A0A087XPK0_POEFO Loading...

RAB5 interacting factor

AlphaFold DB , UniProt , Accession A0A087XPK0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 127 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M44.3Very low49.8Very low226 Ų226106.7 Ų106.7100%1.11356%0.564SS**  0-53.90-71.5175.6171.200113.3S3M1-S3 PolarHBondContact O-N 3.26Å
2A38.4Very low50Low83 Ų83106.3 Ų106.369%0.68656%0.557SS**Hα-helixtrans-67.5-25.5-177.300000116.5K6A2-K6 PolarHBondContact O-N 3.15Å
3S47.6Very low50.5Low77 Ų77108.5 Ų108.554%0.53857%0.568SS.*Hα-helixtrans-76-31.6-177.7172.80000113.8M1 R7M1-S3 PolarHBondContact O-N 3.26Å; S3-R7 PolarHBondContact O-N 3.33Å
4S46.9Very low50.7Low61 Ų61109.9 Ų109.943%0.42758%0.576SS.*Hα-helixtrans-74.7-38.9-179-134.30000111.1R7 K8S4-R7 PolarHBondContact O-N 3.45Å; S4-K8 PolarHBondContact O-N 2.61Å
5S50.9Low50.8Low80 Ų80104.2 Ų104.256%0.55955%0.546SS*.Hα-helixtrans-65-41.5177.5-147.40000112.4R7 K8 E9S5-R7 VanDerWaalsContact C-N 3.34Å; S5-R7 PolarHBondContact O-N 3.15Å; S5-K8 PolarHBondContact O-N 2.69Å; S5-E9 PolarHBondContact O-N 3.14Å; S5-E9 VanDerWaalsContact O-N 3.12Å
6K50.5Low50.9Low150 Ų150102.2 Ų102.265%0.65256%0.558SS**Hα-helixtrans-63.7-38173.9-89.1-171.2172-171.90112.9A2 E9 E10A2-K6 PolarHBondContact O-N 3.15Å; K6-E9 PolarHBondContact O-N 3.12Å; K6-E10 PolarHBondContact O-N 3.01Å
7R55.1Low51Low131 Ų131101.1 Ų101.149%0.49457%0.566SS.*Hα-helixtrans-67.5-39.7179-152.1-177.7-64.6-178.81.5111S3 S4 S5 S11S3-R7 PolarHBondContact O-N 3.33Å; S4-R7 PolarHBondContact O-N 3.45Å; S5-R7 VanDerWaalsContact C-N 3.34Å; S5-R7 PolarHBondContact O-N 3.15Å; R7-S11 WeakPolarHBondContact O-CB 3.32Å; R7-S11 PolarHBondContact O-N 2.88Å; R7-S11 PolarHBondContact O-OG 3.41Å
8K52.6Low51Low77 Ų77100.2 Ų100.234%0.33556%0.563SS.*Hα-helixtrans-60.1-43.3171.9-78.4-174.3178.9-177.80112.2S4 S5 S11 H12 V32 E94S4-K8 PolarHBondContact O-N 2.61Å; S5-K8 PolarHBondContact O-N 2.69Å; K8-S11 PolarHBondContact O-N 3.48Å; K8-H12 WeakPolarHBondContact O-CB 3.07Å; K8-H12 PolarHBondContact O-N 3.01Å; K8-V32 HydrophobicContact CG-CG2 4.48Å; K8-E94 IonicContact NZ-OE1 3.99Å; K8-E94 PolarHBondContact NZ-OE1 3.44Å; K8-E94 IonicContact NZ-OE2 2.69Å; K8-E94 PolarHBondContact NZ-OE2 3.45Å
9E54.5Low51.1Low133 Ų133106.5 Ų106.562%0.62158%0.583SS**Hα-helixtrans-68.1-42.4-178.3-154.2172.4-163.100112.7S5 K6 H12 L13S5-E9 PolarHBondContact O-N 3.14Å; S5-E9 VanDerWaalsContact O-N 3.12Å; K6-E9 PolarHBondContact O-N 3.12Å; E9-H12 WeakPolarHBondContact O-CB 3.41Å; E9-H12 PolarHBondContact O-N 3.31Å; E9-L13 PolarHBondContact O-N 3.4Å
10E54.5Low51.4Low133 Ų133105 Ų10562%0.62157%0.572SS**Hα-helixtrans-63.8-40.2171.6-89.2-177.7142.100112.3K6 H12 L13 L14K6-E10 PolarHBondContact O-N 3.01Å; E10-H12 VanDerWaalsContact C-N 3.35Å; E10-L13 PolarHBondContact O-N 2.6Å; E10-L14 VanDerWaalsContact O-CG 3.3Å; E10-L14 WeakPolarHBondContact O-CG 3.29Å; E10-L14 PolarHBondContact O-N 3.01Å; E10-L14 VanDerWaalsContact O-N 3.08Å
11S52.8Low52Low23 Ų23103.6 Ų103.616%0.16157%0.57CS.*Hα-helixtrans-66.9-36.6178-52.20000112.1R7 K8 L14 N15R7-S11 WeakPolarHBondContact O-CB 3.32Å; R7-S11 PolarHBondContact O-N 2.88Å; R7-S11 PolarHBondContact O-OG 3.41Å; K8-S11 PolarHBondContact O-N 3.48Å; S11-L14 PolarHBondContact O-N 3.05Å; S11-N15 WeakPolarHBondContact O-CB 3.42Å; S11-N15 PolarHBondContact O-N 3.25Å
12H51.4Low53.1Low102 Ų10295.1 Ų95.147%0.47253%0.531SS..Hα-helixtrans-61.5-43.6175.1-133.8-81.2000111.5K8 E9 E10 G16 E34K8-H12 WeakPolarHBondContact O-CB 3.07Å; K8-H12 PolarHBondContact O-N 3.01Å; E9-H12 WeakPolarHBondContact O-CB 3.41Å; E9-H12 PolarHBondContact O-N 3.31Å; E10-H12 VanDerWaalsContact C-N 3.35Å; H12-G16 PolarHBondContact O-N 2.85Å; H12-E34 IonicContact CD2-OE1 2.61Å; H12-E34 IonicContact CE1-OE1 2.89Å; H12-E34 PolarHBondContact CE1-OE1 3.44Å; H12-E34 IonicContact ND1-OE1 3.36Å; H12-E34 PolarHBondContact ND1-OE1 3.16Å; H12-E34 IonicContact NE2-OE1 3.36Å; H12-E34 PolarHBondContact NE2-OE1 3.09Å
13L56.7Low54.4Low134 Ų13495.9 Ų95.970%0.70252%0.517SS*.Hα-helixtrans-68.1-35.3177.6-73.7166.4000112.3E9 E10E9-L13 PolarHBondContact O-N 3.4Å; E10-L13 PolarHBondContact O-N 2.6Å
14L53.7Low55.1Low129 Ų12995 Ų9568%0.67551%0.51SS*.Hα-helixtrans-72.6-37.3177.9-71.5166.1000112.7E10 S11E10-L14 VanDerWaalsContact O-CG 3.3Å; E10-L14 WeakPolarHBondContact O-CG 3.29Å; E10-L14 PolarHBondContact O-N 3.01Å; E10-L14 VanDerWaalsContact O-N 3.08Å; S11-L14 PolarHBondContact O-N 3.05Å
15N52.5Low56Low24 Ų2493.4 Ų93.413%0.12850%0.496CS..Hα-helixtrans-72.5-31177.5-86.8-30.1000113.4S11 A17 V32S11-N15 WeakPolarHBondContact O-CB 3.42Å; S11-N15 PolarHBondContact O-N 3.25Å; N15-A17 VanDerWaalsContact C-N 3.27Å; N15-A17 PolarHBondContact O-N 3.44Å; N15-V32 PolarHBondContact ND2-O 3Å
16G52.6Low56.6Low72 Ų7289.6 Ų89.674%0.74247%0.469SS*.Hα-helixtrans-69.5-20177.900000114.6H12H12-G16 PolarHBondContact O-N 2.85Å
17A51.8Low57.2Low83 Ų8388.4 Ų88.469%0.68646%0.464SS*.Hα-helixtrans-91.1-19.2-175.800000114.2N15N15-A17 VanDerWaalsContact C-N 3.27Å; N15-A17 PolarHBondContact O-N 3.44Å
18V50.7Low57.5Low85 Ų8585 Ų8552%0.51546%0.459SS..SBendtrans-136.3116.4-176.9-1780000108.9Q20V18-Q20 HydrophobicContact CB-CG 4.49Å; V18-Q20 HydrophobicContact CG1-CG 3.98Å; V18-Q20 PolarHBondContact O-N 2.79Å
19K53.1Low57.4Low220 Ų22082.8 Ų82.896%0.95746%0.459SS*.  trans-6180.2164.6-93.6-172.1173.4-174.80109.2
20Q57.4Low57.4Low77 Ų7783.1 Ų83.136%0.3647%0.465SS..  trans-73.1129.3169-76.8-173.1-2000108.3V18 T22 K25V18-Q20 HydrophobicContact CB-CG 4.49Å; V18-Q20 HydrophobicContact CG1-CG 3.98Å; V18-Q20 PolarHBondContact O-N 2.79Å; Q20-T22 PolarHBondContact O-N 3.49Å; Q20-K25 HydrophobicContact CB-CD 4.46Å; Q20-K25 HydrophobicContact CB-CG 3.8Å
21S64.3Low57.3Low76 Ų7677.5 Ų77.553%0.53144%0.441SS..  trans-55.4137.4171.4173.50000110W23 S24 K25S21-W23 PolarHBondContact O-N 3.46Å; S21-W23 VanDerWaalsContact O-N 3.13Å; S21-S24 CarbonylContact O-C 3.57Å; S21-S24 VanDerWaalsContact O-CA 3.31Å; S21-S24 WeakPolarHBondContact O-CA 3.44Å; S21-S24 WeakPolarHBondContact O-CB 3.3Å; S21-S24 PolarHBondContact O-N 3.24Å; S21-K25 PolarHBondContact O-N 3.35Å
22T67.4Low57.5Low48 Ų4878.4 Ų78.429%0.29445%0.445SS..Hα-helixtrans-45.9-41.8178.2-54.70000113.1Q20 K25 A26 W33 E38 V42Q20-T22 PolarHBondContact O-N 3.49Å; T22-K25 PolarHBondContact O-N 2.86Å; T22-A26 WeakPolarHBondContact O-CB 3.48Å; T22-A26 PolarHBondContact O-N 3.08Å; T22-W33 HydrophobicContact CG2-CZ3 4.32Å; T22-E38 WeakPolarHBondContact CB-OE1 3.47Å; T22-E38 HydrophobicContact CG2-CG 3.45Å; T22-E38 VanDerWaalsContact CG2-CG 3.45Å; T22-E38 WeakPolarHBondContact CG2-OE1 3.5Å; T22-E38 PolarHBondContact OG1-OE1 3.36Å; T22-V42 HydrophobicContact CG2-CG2 3.62Å
23W64.9Low58.1Low99 Ų9974.5 Ų74.538%0.37543%0.426SS..Hα-helixtrans-71.5-33.4176-74.791.3000113.1S21 K25 A26 F27 W45 I49S21-W23 PolarHBondContact O-N 3.46Å; S21-W23 VanDerWaalsContact O-N 3.13Å; W23-K25 VanDerWaalsContact C-N 3.35Å; W23-A26 WeakPolarHBondContact O-CB 3.3Å; W23-A26 PolarHBondContact O-N 2.95Å; W23-F27 AromaticContact CE3-CE2 3.66Å; W23-F27 HydrophobicContact CE3-CE2 3.66Å; W23-F27 HydrophobicContact CE3-CZ 4.03Å; W23-F27 HydrophobicContact CZ3-CE2 4.25Å; W23-F27 HydrophobicContact CZ3-CZ 4.17Å; W23-F27 WeakPolarHBondContact O-CD2 3.39Å; W23-F27 PolarHBondContact O-N 3.37Å; W23-W45 HydrophobicContact CH2-CB 3.66Å; W23-W45 HydrophobicContact CH2-CG 4.44Å; W23-W45 HydrophobicContact CZ2-CB 3.79Å; W23-W45 HydrophobicContact CZ2-CG 4.12Å; W23-I49 HydrophobicContact CH2-CD1 4.3Å
24S62.4Low58.2Low58 Ų5873.7 Ų73.741%0.40642%0.419SS..Hα-helixtrans-68.1-37.5173.8-159.20000111.1S21 F27 C28S21-S24 CarbonylContact O-C 3.57Å; S21-S24 VanDerWaalsContact O-CA 3.31Å; S21-S24 WeakPolarHBondContact O-CA 3.44Å; S21-S24 WeakPolarHBondContact O-CB 3.3Å; S21-S24 PolarHBondContact O-N 3.24Å; S24-F27 PolarHBondContact O-N 3.19Å; S24-C28 VanDerWaalsContact O-CB 3.3Å; S24-C28 WeakPolarHBondContact O-CB 3.39Å; S24-C28 PolarHBondContact O-N 2.67Å; S24-C28 PolarHBondContact O-SG 2.89Å
25K66.3Low58.8Low27 Ų2773.6 Ų73.612%0.11742%0.415CS..Hα-helixtrans-64.8-40.4170-73.5-175.7178.51790111.8Q20 S21 T22 W23 F27 C28 A31 W33Q20-K25 HydrophobicContact CB-CD 4.46Å; Q20-K25 HydrophobicContact CB-CG 3.8Å; S21-K25 PolarHBondContact O-N 3.35Å; T22-K25 PolarHBondContact O-N 2.86Å; W23-K25 VanDerWaalsContact C-N 3.35Å; K25-F27 VanDerWaalsContact C-N 3.26Å; K25-F27 PolarHBondContact O-N 3.4Å; K25-C28 PolarHBondContact O-N 2.99Å; K25-C28 VanDerWaalsContact O-O 3.12Å; K25-A31 HydrophobicContact CB-CB 4.02Å; K25-A31 HydrophobicContact CG-CB 4.21Å; K25-W33 HydrophobicContact CB-CH2 3.87Å; K25-W33 HydrophobicContact CB-CZ2 4.21Å; K25-W33 HydrophobicContact CB-CZ3 4.38Å
