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Caveolin

May act as a scaffolding protein within caveolar membranes. Interacts directly with G-protein alpha subunits and can functionally regulate their activity. May also regulate voltage-gated potassium channels. Plays a role in the sarcolemma repair mechanism of both skeletal muscle and cardiomyocytes that permits rapid resealing of membranes disrupted by mechanical stress. Mediates the recruitment of CAVIN2 and CAVIN3 proteins to the caveolae.

AlphaFold DB (A0A673Z494), UniProt , Accession A0A060WGA5, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110528162, Length 152 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
1M58.5Low60.2Low196 Ų196119.9 Ų119.997%0.96660%0.595SS**  0-40.20-165.1166.6-112.700111.9
2A58.6Low60.2Low77 Ų77121.3 Ų121.364%0.63660%0.599SS**Hα-helixtrans-64.8-38.5174.700000114Q4 Y5 Q6A2-Q4 PolarHBondContact O-N 3.36Å; A2-Y5 PolarHBondContact O-N 3.15Å; A2-Q6 PolarHBondContact O-N 3.4Å
3D59.3Low59.9Low125 Ų125123.1 Ų123.167%0.66860%0.601SS**Hα-helixtrans-68.2-34-177.2-54.9-61.1000113.9Q6 Y7D3-Q6 PolarHBondContact O-N 3.09Å; D3-Y7 WeakPolarHBondContact O-CB 3.44Å; D3-Y7 PolarHBondContact O-N 3.05Å
4Q56.7Low59.6Low149 Ų149125.7 Ų125.770%0.69661%0.608SS**Hα-helixtrans-71.2-35175.6-77.8-138.9-61.600112.7A2 N8A2-Q4 PolarHBondContact O-N 3.36Å; Q4-N8 PolarHBondContact O-N 3.36Å; Q4-N8 VanDerWaalsContact O-N 3.07Å
5Y59.3Low59.4Low177 Ų177124 Ų12469%0.69461%0.608SS**Hα-helixtrans-67.8-39.8174.1-99.7-89.7000111.6A2 T9A2-Y5 PolarHBondContact O-N 3.15Å; Y5-T9 WeakPolarHBondContact O-CB 3.42Å; Y5-T9 PolarHBondContact O-N 3.13Å; Y5-T9 PolarHBondContact O-OG1 3.36Å
6Q60Low59Low128 Ų128126.3 Ų126.360%0.59861%0.614SS**Hα-helixtrans-69.3-35.6177.7-165157.4-95.800111.9A2 D3 N10A2-Q6 PolarHBondContact O-N 3.4Å; D3-Q6 PolarHBondContact O-N 3.09Å; Q6-N10 WeakPolarHBondContact O-CB 3.5Å; Q6-N10 VanDerWaalsContact O-CG 3.22Å; Q6-N10 PolarHBondContact O-N 3.24Å; Q6-N10 PolarHBondContact O-ND2 3.42Å
7Y58Low58.7Low137 Ų137125.2 Ų125.254%0.53761%0.612SS.*Hα-helixtrans-63.1-51.6172.9-174.4-95.1000111.9D3 T9 N10 E11D3-Y7 WeakPolarHBondContact O-CB 3.44Å; D3-Y7 PolarHBondContact O-N 3.05Å; Y7-T9 VanDerWaalsContact C-N 3.32Å; Y7-T9 PolarHBondContact O-N 3.29Å; Y7-N10 PolarHBondContact O-N 3.26Å; Y7-E11 HydrophobicContact CD1-CG 4.28Å; Y7-E11 HydrophobicContact CE1-CG 3.88Å; Y7-E11 WeakPolarHBondContact CE1-OE1 3.48Å; Y7-E11 WeakPolarHBondContact CE1-OE2 3.24Å; Y7-E11 VanDerWaalsContact CZ-CD 3.49Å; Y7-E11 PolarHBondContact O-N 2.91Å; Y7-E11 PolarHBondContact OH-OE1 3.31Å
8N62.2Low58.6Low86 Ų86122.4 Ų122.446%0.4661%0.607SS.*Hα-helixtrans-60.6-40.6176.6-77.810000112.1Q4 N10 E11 E12Q4-N8 PolarHBondContact O-N 3.36Å; Q4-N8 VanDerWaalsContact O-N 3.07Å; N8-N10 VanDerWaalsContact C-N 3.32Å; N8-N10 PolarHBondContact O-N 3.14Å; N8-E11 PolarHBondContact O-N 3.47Å; N8-E12 WeakPolarHBondContact O-CB 3.46Å; N8-E12 VanDerWaalsContact O-CG 3.24Å; N8-E12 WeakPolarHBondContact O-CG 3.37Å; N8-E12 PolarHBondContact O-N 2.97Å
9T67.4Low58.4Low61 Ų61125.3 Ų125.337%0.37462%0.618SS.*Hα-helixtrans-65.7-35.5178.4-53.80000112.2Y5 Y7 K13Y5-T9 WeakPolarHBondContact O-CB 3.42Å; Y5-T9 PolarHBondContact O-N 3.13Å; Y5-T9 PolarHBondContact O-OG1 3.36Å; Y7-T9 VanDerWaalsContact C-N 3.32Å; Y7-T9 PolarHBondContact O-N 3.29Å; T9-K13 WeakPolarHBondContact O-CB 3.37Å; T9-K13 WeakPolarHBondContact O-CG 3.47Å; T9-K13 PolarHBondContact O-N 3.49Å
10N62.5Low58.2Low95 Ų95123.8 Ų123.851%0.50862%0.617SS.*Hα-helixtrans-75.5-37.7177.1-73.8-35.7000112Q6 Y7 N8 K13 F14Q6-N10 WeakPolarHBondContact O-CB 3.5Å; Q6-N10 VanDerWaalsContact O-CG 3.22Å; Q6-N10 PolarHBondContact O-N 3.24Å; Q6-N10 PolarHBondContact O-ND2 3.42Å; Y7-N10 PolarHBondContact O-N 3.26Å; N8-N10 VanDerWaalsContact C-N 3.32Å; N8-N10 PolarHBondContact O-N 3.14Å; N10-K13 PolarHBondContact O-N 3.08Å; N10-F14 WeakPolarHBondContact O-CB 3.29Å; N10-F14 PolarHBondContact O-N 3.4Å
11E60Low58.5Low88 Ų88125.3 Ų125.341%0.41162%0.619SS.*Hα-helixtrans-64.5-44.5171.5-75.2-169.3144.300111.4Y7 N8 K13 F14 V15Y7-E11 HydrophobicContact CD1-CG 4.28Å; Y7-E11 HydrophobicContact CE1-CG 3.88Å; Y7-E11 WeakPolarHBondContact CE1-OE1 3.48Å; Y7-E11 WeakPolarHBondContact CE1-OE2 3.24Å; Y7-E11 VanDerWaalsContact CZ-CD 3.49Å; Y7-E11 PolarHBondContact O-N 2.91Å; Y7-E11 PolarHBondContact OH-OE1 3.31Å; N8-E11 PolarHBondContact O-N 3.47Å; E11-K13 PolarHBondContact O-N 3.39Å; E11-F14 PolarHBondContact O-N 3.29Å; E11-V15 WeakPolarHBondContact O-CB 3.27Å; E11-V15 WeakPolarHBondContact O-CG2 3.21Å; E11-V15 PolarHBondContact O-N 3.14Å
12E59.5Low59Low137 Ų137125.2 Ų125.264%0.6462%0.617SS**Hα-helixtrans-63.8-40.1176-73.4-178.7125.900112N8 K16N8-E12 WeakPolarHBondContact O-CB 3.46Å; N8-E12 VanDerWaalsContact O-CG 3.24Å; N8-E12 WeakPolarHBondContact O-CG 3.37Å; N8-E12 PolarHBondContact O-N 2.97Å; E12-K16 VanDerWaalsContact O-CB 3.25Å; E12-K16 WeakPolarHBondContact O-CB 3.12Å; E12-K16 PolarHBondContact O-N 2.94Å
13K56.5Low59.8Low144 Ų144128.1 Ų128.163%0.62662%0.62SS**Hα-helixtrans-64.7-44.1172-86-176.3176.4-178.20112T9 N10 E11 V15 K16 D17T9-K13 WeakPolarHBondContact O-CB 3.37Å; T9-K13 WeakPolarHBondContact O-CG 3.47Å; T9-K13 PolarHBondContact O-N 3.49Å; N10-K13 PolarHBondContact O-N 3.08Å; E11-K13 PolarHBondContact O-N 3.39Å; K13-V15 PolarHBondContact O-N 3.47Å; K13-K16 PolarHBondContact O-N 3.16Å; K13-D17 WeakPolarHBondContact O-CB 3.14Å; K13-D17 PolarHBondContact O-N 3.38Å
14F56Low60.6Low160 Ų160126.4 Ų126.470%0.70261%0.611SS**Hα-helixtrans-64.7-40.2-179.3-170.1-94.6000112N10 E11 S18N10-F14 WeakPolarHBondContact O-CB 3.29Å; N10-F14 PolarHBondContact O-N 3.4Å; E11-F14 PolarHBondContact O-N 3.29Å; F14-S18 WeakPolarHBondContact O-CB 3.36Å; F14-S18 PolarHBondContact O-N 2.82Å; F14-S18 VanDerWaalsContact O-N 3.11Å
15V56.8Low61.7Low100 Ų100125 Ų12561%0.60661%0.607SS**Hα-helixtrans-68.5-39.9176.4173.30000111.3E11 K13E11-V15 WeakPolarHBondContact O-CB 3.27Å; E11-V15 WeakPolarHBondContact O-CG2 3.21Å; E11-V15 PolarHBondContact O-N 3.14Å; K13-V15 PolarHBondContact O-N 3.47Å
16K53.1Low62.5Low160 Ų160124.3 Ų124.370%0.69661%0.614SS**Hα-helixtrans-73.4-34.5179.7-152.8175-172.2-1800112.8E12 K13 T20E12-K16 VanDerWaalsContact O-CB 3.25Å; E12-K16 WeakPolarHBondContact O-CB 3.12Å; E12-K16 PolarHBondContact O-N 2.94Å; K13-K16 PolarHBondContact O-N 3.16Å; K16-T20 PolarHBondContact O-N 3.37Å; K16-T20 PolarHBondContact O-OG1 2.78Å
17D53.6Low63.6Low108 Ų108121.8 Ų121.858%0.57861%0.605SS**Hα-helixtrans-73-33.5177.7-161.455000111.9K13 H19 T20 K21K13-D17 WeakPolarHBondContact O-CB 3.14Å; K13-D17 PolarHBondContact O-N 3.38Å; D17-H19 PolarHBondContact O-N 2.84Å; D17-T20 PolarHBondContact O-N 3.33Å; D17-K21 PolarHBondContact O-N 2.83Å
18S56.4Low64.7Low76 Ų76124.9 Ų124.953%0.53162%0.615SS.*Hα-helixtrans-63.1-29.3175.9-171.80000113.5F14F14-S18 WeakPolarHBondContact O-CB 3.36Å; F14-S18 PolarHBondContact O-N 2.82Å; F14-S18 VanDerWaalsContact O-N 3.11Å
19H55.2Low65.6Low177 Ų177122.5 Ų122.582%0.81960%0.603SS**Hα-helixtrans-92-11.7179.1-109.8-73.7000113.8D17D17-H19 PolarHBondContact O-N 2.84Å
20T55Low66.4Low95 Ų95124 Ų12458%0.58361%0.613SS**  trans-126.236.5-172.6-30.80000111.6K16 D17 E22K16-T20 PolarHBondContact O-N 3.37Å; K16-T20 PolarHBondContact O-OG1 2.78Å; D17-T20 PolarHBondContact O-N 3.33Å; T20-E22 PolarHBondContact O-N 2.8Å; T20-E22 VanDerWaalsContact O-N 3.09Å
21K64.1Low67.4Low155 Ų155127.6 Ų127.667%0.67463%0.625SS**  trans-63.9115.4169.6-68.3-173.1178.9176.90108.2D17 I23D17-K21 PolarHBondContact O-N 2.83Å; K21-I23 PolarHBondContact O-N 3.01Å; K21-I23 VanDerWaalsContact O-N 3.13Å
22E69.4Low68.4Low195 Ų195127.7 Ų127.791%0.91163%0.627SS**  trans-58.9117.5174.6-64.1-169109.400108.6T20T20-E22 PolarHBondContact O-N 2.8Å; T20-E22 VanDerWaalsContact O-N 3.09Å
23I75.3Confident69.6Low137 Ų137126.8 Ų126.870%0.70363%0.626SS**  trans-77.8124.2177.450.1168000109K21 L25K21-I23 PolarHBondContact O-N 3.01Å; K21-I23 VanDerWaalsContact O-N 3.13Å; I23-L25 HydrophobicContact CD1-CD2 3.91Å; I23-L25 HydrophobicContact CG1-CD2 4.25Å; I23-L25 PolarHBondContact O-N 3.35Å
24D76.2Confident70.9Confident90 Ų90123.7 Ų123.748%0.48162%0.616SS.*  trans-72.3112.5172.5-171-15.5000109.2I26 N27D24-I26 VanDerWaalsContact C-N 3.34Å; D24-I26 WeakPolarHBondContact OD1-CA 3.1Å; D24-I26 WeakPolarHBondContact OD1-CB 3.46Å; D24-I26 PolarHBondContact OD1-N 2.98Å; D24-N27 PolarHBondContact OD1-N 3.31Å; D24-N27 WeakPolarHBondContact OD2-CB 3.13Å
25L79Confident71.9Confident118 Ų118120.2 Ų120.262%0.61860%0.602SS**SBendtrans-81.1-18.6-179.6-62.9175.4000112.6I23 R28I23-L25 HydrophobicContact CD1-CD2 3.91Å; I23-L25 HydrophobicContact CG1-CD2 4.25Å; I23-L25 PolarHBondContact O-N 3.35Å; L25-R28 PolarHBondContact O-NE 3.32Å
