60.5-47.3178.8-62.40000110.7V79 R137 A138 V144 H145V79-T141 HydrophobicContact CG2-CG2 4.07Å; V79-T141 PolarHBondContact N-OG1 3.21Å; V79-T141 VanDerWaalsContact N-OG1 3.13Å; R137-T141 WeakPolarHBondContact O-CB 3.46Å; R137-T141 PolarHBondContact O-N 3.04Å; R137-T141 PolarHBondContact O-OG1 3.1Å; A138-T141 PolarHBondContact O-N 3.46Å; T141-V144 PolarHBondContact O-N 2.91Å; T141-H145 PolarHBondContact O-CD2 3.04Å; T141-H145 PolarHBondContact O-N 3.36Å
142E91.3Very high90Very high105 Ų10569.1 Ų69.149%0.49134%0.339SS..Hα-helixtrans-64-42.2177.9-169.6-175.5172.800111.9A138 E139 V144 H145 K146A138-E142 WeakPolarHBondContact O-CB 3.31Å; A138-E142 PolarHBondContact O-N 3.24Å; E139-E142 PolarHBondContact O-N 3.45Å; E142-V144 PolarHBondContact O-N 3.43Å; E142-H145 PolarHBondContact O-N 3.01Å; E142-K146 HydrophobicContact CG-CD 4.23Å; E142-K146 WeakPolarHBondContact O-CB 3.22Å; E142-K146 VanDerWaalsContact O-CG 3.32Å; E142-K146 WeakPolarHBondContact O-CG 3.48Å; E142-K146 PolarHBondContact O-N 3.42Å; E142-K146 WeakPolarHBondContact OE1-CE 3.4Å; E142-K146 IonicContact OE1-NZ 3.26Å; E142-K146 PolarHBondContact OE1-NZ 3.03Å
143L92.4Very high90.2Very high35 Ų3568.9 Ų68.918%0.18334%0.338CS..Hα-helixtrans-57.4-49.4176.5176.773.6000111.6L111 F112 E139 F140 K146 K147L111-L143 HydrophobicContact CB-CD2 4.22Å; F112-L143 HydrophobicContact CB-CD2 3.61Å; F112-L143 HydrophobicContact CD2-CD2 4.38Å; F112-L143 HydrophobicContact CG-CD2 4.32Å; E139-L143 WeakPolarHBondContact O-CB 3.23Å; E139-L143 PolarHBondContact O-N 3.45Å; F140-L143 PolarHBondContact O-N 3.28Å; L143-K146 PolarHBondContact O-N 3.1Å; L143-K147 VanDerWaalsContact O-CG 3.32Å; L143-K147 WeakPolarHBondContact O-CG 3.42Å; L143-K147 PolarHBondContact O-N 3.42Å
144V92.4Very high90.6Very high1 Ų162.7 Ų62.71%0.00631%0.309CS..Hα-helixtrans-66.9-42.6-177.9174.20000110.8V28 L39 L61 V79 F140 T141 E142 K146 K147 V148V28-V144 HydrophobicContact CG1-CG1 4.07Å; L39-V144 HydrophobicContact CD1-CG1 3.46Å; L39-V144 VanDerWaalsContact CD1-CG1 3.46Å; L39-V144 HydrophobicContact CD2-CG1 4.43Å; L61-V144 HydrophobicContact CD2-CG1 3.9Å; V79-V144 HydrophobicContact CG1-CB 4.19Å; V79-V144 HydrophobicContact CG1-CG1 4.05Å; V79-V144 HydrophobicContact CG1-CG2 4.13Å; V79-V144 HydrophobicContact CG2-CB 4.2Å; V79-V144 HydrophobicContact CG2-CG1 4.23Å; F140-V144 HydrophobicContact CD2-CG2 4.31Å; F140-V144 HydrophobicContact CE1-CG2 4.36Å; F140-V144 HydrophobicContact CE2-CG2 3.93Å; F140-V144 HydrophobicContact CZ-CG2 3.96Å; F140-V144 WeakPolarHBondContact O-CG2 3.47Å; F140-V144 PolarHBondContact O-N 3.43Å; T141-V144 PolarHBondContact O-N 2.91Å; E142-V144 PolarHBondContact O-N 3.43Å; V144-K146 PolarHBondContact O-N 2.92Å; V144-K147 CarbonylContact O-C 3.58Å; V144-K147 WeakPolarHBondContact O-CA 3.35Å; V144-K147 PolarHBondContact O-N 3Å; V144-V148 PolarHBondContact O-N 3.48Å
145H91.3Very high91.1Very high68 Ų6856.3 Ų56.332%0.31528%0.282SS..Hα-helixtrans-63.4-38.5176.2-79.2-57.5000112.9D63 T141 E142 K147 V148D63-H145 IonicContact OD1-CE1 2.8Å; D63-H145 IonicContact OD1-NE2 2.68Å; D63-H145 IonicContact OD2-CE1 3.33Å; T141-H145 PolarHBondContact O-CD2 3.04Å; T141-H145 PolarHBondContact O-N 3.36Å; E142-H145 PolarHBondContact O-N 3.01Å; H145-K147 PolarHBondContact O-N 2.88Å; H145-V148 VanDerWaalsContact O-CG2 3.26Å; H145-V148 WeakPolarHBondContact O-CG2 3.38Å; H145-V148 PolarHBondContact O-N 3.4Å
146K91.3Very high91.6Very high146 Ų14649.1 Ų49.164%0.63525%0.249SC*.Hα-helixtrans-63.1-21.4173.1-77.9176.3-179.41680113.3E142 L143 V144E142-K146 HydrophobicContact CG-CD 4.23Å; E142-K146 WeakPolarHBondContact O-CB 3.22Å; E142-K146 VanDerWaalsContact O-CG 3.32Å; E142-K146 WeakPolarHBondContact O-CG 3.48Å; E142-K146 PolarHBondContact O-N 3.42Å; E142-K146 WeakPolarHBondContact OE1-CE 3.4Å; E142-K146 IonicContact OE1-NZ 3.26Å; E142-K146 PolarHBondContact OE1-NZ 3.03Å; L143-K146 PolarHBondContact O-N 3.1Å; V144-K146 PolarHBondContact O-N 2.92Å
147K89.9Confident92Very high55 Ų5548 Ų4824%0.23925%0.246CC..THydrogen-bonded Turntrans-102.711.9-178-68.2-78.8-173.5171.50112.8V28 L143 V144 H145 S150 L152V28-K147 WeakPolarHBondContact CB-O 3.46Å; L143-K147 VanDerWaalsContact O-CG 3.32Å; L143-K147 WeakPolarHBondContact O-CG 3.42Å; L143-K147 PolarHBondContact O-N 3.42Å; V144-K147 CarbonylContact O-C 3.58Å; V144-K147 WeakPolarHBondContact O-CA 3.35Å; V144-K147 PolarHBondContact O-N 3Å; H145-K147 PolarHBondContact O-N 2.88Å; K147-S150 WeakPolarHBondContact O-CA 3.43Å; K147-S150 VanDerWaalsContact O-CB 3.24Å; K147-S150 WeakPolarHBondContact O-CB 3.4Å; K147-S150 PolarHBondContact O-N 2.92Å; K147-L152 HydrophobicContact CB-CD1 4.07Å; K147-L152 HydrophobicContact CB-CD2 4.06Å; K147-L152 HydrophobicContact CB-CG 4.15Å; K147-L152 HydrophobicContact CD-CD2 4.03Å; K147-L152 HydrophobicContact CG-CD2 3.92Å
148V90.8Very high92.4Very high30 Ų3044.4 Ų44.418%0.18223%0.233CC..THydrogen-bonded Turntrans-55.1140.7168.41740000109.6V28 Q30 V144 H145 S150V28-V148 HydrophobicContact CG1-CG2 4.12Å; Q30-V148 HydrophobicContact CG-CG1 4.06Å; Q30-V148 HydrophobicContact CG-CG2 4.01Å; V144-V148 PolarHBondContact O-N 3.48Å; H145-V148 VanDerWaalsContact O-CG2 3.26Å; H145-V148 WeakPolarHBondContact O-CG2 3.38Å; H145-V148 PolarHBondContact O-N 3.4Å; V148-S150 PolarHBondContact O-N 2.93Å
149D89.7Confident92.7Very high109 Ų10943.5 Ų43.558%0.58322%0.217SC*.THydrogen-bonded Turntrans62.42.7-172-64.3-52000115.9K27 V28K27-D149 WeakPolarHBondContact CE-O 3.39Å; V28-D149 PolarHBondContact O-N 3.17Å
150S90.9Very high92.8Very high51 Ų5139.2 Ų39.236%0.35720%0.197SC..SBendtrans-103.9163.1174.5-55.40000111.8K27 V28 K147 V148K27-S150 WeakPolarHBondContact CA-O 3.44Å; V28-S150 PolarHBondContact N-O 3.34Å; K147-S150 WeakPolarHBondContact O-CA 3.43Å; K147-S150 VanDerWaalsContact O-CB 3.24Å; K147-S150 WeakPolarHBondContact O-CB 3.4Å; K147-S150 PolarHBondContact O-N 2.92Å; V148-S150 PolarHBondContact O-N 2.93Å
151N91.9Very high92.9Very high88 Ų8842.8 Ų42.847%0.47121%0.212SC..EExtended strand (participates in β ladder)trans-87.5140.5174.5-66.1-39.3000111.1L26 K27 P105L26-N151 CarbonylContact O-C 3.52Å; L26-N151 VanDerWaalsContact O-CA 3.28Å; L26-N151 WeakPolarHBondContact O-CA 3.14Å; K27-N151 WeakPolarHBondContact CB-OD1 3.46Å; P105-N151 HydrophobicContact CG-CB 3.9Å
152L93.3Very high92.9Very high2 Ų244 Ų441%0.0122%0.217CC..EExtended strand (participates in β ladder)trans-127.3150170.7-68.8-179.3000109.8T25 L26 V28 I102 L111 K147T25-L152 WeakPolarHBondContact CA-O 3.49Å; L26-L152 HydrophobicContact CD2-CB 4.2Å; L26-L152 HydrophobicContact CG-CB 4.5Å; L26-L152 PolarHBondContact N-O 2.62Å; L26-L152 PolarHBondContact O-N 3.31Å; V28-L152 HydrophobicContact CG2-CB 4.38Å; V28-L152 HydrophobicContact CG2-CD1 3.49Å; V28-L152 VanDerWaalsContact CG2-CD1 3.49Å; V28-L152 HydrophobicContact CG2-CG 3.82Å; I102-L152 HydrophobicContact CG2-CB 4.37Å; I102-L152 HydrophobicContact CG2-CD1 4.21Å; I102-L152 HydrophobicContact CG2-CD2 4.08Å; I102-L152 HydrophobicContact CG2-CG 4.47Å; L111-L152 HydrophobicContact CD1-CD2 3.81Å; K147-L152 HydrophobicContact CB-CD1 4.07Å; K147-L152 HydrophobicContact CB-CD2 4.06Å; K147-L152 HydrophobicContact CB-CG 4.15Å; K147-L152 HydrophobicContact CD-CD2 4.03Å; K147-L152 HydrophobicContact CG-CD2 3.92Å
153L95Very high92.9Very high21 Ų2140.1 Ų40.111%0.1120%0.202CC..EExtended strand (participates in β ladder)trans-109.5112.1170.1175.260.6000109.2P23 I102 L103 P105 V155P23-L153 HydrophobicContact CB-CD1 3.93Å; I102-L153 CarbonylContact C-O 3.47Å; I102-L153 WeakPolarHBondContact CA-O 3.08Å; L103-L153 HydrophobicContact CB-CB 4.23Å; L103-L153 HydrophobicContact CB-CD2 4.24Å; L103-L153 HydrophobicContact CB-CG 4.36Å; L103-L153 HydrophobicContact CD1-CD2 4.21Å; L103-L153 PolarHBondContact N-O 3.11Å; L103-L153 PolarHBondContact O-N 2.91Å; L103-L153 VanDerWaalsContact O-N 3.08Å; P105-L153 HydrophobicContact CB-CB 4.31Å; L153-V155 HydrophobicContact CD1-CG2 4.38Å; L153-V155 HydrophobicContact CD2-CG2 4.29Å; L153-V155 HydrophobicContact CG-CG2 4Å
154V95.6Very high92.9Very high1 Ų140 Ų401%0.00620%0.201CC..EExtended strand (participates in β ladder)trans-93.5122.2171.9-176.90000107.6W24 L26 L81 Q101 I102 V156W24-V154 HydrophobicContact CB-CB 4.32Å; W24-V154 HydrophobicContact CE3-CB 4.03Å; W24-V154 HydrophobicContact CE3-CG1 4.38Å; W24-V154 HydrophobicContact CE3-CG2 3.97Å; W24-V154 HydrophobicContact CZ3-CG2 4.43Å; W24-V154 PolarHBondContact N-O 3.34Å; W24-V154 PolarHBondContact O-N 2.97Å; L26-V154 HydrophobicContact CD2-CB 4.47Å; L26-V154 HydrophobicContact CD2-CG2 3.39Å; L81-V154 HydrophobicContact CD2-CG1 3.79Å; Q101-V154 WeakPolarHBondContact O-CA 3.36Å; I102-V154 HydrophobicContact CD1-CB 4.31Å; I102-V154 HydrophobicContact CD1-CG1 4.15Å; I102-V154 HydrophobicContact CD1-CG2 3.72Å; V154-V156 HydrophobicContact CG1-CG2 3.87Å
155V95.2Very high92.9Very high12 Ų1240 Ų407%0.07320%0.2CC..EExtended strand (participates in β ladder)trans-109.7120.6172.8-177.40000108.2Q21 A100 Q101 L103 L153Q21-V155 HydrophobicContact CG-CG1 3.58Å; A100-V155 WeakPolarHBondContact CA-O 3.49Å; Q101-V155 HydrophobicContact CG-CB 3.95Å; Q101-V155 PolarHBondContact N-O 2.97Å; Q101-V155 PolarHBondContact O-N 2.91Å; L103-V155 HydrophobicContact CD1-CG2 3.69Å; L103-V155 HydrophobicContact CG-CG2 4.29Å; L153-V155 HydrophobicContact CD1-CG2 4.38Å; L153-V155 HydrophobicContact CD2-CG2 4.29Å; L153-V155 HydrophobicContact CG-CG2 4Å
156V95.3Very high92.9Very high0 Ų040.5 Ų40.50%020%0.203CC..EExtended strand (participates in β ladder)trans-111.7132178.4-176.50000109.5Q21 H22 L59 V98 R99 A100 V154 I158Q21-V156 CarbonylContact C-O 3.56Å; Q21-V156 WeakPolarHBondContact CA-O 3.46Å; H22-V156 PolarHBondContact N-O 3.45Å; H22-V156 PolarHBondContact O-N 3.44Å; L59-V156 HydrophobicContact CD1-CB 4.38Å; L59-V156 HydrophobicContact CD1-CG2 3.5Å; L59-V156 HydrophobicContact CD2-CG2 3.83Å; L59-V156 HydrophobicContact CG-CG2 4.31Å; V98-V156 HydrophobicContact CG1-CG1 3.62Å; R99-V156 CarbonylContact O-C 3.59Å; R99-V156 WeakPolarHBondContact O-CA 3.5Å; A100-V156 HydrophobicContact CB-CG2 3.99Å; V154-V156 HydrophobicContact CG1-CG2 3.87Å; V156-I158 HydrophobicContact CG1-CG1 4.02Å
157E95.3Very high92.8Very high40 Ų4034 Ų3419%0.18718%0.176CC..EExtended strand (participates in β ladder)trans-108126.5170.4-175.8178.7-124.900108.7S19 F20 V98 R99S19-E157 WeakPolarHBondContact OG-CG 3.43Å; S19-E157 PolarHBondContact OG-OE1 3.47Å; F20-E157 CarbonylContact O-C 3.59Å; F20-E157 VanDerWaalsContact O-CA 3.29Å; F20-E157 WeakPolarHBondContact O-CA 3.46Å; V98-E157 CarbonylContact C-O 3.53Å; V98-E157 VanDerWaalsContact CA-O 3.3Å; V98-E157 WeakPolarHBondContact CA-O 3.34Å; R99-E157 HydrophobicContact CB-CB 4.4Å; R99-E157 PolarHBondContact N-O 2.94Å; R99-E157 PolarHBondContact O-N 3.36Å
158I95.4Very high92.8Very high2 Ų233.6 Ų33.61%0.0118%0.176CC..EExtended strand (participates in β ladder)trans-117.7122.7178.5-52.7177.5000107.8F20 F46 T48 W57 L83 V95 V98 V156 M160F20-I158 PolarHBondContact N-O 3.25Å; F20-I158 PolarHBondContact O-N 3.37Å; F46-I158 HydrophobicContact CE2-CD1 3.84Å; F46-I158 HydrophobicContact CZ-CD1 4.14Å; T48-I158 HydrophobicContact CG2-CD1 4.4Å; W57-I158 HydrophobicContact CD2-CD1 4.25Å; W57-I158 HydrophobicContact CG-CD1 4.12Å; L83-I158 HydrophobicContact CD1-CD1 4.09Å; L83-I158 HydrophobicContact CD2-CD1 4.02Å; L83-I158 HydrophobicContact CD2-CG1 4.35Å; V95-I158 HydrophobicContact CG1-CG2 3.78Å; V98-I158 HydrophobicContact CG1-CG1 4.48Å; V98-I158 HydrophobicContact CG2-CG2 4.48Å; V156-I158 HydrophobicContact CG1-CG1 4.02Å; I158-M160 HydrophobicContact CG2-CG 3.92Å; I158-M160 HydrophobicContact CG2-SD 4.19Å
159K94.6Very high92.7Very high44 Ų4436.6 Ų36.619%0.19119%0.191CC..EExtended strand (participates in β ladder)trans-106.2125.8176.7-67.4-172.5-170.7162.90110.9V17 I18 V95 E96 E97V17-K159 HydrophobicContact CG1-CB 3.7Å; V17-K159 HydrophobicContact CG1-CD 4.35Å; V17-K159 HydrophobicContact CG1-CG 4.32Å; I18-K159 WeakPolarHBondContact O-CA 3.32Å; V95-K159 WeakPolarHBondContact CG1-O 3.28Å; E96-K159 HydrophobicContact CB-CB 4.44Å; E96-K159 PolarHBondContact N-O 2.87Å; E97-K159 HydrophobicContact CB-CB 4.11Å; E97-K159 HydrophobicContact CB-CD 4.19Å; E97-K159 HydrophobicContact CB-CG 4.46Å; E97-K159 PolarHBondContact N-O 3.4Å; E97-K159 PolarHBondContact O-N 2.96Å; E97-K159 WeakPolarHBondContact OE2-CD 3.26Å; E97-K159 WeakPolarHBondContact OE2-CE 3.41Å; E97-K159 IonicContact OE2-NZ 3.87Å; E97-K159 PolarHBondContact OE2-NZ 3.08Å
160M94.1Very high92.7Very high0 Ų033.6 Ų33.60%017%0.172CC..EExtended strand (participates in β ladder)trans-133.8146.2-175.1-61.7-177.671.400109.7I18 F20 F55 W57 V93 I158 L164 F165I18-M160 PolarHBondContact N-O 3.21Å; I18-M160 PolarHBondContact O-N 3.17Å; F20-M160 HydrophobicContact CE2-CB 4.39Å; F20-M160 HydrophobicContact CE2-SD 4.45Å; F55-M160 HydrophobicContact CB-CE 4.48Å; F55-M160 HydrophobicContact CD1-CE 4.12Å; F55-M160 HydrophobicContact CD2-CE 3.67Å; F55-M160 HydrophobicContact CD2-SD 4.46Å; F55-M160 HydrophobicContact CE1-CE 4.21Å; F55-M160 HydrophobicContact CE2-CE 3.77Å; F55-M160 HydrophobicContact CG-CE 3.84Å; F55-M160 HydrophobicContact CZ-CE 4.03Å; W57-M160 HydrophobicContact CZ2-CE 3.9Å; W57-M160 HydrophobicContact CZ2-SD 3.86Å; V93-M160 HydrophobicContact CG2-CE 3.72Å; I158-M160 HydrophobicContact CG2-CG 3.92Å; I158-M160 HydrophobicContact CG2-SD 4.19Å; M160-L164 HydrophobicContact CB-CD1 4.15Å; M160-L164 HydrophobicContact CE-CD1 3.77Å; M160-F165 HydrophobicContact CB-CE2 3.91Å; M160-F165 HydrophobicContact CB-CZ 4.38Å; M160-F165 HydrophobicContact CE-CZ 4.27Å; M160-F165 HydrophobicContact SD-CE2 4.42Å; M160-F165 HydrophobicContact SD-CZ 3.97Å
161K93.2Very high92.6Very high74 Ų7431.5 Ų31.532%0.32216%0.157SC..EExtended strand (participates in β ladder)trans-62.7140.5172.5-75.6177.1161.5123.70111D15 E96 S163 L164D15-K161 HydrophobicContact CB-CB 4.39Å; D15-K161 HydrophobicContact CB-CD 4.12Å; D15-K161 HydrophobicContact CB-CG 4.08Å; E96-K161 HydrophobicContact CG-CG 4Å; E96-K161 WeakPolarHBondContact OE1-CD 3.37Å; E96-K161 WeakPolarHBondContact OE1-CE 3.32Å; E96-K161 WeakPolarHBondContact OE1-CG 3.29Å; E96-K161 IonicContact OE1-NZ 3.67Å; E96-K161 PolarHBondContact OE1-NZ 2.99Å; K161-S163 PolarHBondContact O-N 2.82Å; K161-L164 HydrophobicContact CB-CD1 4.39Å; K161-L164 HydrophobicContact CB-CG 4.32Å; K161-L164 WeakPolarHBondContact O-CB 3.37Å; K161-L164 PolarHBondContact O-N 3.46Å
162E91.9Very high92.3Very high41 Ų4129.2 Ų29.219%0.19215%0.147CC..G310 helixtrans-60.8-33.8176175.7166.3-156.200112.2S16 I18 Y50 K51 L164 F165S16-E162 VanDerWaalsContact O-CB 3.29Å; S16-E162 WeakPolarHBondContact O-CB 3.45Å; S16-E162 PolarHBondContact O-N 3.33Å; S16-E162 WeakPolarHBondContact OG-CB 3.46Å; S16-E162 PolarHBondContact OG-OE2 2.92Å; I18-E162 HydrophobicContact CD1-CB 3.88Å; I18-E162 HydrophobicContact CD1-CG 4.04Å; I18-E162 HydrophobicContact CG1-CB 4.07Å; Y50-E162 HydrophobicContact CE1-CG 3.87Å; Y50-E162 WeakPolarHBondContact CE1-OE1 3.18Å; Y50-E162 PolarHBondContact OH-OE1 3.02Å; K51-E162 WeakPolarHBondContact CE-OE1 3.37Å; K51-E162 IonicContact NZ-OE1 2.66Å; K51-E162 PolarHBondContact NZ-OE1 3.33Å; E162-L164 PolarHBondContact O-N 2.8Å; E162-L164 VanDerWaalsContact O-N 3.14Å; E162-F165 WeakPolarHBondContact O-CB 3.37Å; E162-F165 PolarHBondContact O-N 2.81Å
163S91.5Very high91.5Very high23 Ų2333 Ų3316%0.16117%0.167CC..G310 helixtrans-59.4-23.1177.354.20000113.8D15 K161 F165 E166 N169D15-S163 WeakPolarHBondContact OD2-CB 3.23Å; D15-S163 PolarHBondContact OD2-OG 2.84Å; K161-S163 PolarHBondContact O-N 2.82Å; S163-F165 PolarHBondContact O-N 3.26Å; S163-E166 PolarHBondContact O-N 3.48Å; S163-N169 PolarHBondContact O-ND2 3.07Å
164L92.7Very high90.3Very high32 Ų3232.4 Ų32.417%0.16816%0.164CC..G310 helixtrans-68.8-13.1171.7-65.6172.1000112.9F55 V93 A94 M160 K161 E162 Y170F55-L164 HydrophobicContact CE2-CB 4.18Å; F55-L164 HydrophobicContact CZ-CB 3.98Å; V93-L164 HydrophobicContact CG2-CD1 3.91Å; V93-L164 HydrophobicContact CG2-CD2 4.3Å; A94-L164 WeakPolarHBondContact O-CD1 3.49Å; M160-L164 HydrophobicContact CB-CD1 4.15Å; M160-L164 HydrophobicContact CE-CD1 3.77Å; K161-L164 HydrophobicContact CB-CD1 4.39Å; K161-L164 HydrophobicContact CB-CG 4.32Å; K161-L164 WeakPolarHBondContact O-CB 3.37Å; K161-L164 PolarHBondContact O-N 3.46Å; E162-L164 PolarHBondContact O-N 2.8Å; E162-L164 VanDerWaalsContact O-N 3.14Å; L164-Y170 PolarHBondContact O-OH 2.97Å
165F92Very high88.9Confident0 Ų040 Ų400%020%0.199CC..G310 helixtrans-10716.2-179.7-62.8-87000112.3I18 F20 Y50 V53 F55 M160 E162 S163 P167I18-F165 HydrophobicContact CD1-CD2 3.99Å; I18-F165 HydrophobicContact CD1-CE2 4.32Å; F20-F165 HydrophobicContact CE1-CZ 4.41Å; F20-F165 HydrophobicContact CE2-CE1 4.41Å; F20-F165 AromaticContact CE2-CE2 3.79Å; F20-F165 HydrophobicContact CE2-CE2 3.79Å; F20-F165 AromaticContact CE2-CZ 3.46Å; F20-F165 HydrophobicContact CE2-CZ 3.46Å; F20-F165 VanDerWaalsContact CE2-CZ 3.46Å; F20-F165 AromaticContact CZ-CE1 3.86Å; F20-F165 HydrophobicContact CZ-CE1 3.86Å; F20-F165 AromaticContact CZ-CE2 3.84Å; F20-F165 HydrophobicContact CZ-CE2 3.84Å; F20-F165 AromaticContact CZ-CZ 3.32Å; F20-F165 HydrophobicContact CZ-CZ 3.32Å; Y50-F165 HydrophobicContact CD1-CB 3.63Å; Y50-F165 HydrophobicContact CD1-CD2 4.3Å; Y50-F165 AromaticContact CD1-CG 3.95Å; Y50-F165 HydrophobicContact CD1-CG 3.95Å; Y50-F165 HydrophobicContact CG-CB 4.42Å; Y50-F165 HydrophobicContact CG-CG 4.38Å; Y50-F165 WeakPolarHBondContact O-CD1 3.48Å; V53-F165 HydrophobicContact CB-CB 4.28Å; V53-F165 HydrophobicContact CB-CD1 4.01Å; V53-F165 HydrophobicContact CG1-CD1 4.21Å; V53-F165 WeakPolarHBondContact CG2-O 3.48Å; V53-F165 WeakPolarHBondContact O-CD1 3.41Å; F55-F165 HydrophobicContact CD2-CD1 4.47Å; F55-F165 AromaticContact CD2-CE1 3.76Å; F55-F165 HydrophobicContact CD2-CE1 3.76Å; F55-F165 HydrophobicContact CD2-CZ 4Å; F55-F165 HydrophobicContact CE2-CD1 4.18Å; F55-F165 AromaticContact CE2-CE1 3.84Å; F55-F165 HydrophobicContact CE2-CE1 3.84Å; F55-F165 HydrophobicContact CE2-CZ 4.04Å; M160-F165 HydrophobicContact CB-CE2 3.91Å; M160-F165 HydrophobicContact CB-CZ 4.38Å; M160-F165 HydrophobicContact CE-CZ 4.27Å; M160-F165 HydrophobicContact SD-CE2 4.42Å; M160-F165 HydrophobicContact SD-CZ 3.97Å; E162-F165 WeakPolarHBondContact O-CB 3.37Å; E162-F165 PolarHBondContact O-N 2.81Å; S163-F165 PolarHBondContact O-N 3.26Å; F165-P167 WeakPolarHBondContact O-CD 3.22Å
166E90.6Very high87.2Confident80 Ų8041.9 Ų41.937%0.37421%0.211SC..  trans-96112.1172.7-64.5-176.9161.300109.6S163 L168 N169S163-E166 PolarHBondContact O-N 3.48Å; E166-L168 PolarHBondContact O-N 3.29Å; E166-L168 VanDerWaalsContact O-N 3.16Å; E166-N169 WeakPolarHBondContact CB-ND2 3.49Å; E166-N169 WeakPolarHBondContact O-CB 3.04Å; E166-N169 PolarHBondContact O-N 2.76Å; E166-N169 PolarHBondContact OE2-ND2 3.12Å
167P89.8Confident85.1Confident9 Ų942 Ų426%0.05821%0.212CC..G310 helixtrans-59.5-32.9-173.2-25.933.8000114.2V53 F165 N169 Y170 I297 I320 V324V53-P167 HydrophobicContact CG2-CB 4.36Å; V53-P167 HydrophobicContact CG2-CG 3.66Å; F165-P167 WeakPolarHBondContact O-CD 3.22Å; P167-N169 PolarHBondContact O-N 3.25Å; P167-Y170 PolarHBondContact O-N 2.65Å; P167-I297 HydrophobicContact CB-CD1 4.15Å; P167-I297 HydrophobicContact CG-CD1 3.84Å; P167-I297 HydrophobicContact CG-CG1 4.47Å; P167-I320 HydrophobicContact CB-CG2 4.16Å; P167-I320 WeakPolarHBondContact O-CG2 3.45Å; P167-V324 HydrophobicContact CB-CG2 3.44Å; P167-V324 VanDerWaalsContact CB-CG2 3.44Å; P167-V324 HydrophobicContact CG-CG2 3.44Å; P167-V324 VanDerWaalsContact CG-CG2 3.44Å
168L89.7Confident83.2Confident47 Ų4742.9 Ų42.925%0.24622%0.215CC..G310 helixtrans-69.2-19.6-175.3-56.4-176.9000113.1E166 Y170 L171 R290 C293 Q294 I297E166-L168 PolarHBondContact O-N 3.29Å; E166-L168 VanDerWaalsContact O-N 3.16Å; L168-Y170 PolarHBondContact O-N 3.24Å; L168-L171 HydrophobicContact CD2-CD1 4.33Å; L168-L171 PolarHBondContact O-N 3.45Å; L168-R290 HydrophobicContact CD2-CG 4.43Å; L168-C293 HydrophobicContact CD2-CB 3.93Å; L168-Q294 HydrophobicContact CD1-CG 3.69Å; L168-Q294 HydrophobicContact CD2-CG 3.97Å; L168-I297 HydrophobicContact CD2-CD1 4.35Å; L168-I297 HydrophobicContact CG-CD1 4.28Å
169N89.1Confident81.4Confident93 Ų9352.2 Ų52.250%0.49725%0.25SS..G310 helixtrans-70.6-13.7177-67.8-13000112.5S163 E166 P167S163-N169 PolarHBondContact O-ND2 3.07Å; E166-N169 WeakPolarHBondContact CB-ND2 3.49Å; E166-N169 WeakPolarHBondContact O-CB 3.04Å; E166-N169 PolarHBondContact O-N 2.76Å; E166-N169 PolarHBondContact OE2-ND2 3.12Å; P167-N169 PolarHBondContact O-N 3.25Å
170Y89.7Confident80.2Confident45 Ų4552 Ų5218%0.17626%0.255CS..G310 helixtrans-95.9-1.4177.3-57.8-66000114.1V53 F55 P89 C90 L164 P167 L168 I320 M323V53-Y170 HydrophobicContact CG1-CE2 4.09Å; F55-Y170 VanDerWaalsContact CZ-OH 3.26Å; F55-Y170 WeakPolarHBondContact CZ-OH 3.45Å; P89-Y170 HydrophobicContact CB-CD1 3.65Å; P89-Y170 HydrophobicContact CB-CD2 3.7Å; P89-Y170 HydrophobicContact CB-CE1 3.6Å; P89-Y170 HydrophobicContact CB-CE2 3.67Å; P89-Y170 HydrophobicContact CB-CG 3.69Å; P89-Y170 HydrophobicContact CG-CD1 4.12Å; P89-Y170 HydrophobicContact CG-CD2 4.17Å; P89-Y170 HydrophobicContact CG-CE1 3.52Å; P89-Y170 HydrophobicContact CG-CE2 3.59Å; P89-Y170 HydrophobicContact CG-CG 4.4Å; P89-Y170 WeakPolarHBondContact CG-OH 3.32Å; C90-Y170 HydrophobicContact CB-CD1 4.11Å; C90-Y170 HydrophobicContact CB-CE1 3.87Å; L164-Y170 PolarHBondContact O-OH 2.97Å; P167-Y170 PolarHBondContact O-N 2.65Å; L168-Y170 PolarHBondContact O-N 3.24Å; Y170-I320 VanDerWaalsContact CB-CD1 3.46Å; Y170-I320 HydrophobicContact CG-CD1 4.35Å; Y170-M323 HydrophobicContact CD2-CE 4.29Å