26A63.6Low59.5Low0 Ų076.4 Ų76.40%043%0.426CS..Hα-helixtrans-57.2-35.9176.900000114.1T22 W23 W33 V42 Y83T22-A26 WeakPolarHBondContact O-CB 3.48Å; T22-A26 PolarHBondContact O-N 3.08Å; W23-A26 WeakPolarHBondContact O-CB 3.3Å; W23-A26 PolarHBondContact O-N 2.95Å; A26-W33 HydrophobicContact CB-CH2 4.13Å; A26-W33 HydrophobicContact CB-CZ2 4.43Å; A26-V42 HydrophobicContact CB-CB 4.32Å; A26-V42 HydrophobicContact CB-CG1 3.29Å; A26-V42 HydrophobicContact CB-CG2 4.05Å; A26-Y83 PolarHBondContact O-OH 3.36Å
27F63.7Low60.6Low125 Ų12578.4 Ų78.455%0.54842%0.42SS..Hα-helixtrans-98.3-8-179.8-62.4-62.7000113.7W23 S24 K25W23-F27 AromaticContact CE3-CE2 3.66Å; W23-F27 HydrophobicContact CE3-CE2 3.66Å; W23-F27 HydrophobicContact CE3-CZ 4.03Å; W23-F27 HydrophobicContact CZ3-CE2 4.25Å; W23-F27 HydrophobicContact CZ3-CZ 4.17Å; W23-F27 WeakPolarHBondContact O-CD2 3.39Å; W23-F27 PolarHBondContact O-N 3.37Å; S24-F27 PolarHBondContact O-N 3.19Å; K25-F27 VanDerWaalsContact C-N 3.26Å; K25-F27 PolarHBondContact O-N 3.4Å
28C60Low61.7Low59 Ų5976.5 Ų76.540%0.39940%0.397SS..SBendtrans-93.998.7171-73.10000109.9S24 K25 N30 A31S24-C28 VanDerWaalsContact O-CB 3.3Å; S24-C28 WeakPolarHBondContact O-CB 3.39Å; S24-C28 PolarHBondContact O-N 2.67Å; S24-C28 PolarHBondContact O-SG 2.89Å; K25-C28 PolarHBondContact O-N 2.99Å; K25-C28 VanDerWaalsContact O-O 3.12Å; C28-N30 PolarHBondContact O-N 3Å; C28-A31 PolarHBondContact O-N 3.2Å
29G50.5Low62.8Low31 Ų3172.5 Ų72.532%0.3237%0.373SS..THydrogen-bonded Turntrans-6839.2-174.400000117.5F87G29-F87 CarbonylContact C-O 3.46Å; G29-F87 WeakPolarHBondContact CA-O 3.34Å
30N54.3Low63.9Low141 Ų14163.4 Ų63.475%0.75433%0.334SS*.THydrogen-bonded Turntrans-145.512.3171.9-96.3-41.7000112.7C28C28-N30 PolarHBondContact O-N 3Å
31A54.2Low65.1Low14 Ų1464.5 Ų64.512%0.11634%0.343CS..  trans-80.4122.8179.800000111.1K25 C28 W33K25-A31 HydrophobicContact CB-CB 4.02Å; K25-A31 HydrophobicContact CG-CB 4.21Å; C28-A31 PolarHBondContact O-N 3.2Å; A31-W33 PolarHBondContact O-NE1 3.35Å
32V56Low65.8Low42 Ų4261.1 Ų61.126%0.25532%0.319SS..  trans-73.9124.9164.7174.50000108K8 N15K8-V32 HydrophobicContact CG-CG2 4.48Å; N15-V32 PolarHBondContact ND2-O 3Å
33W63.5Low66.3Low20 Ų2059.2 Ų59.28%0.07631%0.307CS..  trans-87.3113.1176.5-60.384.3000108.8T22 K25 A26 A31 E35 E38 F39 V42T22-W33 HydrophobicContact CG2-CZ3 4.32Å; K25-W33 HydrophobicContact CB-CH2 3.87Å; K25-W33 HydrophobicContact CB-CZ2 4.21Å; K25-W33 HydrophobicContact CB-CZ3 4.38Å; A26-W33 HydrophobicContact CB-CH2 4.13Å; A26-W33 HydrophobicContact CB-CZ2 4.43Å; A31-W33 PolarHBondContact O-NE1 3.35Å; W33-E35 VanDerWaalsContact C-N 3.33Å; W33-E38 HydrophobicContact CE3-CB 4.45Å; W33-E38 HydrophobicContact CE3-CG 4.28Å; W33-E38 HydrophobicContact CZ3-CG 4.01Å; W33-F39 HydrophobicContact CB-CB 4.19Å; W33-F39 HydrophobicContact CD2-CB 3.8Å; W33-F39 AromaticContact CD2-CD2 3.92Å; W33-F39 HydrophobicContact CD2-CD2 3.92Å; W33-F39 HydrophobicContact CD2-CG 4.14Å; W33-F39 AromaticContact CE2-CD2 3.73Å; W33-F39 HydrophobicContact CE3-CB 3.9Å; W33-F39 HydrophobicContact CE3-CD2 4.47Å; W33-F39 HydrophobicContact CG-CB 3.91Å; W33-F39 HydrophobicContact CG-CD2 4.19Å; W33-F39 HydrophobicContact CG-CG 4.11Å; W33-F39 HydrophobicContact CZ2-CD2 4.12Å; W33-F39 AromaticContact NE1-CD2 3.91Å; W33-V42 HydrophobicContact CH2-CG2 4.1Å; W33-V42 HydrophobicContact CZ3-CG2 4.33Å
34E59Low67Low118 Ų11858.8 Ų58.855%0.55131%0.306SS*.SBendtrans-72.4-31.6175.8-69.9177.3155.200111.1H12H12-E34 IonicContact CD2-OE1 2.61Å; H12-E34 IonicContact CE1-OE1 2.89Å; H12-E34 PolarHBondContact CE1-OE1 3.44Å; H12-E34 IonicContact ND1-OE1 3.36Å; H12-E34 PolarHBondContact ND1-OE1 3.16Å; H12-E34 IonicContact NE2-OE1 3.36Å; H12-E34 PolarHBondContact NE2-OE1 3.09Å
35E65.9Low68.1Low127 Ų12762.7 Ų62.759%0.59331%0.312SS*.  trans-115.7121.6-179.8-67.7-178.2-172.400111.1W33 D37 E38W33-E35 VanDerWaalsContact C-N 3.33Å; E35-D37 VanDerWaalsContact C-N 3.26Å; E35-D37 PolarHBondContact O-N 3.44Å; E35-E38 HydrophobicContact CB-CB 4.23Å; E35-E38 PolarHBondContact O-N 3.31Å
36K68.2Low68.9Low83 Ų8362.9 Ų62.936%0.36131%0.314SS..Hα-helixtrans-60.2-37.2176.5177.4173.3178.4-174.50111.8F39 L40 Y95K36-F39 PolarHBondContact O-N 2.89Å; K36-L40 HydrophobicContact CG-CD1 3.89Å; K36-L40 HydrophobicContact CG-CG 4.28Å; K36-L40 VanDerWaalsContact O-CG 3.3Å; K36-L40 WeakPolarHBondContact O-CG 3.31Å; K36-L40 PolarHBondContact O-N 3.3Å; K36-Y95 HydrophobicContact CB-CE1 4Å; K36-Y95 HydrophobicContact CD-CD1 4.27Å; K36-Y95 HydrophobicContact CD-CE1 4.03Å; K36-Y95 HydrophobicContact CG-CD1 4.44Å; K36-Y95 HydrophobicContact CG-CE1 3.84Å
37D74.7Confident69.8Low114 Ų11463 Ų6361%0.6131%0.314SS*.Hα-helixtrans-68.3-40.4-176.2-61.5-22.6000112E35 F39 L40 D41E35-D37 VanDerWaalsContact C-N 3.26Å; E35-D37 PolarHBondContact O-N 3.44Å; D37-F39 VanDerWaalsContact C-N 3.26Å; D37-F39 PolarHBondContact O-N 3.36Å; D37-L40 PolarHBondContact O-N 2.99Å; D37-D41 PolarHBondContact O-N 2.8Å
38E75.7Confident71Confident42 Ų4258 Ų5820%0.19629%0.293CS..Hα-helixtrans-59.6-40.7175.7-170.3-174-175.100111.3T22 W33 E35 D41 V42T22-E38 WeakPolarHBondContact CB-OE1 3.47Å; T22-E38 HydrophobicContact CG2-CG 3.45Å; T22-E38 VanDerWaalsContact CG2-CG 3.45Å; T22-E38 WeakPolarHBondContact CG2-OE1 3.5Å; T22-E38 PolarHBondContact OG1-OE1 3.36Å; W33-E38 HydrophobicContact CE3-CB 4.45Å; W33-E38 HydrophobicContact CE3-CG 4.28Å; W33-E38 HydrophobicContact CZ3-CG 4.01Å; E35-E38 HydrophobicContact CB-CB 4.23Å; E35-E38 PolarHBondContact O-N 3.31Å; E38-D41 PolarHBondContact O-N 3.41Å; E38-V42 WeakPolarHBondContact O-CG2 3.09Å; E38-V42 PolarHBondContact O-N 3.29Å
39F73.4Confident72.4Confident2 Ų258.9 Ų58.91%0.00929%0.293CS..Hα-helixtrans-68.5-41.9177178.8-130.6000112.6W33 K36 D37 D41 V42 I43 Y83 F84 Q88 I90 L101W33-F39 HydrophobicContact CB-CB 4.19Å; W33-F39 HydrophobicContact CD2-CB 3.8Å; W33-F39 AromaticContact CD2-CD2 3.92Å; W33-F39 HydrophobicContact CD2-CD2 3.92Å; W33-F39 HydrophobicContact CD2-CG 4.14Å; W33-F39 AromaticContact CE2-CD2 3.73Å; W33-F39 HydrophobicContact CE3-CB 3.9Å; W33-F39 HydrophobicContact CE3-CD2 4.47Å; W33-F39 HydrophobicContact CG-CB 3.91Å; W33-F39 HydrophobicContact CG-CD2 4.19Å; W33-F39 HydrophobicContact CG-CG 4.11Å; W33-F39 HydrophobicContact CZ2-CD2 4.12Å; W33-F39 AromaticContact NE1-CD2 3.91Å; K36-F39 PolarHBondContact O-N 2.89Å; D37-F39 VanDerWaalsContact C-N 3.26Å; D37-F39 PolarHBondContact O-N 3.36Å; F39-D41 VanDerWaalsContact C-N 3.31Å; F39-D41 PolarHBondContact O-N 3.41Å; F39-V42 PolarHBondContact O-N 2.88Å; F39-I43 HydrophobicContact CD1-CD1 3.89Å; F39-I43 HydrophobicContact CD2-CD1 3.96Å; F39-I43 HydrophobicContact CD2-CG1 4.34Å; F39-I43 HydrophobicContact CE1-CD1 3.5Å; F39-I43 HydrophobicContact CE2-CD1 3.47Å; F39-I43 VanDerWaalsContact CE2-CD1 3.47Å; F39-I43 HydrophobicContact CE2-CG1 3.88Å; F39-I43 HydrophobicContact CG-CD1 4.15Å; F39-I43 HydrophobicContact CZ-CD1 3.3Å; F39-I43 HydrophobicContact CZ-CG1 4.17Å; F39-I43 WeakPolarHBondContact O-CG1 3.48Å; F39-I43 PolarHBondContact O-N 2.96Å; F39-I43 VanDerWaalsContact O-N 3.1Å; F39-Y83 AromaticContact CE2-CE1 3.91Å; F39-Y83 HydrophobicContact CE2-CE1 3.91Å; F39-Y83 HydrophobicContact CZ-CE1 4.37Å; F39-F84 HydrophobicContact CE1-CD1 4.32Å; F39-F84 AromaticContact CE1-CE1 3.6Å; F39-F84 HydrophobicContact CE1-CE1 3.6Å; F39-F84 AromaticContact CZ-CD1 3.91Å; F39-F84 HydrophobicContact CZ-CD1 3.91Å; F39-F84 AromaticContact CZ-CE1 3.42Å; F39-F84 HydrophobicContact CZ-CE1 3.42Å; F39-F84 VanDerWaalsContact CZ-CE1 3.42Å; F39-Q88 HydrophobicContact CE2-CG 4.41Å; F39-Q88 HydrophobicContact CZ-CG 4.1Å; F39-Q88 VanDerWaalsContact CZ-NE2 3.27Å; F39-I90 HydrophobicContact CE1-CD1 3.85Å; F39-I90 HydrophobicContact CZ-CD1 4.06Å; F39-L101 HydrophobicContact CD1-CD2 3.87Å; F39-L101 HydrophobicContact CE1-CD2 3.57Å
40L76.5Confident74.1Confident29 Ų2958.6 Ų58.615%0.15228%0.283CS..Hα-helixtrans-61.8-39.1175.5-74171.9000111.7K36 D37 I43 Y44 L101K36-L40 HydrophobicContact CG-CD1 3.89Å; K36-L40 HydrophobicContact CG-CG 4.28Å; K36-L40 VanDerWaalsContact O-CG 3.3Å; K36-L40 WeakPolarHBondContact O-CG 3.31Å; K36-L40 PolarHBondContact O-N 3.3Å; D37-L40 PolarHBondContact O-N 2.99Å; L40-I43 PolarHBondContact O-N 3.48Å; L40-Y44 VanDerWaalsContact O-CB 3.24Å; L40-Y44 WeakPolarHBondContact O-CB 3.23Å; L40-Y44 PolarHBondContact O-N 3.17Å; L40-L101 HydrophobicContact CD2-CD2 3.93Å; L40-L101 HydrophobicContact CD2-CG 3.87Å
41D81.8Confident75.8Confident100 Ų10051.9 Ų51.954%0.53525%0.248SC..Hα-helixtrans-61.9-44.7176.3-84.6-12000112.1D37 E38 F39 Y44 W45D37-D41 PolarHBondContact O-N 2.8Å; E38-D41 PolarHBondContact O-N 3.41Å; F39-D41 VanDerWaalsContact C-N 3.31Å; F39-D41 PolarHBondContact O-N 3.41Å; D41-Y44 WeakPolarHBondContact O-CB 3.41Å; D41-Y44 PolarHBondContact O-N 2.87Å; D41-W45 VanDerWaalsContact O-CD1 3.25Å; D41-W45 PolarHBondContact O-N 3.38Å