26I77.4Confident72.6Confident164 Ų164121.8 Ų121.884%0.84161%0.607SS**SBendtrans-92.6-54.6-176-55.8174.2000109.1D24D24-I26 VanDerWaalsContact C-N 3.34Å; D24-I26 WeakPolarHBondContact OD1-CA 3.1Å; D24-I26 WeakPolarHBondContact OD1-CB 3.46Å; D24-I26 PolarHBondContact OD1-N 2.98Å
27N81.2Confident73.4Confident74 Ų74119.7 Ų119.740%0.39661%0.607SS.*  trans-101.396175.1-171.2-2.5000111.4D24 D29D24-N27 PolarHBondContact OD1-N 3.31Å; D24-N27 WeakPolarHBondContact OD2-CB 3.13Å; N27-D29 PolarHBondContact OD1-N 3.47Å; N27-D29 VanDerWaalsContact OD1-N 3.16Å; N27-D29 PolarHBondContact OD1-O 2.88Å
28R81.1Confident74.2Confident202 Ų202119.6 Ų119.676%0.76261%0.606SS**SBendtrans-85.7-9.2-179.6-61.1-177.7-177.5-165.4-3114.1L25 P30L25-R28 PolarHBondContact O-NE 3.32Å; R28-P30 VanDerWaalsContact C-CD 3.46Å
29D82.6Confident74.8Confident36 Ų36121.8 Ų121.819%0.19361%0.606CS.*  trans-128.265.4174.8-173.215.4000110.8N27 K31 L32 I33 N34N27-D29 PolarHBondContact OD1-N 3.47Å; N27-D29 VanDerWaalsContact OD1-N 3.16Å; N27-D29 PolarHBondContact OD1-O 2.88Å; D29-K31 PolarHBondContact O-N 2.94Å; D29-K31 VanDerWaalsContact O-N 3.09Å; D29-L32 WeakPolarHBondContact O-CD2 3.3Å; D29-L32 PolarHBondContact O-N 3.38Å; D29-L32 VanDerWaalsContact O-N 3.07Å; D29-L32 PolarHBondContact OD1-N 3.34Å; D29-L32 VanDerWaalsContact OD2-C 3.29Å; D29-L32 WeakPolarHBondContact OD2-CA 3.2Å; D29-I33 VanDerWaalsContact CG-N 3.34Å; D29-I33 PolarHBondContact OD1-N 3.26Å; D29-I33 PolarHBondContact OD2-N 3.42Å; D29-N34 PolarHBondContact OD2-N 2.71Å
30P82.7Confident75.8Confident92 Ų92117 Ų11760%0.59759%0.588SS**THydrogen-bonded Turntrans-66.3-14.1-177.528.2-36.4000113.6R28R28-P30 VanDerWaalsContact C-CD 3.46Å
31K83.7Confident77.1Confident172 Ų172118 Ų11875%0.74859%0.586SS**THydrogen-bonded Turntrans-100.51.5179-67.7-178.3-178.2-179.40112.6D29 I33D29-K31 PolarHBondContact O-N 2.94Å; D29-K31 VanDerWaalsContact O-N 3.09Å; K31-I33 HydrophobicContact CB-CD1 3.9Å; K31-I33 HydrophobicContact CB-CG1 3.73Å; K31-I33 HydrophobicContact CD-CD1 4.23Å; K31-I33 PolarHBondContact O-N 3.21Å
32L82.6Confident78Confident90 Ų90111.1 Ų111.147%0.47156%0.557SS.*  trans53.434.8178.6-48.9179.3000112.6D29 N34 E35D29-L32 WeakPolarHBondContact O-CD2 3.3Å; D29-L32 PolarHBondContact O-N 3.38Å; D29-L32 VanDerWaalsContact O-N 3.07Å; D29-L32 PolarHBondContact OD1-N 3.34Å; D29-L32 VanDerWaalsContact OD2-C 3.29Å; D29-L32 WeakPolarHBondContact OD2-CA 3.2Å; L32-N34 PolarHBondContact O-N 2.86Å; L32-E35 HydrophobicContact CB-CB 4.3Å; L32-E35 HydrophobicContact CB-CG 3.76Å; L32-E35 HydrophobicContact CD2-CG 3.78Å; L32-E35 WeakPolarHBondContact CD2-OE1 3.34Å; L32-E35 HydrophobicContact CG-CG 4.23Å
33I84.7Confident78.7Confident117 Ų117106.6 Ų106.660%0.654%0.536SS*.SBendtrans-67.2-28.9-176.3-61.7169.4000110.4D29 K31D29-I33 VanDerWaalsContact CG-N 3.34Å; D29-I33 PolarHBondContact OD1-N 3.26Å; D29-I33 PolarHBondContact OD2-N 3.42Å; K31-I33 HydrophobicContact CB-CD1 3.9Å; K31-I33 HydrophobicContact CB-CG1 3.73Å; K31-I33 HydrophobicContact CD-CD1 4.23Å; K31-I33 PolarHBondContact O-N 3.21Å
34N83.1Confident79Confident80 Ų80104.9 Ų104.943%0.42853%0.528SS..SBendtrans-112.43.5-173.4-70.6103.9000113.9D29 L32 D36 V37 I38D29-N34 PolarHBondContact OD2-N 2.71Å; L32-N34 PolarHBondContact O-N 2.86Å; N34-D36 PolarHBondContact O-N 3.4Å; N34-V37 PolarHBondContact O-N 3.48Å; N34-I38 HydrophobicContact CB-CD1 3.76Å; N34-I38 HydrophobicContact CB-CG1 4.29Å; N34-I38 PolarHBondContact O-N 2.74Å
35E76.8Confident79.3Confident86 Ų86104.2 Ų104.240%0.40253%0.527SS..THydrogen-bonded Turntrans-57.4-48.2-176-86-159.215700112.6L32 K39L32-E35 HydrophobicContact CB-CB 4.3Å; L32-E35 HydrophobicContact CB-CG 3.76Å; L32-E35 HydrophobicContact CD2-CG 3.78Å; L32-E35 WeakPolarHBondContact CD2-OE1 3.34Å; L32-E35 HydrophobicContact CG-CG 4.23Å; E35-K39 WeakPolarHBondContact O-CD 3.38Å; E35-K39 WeakPolarHBondContact O-CE 3.47Å; E35-K39 WeakPolarHBondContact O-CG 3.45Å; E35-K39 PolarHBondContact O-NZ 3.38Å
36D70.9Confident79.5Confident133 Ų133102.9 Ų102.971%0.71152%0.52SS*.THydrogen-bonded Turntrans-90.2-11.5-171.3-60-37.6000114N34 K39N34-D36 PolarHBondContact O-N 3.4Å; D36-K39 IonicContact OD1-NZ 3.95Å; D36-K39 PolarHBondContact OD1-NZ 3.4Å
37V69.8Low79.7Confident116 Ų11698.3 Ų98.370%0.70351%0.506SS*.THydrogen-bonded Turntrans-93.5-27.7-175.4-177.40000112.2N34N34-V37 PolarHBondContact O-N 3.48Å
38I70.3Confident79.8Confident107 Ų10797.6 Ų97.655%0.54950%0.501SS..SBendtrans-107.6-0.5-171.4-50.6-177.5000112.6N34 V40N34-I38 HydrophobicContact CB-CD1 3.76Å; N34-I38 HydrophobicContact CB-CG1 4.29Å; N34-I38 PolarHBondContact O-N 2.74Å; I38-V40 PolarHBondContact O-N 2.88Å
39K70.4Confident79.8Confident122 Ų12291.7 Ų91.753%0.5349%0.488SS..  trans-73.871.2171.7-72.3165.4-169.5159.20110.4E35 D36E35-K39 WeakPolarHBondContact O-CD 3.38Å; E35-K39 WeakPolarHBondContact O-CE 3.47Å; E35-K39 WeakPolarHBondContact O-CG 3.45Å; E35-K39 PolarHBondContact O-NZ 3.38Å; D36-K39 IonicContact OD1-NZ 3.95Å; D36-K39 PolarHBondContact OD1-NZ 3.4Å
40V75.9Confident79.3Confident75 Ų7597.2 Ų97.246%0.45552%0.518SS..  trans-106108.2168.1179.80000107.4I38 V45I38-V40 PolarHBondContact O-N 2.88Å; V40-V45 HydrophobicContact CG1-CG2 3.44Å; V40-V45 VanDerWaalsContact CG1-CG2 3.44Å
41E81.8Confident78.8Confident116 Ų11696.5 Ų96.554%0.54253%0.527SS..  trans-89.9162.8178.6-59.8-170.5108.400110.9E43 D44 V45E41-E43 PolarHBondContact O-N 3.29Å; E41-D44 WeakPolarHBondContact CB-OD2 3.47Å; E41-D44 PolarHBondContact N-OD2 3.08Å; E41-D44 WeakPolarHBondContact O-CB 3.46Å; E41-D44 PolarHBondContact O-N 2.95Å; E41-D44 VanDerWaalsContact O-N 3.16Å; E41-V45 PolarHBondContact O-N 3.37Å
42F83.8Confident78.3Confident12 Ų1293.2 Ų93.25%0.05352%0.522CS..Hα-helixtrans-59.8-38.1178.9172.9-102.6000111.6D44 V45 I46 W59 S62 Y63 F66F42-D44 VanDerWaalsContact C-N 3.32Å; F42-D44 PolarHBondContact O-N 3.19Å; F42-V45 PolarHBondContact O-N 3.21Å; F42-I46 HydrophobicContact CD2-CG1 4.2Å; F42-I46 HydrophobicContact CE2-CG1 3.69Å; F42-I46 HydrophobicContact CZ-CB 4.4Å; F42-I46 HydrophobicContact CZ-CG1 3.92Å; F42-I46 PolarHBondContact O-N 3.17Å; F42-I46 VanDerWaalsContact O-N 3.12Å; F42-W59 HydrophobicContact CD1-CH2 4.13Å; F42-W59 HydrophobicContact CD1-CZ2 4.06Å; F42-W59 AromaticContact CE1-CD2 3.99Å; F42-W59 HydrophobicContact CE1-CD2 3.99Å; F42-W59 AromaticContact CE1-CE2 3.92Å; F42-W59 AromaticContact CE1-CE3 3.83Å; F42-W59 HydrophobicContact CE1-CE3 3.83Å; F42-W59 AromaticContact CE1-CH2 3.56Å; F42-W59 HydrophobicContact CE1-CH2 3.56Å; F42-W59 AromaticContact CE1-CZ2 3.74Å; F42-W59 HydrophobicContact CE1-CZ2 3.74Å; F42-W59 AromaticContact CE1-CZ3 3.6Å; F42-W59 HydrophobicContact CE1-CZ3 3.6Å; F42-W59 HydrophobicContact CZ-CE3 4.33Å; F42-W59 HydrophobicContact CZ-CH2 4.4Å; F42-W59 HydrophobicContact CZ-CZ3 4.09Å; F42-S62 VanDerWaalsContact CZ-CB 3.5Å; F42-Y63 HydrophobicContact CB-CD2 3.67Å; F42-Y63 HydrophobicContact CB-CE2 4.17Å; F42-Y63 AromaticContact CD1-CD2 3.84Å; F42-Y63 HydrophobicContact CD1-CD2 3.84Å; F42-Y63 HydrophobicContact CD1-CG 4.39Å; F42-Y63 AromaticContact CG-CD2 3.98Å; F42-Y63 HydrophobicContact CG-CD2 3.98Å; F42-F66 HydrophobicContact CB-CD1 3.81Å; F42-F66 HydrophobicContact CB-CE1 4.21Å; F42-F66 HydrophobicContact CD2-CB 3.6Å; F42-F66 AromaticContact CD2-CD1 3.81Å; F42-F66 HydrophobicContact CD2-CD1 3.81Å; F42-F66 HydrophobicContact CD2-CD2 4.28Å; F42-F66 AromaticContact CD2-CG 3.64Å; F42-F66 HydrophobicContact CD2-CG 3.64Å; F42-F66 HydrophobicContact CE2-CB 4.09Å; F42-F66 HydrophobicContact CE2-CG 4.43Å; F42-F66 HydrophobicContact CG-CD1 4.3Å
43E82.9Confident78.2Confident100 Ų10094.5 Ų94.547%0.46753%0.525SS..Hα-helixtrans-65-33.6176.9-72144.8137.400112.2E41 V45 A47 W59E41-E43 PolarHBondContact O-N 3.29Å; E43-V45 VanDerWaalsContact C-N 3.28Å; E43-V45 PolarHBondContact O-N 2.8Å; E43-A47 WeakPolarHBondContact O-CA 3.45Å; E43-A47 WeakPolarHBondContact O-CB 3.26Å; E43-A47 PolarHBondContact O-N 3.5Å; E43-W59 HydrophobicContact CG-CZ2 3.91Å
44D81.6Confident78Confident100 Ų10090.6 Ų90.654%0.53551%0.508SS..Hα-helixtrans-68.9-25.2175.7-61.7-39.8000113.1E41 F42E41-D44 WeakPolarHBondContact CB-OD2 3.47Å; E41-D44 PolarHBondContact N-OD2 3.08Å; E41-D44 WeakPolarHBondContact O-CB 3.46Å; E41-D44 PolarHBondContact O-N 2.95Å; E41-D44 VanDerWaalsContact O-N 3.16Å; F42-D44 VanDerWaalsContact C-N 3.32Å; F42-D44 PolarHBondContact O-N 3.19Å