171L89.1Confident79.5Confident7 Ų758.1 Ų58.14%0.03728%0.283CS..SBendtrans-101154.3174.5-66.2171.1000109.5L168 D173 K286 E289 R290 I320L168-L171 HydrophobicContact CD2-CD1 4.33Å; L168-L171 PolarHBondContact O-N 3.45Å; L171-D173 PolarHBondContact O-N 3.33Å; L171-D173 VanDerWaalsContact O-N 3.12Å; L171-K286 HydrophobicContact CD2-CD 3.8Å; L171-E289 HydrophobicContact CD2-CB 4.4Å; L171-E289 HydrophobicContact CD2-CG 4.13Å; L171-R290 VanDerWaalsContact C-NH2 3.25Å; L171-R290 VanDerWaalsContact CD1-CA 3.44Å; L171-R290 HydrophobicContact CD1-CB 3.74Å; L171-R290 HydrophobicContact CD1-CG 4.28Å; L171-R290 PolarHBondContact O-NH2 2.95Å; L171-I320 HydrophobicContact CD1-CG2 4.49Å; L171-I320 HydrophobicContact CD2-CB 4.12Å; L171-I320 HydrophobicContact CD2-CG1 3.7Å; L171-I320 HydrophobicContact CG-CB 4.37Å; L171-I320 HydrophobicContact CG-CG1 4.11Å; L171-I320 HydrophobicContact CG-CG2 4.29Å
172P85.6Confident79.1Confident41 Ų4160.8 Ų60.827%0.26629%0.291SS..PPolyproline II helixtrans-51.5119.7-173.7-26.634.2000112.7V174 K286 R290P172-V174 VanDerWaalsContact O-CG2 3.27Å; P172-V174 WeakPolarHBondContact O-CG2 3.39Å; P172-V174 PolarHBondContact O-N 2.89Å; P172-V174 VanDerWaalsContact O-N 3.09Å; P172-K286 HydrophobicContact CG-CB 4.13Å; P172-K286 HydrophobicContact CG-CG 4.31Å; P172-R290 PolarHBondContact O-NH2 2.96Å
173D75.7Confident78.8Confident81 Ų8159.1 Ų59.143%0.43328%0.283SS..PPolyproline II helixtrans-57.3116.8-175-176.3-3.5000111.2L171 E175 T176L171-D173 PolarHBondContact O-N 3.33Å; L171-D173 VanDerWaalsContact O-N 3.12Å; D173-E175 PolarHBondContact OD1-N 3.07Å; D173-T176 PolarHBondContact OD1-N 2.89Å; D173-T176 WeakPolarHBondContact OD2-CB 3.34Å; D173-T176 PolarHBondContact OD2-OG1 2.85Å
174V70.2Confident78.7Confident8 Ų860.9 Ų60.95%0.04829%0.289CS..SBendtrans-97.9-30.4177.6-163.60000110.4P172 A177 F178 H252P172-V174 VanDerWaalsContact O-CG2 3.27Å; P172-V174 WeakPolarHBondContact O-CG2 3.39Å; P172-V174 PolarHBondContact O-N 2.89Å; P172-V174 VanDerWaalsContact O-N 3.09Å; V174-A177 CarbonylContact O-C 3.53Å; V174-A177 WeakPolarHBondContact O-CA 3.23Å; V174-A177 VanDerWaalsContact O-CB 3.28Å; V174-A177 WeakPolarHBondContact O-CB 3.39Å; V174-A177 PolarHBondContact O-N 3.26Å; V174-F178 HydrophobicContact CB-CE2 4.35Å; V174-F178 HydrophobicContact CG1-CD2 3.8Å; V174-F178 HydrophobicContact CG1-CE2 3.36Å; V174-F178 HydrophobicContact CG1-CZ 4.17Å; V174-F178 WeakPolarHBondContact O-CD2 3.18Å; V174-F178 PolarHBondContact O-N 3.41Å; V174-H252 HydrophobicContact CG1-CB 3.52Å; V174-H252 HydrophobicContact CG2-CB 4.34Å
175E66.1Low78.5Confident160 Ų16065.7 Ų65.775%0.74831%0.309SS*.THydrogen-bonded Turntrans-67.5-39.3-178.9-66.2-168.9172.900112D173 A177 F178 R179D173-E175 PolarHBondContact OD1-N 3.07Å; E175-A177 VanDerWaalsContact C-N 3.31Å; E175-F178 PolarHBondContact O-N 2.92Å; E175-R179 PolarHBondContact O-N 3.24Å
176T59.7Low78.5Confident53 Ų5366 Ų6633%0.32531%0.312SS..THydrogen-bonded Turntrans-71.1-29.3170.3-60.60000111.6D173 F178 R179D173-T176 PolarHBondContact OD1-N 2.89Å; D173-T176 WeakPolarHBondContact OD2-CB 3.34Å; D173-T176 PolarHBondContact OD2-OG1 2.85Å; T176-F178 VanDerWaalsContact C-N 3.33Å; T176-F178 PolarHBondContact O-N 3.48Å; T176-R179 VanDerWaalsContact O-CB 3.28Å; T176-R179 WeakPolarHBondContact O-CB 3.17Å; T176-R179 PolarHBondContact O-N 3.43Å; T176-R179 VanDerWaalsContact O-N 3.1Å
177A52.3Low78.6Confident1 Ų162.2 Ų62.21%0.00829%0.294CS..G310 helixtrans-66.5-35.2174.900000112V174 E175 R179 S180 L245 T249V174-A177 CarbonylContact O-C 3.53Å; V174-A177 WeakPolarHBondContact O-CA 3.23Å; V174-A177 VanDerWaalsContact O-CB 3.28Å; V174-A177 WeakPolarHBondContact O-CB 3.39Å; V174-A177 PolarHBondContact O-N 3.26Å; E175-A177 VanDerWaalsContact C-N 3.31Å; A177-R179 PolarHBondContact O-N 2.88Å; A177-S180 PolarHBondContact O-N 3.3Å; A177-L245 HydrophobicContact CB-CD2 4.25Å; A177-T249 VanDerWaalsContact CB-OG1 3.29Å; A177-T249 WeakPolarHBondContact CB-OG1 3.48Å
178F55Low78.8Confident60 Ų6063.7 Ų63.726%0.26330%0.301SS..G310 helixtrans-68.8-13.1170.3-74.7-66.1000114.6V174 E175 T176 S180 E184 H252 I253V174-F178 HydrophobicContact CB-CE2 4.35Å; V174-F178 HydrophobicContact CG1-CD2 3.8Å; V174-F178 HydrophobicContact CG1-CE2 3.36Å; V174-F178 HydrophobicContact CG1-CZ 4.17Å; V174-F178 WeakPolarHBondContact O-CD2 3.18Å; V174-F178 PolarHBondContact O-N 3.41Å; E175-F178 PolarHBondContact O-N 2.92Å; T176-F178 VanDerWaalsContact C-N 3.33Å; T176-F178 PolarHBondContact O-N 3.48Å; F178-S180 PolarHBondContact O-N 3.18Å; F178-S180 VanDerWaalsContact O-N 3.15Å; F178-E184 HydrophobicContact CD1-CB 4.29Å; F178-E184 VanDerWaalsContact CD1-CD 3.44Å; F178-E184 HydrophobicContact CD1-CG 3.73Å; F178-E184 HydrophobicContact CE1-CG 3.83Å; F178-H252 AromaticContact CE2-CD2 3.67Å; F178-H252 AromaticContact CE2-NE2 3.78Å; F178-H252 AromaticContact CZ-CD2 3.42Å; F178-H252 VanDerWaalsContact CZ-CD2 3.42Å; F178-H252 WeakPolarHBondContact CZ-CD2 3.44Å; F178-H252 AromaticContact CZ-NE2 3.77Å; F178-I253 HydrophobicContact CE1-CD1 4.49Å
179R57.9Low79Confident197 Ų19766.9 Ų66.974%0.74331%0.313SS*.G310 helixtrans-65.8-17.3175.8-65.1-179.8-173.1177.21.7112.7E175 T176 A177E175-R179 PolarHBondContact O-N 3.24Å; T176-R179 VanDerWaalsContact O-CB 3.28Å; T176-R179 WeakPolarHBondContact O-CB 3.17Å; T176-R179 PolarHBondContact O-N 3.43Å; T176-R179 VanDerWaalsContact O-N 3.1Å; A177-R179 PolarHBondContact O-N 2.88Å
180S68.4Low79.3Confident40 Ų4063.3 Ų63.328%0.2829%0.293SS..  trans-96.689.6168.5-173.70000110.8A177 F178 R182 I183 E184A177-S180 PolarHBondContact O-N 3.3Å; F178-S180 PolarHBondContact O-N 3.18Å; F178-S180 VanDerWaalsContact O-N 3.15Å; S180-R182 PolarHBondContact O-N 3.4Å; S180-I183 PolarHBondContact O-N 3Å; S180-I183 WeakPolarHBondContact OG-CG1 3.41Å; S180-I183 PolarHBondContact OG-N 2.86Å; S180-E184 PolarHBondContact O-N 3.47Å; S180-E184 VanDerWaalsContact O-N 3.09Å
181Q79.1Confident79.5Confident129 Ų12961.2 Ų61.260%0.60329%0.285SS*.Hα-helixtrans-52-24.3170.3-69.4-175.44.200112.7K185Q181-K185 VanDerWaalsContact O-CB 3.25Å; Q181-K185 WeakPolarHBondContact O-CB 3.24Å; Q181-K185 VanDerWaalsContact O-CD 3.31Å; Q181-K185 WeakPolarHBondContact O-CD 3.39Å; Q181-K185 WeakPolarHBondContact O-CG 3.21Å; Q181-K185 PolarHBondContact O-N 3.31Å; Q181-K185 VanDerWaalsContact O-N 3.16Å
182R84.6Confident79.8Confident129 Ų12963.4 Ų63.449%0.48730%0.297SS..Hα-helixtrans-67.4-51.6174.4-177.7-179.1175.8174.80.9111.2S180 K185 A186 E231 D234S180-R182 PolarHBondContact O-N 3.4Å; R182-K185 PolarHBondContact O-N 2.99Å; R182-A186 WeakPolarHBondContact O-CB 3.48Å; R182-A186 PolarHBondContact O-N 3.07Å; R182-E231 PolarHBondContact NH2-O 2.78Å; R182-D234 IonicContact NH2-OD2 3.02Å; R182-D234 PolarHBondContact NH2-OD2 2.96Å
183I86.6Confident80.3Confident6 Ų663 Ų633%0.03129%0.292CS..Hα-helixtrans-62-50.8180-65.9168.3000109.7S180 K185 A186 V187 I232 L245 V246 T249S180-I183 PolarHBondContact O-N 3Å; S180-I183 WeakPolarHBondContact OG-CG1 3.41Å; S180-I183 PolarHBondContact OG-N 2.86Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 3.17Å; I183-A186 PolarHBondContact O-N 3.45Å; I183-A186 VanDerWaalsContact O-N 3.16Å; I183-V187 HydrophobicContact CG2-CG2 4.13Å; I183-V187 WeakPolarHBondContact O-CG2 3.26Å; I183-V187 PolarHBondContact O-N 2.91Å; I183-I232 HydrophobicContact CB-CD1 4.03Å; I183-I232 HydrophobicContact CG1-CD1 3.55Å; I183-I232 HydrophobicContact CG1-CG2 4.3Å; I183-I232 HydrophobicContact CG2-CD1 4.33Å; I183-L245 HydrophobicContact CD1-CB 4.09Å; I183-V246 HydrophobicContact CD1-CG2 4.31Å; I183-V246 HydrophobicContact CG1-CG2 4.22Å; I183-V246 HydrophobicContact CG2-CG2 3.97Å; I183-T249 HydrophobicContact CG2-CG2 4Å
184E88Confident81.1Confident61 Ų6160.4 Ų60.429%0.28528%0.28SS..Hα-helixtrans-56-45.7-179.4-175.7-168.5172.400112.3F178 S180 N188 I253F178-E184 HydrophobicContact CD1-CB 4.29Å; F178-E184 VanDerWaalsContact CD1-CD 3.44Å; F178-E184 HydrophobicContact CD1-CG 3.73Å; F178-E184 HydrophobicContact CE1-CG 3.83Å; S180-E184 PolarHBondContact O-N 3.47Å; S180-E184 VanDerWaalsContact O-N 3.09Å; E184-N188 WeakPolarHBondContact O-CB 3.48Å; E184-N188 PolarHBondContact O-N 3.14Å; E184-N188 PolarHBondContact O-ND2 3.16Å; E184-I253 HydrophobicContact CG-CD1 4.19Å
185K89.7Confident82Confident133 Ų13364.4 Ų64.458%0.57830%0.3SS*.Hα-helixtrans-64.8-42.3178-76.1172.4-173.7170.90112.2Q181 R182 I183 K189Q181-K185 VanDerWaalsContact O-CB 3.25Å; Q181-K185 WeakPolarHBondContact O-CB 3.24Å; Q181-K185 VanDerWaalsContact O-CD 3.31Å; Q181-K185 WeakPolarHBondContact O-CD 3.39Å; Q181-K185 WeakPolarHBondContact O-CG 3.21Å; Q181-K185 PolarHBondContact O-N 3.31Å; Q181-K185 VanDerWaalsContact O-N 3.16Å; R182-K185 PolarHBondContact O-N 2.99Å; I183-K185 VanDerWaalsContact C-N 3.33Å; I183-K185 PolarHBondContact O-N 3.17Å; K185-K189 VanDerWaalsContact O-CB 3.27Å; K185-K189 WeakPolarHBondContact O-CB 3.39Å; K185-K189 PolarHBondContact O-N 2.92Å
186A91.3Very high83.3Confident7 Ų761.5 Ų61.56%0.05829%0.289CS..Hα-helixtrans-64.9-44.717900000111.4R182 I183 K189 F190 V228 I232R182-A186 WeakPolarHBondContact O-CB 3.48Å; R182-A186 PolarHBondContact O-N 3.07Å; I183-A186 PolarHBondContact O-N 3.45Å; I183-A186 VanDerWaalsContact O-N 3.16Å; A186-K189 PolarHBondContact O-N 2.82Å; A186-F190 WeakPolarHBondContact O-CB 3.19Å; A186-F190 PolarHBondContact O-N 2.88Å; A186-V228 HydrophobicContact CB-CG1 3.92Å; A186-I232 HydrophobicContact CB-CD1 4.14Å
187V92.7Very high84.7Confident0 Ų062 Ų620%031%0.305CS..Hα-helixtrans-62-49.3175.4173.90000111.1I183 K189 F190 V191 V228 T249 F250 I253I183-V187 HydrophobicContact CG2-CG2 4.13Å; I183-V187 WeakPolarHBondContact O-CG2 3.26Å; I183-V187 PolarHBondContact O-N 2.91Å; V187-K189 VanDerWaalsContact C-N 3.34Å; V187-K189 PolarHBondContact O-N 2.63Å; V187-F190 PolarHBondContact O-N 2.66Å; V187-V191 HydrophobicContact CG1-CG2 4.29Å; V187-V191 WeakPolarHBondContact O-CG2 3.26Å; V187-V191 PolarHBondContact O-N 3.38Å; V187-V228 HydrophobicContact CG2-CG1 3.91Å; V187-V228 HydrophobicContact CG2-CG2 4.46Å; V187-T249 HydrophobicContact CB-CG2 4.45Å; V187-T249 HydrophobicContact CG2-CG2 4.15Å; V187-F250 HydrophobicContact CB-CD2 4.48Å; V187-F250 HydrophobicContact CG1-CB 4.2Å; V187-F250 HydrophobicContact CG1-CD2 3.84Å; V187-F250 HydrophobicContact CG1-CE2 4.45Å; V187-F250 HydrophobicContact CG1-CG 4.13Å; V187-F250 HydrophobicContact CG2-CB 4.39Å; V187-F250 HydrophobicContact CG2-CD2 4.12Å; V187-I253 HydrophobicContact CB-CD1 3.97Å; V187-I253 HydrophobicContact CG1-CB 3.91Å; V187-I253 HydrophobicContact CG1-CD1 3.61Å; V187-I253 HydrophobicContact CG1-CG1 4.3Å; V187-I253 HydrophobicContact CG1-CG2 4.12Å
188N93.7Very high86.5Confident40 Ų4068.7 Ų68.721%0.21433%0.334CS..Hα-helixtrans-57.3-48.1178.4-91.1-65.1000111.7E184 F190 V191 D192 I253 R257E184-N188 WeakPolarHBondContact O-CB 3.48Å; E184-N188 PolarHBondContact O-N 3.14Å; E184-N188 PolarHBondContact O-ND2 3.16Å; N188-F190 VanDerWaalsContact C-N 3.33Å; N188-F190 PolarHBondContact O-N 2.98Å; N188-V191 PolarHBondContact O-N 2.93Å; N188-D192 WeakPolarHBondContact O-CB 3.46Å; N188-D192 PolarHBondContact O-N 2.95Å; N188-D192 VanDerWaalsContact O-OD2 3.12Å; N188-I253 WeakPolarHBondContact ND2-CD1 3.47Å; N188-R257 PolarHBondContact OD1-NH1 3.24Å
189K94.7Very high88.1Confident114 Ų11468 Ų6850%0.49633%0.333SS..Hα-helixtrans-57.5-46.5176.7179.9-172.5170.2-161.10111.4K185 A186 V187 D192 D193K185-K189 VanDerWaalsContact O-CB 3.27Å; K185-K189 WeakPolarHBondContact O-CB 3.39Å; K185-K189 PolarHBondContact O-N 2.92Å; A186-K189 PolarHBondContact O-N 2.82Å; V187-K189 VanDerWaalsContact C-N 3.34Å; V187-K189 PolarHBondContact O-N 2.63Å; K189-D192 PolarHBondContact O-N 3.26Å; K189-D193 WeakPolarHBondContact O-CB 3.42Å; K189-D193 VanDerWaalsContact O-CG 3.26Å; K189-D193 PolarHBondContact O-N 3.29Å
190F95.5Very high89.5Confident17 Ų1767.6 Ų67.68%0.07533%0.331CS..Hα-helixtrans-60.2-49.3178.1-177.6-82.3000111.5A186 V187 N188 D192 D193 V194 I199 I201 Y223 V228 F250A186-F190 WeakPolarHBondContact O-CB 3.19Å; A186-F190 PolarHBondContact O-N 2.88Å; V187-F190 PolarHBondContact O-N 2.66Å; N188-F190 VanDerWaalsContact C-N 3.33Å; N188-F190 PolarHBondContact O-N 2.98Å; F190-D192 VanDerWaalsContact C-N 3.33Å; F190-D192 PolarHBondContact O-N 3.21Å; F190-D193 PolarHBondContact O-N 3.46Å; F190-V194 HydrophobicContact CD1-CG2 4.01Å; F190-V194 HydrophobicContact CE1-CG2 3.44Å; F190-V194 VanDerWaalsContact CE1-CG2 3.44Å; F190-V194 HydrophobicContact CZ-CG2 3.77Å; F190-V194 WeakPolarHBondContact O-CG2 3.5Å; F190-V194 PolarHBondContact O-N 2.79Å; F190-I199 HydrophobicContact CD2-CD1 3.7Å; F190-I199 HydrophobicContact CE2-CD1 3.71Å; F190-I199 HydrophobicContact CE2-CG2 4.38Å; F190-I199 HydrophobicContact CG-CD1 4.28Å; F190-I199 HydrophobicContact CZ-CD1 4.29Å; F190-I199 HydrophobicContact CZ-CG2 4.49Å; F190-I201 HydrophobicContact CZ-CD1 4.02Å; F190-Y223 HydrophobicContact CE2-CD1 4.06Å; F190-Y223 AromaticContact CE2-CE1 4Å; F190-Y223 HydrophobicContact CE2-CE1 4Å; F190-Y223 AromaticContact CZ-CD1 3.77Å; F190-Y223 HydrophobicContact CZ-CD1 3.77Å; F190-Y223 HydrophobicContact CZ-CE1 4.13Å; F190-V228 HydrophobicContact CB-CG2 3.91Å; F190-V228 HydrophobicContact CD2-CG2 4.37Å; F190-V228 HydrophobicContact CG-CG2 4.16Å; F190-F250 AromaticContact CD1-CE2 3.47Å; F190-F250 HydrophobicContact CD1-CE2 3.47Å; F190-F250 VanDerWaalsContact CD1-CE2 3.47Å; F190-F250 AromaticContact CD1-CZ 3.54Å; F190-F250 HydrophobicContact CD1-CZ 3.54Å; F190-F250 AromaticContact CE1-CE2 3.96Å; F190-F250 HydrophobicContact CE1-CE2 3.96Å; F190-F250 AromaticContact CE1-CZ 3.7Å; F190-F250 HydrophobicContact CE1-CZ 3.7Å; F190-F250 HydrophobicContact CG-CE2 4.15Å
191V94.8Very high90.5Very high2 Ų266.1 Ų66.11%0.01232%0.32CS..Hα-helixtrans-61.6-41.9179.21730000111V187 N188 V194 I195 F250 I253 Y254 R257 V258V187-V191 HydrophobicContact CG1-CG2 4.29Å; V187-V191 WeakPolarHBondContact O-CG2 3.26Å; V187-V191 PolarHBondContact O-N 3.38Å; N188-V191 PolarHBondContact O-N 2.93Å; V191-V194 PolarHBondContact O-N 2.88Å; V191-I195 HydrophobicContact CG1-CD1 3.78Å; V191-I195 HydrophobicContact CG1-CG1 4.46Å; V191-I195 VanDerWaalsContact O-CG1 3.28Å; V191-I195 WeakPolarHBondContact O-CG1 3.21Å; V191-I195 PolarHBondContact O-N 2.78Å; V191-F250 HydrophobicContact CG2-CE1 4.49Å; V191-F250 HydrophobicContact CG2-CE2 4.45Å; V191-F250 HydrophobicContact CG2-CZ 4.14Å; V191-I253 HydrophobicContact CG2-CG2 4.24Å; V191-Y254 HydrophobicContact CG2-CD2 4.25Å; V191-R257 HydrophobicContact CG1-CB 4.49Å; V191-V258 HydrophobicContact CG1-CG2 4.35Å
192D95.4Very high91Very high53 Ų5363 Ų6328%0.28331%0.311SS..Hα-helixtrans-60.6-45174-83.4-48.8000112.3N188 K189 F190 V194 I195 N196 R257N188-D192 WeakPolarHBondContact O-CB 3.46Å; N188-D192 PolarHBondContact O-N 2.95Å; N188-D192 VanDerWaalsContact O-OD2 3.12Å; K189-D192 PolarHBondContact O-N 3.26Å; F190-D192 VanDerWaalsContact C-N 3.33Å; F190-D192 PolarHBondContact O-N 3.21Å; D192-V194 VanDerWaalsContact C-N 3.31Å; D192-V194 PolarHBondContact O-N 3Å; D192-I195 PolarHBondContact O-N 2.96Å; D192-N196 VanDerWaalsContact O-CB 3.29Å; D192-N196 WeakPolarHBondContact O-CB 3.31Å; D192-N196 VanDerWaalsContact O-CG 3.26Å; D192-N196 PolarHBondContact O-N 3.13Å; D192-N196 PolarHBondContact O-ND2 3.32Å; D192-R257 VanDerWaalsContact CG-NH1 3.3Å; D192-R257 IonicContact OD1-CZ 2.86Å; D192-R257 IonicContact OD1-NH1 3.89Å; D192-R257 PolarHBondContact OD1-NH1 2.85Å; D192-R257 IonicContact OD1-NH2 3.75Å; D192-R257 PolarHBondContact OD1-NH2 3.14Å; D192-R257 IonicContact OD2-CZ 3.07Å; D192-R257 IonicContact OD2-NH1 3.22Å; D192-R257 PolarHBondContact OD2-NH1 3.35Å; D192-R257 IonicContact OD2-NH2 2.62Å
193D94.8Very high91Very high31 Ų3161.7 Ų61.717%0.16631%0.314CS..Hα-helixtrans-69.7-29.9-178.8-72.6-20000111.8K189 F190 G197 K198 I199K189-D193 WeakPolarHBondContact O-CB 3.42Å; K189-D193 VanDerWaalsContact O-CG 3.26Å; K189-D193 PolarHBondContact O-N 3.29Å; F190-D193 PolarHBondContact O-N 3.46Å; D193-G197 PolarHBondContact O-N 3Å; D193-K198 HydrophobicContact CB-CB 4.13Å; D193-K198 HydrophobicContact CB-CD 4.45Å; D193-K198 PolarHBondContact O-N 3.47Å; D193-K198 WeakPolarHBondContact OD1-CD 3.32Å; D193-K198 IonicContact OD1-NZ 3.79Å; D193-K198 PolarHBondContact OD1-NZ 3.42Å; D193-I199 HydrophobicContact CB-CD1 3.49Å; D193-I199 VanDerWaalsContact CB-CD1 3.49Å; D193-I199 HydrophobicContact CB-CG1 3.8Å; D193-I199 PolarHBondContact O-N 3.03Å
194V93Very high91Very high28 Ų2863.9 Ų63.917%0.1733%0.325CS..Hα-helixtrans-68.4-50169.51720000111.5F190 V191 D192 N196 G197 I199 I201 I220F190-V194 HydrophobicContact CD1-CG2 4.01Å; F190-V194 HydrophobicContact CE1-CG2 3.44Å; F190-V194 VanDerWaalsContact CE1-CG2 3.44Å; F190-V194 HydrophobicContact CZ-CG2 3.77Å; F190-V194 WeakPolarHBondContact O-CG2 3.5Å; F190-V194 PolarHBondContact O-N 2.79Å; V191-V194 PolarHBondContact O-N 2.88Å; D192-V194 VanDerWaalsContact C-N 3.31Å; D192-V194 PolarHBondContact O-N 3Å; V194-N196 PolarHBondContact O-N 2.81Å; V194-G197 PolarHBondContact O-N 2.89Å; V194-I199 HydrophobicContact CG2-CB 4.29Å; V194-I199 HydrophobicContact CG2-CD1 4.3Å; V194-I201 HydrophobicContact CG2-CD1 4.07Å; V194-I220 HydrophobicContact CG1-CD1 4.19Å; V194-I220 HydrophobicContact CG1-CG1 4.41Å; V194-I220 HydrophobicContact CG1-CG2 4.07Å; V194-I220 HydrophobicContact CG2-CG2 4.5Å
195I89.8Confident90.8Very high92 Ų9267 Ų6747%0.47234%0.34SS..Hα-helixtrans-59.3-37179.3-69.3167.4000111V191 D192 G197 V258V191-I195 HydrophobicContact CG1-CD1 3.78Å; V191-I195 HydrophobicContact CG1-CG1 4.46Å; V191-I195 VanDerWaalsContact O-CG1 3.28Å; V191-I195 WeakPolarHBondContact O-CG1 3.21Å; V191-I195 PolarHBondContact O-N 2.78Å; D192-I195 PolarHBondContact O-N 2.96Å; I195-G197 VanDerWaalsContact C-N 3.29Å; I195-G197 PolarHBondContact O-N 2.77Å; I195-V258 HydrophobicContact CD1-CG2 4.22Å
196N92.6Very high90.5Very high99 Ų9967.4 Ų67.453%0.52934%0.343SS..THydrogen-bonded Turntrans-84.84.1178.4-66.6-55.5000113.8D192 V194 K198D192-N196 VanDerWaalsContact O-CB 3.29Å; D192-N196 WeakPolarHBondContact O-CB 3.31Å; D192-N196 VanDerWaalsContact O-CG 3.26Å; D192-N196 PolarHBondContact O-N 3.13Å; D192-N196 PolarHBondContact O-ND2 3.32Å; V194-N196 PolarHBondContact O-N 2.81Å; N196-K198 VanDerWaalsContact C-N 3.28Å; N196-K198 HydrophobicContact CB-CG 4.17Å; N196-K198 PolarHBondContact O-N 2.93Å
197G88Confident90.2Very high64 Ų6468.9 Ų68.966%0.6635%0.351SS*.THydrogen-bonded Turntrans66.522.8177.500000115D193 V194 I195D193-G197 PolarHBondContact O-N 3Å; V194-G197 PolarHBondContact O-N 2.89Å; I195-G197 VanDerWaalsContact C-N 3.29Å; I195-G197 PolarHBondContact O-N 2.77Å
198K91.3Very high89.7Confident141 Ų14173.5 Ų73.561%0.61338%0.376SS*.  trans-85-19.2180-60.1-177.3-158.4153.60113.3D193 N196D193-K198 HydrophobicContact CB-CB 4.13Å; D193-K198 HydrophobicContact CB-CD 4.45Å; D193-K198 PolarHBondContact O-N 3.47Å; D193-K198 WeakPolarHBondContact OD1-CD 3.32Å; D193-K198 IonicContact OD1-NZ 3.79Å; D193-K198 PolarHBondContact OD1-NZ 3.42Å; N196-K198 VanDerWaalsContact C-N 3.28Å; N196-K198 HydrophobicContact CB-CG 4.17Å; N196-K198 PolarHBondContact O-N 2.93Å
199I88.3Confident89.1Confident46 Ų4678 Ų7824%0.23640%0.396CS..SBendtrans-107.5129.8178.4-66.8170.6000109F190 D193 V194 I201 Y223F190-I199 HydrophobicContact CD2-CD1 3.7Å; F190-I199 HydrophobicContact CE2-CD1 3.71Å; F190-I199 HydrophobicContact CE2-CG2 4.38Å; F190-I199 HydrophobicContact CG-CD1 4.28Å; F190-I199 HydrophobicContact CZ-CD1 4.29Å; F190-I199 HydrophobicContact CZ-CG2 4.49Å; D193-I199 HydrophobicContact CB-CD1 3.49Å; D193-I199 VanDerWaalsContact CB-CD1 3.49Å; D193-I199 HydrophobicContact CB-CG1 3.8Å; D193-I199 PolarHBondContact O-N 3.03Å; V194-I199 HydrophobicContact CG2-CB 4.29Å; V194-I199 HydrophobicContact CG2-CD1 4.3Å; I199-I201 HydrophobicContact CG2-CD1 3.81Å; I199-Y223 HydrophobicContact CG2-CE1 3.87Å
200R87.1Confident88.3Confident187 Ų18782.2 Ų82.271%0.70641%0.414SS*.  trans-88.7112.2169.4-171.8179-178-161.6-1108.9E205R200-E205 IonicContact CZ-OE2 3.62Å; R200-E205 IonicContact NE-OE2 3.71Å; R200-E205 VanDerWaalsContact NH2-CD 3.32Å; R200-E205 IonicContact NH2-OE1 3.12Å; R200-E205 PolarHBondContact NH2-OE1 2.79Å; R200-E205 VanDerWaalsContact NH2-OE1 3.12Å; R200-E205 IonicContact NH2-OE2 2.71Å; R200-E205 PolarHBondContact NH2-OE2 3.14Å
201I89.8Confident87.5Confident9 Ų985.2 Ų85.25%0.04644%0.443CS..  trans-81.1127.3175-54.2-65.8000108.5F190 V194 I199 L204 L219 I220 Y223F190-I201 HydrophobicContact CZ-CD1 4.02Å; V194-I201 HydrophobicContact CG2-CD1 4.07Å; I199-I201 HydrophobicContact CG2-CD1 3.81Å; I201-L204 HydrophobicContact CB-CB 4.01Å; I201-L204 HydrophobicContact CB-CD2 3.95Å; I201-L204 HydrophobicContact CG1-CD2 4.23Å; I201-L204 HydrophobicContact CG2-CB 4.23Å; I201-L204 WeakPolarHBondContact O-CB 3.43Å; I201-L219 HydrophobicContact CG2-CB 4.16Å; I201-I220 HydrophobicContact CG1-CG1 4.15Å; I201-Y223 HydrophobicContact CD1-CD1 3.37Å; I201-Y223 HydrophobicContact CD1-CE1 3.9Å; I201-Y223 HydrophobicContact CD1-CG 4.21Å
202P88.4Confident87.1Confident64 Ų6488.4 Ų88.442%0.41646%0.46SS..THydrogen-bonded Turntrans-55.5145.2174.6-25.134.8000112.2L204 Y223P202-L204 PolarHBondContact O-N 3.29Å; P202-Y223 VanDerWaalsContact CD-CD2 3.45Å; P202-Y223 HydrophobicContact CG-CD2 3.78Å; P202-Y223 HydrophobicContact CG-CE2 3.71Å
203D85.9Confident86.8Confident101 Ų10189.1 Ų89.154%0.5446%0.46SS..THydrogen-bonded Turntrans61.4-4.4176.1-54.6-43.1000117.1E205 H206 L219D203-E205 PolarHBondContact O-N 2.92Å; D203-H206 PolarHBondContact O-N 3.48Å; D203-H206 VanDerWaalsContact O-N 3.09Å; D203-H206 IonicContact OD1-ND1 3.09Å; D203-L219 HydrophobicContact CB-CD1 4.38Å