42V78.8Confident77.6Confident5 Ų554.9 Ų54.93%0.0326%0.261CS..Hα-helixtrans-60.1-48.3176.1166.10000111.1T22 A26 W33 E38 F39 Y44 W45 L46T22-V42 HydrophobicContact CG2-CG2 3.62Å; A26-V42 HydrophobicContact CB-CB 4.32Å; A26-V42 HydrophobicContact CB-CG1 3.29Å; A26-V42 HydrophobicContact CB-CG2 4.05Å; W33-V42 HydrophobicContact CH2-CG2 4.1Å; W33-V42 HydrophobicContact CZ3-CG2 4.33Å; E38-V42 WeakPolarHBondContact O-CG2 3.09Å; E38-V42 PolarHBondContact O-N 3.29Å; F39-V42 PolarHBondContact O-N 2.88Å; V42-Y44 VanDerWaalsContact C-N 3.32Å; V42-Y44 PolarHBondContact O-N 2.94Å; V42-W45 PolarHBondContact O-N 2.84Å; V42-L46 WeakPolarHBondContact O-CB 3.22Å; V42-L46 PolarHBondContact O-N 3.29Å
43I77.9Confident79.2Confident7 Ų757.1 Ų57.14%0.03627%0.27CS..Hα-helixtrans-61.9-44.4178.8-70.8163.7000110.4F39 L40 W45 L46 R47 L80 Y83 F84 L101F39-I43 HydrophobicContact CD1-CD1 3.89Å; F39-I43 HydrophobicContact CD2-CD1 3.96Å; F39-I43 HydrophobicContact CD2-CG1 4.34Å; F39-I43 HydrophobicContact CE1-CD1 3.5Å; F39-I43 HydrophobicContact CE2-CD1 3.47Å; F39-I43 VanDerWaalsContact CE2-CD1 3.47Å; F39-I43 HydrophobicContact CE2-CG1 3.88Å; F39-I43 HydrophobicContact CG-CD1 4.15Å; F39-I43 HydrophobicContact CZ-CD1 3.3Å; F39-I43 HydrophobicContact CZ-CG1 4.17Å; F39-I43 WeakPolarHBondContact O-CG1 3.48Å; F39-I43 PolarHBondContact O-N 2.96Å; F39-I43 VanDerWaalsContact O-N 3.1Å; L40-I43 PolarHBondContact O-N 3.48Å; I43-W45 PolarHBondContact O-N 3.45Å; I43-L46 PolarHBondContact O-N 2.93Å; I43-R47 HydrophobicContact CG2-CG 4.45Å; I43-R47 WeakPolarHBondContact O-CG 3.36Å; I43-R47 PolarHBondContact O-N 3.25Å; I43-L80 HydrophobicContact CG2-CD2 3.63Å; I43-L80 HydrophobicContact CG2-CG 4.32Å; I43-Y83 HydrophobicContact CG1-CE1 4.38Å; I43-F84 HydrophobicContact CD1-CE1 3.55Å; I43-F84 HydrophobicContact CD1-CZ 3.55Å; I43-L101 HydrophobicContact CD1-CD2 4.09Å
44Y81Confident80.5Confident91 Ų9157 Ų5736%0.35727%0.271SS..Hα-helixtrans-55.7-52.4177.5171.9-94.5000110.7L40 D41 V42 L46 R47 Q48L40-Y44 VanDerWaalsContact O-CB 3.24Å; L40-Y44 WeakPolarHBondContact O-CB 3.23Å; L40-Y44 PolarHBondContact O-N 3.17Å; D41-Y44 WeakPolarHBondContact O-CB 3.41Å; D41-Y44 PolarHBondContact O-N 2.87Å; V42-Y44 VanDerWaalsContact C-N 3.32Å; V42-Y44 PolarHBondContact O-N 2.94Å; Y44-L46 PolarHBondContact O-N 2.76Å; Y44-R47 PolarHBondContact O-N 2.76Å; Y44-Q48 WeakPolarHBondContact O-CB 3.38Å; Y44-Q48 PolarHBondContact O-N 2.84Å
45W84.4Confident81.9Confident140 Ų14051.4 Ų51.453%0.5325%0.245SC..Hα-helixtrans-64.4-39.5179.4-84.4103.7000113.2W23 D41 V42 I43 R47 Q48 I49W23-W45 HydrophobicContact CH2-CB 3.66Å; W23-W45 HydrophobicContact CH2-CG 4.44Å; W23-W45 HydrophobicContact CZ2-CB 3.79Å; W23-W45 HydrophobicContact CZ2-CG 4.12Å; D41-W45 VanDerWaalsContact O-CD1 3.25Å; D41-W45 PolarHBondContact O-N 3.38Å; V42-W45 PolarHBondContact O-N 2.84Å; I43-W45 PolarHBondContact O-N 3.45Å; W45-R47 PolarHBondContact O-N 3.03Å; W45-Q48 WeakPolarHBondContact O-CB 3.48Å; W45-Q48 PolarHBondContact O-N 3.33Å; W45-I49 WeakPolarHBondContact O-CG1 3.34Å; W45-I49 PolarHBondContact O-N 3.33Å
46L83.3Confident83.1Confident31 Ų3147.1 Ų47.116%0.16223%0.228CC..Hα-helixtrans-60.5-46.4176.4-176130.5000111.1V42 I43 Y44 Q48 I49 I50 L79V42-L46 WeakPolarHBondContact O-CB 3.22Å; V42-L46 PolarHBondContact O-N 3.29Å; I43-L46 PolarHBondContact O-N 2.93Å; Y44-L46 PolarHBondContact O-N 2.76Å; L46-Q48 VanDerWaalsContact C-N 3.31Å; L46-Q48 PolarHBondContact O-N 3.34Å; L46-I49 PolarHBondContact O-N 3.19Å; L46-I50 HydrophobicContact CD2-CD1 3.58Å; L46-I50 HydrophobicContact CG-CD1 4.11Å; L46-I50 VanDerWaalsContact O-CD1 3.26Å; L46-I50 WeakPolarHBondContact O-CD1 3.44Å; L46-I50 VanDerWaalsContact O-CG1 3.3Å; L46-I50 WeakPolarHBondContact O-CG1 3.4Å; L46-I50 PolarHBondContact O-N 2.99Å; L46-I50 VanDerWaalsContact O-N 3.1Å; L46-L79 HydrophobicContact CD2-CD2 4.08Å
47R83.9Confident84.1Confident1 Ų146.9 Ų46.90%0.00423%0.229CC..Hα-helixtrans-60-42173.5-70.6-179.2-169.9-108.227.6112.2I43 Y44 W45 I49 I50 A51 N76 L80 L101 T102 E104I43-R47 HydrophobicContact CG2-CG 4.45Å; I43-R47 WeakPolarHBondContact O-CG 3.36Å; I43-R47 PolarHBondContact O-N 3.25Å; Y44-R47 PolarHBondContact O-N 2.76Å; W45-R47 PolarHBondContact O-N 3.03Å; R47-I49 VanDerWaalsContact C-N 3.33Å; R47-I49 PolarHBondContact O-N 3.19Å; R47-I50 PolarHBondContact O-N 3.1Å; R47-A51 WeakPolarHBondContact O-CB 3.34Å; R47-A51 PolarHBondContact O-N 3.34Å; R47-N76 PolarHBondContact NH1-OD1 2.69Å; R47-L80 HydrophobicContact CG-CD1 3.56Å; R47-L101 PolarHBondContact NH2-O 3.43Å; R47-T102 VanDerWaalsContact NH2-C 3.28Å; R47-T102 VanDerWaalsContact NH2-CA 3.32Å; R47-T102 PolarHBondContact NH2-O 3.38Å; R47-E104 PolarHBondContact NH2-O 3.24Å
48Q88.4Confident84.7Confident21 Ų2143.2 Ų43.210%0.09821%0.207CC..Hα-helixtrans-59.3-45.4179.6-132.463.628.500110.8Y44 W45 L46 A51 I52 L112Y44-Q48 WeakPolarHBondContact O-CB 3.38Å; Y44-Q48 PolarHBondContact O-N 2.84Å; W45-Q48 WeakPolarHBondContact O-CB 3.48Å; W45-Q48 PolarHBondContact O-N 3.33Å; L46-Q48 VanDerWaalsContact C-N 3.31Å; L46-Q48 PolarHBondContact O-N 3.34Å; Q48-A51 PolarHBondContact O-N 3.34Å; Q48-I52 WeakPolarHBondContact O-CD1 3.02Å; Q48-I52 VanDerWaalsContact O-CG1 3.29Å; Q48-I52 WeakPolarHBondContact O-CG1 3.25Å; Q48-I52 PolarHBondContact O-N 3.34Å; Q48-L112 HydrophobicContact CB-CD2 4.4Å; Q48-L112 HydrophobicContact CG-CD2 3.46Å; Q48-L112 VanDerWaalsContact CG-CD2 3.46Å
49I87.8Confident85.1Confident78 Ų7841.2 Ų41.240%0.420%0.198SC..Hα-helixtrans-62.3-46.2177.1-67.4167000110.8W23 W45 L46 R47 A51 I52 I53W23-I49 HydrophobicContact CH2-CD1 4.3Å; W45-I49 WeakPolarHBondContact O-CG1 3.34Å; W45-I49 PolarHBondContact O-N 3.33Å; L46-I49 PolarHBondContact O-N 3.19Å; R47-I49 VanDerWaalsContact C-N 3.33Å; R47-I49 PolarHBondContact O-N 3.19Å; I49-A51 VanDerWaalsContact C-N 3.34Å; I49-A51 PolarHBondContact O-N 3.49Å; I49-I52 PolarHBondContact O-N 3.34Å; I49-I53 HydrophobicContact CG2-CD1 3.75Å; I49-I53 HydrophobicContact CG2-CG1 4.46Å; I49-I53 WeakPolarHBondContact O-CG1 3.49Å; I49-I53 PolarHBondContact O-N 3.24Å
50I87.1Confident85.7Confident25 Ų2545.6 Ų45.613%0.12822%0.22CC..Hα-helixtrans-62.8-42.2178.5-64.4153.9000111.2L46 R47 I52 I53 L54 I75 L79L46-I50 HydrophobicContact CD2-CD1 3.58Å; L46-I50 HydrophobicContact CG-CD1 4.11Å; L46-I50 VanDerWaalsContact O-CD1 3.26Å; L46-I50 WeakPolarHBondContact O-CD1 3.44Å; L46-I50 VanDerWaalsContact O-CG1 3.3Å; L46-I50 WeakPolarHBondContact O-CG1 3.4Å; L46-I50 PolarHBondContact O-N 2.99Å; L46-I50 VanDerWaalsContact O-N 3.1Å; R47-I50 PolarHBondContact O-N 3.1Å; I50-I52 VanDerWaalsContact C-N 3.32Å; I50-I52 PolarHBondContact O-N 3.35Å; I50-I53 PolarHBondContact O-N 3.47Å; I50-L54 HydrophobicContact CG2-CD1 3.74Å; I50-L54 HydrophobicContact CG2-CG 4.18Å; I50-L54 WeakPolarHBondContact O-CB 3.34Å; I50-L54 WeakPolarHBondContact O-CG 3.14Å; I50-L54 PolarHBondContact O-N 3.4Å; I50-I75 HydrophobicContact CG2-CG2 4.33Å; I50-L79 HydrophobicContact CD1-CD2 3.16Å; I50-L79 HydrophobicContact CG1-CD2 4.11Å
51A90.1Very high86Confident0 Ų046.7 Ų46.70%023%0.233CC..Hα-helixtrans-60.9-41.3177.500000112.2R47 Q48 I49 G55 F72 S109 F113R47-A51 WeakPolarHBondContact O-CB 3.34Å; R47-A51 PolarHBondContact O-N 3.34Å; Q48-A51 PolarHBondContact O-N 3.34Å; I49-A51 VanDerWaalsContact C-N 3.34Å; I49-A51 PolarHBondContact O-N 3.49Å; A51-G55 PolarHBondContact O-N 3.39Å; A51-F72 HydrophobicContact CB-CE2 3.96Å; A51-F72 HydrophobicContact CB-CZ 4.33Å; A51-S109 VanDerWaalsContact CB-O 3.3Å; A51-S109 WeakPolarHBondContact CB-O 3.3Å; A51-F113 HydrophobicContact CB-CB 3.97Å
52I91.5Very high85.6Confident76 Ų7644.5 Ų44.539%0.3922%0.224SC..Hα-helixtrans-64.3-51.7174.6-66.9161.5000110.2Q48 I49 I50 L54 G55 V56 L112 V116Q48-I52 WeakPolarHBondContact O-CD1 3.02Å; Q48-I52 VanDerWaalsContact O-CG1 3.29Å; Q48-I52 WeakPolarHBondContact O-CG1 3.25Å; Q48-I52 PolarHBondContact O-N 3.34Å; I49-I52 PolarHBondContact O-N 3.34Å; I50-I52 VanDerWaalsContact C-N 3.32Å; I50-I52 PolarHBondContact O-N 3.35Å; I52-L54 PolarHBondContact O-N 3.19Å; I52-G55 PolarHBondContact O-N 3.26Å; I52-V56 HydrophobicContact CG2-CG2 4.39Å; I52-V56 VanDerWaalsContact O-CG2 3.28Å; I52-V56 WeakPolarHBondContact O-CG2 3.27Å; I52-V56 PolarHBondContact O-N 3.45Å; I52-L112 HydrophobicContact CD1-CD2 3.99Å; I52-L112 HydrophobicContact CG1-CD2 3.71Å; I52-L112 HydrophobicContact CG1-CG 4.26Å; I52-V116 HydrophobicContact CG1-CG2 4.29Å
53I90.8Very high85.3Confident90 Ų9046.7 Ų46.746%0.46224%0.236SC..Hα-helixtrans-58.3-50-178-68.1169000110.8I49 I50 V56 I57I49-I53 HydrophobicContact CG2-CD1 3.75Å; I49-I53 HydrophobicContact CG2-CG1 4.46Å; I49-I53 WeakPolarHBondContact O-CG1 3.49Å; I49-I53 PolarHBondContact O-N 3.24Å; I50-I53 PolarHBondContact O-N 3.47Å; I53-V56 PolarHBondContact O-N 3Å; I53-I57 HydrophobicContact CG2-CD1 3.73Å; I53-I57 VanDerWaalsContact O-CG1 3.26Å; I53-I57 WeakPolarHBondContact O-CG1 3.21Å; I53-I57 PolarHBondContact O-N 2.81Å