45V82.4Confident78.1Confident77 Ų7793.5 Ų93.547%0.46752%0.523SS..Hα-helixtrans-91.1-43.5-175.71790000112.1V40 E41 F42 E43 F66V40-V45 HydrophobicContact CG1-CG2 3.44Å; V40-V45 VanDerWaalsContact CG1-CG2 3.44Å; E41-V45 PolarHBondContact O-N 3.37Å; F42-V45 PolarHBondContact O-N 3.21Å; E43-V45 VanDerWaalsContact C-N 3.28Å; E43-V45 PolarHBondContact O-N 2.8Å; V45-F66 HydrophobicContact CG2-CZ 4.15Å
46I83.5Confident78.5Confident90 Ų9095.2 Ų95.246%0.46253%0.534SS..Hα-helixtrans-97.4-33.9-175-55.9-59.9000111.9F42 E48 W59F42-I46 HydrophobicContact CD2-CG1 4.2Å; F42-I46 HydrophobicContact CE2-CG1 3.69Å; F42-I46 HydrophobicContact CZ-CB 4.4Å; F42-I46 HydrophobicContact CZ-CG1 3.92Å; F42-I46 PolarHBondContact O-N 3.17Å; F42-I46 VanDerWaalsContact O-N 3.12Å; I46-E48 HydrophobicContact CG2-CG 4.31Å; I46-E48 PolarHBondContact O-N 3.43Å; I46-W59 HydrophobicContact CB-CH2 4.42Å; I46-W59 HydrophobicContact CB-CZ3 4.39Å; I46-W59 HydrophobicContact CG2-CH2 4.37Å; I46-W59 HydrophobicContact CG2-CZ3 3.92Å
47A82.5Confident79.2Confident68 Ų6891.4 Ų91.456%0.56253%0.527SS*.  trans43.958.4172.300000114.7E43 P49E43-A47 WeakPolarHBondContact O-CA 3.45Å; E43-A47 WeakPolarHBondContact O-CB 3.26Å; E43-A47 PolarHBondContact O-N 3.5Å; A47-P49 WeakPolarHBondContact O-CD 3.36Å
48E83.4Confident80.1Confident59 Ų5989.5 Ų89.528%0.27652%0.515SS..  trans-63.6125.8174.8-80.6-175.4-168.900110.7I46 S54 W59I46-E48 HydrophobicContact CG2-CG 4.31Å; I46-E48 PolarHBondContact O-N 3.43Å; E48-S54 VanDerWaalsContact CD-OG 3.24Å; E48-S54 VanDerWaalsContact OE1-CB 3.28Å; E48-S54 WeakPolarHBondContact OE1-CB 3.29Å; E48-S54 PolarHBondContact OE1-OG 2.96Å; E48-S54 WeakPolarHBondContact OE2-CB 3.47Å; E48-S54 PolarHBondContact OE2-N 3.12Å; E48-S54 PolarHBondContact OE2-OG 2.97Å; E48-W59 HydrophobicContact CB-CH2 3.97Å; E48-W59 HydrophobicContact CB-CZ3 3.86Å; E48-W59 HydrophobicContact CG-CE3 4.1Å; E48-W59 HydrophobicContact CG-CH2 4.03Å; E48-W59 HydrophobicContact CG-CZ3 3.43Å; E48-W59 VanDerWaalsContact CG-CZ3 3.43Å; E48-W59 WeakPolarHBondContact OE1-CZ3 3.38Å
49P80.6Confident80.9Confident78 Ų7887 Ų8751%0.50650%0.499SS..  trans-81.1151.2-179.331.9-34.4000112.2A47 G51 T52A47-P49 WeakPolarHBondContact O-CD 3.36Å; P49-G51 PolarHBondContact O-N 3.43Å; P49-T52 PolarHBondContact O-N 2.86Å
50D72.4Confident81.7Confident152 Ų15288 Ų8881%0.81350%0.503SS*.THydrogen-bonded Turntrans-53.4-21.6-175.6-68-45.8000115.3H53D50-H53 WeakPolarHBondContact CA-NE2 3.28Å; D50-H53 PolarHBondContact O-CD2 3.15Å; D50-H53 IonicContact OD1-NE2 2.9Å
51G72Confident82.4Confident76 Ų7689.9 Ų89.978%0.78451%0.51SS*.THydrogen-bonded Turntrans-86-14-179.300000115.5P49P49-G51 PolarHBondContact O-N 3.43Å
52T71.9Confident82.8Confident104 Ų10486.7 Ų86.764%0.63850%0.5SS*.SBendtrans-148.478.9-174.3250000110.4P49P49-T52 PolarHBondContact O-N 2.86Å
53H81.7Confident83Confident117 Ų11791 Ų9154%0.54252%0.517SS..PPolyproline II helixtrans-84.8136175.5-75.7-102.8000111.8D50D50-H53 WeakPolarHBondContact CA-NE2 3.28Å; D50-H53 PolarHBondContact O-CD2 3.15Å; D50-H53 IonicContact OD1-NE2 2.9Å
54S80.2Confident83.3Confident35 Ų3589.8 Ų89.825%0.24552%0.517CS..PPolyproline II helixtrans-66.2165.3162.564.10000110.9E48 D56E48-S54 VanDerWaalsContact CD-OG 3.24Å; E48-S54 VanDerWaalsContact OE1-CB 3.28Å; E48-S54 WeakPolarHBondContact OE1-CB 3.29Å; E48-S54 PolarHBondContact OE1-OG 2.96Å; E48-S54 WeakPolarHBondContact OE2-CB 3.47Å; E48-S54 PolarHBondContact OE2-N 3.12Å; E48-S54 PolarHBondContact OE2-OG 2.97Å; S54-D56 PolarHBondContact O-N 3.17Å
55L84.5Confident83.8Confident140 Ų14088.7 Ų88.773%0.73351%0.514SS*.PPolyproline II helixtrans-58.4133.6175.8-65.3171.7000110.2G57 V58 W59L55-G57 PolarHBondContact O-N 3.3Å; L55-V58 HydrophobicContact CB-CG2 4.15Å; L55-V58 WeakPolarHBondContact O-CA 3.39Å; L55-V58 WeakPolarHBondContact O-CB 3.47Å; L55-V58 PolarHBondContact O-N 2.83Å; L55-W59 PolarHBondContact O-N 3.48Å
56D85.4Confident84.1Confident122 Ų12288.2 Ų88.265%0.65251%0.505SS*.Hα-helixtrans-49.8-35.1-177.4-67.8-45.7000114.1S54 K60S54-D56 PolarHBondContact O-N 3.17Å; D56-K60 WeakPolarHBondContact O-CB 3.46Å; D56-K60 WeakPolarHBondContact O-CG 3.43Å; D56-K60 PolarHBondContact O-N 3.13Å
57G85.8Confident84.3Confident53 Ų5386.4 Ų86.455%0.54650%0.499SS..Hα-helixtrans-68.8-39.2177.400000113.2L55 L61L55-G57 PolarHBondContact O-N 3.3Å; G57-L61 VanDerWaalsContact O-CB 3.28Å; G57-L61 WeakPolarHBondContact O-CB 3.33Å; G57-L61 PolarHBondContact O-N 2.91Å
58V88.3Confident84.6Confident76 Ų7686.5 Ų86.546%0.46149%0.492SS..Hα-helixtrans-70.3-41.4177178.90000109.6L55 L61 S62L55-V58 HydrophobicContact CB-CG2 4.15Å; L55-V58 WeakPolarHBondContact O-CA 3.39Å; L55-V58 WeakPolarHBondContact O-CB 3.47Å; L55-V58 PolarHBondContact O-N 2.83Å; V58-L61 PolarHBondContact O-N 3.33Å; V58-S62 VanDerWaalsContact O-CB 3.25Å; V58-S62 WeakPolarHBondContact O-CB 3.28Å; V58-S62 PolarHBondContact O-N 3.43Å; V58-S62 PolarHBondContact O-OG 3.44Å
59W87.8Confident85Confident55 Ų5586.9 Ų86.921%0.20850%0.501CS..Hα-helixtrans-59.6-51.5176.4-172.4-111.2000111.9F42 E43 I46 E48 L55 L61 S62 Y63F42-W59 HydrophobicContact CD1-CH2 4.13Å; F42-W59 HydrophobicContact CD1-CZ2 4.06Å; F42-W59 AromaticContact CE1-CD2 3.99Å; F42-W59 HydrophobicContact CE1-CD2 3.99Å; F42-W59 AromaticContact CE1-CE2 3.92Å; F42-W59 AromaticContact CE1-CE3 3.83Å; F42-W59 HydrophobicContact CE1-CE3 3.83Å; F42-W59 AromaticContact CE1-CH2 3.56Å; F42-W59 HydrophobicContact CE1-CH2 3.56Å; F42-W59 AromaticContact CE1-CZ2 3.74Å; F42-W59 HydrophobicContact CE1-CZ2 3.74Å; F42-W59 AromaticContact CE1-CZ3 3.6Å; F42-W59 HydrophobicContact CE1-CZ3 3.6Å; F42-W59 HydrophobicContact CZ-CE3 4.33Å; F42-W59 HydrophobicContact CZ-CH2 4.4Å; F42-W59 HydrophobicContact CZ-CZ3 4.09Å; E43-W59 HydrophobicContact CG-CZ2 3.91Å; I46-W59 HydrophobicContact CB-CH2 4.42Å; I46-W59 HydrophobicContact CB-CZ3 4.39Å; I46-W59 HydrophobicContact CG2-CH2 4.37Å; I46-W59 HydrophobicContact CG2-CZ3 3.92Å; E48-W59 HydrophobicContact CB-CH2 3.97Å; E48-W59 HydrophobicContact CB-CZ3 3.86Å; E48-W59 HydrophobicContact CG-CE3 4.1Å; E48-W59 HydrophobicContact CG-CH2 4.03Å; E48-W59 HydrophobicContact CG-CZ3 3.43Å; E48-W59 VanDerWaalsContact CG-CZ3 3.43Å; E48-W59 WeakPolarHBondContact OE1-CZ3 3.38Å; L55-W59 PolarHBondContact O-N 3.48Å; W59-L61 PolarHBondContact O-N 3.44Å; W59-S62 PolarHBondContact O-N 3.02Å; W59-Y63 WeakPolarHBondContact O-CB 3.5Å; W59-Y63 PolarHBondContact O-N 3.14Å
60K87.6Confident85.3Confident144 Ų14488.4 Ų88.463%0.62650%0.5SS*.Hα-helixtrans-63.5-39.8178.5-73.8176.3-177.9174.60113.3D56 T64D56-K60 WeakPolarHBondContact O-CB 3.46Å; D56-K60 WeakPolarHBondContact O-CG 3.43Å; D56-K60 PolarHBondContact O-N 3.13Å; K60-T64 WeakPolarHBondContact O-CB 3.29Å; K60-T64 PolarHBondContact O-N 3.36Å; K60-T64 PolarHBondContact O-OG1 3.35Å
61L90.3Very high86Confident114 Ų11487.2 Ų87.260%0.59749%0.485SS*.Hα-helixtrans-66.3-44.1177.7-176.961.1000110.6G57 V58 W59 T64 T65G57-L61 VanDerWaalsContact O-CB 3.28Å; G57-L61 WeakPolarHBondContact O-CB 3.33Å; G57-L61 PolarHBondContact O-N 2.91Å; V58-L61 PolarHBondContact O-N 3.33Å; W59-L61 PolarHBondContact O-N 3.44Å; L61-T64 PolarHBondContact O-N 3.49Å; L61-T65 WeakPolarHBondContact O-CB 3.37Å; L61-T65 PolarHBondContact O-N 3.27Å; L61-T65 PolarHBondContact O-OG1 2.88Å
62S89.5Confident86.9Confident48 Ų4890.3 Ų90.334%0.33647%0.473SS..Hα-helixtrans-61.9-45.9177.8-57.30000111.5F42 V58 W59 T64 T65 F66F42-S62 VanDerWaalsContact CZ-CB 3.5Å; V58-S62 VanDerWaalsContact O-CB 3.25Å; V58-S62 WeakPolarHBondContact O-CB 3.28Å; V58-S62 PolarHBondContact O-N 3.43Å; V58-S62 PolarHBondContact O-OG 3.44Å; W59-S62 PolarHBondContact O-N 3.02Å; S62-T64 VanDerWaalsContact C-N 3.33Å; S62-T64 PolarHBondContact O-N 3.43Å; S62-T65 PolarHBondContact O-N 3.37Å; S62-F66 VanDerWaalsContact O-CB 3.23Å; S62-F66 WeakPolarHBondContact O-CB 3.5Å; S62-F66 PolarHBondContact O-N 2.82Å
63Y88.8Confident87.8Confident103 Ų10388.6 Ų88.640%0.40447%0.465SS..Hα-helixtrans-55.4-47.9173.7174.5-92.7000112F42 W59 T67F42-Y63 HydrophobicContact CB-CD2 3.67Å; F42-Y63 HydrophobicContact CB-CE2 4.17Å; F42-Y63 AromaticContact CD1-CD2 3.84Å; F42-Y63 HydrophobicContact CD1-CD2 3.84Å; F42-Y63 HydrophobicContact CD1-CG 4.39Å; F42-Y63 AromaticContact CG-CD2 3.98Å; F42-Y63 HydrophobicContact CG-CD2 3.98Å; W59-Y63 WeakPolarHBondContact O-CB 3.5Å; W59-Y63 PolarHBondContact O-N 3.14Å; Y63-T67 WeakPolarHBondContact O-CB 3.2Å; Y63-T67 PolarHBondContact O-N 3.12Å; Y63-T67 PolarHBondContact O-OG1 3Å