204L86.8Confident86.7Confident52 Ų5288.7 Ų88.727%0.27246%0.457SS..G310 helixtrans-63.3-30.8-179-173.564.6000112.6I201 P202 H206 V207 V216 L219I201-L204 HydrophobicContact CB-CB 4.01Å; I201-L204 HydrophobicContact CB-CD2 3.95Å; I201-L204 HydrophobicContact CG1-CD2 4.23Å; I201-L204 HydrophobicContact CG2-CB 4.23Å; I201-L204 WeakPolarHBondContact O-CB 3.43Å; P202-L204 PolarHBondContact O-N 3.29Å; L204-H206 PolarHBondContact O-N 2.88Å; L204-V207 PolarHBondContact O-N 3.28Å; L204-V216 HydrophobicContact CD1-CB 3.94Å; L204-V216 HydrophobicContact CD1-CG1 3.63Å; L204-V216 HydrophobicContact CD1-CG2 3.8Å; L204-L219 HydrophobicContact CD1-CD1 4.38Å
205E82.9Confident86.6Confident128 Ų12889 Ų8960%0.59846%0.46SS*.G310 helixtrans-67.3-15.3177.465.2-163.1-176.100114.2R200 D203R200-E205 IonicContact CZ-OE2 3.62Å; R200-E205 IonicContact NE-OE2 3.71Å; R200-E205 VanDerWaalsContact NH2-CD 3.32Å; R200-E205 IonicContact NH2-OE1 3.12Å; R200-E205 PolarHBondContact NH2-OE1 2.79Å; R200-E205 VanDerWaalsContact NH2-OE1 3.12Å; R200-E205 IonicContact NH2-OE2 2.71Å; R200-E205 PolarHBondContact NH2-OE2 3.14Å; D203-E205 PolarHBondContact O-N 2.92Å
206H84.2Confident86.7Confident140 Ų14085.3 Ų85.365%0.64844%0.442SS*.G310 helixtrans-94.3-4.5178.3-54.2112.7000113D203 L204D203-H206 PolarHBondContact O-N 3.48Å; D203-H206 VanDerWaalsContact O-N 3.09Å; D203-H206 IonicContact OD1-ND1 3.09Å; L204-H206 PolarHBondContact O-N 2.88Å
207V84.6Confident86.8Confident38 Ų3881.4 Ų81.423%0.2342%0.42CS..SBendtrans-98.1124.2-178.6-1760000109.7L204 E209 V216 L219L204-V207 PolarHBondContact O-N 3.28Å; V207-E209 PolarHBondContact O-N 3.06Å; V207-V216 HydrophobicContact CB-CG2 4.27Å; V207-V216 HydrophobicContact CG1-CG2 3.77Å; V207-L219 HydrophobicContact CG2-CD1 3.66Å
208D82.5Confident87.1Confident98 Ų9883 Ų8352%0.52441%0.406SS..  trans-78.7100.8167.3-177.94.3000109.3K210 A211 D212D208-K210 PolarHBondContact O-N 2.98Å; D208-K210 VanDerWaalsContact O-N 3.12Å; D208-K210 WeakPolarHBondContact OD1-CB 3.23Å; D208-K210 PolarHBondContact OD1-N 2.98Å; D208-A211 HydrophobicContact CB-CB 3.99Å; D208-A211 PolarHBondContact O-N 3.34Å; D208-D212 PolarHBondContact O-N 3.46Å
209E80.9Confident87.3Confident133 Ų13377.9 Ų77.962%0.62139%0.386SS*.THydrogen-bonded Turntrans-54.3-30.1178.3-174.2-179.1179.400112.7V207 A211 K213 V216V207-E209 PolarHBondContact O-N 3.06Å; E209-A211 VanDerWaalsContact C-N 3.34Å; E209-K213 PolarHBondContact O-N 3.47Å; E209-V216 HydrophobicContact CB-CG2 4.21Å; E209-V216 HydrophobicContact CG-CG2 4.28Å
210K78.3Confident87.6Confident203 Ų20376.3 Ų76.388%0.88338%0.378SS*.THydrogen-bonded Turntrans-75.2-27.3179.3-63.1-178.4179.7177.80112.5D208D208-K210 PolarHBondContact O-N 2.98Å; D208-K210 VanDerWaalsContact O-N 3.12Å; D208-K210 WeakPolarHBondContact OD1-CB 3.23Å; D208-K210 PolarHBondContact OD1-N 2.98Å
211A78.5Confident88Confident81 Ų8168 Ų6867%0.66935%0.347SS*.THydrogen-bonded Turntrans-90.4-38.3178.900000111.8D208 E209D208-A211 HydrophobicContact CB-CB 3.99Å; D208-A211 PolarHBondContact O-N 3.34Å; E209-A211 VanDerWaalsContact C-N 3.34Å
212D85Confident88.2Confident69 Ų6971.6 Ų71.637%0.36937%0.365SS..  trans-147.379.9-178.3-173.70.2000112.4D208 F214 S215D208-D212 PolarHBondContact O-N 3.46Å; D212-F214 PolarHBondContact O-N 3.18Å; D212-F214 PolarHBondContact OD1-N 3.12Å; D212-S215 VanDerWaalsContact CG-OG 3.28Å; D212-S215 PolarHBondContact O-N 2.92Å; D212-S215 PolarHBondContact OD1-N 3.26Å; D212-S215 VanDerWaalsContact OD2-CB 3.23Å; D212-S215 WeakPolarHBondContact OD2-CB 3.47Å; D212-S215 PolarHBondContact OD2-OG 3.26Å
213K90.1Very high88.5Confident67 Ų6772 Ų7229%0.29136%0.359SS..Hα-helixtrans-61.3-27175.773171.4-171.31670113.4E209 V216 H217 E262E209-K213 PolarHBondContact O-N 3.47Å; K213-V216 WeakPolarHBondContact O-CB 3.38Å; K213-V216 PolarHBondContact O-N 2.79Å; K213-H217 PolarHBondContact O-CD2 3.37Å; K213-H217 PolarHBondContact O-N 2.91Å; K213-E262 IonicContact NZ-OE2 2.92Å; K213-E262 PolarHBondContact NZ-OE2 3.46Å
214F92.5Very high88.9Confident22 Ų2267.2 Ų67.210%0.09633%0.333CS..Hα-helixtrans-78.9-27.7-175.8-66.3-74.6000112.5D212 V216 H217 R218 T271 L272 G275 L276 A279D212-F214 PolarHBondContact O-N 3.18Å; D212-F214 PolarHBondContact OD1-N 3.12Å; F214-V216 VanDerWaalsContact C-N 3.28Å; F214-V216 PolarHBondContact O-N 2.95Å; F214-H217 PolarHBondContact O-N 3.08Å; F214-R218 WeakPolarHBondContact O-CB 3.13Å; F214-R218 PolarHBondContact O-N 2.81Å; F214-T271 HydrophobicContact CE2-CG2 4.45Å; F214-T271 HydrophobicContact CZ-CG2 4.41Å; F214-T271 WeakPolarHBondContact CZ-O 3.34Å; F214-L272 HydrophobicContact CE1-CD1 3.84Å; F214-G275 VanDerWaalsContact CD2-CA 3.41Å; F214-G275 VanDerWaalsContact CE2-CA 3.49Å; F214-L276 HydrophobicContact CD1-CD2 4.43Å; F214-A279 HydrophobicContact CB-CB 3.99Å
215S91.4Very high89.2Confident34 Ų3465.1 Ų65.124%0.23832%0.323CS..Hα-helixtrans-60.6-36.5166.9-82.40000112.8D212 R218 L219D212-S215 VanDerWaalsContact CG-OG 3.28Å; D212-S215 PolarHBondContact O-N 2.92Å; D212-S215 PolarHBondContact OD1-N 3.26Å; D212-S215 VanDerWaalsContact OD2-CB 3.23Å; D212-S215 WeakPolarHBondContact OD2-CB 3.47Å; D212-S215 PolarHBondContact OD2-OG 3.26Å; S215-R218 WeakPolarHBondContact O-CB 3.35Å; S215-R218 PolarHBondContact O-N 2.88Å; S215-L219 WeakPolarHBondContact O-CG 3.44Å; S215-L219 PolarHBondContact O-N 2.88Å
216V92Very high89.7Confident16 Ų1662.4 Ų62.410%0.09731%0.312CS..Hα-helixtrans-61.1-52.4173.61690000110.8L204 V207 E209 K213 F214 R218 L219 I220L204-V216 HydrophobicContact CD1-CB 3.94Å; L204-V216 HydrophobicContact CD1-CG1 3.63Å; L204-V216 HydrophobicContact CD1-CG2 3.8Å; V207-V216 HydrophobicContact CB-CG2 4.27Å; V207-V216 HydrophobicContact CG1-CG2 3.77Å; E209-V216 HydrophobicContact CB-CG2 4.21Å; E209-V216 HydrophobicContact CG-CG2 4.28Å; K213-V216 WeakPolarHBondContact O-CB 3.38Å; K213-V216 PolarHBondContact O-N 2.79Å; F214-V216 VanDerWaalsContact C-N 3.28Å; F214-V216 PolarHBondContact O-N 2.95Å; V216-R218 PolarHBondContact O-N 3.36Å; V216-L219 PolarHBondContact O-N 2.97Å; V216-I220 HydrophobicContact CG1-CD1 3.72Å; V216-I220 WeakPolarHBondContact O-CG1 3.3Å; V216-I220 PolarHBondContact O-N 2.73Å
217H94.4Very high90Very high16 Ų1656.9 Ų56.97%0.07429%0.289CS..Hα-helixtrans-58.8-38.4177.7-63.1-56.9000112.1K213 F214 I220 F221 Y254K213-H217 PolarHBondContact O-CD2 3.37Å; K213-H217 PolarHBondContact O-N 2.91Å; F214-H217 PolarHBondContact O-N 3.08Å; H217-I220 PolarHBondContact O-N 2.81Å; H217-F221 WeakPolarHBondContact O-CB 3.46Å; H217-F221 PolarHBondContact O-N 2.97Å; H217-Y254 HydrophobicContact CB-CE1 4.39Å; H217-Y254 AromaticContact ND1-CE1 3.89Å; H217-Y254 AromaticContact ND1-CZ 3.83Å; H217-Y254 PolarHBondContact ND1-OH 2.91Å
218R94.8Very high90.3Very high97 Ų9755 Ų5537%0.36628%0.278SS..Hα-helixtrans-61.7-48.3177.7-173.2-175.3177.3-87.2-4112.4F214 S215 V216 F221 I222 A279 L281F214-R218 WeakPolarHBondContact O-CB 3.13Å; F214-R218 PolarHBondContact O-N 2.81Å; S215-R218 WeakPolarHBondContact O-CB 3.35Å; S215-R218 PolarHBondContact O-N 2.88Å; V216-R218 PolarHBondContact O-N 3.36Å; R218-F221 PolarHBondContact O-N 2.74Å; R218-I222 HydrophobicContact CG-CD1 3.85Å; R218-I222 WeakPolarHBondContact O-CG1 3.2Å; R218-I222 PolarHBondContact O-N 2.73Å; R218-A279 HydrophobicContact CB-CB 4.38Å; R218-A279 WeakPolarHBondContact CD-O 3.47Å; R218-A279 PolarHBondContact NE-O 2.65Å; R218-L281 HydrophobicContact CB-CD1 3.94Å; R218-L281 HydrophobicContact CB-CD2 4.36Å; R218-L281 HydrophobicContact CB-CG 4.35Å; R218-L281 HydrophobicContact CG-CD1 4.44Å; R218-L281 HydrophobicContact CG-CD2 4.09Å; R218-L281 HydrophobicContact CG-CG 4.31Å
219L94.3Very high90.6Very high35 Ų3551 Ų5118%0.18326%0.258CS..Hα-helixtrans-63.5-45.2179.3-70.6175.1000111.3I201 D203 L204 V207 S215 V216 F221 Y223I201-L219 HydrophobicContact CG2-CB 4.16Å; D203-L219 HydrophobicContact CB-CD1 4.38Å; L204-L219 HydrophobicContact CD1-CD1 4.38Å; V207-L219 HydrophobicContact CG2-CD1 3.66Å; S215-L219 WeakPolarHBondContact O-CG 3.44Å; S215-L219 PolarHBondContact O-N 2.88Å; V216-L219 PolarHBondContact O-N 2.97Å; L219-F221 VanDerWaalsContact C-N 3.34Å; L219-F221 PolarHBondContact O-N 3.31Å; L219-Y223 VanDerWaalsContact O-CB 3.27Å; L219-Y223 WeakPolarHBondContact O-CB 3.34Å; L219-Y223 PolarHBondContact O-N 2.97Å
220I94.9Very high91Very high13 Ų1351.3 Ų51.37%0.06725%0.253CS..Hα-helixtrans-59.3-46.8176.6-66.6165.7000110.6V194 I201 V216 H217 G224 Y254V194-I220 HydrophobicContact CG1-CD1 4.19Å; V194-I220 HydrophobicContact CG1-CG1 4.41Å; V194-I220 HydrophobicContact CG1-CG2 4.07Å; V194-I220 HydrophobicContact CG2-CG2 4.5Å; I201-I220 HydrophobicContact CG1-CG1 4.15Å; V216-I220 HydrophobicContact CG1-CD1 3.72Å; V216-I220 WeakPolarHBondContact O-CG1 3.3Å; V216-I220 PolarHBondContact O-N 2.73Å; H217-I220 PolarHBondContact O-N 2.81Å; I220-G224 WeakPolarHBondContact O-CA 3.39Å; I220-G224 PolarHBondContact O-N 2.82Å; I220-Y254 HydrophobicContact CG2-CD2 4.45Å; I220-Y254 HydrophobicContact CG2-CE2 3.6Å
221F95.4Very high91.4Very high13 Ų1346.3 Ų46.36%0.05723%0.233CC..Hα-helixtrans-63.9-49.8-177.3-172.4-91.1000112H217 R218 L219 G224 V225 R247 F250 A251 L281 A283 L284H217-F221 WeakPolarHBondContact O-CB 3.46Å; H217-F221 PolarHBondContact O-N 2.97Å; R218-F221 PolarHBondContact O-N 2.74Å; L219-F221 VanDerWaalsContact C-N 3.34Å; L219-F221 PolarHBondContact O-N 3.31Å; F221-G224 PolarHBondContact O-N 3.03Å; F221-V225 HydrophobicContact CD1-CG2 4.25Å; F221-V225 HydrophobicContact CE1-CG2 3.88Å; F221-V225 HydrophobicContact CE2-CG2 4.37Å; F221-V225 HydrophobicContact CZ-CG2 3.94Å; F221-V225 WeakPolarHBondContact O-CG2 3.4Å; F221-V225 PolarHBondContact O-N 2.7Å; F221-R247 HydrophobicContact CE1-CG 4.39Å; F221-R247 HydrophobicContact CZ-CG 4.18Å; F221-F250 AromaticContact CD2-CD1 3.65Å; F221-F250 HydrophobicContact CD2-CD1 3.65Å; F221-F250 HydrophobicContact CD2-CE1 4.01Å; F221-F250 HydrophobicContact CE2-CB 4.47Å; F221-F250 AromaticContact CE2-CD1 3.71Å; F221-F250 HydrophobicContact CE2-CD1 3.71Å; F221-F250 HydrophobicContact CE2-CG 4.49Å; F221-A251 HydrophobicContact CE2-CB 3.92Å; F221-A251 HydrophobicContact CZ-CB 4.12Å; F221-L281 HydrophobicContact CB-CD2 4.13Å; F221-L281 HydrophobicContact CD1-CD2 3.84Å; F221-L281 HydrophobicContact CG-CD2 4.11Å; F221-A283 HydrophobicContact CE1-CB 4.43Å; F221-A283 HydrophobicContact CZ-CB 3.89Å; F221-L284 HydrophobicContact CB-CD1 4.46Å; F221-L284 HydrophobicContact CD2-CD1 3.68Å; F221-L284 HydrophobicContact CD2-CD2 4.18Å; F221-L284 HydrophobicContact CD2-CG 3.88Å; F221-L284 HydrophobicContact CE2-CD1 4.18Å; F221-L284 HydrophobicContact CE2-CD2 4.06Å; F221-L284 HydrophobicContact CE2-CG 3.85Å; F221-L284 HydrophobicContact CG-CD1 4.13Å
222I94.3Very high91.6Very high83 Ų8343.2 Ų43.243%0.42621%0.205SC..Hα-helixtrans-62-48.8-179.5-68.3170.8000110.5R218 G224 D226R218-I222 HydrophobicContact CG-CD1 3.85Å; R218-I222 WeakPolarHBondContact O-CG1 3.2Å; R218-I222 PolarHBondContact O-N 2.73Å; I222-G224 VanDerWaalsContact C-N 3.34Å; I222-G224 PolarHBondContact O-N 3.09Å; I222-D226 WeakPolarHBondContact O-CB 3.43Å; I222-D226 PolarHBondContact O-N 3.25Å; I222-D226 VanDerWaalsContact O-N 3.16Å
223Y94.9Very high91.1Very high73 Ų7341.9 Ų41.929%0.28620%0.201SC..Hα-helixtrans-66.6-37-179-179.2-97000112.2F190 I199 I201 P202 L219 S227F190-Y223 HydrophobicContact CE2-CD1 4.06Å; F190-Y223 AromaticContact CE2-CE1 4Å; F190-Y223 HydrophobicContact CE2-CE1 4Å; F190-Y223 AromaticContact CZ-CD1 3.77Å; F190-Y223 HydrophobicContact CZ-CD1 3.77Å; F190-Y223 HydrophobicContact CZ-CE1 4.13Å; I199-Y223 HydrophobicContact CG2-CE1 3.87Å; I201-Y223 HydrophobicContact CD1-CD1 3.37Å; I201-Y223 HydrophobicContact CD1-CE1 3.9Å; I201-Y223 HydrophobicContact CD1-CG 4.21Å; P202-Y223 VanDerWaalsContact CD-CD2 3.45Å; P202-Y223 HydrophobicContact CG-CD2 3.78Å; P202-Y223 HydrophobicContact CG-CE2 3.71Å; L219-Y223 VanDerWaalsContact O-CB 3.27Å; L219-Y223 WeakPolarHBondContact O-CB 3.34Å; L219-Y223 PolarHBondContact O-N 2.97Å; Y223-S227 WeakPolarHBondContact CE1-OG 3.39Å; Y223-S227 VanDerWaalsContact O-CB 3.23Å; Y223-S227 WeakPolarHBondContact O-CB 3.33Å; Y223-S227 PolarHBondContact O-N 2.83Å; Y223-S227 PolarHBondContact O-OG 2.6Å
224G94.2Very high89.8Confident0 Ų044.2 Ų44.20%022%0.216CC..Hα-helixtrans-67.2-46.9178.500000113.3I220 F221 I222 D226 S227 V228I220-G224 WeakPolarHBondContact O-CA 3.39Å; I220-G224 PolarHBondContact O-N 2.82Å; F221-G224 PolarHBondContact O-N 3.03Å; I222-G224 VanDerWaalsContact C-N 3.34Å; I222-G224 PolarHBondContact O-N 3.09Å; G224-D226 PolarHBondContact O-N 3.12Å; G224-S227 PolarHBondContact O-N 2.62Å; G224-V228 WeakPolarHBondContact O-CB 3.37Å; G224-V228 VanDerWaalsContact O-CG2 3.3Å; G224-V228 WeakPolarHBondContact O-CG2 3.33Å; G224-V228 PolarHBondContact O-N 3.07Å
225V93.6Very high88.1Confident9 Ų949.9 Ų49.96%0.05525%0.248CC..Hα-helixtrans-59.8-46.5175.9171.40000110.9F221 S229 V246 R247 F250F221-V225 HydrophobicContact CD1-CG2 4.25Å; F221-V225 HydrophobicContact CE1-CG2 3.88Å; F221-V225 HydrophobicContact CE2-CG2 4.37Å; F221-V225 HydrophobicContact CZ-CG2 3.94Å; F221-V225 WeakPolarHBondContact O-CG2 3.4Å; F221-V225 PolarHBondContact O-N 2.7Å; V225-S229 VanDerWaalsContact O-CB 3.23Å; V225-S229 WeakPolarHBondContact O-CB 3.05Å; V225-S229 PolarHBondContact O-N 2.75Å; V225-S229 PolarHBondContact O-OG 3.09Å; V225-V246 HydrophobicContact CG1-CG1 4.39Å; V225-R247 HydrophobicContact CG1-CB 4.25Å; V225-F250 HydrophobicContact CG2-CB 3.9Å; V225-F250 HydrophobicContact CG2-CD1 4.28Å; V225-F250 HydrophobicContact CG2-CD2 4.31Å; V225-F250 HydrophobicContact CG2-CG 3.91Å
226D92.1Very high86.2Confident71 Ų7157.4 Ų57.438%0.3828%0.279SS..Hα-helixtrans-62.7-45.3178.1174.150.4000112.5I222 G224 S229 R230I222-D226 WeakPolarHBondContact O-CB 3.43Å; I222-D226 PolarHBondContact O-N 3.25Å; I222-D226 VanDerWaalsContact O-N 3.16Å; G224-D226 PolarHBondContact O-N 3.12Å; D226-S229 PolarHBondContact O-N 3.32Å; D226-R230 PolarHBondContact O-N 3.06Å; D226-R230 IonicContact OD1-CZ 3.6Å; D226-R230 IonicContact OD1-NH1 3.03Å; D226-R230 PolarHBondContact OD1-NH1 3.5Å; D226-R230 IonicContact OD1-NH2 3.99Å; D226-R230 IonicContact OD2-CZ 3.04Å; D226-R230 IonicContact OD2-NH1 2.66Å; D226-R230 PolarHBondContact OD2-NH1 3.05Å; D226-R230 IonicContact OD2-NH2 2.76Å; D226-R230 PolarHBondContact OD2-NH2 2.84Å
227S91.4Very high84.3Confident23 Ų2365.9 Ų65.916%0.16132%0.318CS..Hα-helixtrans-65-46.2179.7-61.70000112.6Y223 G224 R230 E231Y223-S227 WeakPolarHBondContact CE1-OG 3.39Å; Y223-S227 VanDerWaalsContact O-CB 3.23Å; Y223-S227 WeakPolarHBondContact O-CB 3.33Å; Y223-S227 PolarHBondContact O-N 2.83Å; Y223-S227 PolarHBondContact O-OG 2.6Å; G224-S227 PolarHBondContact O-N 2.62Å; S227-R230 PolarHBondContact O-N 2.91Å; S227-E231 PolarHBondContact O-N 3.03Å; S227-E231 VanDerWaalsContact O-N 3.16Å
228V90.9Very high82.6Confident0 Ų072.2 Ų72.20%035%0.348CS..Hα-helixtrans-67.2-38.8177.91740000110.7A186 V187 F190 G224 R230 E231 I232 V246 F250A186-V228 HydrophobicContact CB-CG1 3.92Å; V187-V228 HydrophobicContact CG2-CG1 3.91Å; V187-V228 HydrophobicContact CG2-CG2 4.46Å; F190-V228 HydrophobicContact CB-CG2 3.91Å; F190-V228 HydrophobicContact CD2-CG2 4.37Å; F190-V228 HydrophobicContact CG-CG2 4.16Å; G224-V228 WeakPolarHBondContact O-CB 3.37Å; G224-V228 VanDerWaalsContact O-CG2 3.3Å; G224-V228 WeakPolarHBondContact O-CG2 3.33Å; G224-V228 PolarHBondContact O-N 3.07Å; V228-R230 VanDerWaalsContact C-N 3.35Å; V228-R230 PolarHBondContact O-N 2.89Å; V228-E231 PolarHBondContact O-N 3.36Å; V228-I232 HydrophobicContact CG1-CD1 3.6Å; V228-I232 HydrophobicContact CG1-CG1 4.39Å; V228-I232 VanDerWaalsContact O-CG1 3.25Å; V228-I232 WeakPolarHBondContact O-CG1 3.41Å; V228-I232 PolarHBondContact O-N 3.29Å; V228-V246 HydrophobicContact CB-CG1 3.97Å; V228-V246 HydrophobicContact CG1-CG1 3.72Å; V228-V246 HydrophobicContact CG1-CG2 4.34Å; V228-F250 HydrophobicContact CG2-CD2 4.44Å; V228-F250 HydrophobicContact CG2-CE2 4.38Å
229S89.7Confident81.2Confident13 Ų1370.6 Ų70.69%0.09135%0.351CS..Hα-helixtrans-62-43.3177.8-59.40000111.2V225 D226 E231 I232 S233V225-S229 VanDerWaalsContact O-CB 3.23Å; V225-S229 WeakPolarHBondContact O-CB 3.05Å; V225-S229 PolarHBondContact O-N 2.75Å; V225-S229 PolarHBondContact O-OG 3.09Å; D226-S229 PolarHBondContact O-N 3.32Å; S229-E231 VanDerWaalsContact C-N 3.34Å; S229-E231 PolarHBondContact O-N 3.35Å; S229-I232 PolarHBondContact O-N 3.2Å; S229-I232 VanDerWaalsContact O-N 3.15Å; S229-S233 WeakPolarHBondContact O-CB 3.45Å; S229-S233 PolarHBondContact O-N 3.18Å; S229-S233 PolarHBondContact O-OG 2.83Å
230R87.7Confident80Confident140 Ų14076.7 Ų76.753%0.52838%0.379SS..Hα-helixtrans-61.5-36.8173.9-76.9-167-67.2-103.2-8.3113.9D226 S227 V228 I232D226-R230 PolarHBondContact O-N 3.06Å; D226-R230 IonicContact OD1-CZ 3.6Å; D226-R230 IonicContact OD1-NH1 3.03Å; D226-R230 PolarHBondContact OD1-NH1 3.5Å; D226-R230 IonicContact OD1-NH2 3.99Å; D226-R230 IonicContact OD2-CZ 3.04Å; D226-R230 IonicContact OD2-NH1 2.66Å; D226-R230 PolarHBondContact OD2-NH1 3.05Å; D226-R230 IonicContact OD2-NH2 2.76Å; D226-R230 PolarHBondContact OD2-NH2 2.84Å; S227-R230 PolarHBondContact O-N 2.91Å; V228-R230 VanDerWaalsContact C-N 3.35Å; V228-R230 PolarHBondContact O-N 2.89Å; R230-I232 PolarHBondContact O-N 3.4Å
231E86.4Confident78.9Confident98 Ų9882 Ų8246%0.45841%0.406SS..Hα-helixtrans-68.2-22.2177-176.8176.8172.600112.6R182 S227 V228 S229R182-E231 PolarHBondContact NH2-O 2.78Å; S227-E231 PolarHBondContact O-N 3.03Å; S227-E231 VanDerWaalsContact O-N 3.16Å; V228-E231 PolarHBondContact O-N 3.36Å; S229-E231 VanDerWaalsContact C-N 3.34Å; S229-E231 PolarHBondContact O-N 3.35Å
232I83.5Confident78Confident16 Ų1682.4 Ų82.48%0.08241%0.41CS..Hα-helixtrans-102.9-32.9-172.7-62.5178.5000112.3I183 A186 V228 S229 R230 D234 V246I183-I232 HydrophobicContact CB-CD1 4.03Å; I183-I232 HydrophobicContact CG1-CD1 3.55Å; I183-I232 HydrophobicContact CG1-CG2 4.3Å; I183-I232 HydrophobicContact CG2-CD1 4.33Å; A186-I232 HydrophobicContact CB-CD1 4.14Å; V228-I232 HydrophobicContact CG1-CD1 3.6Å; V228-I232 HydrophobicContact CG1-CG1 4.39Å; V228-I232 VanDerWaalsContact O-CG1 3.25Å; V228-I232 WeakPolarHBondContact O-CG1 3.41Å; V228-I232 PolarHBondContact O-N 3.29Å; S229-I232 PolarHBondContact O-N 3.2Å; S229-I232 VanDerWaalsContact O-N 3.15Å; R230-I232 PolarHBondContact O-N 3.4Å; I232-D234 PolarHBondContact O-N 3.44Å; I232-V246 HydrophobicContact CD1-CG2 4.05Å
233S74.6Confident77.5Confident40 Ų4081.9 Ų81.928%0.2841%0.406SS..  trans-77.740.4-171.8-73.40000115.7S229 N235S229-S233 WeakPolarHBondContact O-CB 3.45Å; S229-S233 PolarHBondContact O-N 3.18Å; S229-S233 PolarHBondContact O-OG 2.83Å; S233-N235 PolarHBondContact O-N 3.16Å
234D61.8Low77.1Confident116 Ų11682.3 Ų82.362%0.6241%0.41SS*.  trans-65.6-3.3175.2-65.2-45.5000114.4R182 I232R182-D234 IonicContact NH2-OD2 3.02Å; R182-D234 PolarHBondContact NH2-OD2 2.96Å; I232-D234 PolarHBondContact O-N 3.44Å
235N56.8Low76.6Confident142 Ų14284.9 Ų84.976%0.75942%0.424SS*.SBendtrans-133.6116.4179.3-76.9-38.9000112.1S233 Q237S233-N235 PolarHBondContact O-N 3.16Å; N235-Q237 VanDerWaalsContact C-N 3.3Å; N235-Q237 PolarHBondContact O-N 3.27Å
236E52.3Low76.4Confident192 Ų19284.5 Ų84.590%0.89742%0.421SS*.THydrogen-bonded Turntrans-69.5-1.5-164.5-66.6-178153.500117.3
237Q52.7Low76.4Confident194 Ų19484.4 Ų84.491%0.90742%0.416SS*.THydrogen-bonded Turntrans-98.9-1.1-171.2-75.5-179.4-1200116N235N235-Q237 VanDerWaalsContact C-N 3.3Å; N235-Q237 PolarHBondContact O-N 3.27Å
238Q58Low76.3Confident149 Ų14984.2 Ų84.270%0.69641%0.413SS*.SBendtrans-133.921.8-176.6-78.4172.7-23.700114.6E240 C242Q238-E240 PolarHBondContact O-N 3.34Å; Q238-C242 VanDerWaalsContact O-CB 3.25Å; Q238-C242 WeakPolarHBondContact O-CB 3.35Å; Q238-C242 PolarHBondContact O-N 3Å
239S65.9Low76.3Confident63 Ų6384.2 Ų84.244%0.44141%0.413SS..Hα-helixtrans-57.9-45.6-166-165.30000114.6C242 E243S239-C242 PolarHBondContact O-N 3.35Å; S239-E243 WeakPolarHBondContact O-CB 3.46Å; S239-E243 PolarHBondContact O-N 2.84Å
240E69.5Low76.4Confident163 Ų16383.6 Ų83.676%0.76241%0.408SS*.Hα-helixtrans-73.8-41.5-172-170.1174-169.400112.8Q238 C242 E243 Q244Q238-E240 PolarHBondContact O-N 3.34Å; E240-C242 VanDerWaalsContact C-N 3.32Å; E240-C242 PolarHBondContact O-N 3.35Å; E240-E243 PolarHBondContact O-N 3.38Å; E240-Q244 PolarHBondContact O-N 3.32Å
241I71.2Confident76.8Confident123 Ų12377 Ų7763%0.63138%0.384SS*.Hα-helixtrans-63.8-42173.5-62.3173.2000109.7Q244 L245I241-Q244 PolarHBondContact O-N 2.73Å; I241-L245 HydrophobicContact CG2-CD1 4.03Å; I241-L245 WeakPolarHBondContact O-CB 3.39Å; I241-L245 VanDerWaalsContact O-CG 3.24Å; I241-L245 WeakPolarHBondContact O-CG 3.29Å; I241-L245 PolarHBondContact O-N 2.85Å
242C77.4Confident77.1Confident22 Ų2274 Ų7415%0.14937%0.37CS..Hα-helixtrans-61.7-45.6176.5-170.30000111.5Q238 S239 E240 Q244 L245 V246Q238-C242 VanDerWaalsContact O-CB 3.25Å; Q238-C242 WeakPolarHBondContact O-CB 3.35Å; Q238-C242 PolarHBondContact O-N 3Å; S239-C242 PolarHBondContact O-N 3.35Å; E240-C242 VanDerWaalsContact C-N 3.32Å; E240-C242 PolarHBondContact O-N 3.35Å; C242-Q244 PolarHBondContact O-N 3.4Å; C242-L245 PolarHBondContact O-N 2.98Å; C242-V246 VanDerWaalsContact O-CG2 3.3Å; C242-V246 WeakPolarHBondContact O-CG2 3.22Å; C242-V246 PolarHBondContact O-N 2.88Å
243E83.8Confident77.5Confident73 Ų7373.4 Ų73.434%0.34137%0.367SS..Hα-helixtrans-63-41.8179-169-173.4149.200111.9S239 E240 V246 R247S239-E243 WeakPolarHBondContact O-CB 3.46Å; S239-E243 PolarHBondContact O-N 2.84Å; E240-E243 PolarHBondContact O-N 3.38Å; E243-V246 PolarHBondContact O-N 3.33Å; E243-R247 VanDerWaalsContact O-CB 3.28Å; E243-R247 WeakPolarHBondContact O-CB 3.02Å; E243-R247 PolarHBondContact O-N 3Å; E243-R247 IonicContact OE1-CZ 3.22Å; E243-R247 IonicContact OE1-NH1 2.75Å; E243-R247 IonicContact OE1-NH2 2.7Å; E243-R247 PolarHBondContact OE1-NH2 2.96Å