54L89.8Confident85Confident17 Ų1752.8 Ų52.89%0.08926%0.262CS..Hα-helixtrans-64.7-41178.8-71177.7000112I50 I52 V56 I57 W58 F72 I75 F113I50-L54 HydrophobicContact CG2-CD1 3.74Å; I50-L54 HydrophobicContact CG2-CG 4.18Å; I50-L54 WeakPolarHBondContact O-CB 3.34Å; I50-L54 WeakPolarHBondContact O-CG 3.14Å; I50-L54 PolarHBondContact O-N 3.4Å; I52-L54 PolarHBondContact O-N 3.19Å; L54-V56 VanDerWaalsContact C-N 3.33Å; L54-V56 PolarHBondContact O-N 3.06Å; L54-I57 PolarHBondContact O-N 3.34Å; L54-W58 WeakPolarHBondContact O-CB 3.26Å; L54-W58 PolarHBondContact O-N 2.76Å; L54-F72 HydrophobicContact CB-CD2 4.44Å; L54-F72 HydrophobicContact CD1-CD2 3.76Å; L54-F72 HydrophobicContact CD1-CE2 4.4Å; L54-I75 HydrophobicContact CD1-CB 4.18Å; L54-I75 HydrophobicContact CD1-CD1 4.09Å; L54-I75 HydrophobicContact CD1-CG2 3.98Å; L54-I75 HydrophobicContact CD2-CD1 3.94Å; L54-F113 HydrophobicContact CB-CD2 4.17Å; L54-F113 HydrophobicContact CB-CE2 4.22Å
55G89.4Confident84.8Confident0 Ų050.9 Ų50.90%027%0.27CS..Hα-helixtrans-60.8-42.2177.700000112.1A51 I52 G59 W117A51-G55 PolarHBondContact O-N 3.39Å; I52-G55 PolarHBondContact O-N 3.26Å; G55-G59 PolarHBondContact O-N 3.28Å; G55-W117 WeakPolarHBondContact O-CA 3.18Å
56V90.6Very high84.8Confident38 Ų3851.9 Ų51.923%0.2328%0.278CS..Hα-helixtrans-63.9-51.4175.6173.60000110.7I52 I53 L54 W58 G59 I60 V116 F120I52-V56 HydrophobicContact CG2-CG2 4.39Å; I52-V56 VanDerWaalsContact O-CG2 3.28Å; I52-V56 WeakPolarHBondContact O-CG2 3.27Å; I52-V56 PolarHBondContact O-N 3.45Å; I53-V56 PolarHBondContact O-N 3Å; L54-V56 VanDerWaalsContact C-N 3.33Å; L54-V56 PolarHBondContact O-N 3.06Å; V56-W58 VanDerWaalsContact C-N 3.3Å; V56-W58 PolarHBondContact O-N 3.21Å; V56-G59 PolarHBondContact O-N 2.87Å; V56-I60 HydrophobicContact CG1-CD1 3.68Å; V56-I60 VanDerWaalsContact O-CG1 3.31Å; V56-I60 WeakPolarHBondContact O-CG1 3.3Å; V56-I60 PolarHBondContact O-N 3.2Å; V56-V116 HydrophobicContact CG2-CG1 3.75Å; V56-F120 HydrophobicContact CG1-CD1 4.37Å; V56-F120 HydrophobicContact CG1-CE1 4.14Å; V56-F120 HydrophobicContact CG1-CZ 4.35Å; V56-F120 HydrophobicContact CG2-CD2 4.03Å; V56-F120 HydrophobicContact CG2-CE1 4.38Å; V56-F120 HydrophobicContact CG2-CE2 3.63Å; V56-F120 HydrophobicContact CG2-CZ 3.82Å
57I89.4Confident84.9Confident77 Ų7755.4 Ų55.440%0.39530%0.297SS..Hα-helixtrans-59.8-43.5-178-63164.6000110.3I53 L54 I60 A61I53-I57 HydrophobicContact CG2-CD1 3.73Å; I53-I57 VanDerWaalsContact O-CG1 3.26Å; I53-I57 WeakPolarHBondContact O-CG1 3.21Å; I53-I57 PolarHBondContact O-N 2.81Å; L54-I57 PolarHBondContact O-N 3.34Å; I57-I60 PolarHBondContact O-N 2.91Å; I57-A61 WeakPolarHBondContact O-CB 3.24Å; I57-A61 PolarHBondContact O-N 3.45Å
58W86.4Confident84.9Confident38 Ų3855.4 Ų55.414%0.14430%0.297CS..Hα-helixtrans-72.6-32.5-178.6-93.5-134.1000112.9L54 V56 I60 L63 G68 I71 W117L54-W58 WeakPolarHBondContact O-CB 3.26Å; L54-W58 PolarHBondContact O-N 2.76Å; V56-W58 VanDerWaalsContact C-N 3.3Å; V56-W58 PolarHBondContact O-N 3.21Å; W58-I60 VanDerWaalsContact C-N 3.32Å; W58-L63 HydrophobicContact CD2-CD1 3.44Å; W58-L63 VanDerWaalsContact CD2-CD1 3.44Å; W58-L63 HydrophobicContact CE3-CD1 3.98Å; W58-L63 HydrophobicContact CG-CB 4.04Å; W58-L63 HydrophobicContact CG-CD1 3.83Å; W58-L63 HydrophobicContact CH2-CD1 3.97Å; W58-L63 HydrophobicContact CZ2-CD1 3.45Å; W58-L63 VanDerWaalsContact CZ2-CD1 3.45Å; W58-L63 HydrophobicContact CZ3-CD1 4.21Å; W58-L63 PolarHBondContact O-N 3.48Å; W58-G68 VanDerWaalsContact CD1-CA 3.49Å; W58-I71 HydrophobicContact CH2-CG2 4.3Å; W58-I71 HydrophobicContact CZ2-CB 4.18Å; W58-I71 HydrophobicContact CZ2-CD1 3.89Å; W58-I71 HydrophobicContact CZ2-CG2 3.73Å; W58-W117 HydrophobicContact CB-CD2 4.36Å; W58-W117 HydrophobicContact CB-CG 4.26Å; W58-W117 PolarHBondContact O-NE1 3.03Å
59G85.3Confident84.8Confident0 Ų056.8 Ų56.80%030%0.304CS..Hα-helixtrans-65.1-35.1172.100000112.8G55 V56 H125G55-G59 PolarHBondContact O-N 3.28Å; V56-G59 PolarHBondContact O-N 2.87Å; G59-H125 PolarHBondContact O-CE1 3.02Å; G59-H125 VanDerWaalsContact O-CE1 3.26Å
60I85.6Confident84.9Confident94 Ų9454.3 Ų54.348%0.48230%0.296SS..Hα-helixtrans-79.9-37.6176.1-62.1163.2000112.1V56 I57 W58 P62 L124V56-I60 HydrophobicContact CG1-CD1 3.68Å; V56-I60 VanDerWaalsContact O-CG1 3.31Å; V56-I60 WeakPolarHBondContact O-CG1 3.3Å; V56-I60 PolarHBondContact O-N 3.2Å; I57-I60 PolarHBondContact O-N 2.91Å; W58-I60 VanDerWaalsContact C-N 3.32Å; I60-P62 VanDerWaalsContact C-N 3.26Å; I60-P62 WeakPolarHBondContact O-CD 3.35Å; I60-L124 HydrophobicContact CB-CD1 4.13Å; I60-L124 HydrophobicContact CG1-CD1 3.49Å; I60-L124 VanDerWaalsContact CG1-CD1 3.49Å
61A83.2Confident84.8Confident52 Ų5255.8 Ų55.843%0.4330%0.303SS..THydrogen-bonded Turntrans-86.129.9-17200000114.8I57 L63I57-A61 WeakPolarHBondContact O-CB 3.24Å; I57-A61 PolarHBondContact O-N 3.45Å; A61-L63 HydrophobicContact CB-CD1 4.41Å; A61-L63 PolarHBondContact O-N 3.17Å
62P72Confident84.7Confident53 Ų5355.9 Ų55.934%0.34430%0.303SS..THydrogen-bonded Turntrans-9.862.9-144.425.8-39.7000115.8I60 K64 Y121 H125I60-P62 VanDerWaalsContact C-N 3.26Å; I60-P62 WeakPolarHBondContact O-CD 3.35Å; P62-K64 PolarHBondContact O-N 3.16Å; P62-Y121 HydrophobicContact CB-CD2 4.27Å; P62-Y121 HydrophobicContact CB-CE2 3.7Å; P62-H125 VanDerWaalsContact CB-NE2 3.33Å; P62-H125 WeakPolarHBondContact CB-NE2 3.35Å; P62-H125 VanDerWaalsContact CD-NE2 3.32Å; P62-H125 WeakPolarHBondContact CD-NE2 3.27Å; P62-H125 VanDerWaalsContact CG-NE2 3.31Å; P62-H125 WeakPolarHBondContact CG-NE2 3.13Å
63L73Confident84.5Confident51 Ų5154.1 Ų54.127%0.26730%0.298SS..  trans-67.6129.6173.1-81.9161000106.8W58 A61 W117W58-L63 HydrophobicContact CD2-CD1 3.44Å; W58-L63 VanDerWaalsContact CD2-CD1 3.44Å; W58-L63 HydrophobicContact CE3-CD1 3.98Å; W58-L63 HydrophobicContact CG-CB 4.04Å; W58-L63 HydrophobicContact CG-CD1 3.83Å; W58-L63 HydrophobicContact CH2-CD1 3.97Å; W58-L63 HydrophobicContact CZ2-CD1 3.45Å; W58-L63 VanDerWaalsContact CZ2-CD1 3.45Å; W58-L63 HydrophobicContact CZ3-CD1 4.21Å; W58-L63 PolarHBondContact O-N 3.48Å; A61-L63 HydrophobicContact CB-CD1 4.41Å; A61-L63 PolarHBondContact O-N 3.17Å; L63-W117 WeakPolarHBondContact O-CZ2 3.22Å; L63-W117 PolarHBondContact O-NE1 3.35Å
64K71.4Confident84.4Confident136 Ų13655 Ų5559%0.59131%0.307SS*.  trans-120.1143.7-176.9-72.4179.3172.970.60109.9P62 Y121P62-K64 PolarHBondContact O-N 3.16Å; K64-Y121 WeakPolarHBondContact CE-OH 3.36Å; K64-Y121 HydrophobicContact CG-CE2 4.24Å; K64-Y121 PolarHBondContact NZ-OH 2.91Å
65G76.9Confident84.2Confident50 Ų5057.1 Ų57.152%0.51532%0.318SS..SBendtrans81.3-163.5170.300000114.9L67 G68G65-L67 PolarHBondContact O-N 2.96Å; G65-G68 PolarHBondContact O-N 3.34Å
66F84.4Confident83.9Confident161 Ų16157.1 Ų57.171%0.70632%0.318SS*.Hα-helixtrans-60.9-29-169.7175.7-101.6000114G68 I69 A70F66-G68 PolarHBondContact O-N 3.49Å; F66-I69 PolarHBondContact O-N 3.42Å; F66-I69 VanDerWaalsContact O-N 3.16Å; F66-A70 HydrophobicContact CD1-CB 4.23Å; F66-A70 HydrophobicContact CE1-CB 3.81Å; F66-A70 HydrophobicContact CZ-CB 4.1Å; F66-A70 WeakPolarHBondContact O-CB 3.48Å; F66-A70 PolarHBondContact O-N 3.37Å
67L85.5Confident83.5Confident106 Ų10657.3 Ų57.356%0.55532%0.323SS*.Hα-helixtrans-59.4-37.2-177-172.663.2000112G65 A70 I71G65-L67 PolarHBondContact O-N 2.96Å; L67-A70 PolarHBondContact O-N 3.5Å; L67-I71 HydrophobicContact CD1-CD1 4.22Å; L67-I71 HydrophobicContact CD1-CG1 4.47Å; L67-I71 HydrophobicContact CG-CD1 3.94Å; L67-I71 VanDerWaalsContact O-CG1 3.27Å; L67-I71 WeakPolarHBondContact O-CG1 3.24Å; L67-I71 PolarHBondContact O-N 3.32Å
68G84.4Confident83.1Confident0 Ų055.1 Ų55.10%032%0.32CS..Hα-helixtrans-70.1-37.2179.500000113.6W58 G65 F66 F72W58-G68 VanDerWaalsContact CD1-CA 3.49Å; G65-G68 PolarHBondContact O-N 3.34Å; F66-G68 PolarHBondContact O-N 3.49Å; G68-F72 WeakPolarHBondContact O-CB 3.48Å; G68-F72 PolarHBondContact O-N 3.5Å
69I87.2Confident82.7Confident50 Ų5057.1 Ų57.126%0.25633%0.333SS..Hα-helixtrans-65.5-46173.1-61.4173.4000110.2F66 I71 F72 C73 F110 W117F66-I69 PolarHBondContact O-N 3.42Å; F66-I69 VanDerWaalsContact O-N 3.16Å; I69-I71 PolarHBondContact O-N 3.38Å; I69-F72 PolarHBondContact O-N 2.71Å; I69-C73 PolarHBondContact O-N 2.93Å; I69-C73 PolarHBondContact O-SG 3.44Å; I69-F110 HydrophobicContact CG2-CE2 3.79Å; I69-F110 HydrophobicContact CG2-CZ 4.07Å; I69-W117 HydrophobicContact CG1-CH2 4.25Å; I69-W117 HydrophobicContact CG1-CZ3 3.75Å
70A88.1Confident82.1Confident27 Ų2757.2 Ų57.222%0.22333%0.333CS..Hα-helixtrans-60.5-45-179.800000111.9F66 L67 C73 V74F66-A70 HydrophobicContact CD1-CB 4.23Å; F66-A70 HydrophobicContact CE1-CB 3.81Å; F66-A70 HydrophobicContact CZ-CB 4.1Å; F66-A70 WeakPolarHBondContact O-CB 3.48Å; F66-A70 PolarHBondContact O-N 3.37Å; L67-A70 PolarHBondContact O-N 3.5Å; A70-C73 PolarHBondContact O-N 3.47Å; A70-V74 WeakPolarHBondContact O-CG2 3.24Å; A70-V74 PolarHBondContact O-N 2.89Å