64T88.8Confident88.2Confident75 Ų7590.6 Ų90.646%0.4647%0.469SS..Hα-helixtrans-66.1-49.5-178.3-57.80000111.1K60 L61 S62 F66 T67 V68K60-T64 WeakPolarHBondContact O-CB 3.29Å; K60-T64 PolarHBondContact O-N 3.36Å; K60-T64 PolarHBondContact O-OG1 3.35Å; L61-T64 PolarHBondContact O-N 3.49Å; S62-T64 VanDerWaalsContact C-N 3.33Å; S62-T64 PolarHBondContact O-N 3.43Å; T64-F66 VanDerWaalsContact C-N 3.33Å; T64-F66 PolarHBondContact O-N 3.19Å; T64-T67 PolarHBondContact O-N 3.19Å; T64-V68 HydrophobicContact CG2-CG2 4.36Å; T64-V68 WeakPolarHBondContact O-CB 3.48Å; T64-V68 VanDerWaalsContact O-CG2 3.27Å; T64-V68 WeakPolarHBondContact O-CG2 3.27Å; T64-V68 PolarHBondContact O-N 3.28Å
65T91.2Very high88.6Confident77 Ų7794.8 Ų94.847%0.47248%0.479SS..Hα-helixtrans-63.2-38.8-179.9-64.40000111.8L61 S62 S69L61-T65 WeakPolarHBondContact O-CB 3.37Å; L61-T65 PolarHBondContact O-N 3.27Å; L61-T65 PolarHBondContact O-OG1 2.88Å; S62-T65 PolarHBondContact O-N 3.37Å; T65-S69 WeakPolarHBondContact O-CB 3.5Å; T65-S69 PolarHBondContact O-N 3.22Å; T65-S69 PolarHBondContact O-OG 2.99Å
66F89.2Confident89Confident66 Ų6692.6 Ų92.629%0.28947%0.467SS..Hα-helixtrans-63-50.5175.2179.1-98.9000111.6F42 V45 S62 T64 V68 S69 K70F42-F66 HydrophobicContact CB-CD1 3.81Å; F42-F66 HydrophobicContact CB-CE1 4.21Å; F42-F66 HydrophobicContact CD2-CB 3.6Å; F42-F66 AromaticContact CD2-CD1 3.81Å; F42-F66 HydrophobicContact CD2-CD1 3.81Å; F42-F66 HydrophobicContact CD2-CD2 4.28Å; F42-F66 AromaticContact CD2-CG 3.64Å; F42-F66 HydrophobicContact CD2-CG 3.64Å; F42-F66 HydrophobicContact CE2-CB 4.09Å; F42-F66 HydrophobicContact CE2-CG 4.43Å; F42-F66 HydrophobicContact CG-CD1 4.3Å; V45-F66 HydrophobicContact CG2-CZ 4.15Å; S62-F66 VanDerWaalsContact O-CB 3.23Å; S62-F66 WeakPolarHBondContact O-CB 3.5Å; S62-F66 PolarHBondContact O-N 2.82Å; T64-F66 VanDerWaalsContact C-N 3.33Å; T64-F66 PolarHBondContact O-N 3.19Å; F66-V68 PolarHBondContact O-N 2.81Å; F66-S69 PolarHBondContact O-N 2.94Å; F66-K70 HydrophobicContact CE1-CD 4.41Å; F66-K70 WeakPolarHBondContact O-CB 3.36Å; F66-K70 PolarHBondContact O-N 2.89Å
67T87.7Confident89.2Confident53 Ų5391 Ų9133%0.32546%0.458SS..Hα-helixtrans-61.8-46.4-177.9-59.20000111.8Y63 T64 Y71Y63-T67 WeakPolarHBondContact O-CB 3.2Å; Y63-T67 PolarHBondContact O-N 3.12Å; Y63-T67 PolarHBondContact O-OG1 3Å; T64-T67 PolarHBondContact O-N 3.19Å; T67-Y71 WeakPolarHBondContact O-CB 3.32Å; T67-Y71 PolarHBondContact O-N 3.46Å
68V90.4Very high89.5Confident70 Ų7090.6 Ų90.642%0.42445%0.447SS..Hα-helixtrans-65-48.5178.9173.70000110.4T64 F66 K70 Y71 W72T64-V68 HydrophobicContact CG2-CG2 4.36Å; T64-V68 WeakPolarHBondContact O-CB 3.48Å; T64-V68 VanDerWaalsContact O-CG2 3.27Å; T64-V68 WeakPolarHBondContact O-CG2 3.27Å; T64-V68 PolarHBondContact O-N 3.28Å; F66-V68 PolarHBondContact O-N 2.81Å; V68-K70 PolarHBondContact O-N 2.9Å; V68-Y71 PolarHBondContact O-N 2.91Å; V68-W72 VanDerWaalsContact O-CD1 3.24Å; V68-W72 PolarHBondContact O-N 3.3Å
69S89.9Confident89.6Confident67 Ų6790.6 Ų90.647%0.46946%0.455SS..Hα-helixtrans-58.7-45.8179.4-630000112.1T65 F66 Y71 W72 C73T65-S69 WeakPolarHBondContact O-CB 3.5Å; T65-S69 PolarHBondContact O-N 3.22Å; T65-S69 PolarHBondContact O-OG 2.99Å; F66-S69 PolarHBondContact O-N 2.94Å; S69-Y71 PolarHBondContact O-N 3.28Å; S69-W72 PolarHBondContact O-N 2.89Å; S69-C73 WeakPolarHBondContact O-CB 3.38Å; S69-C73 PolarHBondContact O-N 3.37Å
70K87.9Confident89.9Confident109 Ų10992.7 Ų92.747%0.47447%0.469SS..Hα-helixtrans-58.7-47.4176.6-176.7178.473.890.50111.6F66 V68 Y74F66-K70 HydrophobicContact CE1-CD 4.41Å; F66-K70 WeakPolarHBondContact O-CB 3.36Å; F66-K70 PolarHBondContact O-N 2.89Å; V68-K70 PolarHBondContact O-N 2.9Å; K70-Y74 WeakPolarHBondContact O-CB 3.45Å; K70-Y74 PolarHBondContact O-N 2.9Å
71Y87.4Confident90.2Very high127 Ų12791.4 Ų91.450%0.49846%0.464SS..Hα-helixtrans-63.4-47.7-178.7178.2-102.4000112.5T67 V68 S69 Y74 R75T67-Y71 WeakPolarHBondContact O-CB 3.32Å; T67-Y71 PolarHBondContact O-N 3.46Å; V68-Y71 PolarHBondContact O-N 2.91Å; S69-Y71 PolarHBondContact O-N 3.28Å; Y71-Y74 PolarHBondContact O-N 3.44Å; Y71-R75 VanDerWaalsContact CE1-CD 3.43Å; Y71-R75 HydrophobicContact CE1-CG 4.44Å; Y71-R75 WeakPolarHBondContact O-CG 3.41Å; Y71-R75 PolarHBondContact O-N 3.27Å; Y71-R75 VanDerWaalsContact O-N 3.1Å; Y71-R75 PolarHBondContact OH-NH1 3Å
72W90.1Very high90.3Very high141 Ų14187.6 Ų87.653%0.53445%0.452SS..Hα-helixtrans-68.2-41.5179.7-80.297.4000112.6V68 S69 Y74 R75 I76V68-W72 VanDerWaalsContact O-CD1 3.24Å; V68-W72 PolarHBondContact O-N 3.3Å; S69-W72 PolarHBondContact O-N 2.89Å; W72-Y74 VanDerWaalsContact C-N 3.34Å; W72-Y74 PolarHBondContact O-N 2.89Å; W72-R75 PolarHBondContact O-N 2.96Å; W72-I76 WeakPolarHBondContact O-CG1 3.27Å; W72-I76 PolarHBondContact O-N 3.41Å
73C90.1Very high90.4Very high69 Ų6991.2 Ų91.247%0.46647%0.467SS..Hα-helixtrans-57.9-48.1175.2-175.60000111S69 R75 I76 L77S69-C73 WeakPolarHBondContact O-CB 3.38Å; S69-C73 PolarHBondContact O-N 3.37Å; C73-R75 VanDerWaalsContact C-N 3.33Å; C73-R75 PolarHBondContact O-N 3.39Å; C73-I76 PolarHBondContact O-N 2.83Å; C73-L77 WeakPolarHBondContact O-CB 3.31Å; C73-L77 WeakPolarHBondContact O-CG 3.41Å; C73-L77 PolarHBondContact O-N 3.34Å
74Y90.8Very high90.6Very high158 Ų15889.3 Ų89.362%0.6247%0.467SS*.Hα-helixtrans-58.1-43.1176.7176.7-103.1000112.5K70 Y71 W72 S78K70-Y74 WeakPolarHBondContact O-CB 3.45Å; K70-Y74 PolarHBondContact O-N 2.9Å; Y71-Y74 PolarHBondContact O-N 3.44Å; W72-Y74 VanDerWaalsContact C-N 3.34Å; W72-Y74 PolarHBondContact O-N 2.89Å; Y74-S78 WeakPolarHBondContact O-CB 3.27Å; Y74-S78 PolarHBondContact O-N 3.46Å; Y74-S78 PolarHBondContact O-OG 2.92Å
75R89.8Confident90.9Very high123 Ų12388.9 Ų88.946%0.46446%0.464SS..Hα-helixtrans-63.5-43.6178.4-75.9-177.666.2169.1-2.2112.7Y71 W72 C73 A79Y71-R75 VanDerWaalsContact CE1-CD 3.43Å; Y71-R75 HydrophobicContact CE1-CG 4.44Å; Y71-R75 WeakPolarHBondContact O-CG 3.41Å; Y71-R75 PolarHBondContact O-N 3.27Å; Y71-R75 VanDerWaalsContact O-N 3.1Å; Y71-R75 PolarHBondContact OH-NH1 3Å; W72-R75 PolarHBondContact O-N 2.96Å; C73-R75 VanDerWaalsContact C-N 3.33Å; C73-R75 PolarHBondContact O-N 3.39Å; R75-A79 VanDerWaalsContact O-CB 3.31Å; R75-A79 WeakPolarHBondContact O-CB 3.38Å; R75-A79 PolarHBondContact O-N 3.26Å
76I92.5Very high91Very high95 Ų9588.2 Ų88.249%0.48747%0.466SS..Hα-helixtrans-66.6-47.7179.7-67.1169.8000109.9W72 C73 S78 A79 I80W72-I76 WeakPolarHBondContact O-CG1 3.27Å; W72-I76 PolarHBondContact O-N 3.41Å; C73-I76 PolarHBondContact O-N 2.83Å; I76-S78 VanDerWaalsContact C-N 3.33Å; I76-S78 PolarHBondContact O-N 3.32Å; I76-A79 PolarHBondContact O-N 2.95Å; I76-I80 HydrophobicContact CG2-CD1 3.73Å; I76-I80 WeakPolarHBondContact O-CG1 3.41Å; I76-I80 PolarHBondContact O-N 3.42Å
77L89.7Confident91.2Very high87 Ų8791 Ų9146%0.45548%0.484SS..Hα-helixtrans-59.7-44.3176.9-72.4172.4000111.6C73 A79 I80 F81C73-L77 WeakPolarHBondContact O-CB 3.31Å; C73-L77 WeakPolarHBondContact O-CG 3.41Å; C73-L77 PolarHBondContact O-N 3.34Å; L77-A79 VanDerWaalsContact C-N 3.33Å; L77-A79 PolarHBondContact O-N 2.94Å; L77-I80 PolarHBondContact O-N 3.37Å; L77-F81 HydrophobicContact CD2-CD2 4.08Å; L77-F81 HydrophobicContact CD2-CE2 3.96Å; L77-F81 WeakPolarHBondContact O-CB 3.45Å; L77-F81 PolarHBondContact O-N 3.34Å
78S91.8Very high91.5Very high45 Ų4593.8 Ų93.832%0.31550%0.496SS..Hα-helixtrans-65.1-35.7177.2-60.30000112.4Y74 I76 G82Y74-S78 WeakPolarHBondContact O-CB 3.27Å; Y74-S78 PolarHBondContact O-N 3.46Å; Y74-S78 PolarHBondContact O-OG 2.92Å; I76-S78 VanDerWaalsContact C-N 3.33Å; I76-S78 PolarHBondContact O-N 3.32Å; S78-G82 WeakPolarHBondContact O-CA 3.49Å; S78-G82 PolarHBondContact O-N 3.17Å
79A91.1Very high91.7Very high76 Ų7698.1 Ų98.163%0.62851%0.505SS*.Hα-helixtrans-68.3-38.5176.900000112.1R75 I76 L77R75-A79 VanDerWaalsContact O-CB 3.31Å; R75-A79 WeakPolarHBondContact O-CB 3.38Å; R75-A79 PolarHBondContact O-N 3.26Å; I76-A79 PolarHBondContact O-N 2.95Å; L77-A79 VanDerWaalsContact C-N 3.33Å; L77-A79 PolarHBondContact O-N 2.94Å
80I92.7Very high91.9Very high100 Ų10097 Ų9751%0.51350%0.504SS..Hα-helixtrans-78.5-48.4-178.4-64.5168.9000111.1I76 L77 P84I76-I80 HydrophobicContact CG2-CD1 3.73Å; I76-I80 WeakPolarHBondContact O-CG1 3.41Å; I76-I80 PolarHBondContact O-N 3.42Å; L77-I80 PolarHBondContact O-N 3.37Å; I80-P84 WeakPolarHBondContact O-CD 3.3Å
81F93.9Very high92.2Very high116 Ų11698.4 Ų98.451%0.50951%0.51SS..Hα-helixtrans-102.1-14.7-170.4-63.9-73.2000114.2L77 I83 P84 V85L77-F81 HydrophobicContact CD2-CD2 4.08Å; L77-F81 HydrophobicContact CD2-CE2 3.96Å; L77-F81 WeakPolarHBondContact O-CB 3.45Å; L77-F81 PolarHBondContact O-N 3.34Å; F81-I83 PolarHBondContact O-N 3.4Å; F81-P84 WeakPolarHBondContact O-CD 3.29Å; F81-V85 HydrophobicContact CB-CG2 4.38Å; F81-V85 VanDerWaalsContact O-CB 3.26Å; F81-V85 WeakPolarHBondContact O-CB 3.44Å; F81-V85 WeakPolarHBondContact O-CG2 3.17Å; F81-V85 PolarHBondContact O-N 3.03Å