244Q85.8Confident78.5Confident82 Ų8271.8 Ų71.838%0.38336%0.355SS..Hα-helixtrans-66-39.3176.2-171.15937.200112E240 I241 C242 R247 N248E240-Q244 PolarHBondContact O-N 3.32Å; I241-Q244 PolarHBondContact O-N 2.73Å; C242-Q244 PolarHBondContact O-N 3.4Å; Q244-R247 PolarHBondContact O-N 2.77Å; Q244-N248 PolarHBondContact NE2-OD1 3.28Å; Q244-N248 WeakPolarHBondContact O-CB 3.42Å; Q244-N248 VanDerWaalsContact O-CG 3.25Å; Q244-N248 PolarHBondContact O-N 3.37Å; Q244-N248 PolarHBondContact O-OD1 3.47Å
245L84.5Confident80.2Confident54 Ų5466.7 Ų66.728%0.28333%0.327SS..Hα-helixtrans-64-43.7174.1-71.7169.7000111.6A177 I183 I241 C242 N248 T249A177-L245 HydrophobicContact CB-CD2 4.25Å; I183-L245 HydrophobicContact CD1-CB 4.09Å; I241-L245 HydrophobicContact CG2-CD1 4.03Å; I241-L245 WeakPolarHBondContact O-CB 3.39Å; I241-L245 VanDerWaalsContact O-CG 3.24Å; I241-L245 WeakPolarHBondContact O-CG 3.29Å; I241-L245 PolarHBondContact O-N 2.85Å; C242-L245 PolarHBondContact O-N 2.98Å; L245-N248 PolarHBondContact O-N 3.21Å; L245-T249 WeakPolarHBondContact O-CB 3.22Å; L245-T249 PolarHBondContact O-N 2.98Å; L245-T249 PolarHBondContact O-OG1 3.4Å
246V88.6Confident81.9Confident0 Ų065.1 Ų65.10%032%0.315CS..Hα-helixtrans-59.8-48174.21710000110I183 V225 V228 I232 C242 E243 N248 T249 F250I183-V246 HydrophobicContact CD1-CG2 4.31Å; I183-V246 HydrophobicContact CG1-CG2 4.22Å; I183-V246 HydrophobicContact CG2-CG2 3.97Å; V225-V246 HydrophobicContact CG1-CG1 4.39Å; V228-V246 HydrophobicContact CB-CG1 3.97Å; V228-V246 HydrophobicContact CG1-CG1 3.72Å; V228-V246 HydrophobicContact CG1-CG2 4.34Å; I232-V246 HydrophobicContact CD1-CG2 4.05Å; C242-V246 VanDerWaalsContact O-CG2 3.3Å; C242-V246 WeakPolarHBondContact O-CG2 3.22Å; C242-V246 PolarHBondContact O-N 2.88Å; E243-V246 PolarHBondContact O-N 3.33Å; V246-N248 PolarHBondContact O-N 3.07Å; V246-T249 PolarHBondContact O-N 3.43Å; V246-F250 WeakPolarHBondContact O-CB 3.36Å; V246-F250 PolarHBondContact O-N 3.36Å
247R91.3Very high83.8Confident69 Ų6958.9 Ų58.926%0.2628%0.283SS..Hα-helixtrans-59.1-46.8179.6-178.6-178.2-69112.96.5112.3F221 V225 E243 Q244 F250 A251 A283F221-R247 HydrophobicContact CE1-CG 4.39Å; F221-R247 HydrophobicContact CZ-CG 4.18Å; V225-R247 HydrophobicContact CG1-CB 4.25Å; E243-R247 VanDerWaalsContact O-CB 3.28Å; E243-R247 WeakPolarHBondContact O-CB 3.02Å; E243-R247 PolarHBondContact O-N 3Å; E243-R247 IonicContact OE1-CZ 3.22Å; E243-R247 IonicContact OE1-NH1 2.75Å; E243-R247 IonicContact OE1-NH2 2.7Å; E243-R247 PolarHBondContact OE1-NH2 2.96Å; Q244-R247 PolarHBondContact O-N 2.77Å; R247-F250 PolarHBondContact O-N 2.82Å; R247-A251 WeakPolarHBondContact O-CB 3.32Å; R247-A251 PolarHBondContact O-N 3.17Å; R247-A283 HydrophobicContact CG-CB 4.11Å
248N90.1Very high85.7Confident19 Ų1951.2 Ų51.210%0.10225%0.25CC..Hα-helixtrans-64.2-47177.9-69.9-5.5000111.2Q244 L245 V246 F250 A251 H252Q244-N248 PolarHBondContact NE2-OD1 3.28Å; Q244-N248 WeakPolarHBondContact O-CB 3.42Å; Q244-N248 VanDerWaalsContact O-CG 3.25Å; Q244-N248 PolarHBondContact O-N 3.37Å; Q244-N248 PolarHBondContact O-OD1 3.47Å; L245-N248 PolarHBondContact O-N 3.21Å; V246-N248 PolarHBondContact O-N 3.07Å; N248-F250 VanDerWaalsContact C-N 3.33Å; N248-F250 PolarHBondContact O-N 3.29Å; N248-A251 PolarHBondContact O-N 3.39Å; N248-H252 PolarHBondContact O-N 3.47Å
249T90Very high87.4Confident0 Ų044.1 Ų44.10%022%0.217CC..Hα-helixtrans-61.2-42.9178-51.10000111.4A177 I183 V187 L245 V246 H252 I253A177-T249 VanDerWaalsContact CB-OG1 3.29Å; A177-T249 WeakPolarHBondContact CB-OG1 3.48Å; I183-T249 HydrophobicContact CG2-CG2 4Å; V187-T249 HydrophobicContact CB-CG2 4.45Å; V187-T249 HydrophobicContact CG2-CG2 4.15Å; L245-T249 WeakPolarHBondContact O-CB 3.22Å; L245-T249 PolarHBondContact O-N 2.98Å; L245-T249 PolarHBondContact O-OG1 3.4Å; V246-T249 PolarHBondContact O-N 3.43Å; T249-H252 PolarHBondContact O-N 3.25Å; T249-I253 HydrophobicContact CG2-CD1 3.79Å; T249-I253 WeakPolarHBondContact O-CG1 3.47Å; T249-I253 PolarHBondContact O-N 2.96Å
250F93.4Very high88.7Confident0 Ų042.5 Ų42.50%021%0.205CC..Hα-helixtrans-64-46177.5-158.8-70.7000111.4V187 F190 V191 F221 V225 V228 V246 R247 N248 H252 Y254V187-F250 HydrophobicContact CB-CD2 4.48Å; V187-F250 HydrophobicContact CG1-CB 4.2Å; V187-F250 HydrophobicContact CG1-CD2 3.84Å; V187-F250 HydrophobicContact CG1-CE2 4.45Å; V187-F250 HydrophobicContact CG1-CG 4.13Å; V187-F250 HydrophobicContact CG2-CB 4.39Å; V187-F250 HydrophobicContact CG2-CD2 4.12Å; F190-F250 AromaticContact CD1-CE2 3.47Å; F190-F250 HydrophobicContact CD1-CE2 3.47Å; F190-F250 VanDerWaalsContact CD1-CE2 3.47Å; F190-F250 AromaticContact CD1-CZ 3.54Å; F190-F250 HydrophobicContact CD1-CZ 3.54Å; F190-F250 AromaticContact CE1-CE2 3.96Å; F190-F250 HydrophobicContact CE1-CE2 3.96Å; F190-F250 AromaticContact CE1-CZ 3.7Å; F190-F250 HydrophobicContact CE1-CZ 3.7Å; F190-F250 HydrophobicContact CG-CE2 4.15Å; V191-F250 HydrophobicContact CG2-CE1 4.49Å; V191-F250 HydrophobicContact CG2-CE2 4.45Å; V191-F250 HydrophobicContact CG2-CZ 4.14Å; F221-F250 AromaticContact CD2-CD1 3.65Å; F221-F250 HydrophobicContact CD2-CD1 3.65Å; F221-F250 HydrophobicContact CD2-CE1 4.01Å; F221-F250 HydrophobicContact CE2-CB 4.47Å; F221-F250 AromaticContact CE2-CD1 3.71Å; F221-F250 HydrophobicContact CE2-CD1 3.71Å; F221-F250 HydrophobicContact CE2-CG 4.49Å; V225-F250 HydrophobicContact CG2-CB 3.9Å; V225-F250 HydrophobicContact CG2-CD1 4.28Å; V225-F250 HydrophobicContact CG2-CD2 4.31Å; V225-F250 HydrophobicContact CG2-CG 3.91Å; V228-F250 HydrophobicContact CG2-CD2 4.44Å; V228-F250 HydrophobicContact CG2-CE2 4.38Å; V246-F250 WeakPolarHBondContact O-CB 3.36Å; V246-F250 PolarHBondContact O-N 3.36Å; R247-F250 PolarHBondContact O-N 2.82Å; N248-F250 VanDerWaalsContact C-N 3.33Å; N248-F250 PolarHBondContact O-N 3.29Å; F250-H252 VanDerWaalsContact C-N 3.31Å; F250-H252 PolarHBondContact O-N 3.48Å; F250-Y254 AromaticContact CE1-CD2 3.97Å; F250-Y254 HydrophobicContact CE1-CD2 3.97Å; F250-Y254 HydrophobicContact CE1-CG 4.09Å; F250-Y254 WeakPolarHBondContact O-CB 3.39Å; F250-Y254 PolarHBondContact O-N 3.34Å
251A94.4Very high89.6Confident1 Ų143.5 Ų43.51%0.00820%0.202CC..Hα-helixtrans-57.2-46.8176.800000111.6F221 R247 N248 F255 A283 L284 E287F221-A251 HydrophobicContact CE2-CB 3.92Å; F221-A251 HydrophobicContact CZ-CB 4.12Å; R247-A251 WeakPolarHBondContact O-CB 3.32Å; R247-A251 PolarHBondContact O-N 3.17Å; N248-A251 PolarHBondContact O-N 3.39Å; A251-F255 WeakPolarHBondContact O-CB 3.35Å; A251-F255 PolarHBondContact O-N 3.28Å; A251-A283 HydrophobicContact CB-CB 3.84Å; A251-L284 HydrophobicContact CB-CD2 4.1Å; A251-L284 WeakPolarHBondContact O-CD2 3.38Å; A251-E287 HydrophobicContact CB-CG 3.94Å
252H93.3Very high90.4Very high36 Ų3641 Ų4117%0.16719%0.188CC..Hα-helixtrans-63.2-55.2-179.6-175.377.1000112.6V174 F178 N248 T249 F250 Y254 F255 E256 E287V174-H252 HydrophobicContact CG1-CB 3.52Å; V174-H252 HydrophobicContact CG2-CB 4.34Å; F178-H252 AromaticContact CE2-CD2 3.67Å; F178-H252 AromaticContact CE2-NE2 3.78Å; F178-H252 AromaticContact CZ-CD2 3.42Å; F178-H252 VanDerWaalsContact CZ-CD2 3.42Å; F178-H252 WeakPolarHBondContact CZ-CD2 3.44Å; F178-H252 AromaticContact CZ-NE2 3.77Å; N248-H252 PolarHBondContact O-N 3.47Å; T249-H252 PolarHBondContact O-N 3.25Å; F250-H252 VanDerWaalsContact C-N 3.31Å; F250-H252 PolarHBondContact O-N 3.48Å; H252-Y254 PolarHBondContact O-N 3.37Å; H252-F255 PolarHBondContact O-N 2.86Å; H252-E256 WeakPolarHBondContact O-CB 3.42Å; H252-E256 PolarHBondContact O-N 3.06Å; H252-E287 HydrophobicContact CB-CG 4.46Å; H252-E287 IonicContact CE1-OE2 3.95Å; H252-E287 IonicContact CG-OE2 2.68Å; H252-E287 IonicContact ND1-OE2 3.71Å; H252-E287 PolarHBondContact ND1-OE2 2.83Å
253I93.2Very high91Very high4 Ų441.5 Ų41.52%0.02119%0.188CC..Hα-helixtrans-63.5-42.7-177.9-68171.3000111F178 E184 V187 N188 V191 T249 E256 R257F178-I253 HydrophobicContact CE1-CD1 4.49Å; E184-I253 HydrophobicContact CG-CD1 4.19Å; V187-I253 HydrophobicContact CB-CD1 3.97Å; V187-I253 HydrophobicContact CG1-CB 3.91Å; V187-I253 HydrophobicContact CG1-CD1 3.61Å; V187-I253 HydrophobicContact CG1-CG1 4.3Å; V187-I253 HydrophobicContact CG1-CG2 4.12Å; N188-I253 WeakPolarHBondContact ND2-CD1 3.47Å; V191-I253 HydrophobicContact CG2-CG2 4.24Å; T249-I253 HydrophobicContact CG2-CD1 3.79Å; T249-I253 WeakPolarHBondContact O-CG1 3.47Å; T249-I253 PolarHBondContact O-N 2.96Å; I253-E256 PolarHBondContact O-N 2.82Å; I253-R257 HydrophobicContact CG2-CG 4.27Å; I253-R257 VanDerWaalsContact O-CB 3.3Å; I253-R257 WeakPolarHBondContact O-CB 3.46Å; I253-R257 VanDerWaalsContact O-CG 3.31Å; I253-R257 WeakPolarHBondContact O-CG 3.36Å; I253-R257 PolarHBondContact O-N 2.86Å
254Y95.6Very high91.2Very high6 Ų642.6 Ų42.62%0.02420%0.2CC..Hα-helixtrans-65.8-43.1179.1-170.1-98.4000111.3V191 H217 I220 F250 H252 V258 L259 L284V191-Y254 HydrophobicContact CG2-CD2 4.25Å; H217-Y254 HydrophobicContact CB-CE1 4.39Å; H217-Y254 AromaticContact ND1-CE1 3.89Å; H217-Y254 AromaticContact ND1-CZ 3.83Å; H217-Y254 PolarHBondContact ND1-OH 2.91Å; I220-Y254 HydrophobicContact CG2-CD2 4.45Å; I220-Y254 HydrophobicContact CG2-CE2 3.6Å; F250-Y254 AromaticContact CE1-CD2 3.97Å; F250-Y254 HydrophobicContact CE1-CD2 3.97Å; F250-Y254 HydrophobicContact CE1-CG 4.09Å; F250-Y254 WeakPolarHBondContact O-CB 3.39Å; F250-Y254 PolarHBondContact O-N 3.34Å; H252-Y254 PolarHBondContact O-N 3.37Å; Y254-V258 HydrophobicContact CD2-CB 4.45Å; Y254-V258 HydrophobicContact CD2-CG2 3.87Å; Y254-V258 HydrophobicContact CE1-CB 4.38Å; Y254-V258 HydrophobicContact CE1-CG1 4.43Å; Y254-V258 HydrophobicContact CE2-CB 4.25Å; Y254-V258 HydrophobicContact CE2-CG1 4.4Å; Y254-V258 HydrophobicContact CE2-CG2 3.77Å; Y254-V258 HydrophobicContact CG-CG2 4.4Å; Y254-V258 WeakPolarHBondContact O-CA 3.16Å; Y254-V258 WeakPolarHBondContact O-CB 3.2Å; Y254-V258 PolarHBondContact O-N 2.79Å; Y254-L259 HydrophobicContact CD1-CD1 4.2Å; Y254-L259 HydrophobicContact CD1-CG 4.29Å; Y254-L259 HydrophobicContact CE1-CD1 4.26Å; Y254-L259 HydrophobicContact CE1-CD2 4.38Å; Y254-L259 HydrophobicContact CE1-CG 4.16Å; Y254-L259 PolarHBondContact O-N 3.19Å; Y254-L284 HydrophobicContact CD1-CD1 4.18Å; Y254-L284 HydrophobicContact CD1-CD2 3.99Å; Y254-L284 HydrophobicContact CE1-CD1 4.49Å
255F95.5Very high91.3Very high9 Ų946.3 Ų46.34%0.03921%0.212CC..Iπ-helixtrans-59.8-53.2174.4174-96.1000111A251 H252 R257 L259 S260 I263 L272 L284 E287 V288 F291A251-F255 WeakPolarHBondContact O-CB 3.35Å; A251-F255 PolarHBondContact O-N 3.28Å; H252-F255 PolarHBondContact O-N 2.86Å; F255-R257 PolarHBondContact O-N 2.51Å; F255-L259 HydrophobicContact CD2-CB 3.85Å; F255-L259 HydrophobicContact CD2-CD1 4.29Å; F255-L259 HydrophobicContact CE2-CB 4.29Å; F255-L259 PolarHBondContact O-N 2.99Å; F255-S260 WeakPolarHBondContact O-CB 3.32Å; F255-S260 PolarHBondContact O-N 2.74Å; F255-I263 HydrophobicContact CE2-CD1 4.03Å; F255-I263 HydrophobicContact CZ-CD1 3.93Å; F255-L272 HydrophobicContact CE2-CD2 4.08Å; F255-L284 HydrophobicContact CB-CD2 4.19Å; F255-E287 HydrophobicContact CB-CB 3.88Å; F255-E287 HydrophobicContact CD1-CB 4.17Å; F255-E287 HydrophobicContact CD2-CB 4.45Å; F255-E287 HydrophobicContact CG-CB 3.89Å; F255-V288 HydrophobicContact CD2-CG2 3.85Å; F255-V288 HydrophobicContact CE2-CB 4.29Å; F255-V288 HydrophobicContact CE2-CG2 3.5Å; F255-V288 VanDerWaalsContact CE2-CG2 3.5Å; F255-V288 HydrophobicContact CZ-CG2 4.43Å; F255-F291 HydrophobicContact CE1-CB 3.58Å; F255-F291 HydrophobicContact CE1-CD2 4.08Å; F255-F291 AromaticContact CE1-CG 3.92Å; F255-F291 HydrophobicContact CE1-CG 3.92Å; F255-F291 HydrophobicContact CZ-CB 3.59Å; F255-F291 HydrophobicContact CZ-CD1 4.19Å; F255-F291 HydrophobicContact CZ-CD2 4.21Å; F255-F291 AromaticContact CZ-CG 3.74Å; F255-F291 HydrophobicContact CZ-CG 3.74Å
256E92.8Very high91.5Very high109 Ų10945.6 Ų45.651%0.50921%0.206SC..Iπ-helixtrans-60.3-45.6-176.9-168.5-168.6173.800111.9H252 I253 S260H252-E256 WeakPolarHBondContact O-CB 3.42Å; H252-E256 PolarHBondContact O-N 3.06Å; I253-E256 PolarHBondContact O-N 2.82Å; E256-S260 PolarHBondContact O-OG 3.41Å
257R92.8Very high91.6Very high61 Ų6151 Ų5123%0.2324%0.235CC..Iπ-helixtrans-84.9-27.4-172.2-62.3-172.667.3-176.5-4.9114.2N188 V191 D192 I253 F255 R261N188-R257 PolarHBondContact OD1-NH1 3.24Å; V191-R257 HydrophobicContact CG1-CB 4.49Å; D192-R257 VanDerWaalsContact CG-NH1 3.3Å; D192-R257 IonicContact OD1-CZ 2.86Å; D192-R257 IonicContact OD1-NH1 3.89Å; D192-R257 PolarHBondContact OD1-NH1 2.85Å; D192-R257 IonicContact OD1-NH2 3.75Å; D192-R257 PolarHBondContact OD1-NH2 3.14Å; D192-R257 IonicContact OD2-CZ 3.07Å; D192-R257 IonicContact OD2-NH1 3.22Å; D192-R257 PolarHBondContact OD2-NH1 3.35Å; D192-R257 IonicContact OD2-NH2 2.62Å; I253-R257 HydrophobicContact CG2-CG 4.27Å; I253-R257 VanDerWaalsContact O-CB 3.3Å; I253-R257 WeakPolarHBondContact O-CB 3.46Å; I253-R257 VanDerWaalsContact O-CG 3.31Å; I253-R257 WeakPolarHBondContact O-CG 3.36Å; I253-R257 PolarHBondContact O-N 2.86Å; F255-R257 PolarHBondContact O-N 2.51Å; R257-R261 WeakPolarHBondContact O-CD 3.06Å; R257-R261 PolarHBondContact O-NE 3.04Å
258V93.1Very high91.6Very high33 Ų3350.4 Ų50.420%0.224%0.237CC..Iπ-helixtrans-112.5-62.9-173.9-172.80000110.8V191 I195 Y254V191-V258 HydrophobicContact CG1-CG2 4.35Å; I195-V258 HydrophobicContact CD1-CG2 4.22Å; Y254-V258 HydrophobicContact CD2-CB 4.45Å; Y254-V258 HydrophobicContact CD2-CG2 3.87Å; Y254-V258 HydrophobicContact CE1-CB 4.38Å; Y254-V258 HydrophobicContact CE1-CG1 4.43Å; Y254-V258 HydrophobicContact CE2-CB 4.25Å; Y254-V258 HydrophobicContact CE2-CG1 4.4Å; Y254-V258 HydrophobicContact CE2-CG2 3.77Å; Y254-V258 HydrophobicContact CG-CG2 4.4Å; Y254-V258 WeakPolarHBondContact O-CA 3.16Å; Y254-V258 WeakPolarHBondContact O-CB 3.2Å; Y254-V258 PolarHBondContact O-N 2.79Å
259L94.2Very high91.8Very high0 Ų049.7 Ų49.70%023%0.233CC..Iπ-helixtrans-79.6-36.7-167.1-59.7176.9000114.1Y254 F255 R261 E262 L272 L276 L284Y254-L259 HydrophobicContact CD1-CD1 4.2Å; Y254-L259 HydrophobicContact CD1-CG 4.29Å; Y254-L259 HydrophobicContact CE1-CD1 4.26Å; Y254-L259 HydrophobicContact CE1-CD2 4.38Å; Y254-L259 HydrophobicContact CE1-CG 4.16Å; Y254-L259 PolarHBondContact O-N 3.19Å; F255-L259 HydrophobicContact CD2-CB 3.85Å; F255-L259 HydrophobicContact CD2-CD1 4.29Å; F255-L259 HydrophobicContact CE2-CB 4.29Å; F255-L259 PolarHBondContact O-N 2.99Å; L259-R261 PolarHBondContact O-N 3.46Å; L259-R261 VanDerWaalsContact O-N 3.15Å; L259-E262 WeakPolarHBondContact O-CB 3.41Å; L259-E262 PolarHBondContact O-N 2.72Å; L259-L272 HydrophobicContact CB-CD1 4.42Å; L259-L272 HydrophobicContact CB-CD2 4.46Å; L259-L272 HydrophobicContact CD1-CD1 4.36Å; L259-L272 HydrophobicContact CD2-CD1 4.3Å; L259-L276 HydrophobicContact CD1-CD2 4.36Å; L259-L284 HydrophobicContact CD1-CD1 4.09Å; L259-L284 HydrophobicContact CD1-CD2 4.05Å; L259-L284 HydrophobicContact CD1-CG 4.47Å
260S92.4Very high91.9Very high28 Ų2850.2 Ų50.220%0.19624%0.237CC..G310 helixtrans-61.4-28.8-174.478.60000112.5F255 E256 E262 I263F255-S260 WeakPolarHBondContact O-CB 3.32Å; F255-S260 PolarHBondContact O-N 2.74Å; E256-S260 PolarHBondContact O-OG 3.41Å; S260-E262 PolarHBondContact O-N 2.55Å; S260-I263 PolarHBondContact O-N 3.1Å
261R89.2Confident91.9Very high184 Ų18453.6 Ų53.669%0.69426%0.257SS*.G310 helixtrans-69-19.6179.3-61.2179.2178.3-175.60.4113R257 L259 I263R257-R261 WeakPolarHBondContact O-CD 3.06Å; R257-R261 PolarHBondContact O-NE 3.04Å; L259-R261 PolarHBondContact O-N 3.46Å; L259-R261 VanDerWaalsContact O-N 3.15Å; R261-I263 VanDerWaalsContact C-N 3.33Å
262E86.7Confident91.9Very high72 Ų7253.7 Ų53.734%0.33626%0.258SS..G310 helixtrans-82.1-13.5177-59.5-173.2-16800112.3K213 L259 S260 T264 D268K213-E262 IonicContact NZ-OE2 2.92Å; K213-E262 PolarHBondContact NZ-OE2 3.46Å; L259-E262 WeakPolarHBondContact O-CB 3.41Å; L259-E262 PolarHBondContact O-N 2.72Å; S260-E262 PolarHBondContact O-N 2.55Å; E262-T264 PolarHBondContact O-N 3.24Å; E262-D268 WeakPolarHBondContact O-CB 3.43Å
263I90.9Very high92Very high31 Ų3152 Ų5216%0.15925%0.25CC..  trans-91.399.2-175-48.7173.2000109.6F255 S260 R261 F269 L272 F291F255-I263 HydrophobicContact CE2-CD1 4.03Å; F255-I263 HydrophobicContact CZ-CD1 3.93Å; S260-I263 PolarHBondContact O-N 3.1Å; R261-I263 VanDerWaalsContact C-N 3.33Å; I263-F269 HydrophobicContact CG2-CB 4.08Å; I263-L272 HydrophobicContact CD1-CD2 3.48Å; I263-L272 VanDerWaalsContact CD1-CD2 3.48Å; I263-L272 HydrophobicContact CG1-CD2 3.69Å; I263-F291 HydrophobicContact CD1-CD1 4.03Å; I263-F291 HydrophobicContact CD1-CE1 3.88Å; I263-F291 HydrophobicContact CG2-CE1 4.15Å
264T87.8Confident92Very high97 Ų9753 Ų5360%0.59526%0.255SS*.SBendtrans-109-39.8173.9-51.90000111.5E262 D268E262-T264 PolarHBondContact O-N 3.24Å; T264-D268 WeakPolarHBondContact CA-OD2 3.37Å; T264-D268 WeakPolarHBondContact CB-OD2 3.44Å; T264-D268 PolarHBondContact N-OD2 2.93Å
265Y88.4Confident91.9Very high160 Ų16053.1 Ų53.163%0.62726%0.257SS*.SBendtrans-123.5169.8-176.9-54.4-74.7000111.6D267 D268 F269Y265-D267 VanDerWaalsContact C-N 3.27Å; Y265-D267 PolarHBondContact O-N 3.23Å; Y265-D268 PolarHBondContact N-OD2 3.48Å; Y265-D268 WeakPolarHBondContact O-CB 3.28Å; Y265-D268 PolarHBondContact O-N 2.68Å; Y265-F269 PolarHBondContact O-N 3.43Å
266F88.6Confident91.8Very high38 Ų3852.7 Ų52.717%0.16726%0.255CS..Hα-helixtrans-58.4-38.9177.2177.9-101.3000112.6D268 F269 V270 F305 K308 L309 V312 I357F266-D268 VanDerWaalsContact C-N 3.29Å; F266-D268 PolarHBondContact O-N 2.76Å; F266-F269 HydrophobicContact CE2-CD1 4.49Å; F266-F269 WeakPolarHBondContact O-CB 3.47Å; F266-F269 PolarHBondContact O-N 2.89Å; F266-F269 VanDerWaalsContact O-N 3.16Å; F266-V270 HydrophobicContact CD1-CG2 4.04Å; F266-V270 HydrophobicContact CE1-CG2 3.61Å; F266-V270 HydrophobicContact CE2-CG2 4.31Å; F266-V270 HydrophobicContact CZ-CG2 3.77Å; F266-V270 WeakPolarHBondContact O-CG2 3.44Å; F266-V270 PolarHBondContact O-N 3.38Å; F266-F305 HydrophobicContact CB-CE2 4.46Å; F266-F305 HydrophobicContact CD2-CD2 4.32Å; F266-F305 AromaticContact CD2-CE2 3.69Å; F266-F305 HydrophobicContact CD2-CE2 3.69Å; F266-F305 HydrophobicContact CE2-CE2 4.43Å; F266-F305 HydrophobicContact CG-CE2 4.46Å; F266-K308 HydrophobicContact CE1-CB 4.24Å; F266-K308 HydrophobicContact CE1-CD 4.4Å; F266-K308 HydrophobicContact CE2-CB 3.93Å; F266-K308 HydrophobicContact CZ-CB 3.61Å; F266-L309 HydrophobicContact CD2-CD2 4.48Å; F266-L309 HydrophobicContact CE2-CD2 3.99Å; F266-L309 HydrophobicContact CE2-CG 4.43Å; F266-V312 HydrophobicContact CE1-CG2 4.42Å; F266-V312 HydrophobicContact CE2-CG2 4.26Å; F266-V312 HydrophobicContact CZ-CG2 3.58Å; F266-I357 HydrophobicContact CE1-CD1 4.5Å; F266-I357 HydrophobicContact CE1-CG1 4.34Å; F266-I357 HydrophobicContact CZ-CD1 4.43Å
267D90Very high91.8Very high114 Ų11449.6 Ų49.661%0.6124%0.244SC*.Hα-helixtrans-67.3-31.2179.7-64.3-19.7000112.4Y265 V270 T271Y265-D267 VanDerWaalsContact C-N 3.27Å; Y265-D267 PolarHBondContact O-N 3.23Å; D267-V270 PolarHBondContact O-N 2.94Å; D267-T271 VanDerWaalsContact O-CB 3.29Å; D267-T271 WeakPolarHBondContact O-CB 3.36Å; D267-T271 PolarHBondContact O-N 3.34Å; D267-T271 PolarHBondContact O-OG1 3.46Å
268D92.3Very high91.8Very high56 Ų5653.8 Ų53.830%0.29926%0.264SS..Hα-helixtrans-65.2-42.8173.2-57-35.6000110.3E262 T264 Y265 F266 T271 L272E262-D268 WeakPolarHBondContact O-CB 3.43Å; T264-D268 WeakPolarHBondContact CA-OD2 3.37Å; T264-D268 WeakPolarHBondContact CB-OD2 3.44Å; T264-D268 PolarHBondContact N-OD2 2.93Å; Y265-D268 PolarHBondContact N-OD2 3.48Å; Y265-D268 WeakPolarHBondContact O-CB 3.28Å; Y265-D268 PolarHBondContact O-N 2.68Å; F266-D268 VanDerWaalsContact C-N 3.29Å; F266-D268 PolarHBondContact O-N 2.76Å; D268-T271 PolarHBondContact O-N 2.93Å; D268-L272 VanDerWaalsContact O-CB 3.3Å; D268-L272 WeakPolarHBondContact O-CB 3.26Å; D268-L272 PolarHBondContact O-N 3.13Å
269F93.2Very high91.8Very high4 Ų452.7 Ų52.72%0.01826%0.258CS..Hα-helixtrans-61.1-47.9174.7167.1-99000111.7I263 Y265 F266 T271 L272 V273 V288 I292 L309 V312 L318 L321I263-F269 HydrophobicContact CG2-CB 4.08Å; Y265-F269 PolarHBondContact O-N 3.43Å; F266-F269 HydrophobicContact CE2-CD1 4.49Å; F266-F269 WeakPolarHBondContact O-CB 3.47Å; F266-F269 PolarHBondContact O-N 2.89Å; F266-F269 VanDerWaalsContact O-N 3.16Å; F269-T271 PolarHBondContact O-N 3.29Å; F269-L272 PolarHBondContact O-N 3.41Å; F269-V273 HydrophobicContact CD2-CG2 4.16Å; F269-V273 HydrophobicContact CE1-CG2 4.23Å; F269-V273 HydrophobicContact CE2-CG2 3.78Å; F269-V273 HydrophobicContact CZ-CG2 3.8Å; F269-V273 WeakPolarHBondContact O-CG2 3.36Å; F269-V273 PolarHBondContact O-N 3.4Å; F269-V288 HydrophobicContact CD2-CG1 3.79Å; F269-V288 HydrophobicContact CE2-CG1 3.43Å; F269-V288 VanDerWaalsContact CE2-CG1 3.43Å; F269-V288 HydrophobicContact CZ-CG1 4.44Å; F269-I292 HydrophobicContact CE2-CB 3.81Å; F269-I292 HydrophobicContact CE2-CG1 4.12Å; F269-I292 HydrophobicContact CE2-CG2 3.78Å; F269-I292 HydrophobicContact CZ-CB 4.24Å; F269-I292 HydrophobicContact CZ-CG1 4.21Å; F269-I292 HydrophobicContact CZ-CG2 3.92Å; F269-L309 HydrophobicContact CD1-CD2 4.33Å; F269-L309 HydrophobicContact CE1-CD2 3.77Å; F269-L309 HydrophobicContact CZ-CD2 4.27Å; F269-V312 HydrophobicContact CD1-CG1 4.48Å; F269-V312 HydrophobicContact CE1-CG1 3.76Å; F269-L318 HydrophobicContact CZ-CD1 4.09Å; F269-L321 HydrophobicContact CZ-CD2 4.29Å
270V92.6Very high91.7Very high12 Ų1259.9 Ų59.97%0.07329%0.292CS..Hα-helixtrans-60.8-46.1177.8175.30000110.8F266 D267 L272 V273 E274 V312 Y316F266-V270 HydrophobicContact CD1-CG2 4.04Å; F266-V270 HydrophobicContact CE1-CG2 3.61Å; F266-V270 HydrophobicContact CE2-CG2 4.31Å; F266-V270 HydrophobicContact CZ-CG2 3.77Å; F266-V270 WeakPolarHBondContact O-CG2 3.44Å; F266-V270 PolarHBondContact O-N 3.38Å; D267-V270 PolarHBondContact O-N 2.94Å; V270-L272 VanDerWaalsContact C-N 3.31Å; V270-L272 PolarHBondContact O-N 3.42Å; V270-V273 PolarHBondContact O-N 2.85Å; V270-E274 VanDerWaalsContact O-CB 3.24Å; V270-E274 WeakPolarHBondContact O-CB 3.49Å; V270-E274 PolarHBondContact O-N 2.85Å; V270-V312 HydrophobicContact CG2-CG1 4.36Å; V270-V312 HydrophobicContact CG2-CG2 3.82Å; V270-Y316 HydrophobicContact CG1-CE2 4.41Å