71I86.8Confident81.5Confident55 Ų5559.6 Ų59.628%0.28234%0.337SS..Hα-helixtrans-64.3-43.2177.2-67167.1000110.8W58 L67 I69 C73 V74 I75W58-I71 HydrophobicContact CH2-CG2 4.3Å; W58-I71 HydrophobicContact CZ2-CB 4.18Å; W58-I71 HydrophobicContact CZ2-CD1 3.89Å; W58-I71 HydrophobicContact CZ2-CG2 3.73Å; L67-I71 HydrophobicContact CD1-CD1 4.22Å; L67-I71 HydrophobicContact CD1-CG1 4.47Å; L67-I71 HydrophobicContact CG-CD1 3.94Å; L67-I71 VanDerWaalsContact O-CG1 3.27Å; L67-I71 WeakPolarHBondContact O-CG1 3.24Å; L67-I71 PolarHBondContact O-N 3.32Å; I69-I71 PolarHBondContact O-N 3.38Å; I71-C73 VanDerWaalsContact C-N 3.35Å; I71-C73 PolarHBondContact O-N 2.94Å; I71-V74 PolarHBondContact O-N 2.85Å; I71-I75 HydrophobicContact CG2-CD1 3.62Å; I71-I75 HydrophobicContact CG2-CG1 4.23Å; I71-I75 WeakPolarHBondContact O-CG1 3.09Å; I71-I75 PolarHBondContact O-N 3.39Å
72F86.8Confident81Confident2 Ų261.1 Ų61.11%0.00934%0.341CS..Hα-helixtrans-57.2-47.8174.2172.7-93.3000111.5A51 L54 G68 I69 V74 I75 N76 F110 F113A51-F72 HydrophobicContact CB-CE2 3.96Å; A51-F72 HydrophobicContact CB-CZ 4.33Å; L54-F72 HydrophobicContact CB-CD2 4.44Å; L54-F72 HydrophobicContact CD1-CD2 3.76Å; L54-F72 HydrophobicContact CD1-CE2 4.4Å; G68-F72 WeakPolarHBondContact O-CB 3.48Å; G68-F72 PolarHBondContact O-N 3.5Å; I69-F72 PolarHBondContact O-N 2.71Å; F72-V74 VanDerWaalsContact C-N 3.34Å; F72-V74 PolarHBondContact O-N 3.38Å; F72-I75 PolarHBondContact O-N 2.8Å; F72-N76 HydrophobicContact CE1-CB 4.19Å; F72-N76 HydrophobicContact CE2-CB 4.44Å; F72-N76 HydrophobicContact CZ-CB 4.14Å; F72-N76 WeakPolarHBondContact CZ-ND2 3.48Å; F72-N76 WeakPolarHBondContact O-CB 3.38Å; F72-N76 PolarHBondContact O-N 3.15Å; F72-F110 AromaticContact CD1-CD2 3.8Å; F72-F110 HydrophobicContact CD1-CD2 3.8Å; F72-F110 HydrophobicContact CD1-CE2 4.49Å; F72-F110 HydrophobicContact CE1-CB 3.95Å; F72-F110 AromaticContact CE1-CD2 3.72Å; F72-F110 HydrophobicContact CE1-CD2 3.72Å; F72-F110 HydrophobicContact CE1-CG 4.34Å; F72-F113 HydrophobicContact CB-CD1 4.13Å; F72-F113 HydrophobicContact CB-CD2 4.49Å; F72-F113 HydrophobicContact CB-CE1 3.83Å; F72-F113 HydrophobicContact CB-CE2 4.23Å; F72-F113 HydrophobicContact CB-CG 4.44Å; F72-F113 HydrophobicContact CB-CZ 3.89Å; F72-F113 HydrophobicContact CD1-CD1 4.02Å; F72-F113 HydrophobicContact CD1-CE1 4.47Å; F72-F113 HydrophobicContact CD1-CG 4.33Å; F72-F113 HydrophobicContact CD2-CB 3.84Å; F72-F113 AromaticContact CD2-CD1 3.93Å; F72-F113 HydrophobicContact CD2-CD1 3.93Å; F72-F113 AromaticContact CD2-CD2 3.61Å; F72-F113 HydrophobicContact CD2-CD2 3.61Å; F72-F113 HydrophobicContact CD2-CE1 4.4Å; F72-F113 HydrophobicContact CD2-CE2 4.13Å; F72-F113 AromaticContact CD2-CG 3.49Å; F72-F113 HydrophobicContact CD2-CG 3.49Å; F72-F113 VanDerWaalsContact CD2-CG 3.49Å; F72-F113 HydrophobicContact CD2-CZ 4.49Å; F72-F113 HydrophobicContact CE1-CB 4.37Å; F72-F113 HydrophobicContact CE1-CD1 4.46Å; F72-F113 HydrophobicContact CE2-CB 3.53Å; F72-F113 HydrophobicContact CE2-CD1 4.39Å; F72-F113 HydrophobicContact CE2-CD2 4.12Å; F72-F113 AromaticContact CE2-CG 3.76Å; F72-F113 HydrophobicContact CE2-CG 3.76Å; F72-F113 HydrophobicContact CG-CB 4.39Å; F72-F113 AromaticContact CG-CD1 3.72Å; F72-F113 HydrophobicContact CG-CD1 3.72Å; F72-F113 HydrophobicContact CG-CD2 4.15Å; F72-F113 AromaticContact CG-CE1 3.97Å; F72-F113 HydrophobicContact CG-CE1 3.97Å; F72-F113 HydrophobicContact CG-CE2 4.38Å; F72-F113 AromaticContact CG-CG 3.81Å; F72-F113 HydrophobicContact CG-CG 3.81Å; F72-F113 HydrophobicContact CG-CZ 4.29Å; F72-F113 HydrophobicContact CZ-CB 3.8Å; F72-F113 HydrophobicContact CZ-CG 4.27Å
73C87.8Confident81.1Confident40 Ų4059.7 Ų59.727%0.2733%0.329SS..Hα-helixtrans-59.6-43.9178.6-68.20000112.1I69 A70 I71 A77I69-C73 PolarHBondContact O-N 2.93Å; I69-C73 PolarHBondContact O-SG 3.44Å; A70-C73 PolarHBondContact O-N 3.47Å; I71-C73 VanDerWaalsContact C-N 3.35Å; I71-C73 PolarHBondContact O-N 2.94Å; C73-A77 VanDerWaalsContact O-CB 3.22Å; C73-A77 WeakPolarHBondContact O-CB 3.41Å; C73-A77 PolarHBondContact O-N 2.98Å
74V87.5Confident80.8Confident108 Ų10857.6 Ų57.666%0.65532%0.317SS*.Hα-helixtrans-64.8-45.9178.6171.80000111.1A70 I71 F72 G78A70-V74 WeakPolarHBondContact O-CG2 3.24Å; A70-V74 PolarHBondContact O-N 2.89Å; I71-V74 PolarHBondContact O-N 2.85Å; F72-V74 VanDerWaalsContact C-N 3.34Å; F72-V74 PolarHBondContact O-N 3.38Å; V74-G78 WeakPolarHBondContact O-CA 3.47Å; V74-G78 PolarHBondContact O-N 3.08Å
75I86.1Confident80.5Confident61 Ų6154.6 Ų54.631%0.31331%0.314SS..Hα-helixtrans-66.7-44.8179.1-65.7172000110.4I50 L54 I71 F72 G78 L79I50-I75 HydrophobicContact CG2-CG2 4.33Å; L54-I75 HydrophobicContact CD1-CB 4.18Å; L54-I75 HydrophobicContact CD1-CD1 4.09Å; L54-I75 HydrophobicContact CD1-CG2 3.98Å; L54-I75 HydrophobicContact CD2-CD1 3.94Å; I71-I75 HydrophobicContact CG2-CD1 3.62Å; I71-I75 HydrophobicContact CG2-CG1 4.23Å; I71-I75 WeakPolarHBondContact O-CG1 3.09Å; I71-I75 PolarHBondContact O-N 3.39Å; F72-I75 PolarHBondContact O-N 2.8Å; I75-G78 PolarHBondContact O-N 2.97Å; I75-L79 WeakPolarHBondContact O-CB 3.4Å; I75-L79 PolarHBondContact O-N 3.36Å
76N84.6Confident79.7Confident0 Ų056.1 Ų56.10%032%0.317CS..Hα-helixtrans-65.9-43.4-176.9-162.1-74000111.5R47 F72 L80 S109R47-N76 PolarHBondContact NH1-OD1 2.69Å; F72-N76 HydrophobicContact CE1-CB 4.19Å; F72-N76 HydrophobicContact CE2-CB 4.44Å; F72-N76 HydrophobicContact CZ-CB 4.14Å; F72-N76 WeakPolarHBondContact CZ-ND2 3.48Å; F72-N76 WeakPolarHBondContact O-CB 3.38Å; F72-N76 PolarHBondContact O-N 3.15Å; N76-L80 WeakPolarHBondContact O-CD1 3.17Å; N76-S109 PolarHBondContact ND2-OG 3.02Å
77A81.1Confident78.4Confident42 Ų4253 Ų5335%0.34730%0.303SS..Hα-helixtrans-71.9-42.6175.100000112.2C73 Y81C73-A77 VanDerWaalsContact O-CB 3.22Å; C73-A77 WeakPolarHBondContact O-CB 3.41Å; C73-A77 PolarHBondContact O-N 2.98Å; A77-Y81 VanDerWaalsContact O-CB 3.29Å; A77-Y81 WeakPolarHBondContact O-CB 3.3Å; A77-Y81 PolarHBondContact O-N 2.95Å
78G80.7Confident77.1Confident31 Ų3149.1 Ų49.132%0.3228%0.282SS..Hα-helixtrans-67.3-43.2-177.600000113V74 I75 L80 Y81 V82V74-G78 WeakPolarHBondContact O-CA 3.47Å; V74-G78 PolarHBondContact O-N 3.08Å; I75-G78 PolarHBondContact O-N 2.97Å; G78-L80 VanDerWaalsContact C-N 3.34Å; G78-L80 PolarHBondContact O-N 3.34Å; G78-Y81 PolarHBondContact O-N 2.83Å; G78-V82 WeakPolarHBondContact O-CB 3.01Å; G78-V82 VanDerWaalsContact O-CG2 3.31Å; G78-V82 WeakPolarHBondContact O-CG2 3.22Å; G78-V82 PolarHBondContact O-N 2.6Å
79L77.7Confident75.7Confident81 Ų8156.1 Ų56.142%0.42432%0.315SS..Hα-helixtrans-66.6-38.8180-157.487.5000111.4L46 I50 I75 Y83L46-L79 HydrophobicContact CD2-CD2 4.08Å; I50-L79 HydrophobicContact CD1-CD2 3.16Å; I50-L79 HydrophobicContact CG1-CD2 4.11Å; I75-L79 WeakPolarHBondContact O-CB 3.4Å; I75-L79 PolarHBondContact O-N 3.36Å; L79-Y83 VanDerWaalsContact O-CB 3.25Å; L79-Y83 WeakPolarHBondContact O-CB 3.31Å; L79-Y83 PolarHBondContact O-N 3.31Å
80L73.6Confident74.1Confident2 Ų255.7 Ų55.71%0.0131%0.313CS..Hα-helixtrans-67.1-43.6173.3-100.489.3000112.4I43 R47 N76 G78 V82 Y83 F84I43-L80 HydrophobicContact CG2-CD2 3.63Å; I43-L80 HydrophobicContact CG2-CG 4.32Å; R47-L80 HydrophobicContact CG-CD1 3.56Å; N76-L80 WeakPolarHBondContact O-CD1 3.17Å; G78-L80 VanDerWaalsContact C-N 3.34Å; G78-L80 PolarHBondContact O-N 3.34Å; L80-V82 VanDerWaalsContact C-N 3.3Å; L80-V82 PolarHBondContact O-N 3.28Å; L80-Y83 PolarHBondContact O-N 2.91Å; L80-F84 HydrophobicContact CB-CD2 4.24Å; L80-F84 HydrophobicContact CB-CE2 4.09Å; L80-F84 HydrophobicContact CD2-CD2 4.41Å; L80-F84 HydrophobicContact CD2-CE2 3.5Å; L80-F84 VanDerWaalsContact CD2-CE2 3.5Å; L80-F84 HydrophobicContact CD2-CZ 3.96Å; L80-F84 HydrophobicContact CG-CE2 4.14Å; L80-F84 WeakPolarHBondContact O-CB 3.16Å; L80-F84 WeakPolarHBondContact O-CD2 3.38Å; L80-F84 WeakPolarHBondContact O-CG 3.45Å; L80-F84 PolarHBondContact O-N 3.25Å
81Y73.3Confident72.3Confident144 Ų14459.4 Ų59.457%0.56533%0.329SS*.Hα-helixtrans-57.6-46.1176.6-177.6-99.1000111.2A77 G78 F84 S85A77-Y81 VanDerWaalsContact O-CB 3.29Å; A77-Y81 WeakPolarHBondContact O-CB 3.3Å; A77-Y81 PolarHBondContact O-N 2.95Å; G78-Y81 PolarHBondContact O-N 2.83Å; Y81-F84 PolarHBondContact O-N 2.9Å; Y81-S85 WeakPolarHBondContact O-CB 3.33Å; Y81-S85 PolarHBondContact O-N 3.48Å
82V73.3Confident70.6Confident84 Ų8463 Ų6351%0.50934%0.344SS..Hα-helixtrans-65.1-40.5175.91720000111.4G78 L80 S86G78-V82 WeakPolarHBondContact O-CB 3.01Å; G78-V82 VanDerWaalsContact O-CG2 3.31Å; G78-V82 WeakPolarHBondContact O-CG2 3.22Å; G78-V82 PolarHBondContact O-N 2.6Å; L80-V82 VanDerWaalsContact C-N 3.3Å; L80-V82 PolarHBondContact O-N 3.28Å; V82-S86 WeakPolarHBondContact O-CA 3.3Å; V82-S86 WeakPolarHBondContact O-CB 3.34Å; V82-S86 PolarHBondContact O-N 3.45Å