82G92.8Very high92.6Very high34 Ų3496.7 Ų96.735%0.35151%0.509SS..Hα-helixtrans-59.8-50.5-175.500000113S78 A86S78-G82 WeakPolarHBondContact O-CA 3.49Å; S78-G82 PolarHBondContact O-N 3.17Å; G82-A86 VanDerWaalsContact O-CB 3.29Å; G82-A86 WeakPolarHBondContact O-CB 3.37Å; G82-A86 PolarHBondContact O-N 3.3Å
83I91.4Very high92.7Very high125 Ų12596.3 Ų96.364%0.64151%0.512SS*.Hα-helixtrans-66.2-49.9-179.7-58.9169.8000111.4F81 V85 A86 L87F81-I83 PolarHBondContact O-N 3.4Å; I83-V85 VanDerWaalsContact C-N 3.35Å; I83-V85 PolarHBondContact O-N 2.72Å; I83-A86 PolarHBondContact O-N 2.96Å; I83-L87 HydrophobicContact CG2-CD1 4.21Å; I83-L87 WeakPolarHBondContact O-CG 3.26Å; I83-L87 PolarHBondContact O-N 3.32Å
84P93.9Very high92.9Very high63 Ų6395.9 Ų95.941%0.40951%0.513SS..Hα-helixtrans-56.1-44.9176.1-27.234.2000113.8I80 F81 L87 L88I80-P84 WeakPolarHBondContact O-CD 3.3Å; F81-P84 WeakPolarHBondContact O-CD 3.29Å; P84-L87 PolarHBondContact O-N 3.45Å; P84-L88 WeakPolarHBondContact O-CG 3.46Å; P84-L88 PolarHBondContact O-N 2.95Å
85V94.4Very high93.1Very high65 Ų6590.7 Ų90.739%0.39450%0.499SS..Hα-helixtrans-67.3-40.3-179.4171.90000111F81 I83 L87 L88 W89F81-V85 HydrophobicContact CB-CG2 4.38Å; F81-V85 VanDerWaalsContact O-CB 3.26Å; F81-V85 WeakPolarHBondContact O-CB 3.44Å; F81-V85 WeakPolarHBondContact O-CG2 3.17Å; F81-V85 PolarHBondContact O-N 3.03Å; I83-V85 VanDerWaalsContact C-N 3.35Å; I83-V85 PolarHBondContact O-N 2.72Å; V85-L87 VanDerWaalsContact C-N 3.33Å; V85-L87 PolarHBondContact O-N 2.96Å; V85-L88 PolarHBondContact O-N 3.45Å; V85-W89 VanDerWaalsContact O-CD1 3.3Å; V85-W89 PolarHBondContact O-N 3.48Å
86A93.1Very high93.3Very high64 Ų6490 Ų9053%0.52950%0.503SS..Hα-helixtrans-60.9-41.8175.300000112.1G82 I83 W89 G90G82-A86 VanDerWaalsContact O-CB 3.29Å; G82-A86 WeakPolarHBondContact O-CB 3.37Å; G82-A86 PolarHBondContact O-N 3.3Å; I83-A86 PolarHBondContact O-N 2.96Å; A86-W89 PolarHBondContact O-N 3.38Å; A86-G90 PolarHBondContact O-N 3.34Å
87L92.9Very high93.4Very high124 Ų12487.8 Ų87.865%0.64950%0.497SS*.Hα-helixtrans-64-44.3176.1-70.9173.9000112.1I83 P84 V85 G90 F91I83-L87 HydrophobicContact CG2-CD1 4.21Å; I83-L87 WeakPolarHBondContact O-CG 3.26Å; I83-L87 PolarHBondContact O-N 3.32Å; P84-L87 PolarHBondContact O-N 3.45Å; V85-L87 VanDerWaalsContact C-N 3.33Å; V85-L87 PolarHBondContact O-N 2.96Å; L87-G90 PolarHBondContact O-N 3.03Å; L87-F91 PolarHBondContact O-N 2.99Å
88L95.1Very high93.6Very high112 Ų11289.5 Ų89.559%0.58650%0.501SS*.Hα-helixtrans-60.4-46.4176.6-72172.1000111.5P84 V85 F91 L92P84-L88 WeakPolarHBondContact O-CG 3.46Å; P84-L88 PolarHBondContact O-N 2.95Å; V85-L88 PolarHBondContact O-N 3.45Å; L88-F91 PolarHBondContact O-N 3.35Å; L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.17Å; L88-L92 PolarHBondContact O-N 2.98Å
89W94.4Very high93.7Very high160 Ų16090.7 Ų90.761%0.60651%0.508SS*.Hα-helixtrans-62.7-42.4177.1-87.5106.8000112.6V85 A86 F91 L92 F93V85-W89 VanDerWaalsContact O-CD1 3.3Å; V85-W89 PolarHBondContact O-N 3.48Å; A86-W89 PolarHBondContact O-N 3.38Å; W89-F91 VanDerWaalsContact C-N 3.35Å; W89-F91 PolarHBondContact O-N 3.03Å; W89-L92 PolarHBondContact O-N 2.88Å; W89-F93 WeakPolarHBondContact O-CB 3.48Å; W89-F93 PolarHBondContact O-N 3.35Å
90G94.2Very high93.7Very high44 Ų4491.8 Ų91.845%0.45450%0.5SS..Hα-helixtrans-59.7-44.9175.700000112.4A86 L87 F93 A94A86-G90 PolarHBondContact O-N 3.34Å; L87-G90 PolarHBondContact O-N 3.03Å; G90-F93 PolarHBondContact O-N 3.39Å; G90-A94 PolarHBondContact O-N 3.23Å
91F94.7Very high93.8Very high139 Ų13991.9 Ų91.961%0.6150%0.5SS*.Hα-helixtrans-63.5-46.3176.7-179.7-102.4000112.3L87 L88 W89 F93 A94 C95L87-F91 PolarHBondContact O-N 2.99Å; L88-F91 PolarHBondContact O-N 3.35Å; W89-F91 VanDerWaalsContact C-N 3.35Å; W89-F91 PolarHBondContact O-N 3.03Å; F91-F93 VanDerWaalsContact C-N 3.33Å; F91-F93 PolarHBondContact O-N 2.94Å; F91-A94 WeakPolarHBondContact O-CB 3.48Å; F91-A94 PolarHBondContact O-N 3.41Å; F91-A94 VanDerWaalsContact O-N 3.17Å; F91-C95 VanDerWaalsContact CZ-SG 3.55Å; F91-C95 PolarHBondContact O-N 3.16Å; F91-C95 PolarHBondContact O-SG 2.9Å
92L94.5Very high93.7Very high90 Ų9095 Ų9547%0.47151%0.509SS..Hα-helixtrans-58.1-45.5176.7-72.9171.9000111.6L88 W89 A94 C95 I96L88-L92 VanDerWaalsContact O-CG 3.3Å; L88-L92 WeakPolarHBondContact O-CG 3.17Å; L88-L92 PolarHBondContact O-N 2.98Å; W89-L92 PolarHBondContact O-N 2.88Å; L92-A94 VanDerWaalsContact C-N 3.29Å; L92-A94 PolarHBondContact O-N 3.49Å; L92-C95 PolarHBondContact O-N 3.35Å; L92-I96 VanDerWaalsContact O-CG1 3.27Å; L92-I96 WeakPolarHBondContact O-CG1 3.06Å; L92-I96 PolarHBondContact O-N 3.4Å
93F93.3Very high93.6Very high134 Ų13495.8 Ų95.859%0.58851%0.512SS*.Hα-helixtrans-62.9-37.6178.2-124.8-86.7000112.2W89 G90 F91 S97W89-F93 WeakPolarHBondContact O-CB 3.48Å; W89-F93 PolarHBondContact O-N 3.35Å; G90-F93 PolarHBondContact O-N 3.39Å; F91-F93 VanDerWaalsContact C-N 3.33Å; F91-F93 PolarHBondContact O-N 2.94Å; F93-S97 VanDerWaalsContact O-CB 3.29Å; F93-S97 WeakPolarHBondContact O-CB 3.49Å; F93-S97 PolarHBondContact O-N 3.44Å; F93-S97 PolarHBondContact O-OG 3.12Å
94A94.7Very high93.6Very high59 Ų5992.7 Ų92.749%0.48850%0.499SS..Hα-helixtrans-64.2-46.2174.900000111.7G90 F91 L92 S97 F98G90-A94 PolarHBondContact O-N 3.23Å; F91-A94 WeakPolarHBondContact O-CB 3.48Å; F91-A94 PolarHBondContact O-N 3.41Å; F91-A94 VanDerWaalsContact O-N 3.17Å; L92-A94 VanDerWaalsContact C-N 3.29Å; L92-A94 PolarHBondContact O-N 3.49Å; A94-S97 PolarHBondContact O-N 3.33Å; A94-F98 WeakPolarHBondContact O-CB 2.96Å; A94-F98 PolarHBondContact O-N 3.4Å
95C94.4Very high93.5Very high50 Ų5092.4 Ų92.434%0.33850%0.496SS..Hα-helixtrans-61.6-45.3175.9-690000112.3F91 L92 S97 F98 C99F91-C95 VanDerWaalsContact CZ-SG 3.55Å; F91-C95 PolarHBondContact O-N 3.16Å; F91-C95 PolarHBondContact O-SG 2.9Å; L92-C95 PolarHBondContact O-N 3.35Å; C95-S97 VanDerWaalsContact C-N 3.32Å; C95-S97 PolarHBondContact O-N 2.9Å; C95-F98 PolarHBondContact O-N 2.85Å; C95-C99 PolarHBondContact O-N 3.5Å; C95-C99 PolarHBondContact O-SG 3.07Å; C95-C99 VanDerWaalsContact O-SG 3.37Å
96I93.8Very high93.4Very high107 Ų10792.2 Ų92.255%0.54950%0.496SS..Hα-helixtrans-60.1-45.7176.8-69166.1000110.1L92 F98 C99 H100L92-I96 VanDerWaalsContact O-CG1 3.27Å; L92-I96 WeakPolarHBondContact O-CG1 3.06Å; L92-I96 PolarHBondContact O-N 3.4Å; I96-F98 VanDerWaalsContact C-N 3.32Å; I96-F98 PolarHBondContact O-N 2.85Å; I96-C99 PolarHBondContact O-N 2.93Å; I96-H100 VanDerWaalsContact O-CB 3.31Å; I96-H100 WeakPolarHBondContact O-CB 3.15Å; I96-H100 PolarHBondContact O-N 3.07Å
97S94.8Very high93.1Very high50 Ų5092.9 Ų92.935%0.3550%0.496SS..Hα-helixtrans-61.9-41.9178.8-59.30000111.5F93 A94 C95 H100 I101F93-S97 VanDerWaalsContact O-CB 3.29Å; F93-S97 WeakPolarHBondContact O-CB 3.49Å; F93-S97 PolarHBondContact O-N 3.44Å; F93-S97 PolarHBondContact O-OG 3.12Å; A94-S97 PolarHBondContact O-N 3.33Å; C95-S97 VanDerWaalsContact C-N 3.32Å; C95-S97 PolarHBondContact O-N 2.9Å; S97-H100 PolarHBondContact O-N 3.42Å; S97-I101 WeakPolarHBondContact O-CD1 3.35Å; S97-I101 VanDerWaalsContact O-CG1 3.27Å; S97-I101 WeakPolarHBondContact O-CG1 3.14Å; S97-I101 PolarHBondContact O-N 2.84Å
98F94.3Very high93Very high123 Ų12391.2 Ų91.254%0.53949%0.487SS..Hα-helixtrans-61.1-52.9174.8179.4-96.1000111.4A94 C95 I96 H100 I101 W102A94-F98 WeakPolarHBondContact O-CB 2.96Å; A94-F98 PolarHBondContact O-N 3.4Å; C95-F98 PolarHBondContact O-N 2.85Å; I96-F98 VanDerWaalsContact C-N 3.32Å; I96-F98 PolarHBondContact O-N 2.85Å; F98-H100 VanDerWaalsContact C-N 3.27Å; F98-H100 PolarHBondContact O-N 3.45Å; F98-I101 PolarHBondContact O-N 3.32Å; F98-W102 AromaticContact CD2-CD1 3.21Å; F98-W102 HydrophobicContact CD2-CG 4.1Å; F98-W102 AromaticContact CD2-NE1 3.5Å; F98-W102 HydrophobicContact CE2-CB 4.47Å; F98-W102 AromaticContact CE2-CD1 3.27Å; F98-W102 HydrophobicContact CE2-CD2 4.25Å; F98-W102 AromaticContact CE2-CG 3.77Å; F98-W102 HydrophobicContact CE2-CG 3.77Å; F98-W102 AromaticContact CE2-NE1 3.46Å; F98-W102 AromaticContact CG-CD1 3.84Å; F98-W102 HydrophobicContact CZ-CB 4.33Å; F98-W102 AromaticContact CZ-CD1 3.95Å; F98-W102 HydrophobicContact CZ-CG 4.06Å; F98-W102 WeakPolarHBondContact O-CB 3.46Å; F98-W102 PolarHBondContact O-N 3Å
99C92.7Very high92.6Very high70 Ų7092.2 Ų92.247%0.47349%0.486SS..Hα-helixtrans-58.5-40177.5-69.40000112C95 I96 A103 V104C95-C99 PolarHBondContact O-N 3.5Å; C95-C99 PolarHBondContact O-SG 3.07Å; C95-C99 VanDerWaalsContact O-SG 3.37Å; I96-C99 PolarHBondContact O-N 2.93Å; C99-A103 WeakPolarHBondContact O-CA 3.29Å; C99-A103 VanDerWaalsContact O-CB 3.27Å; C99-A103 WeakPolarHBondContact O-CB 3.4Å; C99-A103 PolarHBondContact O-N 3.17Å; C99-V104 PolarHBondContact O-N 2.86Å