271T92.8Very high91.8Very high70 Ų7058.9 Ų58.943%0.42928%0.284SS..Hα-helixtrans-59.7-42.1177.9-59.70000111.5F214 D267 D268 F269 G275F214-T271 HydrophobicContact CE2-CG2 4.45Å; F214-T271 HydrophobicContact CZ-CG2 4.41Å; F214-T271 WeakPolarHBondContact CZ-O 3.34Å; D267-T271 VanDerWaalsContact O-CB 3.29Å; D267-T271 WeakPolarHBondContact O-CB 3.36Å; D267-T271 PolarHBondContact O-N 3.34Å; D267-T271 PolarHBondContact O-OG1 3.46Å; D268-T271 PolarHBondContact O-N 2.93Å; F269-T271 PolarHBondContact O-N 3.29Å; T271-G275 PolarHBondContact O-N 2.76Å
272L94.8Very high91.9Very high4 Ų454 Ų542%0.02128%0.276CS..Hα-helixtrans-65.3-49.9177.7179.859000112.1F214 F255 L259 I263 D268 F269 V270 E274 G275 L276 V288F214-L272 HydrophobicContact CE1-CD1 3.84Å; F255-L272 HydrophobicContact CE2-CD2 4.08Å; L259-L272 HydrophobicContact CB-CD1 4.42Å; L259-L272 HydrophobicContact CB-CD2 4.46Å; L259-L272 HydrophobicContact CD1-CD1 4.36Å; L259-L272 HydrophobicContact CD2-CD1 4.3Å; I263-L272 HydrophobicContact CD1-CD2 3.48Å; I263-L272 VanDerWaalsContact CD1-CD2 3.48Å; I263-L272 HydrophobicContact CG1-CD2 3.69Å; D268-L272 VanDerWaalsContact O-CB 3.3Å; D268-L272 WeakPolarHBondContact O-CB 3.26Å; D268-L272 PolarHBondContact O-N 3.13Å; F269-L272 PolarHBondContact O-N 3.41Å; V270-L272 VanDerWaalsContact C-N 3.31Å; V270-L272 PolarHBondContact O-N 3.42Å; L272-E274 VanDerWaalsContact C-N 3.31Å; L272-E274 PolarHBondContact O-N 2.9Å; L272-G275 PolarHBondContact O-N 3.11Å; L272-L276 HydrophobicContact CD1-CD1 3.86Å; L272-L276 HydrophobicContact CD1-CG 4.02Å; L272-L276 HydrophobicContact CG-CD1 4.04Å; L272-L276 WeakPolarHBondContact O-CB 3.46Å; L272-L276 VanDerWaalsContact O-CG 3.25Å; L272-L276 WeakPolarHBondContact O-CG 3.43Å; L272-L276 PolarHBondContact O-N 2.95Å; L272-V288 HydrophobicContact CD2-CG2 3.77Å; L272-V288 HydrophobicContact CG-CG2 4Å
273V94.8Very high92.2Very high0 Ų051.4 Ų51.40%027%0.267CS..Hα-helixtrans-60.4-43.6179174.20000110.9F269 V270 T277 V288 Y316 L318F269-V273 HydrophobicContact CD2-CG2 4.16Å; F269-V273 HydrophobicContact CE1-CG2 4.23Å; F269-V273 HydrophobicContact CE2-CG2 3.78Å; F269-V273 HydrophobicContact CZ-CG2 3.8Å; F269-V273 WeakPolarHBondContact O-CG2 3.36Å; F269-V273 PolarHBondContact O-N 3.4Å; V270-V273 PolarHBondContact O-N 2.85Å; V273-T277 WeakPolarHBondContact O-CB 3.19Å; V273-T277 PolarHBondContact O-N 3.14Å; V273-T277 PolarHBondContact O-OG1 2.78Å; V273-V288 HydrophobicContact CG2-CG1 3.47Å; V273-V288 VanDerWaalsContact CG2-CG1 3.47Å; V273-Y316 VanDerWaalsContact CG1-CB 3.42Å; V273-Y316 HydrophobicContact CG1-CD1 4.06Å; V273-Y316 HydrophobicContact CG1-CD2 3.76Å; V273-Y316 HydrophobicContact CG1-CG 3.49Å; V273-Y316 VanDerWaalsContact CG1-CG 3.49Å; V273-L318 HydrophobicContact CG1-CD1 4.2Å; V273-L318 HydrophobicContact CG1-CD2 4.31Å; V273-L318 HydrophobicContact CG2-CD1 4.29Å
274E92.9Very high92.3Very high26 Ų2649.9 Ų49.912%0.12126%0.259CS..Hα-helixtrans-62.7-50178.2-178.3165163.300112V270 L272 L276 T277 F278 Y316 R358V270-E274 VanDerWaalsContact O-CB 3.24Å; V270-E274 WeakPolarHBondContact O-CB 3.49Å; V270-E274 PolarHBondContact O-N 2.85Å; L272-E274 VanDerWaalsContact C-N 3.31Å; L272-E274 PolarHBondContact O-N 2.9Å; E274-L276 PolarHBondContact O-N 2.73Å; E274-T277 WeakPolarHBondContact O-CB 3.46Å; E274-T277 PolarHBondContact O-N 2.8Å; E274-T277 VanDerWaalsContact O-N 3.12Å; E274-F278 HydrophobicContact CG-CD2 3.6Å; E274-F278 HydrophobicContact CG-CE2 3.31Å; E274-F278 HydrophobicContact CG-CZ 4.45Å; E274-F278 VanDerWaalsContact O-CD2 3.23Å; E274-F278 WeakPolarHBondContact O-CD2 3.34Å; E274-F278 PolarHBondContact O-N 3.06Å; E274-Y316 HydrophobicContact CB-CE1 3.69Å; E274-Y316 HydrophobicContact CG-CE1 3.93Å; E274-Y316 PolarHBondContact OE2-OH 2.98Å; E274-R358 IonicContact OE1-CZ 3.63Å; E274-R358 VanDerWaalsContact OE1-CZ 3.22Å; E274-R358 IonicContact OE1-NH1 2.73Å; E274-R358 PolarHBondContact OE1-NH1 2.92Å; E274-R358 VanDerWaalsContact OE1-NH1 3.09Å; E274-R358 IonicContact OE1-NH2 3.36Å; E274-R358 PolarHBondContact OE1-NH2 3.46Å; E274-R358 IonicContact OE2-CZ 3.63Å; E274-R358 IonicContact OE2-NE 3.15Å; E274-R358 IonicContact OE2-NH1 2.97Å; E274-R358 IonicContact OE2-NH2 3.61Å; E274-R358 PolarHBondContact OE2-NH2 3.43Å
275G93.6Very high92.7Very high7 Ų747.6 Ų47.67%0.07224%0.24CC..Hα-helixtrans-59.7-44.2178.300000113.3F214 T271 L272 T277 F278 A279F214-G275 VanDerWaalsContact CD2-CA 3.41Å; F214-G275 VanDerWaalsContact CE2-CA 3.49Å; T271-G275 PolarHBondContact O-N 2.76Å; L272-G275 PolarHBondContact O-N 3.11Å; G275-T277 VanDerWaalsContact C-N 3.29Å; G275-T277 PolarHBondContact O-N 2.95Å; G275-F278 PolarHBondContact O-N 3.28Å; G275-A279 VanDerWaalsContact O-CB 3.24Å; G275-A279 WeakPolarHBondContact O-CB 3.38Å; G275-A279 PolarHBondContact O-N 2.9Å
276L94.9Very high92.9Very high1 Ų142 Ų421%0.00522%0.219CC..Hα-helixtrans-66.5-31.7175.8-67.1175000112.7F214 L259 L272 E274 H280 L281 L284 V288F214-L276 HydrophobicContact CD1-CD2 4.43Å; L259-L276 HydrophobicContact CD1-CD2 4.36Å; L272-L276 HydrophobicContact CD1-CD1 3.86Å; L272-L276 HydrophobicContact CD1-CG 4.02Å; L272-L276 HydrophobicContact CG-CD1 4.04Å; L272-L276 WeakPolarHBondContact O-CB 3.46Å; L272-L276 VanDerWaalsContact O-CG 3.25Å; L272-L276 WeakPolarHBondContact O-CG 3.43Å; L272-L276 PolarHBondContact O-N 2.95Å; E274-L276 PolarHBondContact O-N 2.73Å; L276-H280 PolarHBondContact O-N 2.88Å; L276-L281 HydrophobicContact CD2-CB 4.08Å; L276-L281 HydrophobicContact CD2-CD1 3.78Å; L276-L281 PolarHBondContact O-N 2.73Å; L276-L284 HydrophobicContact CD1-CB 3.98Å; L276-L284 HydrophobicContact CD2-CB 3.98Å; L276-L284 HydrophobicContact CD2-CD1 4.06Å; L276-V288 HydrophobicContact CD1-CG2 3.59Å
277T92.4Very high93.2Very high43 Ų4340.5 Ų40.526%0.26421%0.212SC..Hα-helixtrans-67.5-48.5175.2-60.40000110.6V273 E274 G275 H280 Y316V273-T277 WeakPolarHBondContact O-CB 3.19Å; V273-T277 PolarHBondContact O-N 3.14Å; V273-T277 PolarHBondContact O-OG1 2.78Å; E274-T277 WeakPolarHBondContact O-CB 3.46Å; E274-T277 PolarHBondContact O-N 2.8Å; E274-T277 VanDerWaalsContact O-N 3.12Å; G275-T277 VanDerWaalsContact C-N 3.29Å; G275-T277 PolarHBondContact O-N 2.95Å; T277-H280 PolarHBondContact O-N 2.97Å; T277-H280 VanDerWaalsContact O-N 3.15Å; T277-Y316 HydrophobicContact CG2-CD1 4.46Å
278F92Very high93.4Very high150 Ų15035 Ų3566%0.65818%0.183SC*.Hα-helixtrans-67.2-34.7177.3-73.8-58000113.2E274 G275 H280E274-F278 HydrophobicContact CG-CD2 3.6Å; E274-F278 HydrophobicContact CG-CE2 3.31Å; E274-F278 HydrophobicContact CG-CZ 4.45Å; E274-F278 VanDerWaalsContact O-CD2 3.23Å; E274-F278 WeakPolarHBondContact O-CD2 3.34Å; E274-F278 PolarHBondContact O-N 3.06Å; G275-F278 PolarHBondContact O-N 3.28Å; F278-H280 PolarHBondContact O-CD2 3.34Å; F278-H280 PolarHBondContact O-N 3.28Å
279A92.9Very high93.5Very high10 Ų1032.4 Ų32.48%0.08317%0.169CC..THydrogen-bonded Turntrans-76.2-2.3174.800000113.6F214 R218 G275 L281F214-A279 HydrophobicContact CB-CB 3.99Å; R218-A279 HydrophobicContact CB-CB 4.38Å; R218-A279 WeakPolarHBondContact CD-O 3.47Å; R218-A279 PolarHBondContact NE-O 2.65Å; G275-A279 VanDerWaalsContact O-CB 3.24Å; G275-A279 WeakPolarHBondContact O-CB 3.38Å; G275-A279 PolarHBondContact O-N 2.9Å; A279-L281 HydrophobicContact CB-CD1 3.91Å; A279-L281 HydrophobicContact CB-CG 4.2Å
280H92.6Very high93.5Very high151 Ų15133.2 Ų33.270%0.69917%0.172SC*.THydrogen-bonded Turntrans55.750.3-178.1-58.5-69.8000113.4L276 T277 F278 P282L276-H280 PolarHBondContact O-N 2.88Å; T277-H280 PolarHBondContact O-N 2.97Å; T277-H280 VanDerWaalsContact O-N 3.15Å; F278-H280 PolarHBondContact O-CD2 3.34Å; F278-H280 PolarHBondContact O-N 3.28Å; H280-P282 WeakPolarHBondContact O-CD 3.34Å
281L93.4Very high93.5Very high7 Ų734.8 Ų34.84%0.03718%0.177CC..  trans-110.771.1179.3-68.9167.7000111.7R218 F221 L276 A279 A283 L284 R285R218-L281 HydrophobicContact CB-CD1 3.94Å; R218-L281 HydrophobicContact CB-CD2 4.36Å; R218-L281 HydrophobicContact CB-CG 4.35Å; R218-L281 HydrophobicContact CG-CD1 4.44Å; R218-L281 HydrophobicContact CG-CD2 4.09Å; R218-L281 HydrophobicContact CG-CG 4.31Å; F221-L281 HydrophobicContact CB-CD2 4.13Å; F221-L281 HydrophobicContact CD1-CD2 3.84Å; F221-L281 HydrophobicContact CG-CD2 4.11Å; L276-L281 HydrophobicContact CD2-CB 4.08Å; L276-L281 HydrophobicContact CD2-CD1 3.78Å; L276-L281 PolarHBondContact O-N 2.73Å; A279-L281 HydrophobicContact CB-CD1 3.91Å; A279-L281 HydrophobicContact CB-CG 4.2Å; L281-A283 VanDerWaalsContact C-N 3.33Å; L281-A283 PolarHBondContact O-N 3.19Å; L281-L284 HydrophobicContact CB-CB 4.38Å; L281-L284 HydrophobicContact CB-CD1 4.3Å; L281-L284 HydrophobicContact CD1-CD1 4.05Å; L281-L284 PolarHBondContact O-N 3.03Å; L281-R285 PolarHBondContact O-N 3.13Å
282P92.6Very high93.4Very high82 Ų8231.9 Ų31.953%0.53216%0.159SC..Hα-helixtrans-64.5-33-172.325.9-35.3000113.6H280 R285 K286H280-P282 WeakPolarHBondContact O-CD 3.34Å; P282-R285 PolarHBondContact O-N 3.39Å; P282-K286 WeakPolarHBondContact O-CG 3.25Å; P282-K286 PolarHBondContact O-N 3.49Å
283A92.3Very high93.2Very high16 Ų1631.7 Ų31.713%0.13216%0.158CC..Hα-helixtrans-64.9-45.2178.700000111.7F221 R247 A251 L281 K286 E287F221-A283 HydrophobicContact CE1-CB 4.43Å; F221-A283 HydrophobicContact CZ-CB 3.89Å; R247-A283 HydrophobicContact CG-CB 4.11Å; A251-A283 HydrophobicContact CB-CB 3.84Å; L281-A283 VanDerWaalsContact C-N 3.33Å; L281-A283 PolarHBondContact O-N 3.19Å; A283-K286 PolarHBondContact O-N 2.98Å; A283-E287 PolarHBondContact O-N 3Å
284L94.4Very high93Very high0 Ų035.2 Ų35.20%018%0.175CC..Hα-helixtrans-68.2-35.7175.1-70.4170.4000111.9F221 A251 Y254 F255 L259 L276 L281 K286 E287 V288F221-L284 HydrophobicContact CB-CD1 4.46Å; F221-L284 HydrophobicContact CD2-CD1 3.68Å; F221-L284 HydrophobicContact CD2-CD2 4.18Å; F221-L284 HydrophobicContact CD2-CG 3.88Å; F221-L284 HydrophobicContact CE2-CD1 4.18Å; F221-L284 HydrophobicContact CE2-CD2 4.06Å; F221-L284 HydrophobicContact CE2-CG 3.85Å; F221-L284 HydrophobicContact CG-CD1 4.13Å; A251-L284 HydrophobicContact CB-CD2 4.1Å; A251-L284 WeakPolarHBondContact O-CD2 3.38Å; Y254-L284 HydrophobicContact CD1-CD1 4.18Å; Y254-L284 HydrophobicContact CD1-CD2 3.99Å; Y254-L284 HydrophobicContact CE1-CD1 4.49Å; F255-L284 HydrophobicContact CB-CD2 4.19Å; L259-L284 HydrophobicContact CD1-CD1 4.09Å; L259-L284 HydrophobicContact CD1-CD2 4.05Å; L259-L284 HydrophobicContact CD1-CG 4.47Å; L276-L284 HydrophobicContact CD1-CB 3.98Å; L276-L284 HydrophobicContact CD2-CB 3.98Å; L276-L284 HydrophobicContact CD2-CD1 4.06Å; L281-L284 HydrophobicContact CB-CB 4.38Å; L281-L284 HydrophobicContact CB-CD1 4.3Å; L281-L284 HydrophobicContact CD1-CD1 4.05Å; L281-L284 PolarHBondContact O-N 3.03Å; L284-K286 VanDerWaalsContact C-N 3.26Å; L284-K286 PolarHBondContact O-N 3.42Å; L284-E287 PolarHBondContact O-N 3.32Å; L284-E287 VanDerWaalsContact O-N 3.12Å; L284-V288 WeakPolarHBondContact O-CG2 3.33Å; L284-V288 PolarHBondContact O-N 2.92Å
285R94.9Very high92.6Very high49 Ų4938.8 Ų38.819%0.18519%0.19CC..Hα-helixtrans-59.5-38.2173.2-171.6-179.366.1169.6-2.5111.7L281 P282 E287 V288 E289 Y316 L318L281-R285 PolarHBondContact O-N 3.13Å; P282-R285 PolarHBondContact O-N 3.39Å; R285-E287 VanDerWaalsContact C-N 3.34Å; R285-V288 PolarHBondContact O-N 3.29Å; R285-E289 PolarHBondContact O-N 2.88Å; R285-Y316 PolarHBondContact NH1-O 2.92Å; R285-L318 HydrophobicContact CG-CD2 3.7Å
286K93.8Very high92.2Very high43 Ų4338.9 Ų38.919%0.18719%0.189CC..Hα-helixtrans-67.7-31.9175.4-72.5-69.1173.5-168.60113L171 P172 P282 A283 L284 E289 R290L171-K286 HydrophobicContact CD2-CD 3.8Å; P172-K286 HydrophobicContact CG-CB 4.13Å; P172-K286 HydrophobicContact CG-CG 4.31Å; P282-K286 WeakPolarHBondContact O-CG 3.25Å; P282-K286 PolarHBondContact O-N 3.49Å; A283-K286 PolarHBondContact O-N 2.98Å; L284-K286 VanDerWaalsContact C-N 3.26Å; L284-K286 PolarHBondContact O-N 3.42Å; K286-E289 WeakPolarHBondContact CD-OE2 3.44Å; K286-E289 IonicContact NZ-OE2 3.76Å; K286-E289 PolarHBondContact NZ-OE2 2.94Å; K286-E289 WeakPolarHBondContact O-CB 3.29Å; K286-E289 PolarHBondContact O-N 3.16Å; K286-R290 WeakPolarHBondContact O-CB 3.44Å; K286-R290 PolarHBondContact O-N 3.08Å
287E93.4Very high91.6Very high5 Ų543 Ų432%0.02321%0.21CC..Hα-helixtrans-74-34.6173.2-68.6-58.2119.200112.8A251 H252 F255 A283 L284 R285 E289 R290 F291A251-E287 HydrophobicContact CB-CG 3.94Å; H252-E287 HydrophobicContact CB-CG 4.46Å; H252-E287 IonicContact CE1-OE2 3.95Å; H252-E287 IonicContact CG-OE2 2.68Å; H252-E287 IonicContact ND1-OE2 3.71Å; H252-E287 PolarHBondContact ND1-OE2 2.83Å; F255-E287 HydrophobicContact CB-CB 3.88Å; F255-E287 HydrophobicContact CD1-CB 4.17Å; F255-E287 HydrophobicContact CD2-CB 4.45Å; F255-E287 HydrophobicContact CG-CB 3.89Å; A283-E287 PolarHBondContact O-N 3Å; L284-E287 PolarHBondContact O-N 3.32Å; L284-E287 VanDerWaalsContact O-N 3.12Å; R285-E287 VanDerWaalsContact C-N 3.34Å; E287-E289 VanDerWaalsContact C-N 3.32Å; E287-R290 WeakPolarHBondContact O-CB 3.26Å; E287-R290 PolarHBondContact O-N 2.71Å; E287-R290 IonicContact OE1-NE 3.31Å; E287-R290 PolarHBondContact OE1-NE 3.06Å; E287-R290 WeakPolarHBondContact OE2-CD 3.45Å; E287-R290 IonicContact OE2-NE 2.74Å; E287-F291 WeakPolarHBondContact O-CB 3.44Å; E287-F291 PolarHBondContact O-N 2.93Å
288V94.6Very high90.8Very high0 Ų047.9 Ų47.90%023%0.23CC..Hα-helixtrans-61.6-43.2169175.90000110.9F255 F269 L272 V273 L276 L284 R285 F291 I292F255-V288 HydrophobicContact CD2-CG2 3.85Å; F255-V288 HydrophobicContact CE2-CB 4.29Å; F255-V288 HydrophobicContact CE2-CG2 3.5Å; F255-V288 VanDerWaalsContact CE2-CG2 3.5Å; F255-V288 HydrophobicContact CZ-CG2 4.43Å; F269-V288 HydrophobicContact CD2-CG1 3.79Å; F269-V288 HydrophobicContact CE2-CG1 3.43Å; F269-V288 VanDerWaalsContact CE2-CG1 3.43Å; F269-V288 HydrophobicContact CZ-CG1 4.44Å; L272-V288 HydrophobicContact CD2-CG2 3.77Å; L272-V288 HydrophobicContact CG-CG2 4Å; V273-V288 HydrophobicContact CG2-CG1 3.47Å; V273-V288 VanDerWaalsContact CG2-CG1 3.47Å; L276-V288 HydrophobicContact CD1-CG2 3.59Å; L284-V288 WeakPolarHBondContact O-CG2 3.33Å; L284-V288 PolarHBondContact O-N 2.92Å; R285-V288 PolarHBondContact O-N 3.29Å; V288-F291 PolarHBondContact O-N 3.45Å; V288-I292 WeakPolarHBondContact O-CG2 3.44Å; V288-I292 PolarHBondContact O-N 3.3Å; V288-I292 VanDerWaalsContact O-N 3.13Å
289E94.9Very high89.8Confident0 Ų043.4 Ų43.40%022%0.221CC..Hα-helixtrans-61.1-43.8174.3-170.8172.5-16300111.7L171 R285 K286 E287 I292 C293 L318 E319 I320 L321L171-E289 HydrophobicContact CD2-CB 4.4Å; L171-E289 HydrophobicContact CD2-CG 4.13Å; R285-E289 PolarHBondContact O-N 2.88Å; K286-E289 WeakPolarHBondContact CD-OE2 3.44Å; K286-E289 IonicContact NZ-OE2 3.76Å; K286-E289 PolarHBondContact NZ-OE2 2.94Å; K286-E289 WeakPolarHBondContact O-CB 3.29Å; K286-E289 PolarHBondContact O-N 3.16Å; E287-E289 VanDerWaalsContact C-N 3.32Å; E289-I292 WeakPolarHBondContact O-CG2 3.3Å; E289-I292 PolarHBondContact O-N 3.22Å; E289-C293 VanDerWaalsContact O-CB 3.31Å; E289-C293 WeakPolarHBondContact O-CB 3.24Å; E289-C293 PolarHBondContact O-N 3.28Å; E289-C293 PolarHBondContact O-SG 3.43Å; E289-L318 HydrophobicContact CB-CD2 4.39Å; E289-L318 HydrophobicContact CG-CB 4.2Å; E289-L318 VanDerWaalsContact OE1-CA 3.32Å; E289-L318 WeakPolarHBondContact OE1-CA 3.25Å; E289-E319 PolarHBondContact OE1-N 3.3Å; E289-E319 VanDerWaalsContact OE1-N 3.14Å; E289-I320 WeakPolarHBondContact OE1-CA 3.37Å; E289-I320 WeakPolarHBondContact OE1-CB 3.29Å; E289-I320 PolarHBondContact OE1-N 2.93Å; E289-L321 HydrophobicContact CG-CB 4.03Å; E289-L321 PolarHBondContact OE1-N 3.19Å
290R92.8Very high88.8Confident22 Ų2250.8 Ų50.88%0.08326%0.259CS..Hα-helixtrans-57.1-50.6174-177.5-179.7-64.5-68.9-2.2111.9L168 L171 P172 K286 E287 I292 C293 Q294L168-R290 HydrophobicContact CD2-CG 4.43Å; L171-R290 VanDerWaalsContact C-NH2 3.25Å; L171-R290 VanDerWaalsContact CD1-CA 3.44Å; L171-R290 HydrophobicContact CD1-CB 3.74Å; L171-R290 HydrophobicContact CD1-CG 4.28Å; L171-R290 PolarHBondContact O-NH2 2.95Å; P172-R290 PolarHBondContact O-NH2 2.96Å; K286-R290 WeakPolarHBondContact O-CB 3.44Å; K286-R290 PolarHBondContact O-N 3.08Å; E287-R290 WeakPolarHBondContact O-CB 3.26Å; E287-R290 PolarHBondContact O-N 2.71Å; E287-R290 IonicContact OE1-NE 3.31Å; E287-R290 PolarHBondContact OE1-NE 3.06Å; E287-R290 WeakPolarHBondContact OE2-CD 3.45Å; E287-R290 IonicContact OE2-NE 2.74Å; R290-I292 PolarHBondContact O-N 2.87Å; R290-C293 PolarHBondContact O-N 3.39Å; R290-Q294 WeakPolarHBondContact O-CG 3.34Å; R290-Q294 PolarHBondContact O-N 3.38Å
291F92.1Very high88.2Confident44 Ų4444.1 Ų44.119%0.19323%0.228CC..Hα-helixtrans-57.2-49.4-178.4168.8-100.2000111.9F255 I263 E287 V288 Q294 K295F255-F291 HydrophobicContact CE1-CB 3.58Å; F255-F291 HydrophobicContact CE1-CD2 4.08Å; F255-F291 AromaticContact CE1-CG 3.92Å; F255-F291 HydrophobicContact CE1-CG 3.92Å; F255-F291 HydrophobicContact CZ-CB 3.59Å; F255-F291 HydrophobicContact CZ-CD1 4.19Å; F255-F291 HydrophobicContact CZ-CD2 4.21Å; F255-F291 AromaticContact CZ-CG 3.74Å; F255-F291 HydrophobicContact CZ-CG 3.74Å; I263-F291 HydrophobicContact CD1-CD1 4.03Å; I263-F291 HydrophobicContact CD1-CE1 3.88Å; I263-F291 HydrophobicContact CG2-CE1 4.15Å; E287-F291 WeakPolarHBondContact O-CB 3.44Å; E287-F291 PolarHBondContact O-N 2.93Å; V288-F291 PolarHBondContact O-N 3.45Å; F291-Q294 PolarHBondContact O-N 2.71Å; F291-K295 HydrophobicContact CZ-CG 4.36Å; F291-K295 WeakPolarHBondContact O-CG 3.35Å; F291-K295 PolarHBondContact O-N 2.68Å; F291-K295 VanDerWaalsContact O-N 3.17Å
292I91.8Very high87.9Confident10 Ų1048.1 Ų48.15%0.05125%0.25CC..Hα-helixtrans-73-34.6-177.8-166.464.5000111.9F269 V288 E289 R290 Q294 K295 V296 F305 L309 L321F269-I292 HydrophobicContact CE2-CB 3.81Å; F269-I292 HydrophobicContact CE2-CG1 4.12Å; F269-I292 HydrophobicContact CE2-CG2 3.78Å; F269-I292 HydrophobicContact CZ-CB 4.24Å; F269-I292 HydrophobicContact CZ-CG1 4.21Å; F269-I292 HydrophobicContact CZ-CG2 3.92Å; V288-I292 WeakPolarHBondContact O-CG2 3.44Å; V288-I292 PolarHBondContact O-N 3.3Å; V288-I292 VanDerWaalsContact O-N 3.13Å; E289-I292 WeakPolarHBondContact O-CG2 3.3Å; E289-I292 PolarHBondContact O-N 3.22Å; R290-I292 PolarHBondContact O-N 2.87Å; I292-Q294 PolarHBondContact O-N 2.94Å; I292-K295 HydrophobicContact CD1-CB 4.47Å; I292-K295 PolarHBondContact O-N 2.71Å; I292-V296 WeakPolarHBondContact O-CB 3.35Å; I292-V296 VanDerWaalsContact O-CG2 3.31Å; I292-V296 WeakPolarHBondContact O-CG2 3.45Å; I292-V296 PolarHBondContact O-N 2.98Å; I292-F305 HydrophobicContact CD1-CE1 4.49Å; I292-F305 HydrophobicContact CD1-CZ 4.18Å; I292-L309 HydrophobicContact CD1-CD1 4.41Å; I292-L309 HydrophobicContact CD1-CD2 4.27Å; I292-L309 HydrophobicContact CG1-CD1 4.12Å; I292-L309 HydrophobicContact CG1-CD2 3.86Å; I292-L321 HydrophobicContact CG2-CD1 3.93Å; I292-L321 HydrophobicContact CG2-CD2 3.56Å; I292-L321 HydrophobicContact CG2-CG 4.27Å
293C91.1Very high87.6Confident0 Ų046.4 Ų46.40%024%0.238CC..Hα-helixtrans-59.3-43.9171.6-790000111.9L168 E289 R290 K295 V296 I297L168-C293 HydrophobicContact CD2-CB 3.93Å; E289-C293 VanDerWaalsContact O-CB 3.31Å; E289-C293 WeakPolarHBondContact O-CB 3.24Å; E289-C293 PolarHBondContact O-N 3.28Å; E289-C293 PolarHBondContact O-SG 3.43Å; R290-C293 PolarHBondContact O-N 3.39Å; C293-K295 VanDerWaalsContact C-N 3.35Å; C293-K295 PolarHBondContact O-N 3.15Å; C293-V296 WeakPolarHBondContact O-CB 3.31Å; C293-V296 PolarHBondContact O-N 3.44Å; C293-I297 WeakPolarHBondContact O-CB 3.37Å; C293-I297 WeakPolarHBondContact O-CD1 3.34Å; C293-I297 WeakPolarHBondContact O-CG1 3.32Å; C293-I297 PolarHBondContact O-N 3.01Å
294Q88.6Confident87.4Confident74 Ų7447.7 Ų47.735%0.34625%0.246SC..Hα-helixtrans-59-46.3175-76.3172.6-25.200111.4L168 R290 F291 I292 V296 I297 E298L168-Q294 HydrophobicContact CD1-CG 3.69Å; L168-Q294 HydrophobicContact CD2-CG 3.97Å; R290-Q294 WeakPolarHBondContact O-CG 3.34Å; R290-Q294 PolarHBondContact O-N 3.38Å; F291-Q294 PolarHBondContact O-N 2.71Å; I292-Q294 PolarHBondContact O-N 2.94Å; Q294-V296 VanDerWaalsContact C-N 3.3Å; Q294-V296 PolarHBondContact O-N 2.96Å; Q294-I297 PolarHBondContact O-N 2.89Å; Q294-E298 WeakPolarHBondContact O-CB 3.38Å; Q294-E298 VanDerWaalsContact O-CG 3.26Å; Q294-E298 WeakPolarHBondContact O-CG 3.38Å; Q294-E298 PolarHBondContact O-N 2.75Å
295K85.4Confident87.2Confident100 Ų10051 Ų5144%0.43526%0.261SS..Hα-helixtrans-61-39.4176.8-65.9-63.3173.6-157.90113F291 I292 C293 A299F291-K295 HydrophobicContact CZ-CG 4.36Å; F291-K295 WeakPolarHBondContact O-CG 3.35Å; F291-K295 PolarHBondContact O-N 2.68Å; F291-K295 VanDerWaalsContact O-N 3.17Å; I292-K295 HydrophobicContact CD1-CB 4.47Å; I292-K295 PolarHBondContact O-N 2.71Å; C293-K295 VanDerWaalsContact C-N 3.35Å; C293-K295 PolarHBondContact O-N 3.15Å; K295-A299 WeakPolarHBondContact O-CB 3.35Å; K295-A299 PolarHBondContact O-N 3.12Å
296V85.6Confident87.1Confident10 Ų1048.7 Ų48.76%0.06125%0.252CS..Hα-helixtrans-65.7-41.7177.3148.50000111.9I292 C293 Q294 M301 L309 L321 V324 I325I292-V296 WeakPolarHBondContact O-CB 3.35Å; I292-V296 VanDerWaalsContact O-CG2 3.31Å; I292-V296 WeakPolarHBondContact O-CG2 3.45Å; I292-V296 PolarHBondContact O-N 2.98Å; C293-V296 WeakPolarHBondContact O-CB 3.31Å; C293-V296 PolarHBondContact O-N 3.44Å; Q294-V296 VanDerWaalsContact C-N 3.3Å; Q294-V296 PolarHBondContact O-N 2.96Å; V296-M301 HydrophobicContact CB-CE 3.66Å; V296-M301 HydrophobicContact CG1-CE 3.15Å; V296-M301 HydrophobicContact CG2-CE 3.54Å; V296-M301 HydrophobicContact CG2-SD 4.01Å; V296-L309 HydrophobicContact CG2-CD1 3.77Å; V296-L321 HydrophobicContact CG2-CD1 4.36Å; V296-V324 HydrophobicContact CG1-CG1 3.53Å; V296-I325 HydrophobicContact CG1-CD1 4.3Å; V296-I325 HydrophobicContact CG2-CD1 4.03Å