83Y72.4Confident68.7Low23 Ų2371.7 Ų71.79%0.0939%0.385CS..Iπ-helixtrans-63.9-46.3177.9-176.6-106.4000111.8A26 F39 I43 L79 L80 F87 Q88A26-Y83 PolarHBondContact O-OH 3.36Å; F39-Y83 AromaticContact CE2-CE1 3.91Å; F39-Y83 HydrophobicContact CE2-CE1 3.91Å; F39-Y83 HydrophobicContact CZ-CE1 4.37Å; I43-Y83 HydrophobicContact CG1-CE1 4.38Å; L79-Y83 VanDerWaalsContact O-CB 3.25Å; L79-Y83 WeakPolarHBondContact O-CB 3.31Å; L79-Y83 PolarHBondContact O-N 3.31Å; L80-Y83 PolarHBondContact O-N 2.91Å; Y83-F87 HydrophobicContact CD2-CB 3.91Å; Y83-F87 HydrophobicContact CD2-CG 4.23Å; Y83-F87 HydrophobicContact CE2-CB 4.07Å; Y83-F87 HydrophobicContact CE2-CG 4.35Å; Y83-F87 WeakPolarHBondContact O-CA 3.47Å; Y83-F87 VanDerWaalsContact O-CB 3.23Å; Y83-F87 WeakPolarHBondContact O-CB 3.29Å; Y83-F87 PolarHBondContact O-N 3.32Å; Y83-Q88 PolarHBondContact O-N 3.45Å
84F67.1Low67Low6 Ų676 Ų763%0.02640%0.401CS..Iπ-helixtrans-66.5-45.3176.1-69-57.5000112.9F39 I43 L80 Y81 Q89 I90 T98 L101F39-F84 HydrophobicContact CE1-CD1 4.32Å; F39-F84 AromaticContact CE1-CE1 3.6Å; F39-F84 HydrophobicContact CE1-CE1 3.6Å; F39-F84 AromaticContact CZ-CD1 3.91Å; F39-F84 HydrophobicContact CZ-CD1 3.91Å; F39-F84 AromaticContact CZ-CE1 3.42Å; F39-F84 HydrophobicContact CZ-CE1 3.42Å; F39-F84 VanDerWaalsContact CZ-CE1 3.42Å; I43-F84 HydrophobicContact CD1-CE1 3.55Å; I43-F84 HydrophobicContact CD1-CZ 3.55Å; L80-F84 HydrophobicContact CB-CD2 4.24Å; L80-F84 HydrophobicContact CB-CE2 4.09Å; L80-F84 HydrophobicContact CD2-CD2 4.41Å; L80-F84 HydrophobicContact CD2-CE2 3.5Å; L80-F84 VanDerWaalsContact CD2-CE2 3.5Å; L80-F84 HydrophobicContact CD2-CZ 3.96Å; L80-F84 HydrophobicContact CG-CE2 4.14Å; L80-F84 WeakPolarHBondContact O-CB 3.16Å; L80-F84 WeakPolarHBondContact O-CD2 3.38Å; L80-F84 WeakPolarHBondContact O-CG 3.45Å; L80-F84 PolarHBondContact O-N 3.25Å; Y81-F84 PolarHBondContact O-N 2.9Å; F84-Q89 PolarHBondContact O-N 2.86Å; F84-I90 HydrophobicContact CD1-CD1 4.04Å; F84-I90 HydrophobicContact CE1-CD1 4.47Å; F84-T98 HydrophobicContact CB-CG2 3.5Å; F84-T98 VanDerWaalsContact CB-CG2 3.5Å; F84-T98 HydrophobicContact CD1-CG2 4.32Å; F84-T98 HydrophobicContact CD2-CG2 3.22Å; F84-T98 HydrophobicContact CE2-CG2 3.9Å; F84-T98 HydrophobicContact CG-CG2 3.47Å; F84-T98 VanDerWaalsContact CG-CG2 3.47Å; F84-L101 HydrophobicContact CE1-CB 4.47Å; F84-L101 HydrophobicContact CE1-CD2 3.84Å; F84-L101 HydrophobicContact CE2-CB 4.35Å; F84-L101 HydrophobicContact CZ-CB 3.76Å; F84-L101 HydrophobicContact CZ-CD2 3.86Å; F84-L101 HydrophobicContact CZ-CG 4.49Å
85S65.3Low65.3Low73 Ų7373.8 Ų73.851%0.5138%0.381SS..Iπ-helixtrans-71.9-41.6-176.6-178.60000112.5Y81Y81-S85 WeakPolarHBondContact O-CB 3.33Å; Y81-S85 PolarHBondContact O-N 3.48Å
86S60.2Low63.9Low83 Ų8373.6 Ų73.658%0.5839%0.394SS*.Iπ-helixtrans-100.3-32-171.5-167.60000114.5V82V82-S86 WeakPolarHBondContact O-CA 3.3Å; V82-S86 WeakPolarHBondContact O-CB 3.34Å; V82-S86 PolarHBondContact O-N 3.45Å
87F57.8Low62.8Low96 Ų9674.5 Ų74.542%0.42140%0.404SS..Iπ-helixtrans-100.4-34.4-174.9-98.2-95.5000113.5G29 Y83G29-F87 CarbonylContact C-O 3.46Å; G29-F87 WeakPolarHBondContact CA-O 3.34Å; Y83-F87 HydrophobicContact CD2-CB 3.91Å; Y83-F87 HydrophobicContact CD2-CG 4.23Å; Y83-F87 HydrophobicContact CE2-CB 4.07Å; Y83-F87 HydrophobicContact CE2-CG 4.35Å; Y83-F87 WeakPolarHBondContact O-CA 3.47Å; Y83-F87 VanDerWaalsContact O-CB 3.23Å; Y83-F87 WeakPolarHBondContact O-CB 3.29Å; Y83-F87 PolarHBondContact O-N 3.32Å
88Q56.8Low61.8Low24 Ų2473.7 Ų73.711%0.11239%0.394CS..SBendtrans-102.9-15.2-171-136.883.5-45.600114.8F39 Y83 I90F39-Q88 HydrophobicContact CE2-CG 4.41Å; F39-Q88 HydrophobicContact CZ-CG 4.1Å; F39-Q88 VanDerWaalsContact CZ-NE2 3.27Å; Y83-Q88 PolarHBondContact O-N 3.45Å; Q88-I90 HydrophobicContact CB-CD1 3.84Å; Q88-I90 HydrophobicContact CB-CG1 3.84Å; Q88-I90 HydrophobicContact CG-CD1 3.65Å; Q88-I90 HydrophobicContact CG-CG1 3.79Å; Q88-I90 PolarHBondContact O-N 3.29Å
89Q55.6Low60.8Low147 Ų14780.7 Ų80.769%0.68741%0.411SS*.  trans3743.4-174-65.8-151.3-23.600113F84 D91F84-Q89 PolarHBondContact O-N 2.86Å; Q89-D91 PolarHBondContact O-N 3.1Å; Q89-D91 VanDerWaalsContact O-N 3.14Å
90I54.3Low60.4Low41 Ų4182.2 Ų82.221%0.2142%0.416CS..  trans-69.9114.3177.4-69.2164.1000106.4F39 F84 Q88 E92 Y95F39-I90 HydrophobicContact CE1-CD1 3.85Å; F39-I90 HydrophobicContact CZ-CD1 4.06Å; F84-I90 HydrophobicContact CD1-CD1 4.04Å; F84-I90 HydrophobicContact CE1-CD1 4.47Å; Q88-I90 HydrophobicContact CB-CD1 3.84Å; Q88-I90 HydrophobicContact CB-CG1 3.84Å; Q88-I90 HydrophobicContact CG-CD1 3.65Å; Q88-I90 HydrophobicContact CG-CG1 3.79Å; Q88-I90 PolarHBondContact O-N 3.29Å; I90-E92 PolarHBondContact O-N 3.03Å; I90-E92 VanDerWaalsContact O-N 3.15Å; I90-Y95 HydrophobicContact CG2-CD2 4.26Å
91D48.9Very low60Low105 Ų10582.3 Ų82.356%0.56142%0.417SS*.  trans-57.3115.7165.6-125-25000106.8Q89 E93 E94Q89-D91 PolarHBondContact O-N 3.1Å; Q89-D91 VanDerWaalsContact O-N 3.14Å; D91-E93 PolarHBondContact O-N 3.34Å; D91-E94 PolarHBondContact O-N 2.97Å; D91-E94 VanDerWaalsContact O-N 3.15Å
92E51.4Low59.7Low129 Ų12976.5 Ų76.560%0.60340%0.396SS*.THydrogen-bonded Turntrans-56.1-16.5-169.7-69.1-174.4147.700113.6I90 G97I90-E92 PolarHBondContact O-N 3.03Å; I90-E92 VanDerWaalsContact O-N 3.15Å; E92-G97 PolarHBondContact O-N 3.47Å
93E48.3Very low59.6Low186 Ų18678.2 Ų78.287%0.86940%0.397SS*.THydrogen-bonded Turntrans-79.2-21.9-178.6-74.8-173.5148.800115D91D91-E93 PolarHBondContact O-N 3.34Å
94E50.8Low59.6Low129 Ų12982.1 Ų82.160%0.60342%0.416SS*.THydrogen-bonded Turntrans-96.6-15.4-168.8-157.5162.417400114.7K8 D91K8-E94 IonicContact NZ-OE1 3.99Å; K8-E94 PolarHBondContact NZ-OE1 3.44Å; K8-E94 IonicContact NZ-OE2 2.69Å; K8-E94 PolarHBondContact NZ-OE2 3.45Å; D91-E94 PolarHBondContact O-N 2.97Å; D91-E94 VanDerWaalsContact O-N 3.15Å
95Y52.3Low60Low62 Ų6282.8 Ų82.824%0.24342%0.424CS..THydrogen-bonded Turntrans-116.416.6-175.4-98-92.6000115.3K36 I90 G97 L101K36-Y95 HydrophobicContact CB-CE1 4Å; K36-Y95 HydrophobicContact CD-CD1 4.27Å; K36-Y95 HydrophobicContact CD-CE1 4.03Å; K36-Y95 HydrophobicContact CG-CD1 4.44Å; K36-Y95 HydrophobicContact CG-CE1 3.84Å; I90-Y95 HydrophobicContact CG2-CD2 4.26Å; Y95-G97 PolarHBondContact O-N 3.19Å; Y95-L101 HydrophobicContact CD1-CD1 4.43Å
96G57.1Low60.8Low57 Ų5781.9 Ų81.959%0.58841%0.412SS*.THydrogen-bonded Turntrans76.410.8-177.400000114
97G60.3Low62.1Low19 Ų1984.6 Ų84.620%0.19642%0.417CS..  trans89.6136.1-177.200000112.9E92 Y95 W99 E100E92-G97 PolarHBondContact O-N 3.47Å; Y95-G97 PolarHBondContact O-N 3.19Å; G97-W99 PolarHBondContact O-N 3Å; G97-E100 PolarHBondContact O-N 3.13Å
98T59.9Low63.5Low25 Ų2583.1 Ų83.115%0.15342%0.416CS..Hα-helixtrans-47.9-22.5173.8-39.70000113.3F84 T102F84-T98 HydrophobicContact CB-CG2 3.5Å; F84-T98 VanDerWaalsContact CB-CG2 3.5Å; F84-T98 HydrophobicContact CD1-CG2 4.32Å; F84-T98 HydrophobicContact CD2-CG2 3.22Å; F84-T98 HydrophobicContact CE2-CG2 3.9Å; F84-T98 HydrophobicContact CG-CG2 3.47Å; F84-T98 VanDerWaalsContact CG-CG2 3.47Å; T98-T102 VanDerWaalsContact O-CB 3.3Å; T98-T102 WeakPolarHBondContact O-CB 3.33Å; T98-T102 PolarHBondContact O-N 2.78Å; T98-T102 PolarHBondContact O-OG1 3.33Å
99W61.6Low65Low179 Ų17982 Ų8268%0.67841%0.411SS*.Hα-helixtrans-68.7-37.4179.1-172.2-123.9000114.7G97 T102 K103G97-W99 PolarHBondContact O-N 3Å; W99-T102 PolarHBondContact O-N 3.48Å; W99-K103 WeakPolarHBondContact O-CG 3.35Å; W99-K103 PolarHBondContact O-N 3.42Å; W99-K103 VanDerWaalsContact O-N 3.16Å
100E68.3Low66.6Low112 Ų11277.3 Ų77.352%0.52339%0.388SS..Hα-helixtrans-68.5-47.8177-96.1-170.5142.900110.9G97 T102 K103 E104G97-E100 PolarHBondContact O-N 3.13Å; E100-T102 PolarHBondContact O-N 3.24Å; E100-K103 WeakPolarHBondContact O-CB 3.43Å; E100-K103 PolarHBondContact O-N 3.01Å; E100-K103 VanDerWaalsContact O-N 3.09Å; E100-E104 PolarHBondContact O-N 2.88Å
101L64.6Low68.4Low5 Ų577.8 Ų77.83%0.02640%0.398CS..Hα-helixtrans-61.7-34.5174.9-85.685.3000112.3F39 L40 I43 R47 F84 Y95 K103 E104F39-L101 HydrophobicContact CD1-CD2 3.87Å; F39-L101 HydrophobicContact CE1-CD2 3.57Å; L40-L101 HydrophobicContact CD2-CD2 3.93Å; L40-L101 HydrophobicContact CD2-CG 3.87Å; I43-L101 HydrophobicContact CD1-CD2 4.09Å; R47-L101 PolarHBondContact NH2-O 3.43Å; F84-L101 HydrophobicContact CE1-CB 4.47Å; F84-L101 HydrophobicContact CE1-CD2 3.84Å; F84-L101 HydrophobicContact CE2-CB 4.35Å; F84-L101 HydrophobicContact CZ-CB 3.76Å; F84-L101 HydrophobicContact CZ-CD2 3.86Å; F84-L101 HydrophobicContact CZ-CG 4.49Å; Y95-L101 HydrophobicContact CD1-CD1 4.43Å; L101-K103 VanDerWaalsContact C-N 3.27Å; L101-K103 PolarHBondContact O-N 3.45Å; L101-E104 PolarHBondContact O-N 3.29Å