100H92.4Very high92.3Very high99 Ų9987.9 Ų87.946%0.45848%0.481SS..Iπ-helixtrans-62.2-49.6178.3-178.9-94.1000111.7I96 S97 F98 V104 V105I96-H100 VanDerWaalsContact O-CB 3.31Å; I96-H100 WeakPolarHBondContact O-CB 3.15Å; I96-H100 PolarHBondContact O-N 3.07Å; S97-H100 PolarHBondContact O-N 3.42Å; F98-H100 VanDerWaalsContact C-N 3.27Å; F98-H100 PolarHBondContact O-N 3.45Å; H100-V104 WeakPolarHBondContact O-CB 3.17Å; H100-V104 PolarHBondContact O-N 3.47Å; H100-V105 WeakPolarHBondContact O-CG2 3.41Å; H100-V105 PolarHBondContact O-N 2.97Å
101I93.9Very high91.9Very high101 Ų10190 Ų9052%0.51849%0.488SS..Iπ-helixtrans-71-42.6-176.7-64.2162.1000111.4S97 F98 P106S97-I101 WeakPolarHBondContact O-CD1 3.35Å; S97-I101 VanDerWaalsContact O-CG1 3.27Å; S97-I101 WeakPolarHBondContact O-CG1 3.14Å; S97-I101 PolarHBondContact O-N 2.84Å; F98-I101 PolarHBondContact O-N 3.32Å; I101-P106 VanDerWaalsContact O-CD 3.32Å; I101-P106 WeakPolarHBondContact O-CD 3.37Å
102W92.6Very high91.5Very high181 Ų18188.3 Ų88.369%0.68649%0.485SS*.Iπ-helixtrans-94.9-25-169.1-67.395000114.4F98 P106F98-W102 AromaticContact CD2-CD1 3.21Å; F98-W102 HydrophobicContact CD2-CG 4.1Å; F98-W102 AromaticContact CD2-NE1 3.5Å; F98-W102 HydrophobicContact CE2-CB 4.47Å; F98-W102 AromaticContact CE2-CD1 3.27Å; F98-W102 HydrophobicContact CE2-CD2 4.25Å; F98-W102 AromaticContact CE2-CG 3.77Å; F98-W102 HydrophobicContact CE2-CG 3.77Å; F98-W102 AromaticContact CE2-NE1 3.46Å; F98-W102 AromaticContact CG-CD1 3.84Å; F98-W102 HydrophobicContact CZ-CB 4.33Å; F98-W102 AromaticContact CZ-CD1 3.95Å; F98-W102 HydrophobicContact CZ-CG 4.06Å; F98-W102 WeakPolarHBondContact O-CB 3.46Å; F98-W102 PolarHBondContact O-N 3Å; W102-P106 WeakPolarHBondContact O-CG 3.35Å
103A89.6Confident91.3Very high51 Ų5188.9 Ų88.942%0.42149%0.487SS..Iπ-helixtrans-110.9-53.817700000111.3C99 P106 C107C99-A103 WeakPolarHBondContact O-CA 3.29Å; C99-A103 VanDerWaalsContact O-CB 3.27Å; C99-A103 WeakPolarHBondContact O-CB 3.4Å; C99-A103 PolarHBondContact O-N 3.17Å; A103-P106 WeakPolarHBondContact O-CD 3.28Å; A103-C107 VanDerWaalsContact O-CB 3.28Å; A103-C107 WeakPolarHBondContact O-CB 3.42Å; A103-C107 PolarHBondContact O-N 2.88Å; A103-C107 PolarHBondContact O-SG 3.4Å
104V92.3Very high90.8Very high60 Ų6088.4 Ų88.436%0.36449%0.486SS..Iπ-helixtrans-68.3-47.9-171.5-179.60000112C99 H100 C107 I108C99-V104 PolarHBondContact O-N 2.86Å; H100-V104 WeakPolarHBondContact O-CB 3.17Å; H100-V104 PolarHBondContact O-N 3.47Å; V104-C107 PolarHBondContact O-N 2.78Å; V104-I108 HydrophobicContact CG1-CD1 3.6Å; V104-I108 HydrophobicContact CG1-CG1 4.12Å; V104-I108 WeakPolarHBondContact O-CB 3.12Å; V104-I108 VanDerWaalsContact O-CG1 3.29Å; V104-I108 WeakPolarHBondContact O-CG1 3.44Å; V104-I108 PolarHBondContact O-N 3.43Å
105V92.3Very high90.1Very high58 Ų5888.7 Ų88.735%0.35249%0.485SS..Hα-helixtrans-61.1-47.7-179.1171.50000111.7H100 C107 I108 K109H100-V105 WeakPolarHBondContact O-CG2 3.41Å; H100-V105 PolarHBondContact O-N 2.97Å; V105-C107 PolarHBondContact O-N 2.9Å; V105-I108 PolarHBondContact O-N 2.89Å; V105-K109 HydrophobicContact CG1-CG 4.42Å; V105-K109 WeakPolarHBondContact O-CB 3.09Å; V105-K109 WeakPolarHBondContact O-CG 3.47Å; V105-K109 PolarHBondContact O-N 2.64Å
106P90.9Very high89.6Confident60 Ų6091.8 Ų91.839%0.3950%0.495SS..Hα-helixtrans-59.7-43.5172.5-28.237.7000113.1I101 W102 A103 I108 K109 S110I101-P106 VanDerWaalsContact O-CD 3.32Å; I101-P106 WeakPolarHBondContact O-CD 3.37Å; W102-P106 WeakPolarHBondContact O-CG 3.35Å; A103-P106 WeakPolarHBondContact O-CD 3.28Å; P106-I108 PolarHBondContact O-N 3.4Å; P106-K109 PolarHBondContact O-N 3.38Å; P106-S110 WeakPolarHBondContact O-CB 3.23Å; P106-S110 PolarHBondContact O-N 3.43Å; P106-S110 PolarHBondContact O-OG 2.71Å
107C86.8Confident88.8Confident79 Ų7989.4 Ų89.453%0.53449%0.487SS..Hα-helixtrans-60.8-43.3177.3-73.60000112.4A103 V104 V105 S110 C111A103-C107 VanDerWaalsContact O-CB 3.28Å; A103-C107 WeakPolarHBondContact O-CB 3.42Å; A103-C107 PolarHBondContact O-N 2.88Å; A103-C107 PolarHBondContact O-SG 3.4Å; V104-C107 PolarHBondContact O-N 2.78Å; V105-C107 PolarHBondContact O-N 2.9Å; C107-S110 PolarHBondContact O-N 2.69Å; C107-C111 WeakPolarHBondContact O-CB 3.15Å; C107-C111 PolarHBondContact O-N 2.96Å
108I90.6Very high88.3Confident88 Ų8892.2 Ų92.245%0.45150%0.497SS..Hα-helixtrans-61.7-46.7175.1-69.3171000109.6V104 V105 P106 S110 C111 L112V104-I108 HydrophobicContact CG1-CD1 3.6Å; V104-I108 HydrophobicContact CG1-CG1 4.12Å; V104-I108 WeakPolarHBondContact O-CB 3.12Å; V104-I108 VanDerWaalsContact O-CG1 3.29Å; V104-I108 WeakPolarHBondContact O-CG1 3.44Å; V104-I108 PolarHBondContact O-N 3.43Å; V105-I108 PolarHBondContact O-N 2.89Å; P106-I108 PolarHBondContact O-N 3.4Å; I108-S110 VanDerWaalsContact C-N 3.33Å; I108-S110 PolarHBondContact O-N 3.09Å; I108-C111 PolarHBondContact O-N 2.93Å; I108-L112 HydrophobicContact CG2-CD1 4.11Å; I108-L112 HydrophobicContact CG2-CG 4.43Å; I108-L112 WeakPolarHBondContact O-CG 3.33Å; I108-L112 PolarHBondContact O-N 3.41Å
109K88.1Confident87.8Confident133 Ų13389.3 Ų89.358%0.57849%0.492SS*.Hα-helixtrans-60.5-41.9178.2-68.9-75.3-174.1170.10111.7V105 P106 L112 I113V105-K109 HydrophobicContact CG1-CG 4.42Å; V105-K109 WeakPolarHBondContact O-CB 3.09Å; V105-K109 WeakPolarHBondContact O-CG 3.47Å; V105-K109 PolarHBondContact O-N 2.64Å; P106-K109 PolarHBondContact O-N 3.38Å; K109-L112 PolarHBondContact O-N 3.39Å; K109-I113 WeakPolarHBondContact O-CG1 3.25Å; K109-I113 PolarHBondContact O-N 3.46Å; K109-I113 VanDerWaalsContact O-N 3.14Å
110S86.5Confident87.4Confident69 Ų6993.7 Ų93.748%0.48350%0.498SS..Hα-helixtrans-63.3-46.8174.3-66.50000112P106 C107 I108 L112 I113 E114P106-S110 WeakPolarHBondContact O-CB 3.23Å; P106-S110 PolarHBondContact O-N 3.43Å; P106-S110 PolarHBondContact O-OG 2.71Å; C107-S110 PolarHBondContact O-N 2.69Å; I108-S110 VanDerWaalsContact C-N 3.33Å; I108-S110 PolarHBondContact O-N 3.09Å; S110-L112 VanDerWaalsContact C-N 3.27Å; S110-L112 PolarHBondContact O-N 3.34Å; S110-I113 PolarHBondContact O-N 3.05Å; S110-I113 VanDerWaalsContact O-N 3.13Å; S110-E114 WeakPolarHBondContact O-CG 3.17Å; S110-E114 PolarHBondContact O-N 3.23Å
111C87.3Confident87.1Confident90 Ų9094 Ų9461%0.60850%0.502SS*.Hα-helixtrans-59.3-36.9175.1-88.30000112.7C107 I108 E114 S115C107-C111 WeakPolarHBondContact O-CB 3.15Å; C107-C111 PolarHBondContact O-N 2.96Å; I108-C111 PolarHBondContact O-N 2.93Å; C111-E114 PolarHBondContact O-N 3.47Å; C111-S115 VanDerWaalsContact O-CB 3.29Å; C111-S115 WeakPolarHBondContact O-CB 3.36Å; C111-S115 PolarHBondContact O-N 2.93Å
112L86.7Confident86.8Confident103 Ų10396.4 Ų96.454%0.53951%0.506SS..Hα-helixtrans-66.2-38.5176.3-72.1173.3000112I108 K109 S110 S115 Q116I108-L112 HydrophobicContact CG2-CD1 4.11Å; I108-L112 HydrophobicContact CG2-CG 4.43Å; I108-L112 WeakPolarHBondContact O-CG 3.33Å; I108-L112 PolarHBondContact O-N 3.41Å; K109-L112 PolarHBondContact O-N 3.39Å; S110-L112 VanDerWaalsContact C-N 3.27Å; S110-L112 PolarHBondContact O-N 3.34Å; L112-S115 PolarHBondContact O-N 3.49Å; L112-Q116 WeakPolarHBondContact O-CB 3.43Å; L112-Q116 PolarHBondContact O-N 3.46Å
113I88.6Confident86.5Confident102 Ų10290.7 Ų90.752%0.52349%0.494SS..Hα-helixtrans-64.3-46.5175.2-65.1163.9000110.2K109 S110 S115 Q116 C117K109-I113 WeakPolarHBondContact O-CG1 3.25Å; K109-I113 PolarHBondContact O-N 3.46Å; K109-I113 VanDerWaalsContact O-N 3.14Å; S110-I113 PolarHBondContact O-N 3.05Å; S110-I113 VanDerWaalsContact O-N 3.13Å; I113-S115 PolarHBondContact O-N 3.47Å; I113-Q116 WeakPolarHBondContact O-CB 3.45Å; I113-Q116 PolarHBondContact O-N 3.27Å; I113-Q116 VanDerWaalsContact O-N 3.17Å; I113-C117 PolarHBondContact O-N 3.36Å; I113-C117 VanDerWaalsContact O-N 3.15Å
114E83.6Confident86.4Confident123 Ų12393.3 Ų93.358%0.57550%0.5SS*.Hα-helixtrans-60.1-45.1175.4-67.9-61149.300111.6S110 C111 Q116 C117 I118S110-E114 WeakPolarHBondContact O-CG 3.17Å; S110-E114 PolarHBondContact O-N 3.23Å; C111-E114 PolarHBondContact O-N 3.47Å; E114-Q116 VanDerWaalsContact C-N 3.25Å; E114-Q116 PolarHBondContact O-N 2.93Å; E114-C117 WeakPolarHBondContact O-CB 3.22Å; E114-C117 PolarHBondContact O-N 2.97Å; E114-C117 VanDerWaalsContact O-N 3.12Å; E114-I118 WeakPolarHBondContact O-CG1 3.37Å; E114-I118 PolarHBondContact O-N 2.76Å