297I81.3Confident87.1Confident87 Ų8747 Ų4745%0.44625%0.245SC..Hα-helixtrans-73.2-36.1-179.5-66.4161.5000111.3P167 L168 C293 Q294P167-I297 HydrophobicContact CB-CD1 4.15Å; P167-I297 HydrophobicContact CG-CD1 3.84Å; P167-I297 HydrophobicContact CG-CG1 4.47Å; L168-I297 HydrophobicContact CD2-CD1 4.35Å; L168-I297 HydrophobicContact CG-CD1 4.28Å; C293-I297 WeakPolarHBondContact O-CB 3.37Å; C293-I297 WeakPolarHBondContact O-CD1 3.34Å; C293-I297 WeakPolarHBondContact O-CG1 3.32Å; C293-I297 PolarHBondContact O-N 3.01Å; Q294-I297 PolarHBondContact O-N 2.89Å
298E77.2Confident87Confident145 Ų14549 Ų4968%0.67825%0.253SS*.Hα-helixtrans-78-25.7-177.9-72.4171.7-177.900114Q294Q294-E298 WeakPolarHBondContact O-CB 3.38Å; Q294-E298 VanDerWaalsContact O-CG 3.26Å; Q294-E298 WeakPolarHBondContact O-CG 3.38Å; Q294-E298 PolarHBondContact O-N 2.75Å
299A69.1Low87Confident57 Ų5749 Ų4947%0.47125%0.253SS..SBendtrans-105.4148.3-171.900000112.8K295 M301K295-A299 WeakPolarHBondContact O-CB 3.35Å; K295-A299 PolarHBondContact O-N 3.12Å; A299-M301 PolarHBondContact O-N 3.02Å
300D72.4Confident87Confident164 Ų16449 Ų4988%0.87725%0.253SS*.  trans-6997.6159.9-17121.7000107.8D302D300-D302 PolarHBondContact O-N 3.26Å
301M80.4Confident87Confident12 Ų1248 Ų486%0.05925%0.25CC..  trans-73.5128.6-168.5-167.3-172-3100111V296 A299 P303 F305 A306 L309 I325 F328V296-M301 HydrophobicContact CB-CE 3.66Å; V296-M301 HydrophobicContact CG1-CE 3.15Å; V296-M301 HydrophobicContact CG2-CE 3.54Å; V296-M301 HydrophobicContact CG2-SD 4.01Å; A299-M301 PolarHBondContact O-N 3.02Å; M301-P303 WeakPolarHBondContact O-CD 3.32Å; M301-F305 HydrophobicContact CG-CD1 4.04Å; M301-F305 HydrophobicContact SD-CD1 4.48Å; M301-A306 HydrophobicContact CG-CB 4.25Å; M301-A306 HydrophobicContact SD-CB 3.4Å; M301-A306 WeakPolarHBondContact SD-CB 3.47Å; M301-L309 HydrophobicContact SD-CD1 4.46Å; M301-I325 HydrophobicContact CE-CD1 3.64Å; M301-I325 HydrophobicContact SD-CD1 3.5Å; M301-I325 WeakPolarHBondContact SD-CD1 3.39Å; M301-F328 HydrophobicContact CB-CE1 4.12Å; M301-F328 HydrophobicContact CB-CE2 4.15Å; M301-F328 HydrophobicContact CB-CZ 3.76Å; M301-F328 HydrophobicContact CE-CD1 4.28Å; M301-F328 HydrophobicContact CE-CD2 4.48Å; M301-F328 HydrophobicContact CE-CG 4.24Å; M301-F328 HydrophobicContact CG-CE1 4.45Å; M301-F328 VanDerWaalsContact O-CZ 3.26Å; M301-F328 WeakPolarHBondContact O-CZ 3.41Å; M301-F328 HydrophobicContact SD-CD1 4.32Å; M301-F328 HydrophobicContact SD-CE1 4.28Å
302D86.3Confident87Confident90 Ų9046 Ų4648%0.48124%0.241SC..  trans-61.5127.9170.5171.657.5000110.6D300 S304 F305 A306D300-D302 PolarHBondContact O-N 3.26Å; D302-S304 PolarHBondContact O-N 3.37Å; D302-S304 WeakPolarHBondContact OD2-CA 3.5Å; D302-S304 WeakPolarHBondContact OD2-CB 3.37Å; D302-S304 PolarHBondContact OD2-N 2.97Å; D302-F305 HydrophobicContact CB-CB 4Å; D302-F305 WeakPolarHBondContact O-CB 3.44Å; D302-F305 PolarHBondContact O-N 3.06Å; D302-F305 VanDerWaalsContact O-N 3.11Å; D302-F305 PolarHBondContact OD2-N 3.15Å; D302-A306 PolarHBondContact O-N 3.05Å
303P87.1Confident87.2Confident46 Ų4645.5 Ų45.530%0.29924%0.239SC..Hα-helixtrans-58.4-31.3179.8-2532.4000114M301 K307M301-P303 WeakPolarHBondContact O-CD 3.32Å; P303-K307 WeakPolarHBondContact O-CD 3.48Å; P303-K307 WeakPolarHBondContact O-CE 3.11Å; P303-K307 VanDerWaalsContact O-CG 3.23Å; P303-K307 WeakPolarHBondContact O-CG 3.25Å; P303-K307 PolarHBondContact O-N 2.95Å; P303-K307 VanDerWaalsContact O-N 3.1Å
304S89.1Confident87.3Confident43 Ų4347.9 Ų47.930%0.30125%0.25SC..Hα-helixtrans-71-43.4176.51550000110.8D302 A306 K307 K308 M353D302-S304 PolarHBondContact O-N 3.37Å; D302-S304 WeakPolarHBondContact OD2-CA 3.5Å; D302-S304 WeakPolarHBondContact OD2-CB 3.37Å; D302-S304 PolarHBondContact OD2-N 2.97Å; S304-A306 VanDerWaalsContact C-N 3.34Å; S304-A306 PolarHBondContact O-N 3.38Å; S304-K307 PolarHBondContact O-N 3.36Å; S304-K308 PolarHBondContact O-N 3.27Å; S304-K308 VanDerWaalsContact O-N 3.1Å; S304-M353 WeakPolarHBondContact OG-CE 3.29Å
305F89.8Confident87.4Confident71 Ų7148.5 Ų48.531%0.31125%0.252SS..Hα-helixtrans-58.8-42.9171.2-173.5-115.5000112.6F266 I292 M301 D302 K307 K308 L309F266-F305 HydrophobicContact CB-CE2 4.46Å; F266-F305 HydrophobicContact CD2-CD2 4.32Å; F266-F305 AromaticContact CD2-CE2 3.69Å; F266-F305 HydrophobicContact CD2-CE2 3.69Å; F266-F305 HydrophobicContact CE2-CE2 4.43Å; F266-F305 HydrophobicContact CG-CE2 4.46Å; I292-F305 HydrophobicContact CD1-CE1 4.49Å; I292-F305 HydrophobicContact CD1-CZ 4.18Å; M301-F305 HydrophobicContact CG-CD1 4.04Å; M301-F305 HydrophobicContact SD-CD1 4.48Å; D302-F305 HydrophobicContact CB-CB 4Å; D302-F305 WeakPolarHBondContact O-CB 3.44Å; D302-F305 PolarHBondContact O-N 3.06Å; D302-F305 VanDerWaalsContact O-N 3.11Å; D302-F305 PolarHBondContact OD2-N 3.15Å; F305-K307 PolarHBondContact O-N 3.12Å; F305-K308 PolarHBondContact O-N 2.69Å; F305-L309 HydrophobicContact CD1-CD1 3.77Å; F305-L309 HydrophobicContact CD1-CG 4.36Å; F305-L309 HydrophobicContact CE1-CD1 3.36Å; F305-L309 HydrophobicContact CE1-CG 4.04Å; F305-L309 HydrophobicContact CE2-CG 4.4Å; F305-L309 HydrophobicContact CZ-CD1 3.81Å; F305-L309 HydrophobicContact CZ-CD2 4.23Å; F305-L309 HydrophobicContact CZ-CG 4.06Å; F305-L309 PolarHBondContact O-N 3.47Å
306A91.9Very high87.7Confident0 Ų044.5 Ų44.50%023%0.234CC..Hα-helixtrans-57.3-46.4175.600000112M301 D302 S304 K308 L309 L310 I325 F328 L329M301-A306 HydrophobicContact CG-CB 4.25Å; M301-A306 HydrophobicContact SD-CB 3.4Å; M301-A306 WeakPolarHBondContact SD-CB 3.47Å; D302-A306 PolarHBondContact O-N 3.05Å; S304-A306 VanDerWaalsContact C-N 3.34Å; S304-A306 PolarHBondContact O-N 3.38Å; A306-K308 PolarHBondContact O-N 2.78Å; A306-L309 PolarHBondContact O-N 2.87Å; A306-L310 PolarHBondContact O-N 3.19Å; A306-I325 HydrophobicContact CB-CG2 4.32Å; A306-I325 WeakPolarHBondContact O-CG2 3.42Å; A306-F328 HydrophobicContact CB-CD1 3.78Å; A306-F328 HydrophobicContact CB-CE1 3.73Å; A306-L329 HydrophobicContact CB-CD2 4.01Å; A306-L329 HydrophobicContact CB-CG 4.48Å
307K93.5Very high88Confident8 Ų847.7 Ų47.74%0.03525%0.25CS..Hα-helixtrans-61.3-41.9177.8-70.6166.5-154.6-177.40111.9P303 S304 F305 L310 L311 L329 E349 L350 M353P303-K307 WeakPolarHBondContact O-CD 3.48Å; P303-K307 WeakPolarHBondContact O-CE 3.11Å; P303-K307 VanDerWaalsContact O-CG 3.23Å; P303-K307 WeakPolarHBondContact O-CG 3.25Å; P303-K307 PolarHBondContact O-N 2.95Å; P303-K307 VanDerWaalsContact O-N 3.1Å; S304-K307 PolarHBondContact O-N 3.36Å; F305-K307 PolarHBondContact O-N 3.12Å; K307-L310 WeakPolarHBondContact O-CB 3.29Å; K307-L310 PolarHBondContact O-N 2.9Å; K307-L311 PolarHBondContact O-N 3.24Å; K307-L329 HydrophobicContact CG-CD1 4.23Å; K307-L329 HydrophobicContact CG-CD2 4.37Å; K307-E349 HydrophobicContact CD-CB 4.2Å; K307-E349 IonicContact NZ-OE1 3.77Å; K307-E349 PolarHBondContact NZ-OE1 3.45Å; K307-E349 IonicContact NZ-OE2 3.86Å; K307-E349 PolarHBondContact NZ-OE2 3.47Å; K307-L350 HydrophobicContact CB-CD2 3.73Å; K307-L350 HydrophobicContact CG-CD2 4.15Å; K307-L350 WeakPolarHBondContact O-CD2 3.48Å; K307-M353 HydrophobicContact CB-CE 4.34Å; K307-M353 HydrophobicContact CB-SD 3.65Å; K307-M353 HydrophobicContact CD-CE 4.25Å
308K92.7Very high88.6Confident45 Ų4543.5 Ų43.520%0.19623%0.229CC..Hα-helixtrans-63.5-45.2174.7-66.3-169.1177.3-160.80111.9F266 S304 F305 A306 L310 L311 V312 M353 E356 I357F266-K308 HydrophobicContact CE1-CB 4.24Å; F266-K308 HydrophobicContact CE1-CD 4.4Å; F266-K308 HydrophobicContact CE2-CB 3.93Å; F266-K308 HydrophobicContact CZ-CB 3.61Å; S304-K308 PolarHBondContact O-N 3.27Å; S304-K308 VanDerWaalsContact O-N 3.1Å; F305-K308 PolarHBondContact O-N 2.69Å; A306-K308 PolarHBondContact O-N 2.78Å; K308-L310 VanDerWaalsContact C-N 3.27Å; K308-L310 PolarHBondContact O-N 3.4Å; K308-L311 PolarHBondContact O-N 3.12Å; K308-V312 WeakPolarHBondContact O-CG2 3.25Å; K308-V312 PolarHBondContact O-N 2.97Å; K308-V312 VanDerWaalsContact O-N 3.14Å; K308-M353 HydrophobicContact CG-CB 4.4Å; K308-M353 HydrophobicContact CG-CG 4.31Å; K308-M353 HydrophobicContact CG-SD 3.69Å; K308-E356 IonicContact NZ-OE2 2.6Å; K308-E356 PolarHBondContact NZ-OE2 3.38Å; K308-E356 VanDerWaalsContact NZ-OE2 3.09Å; K308-I357 HydrophobicContact CB-CD1 4.14Å; K308-I357 HydrophobicContact CG-CD1 4.23Å
309L93.5Very high89.3Confident0 Ų041.7 Ų41.70%022%0.221CC..Hα-helixtrans-62.4-32.7175.2-75.2178.5000112.8F266 F269 I292 V296 M301 F305 A306 V312 S313 L321 I325F266-L309 HydrophobicContact CD2-CD2 4.48Å; F266-L309 HydrophobicContact CE2-CD2 3.99Å; F266-L309 HydrophobicContact CE2-CG 4.43Å; F269-L309 HydrophobicContact CD1-CD2 4.33Å; F269-L309 HydrophobicContact CE1-CD2 3.77Å; F269-L309 HydrophobicContact CZ-CD2 4.27Å; I292-L309 HydrophobicContact CD1-CD1 4.41Å; I292-L309 HydrophobicContact CD1-CD2 4.27Å; I292-L309 HydrophobicContact CG1-CD1 4.12Å; I292-L309 HydrophobicContact CG1-CD2 3.86Å; V296-L309 HydrophobicContact CG2-CD1 3.77Å; M301-L309 HydrophobicContact SD-CD1 4.46Å; F305-L309 HydrophobicContact CD1-CD1 3.77Å; F305-L309 HydrophobicContact CD1-CG 4.36Å; F305-L309 HydrophobicContact CE1-CD1 3.36Å; F305-L309 HydrophobicContact CE1-CG 4.04Å; F305-L309 HydrophobicContact CE2-CG 4.4Å; F305-L309 HydrophobicContact CZ-CD1 3.81Å; F305-L309 HydrophobicContact CZ-CD2 4.23Å; F305-L309 HydrophobicContact CZ-CG 4.06Å; F305-L309 PolarHBondContact O-N 3.47Å; A306-L309 PolarHBondContact O-N 2.87Å; L309-V312 PolarHBondContact O-N 2.54Å; L309-S313 VanDerWaalsContact O-CB 3.24Å; L309-S313 WeakPolarHBondContact O-CB 3.42Å; L309-S313 PolarHBondContact O-N 3.42Å; L309-S313 PolarHBondContact O-OG 3.49Å; L309-L321 HydrophobicContact CD2-CD2 4.42Å; L309-I325 HydrophobicContact CB-CD1 4.12Å; L309-I325 HydrophobicContact CB-CG1 4.23Å; L309-I325 HydrophobicContact CD1-CD1 4Å
310L94.6Very high90.5Very high0 Ų039.4 Ų39.40%020%0.2CC..Hα-helixtrans-65-43.3177-169.850000112.1A306 K307 K308 S313 E314 K322 I325 N326 L329 V370 L374A306-L310 PolarHBondContact O-N 3.19Å; K307-L310 WeakPolarHBondContact O-CB 3.29Å; K307-L310 PolarHBondContact O-N 2.9Å; K308-L310 VanDerWaalsContact C-N 3.27Å; K308-L310 PolarHBondContact O-N 3.4Å; L310-S313 WeakPolarHBondContact CA-OG 3.48Å; L310-S313 PolarHBondContact O-N 2.77Å; L310-S313 PolarHBondContact O-OG 3.31Å; L310-E314 PolarHBondContact O-N 2.63Å; L310-K322 HydrophobicContact CD1-CG 3.92Å; L310-I325 HydrophobicContact CB-CG2 3.67Å; L310-I325 HydrophobicContact CD1-CB 4.36Å; L310-I325 HydrophobicContact CD1-CG2 4.08Å; L310-I325 HydrophobicContact CD2-CG2 4.33Å; L310-I325 HydrophobicContact CG-CG2 4.24Å; L310-N326 WeakPolarHBondContact CD1-OD1 3.11Å; L310-L329 HydrophobicContact CD2-CD1 3.58Å; L310-V370 HydrophobicContact CD1-CG1 4.31Å; L310-V370 HydrophobicContact CD2-CG1 3.26Å; L310-V370 HydrophobicContact CG-CB 4.49Å; L310-V370 HydrophobicContact CG-CG1 3.45Å; L310-V370 VanDerWaalsContact CG-CG1 3.45Å; L310-V370 HydrophobicContact CG-CG2 4.2Å; L310-L374 HydrophobicContact CD2-CD1 3.96Å; L310-L374 HydrophobicContact CD2-CD2 4.38Å; L310-L374 HydrophobicContact CD2-CG 4.3Å
311L93.4Very high91.5Very high2 Ų231.6 Ų31.61%0.0116%0.159CC..Hα-helixtrans-65.6-42.1177.3-65.7170.5000111.7K307 K308 K315 L350 M353 A354 I357 L366 V367K307-L311 PolarHBondContact O-N 3.24Å; K308-L311 PolarHBondContact O-N 3.12Å; L311-K315 WeakPolarHBondContact O-CB 3.34Å; L311-K315 PolarHBondContact O-N 3.01Å; L311-L350 HydrophobicContact CD1-CD2 4.05Å; L311-L350 HydrophobicContact CD2-CD2 4.03Å; L311-L350 HydrophobicContact CG-CD2 3.82Å; L311-M353 HydrophobicContact CD1-CB 4.04Å; L311-A354 HydrophobicContact CD1-CB 3.92Å; L311-A354 HydrophobicContact CD2-CB 4.4Å; L311-I357 HydrophobicContact CB-CD1 4.08Å; L311-I357 HydrophobicContact CD1-CD1 3.83Å; L311-L366 HydrophobicContact CD2-CD2 4.29Å; L311-L366 HydrophobicContact CD2-CG 4.31Å; L311-V367 HydrophobicContact CD2-CG2 3.99Å
312V92.7Very high92.2Very high1 Ų132.9 Ų32.91%0.00616%0.164CC..Hα-helixtrans-67.3-42.1177.6176.10000111F266 F269 V270 K308 L309 E314 K315 Y316 I357F266-V312 HydrophobicContact CE1-CG2 4.42Å; F266-V312 HydrophobicContact CE2-CG2 4.26Å; F266-V312 HydrophobicContact CZ-CG2 3.58Å; F269-V312 HydrophobicContact CD1-CG1 4.48Å; F269-V312 HydrophobicContact CE1-CG1 3.76Å; V270-V312 HydrophobicContact CG2-CG1 4.36Å; V270-V312 HydrophobicContact CG2-CG2 3.82Å; K308-V312 WeakPolarHBondContact O-CG2 3.25Å; K308-V312 PolarHBondContact O-N 2.97Å; K308-V312 VanDerWaalsContact O-N 3.14Å; L309-V312 PolarHBondContact O-N 2.54Å; V312-E314 PolarHBondContact O-N 3.12Å; V312-K315 PolarHBondContact O-N 3.39Å; V312-Y316 HydrophobicContact CG1-CD2 3.69Å; V312-Y316 HydrophobicContact CG1-CE2 3.98Å; V312-Y316 VanDerWaalsContact O-CD2 3.29Å; V312-Y316 WeakPolarHBondContact O-CD2 3.3Å; V312-Y316 PolarHBondContact O-N 2.9Å; V312-I357 HydrophobicContact CG2-CG2 4.48Å
313S94.8Very high92.5Very high0 Ų029.6 Ų29.60%015%0.146CC..Hα-helixtrans-65.1-40.6-179.760.70000112.3L309 L310 N317 L318 K322L309-S313 VanDerWaalsContact O-CB 3.24Å; L309-S313 WeakPolarHBondContact O-CB 3.42Å; L309-S313 PolarHBondContact O-N 3.42Å; L309-S313 PolarHBondContact O-OG 3.49Å; L310-S313 WeakPolarHBondContact CA-OG 3.48Å; L310-S313 PolarHBondContact O-N 2.77Å; L310-S313 PolarHBondContact O-OG 3.31Å; S313-N317 CarbonylContact O-C 3.55Å; S313-N317 WeakPolarHBondContact O-CA 3.44Å; S313-N317 PolarHBondContact O-N 3.31Å; S313-L318 PolarHBondContact O-N 3.03Å; S313-K322 WeakPolarHBondContact OG-CA 3.23Å; S313-K322 WeakPolarHBondContact OG-CB 3.24Å
314E93.4Very high92.7Very high50 Ų5027.4 Ų27.423%0.23413%0.132CC..Hα-helixtrans-62.8-49.2172.5179.364.7-17800111.7L310 V312 Y316 N317 K322 L366 V370L310-E314 PolarHBondContact O-N 2.63Å; V312-E314 PolarHBondContact O-N 3.12Å; E314-Y316 PolarHBondContact O-N 3.26Å; E314-N317 PolarHBondContact O-N 3.19Å; E314-K322 IonicContact OE1-NZ 2.77Å; E314-K322 VanDerWaalsContact OE2-CD 3.22Å; E314-K322 WeakPolarHBondContact OE2-CD 3.42Å; E314-K322 WeakPolarHBondContact OE2-CE 3.39Å; E314-K322 IonicContact OE2-NZ 3.56Å; E314-K322 PolarHBondContact OE2-NZ 3.26Å; E314-L366 HydrophobicContact CB-CD1 3.76Å; E314-L366 HydrophobicContact CG-CD1 3.38Å; E314-V370 HydrophobicContact CB-CG2 3.76Å; E314-V370 HydrophobicContact CG-CG2 3.94Å
315K90.6Very high93Very high88 Ų8825.4 Ų25.438%0.38312%0.117SC..Hα-helixtrans-59.8-43.3-176.3-179.4-179.3176.4-166.30113.1L311 V312 L366L311-K315 WeakPolarHBondContact O-CB 3.34Å; L311-K315 PolarHBondContact O-N 3.01Å; V312-K315 PolarHBondContact O-N 3.39Å; K315-L366 HydrophobicContact CB-CD1 4.15Å
316Y91.8Very high93.1Very high16 Ų1622.6 Ų22.66%0.06311%0.106CC..THydrogen-bonded Turntrans-102.311.9-175.3-58.8-78.3000113.4V270 V273 E274 T277 R285 V312 E314V270-Y316 HydrophobicContact CG1-CE2 4.41Å; V273-Y316 VanDerWaalsContact CG1-CB 3.42Å; V273-Y316 HydrophobicContact CG1-CD1 4.06Å; V273-Y316 HydrophobicContact CG1-CD2 3.76Å; V273-Y316 HydrophobicContact CG1-CG 3.49Å; V273-Y316 VanDerWaalsContact CG1-CG 3.49Å; E274-Y316 HydrophobicContact CB-CE1 3.69Å; E274-Y316 HydrophobicContact CG-CE1 3.93Å; E274-Y316 PolarHBondContact OE2-OH 2.98Å; T277-Y316 HydrophobicContact CG2-CD1 4.46Å; R285-Y316 PolarHBondContact NH1-O 2.92Å; V312-Y316 HydrophobicContact CG1-CD2 3.69Å; V312-Y316 HydrophobicContact CG1-CE2 3.98Å; V312-Y316 VanDerWaalsContact O-CD2 3.29Å; V312-Y316 WeakPolarHBondContact O-CD2 3.3Å; V312-Y316 PolarHBondContact O-N 2.9Å; E314-Y316 PolarHBondContact O-N 3.26Å
317N91.8Very high93Very high76 Ų7622.6 Ų22.641%0.40611%0.106SC..THydrogen-bonded Turntrans54.251179-160.766000113.3S313 E314 E319S313-N317 CarbonylContact O-C 3.55Å; S313-N317 WeakPolarHBondContact O-CA 3.44Å; S313-N317 PolarHBondContact O-N 3.31Å; E314-N317 PolarHBondContact O-N 3.19Å; N317-E319 PolarHBondContact ND2-OE1 3.45Å; N317-E319 PolarHBondContact O-N 3.35Å
318L94.3Very high92.9Very high0 Ų023.3 Ų23.30%011%0.109CC..  trans-9074.6171.1-50.7179.7000108.6F269 V273 R285 E289 S313 I320 L321 K322F269-L318 HydrophobicContact CZ-CD1 4.09Å; V273-L318 HydrophobicContact CG1-CD1 4.2Å; V273-L318 HydrophobicContact CG1-CD2 4.31Å; V273-L318 HydrophobicContact CG2-CD1 4.29Å; R285-L318 HydrophobicContact CG-CD2 3.7Å; E289-L318 HydrophobicContact CB-CD2 4.39Å; E289-L318 HydrophobicContact CG-CB 4.2Å; E289-L318 VanDerWaalsContact OE1-CA 3.32Å; E289-L318 WeakPolarHBondContact OE1-CA 3.25Å; S313-L318 PolarHBondContact O-N 3.03Å; L318-I320 PolarHBondContact O-N 2.95Å; L318-L321 HydrophobicContact CB-CB 4.05Å; L318-L321 HydrophobicContact CB-CD2 4.39Å; L318-L321 HydrophobicContact CD1-CD2 3.9Å; L318-L321 PolarHBondContact O-N 3.22Å; L318-K322 WeakPolarHBondContact O-CB 3.43Å; L318-K322 PolarHBondContact O-N 3.35Å
319E92.7Very high92.8Very high107 Ų10721.1 Ų21.150%0.510%0.099SC..Hα-helixtrans-58.5-40.8-169.1-65.9172.9-165.100114.7E289 N317 M323E289-E319 PolarHBondContact OE1-N 3.3Å; E289-E319 VanDerWaalsContact OE1-N 3.14Å; N317-E319 PolarHBondContact ND2-OE1 3.45Å; N317-E319 PolarHBondContact O-N 3.35Å; E319-M323 WeakPolarHBondContact O-CB 3.42Å; E319-M323 PolarHBondContact O-N 3.33Å
320I93.1Very high92.7Very high9 Ų921.2 Ų21.25%0.04610%0.1CC..Hα-helixtrans-72.4-43.5-178.9-53.4-48.9000109.6P167 Y170 L171 E289 L318 M323 V324P167-I320 HydrophobicContact CB-CG2 4.16Å; P167-I320 WeakPolarHBondContact O-CG2 3.45Å; Y170-I320 VanDerWaalsContact CB-CD1 3.46Å; Y170-I320 HydrophobicContact CG-CD1 4.35Å; L171-I320 HydrophobicContact CD1-CG2 4.49Å; L171-I320 HydrophobicContact CD2-CB 4.12Å; L171-I320 HydrophobicContact CD2-CG1 3.7Å; L171-I320 HydrophobicContact CG-CB 4.37Å; L171-I320 HydrophobicContact CG-CG1 4.11Å; L171-I320 HydrophobicContact CG-CG2 4.29Å; E289-I320 WeakPolarHBondContact OE1-CA 3.37Å; E289-I320 WeakPolarHBondContact OE1-CB 3.29Å; E289-I320 PolarHBondContact OE1-N 2.93Å; L318-I320 PolarHBondContact O-N 2.95Å; I320-M323 HydrophobicContact CG2-CE 4.29Å; I320-M323 PolarHBondContact O-N 3.31Å; I320-V324 WeakPolarHBondContact O-CG2 3.44Å; I320-V324 PolarHBondContact O-N 3.45Å; I320-V324 VanDerWaalsContact O-N 3.07Å
321L94.6Very high92.3Very high0 Ų024.2 Ų24.20%012%0.116CC..Hα-helixtrans-61-47.2174.2179.361.6000110.9F269 E289 I292 V296 L309 L318 M323 V324 I325F269-L321 HydrophobicContact CZ-CD2 4.29Å; E289-L321 HydrophobicContact CG-CB 4.03Å; E289-L321 PolarHBondContact OE1-N 3.19Å; I292-L321 HydrophobicContact CG2-CD1 3.93Å; I292-L321 HydrophobicContact CG2-CD2 3.56Å; I292-L321 HydrophobicContact CG2-CG 4.27Å; V296-L321 HydrophobicContact CG2-CD1 4.36Å; L309-L321 HydrophobicContact CD2-CD2 4.42Å; L318-L321 HydrophobicContact CB-CB 4.05Å; L318-L321 HydrophobicContact CB-CD2 4.39Å; L318-L321 HydrophobicContact CD1-CD2 3.9Å; L318-L321 PolarHBondContact O-N 3.22Å; L321-M323 VanDerWaalsContact C-N 3.29Å; L321-M323 PolarHBondContact O-N 2.82Å; L321-V324 PolarHBondContact O-N 3.17Å; L321-I325 HydrophobicContact CD1-CD1 4.21Å; L321-I325 HydrophobicContact CD1-CG1 3.81Å; L321-I325 HydrophobicContact CG-CG1 4.16Å; L321-I325 WeakPolarHBondContact O-CB 3.49Å; L321-I325 WeakPolarHBondContact O-CG1 3.49Å; L321-I325 PolarHBondContact O-N 2.95Å
322K94.8Very high92Very high38 Ų3827 Ų2717%0.16513%0.129CC..Hα-helixtrans-55.1-46.4177.6-177.6-175.4172.2-1730111.1L310 S313 E314 L318 I325 N326 D373L310-K322 HydrophobicContact CD1-CG 3.92Å; S313-K322 WeakPolarHBondContact OG-CA 3.23Å; S313-K322 WeakPolarHBondContact OG-CB 3.24Å; E314-K322 IonicContact OE1-NZ 2.77Å; E314-K322 VanDerWaalsContact OE2-CD 3.22Å; E314-K322 WeakPolarHBondContact OE2-CD 3.42Å; E314-K322 WeakPolarHBondContact OE2-CE 3.39Å; E314-K322 IonicContact OE2-NZ 3.56Å; E314-K322 PolarHBondContact OE2-NZ 3.26Å; L318-K322 WeakPolarHBondContact O-CB 3.43Å; L318-K322 PolarHBondContact O-N 3.35Å; K322-I325 PolarHBondContact O-N 3.13Å; K322-N326 VanDerWaalsContact O-CB 3.26Å; K322-N326 WeakPolarHBondContact O-CB 3.4Å; K322-N326 PolarHBondContact O-N 3.42Å; K322-D373 WeakPolarHBondContact CE-OD2 3.41Å; K322-D373 IonicContact NZ-OD2 3.46Å; K322-D373 PolarHBondContact NZ-OD2 2.95Å
323M92.6Very high91.9Very high22 Ų2227 Ų2711%0.10813%0.129CC..Hα-helixtrans-58.3-51.7177.3177.4-171.26100111.8V53 P89 Y170 E319 I320 L321 I325 N326 G327V53-M323 HydrophobicContact CB-CE 4.35Å; V53-M323 HydrophobicContact CB-SD 4.45Å; V53-M323 HydrophobicContact CG1-CE 4.04Å; V53-M323 HydrophobicContact CG1-SD 3.88Å; V53-M323 HydrophobicContact CG2-CE 3.86Å; P89-M323 HydrophobicContact CB-CE 4.01Å; P89-M323 HydrophobicContact CB-SD 3.64Å; P89-M323 HydrophobicContact CG-SD 4.06Å; Y170-M323 HydrophobicContact CD2-CE 4.29Å; E319-M323 WeakPolarHBondContact O-CB 3.42Å; E319-M323 PolarHBondContact O-N 3.33Å; I320-M323 HydrophobicContact CG2-CE 4.29Å; I320-M323 PolarHBondContact O-N 3.31Å; L321-M323 VanDerWaalsContact C-N 3.29Å; L321-M323 PolarHBondContact O-N 2.82Å; M323-I325 VanDerWaalsContact C-N 3.33Å; M323-I325 PolarHBondContact O-N 3.3Å; M323-N326 PolarHBondContact O-N 2.87Å; M323-G327 PolarHBondContact O-N 3.43Å
324V91.8Very high91.5Very high0 Ų029.5 Ų29.50%014%0.142CC..Hα-helixtrans-60.2-45-178.9175.60000111.1H52 P167 V296 I320 L321 G327 F328H52-V324 HydrophobicContact CB-CG1 4.28Å; H52-V324 WeakPolarHBondContact CB-O 3.42Å; P167-V324 HydrophobicContact CB-CG2 3.44Å; P167-V324 VanDerWaalsContact CB-CG2 3.44Å; P167-V324 HydrophobicContact CG-CG2 3.44Å; P167-V324 VanDerWaalsContact CG-CG2 3.44Å; V296-V324 HydrophobicContact CG1-CG1 3.53Å; I320-V324 WeakPolarHBondContact O-CG2 3.44Å; I320-V324 PolarHBondContact O-N 3.45Å; I320-V324 VanDerWaalsContact O-N 3.07Å; L321-V324 PolarHBondContact O-N 3.17Å; V324-G327 PolarHBondContact O-N 2.94Å; V324-F328 WeakPolarHBondContact O-CB 3.23Å; V324-F328 PolarHBondContact O-N 3.41Å