102T67.6Low70.5Confident22 Ų2274.9 Ų74.914%0.13538%0.382CS..Hα-helixtrans-69.6-28.2178.5-59.70000111.8R47 T98 W99 E100R47-T102 VanDerWaalsContact NH2-C 3.28Å; R47-T102 VanDerWaalsContact NH2-CA 3.32Å; R47-T102 PolarHBondContact NH2-O 3.38Å; T98-T102 VanDerWaalsContact O-CB 3.3Å; T98-T102 WeakPolarHBondContact O-CB 3.33Å; T98-T102 PolarHBondContact O-N 2.78Å; T98-T102 PolarHBondContact O-OG1 3.33Å; W99-T102 PolarHBondContact O-N 3.48Å; E100-T102 PolarHBondContact O-N 3.24Å
103K71.8Confident72.4Confident120 Ų12068.8 Ų68.852%0.52235%0.353SS..Hα-helixtrans-76.8-38.3172.5-71.9172.6178.6174.30112W99 E100 L101 G105 F106W99-K103 WeakPolarHBondContact O-CG 3.35Å; W99-K103 PolarHBondContact O-N 3.42Å; W99-K103 VanDerWaalsContact O-N 3.16Å; E100-K103 WeakPolarHBondContact O-CB 3.43Å; E100-K103 PolarHBondContact O-N 3.01Å; E100-K103 VanDerWaalsContact O-N 3.09Å; L101-K103 VanDerWaalsContact C-N 3.27Å; L101-K103 PolarHBondContact O-N 3.45Å; K103-G105 PolarHBondContact O-N 2.93Å; K103-F106 PolarHBondContact O-N 3.42Å
104E72Confident74.4Confident104 Ų10462.2 Ų62.249%0.48632%0.324SS..THydrogen-bonded Turntrans-61.9124.4173.9-114.1179.315700110.5R47 E100 L101 F106R47-E104 PolarHBondContact NH2-O 3.24Å; E100-E104 PolarHBondContact O-N 2.88Å; L101-E104 PolarHBondContact O-N 3.29Å; E104-F106 VanDerWaalsContact C-N 3.31Å; E104-F106 PolarHBondContact O-N 3.39Å
105G74.8Confident76.4Confident20 Ų2059.8 Ų59.821%0.20632%0.318CS..THydrogen-bonded Turntrans80.5-4.1-178.800000116.3K103 T108 S109K103-G105 PolarHBondContact O-N 2.93Å; G105-T108 WeakPolarHBondContact CA-OG1 3.33Å; G105-T108 PolarHBondContact O-OG1 2.95Å; G105-S109 WeakPolarHBondContact O-CB 3.18Å; G105-S109 PolarHBondContact O-N 3.33Å; G105-S109 VanDerWaalsContact O-N 3.15Å; G105-S109 PolarHBondContact O-OG 3.47Å
106F82.9Confident78.4Confident55 Ų5557.6 Ų57.624%0.24131%0.311CS..Hα-helixtrans-67.5-49.2175.1178.4-98.3000111.6K103 E104 T108 S109 F110K103-F106 PolarHBondContact O-N 3.42Å; E104-F106 VanDerWaalsContact C-N 3.31Å; E104-F106 PolarHBondContact O-N 3.39Å; F106-T108 VanDerWaalsContact C-N 3.32Å; F106-T108 PolarHBondContact O-N 3.06Å; F106-S109 PolarHBondContact O-N 2.8Å; F106-S109 PolarHBondContact O-OG 2.89Å; F106-S109 VanDerWaalsContact O-OG 3.08Å; F106-F110 VanDerWaalsContact O-CB 3.24Å; F106-F110 WeakPolarHBondContact O-CB 3.37Å; F106-F110 PolarHBondContact O-N 3.35Å
107M86.4Confident79.9Confident139 Ų13956 Ų5669%0.68529%0.287SS*.Hα-helixtrans-64.6-37-177.3-66-66.3-92.700112.4A111M107-A111 WeakPolarHBondContact O-CB 3.26Å; M107-A111 PolarHBondContact O-N 2.92Å
108T88.8Confident81.3Confident66 Ų6660 Ų6041%0.40530%0.303SS..Hα-helixtrans-70.7-43.8178.551.70000111.7G105 F106 A111 L112G105-T108 WeakPolarHBondContact CA-OG1 3.33Å; G105-T108 PolarHBondContact O-OG1 2.95Å; F106-T108 VanDerWaalsContact C-N 3.32Å; F106-T108 PolarHBondContact O-N 3.06Å; T108-A111 PolarHBondContact O-N 2.87Å; T108-L112 PolarHBondContact O-N 3.32Å
109S87.4Confident82.8Confident0 Ų063.6 Ų63.60%032%0.32CS..Hα-helixtrans-68.8-34.8175.760.10000112.4A51 N76 G105 F106 L112 F113A51-S109 VanDerWaalsContact CB-O 3.3Å; A51-S109 WeakPolarHBondContact CB-O 3.3Å; N76-S109 PolarHBondContact ND2-OG 3.02Å; G105-S109 WeakPolarHBondContact O-CB 3.18Å; G105-S109 PolarHBondContact O-N 3.33Å; G105-S109 VanDerWaalsContact O-N 3.15Å; G105-S109 PolarHBondContact O-OG 3.47Å; F106-S109 PolarHBondContact O-N 2.8Å; F106-S109 PolarHBondContact O-OG 2.89Å; F106-S109 VanDerWaalsContact O-OG 3.08Å; S109-L112 PolarHBondContact O-N 3.36Å; S109-F113 WeakPolarHBondContact O-CB 3.05Å; S109-F113 PolarHBondContact O-N 3.43Å
110F89.4Confident84.1Confident49 Ų4958.8 Ų58.822%0.21530%0.304CS..Hα-helixtrans-63.1-46.8172.7179.7-120.1000112.2I69 F72 F106 L112 F113 L114I69-F110 HydrophobicContact CG2-CE2 3.79Å; I69-F110 HydrophobicContact CG2-CZ 4.07Å; F72-F110 AromaticContact CD1-CD2 3.8Å; F72-F110 HydrophobicContact CD1-CD2 3.8Å; F72-F110 HydrophobicContact CD1-CE2 4.49Å; F72-F110 HydrophobicContact CE1-CB 3.95Å; F72-F110 AromaticContact CE1-CD2 3.72Å; F72-F110 HydrophobicContact CE1-CD2 3.72Å; F72-F110 HydrophobicContact CE1-CG 4.34Å; F106-F110 VanDerWaalsContact O-CB 3.24Å; F106-F110 WeakPolarHBondContact O-CB 3.37Å; F106-F110 PolarHBondContact O-N 3.35Å; F110-L112 VanDerWaalsContact C-N 3.32Å; F110-L112 PolarHBondContact O-N 3.04Å; F110-F113 HydrophobicContact CD2-CD1 4.27Å; F110-F113 HydrophobicContact CE2-CD1 4.37Å; F110-F113 PolarHBondContact O-N 2.87Å; F110-L114 HydrophobicContact CD1-CD1 4.18Å; F110-L114 HydrophobicContact CD2-CG 4.44Å; F110-L114 HydrophobicContact CE1-CD1 3.64Å; F110-L114 HydrophobicContact CE1-CG 4.38Å; F110-L114 HydrophobicContact CE2-CD1 4.15Å; F110-L114 HydrophobicContact CE2-CD2 4.12Å; F110-L114 HydrophobicContact CE2-CG 4.03Å; F110-L114 HydrophobicContact CZ-CD1 3.63Å; F110-L114 HydrophobicContact CZ-CD2 4.16Å; F110-L114 HydrophobicContact CZ-CG 4.02Å; F110-L114 WeakPolarHBondContact O-CG 3.18Å; F110-L114 PolarHBondContact O-N 2.83Å
111A91.8Very high84.9Confident50 Ų5056.4 Ų56.441%0.41329%0.291SS..Hα-helixtrans-59.3-43.8175.600000111.5M107 T108 L114 V115M107-A111 WeakPolarHBondContact O-CB 3.26Å; M107-A111 PolarHBondContact O-N 2.92Å; T108-A111 PolarHBondContact O-N 2.87Å; A111-L114 PolarHBondContact O-N 3.46Å; A111-V115 WeakPolarHBondContact O-CG2 3.33Å; A111-V115 PolarHBondContact O-N 2.94Å
112L92.3Very high86Confident45 Ų4558.8 Ų58.824%0.23631%0.306CS..Hα-helixtrans-63.7-43.9177.5-176.263.5000112.2Q48 I52 T108 S109 F110 L114 V115 V116Q48-L112 HydrophobicContact CB-CD2 4.4Å; Q48-L112 HydrophobicContact CG-CD2 3.46Å; Q48-L112 VanDerWaalsContact CG-CD2 3.46Å; I52-L112 HydrophobicContact CD1-CD2 3.99Å; I52-L112 HydrophobicContact CG1-CD2 3.71Å; I52-L112 HydrophobicContact CG1-CG 4.26Å; T108-L112 PolarHBondContact O-N 3.32Å; S109-L112 PolarHBondContact O-N 3.36Å; F110-L112 VanDerWaalsContact C-N 3.32Å; F110-L112 PolarHBondContact O-N 3.04Å; L112-L114 VanDerWaalsContact C-N 3.32Å; L112-L114 PolarHBondContact O-N 3.47Å; L112-V115 PolarHBondContact O-N 2.93Å; L112-V116 HydrophobicContact CD1-CG2 4.11Å; L112-V116 HydrophobicContact CG-CG2 4.29Å; L112-V116 WeakPolarHBondContact O-CG2 2.86Å; L112-V116 PolarHBondContact O-N 3.46Å
113F92.1Very high86.9Confident0 Ų061.4 Ų61.40%033%0.329CS..Hα-helixtrans-55-48.2174.9160.6-105000111.3A51 L54 F72 S109 F110 V115 V116 W117A51-F113 HydrophobicContact CB-CB 3.97Å; L54-F113 HydrophobicContact CB-CD2 4.17Å; L54-F113 HydrophobicContact CB-CE2 4.22Å; F72-F113 HydrophobicContact CB-CD1 4.13Å; F72-F113 HydrophobicContact CB-CD2 4.49Å; F72-F113 HydrophobicContact CB-CE1 3.83Å; F72-F113 HydrophobicContact CB-CE2 4.23Å; F72-F113 HydrophobicContact CB-CG 4.44Å; F72-F113 HydrophobicContact CB-CZ 3.89Å; F72-F113 HydrophobicContact CD1-CD1 4.02Å; F72-F113 HydrophobicContact CD1-CE1 4.47Å; F72-F113 HydrophobicContact CD1-CG 4.33Å; F72-F113 HydrophobicContact CD2-CB 3.84Å; F72-F113 AromaticContact CD2-CD1 3.93Å; F72-F113 HydrophobicContact CD2-CD1 3.93Å; F72-F113 AromaticContact CD2-CD2 3.61Å; F72-F113 HydrophobicContact CD2-CD2 3.61Å; F72-F113 HydrophobicContact CD2-CE1 4.4Å; F72-F113 HydrophobicContact CD2-CE2 4.13Å; F72-F113 AromaticContact CD2-CG 3.49Å; F72-F113 HydrophobicContact CD2-CG 3.49Å; F72-F113 VanDerWaalsContact CD2-CG 3.49Å; F72-F113 HydrophobicContact CD2-CZ 4.49Å; F72-F113 HydrophobicContact CE1-CB 4.37Å; F72-F113 HydrophobicContact CE1-CD1 4.46Å; F72-F113 HydrophobicContact CE2-CB 3.53Å; F72-F113 HydrophobicContact CE2-CD1 4.39Å; F72-F113 HydrophobicContact CE2-CD2 4.12Å; F72-F113 AromaticContact CE2-CG 3.76Å; F72-F113 HydrophobicContact CE2-CG 3.76Å; F72-F113 HydrophobicContact CG-CB 4.39Å; F72-F113 AromaticContact CG-CD1 3.72Å; F72-F113 HydrophobicContact CG-CD1 3.72Å; F72-F113 HydrophobicContact CG-CD2 4.15Å; F72-F113 AromaticContact CG-CE1 3.97Å; F72-F113 HydrophobicContact CG-CE1 3.97Å; F72-F113 HydrophobicContact CG-CE2 4.38Å; F72-F113 AromaticContact CG-CG 3.81Å; F72-F113 HydrophobicContact CG-CG 3.81Å; F72-F113 HydrophobicContact CG-CZ 4.29Å; F72-F113 HydrophobicContact CZ-CB 3.8Å; F72-F113 HydrophobicContact CZ-CG 4.27Å; S109-F113 WeakPolarHBondContact O-CB 3.05Å; S109-F113 PolarHBondContact O-N 3.43Å; F110-F113 HydrophobicContact CD2-CD1 4.27Å; F110-F113 HydrophobicContact CE2-CD1 4.37Å; F110-F113 PolarHBondContact O-N 2.87Å; F113-V115 PolarHBondContact O-N 3.25Å; F113-V116 PolarHBondContact O-N 3.39Å; F113-W117 HydrophobicContact CD1-CE3 4.33Å; F113-W117 HydrophobicContact CE1-CD2 4.44Å; F113-W117 AromaticContact CE1-CE3 3.38Å; F113-W117 HydrophobicContact CE1-CE3 3.38Å; F113-W117 AromaticContact CE1-CZ3 3.61Å; F113-W117 HydrophobicContact CE1-CZ3 3.61Å; F113-W117 HydrophobicContact CE2-CB 4.49Å; F113-W117 HydrophobicContact CE2-CD2 4.5Å; F113-W117 HydrophobicContact CE2-CE3 4.14Å; F113-W117 AromaticContact CZ-CD2 3.96Å; F113-W117 HydrophobicContact CZ-CD2 3.96Å; F113-W117 AromaticContact CZ-CE3 3.26Å; F113-W117 HydrophobicContact CZ-CE3 3.26Å; F113-W117 AromaticContact CZ-CZ3 3.6Å; F113-W117 HydrophobicContact CZ-CZ3 3.6Å; F113-W117 WeakPolarHBondContact O-CB 3.39Å; F113-W117 PolarHBondContact O-N 3.44Å