115S80.6Confident86.1Confident66 Ų6693.3 Ų93.346%0.46250%0.502SS..Hα-helixtrans-61.9-33.1176.5-174.70000112.4C111 L112 I113 C117 I118 S119C111-S115 VanDerWaalsContact O-CB 3.29Å; C111-S115 WeakPolarHBondContact O-CB 3.36Å; C111-S115 PolarHBondContact O-N 2.93Å; L112-S115 PolarHBondContact O-N 3.49Å; I113-S115 PolarHBondContact O-N 3.47Å; S115-C117 VanDerWaalsContact C-N 3.34Å; S115-I118 PolarHBondContact O-N 3.23Å; S115-S119 VanDerWaalsContact O-CB 3.28Å; S115-S119 WeakPolarHBondContact O-CB 3.4Å; S115-S119 PolarHBondContact O-N 3.02Å
116Q82.8Confident85.9Confident115 Ų11593.4 Ų93.454%0.53750%0.5SS..Hα-helixtrans-70.5-33.8177.2-159.7169.14.400111.4L112 I113 E114 R120L112-Q116 WeakPolarHBondContact O-CB 3.43Å; L112-Q116 PolarHBondContact O-N 3.46Å; I113-Q116 WeakPolarHBondContact O-CB 3.45Å; I113-Q116 PolarHBondContact O-N 3.27Å; I113-Q116 VanDerWaalsContact O-N 3.17Å; E114-Q116 VanDerWaalsContact C-N 3.25Å; E114-Q116 PolarHBondContact O-N 2.93Å; Q116-R120 WeakPolarHBondContact O-CG 3.38Å; Q116-R120 PolarHBondContact O-N 2.86Å
117C76.7Confident85.7Confident56 Ų5696.4 Ų96.438%0.37851%0.508SS..Hα-helixtrans-65.9-47.2170.2-67.50000111.7I113 E114 S115 S119 R120 I121I113-C117 PolarHBondContact O-N 3.36Å; I113-C117 VanDerWaalsContact O-N 3.15Å; E114-C117 WeakPolarHBondContact O-CB 3.22Å; E114-C117 PolarHBondContact O-N 2.97Å; E114-C117 VanDerWaalsContact O-N 3.12Å; S115-C117 VanDerWaalsContact C-N 3.34Å; C117-S119 VanDerWaalsContact C-N 3.33Å; C117-S119 PolarHBondContact O-N 3.1Å; C117-R120 PolarHBondContact O-N 3.02Å; C117-I121 WeakPolarHBondContact O-CG1 3.48Å; C117-I121 PolarHBondContact O-N 2.92Å; C117-I121 VanDerWaalsContact O-N 3.08Å
118I84.8Confident85.7Confident109 Ų10996.9 Ų96.956%0.55951%0.509SS*.Hα-helixtrans-60.7-43.3176.8-65.5168000110.8E114 S115 R120 I121 Y122E114-I118 WeakPolarHBondContact O-CG1 3.37Å; E114-I118 PolarHBondContact O-N 2.76Å; S115-I118 PolarHBondContact O-N 3.23Å; I118-R120 VanDerWaalsContact C-N 3.3Å; I118-R120 PolarHBondContact O-N 3.19Å; I118-I121 PolarHBondContact O-N 3.01Å; I118-Y122 VanDerWaalsContact O-CB 3.26Å; I118-Y122 WeakPolarHBondContact O-CB 3.22Å; I118-Y122 PolarHBondContact O-N 3.4Å
119S84.1Confident85.4Confident63 Ų6399.6 Ų99.644%0.44152%0.518SS..Hα-helixtrans-59.6-39.1177.4174.40000112.4S115 C117 S123S115-S119 VanDerWaalsContact O-CB 3.28Å; S115-S119 WeakPolarHBondContact O-CB 3.4Å; S115-S119 PolarHBondContact O-N 3.02Å; C117-S119 VanDerWaalsContact C-N 3.33Å; C117-S119 PolarHBondContact O-N 3.1Å; S119-S123 WeakPolarHBondContact O-CB 3.34Å; S119-S123 PolarHBondContact O-N 3.33Å; S119-S123 PolarHBondContact O-OG 2.88Å
120R84.3Confident85Confident161 Ų16195.5 Ų95.561%0.60851%0.505SS*.Hα-helixtrans-64.8-46.5174-73174.8-177.5166.42.2111.9Q116 C117 I118 Y122 S123 L124Q116-R120 WeakPolarHBondContact O-CG 3.38Å; Q116-R120 PolarHBondContact O-N 2.86Å; C117-R120 PolarHBondContact O-N 3.02Å; I118-R120 VanDerWaalsContact C-N 3.3Å; I118-R120 PolarHBondContact O-N 3.19Å; R120-Y122 VanDerWaalsContact C-N 3.34Å; R120-Y122 PolarHBondContact O-N 3.22Å; R120-S123 PolarHBondContact O-N 3.04Å; R120-L124 WeakPolarHBondContact O-CG 3.21Å; R120-L124 PolarHBondContact O-N 3.25Å
121I86.4Confident84.8Confident105 Ų10596 Ų9654%0.53850%0.502SS..Hα-helixtrans-61.6-46.1177.8-64.4165.5000110.2C117 I118 S123 L124 C125C117-I121 WeakPolarHBondContact O-CG1 3.48Å; C117-I121 PolarHBondContact O-N 2.92Å; C117-I121 VanDerWaalsContact O-N 3.08Å; I118-I121 PolarHBondContact O-N 3.01Å; I121-S123 VanDerWaalsContact C-N 3.34Å; I121-S123 PolarHBondContact O-N 3.27Å; I121-L124 WeakPolarHBondContact O-CB 3.31Å; I121-L124 PolarHBondContact O-N 3.11Å; I121-C125 PolarHBondContact O-N 2.84Å; I121-C125 PolarHBondContact O-SG 3.37Å; I121-C125 VanDerWaalsContact O-SG 3.34Å
122Y86.6Confident84.7Confident153 Ų15395 Ų9560%0.650%0.495SS*.Hα-helixtrans-58.6-44.2176.5-179.8-103000112.2I118 R120 C125 I126I118-Y122 VanDerWaalsContact O-CB 3.26Å; I118-Y122 WeakPolarHBondContact O-CB 3.22Å; I118-Y122 PolarHBondContact O-N 3.4Å; R120-Y122 VanDerWaalsContact C-N 3.34Å; R120-Y122 PolarHBondContact O-N 3.22Å; Y122-C125 PolarHBondContact O-N 2.84Å; Y122-I126 HydrophobicContact CD1-CD1 3.99Å; Y122-I126 HydrophobicContact CE1-CD1 3.34Å; Y122-I126 HydrophobicContact CE1-CG1 4.3Å; Y122-I126 HydrophobicContact CE2-CD1 4.27Å; Y122-I126 PolarHBondContact O-N 2.89Å
123S87.1Confident84.6Confident61 Ų6196.4 Ų96.443%0.42750%0.497SS..Hα-helixtrans-63.2-43176.4-56.40000111.6S119 R120 I121 C125 I126 Q127S119-S123 WeakPolarHBondContact O-CB 3.34Å; S119-S123 PolarHBondContact O-N 3.33Å; S119-S123 PolarHBondContact O-OG 2.88Å; R120-S123 PolarHBondContact O-N 3.04Å; I121-S123 VanDerWaalsContact C-N 3.34Å; I121-S123 PolarHBondContact O-N 3.27Å; S123-C125 VanDerWaalsContact C-N 3.34Å; S123-C125 PolarHBondContact O-N 3.49Å; S123-I126 PolarHBondContact O-N 3.42Å; S123-Q127 WeakPolarHBondContact O-CB 3.25Å; S123-Q127 PolarHBondContact O-N 3.07Å
124L87.2Confident84.4Confident105 Ų10597.9 Ų97.955%0.5550%0.5SS..Hα-helixtrans-62-40.9174.8-71.8169.1000111.9R120 I121 Q127 T128R120-L124 WeakPolarHBondContact O-CG 3.21Å; R120-L124 PolarHBondContact O-N 3.25Å; I121-L124 WeakPolarHBondContact O-CB 3.31Å; I121-L124 PolarHBondContact O-N 3.11Å; L124-Q127 PolarHBondContact O-N 3.17Å; L124-T128 VanDerWaalsContact O-CB 3.29Å; L124-T128 WeakPolarHBondContact O-CB 3.42Å; L124-T128 PolarHBondContact O-N 3.37Å; L124-T128 PolarHBondContact O-OG1 3.48Å
125C86Confident84.5Confident60 Ų6097.7 Ų97.741%0.40550%0.499SS..Hα-helixtrans-62.5-46.3175.9-72.30000111.7I121 Y122 S123 Q127 T128 F129I121-C125 PolarHBondContact O-N 2.84Å; I121-C125 PolarHBondContact O-SG 3.37Å; I121-C125 VanDerWaalsContact O-SG 3.34Å; Y122-C125 PolarHBondContact O-N 2.84Å; S123-C125 VanDerWaalsContact C-N 3.34Å; S123-C125 PolarHBondContact O-N 3.49Å; C125-Q127 VanDerWaalsContact C-N 3.34Å; C125-Q127 PolarHBondContact O-N 3.48Å; C125-T128 PolarHBondContact O-N 3.48Å; C125-F129 WeakPolarHBondContact O-CB 3.33Å; C125-F129 WeakPolarHBondContact O-CD2 3.24Å; C125-F129 PolarHBondContact O-N 3.45Å
126I88.2Confident84.7Confident60 Ų6096.9 Ų96.931%0.30850%0.496SS..Iπ-helixtrans-59.2-48175.5-70.8-177.3000110.3Y122 S123 T128 F129 C130 D131Y122-I126 HydrophobicContact CD1-CD1 3.99Å; Y122-I126 HydrophobicContact CE1-CD1 3.34Å; Y122-I126 HydrophobicContact CE1-CG1 4.3Å; Y122-I126 HydrophobicContact CE2-CD1 4.27Å; Y122-I126 PolarHBondContact O-N 2.89Å; S123-I126 PolarHBondContact O-N 3.42Å; I126-T128 VanDerWaalsContact C-N 3.28Å; I126-T128 PolarHBondContact O-N 2.97Å; I126-F129 PolarHBondContact O-N 3.37Å; I126-C130 HydrophobicContact CB-CB 4.48Å; I126-C130 HydrophobicContact CG2-CB 3.95Å; I126-C130 CarbonylContact O-C 3.59Å; I126-C130 VanDerWaalsContact O-CA 3.3Å; I126-C130 WeakPolarHBondContact O-CA 3.39Å; I126-C130 WeakPolarHBondContact O-CB 3.46Å; I126-C130 PolarHBondContact O-N 3.04Å; I126-D131 PolarHBondContact O-N 3.03Å
127Q87.5Confident84.8Confident123 Ų12394 Ų9458%0.57549%0.485SS*.Iπ-helixtrans-66.7-29.4-178.3-169.4161.319.200113.2S123 L124 C125 D131S123-Q127 WeakPolarHBondContact O-CB 3.25Å; S123-Q127 PolarHBondContact O-N 3.07Å; L124-Q127 PolarHBondContact O-N 3.17Å; C125-Q127 VanDerWaalsContact C-N 3.34Å; C125-Q127 PolarHBondContact O-N 3.48Å; Q127-D131 WeakPolarHBondContact CG-OD2 3.45Å; Q127-D131 WeakPolarHBondContact O-CB 3.33Å
128T86.5Confident85.2Confident89 Ų8993.3 Ų93.355%0.54649%0.486SS..Iπ-helixtrans-84.4-34.7-179.4-53.10000112.5L124 C125 I126 P132L124-T128 VanDerWaalsContact O-CB 3.29Å; L124-T128 WeakPolarHBondContact O-CB 3.42Å; L124-T128 PolarHBondContact O-N 3.37Å; L124-T128 PolarHBondContact O-OG1 3.48Å; C125-T128 PolarHBondContact O-N 3.48Å; I126-T128 VanDerWaalsContact C-N 3.28Å; I126-T128 PolarHBondContact O-N 2.97Å; T128-P132 WeakPolarHBondContact O-CG 3.46Å
129F83.3Confident85.1Confident146 Ų14694 Ų9464%0.6449%0.485SS*.Iπ-helixtrans-109.7-48-173.4-68.5-76.6000113.1C125 I126 F133C125-F129 WeakPolarHBondContact O-CB 3.33Å; C125-F129 WeakPolarHBondContact O-CD2 3.24Å; C125-F129 PolarHBondContact O-N 3.45Å; I126-F129 PolarHBondContact O-N 3.37Å; F129-F133 VanDerWaalsContact O-CB 3.24Å; F129-F133 WeakPolarHBondContact O-CB 3.44Å; F129-F133 PolarHBondContact O-N 2.83Å
130C80.6Confident85Confident46 Ų4696.3 Ų96.331%0.31149%0.492SS..Iπ-helixtrans-76.4-44.2-175.2-63.80000111.3I126 F133 F134I126-C130 HydrophobicContact CB-CB 4.48Å; I126-C130 HydrophobicContact CG2-CB 3.95Å; I126-C130 CarbonylContact O-C 3.59Å; I126-C130 VanDerWaalsContact O-CA 3.3Å; I126-C130 WeakPolarHBondContact O-CA 3.39Å; I126-C130 WeakPolarHBondContact O-CB 3.46Å; I126-C130 PolarHBondContact O-N 3.04Å; C130-F133 WeakPolarHBondContact O-CB 3.28Å; C130-F133 PolarHBondContact O-N 2.97Å; C130-F133 VanDerWaalsContact O-N 3.14Å; C130-F134 HydrophobicContact CB-CD2 3.89Å; C130-F134 HydrophobicContact CB-CE2 3.86Å; C130-F134 WeakPolarHBondContact O-CB 3.42Å; C130-F134 WeakPolarHBondContact O-CD2 3.41Å; C130-F134 PolarHBondContact O-N 3.3Å