325I94.3Very high91.1Very high0 Ų030.5 Ų30.50%017%0.165CC..Hα-helixtrans-67.4-40.5179.9-61.6-65.9000111.6V296 M301 A306 L309 L310 L321 K322 M323 G327 F328 L329V296-I325 HydrophobicContact CG1-CD1 4.3Å; V296-I325 HydrophobicContact CG2-CD1 4.03Å; M301-I325 HydrophobicContact CE-CD1 3.64Å; M301-I325 HydrophobicContact SD-CD1 3.5Å; M301-I325 WeakPolarHBondContact SD-CD1 3.39Å; A306-I325 HydrophobicContact CB-CG2 4.32Å; A306-I325 WeakPolarHBondContact O-CG2 3.42Å; L309-I325 HydrophobicContact CB-CD1 4.12Å; L309-I325 HydrophobicContact CB-CG1 4.23Å; L309-I325 HydrophobicContact CD1-CD1 4Å; L310-I325 HydrophobicContact CB-CG2 3.67Å; L310-I325 HydrophobicContact CD1-CB 4.36Å; L310-I325 HydrophobicContact CD1-CG2 4.08Å; L310-I325 HydrophobicContact CD2-CG2 4.33Å; L310-I325 HydrophobicContact CG-CG2 4.24Å; L321-I325 HydrophobicContact CD1-CD1 4.21Å; L321-I325 HydrophobicContact CD1-CG1 3.81Å; L321-I325 HydrophobicContact CG-CG1 4.16Å; L321-I325 WeakPolarHBondContact O-CB 3.49Å; L321-I325 WeakPolarHBondContact O-CG1 3.49Å; L321-I325 PolarHBondContact O-N 2.95Å; K322-I325 PolarHBondContact O-N 3.13Å; M323-I325 VanDerWaalsContact C-N 3.33Å; M323-I325 PolarHBondContact O-N 3.3Å; I325-G327 VanDerWaalsContact C-N 3.32Å; I325-G327 PolarHBondContact O-N 2.88Å; I325-F328 PolarHBondContact O-N 3.43Å; I325-L329 HydrophobicContact CG2-CD1 4.35Å; I325-L329 WeakPolarHBondContact O-CG 3.38Å; I325-L329 PolarHBondContact O-N 3.09Å
326N92.6Very high90.9Very high13 Ų1328.8 Ų28.87%0.0716%0.16CC..Hα-helixtrans-58.6-45.9172.8-88.4-25000111.1L310 K322 M323 L329 V330 L374 L377L310-N326 WeakPolarHBondContact CD1-OD1 3.11Å; K322-N326 VanDerWaalsContact O-CB 3.26Å; K322-N326 WeakPolarHBondContact O-CB 3.4Å; K322-N326 PolarHBondContact O-N 3.42Å; M323-N326 PolarHBondContact O-N 2.87Å; N326-L329 PolarHBondContact O-N 3.03Å; N326-V330 WeakPolarHBondContact O-CB 3.16Å; N326-V330 VanDerWaalsContact O-CG2 3.23Å; N326-V330 WeakPolarHBondContact O-CG2 3.37Å; N326-V330 PolarHBondContact O-N 3.02Å; N326-L374 HydrophobicContact CB-CD2 4.46Å; N326-L374 VanDerWaalsContact OD1-CD2 3.31Å; N326-L374 WeakPolarHBondContact OD1-CD2 3.48Å; N326-L377 HydrophobicContact CB-CD2 4.04Å
327G90Very high90.2Very high0 Ų034 Ų340%020%0.199CC..Hα-helixtrans-58.3-49.7175.800000113.3M323 V324 I325 L329 V330 D331M323-G327 PolarHBondContact O-N 3.43Å; V324-G327 PolarHBondContact O-N 2.94Å; I325-G327 VanDerWaalsContact C-N 3.32Å; I325-G327 PolarHBondContact O-N 2.88Å; G327-L329 PolarHBondContact O-N 2.89Å; G327-V330 PolarHBondContact O-N 3.05Å; G327-D331 VanDerWaalsContact O-CG 3.23Å; G327-D331 PolarHBondContact O-N 2.56Å
328F90.7Very high90Very high22 Ų2233.9 Ų33.910%0.09620%0.198CC..Hα-helixtrans-56.4-48.8177.8175.9-101.2000112.4H52 M301 A306 V324 I325 D331 Q332H52-F328 AromaticContact CE1-CD2 3.95Å; H52-F328 WeakPolarHBondContact ND1-CA 3.49Å; M301-F328 HydrophobicContact CB-CE1 4.12Å; M301-F328 HydrophobicContact CB-CE2 4.15Å; M301-F328 HydrophobicContact CB-CZ 3.76Å; M301-F328 HydrophobicContact CE-CD1 4.28Å; M301-F328 HydrophobicContact CE-CD2 4.48Å; M301-F328 HydrophobicContact CE-CG 4.24Å; M301-F328 HydrophobicContact CG-CE1 4.45Å; M301-F328 VanDerWaalsContact O-CZ 3.26Å; M301-F328 WeakPolarHBondContact O-CZ 3.41Å; M301-F328 HydrophobicContact SD-CD1 4.32Å; M301-F328 HydrophobicContact SD-CE1 4.28Å; A306-F328 HydrophobicContact CB-CD1 3.78Å; A306-F328 HydrophobicContact CB-CE1 3.73Å; V324-F328 WeakPolarHBondContact O-CB 3.23Å; V324-F328 PolarHBondContact O-N 3.41Å; I325-F328 PolarHBondContact O-N 3.43Å; F328-D331 PolarHBondContact O-N 3.49Å; F328-Q332 PolarHBondContact O-N 3.04Å
329L91.8Very high89.5Confident0 Ų035 Ų350%021%0.206CC..Hα-helixtrans-68.5-36.4178.7-68.3-178.1000112.5A306 K307 L310 I325 N326 G327 D331 Q332 I333 L374A306-L329 HydrophobicContact CB-CD2 4.01Å; A306-L329 HydrophobicContact CB-CG 4.48Å; K307-L329 HydrophobicContact CG-CD1 4.23Å; K307-L329 HydrophobicContact CG-CD2 4.37Å; L310-L329 HydrophobicContact CD2-CD1 3.58Å; I325-L329 HydrophobicContact CG2-CD1 4.35Å; I325-L329 WeakPolarHBondContact O-CG 3.38Å; I325-L329 PolarHBondContact O-N 3.09Å; N326-L329 PolarHBondContact O-N 3.03Å; G327-L329 PolarHBondContact O-N 2.89Å; L329-D331 VanDerWaalsContact C-N 3.35Å; L329-Q332 WeakPolarHBondContact O-CB 3.05Å; L329-Q332 PolarHBondContact O-N 2.91Å; L329-I333 WeakPolarHBondContact O-CD1 3.3Å; L329-I333 WeakPolarHBondContact O-CG1 3.47Å; L329-I333 PolarHBondContact O-N 2.9Å; L329-L374 HydrophobicContact CB-CD2 3.97Å; L329-L374 HydrophobicContact CD1-CD1 4.27Å; L329-L374 HydrophobicContact CD1-CD2 4.38Å
330V90.7Very high89.3Confident1 Ų133.7 Ų33.71%0.00621%0.206CC..Hα-helixtrans-64.4-41.1176.1167.10000111.4N326 G327 Q332 I333 I334 L374 L377 V381N326-V330 WeakPolarHBondContact O-CB 3.16Å; N326-V330 VanDerWaalsContact O-CG2 3.23Å; N326-V330 WeakPolarHBondContact O-CG2 3.37Å; N326-V330 PolarHBondContact O-N 3.02Å; G327-V330 PolarHBondContact O-N 3.05Å; V330-Q332 VanDerWaalsContact C-N 3.29Å; V330-Q332 PolarHBondContact O-N 3.35Å; V330-I333 PolarHBondContact O-N 2.9Å; V330-I334 HydrophobicContact CG1-CD1 3.54Å; V330-I334 HydrophobicContact CG1-CG1 4.18Å; V330-I334 WeakPolarHBondContact O-CB 3.08Å; V330-I334 VanDerWaalsContact O-CG1 3.28Å; V330-I334 WeakPolarHBondContact O-CG1 3.37Å; V330-I334 PolarHBondContact O-N 3.49Å; V330-L374 HydrophobicContact CG2-CD2 4.05Å; V330-L377 HydrophobicContact CB-CD2 4.49Å; V330-L377 HydrophobicContact CG1-CG 4.49Å; V330-L377 HydrophobicContact CG2-CB 4.01Å; V330-L377 HydrophobicContact CG2-CD2 3.86Å; V330-L377 HydrophobicContact CG2-CG 3.93Å; V330-V381 HydrophobicContact CG1-CB 4.17Å; V330-V381 HydrophobicContact CG1-CG1 4.47Å; V330-V381 HydrophobicContact CG1-CG2 4.16Å
331D86.6Confident89.1Confident64 Ų6439.5 Ų39.534%0.34223%0.231SC..Hα-helixtrans-60.9-40.5176-67.2-26.4000110.8H52 G327 F328 L329 G335H52-D331 IonicContact CE1-OD2 2.74Å; H52-D331 PolarHBondContact CE1-OD2 3.3Å; H52-D331 IonicContact ND1-OD2 3.41Å; H52-D331 PolarHBondContact ND1-OD2 3.23Å; G327-D331 VanDerWaalsContact O-CG 3.23Å; G327-D331 PolarHBondContact O-N 2.56Å; F328-D331 PolarHBondContact O-N 3.49Å; L329-D331 VanDerWaalsContact C-N 3.35Å; D331-G335 PolarHBondContact O-N 3.06Å
332Q87.1Confident88.9Confident60 Ų6041.2 Ų41.228%0.2824%0.239SC..Hα-helixtrans-64.4-45.2172.9-68-172.87.500113F328 L329 V330 I334 G335 N336F328-Q332 PolarHBondContact O-N 3.04Å; L329-Q332 WeakPolarHBondContact O-CB 3.05Å; L329-Q332 PolarHBondContact O-N 2.91Å; V330-Q332 VanDerWaalsContact C-N 3.29Å; V330-Q332 PolarHBondContact O-N 3.35Å; Q332-I334 VanDerWaalsContact C-N 3.32Å; Q332-I334 PolarHBondContact O-N 3.38Å; Q332-G335 PolarHBondContact O-N 3.25Å; Q332-N336 PolarHBondContact O-N 2.99Å; Q332-N336 VanDerWaalsContact O-N 3.09Å
333I89.6Confident88.6Confident0 Ų040.5 Ų40.50%024%0.237CC..Hα-helixtrans-61.1-43.4179-69.3158.2000110.5L329 V330 N336 P339 E342 L343 I346 T378L329-I333 WeakPolarHBondContact O-CD1 3.3Å; L329-I333 WeakPolarHBondContact O-CG1 3.47Å; L329-I333 PolarHBondContact O-N 2.9Å; V330-I333 PolarHBondContact O-N 2.9Å; I333-N336 WeakPolarHBondContact O-CB 3.37Å; I333-N336 PolarHBondContact O-N 3.46Å; I333-P339 HydrophobicContact CG2-CB 3.97Å; I333-P339 VanDerWaalsContact O-CB 3.24Å; I333-P339 WeakPolarHBondContact O-CB 3.31Å; I333-P339 WeakPolarHBondContact O-CG 3.21Å; I333-E342 HydrophobicContact CG1-CG 4.19Å; I333-L343 HydrophobicContact CD1-CD1 3.98Å; I333-I346 HydrophobicContact CD1-CD1 3.68Å; I333-I346 HydrophobicContact CG1-CD1 3.43Å; I333-I346 VanDerWaalsContact CG1-CD1 3.43Å; I333-T378 HydrophobicContact CG2-CG2 3.75Å
334I86.6Confident88.5Confident54 Ų5443.1 Ų43.128%0.27725%0.254SS..Hα-helixtrans-72.1-37.7-179.4-66.7174.2000111.1V330 Q332 N336 T378 V381 R382V330-I334 HydrophobicContact CG1-CD1 3.54Å; V330-I334 HydrophobicContact CG1-CG1 4.18Å; V330-I334 WeakPolarHBondContact O-CB 3.08Å; V330-I334 VanDerWaalsContact O-CG1 3.28Å; V330-I334 WeakPolarHBondContact O-CG1 3.37Å; V330-I334 PolarHBondContact O-N 3.49Å; Q332-I334 VanDerWaalsContact C-N 3.32Å; Q332-I334 PolarHBondContact O-N 3.38Å; I334-N336 PolarHBondContact O-N 3.3Å; I334-T378 HydrophobicContact CG1-CG2 4.22Å; I334-V381 HydrophobicContact CD1-CB 3.75Å; I334-V381 HydrophobicContact CD1-CG1 3.55Å; I334-R382 HydrophobicContact CD1-CG 3.79Å; I334-R382 HydrophobicContact CG1-CG 3.78Å; I334-R382 HydrophobicContact CG2-CG 4.27Å
335G84.4Confident88.4Confident70 Ų7046.1 Ų46.172%0.72227%0.27SS*.Hα-helixtrans-67.2-16.7174.500000114D331 Q332D331-G335 PolarHBondContact O-N 3.06Å; Q332-G335 PolarHBondContact O-N 3.25Å
336N87.7Confident88.2Confident52 Ų5246.2 Ų46.228%0.27827%0.271SS..SBendtrans-74.4143.1178.9-163.2-58.4000112.3Q332 I333 I334 N338 P339 E342Q332-N336 PolarHBondContact O-N 2.99Å; Q332-N336 VanDerWaalsContact O-N 3.09Å; I333-N336 WeakPolarHBondContact O-CB 3.37Å; I333-N336 PolarHBondContact O-N 3.46Å; I334-N336 PolarHBondContact O-N 3.3Å; N336-N338 PolarHBondContact O-N 3.3Å; N336-N338 PolarHBondContact OD1-N 2.91Å; N336-P339 VanDerWaalsContact O-CD 3.32Å; N336-P339 WeakPolarHBondContact O-CD 3.27Å; N336-P339 WeakPolarHBondContact O-CG 3.42Å; N336-E342 HydrophobicContact CB-CB 4.17Å; N336-E342 HydrophobicContact CB-CG 4.22Å; N336-E342 PolarHBondContact ND2-OE2 3.38Å
337S77.1Confident88.1Confident125 Ų12546.9 Ų46.987%0.87428%0.276SS*.SBendtrans-58-27.8174.464.70000114.7
338N86.4Confident88.1Confident75 Ų7552.3 Ų52.340%0.40130%0.3SS..  trans-134.382176.8-170.7-20.3000110.9N336 P340 K341 E342N336-N338 PolarHBondContact O-N 3.3Å; N336-N338 PolarHBondContact OD1-N 2.91Å; N338-P340 WeakPolarHBondContact OD1-CD 3.42Å; N338-K341 HydrophobicContact CB-CB 4.12Å; N338-K341 PolarHBondContact O-N 3.47Å; N338-K341 VanDerWaalsContact O-N 3.15Å; N338-K341 PolarHBondContact OD1-N 2.93Å; N338-E342 PolarHBondContact O-N 3.47Å
339P85.4Confident88.2Confident23 Ų2354.4 Ų54.415%0.14931%0.311CS..Hα-helixtrans-61-37.4-175.2-26.536.4000115.5I333 N336 K341 E342 L343 R382I333-P339 HydrophobicContact CG2-CB 3.97Å; I333-P339 VanDerWaalsContact O-CB 3.24Å; I333-P339 WeakPolarHBondContact O-CB 3.31Å; I333-P339 WeakPolarHBondContact O-CG 3.21Å; N336-P339 VanDerWaalsContact O-CD 3.32Å; N336-P339 WeakPolarHBondContact O-CD 3.27Å; N336-P339 WeakPolarHBondContact O-CG 3.42Å; P339-K341 VanDerWaalsContact C-N 3.34Å; P339-K341 PolarHBondContact O-N 3.48Å; P339-E342 PolarHBondContact O-N 2.83Å; P339-L343 WeakPolarHBondContact O-CB 3.28Å; P339-L343 PolarHBondContact O-N 3.27Å; P339-R382 VanDerWaalsContact CB-CZ 3.44Å
340P87.1Confident88.1Confident80 Ų8054.4 Ų54.452%0.51931%0.311SS..Hα-helixtrans-59.9-40.8173.1-25.734.6000113.6N338 V344N338-P340 WeakPolarHBondContact OD1-CD 3.42Å; P340-V344 WeakPolarHBondContact O-CG2 3.41Å; P340-V344 PolarHBondContact O-N 3.47Å
341K88.9Confident88Confident130 Ų13058.4 Ų58.457%0.56533%0.329SS*.Hα-helixtrans-67.6-42.3178.2-174.6-177.3178.2-173.20111N338 P339 L343 V344 N345N338-K341 HydrophobicContact CB-CB 4.12Å; N338-K341 PolarHBondContact O-N 3.47Å; N338-K341 VanDerWaalsContact O-N 3.15Å; N338-K341 PolarHBondContact OD1-N 2.93Å; P339-K341 VanDerWaalsContact C-N 3.34Å; P339-K341 PolarHBondContact O-N 3.48Å; K341-L343 VanDerWaalsContact C-N 3.29Å; K341-L343 PolarHBondContact O-N 2.92Å; K341-V344 PolarHBondContact O-N 2.95Å; K341-N345 PolarHBondContact O-N 2.79Å
342E89.9Confident88.1Confident36 Ų3661.3 Ų61.317%0.16834%0.341CS..Hα-helixtrans-60.2-41.6178.3-170.456.2-15400111.9I333 N336 N338 P339 V344 N345 I346I333-E342 HydrophobicContact CG1-CG 4.19Å; N336-E342 HydrophobicContact CB-CB 4.17Å; N336-E342 HydrophobicContact CB-CG 4.22Å; N336-E342 PolarHBondContact ND2-OE2 3.38Å; N338-E342 PolarHBondContact O-N 3.47Å; P339-E342 PolarHBondContact O-N 2.83Å; E342-V344 VanDerWaalsContact C-N 3.31Å; E342-V344 PolarHBondContact O-N 3.37Å; E342-N345 WeakPolarHBondContact O-CB 2.98Å; E342-N345 PolarHBondContact O-N 2.7Å; E342-N345 VanDerWaalsContact O-N 3.17Å; E342-I346 HydrophobicContact CG-CD1 4.1Å; E342-I346 WeakPolarHBondContact O-CG1 3.01Å; E342-I346 PolarHBondContact O-N 3.25Å
343L89.4Confident88.2Confident23 Ų2359.2 Ų59.212%0.1233%0.331CS..Hα-helixtrans-62.9-36.6177.2-172.458.9000113I333 P339 K341 T347 L374 Q375I333-L343 HydrophobicContact CD1-CD1 3.98Å; P339-L343 WeakPolarHBondContact O-CB 3.28Å; P339-L343 PolarHBondContact O-N 3.27Å; K341-L343 VanDerWaalsContact C-N 3.29Å; K341-L343 PolarHBondContact O-N 2.92Å; L343-T347 WeakPolarHBondContact O-CB 3.38Å; L343-T347 PolarHBondContact O-N 3Å; L343-T347 PolarHBondContact O-OG1 3.26Å; L343-L374 HydrophobicContact CD1-CB 4.14Å; L343-Q375 HydrophobicContact CD1-CG 4.26Å; L343-Q375 HydrophobicContact CD2-CB 4.31Å; L343-Q375 HydrophobicContact CD2-CG 3.44Å; L343-Q375 VanDerWaalsContact CD2-CG 3.44Å; L343-Q375 HydrophobicContact CG-CG 4.1Å
344V90.4Very high88Confident78 Ų7859.6 Ų59.647%0.47333%0.334SS..Hα-helixtrans-67.6-42174173.10000111P340 K341 E342 T347 H348P340-V344 WeakPolarHBondContact O-CG2 3.41Å; P340-V344 PolarHBondContact O-N 3.47Å; K341-V344 PolarHBondContact O-N 2.95Å; E342-V344 VanDerWaalsContact C-N 3.31Å; E342-V344 PolarHBondContact O-N 3.37Å; V344-T347 WeakPolarHBondContact O-CB 3.33Å; V344-T347 PolarHBondContact O-N 3.36Å; V344-H348 PolarHBondContact O-CD2 2.85Å; V344-H348 PolarHBondContact O-N 2.92Å
345N90.2Very high87.7Confident63 Ų6362.8 Ų62.834%0.33735%0.348SS..Hα-helixtrans-60.3-50175.8-69.2-11.5000111.4K341 E342 T347 H348 E349K341-N345 PolarHBondContact O-N 2.79Å; E342-N345 WeakPolarHBondContact O-CB 2.98Å; E342-N345 PolarHBondContact O-N 2.7Å; E342-N345 VanDerWaalsContact O-N 3.17Å; N345-T347 VanDerWaalsContact C-N 3.25Å; N345-T347 PolarHBondContact O-N 3.34Å; N345-H348 PolarHBondContact O-N 3.18Å; N345-H348 VanDerWaalsContact O-N 3.14Å; N345-E349 PolarHBondContact O-N 2.95Å
346I90.6Very high87.4Confident1 Ų164.7 Ų64.71%0.00534%0.338CS..Hα-helixtrans-58-40.7177.1-68.4170.4000110.7I333 E342 H348 E349 L350 L374I333-I346 HydrophobicContact CD1-CD1 3.68Å; I333-I346 HydrophobicContact CG1-CD1 3.43Å; I333-I346 VanDerWaalsContact CG1-CD1 3.43Å; E342-I346 HydrophobicContact CG-CD1 4.1Å; E342-I346 WeakPolarHBondContact O-CG1 3.01Å; E342-I346 PolarHBondContact O-N 3.25Å; I346-H348 PolarHBondContact O-N 3.38Å; I346-E349 PolarHBondContact O-N 2.91Å; I346-L350 HydrophobicContact CG2-CD1 3.77Å; I346-L350 HydrophobicContact CG2-CG 4.18Å; I346-L350 WeakPolarHBondContact O-CB 3.48Å; I346-L350 VanDerWaalsContact O-CG 3.25Å; I346-L350 WeakPolarHBondContact O-CG 3.41Å; I346-L350 PolarHBondContact O-N 3.33Å; I346-L374 HydrophobicContact CG2-CD1 4.09Å
347T89.9Confident86.8Confident28 Ų2863.8 Ų63.817%0.17233%0.333CS..Hα-helixtrans-59.2-47.9176.6-60.40000111.7L343 V344 N345 L350 Q351 V371L343-T347 WeakPolarHBondContact O-CB 3.38Å; L343-T347 PolarHBondContact O-N 3Å; L343-T347 PolarHBondContact O-OG1 3.26Å; V344-T347 WeakPolarHBondContact O-CB 3.33Å; V344-T347 PolarHBondContact O-N 3.36Å; N345-T347 VanDerWaalsContact C-N 3.25Å; N345-T347 PolarHBondContact O-N 3.34Å; T347-L350 PolarHBondContact O-N 2.63Å; T347-Q351 WeakPolarHBondContact O-CG 3.37Å; T347-Q351 PolarHBondContact O-N 3.1Å; T347-V371 HydrophobicContact CG2-CG1 4.24Å; T347-V371 HydrophobicContact CG2-CG2 3.91Å; T347-V371 WeakPolarHBondContact OG1-CG1 3.49Å
348H89.8Confident86.2Confident113 Ų11363.8 Ų63.852%0.52331%0.313SS..Hα-helixtrans-64.7-40.5178.1-80-60.3000112.8V344 N345 I346 Q351 Q352V344-H348 PolarHBondContact O-CD2 2.85Å; V344-H348 PolarHBondContact O-N 2.92Å; N345-H348 PolarHBondContact O-N 3.18Å; N345-H348 VanDerWaalsContact O-N 3.14Å; I346-H348 PolarHBondContact O-N 3.38Å; H348-Q351 PolarHBondContact ND1-OE1 3.02Å; H348-Q351 WeakPolarHBondContact O-CB 3.28Å; H348-Q351 PolarHBondContact O-N 3.15Å; H348-Q352 PolarHBondContact O-N 3.24Å
349E91.6Very high84.8Confident66 Ų6668.1 Ų68.131%0.30833%0.331SS..Hα-helixtrans-65.7-41.4176.6-72.4179.4-129.900112.2K307 N345 I346 Q351 Q352 M353K307-E349 HydrophobicContact CD-CB 4.2Å; K307-E349 IonicContact NZ-OE1 3.77Å; K307-E349 PolarHBondContact NZ-OE1 3.45Å; K307-E349 IonicContact NZ-OE2 3.86Å; K307-E349 PolarHBondContact NZ-OE2 3.47Å; N345-E349 PolarHBondContact O-N 2.95Å; I346-E349 PolarHBondContact O-N 2.91Å; E349-Q351 VanDerWaalsContact C-N 3.31Å; E349-Q351 PolarHBondContact O-N 3.23Å; E349-Q352 PolarHBondContact O-N 3.09Å; E349-M353 HydrophobicContact CB-CE 4.36Å; E349-M353 WeakPolarHBondContact O-CB 3.22Å; E349-M353 VanDerWaalsContact O-CG 3.29Å; E349-M353 WeakPolarHBondContact O-CG 3.28Å; E349-M353 PolarHBondContact O-N 3.5Å
350L91.6Very high83.3Confident0 Ų074 Ų740%036%0.361CS..Hα-helixtrans-61.5-40.8174.5-74.6169.4000111.4K307 L311 I346 T347 A354 V367 V370 V371 L374K307-L350 HydrophobicContact CB-CD2 3.73Å; K307-L350 HydrophobicContact CG-CD2 4.15Å; K307-L350 WeakPolarHBondContact O-CD2 3.48Å; L311-L350 HydrophobicContact CD1-CD2 4.05Å; L311-L350 HydrophobicContact CD2-CD2 4.03Å; L311-L350 HydrophobicContact CG-CD2 3.82Å; I346-L350 HydrophobicContact CG2-CD1 3.77Å; I346-L350 HydrophobicContact CG2-CG 4.18Å; I346-L350 WeakPolarHBondContact O-CB 3.48Å; I346-L350 VanDerWaalsContact O-CG 3.25Å; I346-L350 WeakPolarHBondContact O-CG 3.41Å; I346-L350 PolarHBondContact O-N 3.33Å; T347-L350 PolarHBondContact O-N 2.63Å; L350-A354 VanDerWaalsContact O-CB 3.23Å; L350-A354 WeakPolarHBondContact O-CB 3.47Å; L350-A354 PolarHBondContact O-N 3.26Å; L350-V367 HydrophobicContact CB-CG1 4.09Å; L350-V370 HydrophobicContact CD1-CG1 3.86Å; L350-V371 HydrophobicContact CD1-CG2 4.06Å; L350-L374 HydrophobicContact CD1-CD1 4.22Å
351Q88.7Confident82.1Confident86 Ų8678.8 Ų78.840%0.40238%0.377SS..Hα-helixtrans-58.4-50.6173.2-72.7175.2-22.800110.5T347 H348 E349 A354 H355 V367T347-Q351 WeakPolarHBondContact O-CG 3.37Å; T347-Q351 PolarHBondContact O-N 3.1Å; H348-Q351 PolarHBondContact ND1-OE1 3.02Å; H348-Q351 WeakPolarHBondContact O-CB 3.28Å; H348-Q351 PolarHBondContact O-N 3.15Å; E349-Q351 VanDerWaalsContact C-N 3.31Å; E349-Q351 PolarHBondContact O-N 3.23Å; Q351-A354 PolarHBondContact O-N 2.88Å; Q351-H355 PolarHBondContact O-N 3.16Å; Q351-H355 PolarHBondContact O-ND1 2.85Å; Q351-V367 HydrophobicContact CG-CG1 3.85Å
352Q88.1Confident81.4Confident125 Ų12577.7 Ų77.758%0.58438%0.377SS*.Hα-helixtrans-60.8-49.3179.7-175.6179.5-1400112.1H348 E349 A354 H355 E356H348-Q352 PolarHBondContact O-N 3.24Å; E349-Q352 PolarHBondContact O-N 3.09Å; Q352-A354 VanDerWaalsContact C-N 3.3Å; Q352-A354 PolarHBondContact O-N 3.03Å; Q352-H355 WeakPolarHBondContact O-CB 3.35Å; Q352-H355 PolarHBondContact O-N 3.47Å; Q352-E356 PolarHBondContact O-N 3.47Å
353M89.1Confident81Confident16 Ų1677.7 Ų77.78%0.07938%0.378CS..Hα-helixtrans-64.7-33.1-179.1-69.1177.9-168.700112.7S304 K307 K308 L311 E349 H355 E356 I357S304-M353 WeakPolarHBondContact OG-CE 3.29Å; K307-M353 HydrophobicContact CB-CE 4.34Å; K307-M353 HydrophobicContact CB-SD 3.65Å; K307-M353 HydrophobicContact CD-CE 4.25Å; K308-M353 HydrophobicContact CG-CB 4.4Å; K308-M353 HydrophobicContact CG-CG 4.31Å; K308-M353 HydrophobicContact CG-SD 3.69Å; L311-M353 HydrophobicContact CD1-CB 4.04Å; E349-M353 HydrophobicContact CB-CE 4.36Å; E349-M353 WeakPolarHBondContact O-CB 3.22Å; E349-M353 VanDerWaalsContact O-CG 3.29Å; E349-M353 WeakPolarHBondContact O-CG 3.28Å; E349-M353 PolarHBondContact O-N 3.5Å; M353-H355 VanDerWaalsContact C-N 3.25Å; M353-H355 PolarHBondContact O-N 2.68Å; M353-E356 WeakPolarHBondContact O-CB 3.24Å; M353-E356 PolarHBondContact O-N 2.98Å; M353-E356 VanDerWaalsContact O-N 3.08Å; M353-I357 VanDerWaalsContact O-CG1 3.31Å; M353-I357 WeakPolarHBondContact O-CG1 3.21Å; M353-I357 PolarHBondContact O-N 2.94Å
354A85.1Confident80.7Confident7 Ų784.8 Ų84.86%0.05841%0.411CS..Hα-helixtrans-63.4-33.917700000112.2L311 L350 Q351 Q352 I357 R358 I363 V367L311-A354 HydrophobicContact CD1-CB 3.92Å; L311-A354 HydrophobicContact CD2-CB 4.4Å; L350-A354 VanDerWaalsContact O-CB 3.23Å; L350-A354 WeakPolarHBondContact O-CB 3.47Å; L350-A354 PolarHBondContact O-N 3.26Å; Q351-A354 PolarHBondContact O-N 2.88Å; Q352-A354 VanDerWaalsContact C-N 3.3Å; Q352-A354 PolarHBondContact O-N 3.03Å; A354-I357 PolarHBondContact O-N 3.39Å; A354-R358 PolarHBondContact O-N 2.65Å; A354-I363 HydrophobicContact CB-CG2 3.56Å; A354-V367 HydrophobicContact CB-CG2 3.67Å
355H81.3Confident80.5Confident122 Ų12286 Ų8657%0.56542%0.415SS*.Hα-helixtrans-70.3-32.1173-65.979.9000112.1Q351 Q352 M353Q351-H355 PolarHBondContact O-N 3.16Å; Q351-H355 PolarHBondContact O-ND1 2.85Å; Q352-H355 WeakPolarHBondContact O-CB 3.35Å; Q352-H355 PolarHBondContact O-N 3.47Å; M353-H355 VanDerWaalsContact C-N 3.25Å; M353-H355 PolarHBondContact O-N 2.68Å
356E77.6Confident80.4Confident110 Ų11084.9 Ų84.951%0.51441%0.408SS..Hα-helixtrans-71.4-35.3174.7-64.6174.2-170.200112.3K308 Q352 M353K308-E356 IonicContact NZ-OE2 2.6Å; K308-E356 PolarHBondContact NZ-OE2 3.38Å; K308-E356 VanDerWaalsContact NZ-OE2 3.09Å; Q352-E356 PolarHBondContact O-N 3.47Å; M353-E356 WeakPolarHBondContact O-CB 3.24Å; M353-E356 PolarHBondContact O-N 2.98Å; M353-E356 VanDerWaalsContact O-N 3.08Å
357I75Confident80.4Confident33 Ų3385.1 Ų85.117%0.16941%0.409CS..Hα-helixtrans-75.1-24.9-178.5-66.9167.6000111.4F266 K308 L311 V312 M353 A354F266-I357 HydrophobicContact CE1-CD1 4.5Å; F266-I357 HydrophobicContact CE1-CG1 4.34Å; F266-I357 HydrophobicContact CZ-CD1 4.43Å; K308-I357 HydrophobicContact CB-CD1 4.14Å; K308-I357 HydrophobicContact CG-CD1 4.23Å; L311-I357 HydrophobicContact CB-CD1 4.08Å; L311-I357 HydrophobicContact CD1-CD1 3.83Å; V312-I357 HydrophobicContact CG2-CG2 4.48Å; M353-I357 VanDerWaalsContact O-CG1 3.31Å; M353-I357 WeakPolarHBondContact O-CG1 3.21Å; M353-I357 PolarHBondContact O-N 2.94Å; A354-I357 PolarHBondContact O-N 3.39Å