131D82.4Confident84.7Confident79 Ų7995.4 Ų95.442%0.42249%0.493SS..Hα-helixtrans-56.4-52.9179.5-76.22.5000113I126 Q127 F133 F134 E135I126-D131 PolarHBondContact O-N 3.03Å; Q127-D131 WeakPolarHBondContact CG-OD2 3.45Å; Q127-D131 WeakPolarHBondContact O-CB 3.33Å; D131-F133 PolarHBondContact O-N 2.91Å; D131-F134 PolarHBondContact O-N 3.43Å; D131-E135 WeakPolarHBondContact O-CB 3.42Å; D131-E135 PolarHBondContact O-N 3.43Å
132P85.5Confident84.2Confident71 Ų7194.6 Ų94.646%0.46150%0.496SS..Hα-helixtrans-65.2-29.7177.823.8-32.3000112.7T128 A136T128-P132 WeakPolarHBondContact O-CG 3.46Å; P132-A136 VanDerWaalsContact O-CB 3.27Å; P132-A136 WeakPolarHBondContact O-CB 3.27Å; P132-A136 PolarHBondContact O-N 2.89Å
133F84.3Confident83.5Confident132 Ų13292 Ų9258%0.57950%0.501SS*.Hα-helixtrans-70.2-46.8177-170.9-100.5000111.9F129 C130 D131 A136 L137F129-F133 VanDerWaalsContact O-CB 3.24Å; F129-F133 WeakPolarHBondContact O-CB 3.44Å; F129-F133 PolarHBondContact O-N 2.83Å; C130-F133 WeakPolarHBondContact O-CB 3.28Å; C130-F133 PolarHBondContact O-N 2.97Å; C130-F133 VanDerWaalsContact O-N 3.14Å; D131-F133 PolarHBondContact O-N 2.91Å; F133-A136 PolarHBondContact O-N 3.26Å; F133-L137 HydrophobicContact CD1-CD1 3.74Å; F133-L137 HydrophobicContact CD1-CG 4.38Å; F133-L137 HydrophobicContact CE1-CD1 3.47Å; F133-L137 VanDerWaalsContact CE1-CD1 3.47Å; F133-L137 HydrophobicContact CE1-CG 4.2Å; F133-L137 HydrophobicContact CZ-CD1 4.24Å; F133-L137 WeakPolarHBondContact O-CG 3.42Å; F133-L137 PolarHBondContact O-N 3.15Å
134F84.3Confident82.8Confident133 Ų13393.9 Ų93.958%0.58351%0.509SS*.Hα-helixtrans-69.6-35.6176.6-75.4-65.6000112.1C130 D131 L137 G138C130-F134 HydrophobicContact CB-CD2 3.89Å; C130-F134 HydrophobicContact CB-CE2 3.86Å; C130-F134 WeakPolarHBondContact O-CB 3.42Å; C130-F134 WeakPolarHBondContact O-CD2 3.41Å; C130-F134 PolarHBondContact O-N 3.3Å; D131-F134 PolarHBondContact O-N 3.43Å; F134-L137 HydrophobicContact CD1-CD1 4.25Å; F134-L137 PolarHBondContact O-N 2.85Å; F134-G138 PolarHBondContact O-N 2.82Å
135E85.1Confident81.9Confident118 Ų11898.3 Ų98.355%0.55152%0.524SS*.Hα-helixtrans-59.4-45.5170179.188.1-150.400110.9D131 G138 K139D131-E135 WeakPolarHBondContact O-CB 3.42Å; D131-E135 PolarHBondContact O-N 3.43Å; E135-G138 PolarHBondContact O-N 3.05Å; E135-K139 WeakPolarHBondContact O-CG 3.4Å; E135-K139 PolarHBondContact O-N 2.88Å; E135-K139 VanDerWaalsContact O-N 3.08Å; E135-K139 IonicContact OE1-NZ 3.49Å; E135-K139 PolarHBondContact OE1-NZ 2.95Å
136A85.2Confident81.1Confident49 Ų49101.1 Ų101.141%0.40554%0.539SS..Hα-helixtrans-65-45.117700000112.1P132 F133 G138 K139 I140P132-A136 VanDerWaalsContact O-CB 3.27Å; P132-A136 WeakPolarHBondContact O-CB 3.27Å; P132-A136 PolarHBondContact O-N 2.89Å; F133-A136 PolarHBondContact O-N 3.26Å; A136-G138 VanDerWaalsContact C-N 3.34Å; A136-G138 PolarHBondContact O-N 3.04Å; A136-K139 PolarHBondContact O-N 3.03Å; A136-I140 WeakPolarHBondContact O-CG1 3.45Å; A136-I140 PolarHBondContact O-N 2.81Å; A136-I140 VanDerWaalsContact O-N 3.13Å
137L85.1Confident80.2Confident56 Ų56102.9 Ų102.929%0.29356%0.562SS.*Hα-helixtrans-59.9-43.3174-73.4174.9000111.8F133 F134 K139 I140 F141F133-L137 HydrophobicContact CD1-CD1 3.74Å; F133-L137 HydrophobicContact CD1-CG 4.38Å; F133-L137 HydrophobicContact CE1-CD1 3.47Å; F133-L137 VanDerWaalsContact CE1-CD1 3.47Å; F133-L137 HydrophobicContact CE1-CG 4.2Å; F133-L137 HydrophobicContact CZ-CD1 4.24Å; F133-L137 WeakPolarHBondContact O-CG 3.42Å; F133-L137 PolarHBondContact O-N 3.15Å; F134-L137 HydrophobicContact CD1-CD1 4.25Å; F134-L137 PolarHBondContact O-N 2.85Å; L137-K139 VanDerWaalsContact C-N 3.29Å; L137-K139 PolarHBondContact O-N 3.16Å; L137-I140 WeakPolarHBondContact O-CB 3.38Å; L137-I140 PolarHBondContact O-N 3.3Å; L137-I140 VanDerWaalsContact O-N 3.14Å; L137-F141 WeakPolarHBondContact O-CD2 3.43Å; L137-F141 PolarHBondContact O-N 3.45Å
138G85.4Confident79.3Confident40 Ų40104.7 Ų104.741%0.41258%0.575SS.*Hα-helixtrans-58.3-39.4176.100000112.7F134 E135 A136 F141 S142F134-G138 PolarHBondContact O-N 2.82Å; E135-G138 PolarHBondContact O-N 3.05Å; A136-G138 VanDerWaalsContact C-N 3.34Å; A136-G138 PolarHBondContact O-N 3.04Å; G138-F141 PolarHBondContact O-N 3.21Å; G138-S142 WeakPolarHBondContact O-CB 3.18Å; G138-S142 PolarHBondContact O-N 3.13Å
139K82.4Confident78.3Confident123 Ų123109.9 Ų109.954%0.53559%0.585SS.*Hα-helixtrans-68-35.4175-74.6175.2-176.9158.90113.4E135 A136 L137 F141 S142 S143E135-K139 WeakPolarHBondContact O-CG 3.4Å; E135-K139 PolarHBondContact O-N 2.88Å; E135-K139 VanDerWaalsContact O-N 3.08Å; E135-K139 IonicContact OE1-NZ 3.49Å; E135-K139 PolarHBondContact OE1-NZ 2.95Å; A136-K139 PolarHBondContact O-N 3.03Å; L137-K139 VanDerWaalsContact C-N 3.29Å; L137-K139 PolarHBondContact O-N 3.16Å; K139-F141 VanDerWaalsContact C-N 3.35Å; K139-S142 PolarHBondContact O-OG 2.98Å; K139-S143 PolarHBondContact O-OG 2.84Å
140I82.5Confident77.2Confident112 Ų112112.3 Ų112.357%0.57460%0.595SS**Hα-helixtrans-63.3-45.4174.5-66.1166.7000109.7A136 L137A136-I140 WeakPolarHBondContact O-CG1 3.45Å; A136-I140 PolarHBondContact O-N 2.81Å; A136-I140 VanDerWaalsContact O-N 3.13Å; L137-I140 WeakPolarHBondContact O-CB 3.38Å; L137-I140 PolarHBondContact O-N 3.3Å; L137-I140 VanDerWaalsContact O-N 3.14Å
141F77.9Confident76.2Confident143 Ų143117.4 Ų117.463%0.62761%0.614SS**Hα-helixtrans-75.6-30.3179.6-68.9-63.1000113.9L137 G138 K139 S143 V144L137-F141 WeakPolarHBondContact O-CD2 3.43Å; L137-F141 PolarHBondContact O-N 3.45Å; G138-F141 PolarHBondContact O-N 3.21Å; K139-F141 VanDerWaalsContact C-N 3.35Å; F141-S143 PolarHBondContact O-N 3.09Å; F141-V144 WeakPolarHBondContact O-CB 3.43Å; F141-V144 PolarHBondContact O-N 3.43Å; F141-V144 VanDerWaalsContact O-N 3.09Å
142S76Confident74.7Confident88 Ų88123.8 Ų123.862%0.61566%0.655SS**Hα-helixtrans-67.9-21.317985.70000113.5G138 K139 V144G138-S142 WeakPolarHBondContact O-CB 3.18Å; G138-S142 PolarHBondContact O-N 3.13Å; K139-S142 PolarHBondContact O-OG 2.98Å; S142-V144 PolarHBondContact O-N 2.87Å
143S70.6Confident74.2Confident99 Ų99126.4 Ų126.469%0.69267%0.665SS**THydrogen-bonded Turntrans-72.1-13.1174.4-64.10000112.9K139 F141 K145K139-S143 PolarHBondContact O-OG 2.84Å; F141-S143 PolarHBondContact O-N 3.09Å; S143-K145 PolarHBondContact O-N 2.98Å; S143-K145 VanDerWaalsContact O-N 3.15Å
144V72.7Confident73.6Confident100 Ų100126.1 Ų126.161%0.60667%0.67SS**  trans-83.688.4175.9-174.10000109.4F141 S142 V146F141-V144 WeakPolarHBondContact O-CB 3.43Å; F141-V144 PolarHBondContact O-N 3.43Å; F141-V144 VanDerWaalsContact O-N 3.09Å; S142-V144 PolarHBondContact O-N 2.87Å; V144-V146 HydrophobicContact CG1-CG2 4.25Å; V144-V146 PolarHBondContact O-N 2.96Å
145K67.6Low73Confident198 Ų198125.7 Ų125.786%0.86167%0.674SS**  trans-79.1105.2170.1-78.8-176177.4175.10110.2S143 A147S143-K145 PolarHBondContact O-N 2.98Å; S143-K145 VanDerWaalsContact O-N 3.15Å; K145-A147 PolarHBondContact O-N 3.02Å
146V70.8Confident72.3Confident118 Ų118126.2 Ų126.272%0.71568%0.682SS**  trans-81.1108.5171.3-176.50000108.7V144 L148V144-V146 HydrophobicContact CG1-CG2 4.25Å; V144-V146 PolarHBondContact O-N 2.96Å; V146-L148 PolarHBondContact O-N 2.95Å
147A69.6Low71.5Confident97 Ų97131 Ų13180%0.80270%0.699SS**  trans-83.1103.3169.300000108.8K145 R149K145-A147 PolarHBondContact O-N 3.02Å; A147-R149 PolarHBondContact O-N 2.7Å; A147-R149 VanDerWaalsContact O-N 3.16Å
148L68.1Low70.6Confident161 Ų161136 Ų13684%0.84373%0.726SS**  trans-71.7106.3171.8-80.9168.5000109.1V146 K150V146-L148 PolarHBondContact O-N 2.95Å; L148-K150 PolarHBondContact O-N 3.06Å
149R64.5Low69.6Low199 Ų199142.9 Ų142.975%0.75175%0.748SS**  trans-74.7114.1164.6-177.6179.2-66.7-82.50.3107.2A147 E151A147-R149 PolarHBondContact O-N 2.7Å; A147-R149 VanDerWaalsContact O-N 3.16Å; R149-E151 WeakPolarHBondContact CD-OE1 3.34Å; R149-E151 WeakPolarHBondContact CG-OE1 3.37Å; R149-E151 PolarHBondContact O-N 3.32Å
150K61.1Low68.6Low196 Ų196144.4 Ų144.485%0.85277%0.765SS**  trans-83.2103.5171.8-164176.9-177.1178.70107.3L148L148-K150 PolarHBondContact O-N 3.06Å
151E58.6Low67.4Low154 Ų154147.1 Ų147.172%0.7278%0.781SS**  trans-70.6130.8169.5-37.7-77.7147.900107.7R149R149-E151 WeakPolarHBondContact CD-OE1 3.34Å; R149-E151 WeakPolarHBondContact CG-OE1 3.37Å; R149-E151 PolarHBondContact O-N 3.32Å
152V51.7Low66.5Low212 Ų212147.5 Ų147.5100%1.28580%0.795SS**  trans-86.10178.1172.70000110.1

Retrieved 152 of 152 residues in 28.7 ms (Link to these results)