358R65.1Low80.4Confident124 Ų12485.3 Ų85.347%0.46842%0.417SS..  trans-176.3159.2166-108156.9-160.5-117.36.5116E274 A354E274-R358 IonicContact OE1-CZ 3.63Å; E274-R358 VanDerWaalsContact OE1-CZ 3.22Å; E274-R358 IonicContact OE1-NH1 2.73Å; E274-R358 PolarHBondContact OE1-NH1 2.92Å; E274-R358 VanDerWaalsContact OE1-NH1 3.09Å; E274-R358 IonicContact OE1-NH2 3.36Å; E274-R358 PolarHBondContact OE1-NH2 3.46Å; E274-R358 IonicContact OE2-CZ 3.63Å; E274-R358 IonicContact OE2-NE 3.15Å; E274-R358 IonicContact OE2-NH1 2.97Å; E274-R358 IonicContact OE2-NH2 3.61Å; E274-R358 PolarHBondContact OE2-NH2 3.43Å; A354-R358 PolarHBondContact O-N 2.65Å
359E56Low80.4Confident167 Ų16781.4 Ų81.478%0.7841%0.405SS*.SBendtrans-94.8125.3167.4-60.8179.2158.700110.6
360N53.6Low80.5Confident145 Ų14578.3 Ų78.378%0.77539%0.39SS*.SBendtrans71.2128.2171.3-49.5-36.8000116.6
361E61.7Low80.5Confident182 Ų18278.8 Ų78.885%0.8539%0.393SS*.SBendcis-131164.9-6.4-67.9179.114500106.7
362N75.5Confident80.7Confident106 Ų10677.8 Ų77.857%0.56739%0.393SS*.  trans79.322.3172.1-137.820.4000118E364 N365 L366N362-E364 VanDerWaalsContact C-N 3.27Å; N362-E364 PolarHBondContact O-N 2.79Å; N362-N365 PolarHBondContact O-N 3Å; N362-N365 VanDerWaalsContact OD1-CB 3.23Å; N362-N365 WeakPolarHBondContact OD1-CB 3.36Å; N362-N365 PolarHBondContact OD1-ND2 2.87Å; N362-L366 PolarHBondContact O-N 3.37Å; N362-L366 VanDerWaalsContact O-N 3.07Å
363I81.1Confident80.9Confident36 Ų3674.1 Ų74.119%0.18538%0.377CS..Hα-helixtrans-54.4-42.7173.9-68170.9000111.7A354 N365 L366 V367A354-I363 HydrophobicContact CB-CG2 3.56Å; I363-N365 VanDerWaalsContact C-N 3.33Å; I363-N365 PolarHBondContact O-N 3.36Å; I363-L366 PolarHBondContact O-N 3.5Å; I363-V367 HydrophobicContact CG2-CG2 4.09Å; I363-V367 WeakPolarHBondContact O-CB 3.49Å; I363-V367 WeakPolarHBondContact O-CG2 3.28Å; I363-V367 PolarHBondContact O-N 3.3Å
364E83.3Confident81.1Confident173 Ų17373.4 Ų73.481%0.80837%0.374SS*.Hα-helixtrans-61.7-40.9-178.8-66.4-173.8167.800112.3N362 G368N362-E364 VanDerWaalsContact C-N 3.27Å; N362-E364 PolarHBondContact O-N 2.79Å; E364-G368 WeakPolarHBondContact O-CA 3.47Å; E364-G368 PolarHBondContact O-N 2.98Å
365N86.6Confident81.4Confident104 Ų10476.2 Ų76.256%0.55639%0.386SS*.Hα-helixtrans-71.7-39177.2-75.2-20000111.6N362 I363 G368 A369N362-N365 PolarHBondContact O-N 3Å; N362-N365 VanDerWaalsContact OD1-CB 3.23Å; N362-N365 WeakPolarHBondContact OD1-CB 3.36Å; N362-N365 PolarHBondContact OD1-ND2 2.87Å; I363-N365 VanDerWaalsContact C-N 3.33Å; I363-N365 PolarHBondContact O-N 3.36Å; N365-G368 PolarHBondContact O-N 3.23Å; N365-A369 WeakPolarHBondContact O-CB 3.27Å; N365-A369 PolarHBondContact O-N 3.46Å
366L88.3Confident81.8Confident39 Ų3974 Ų7420%0.20438%0.375CS..Hα-helixtrans-60.2-53.9176.1179.368.3000111.3L311 E314 K315 N362 I363 G368 A369 V370L311-L366 HydrophobicContact CD2-CD2 4.29Å; L311-L366 HydrophobicContact CD2-CG 4.31Å; E314-L366 HydrophobicContact CB-CD1 3.76Å; E314-L366 HydrophobicContact CG-CD1 3.38Å; K315-L366 HydrophobicContact CB-CD1 4.15Å; N362-L366 PolarHBondContact O-N 3.37Å; N362-L366 VanDerWaalsContact O-N 3.07Å; I363-L366 PolarHBondContact O-N 3.5Å; L366-G368 VanDerWaalsContact C-N 3.32Å; L366-G368 PolarHBondContact O-N 2.88Å; L366-A369 PolarHBondContact O-N 3.2Å; L366-V370 WeakPolarHBondContact O-CG2 3.39Å; L366-V370 PolarHBondContact O-N 3.28Å
367V89.6Confident82.3Confident5 Ų569.4 Ų69.43%0.0336%0.355CS..Hα-helixtrans-65.4-40.4178.9177.10000110.2L311 L350 Q351 A354 I363 A369 V370 V371L311-V367 HydrophobicContact CD2-CG2 3.99Å; L350-V367 HydrophobicContact CB-CG1 4.09Å; Q351-V367 HydrophobicContact CG-CG1 3.85Å; A354-V367 HydrophobicContact CB-CG2 3.67Å; I363-V367 HydrophobicContact CG2-CG2 4.09Å; I363-V367 WeakPolarHBondContact O-CB 3.49Å; I363-V367 WeakPolarHBondContact O-CG2 3.28Å; I363-V367 PolarHBondContact O-N 3.3Å; V367-A369 PolarHBondContact O-N 2.94Å; V367-V370 PolarHBondContact O-N 3.45Å; V367-V371 HydrophobicContact CG1-CG2 3.9Å; V367-V371 VanDerWaalsContact O-CB 3.31Å; V367-V371 WeakPolarHBondContact O-CB 3.43Å; V367-V371 WeakPolarHBondContact O-CG2 3.3Å; V367-V371 PolarHBondContact O-N 3.43Å
368G89.5Confident82.9Confident32 Ų3268 Ų6833%0.3335%0.347SS..Hα-helixtrans-58.6-43.417700000113E364 N365 L366 T372E364-G368 WeakPolarHBondContact O-CA 3.47Å; E364-G368 PolarHBondContact O-N 2.98Å; N365-G368 PolarHBondContact O-N 3.23Å; L366-G368 VanDerWaalsContact C-N 3.32Å; L366-G368 PolarHBondContact O-N 2.88Å; G368-T372 VanDerWaalsContact O-CB 3.31Å; G368-T372 WeakPolarHBondContact O-CB 3.42Å; G368-T372 PolarHBondContact O-N 3.41Å; G368-T372 PolarHBondContact O-OG1 2.86Å
369A90.6Very high83.9Confident32 Ų3268.3 Ų68.326%0.26435%0.349SS..Hα-helixtrans-62.1-53175.800000111.2N365 L366 V367 V371 T372 D373N365-A369 WeakPolarHBondContact O-CB 3.27Å; N365-A369 PolarHBondContact O-N 3.46Å; L366-A369 PolarHBondContact O-N 3.2Å; V367-A369 PolarHBondContact O-N 2.94Å; A369-V371 PolarHBondContact O-N 3.19Å; A369-T372 WeakPolarHBondContact O-CB 3.34Å; A369-T372 PolarHBondContact O-N 2.85Å; A369-D373 PolarHBondContact O-N 2.9Å
370V92.6Very high85.3Confident0 Ų062.1 Ų62.10%032%0.318CS..Hα-helixtrans-57.7-46.2178.8168.50000112.3L310 E314 L350 L366 V367 T372 D373 L374L310-V370 HydrophobicContact CD1-CG1 4.31Å; L310-V370 HydrophobicContact CD2-CG1 3.26Å; L310-V370 HydrophobicContact CG-CB 4.49Å; L310-V370 HydrophobicContact CG-CG1 3.45Å; L310-V370 VanDerWaalsContact CG-CG1 3.45Å; L310-V370 HydrophobicContact CG-CG2 4.2Å; E314-V370 HydrophobicContact CB-CG2 3.76Å; E314-V370 HydrophobicContact CG-CG2 3.94Å; L350-V370 HydrophobicContact CD1-CG1 3.86Å; L366-V370 WeakPolarHBondContact O-CG2 3.39Å; L366-V370 PolarHBondContact O-N 3.28Å; V367-V370 PolarHBondContact O-N 3.45Å; V370-T372 VanDerWaalsContact C-N 3.32Å; V370-T372 PolarHBondContact O-N 3.04Å; V370-D373 PolarHBondContact O-N 3.42Å; V370-L374 HydrophobicContact CG1-CD1 4.23Å; V370-L374 WeakPolarHBondContact O-CG 3.3Å; V370-L374 PolarHBondContact O-N 2.9Å
371V92.6Very high86.7Confident11 Ų1156 Ų567%0.06729%0.286CS..Hα-helixtrans-66.8-36.8-179.3169.40000111T347 L350 V367 A369 L374 Q375T347-V371 HydrophobicContact CG2-CG1 4.24Å; T347-V371 HydrophobicContact CG2-CG2 3.91Å; T347-V371 WeakPolarHBondContact OG1-CG1 3.49Å; L350-V371 HydrophobicContact CD1-CG2 4.06Å; V367-V371 HydrophobicContact CG1-CG2 3.9Å; V367-V371 VanDerWaalsContact O-CB 3.31Å; V367-V371 WeakPolarHBondContact O-CB 3.43Å; V367-V371 WeakPolarHBondContact O-CG2 3.3Å; V367-V371 PolarHBondContact O-N 3.43Å; A369-V371 PolarHBondContact O-N 3.19Å; V371-L374 PolarHBondContact O-N 3.16Å; V371-Q375 HydrophobicContact CG1-CG 4.34Å; V371-Q375 VanDerWaalsContact O-CB 3.32Å; V371-Q375 WeakPolarHBondContact O-CB 3.29Å; V371-Q375 WeakPolarHBondContact O-CG 3.37Å; V371-Q375 PolarHBondContact O-N 2.97Å
372T93.1Very high86.9Confident64 Ų6452.8 Ų52.839%0.39327%0.266SS..Hα-helixtrans-61.9-47174.6-60.80000110.4G368 A369 V370 L374 Q375 E376G368-T372 VanDerWaalsContact O-CB 3.31Å; G368-T372 WeakPolarHBondContact O-CB 3.42Å; G368-T372 PolarHBondContact O-N 3.41Å; G368-T372 PolarHBondContact O-OG1 2.86Å; A369-T372 WeakPolarHBondContact O-CB 3.34Å; A369-T372 PolarHBondContact O-N 2.85Å; V370-T372 VanDerWaalsContact C-N 3.32Å; V370-T372 PolarHBondContact O-N 3.04Å; T372-L374 PolarHBondContact O-N 3.06Å; T372-Q375 WeakPolarHBondContact O-CB 3.33Å; T372-Q375 PolarHBondContact O-N 3.36Å; T372-E376 HydrophobicContact CG2-CG 4.43Å; T372-E376 WeakPolarHBondContact O-CB 3.23Å; T372-E376 WeakPolarHBondContact O-CG 3.36Å; T372-E376 PolarHBondContact O-N 2.75Å
373D91.7Very high86.1Confident49 Ų4952.2 Ų52.226%0.26226%0.256SS..Hα-helixtrans-60.8-46.6178-68.9-11.5000111.8K322 A369 V370 Q375 E376 L377K322-D373 WeakPolarHBondContact CE-OD2 3.41Å; K322-D373 IonicContact NZ-OD2 3.46Å; K322-D373 PolarHBondContact NZ-OD2 2.95Å; A369-D373 PolarHBondContact O-N 2.9Å; V370-D373 PolarHBondContact O-N 3.42Å; D373-Q375 PolarHBondContact O-N 3.48Å; D373-E376 PolarHBondContact O-N 2.93Å; D373-L377 VanDerWaalsContact O-CB 3.27Å; D373-L377 WeakPolarHBondContact O-CB 3.37Å; D373-L377 PolarHBondContact O-N 3.45Å
374L92.9Very high84.9Confident1 Ų151.7 Ų51.71%0.00525%0.254CS..Hα-helixtrans-60.5-44.4176.2-73.7175.6000111.9L310 N326 L329 V330 L343 I346 L350 V370 V371 T372 T378L310-L374 HydrophobicContact CD2-CD1 3.96Å; L310-L374 HydrophobicContact CD2-CD2 4.38Å; L310-L374 HydrophobicContact CD2-CG 4.3Å; N326-L374 HydrophobicContact CB-CD2 4.46Å; N326-L374 VanDerWaalsContact OD1-CD2 3.31Å; N326-L374 WeakPolarHBondContact OD1-CD2 3.48Å; L329-L374 HydrophobicContact CB-CD2 3.97Å; L329-L374 HydrophobicContact CD1-CD1 4.27Å; L329-L374 HydrophobicContact CD1-CD2 4.38Å; V330-L374 HydrophobicContact CG2-CD2 4.05Å; L343-L374 HydrophobicContact CD1-CB 4.14Å; I346-L374 HydrophobicContact CG2-CD1 4.09Å; L350-L374 HydrophobicContact CD1-CD1 4.22Å; V370-L374 HydrophobicContact CG1-CD1 4.23Å; V370-L374 WeakPolarHBondContact O-CG 3.3Å; V370-L374 PolarHBondContact O-N 2.9Å; V371-L374 PolarHBondContact O-N 3.16Å; T372-L374 PolarHBondContact O-N 3.06Å; L374-T378 WeakPolarHBondContact O-CB 3.35Å; L374-T378 PolarHBondContact O-N 3.09Å; L374-T378 PolarHBondContact O-OG1 3.32Å
375Q91Very high83.7Confident66 Ų6647.1 Ų47.131%0.30824%0.241SC..Hα-helixtrans-61-45.5177-80.1176.31800111.8L343 V371 T372 D373 R379L343-Q375 HydrophobicContact CD1-CG 4.26Å; L343-Q375 HydrophobicContact CD2-CB 4.31Å; L343-Q375 HydrophobicContact CD2-CG 3.44Å; L343-Q375 VanDerWaalsContact CD2-CG 3.44Å; L343-Q375 HydrophobicContact CG-CG 4.1Å; V371-Q375 HydrophobicContact CG1-CG 4.34Å; V371-Q375 VanDerWaalsContact O-CB 3.32Å; V371-Q375 WeakPolarHBondContact O-CB 3.29Å; V371-Q375 WeakPolarHBondContact O-CG 3.37Å; V371-Q375 PolarHBondContact O-N 2.97Å; T372-Q375 WeakPolarHBondContact O-CB 3.33Å; T372-Q375 PolarHBondContact O-N 3.36Å; D373-Q375 PolarHBondContact O-N 3.48Å; Q375-R379 WeakPolarHBondContact O-CG 3.44Å; Q375-R379 PolarHBondContact O-N 3.16Å
376E90Very high82.4Confident74 Ų7446.1 Ų46.135%0.34624%0.236SC..Hα-helixtrans-66.8-50.1179.8-72.1-164.4171.500111.5T372 D373 T378 R379 R380T372-E376 HydrophobicContact CG2-CG 4.43Å; T372-E376 WeakPolarHBondContact O-CB 3.23Å; T372-E376 WeakPolarHBondContact O-CG 3.36Å; T372-E376 PolarHBondContact O-N 2.75Å; D373-E376 PolarHBondContact O-N 2.93Å; E376-T378 PolarHBondContact O-N 2.96Å; E376-R379 PolarHBondContact O-N 2.71Å; E376-R379 VanDerWaalsContact O-N 3.14Å; E376-R380 VanDerWaalsContact O-CG 3.26Å; E376-R380 WeakPolarHBondContact O-CG 3.27Å; E376-R380 PolarHBondContact O-N 3.12Å; E376-R380 VanDerWaalsContact O-N 3.11Å; E376-R380 IonicContact OE2-CZ 3.13Å; E376-R380 IonicContact OE2-NH2 2.8Å; E376-R380 PolarHBondContact OE2-NH2 2.66Å
377L88.3Confident80.6Confident15 Ų1546.1 Ų46.18%0.07924%0.239CC..Hα-helixtrans-62.6-42.9-179-171.359.3000111.7Q54 N326 V330 D373 R379 R380 V381Q54-L377 HydrophobicContact CB-CD1 4.17Å; Q54-L377 HydrophobicContact CG-CD1 3.98Å; Q54-L377 HydrophobicContact CG-CD2 4.27Å; N326-L377 HydrophobicContact CB-CD2 4.04Å; V330-L377 HydrophobicContact CB-CD2 4.49Å; V330-L377 HydrophobicContact CG1-CG 4.49Å; V330-L377 HydrophobicContact CG2-CB 4.01Å; V330-L377 HydrophobicContact CG2-CD2 3.86Å; V330-L377 HydrophobicContact CG2-CG 3.93Å; D373-L377 VanDerWaalsContact O-CB 3.27Å; D373-L377 WeakPolarHBondContact O-CB 3.37Å; D373-L377 PolarHBondContact O-N 3.45Å; L377-R379 VanDerWaalsContact C-N 3.27Å; L377-R379 PolarHBondContact O-N 2.75Å; L377-R380 PolarHBondContact O-N 2.76Å; L377-V381 HydrophobicContact CD1-CG2 3.96Å; L377-V381 HydrophobicContact CG-CG2 4.14Å; L377-V381 WeakPolarHBondContact O-CG2 3.44Å; L377-V381 PolarHBondContact O-N 3.03Å
378T88.6Confident78.2Confident3 Ų354.2 Ų54.22%0.01828%0.276CS..Hα-helixtrans-56.9-40175-61.80000112.1I333 I334 L374 E376 R380 R382I333-T378 HydrophobicContact CG2-CG2 3.75Å; I334-T378 HydrophobicContact CG1-CG2 4.22Å; L374-T378 WeakPolarHBondContact O-CB 3.35Å; L374-T378 PolarHBondContact O-N 3.09Å; L374-T378 PolarHBondContact O-OG1 3.32Å; E376-T378 PolarHBondContact O-N 2.96Å; T378-R380 VanDerWaalsContact C-N 3.34Å; T378-R382 WeakPolarHBondContact O-CG 3.25Å
379R86.3Confident75.3Confident130 Ų13057.1 Ų57.149%0.49129%0.291SS..Hα-helixtrans-69.7-31.7176.6-72.5-172.5-139105.1-1112.6Q375 E376 L377Q375-R379 WeakPolarHBondContact O-CG 3.44Å; Q375-R379 PolarHBondContact O-N 3.16Å; E376-R379 PolarHBondContact O-N 2.71Å; E376-R379 VanDerWaalsContact O-N 3.14Å; L377-R379 VanDerWaalsContact C-N 3.27Å; L377-R379 PolarHBondContact O-N 2.75Å
380R85.4Confident72.5Confident37 Ų3761.1 Ų61.114%0.1432%0.315CS..Hα-helixtrans-78.2-43.1-177.1-64.5167.8-165.1-174.46.4111.8P45 S47 T56 E87 E376 L377 T378P45-R380 HydrophobicContact CB-CG 4.43Å; S47-R380 PolarHBondContact N-O 2.92Å; S47-R380 WeakPolarHBondContact OG-CB 3.31Å; S47-R380 WeakPolarHBondContact OG-CD 3.1Å; T56-R380 PolarHBondContact OG1-NH1 3.41Å; T56-R380 VanDerWaalsContact OG1-NH1 3.16Å; E87-R380 IonicContact OE2-CZ 2.58Å; E87-R380 IonicContact OE2-NH1 2.62Å; E87-R380 PolarHBondContact OE2-NH1 3.03Å; E87-R380 IonicContact OE2-NH2 3.09Å; E376-R380 VanDerWaalsContact O-CG 3.26Å; E376-R380 WeakPolarHBondContact O-CG 3.27Å; E376-R380 PolarHBondContact O-N 3.12Å; E376-R380 VanDerWaalsContact O-N 3.11Å; E376-R380 IonicContact OE2-CZ 3.13Å; E376-R380 IonicContact OE2-NH2 2.8Å; E376-R380 PolarHBondContact OE2-NH2 2.66Å; L377-R380 PolarHBondContact O-N 2.76Å; T378-R380 VanDerWaalsContact C-N 3.34Å
381V82Confident69.4Low16 Ų1666.8 Ų66.810%0.09735%0.354CS..Hα-helixtrans-71.5-37.7-175.9174.20000112.9V330 I334 L377 R383 V384V330-V381 HydrophobicContact CG1-CB 4.17Å; V330-V381 HydrophobicContact CG1-CG1 4.47Å; V330-V381 HydrophobicContact CG1-CG2 4.16Å; I334-V381 HydrophobicContact CD1-CB 3.75Å; I334-V381 HydrophobicContact CD1-CG1 3.55Å; L377-V381 HydrophobicContact CD1-CG2 3.96Å; L377-V381 HydrophobicContact CG-CG2 4.14Å; L377-V381 WeakPolarHBondContact O-CG2 3.44Å; L377-V381 PolarHBondContact O-N 3.03Å; V381-R383 PolarHBondContact O-N 3.45Å; V381-V384 PolarHBondContact O-N 3.41Å; V381-V384 VanDerWaalsContact O-N 3.12Å
382R65.4Low66.3Low115 Ų11575.9 Ų75.943%0.43440%0.396SS..THydrogen-bonded Turntrans-56.1-10.5178.5-75.2-174.3-160.7164.318.4115.5I334 P339 T378I334-R382 HydrophobicContact CD1-CG 3.79Å; I334-R382 HydrophobicContact CG1-CG 3.78Å; I334-R382 HydrophobicContact CG2-CG 4.27Å; P339-R382 VanDerWaalsContact CB-CZ 3.44Å; T378-R382 WeakPolarHBondContact O-CG 3.25Å
383R59.5Low63.1Low94 Ų9478.2 Ų78.236%0.35542%0.415SS..THydrogen-bonded Turntrans-107.14.5-176-61.7-168.6-178.1124.37.5114.3H22 V381H22-R383 PolarHBondContact ND1-O 3.43Å; V381-R383 PolarHBondContact O-N 3.45Å
384V55.1Low60Low25 Ų2580.6 Ų80.615%0.15244%0.436CS..  trans-120.4121.1-179-175.30000108.7F20 Q21 H22 F46 S47 T48 V381F20-V384 HydrophobicContact CB-CG1 3.79Å; F20-V384 HydrophobicContact CD1-CG1 3.94Å; F20-V384 HydrophobicContact CG-CG1 4.34Å; Q21-V384 WeakPolarHBondContact O-CA 3.47Å; H22-V384 HydrophobicContact CB-CG2 4.49Å; F46-V384 HydrophobicContact CB-CG2 4.06Å; F46-V384 HydrophobicContact CD2-CG2 3.72Å; F46-V384 HydrophobicContact CG-CG2 4.36Å; S47-V384 WeakPolarHBondContact O-CB 3.23Å; S47-V384 WeakPolarHBondContact O-CG2 3.32Å; T48-V384 HydrophobicContact CG2-CG1 4.32Å; V381-V384 PolarHBondContact O-N 3.41Å; V381-V384 VanDerWaalsContact O-N 3.12Å
385S59Low56.9Low77 Ų7789.9 Ų89.954%0.53848%0.479SS..EExtended strand (participates in β ladder)trans-100.5136.9176.5-60.20000109.3Q21Q21-S385 PolarHBondContact N-O 3.16Å; Q21-S385 PolarHBondContact O-N 3.32Å
386L58.6Low53.8Low83 Ų8392 Ų9244%0.43550%0.501SS..EExtended strand (participates in β ladder)trans-76.8123.2168.7-72.5166.6000108.4I18 F20 Y50I18-L386 HydrophobicContact CG2-CD2 3.69Å; F20-L386 HydrophobicContact CD1-CD2 3.54Å; F20-L386 HydrophobicContact CD1-CG 4.46Å; F20-L386 HydrophobicContact CE1-CD2 3.27Å; F20-L386 HydrophobicContact CE1-CG 4.35Å; F20-L386 HydrophobicContact CG-CD2 4.4Å; F20-L386 HydrophobicContact CZ-CD2 3.94Å; Y50-L386 HydrophobicContact CD2-CD1 4.48Å
387S50.5Low50.6Low40 Ų4094.3 Ų94.328%0.2853%0.525SS..  trans-98112.3171.349.90000109.2S19 S389S19-S387 WeakPolarHBondContact CB-OG 3.25Å; S19-S387 PolarHBondContact O-N 3.15Å; S19-S387 PolarHBondContact OG-OG 3.38Å; S387-S389 PolarHBondContact O-N 3.21Å
388H38.9Very low47.7Very low174 Ų17499.3 Ų99.381%0.80656%0.562SS**  trans-75.2110.9163-68.1-64.9000107.5P390H388-P390 VanDerWaalsContact O-CD 3.23Å; H388-P390 WeakPolarHBondContact O-CD 3.25Å
389S28.8Very low45.1Very low93 Ų93104.8 Ų104.865%0.6560%0.597SS**  trans-61.2118.8171.4-66.20000108.6S387 S391S387-S389 PolarHBondContact O-N 3.21Å; S389-S391 PolarHBondContact O-N 3.43Å
390P31.7Very low42.2Very low116 Ų116107.3 Ų107.375%0.75362%0.619SS**  trans-68.9120.216726.9-28.6000107.5H388 Q392H388-P390 VanDerWaalsContact O-CD 3.23Å; H388-P390 WeakPolarHBondContact O-CD 3.25Å; P390-Q392 PolarHBondContact O-N 2.93Å; P390-Q392 VanDerWaalsContact O-N 3.07Å
391S27Very low39.4Very low119 Ų119109.8 Ų109.883%0.83265%0.647SS**  trans-53.9115.4165.927.50000108.3S389 S393S389-S391 PolarHBondContact O-N 3.43Å; S391-S393 PolarHBondContact O-N 3.22Å; S391-S393 VanDerWaalsContact O-N 3.12Å
392Q28.5Very low36.8Very low202 Ų202115.3 Ų115.394%0.94468%0.681SS**  trans-63.9111.5176.1-69.2-177.6-0.900109.1P390P390-Q392 PolarHBondContact O-N 2.93Å; P390-Q392 VanDerWaalsContact O-N 3.07Å
393S26.3Very low35.5Very low114 Ų114114.7 Ų114.780%0.79769%0.693SS**  trans-125.3113.8148.462.50000108.6S391S391-S393 PolarHBondContact O-N 3.22Å; S391-S393 VanDerWaalsContact O-N 3.12Å
394S26.5Very low33.9Very low99 Ų99117.1 Ų117.169%0.69272%0.718SS**  trans-58.7133.2177.246.50000112.5
395H27.4Very low32.5Very low195 Ų195124.1 Ų124.190%0.90375%0.754SS**  trans-155.7130133.1-85.2-53.8000111.2
396S25.4Very low30.9Very low112 Ų112124.3 Ų124.378%0.78377%0.768SS**  trans-76.3142.7176.864.10000112.5
397S24.3Very low29.4Very low121 Ų121126.7 Ų126.785%0.84679%0.792SS**  -171.5134.6129.6200000110.6
398S25.9Very low28.2Very low121 Ų121128.2 Ų128.285%0.84681%0.814SS**  trans-82.3-172.2-176.8-39.10000112.4
399P35.3Very low27.6Very low117 Ų117125.6 Ų125.676%0.7682%0.816SS**  -104.8165.2-122.834.8-16.4000114.2
400L24.2Very low27.8Very low183 Ų183127.1 Ų127.196%0.95882%0.823SS**  trans-147.1146.8160.1-136.883.4000112.6
401A26.6Very low27.5Very low89 Ų89127.1 Ų127.174%0.73683%0.826SS**  trans-76.5159-165.500000116.5
402T27.4Very low27.6Very low132 Ų132127.5 Ų127.581%0.8182%0.823SS**  trans-41.6178.4162.934.40000117.2
403P38Very low27.5Very low103 Ų103123.7 Ų123.767%0.66982%0.816SS**  cis-136.9176.1-9.827.9-4.9000114.5
404T26.9Very low27.5Very low145 Ų145122.2 Ų122.289%0.8981%0.81SS**  17615212926.30000115.3
405N26.1Very low27.7Very low171 Ų171122.8 Ų122.891%0.91481%0.812SS**  trans-61.8157.1-176.6-69.6-32.6000116.6
406G25.3Very low27.6Very low81 Ų81122.8 Ų122.884%0.83581%0.81SS**  trans-179.2112.4158.600000114.2
407S25.8Very low27.5Very low134 Ų134124.3 Ų124.394%0.93781%0.809SS**  trans-71.2151.2179.3-176.90000113.6
408G25.1Very low27.6Very low72 Ų72124.1 Ų124.174%0.74281%0.808SS**  trans165.6101.5162.500000114.5
409S26.9Very low27.7Very low119 Ų119124 Ų12483%0.83280%0.804SS**  trans-90179.6166.2-43.30000110.8
410P32.8Very low27.2Very low124 Ų124124.5 Ų124.581%0.80581%0.805SS**  -109.4153.3-111.329.8-10.5000113.5
411S24.8Very low27.3Very low117 Ų117121 Ų12182%0.81880%0.796SS**  trans-106.3118169.946.40000111.1
412V30.6Very low27.4Very low127 Ų127128.2 Ų128.277%0.7780%0.804SS**  trans-78.7142.1159.81760000108
413P25.5Very low27.3Very low121 Ų121131.1 Ų131.179%0.78681%0.806SS**  -127.5145.2125.77.413.7000112.4
414A26Very low26.8Very low83 Ų83136.4 Ų136.469%0.68682%0.818SS**  trans-86.5-163.6-178.700000111.7
415P32.2Very low26.9Very low112 Ų112140.2 Ų140.273%0.72782%0.816SS**  -106.5155.7-116.530.4-11.1000112.9
416F24.9Very low26.9Very low195 Ų195138.3 Ų138.386%0.85581%0.811SS**  trans-140111.5164.2-96.9-79.4000112.3
417D23.8Very low27Very low143 Ų143138.8 Ų138.877%0.76580%0.802SS**  trans38.3110.2138.5-65.8-29.3000120.4
418S25.7Very low27.2Very low117 Ų117140.6 Ų140.682%0.81880%0.8SS**  trans-75.3135.6161.4-41.20000111.3T420S418-T420 PolarHBondContact O-N 3.2Å
419P27.3Very low27.4Very low118 Ų118145.3 Ų145.377%0.76683%0.832SS**  trans-84.3104.7161.124.1-15.5000110.4
420T26.1Very low27.4Very low129 Ų129146.6 Ų146.679%0.79183%0.832SS**  trans33.896.8142.652.70000118.5S418S418-T420 PolarHBondContact O-N 3.2Å
421S25.4Very low27.2Very low110 Ų110147.8 Ų147.877%0.76983%0.833SS**  trans-55.4130.3153.4169.20000111.2F423S421-F423 PolarHBondContact OG-N 3.04Å
422R28.3Very low27.3Very low239 Ų239149.5 Ų149.590%0.90283%0.834SS**  trans-117.258.6169-157-169.5-127.5-166.34.5109.8
423F26.4Very low27.1Very low194 Ų194150.8 Ų150.885%0.85184%0.838SS**SBendtrans-134.3121.2156-84.5-80000109.5S421 R425S421-F423 PolarHBondContact OG-N 3.04Å; F423-R425 PolarHBondContact O-N 2.94Å; F423-R425 VanDerWaalsContact O-N 3.08Å
424K26.6Very low27.2Very low213 Ų213152.7 Ų152.793%0.92684%0.841SS**  trans-65108.5179.5-81.7179.1174.41790109.2V426K424-V426 PolarHBondContact O-N 3.07Å
425R29Very low27.3Very low225 Ų225157.3 Ų157.385%0.84985%0.851SS**  trans-19.5116151.2-174.7-178-90.4177.9-9.5112.8F423 S427F423-R425 PolarHBondContact O-N 2.94Å; F423-R425 VanDerWaalsContact O-N 3.08Å; R425-S427 PolarHBondContact O-N 3.02Å
426V26.4Very low26.9Very low131 Ų131160.6 Ų160.679%0.79486%0.86SS**  trans-75110.1156.2177.40000106K424K424-V426 PolarHBondContact O-N 3.07Å
427S27.1Very low27.1Very low92 Ų92157.9 Ų157.964%0.64386%0.86SS**  trans-93.6123.4170.253.80000108.4R425 A429R425-S427 PolarHBondContact O-N 3.02Å; S427-A429 PolarHBondContact O-N 2.92Å
428L30.3Very low27.3Very low171 Ų171159.2 Ų159.290%0.89587%0.868SS**  trans-70.7116165.7-71.5161.1000108.5
429A29.6Very low27.5Very low171 Ų171163 Ų163100%1.41387%0.873SS**  trans-1330155.600000107.2S427S427-A429 PolarHBondContact O-N 2.92Å

Retrieved 429 of 429 residues in 560.5 ms (Link to these results)