114L90.6Very high87.5Confident49 Ų4960.3 Ų60.326%0.25733%0.329SS..Hα-helixtrans-61-45178.1-70.1179.1000111.9F110 A111 L112 W117 I118F110-L114 HydrophobicContact CD1-CD1 4.18Å; F110-L114 HydrophobicContact CD2-CG 4.44Å; F110-L114 HydrophobicContact CE1-CD1 3.64Å; F110-L114 HydrophobicContact CE1-CG 4.38Å; F110-L114 HydrophobicContact CE2-CD1 4.15Å; F110-L114 HydrophobicContact CE2-CD2 4.12Å; F110-L114 HydrophobicContact CE2-CG 4.03Å; F110-L114 HydrophobicContact CZ-CD1 3.63Å; F110-L114 HydrophobicContact CZ-CD2 4.16Å; F110-L114 HydrophobicContact CZ-CG 4.02Å; F110-L114 WeakPolarHBondContact O-CG 3.18Å; F110-L114 PolarHBondContact O-N 2.83Å; A111-L114 PolarHBondContact O-N 3.46Å; L112-L114 VanDerWaalsContact C-N 3.32Å; L112-L114 PolarHBondContact O-N 3.47Å; L114-W117 HydrophobicContact CD2-CE3 4.1Å; L114-W117 HydrophobicContact CD2-CZ3 4.28Å; L114-W117 PolarHBondContact O-N 3.43Å; L114-I118 WeakPolarHBondContact O-CB 3.49Å; L114-I118 WeakPolarHBondContact O-CD1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.32Å; L114-I118 PolarHBondContact O-N 2.99Å
115V93.1Very high87.9Confident77 Ų7758.8 Ų58.847%0.46732%0.322SS..Hα-helixtrans-60.5-50.5179.2169.40000110.9A111 L112 F113 W117 I118 I119A111-V115 WeakPolarHBondContact O-CG2 3.33Å; A111-V115 PolarHBondContact O-N 2.94Å; L112-V115 PolarHBondContact O-N 2.93Å; F113-V115 PolarHBondContact O-N 3.25Å; V115-W117 PolarHBondContact O-N 2.87Å; V115-I118 PolarHBondContact O-N 3.26Å; V115-I119 HydrophobicContact CG1-CD1 3.67Å; V115-I119 WeakPolarHBondContact O-CB 3.46Å; V115-I119 WeakPolarHBondContact O-CD1 3.42Å; V115-I119 WeakPolarHBondContact O-CG1 3.28Å; V115-I119 PolarHBondContact O-N 2.96Å
116V92.6Very high87.6Confident16 Ų1665.8 Ų65.810%0.09735%0.347CS..Hα-helixtrans-62.3-45.8179.5175.80000110.4I52 V56 L112 F113 I118 I119 F120I52-V116 HydrophobicContact CG1-CG2 4.29Å; V56-V116 HydrophobicContact CG2-CG1 3.75Å; L112-V116 HydrophobicContact CD1-CG2 4.11Å; L112-V116 HydrophobicContact CG-CG2 4.29Å; L112-V116 WeakPolarHBondContact O-CG2 2.86Å; L112-V116 PolarHBondContact O-N 3.46Å; F113-V116 PolarHBondContact O-N 3.39Å; V116-I118 PolarHBondContact O-N 3.01Å; V116-I119 PolarHBondContact O-N 3.28Å; V116-F120 HydrophobicContact CG1-CD2 3.78Å; V116-F120 HydrophobicContact CG1-CE2 4.02Å; V116-F120 WeakPolarHBondContact O-CD2 3.27Å; V116-F120 PolarHBondContact O-N 3.49Å
117W89.8Confident86.4Confident25 Ų2574 Ų7410%0.09539%0.393CS..Hα-helixtrans-60-48.5178.9-177.814.8000112G55 W58 L63 I69 F113 L114 V115 I119 F120 Y121G55-W117 WeakPolarHBondContact O-CA 3.18Å; W58-W117 HydrophobicContact CB-CD2 4.36Å; W58-W117 HydrophobicContact CB-CG 4.26Å; W58-W117 PolarHBondContact O-NE1 3.03Å; L63-W117 WeakPolarHBondContact O-CZ2 3.22Å; L63-W117 PolarHBondContact O-NE1 3.35Å; I69-W117 HydrophobicContact CG1-CH2 4.25Å; I69-W117 HydrophobicContact CG1-CZ3 3.75Å; F113-W117 HydrophobicContact CD1-CE3 4.33Å; F113-W117 HydrophobicContact CE1-CD2 4.44Å; F113-W117 AromaticContact CE1-CE3 3.38Å; F113-W117 HydrophobicContact CE1-CE3 3.38Å; F113-W117 AromaticContact CE1-CZ3 3.61Å; F113-W117 HydrophobicContact CE1-CZ3 3.61Å; F113-W117 HydrophobicContact CE2-CB 4.49Å; F113-W117 HydrophobicContact CE2-CD2 4.5Å; F113-W117 HydrophobicContact CE2-CE3 4.14Å; F113-W117 AromaticContact CZ-CD2 3.96Å; F113-W117 HydrophobicContact CZ-CD2 3.96Å; F113-W117 AromaticContact CZ-CE3 3.26Å; F113-W117 HydrophobicContact CZ-CE3 3.26Å; F113-W117 AromaticContact CZ-CZ3 3.6Å; F113-W117 HydrophobicContact CZ-CZ3 3.6Å; F113-W117 WeakPolarHBondContact O-CB 3.39Å; F113-W117 PolarHBondContact O-N 3.44Å; L114-W117 HydrophobicContact CD2-CE3 4.1Å; L114-W117 HydrophobicContact CD2-CZ3 4.28Å; L114-W117 PolarHBondContact O-N 3.43Å; V115-W117 PolarHBondContact O-N 2.87Å; W117-I119 PolarHBondContact O-N 3.48Å; W117-F120 PolarHBondContact O-N 3.41Å; W117-Y121 WeakPolarHBondContact O-CB 3.46Å; W117-Y121 PolarHBondContact O-N 2.98Å
118I88.9Confident86.4Confident101 Ų10170.8 Ų70.852%0.51838%0.379SS..Hα-helixtrans-62.4-44.2179.2-67.4163.4000110.5L114 V115 V116 T122L114-I118 WeakPolarHBondContact O-CB 3.49Å; L114-I118 WeakPolarHBondContact O-CD1 3.31Å; L114-I118 WeakPolarHBondContact O-CG1 3.32Å; L114-I118 PolarHBondContact O-N 2.99Å; V115-I118 PolarHBondContact O-N 3.26Å; V116-I118 PolarHBondContact O-N 3.01Å; I118-T122 WeakPolarHBondContact O-CB 3.41Å; I118-T122 PolarHBondContact O-N 3.5Å; I118-T122 PolarHBondContact O-OG1 3.44Å
119I91Very high86.3Confident102 Ų10271.1 Ų71.152%0.52338%0.377SS..Hα-helixtrans-60.2-52.5179.3-70.6167.7000110.6V115 V116 W117 T122 A123V115-I119 HydrophobicContact CG1-CD1 3.67Å; V115-I119 WeakPolarHBondContact O-CB 3.46Å; V115-I119 WeakPolarHBondContact O-CD1 3.42Å; V115-I119 WeakPolarHBondContact O-CG1 3.28Å; V115-I119 PolarHBondContact O-N 2.96Å; V116-I119 PolarHBondContact O-N 3.28Å; W117-I119 PolarHBondContact O-N 3.48Å; I119-T122 PolarHBondContact O-N 2.63Å; I119-A123 VanDerWaalsContact O-CB 3.27Å; I119-A123 WeakPolarHBondContact O-CB 3.33Å; I119-A123 PolarHBondContact O-N 3.25Å
120F89.1Confident86.2Confident77 Ų7775 Ų7534%0.33840%0.398SS..Hα-helixtrans-68-41.7-177.9-87.2-90.6000112.4V56 V116 W117 T122 A123 L124V56-F120 HydrophobicContact CG1-CD1 4.37Å; V56-F120 HydrophobicContact CG1-CE1 4.14Å; V56-F120 HydrophobicContact CG1-CZ 4.35Å; V56-F120 HydrophobicContact CG2-CD2 4.03Å; V56-F120 HydrophobicContact CG2-CE1 4.38Å; V56-F120 HydrophobicContact CG2-CE2 3.63Å; V56-F120 HydrophobicContact CG2-CZ 3.82Å; V116-F120 HydrophobicContact CG1-CD2 3.78Å; V116-F120 HydrophobicContact CG1-CE2 4.02Å; V116-F120 WeakPolarHBondContact O-CD2 3.27Å; V116-F120 PolarHBondContact O-N 3.49Å; W117-F120 PolarHBondContact O-N 3.41Å; F120-T122 VanDerWaalsContact C-N 3.34Å; F120-T122 PolarHBondContact O-N 3.24Å; F120-A123 PolarHBondContact O-N 2.94Å; F120-L124 HydrophobicContact CD1-CD1 4.43Å; F120-L124 WeakPolarHBondContact O-CB 2.93Å; F120-L124 WeakPolarHBondContact O-CG 3.31Å; F120-L124 PolarHBondContact O-N 3Å
121Y86.7Confident86Confident62 Ų6276.5 Ų76.524%0.24341%0.409CS..Hα-helixtrans-59.9-48.3176.3-178.2-88.4000110.5P62 K64 W117 H125P62-Y121 HydrophobicContact CB-CD2 4.27Å; P62-Y121 HydrophobicContact CB-CE2 3.7Å; K64-Y121 WeakPolarHBondContact CE-OH 3.36Å; K64-Y121 HydrophobicContact CG-CE2 4.24Å; K64-Y121 PolarHBondContact NZ-OH 2.91Å; W117-Y121 WeakPolarHBondContact O-CB 3.46Å; W117-Y121 PolarHBondContact O-N 2.98Å; Y121-H125 AromaticContact CD2-ND1 3.92Å; Y121-H125 HydrophobicContact CE1-CB 4.31Å; Y121-H125 HydrophobicContact CE2-CB 4.39Å; Y121-H125 VanDerWaalsContact O-CB 3.27Å; Y121-H125 WeakPolarHBondContact O-CB 3.37Å; Y121-H125 PolarHBondContact O-N 3.38Å; Y121-H125 PolarHBondContact O-ND1 3.3Å
122T86.3Confident85.6Confident55 Ų5578.2 Ų78.234%0.33741%0.409SS..Hα-helixtrans-62.6-46.4177.9-56.40000110.7I118 I119 F120 L124 F126I118-T122 WeakPolarHBondContact O-CB 3.41Å; I118-T122 PolarHBondContact O-N 3.5Å; I118-T122 PolarHBondContact O-OG1 3.44Å; I119-T122 PolarHBondContact O-N 2.63Å; F120-T122 VanDerWaalsContact C-N 3.34Å; F120-T122 PolarHBondContact O-N 3.24Å; T122-L124 PolarHBondContact O-N 2.86Å; T122-F126 HydrophobicContact CG2-CD2 3.36Å; T122-F126 HydrophobicContact CG2-CE2 3.49Å; T122-F126 VanDerWaalsContact CG2-CE2 3.49Å; T122-F126 WeakPolarHBondContact O-CB 3.44Å; T122-F126 WeakPolarHBondContact O-CD2 3.17Å; T122-F126 PolarHBondContact O-N 3.41Å
123A86.9Confident85.2Confident77 Ų7780.4 Ų80.464%0.63642%0.421SS*.Hα-helixtrans-65.8-34.3-177.700000113.9I119 F120I119-A123 VanDerWaalsContact O-CB 3.27Å; I119-A123 WeakPolarHBondContact O-CB 3.33Å; I119-A123 PolarHBondContact O-N 3.25Å; F120-A123 PolarHBondContact O-N 2.94Å
124L84.7Confident84.7Confident97 Ų9786.1 Ų86.151%0.50845%0.451SS..Hα-helixtrans-94.2-23.5-175.7-67.6171.6000114I60 F120 T122I60-L124 HydrophobicContact CB-CD1 4.13Å; I60-L124 HydrophobicContact CG1-CD1 3.49Å; I60-L124 VanDerWaalsContact CG1-CD1 3.49Å; F120-L124 HydrophobicContact CD1-CD1 4.43Å; F120-L124 WeakPolarHBondContact O-CB 2.93Å; F120-L124 WeakPolarHBondContact O-CG 3.31Å; F120-L124 PolarHBondContact O-N 3Å; T122-L124 PolarHBondContact O-N 2.86Å
125H79.4Confident84.2Confident73 Ų7389 Ų8934%0.33847%0.466SS..Hα-helixtrans-11915.8-176.3-56.183.1000112.6G59 P62 Y121 D127G59-H125 PolarHBondContact O-CE1 3.02Å; G59-H125 VanDerWaalsContact O-CE1 3.26Å; P62-H125 VanDerWaalsContact CB-NE2 3.33Å; P62-H125 WeakPolarHBondContact CB-NE2 3.35Å; P62-H125 VanDerWaalsContact CD-NE2 3.32Å; P62-H125 WeakPolarHBondContact CD-NE2 3.27Å; P62-H125 VanDerWaalsContact CG-NE2 3.31Å; P62-H125 WeakPolarHBondContact CG-NE2 3.13Å; Y121-H125 AromaticContact CD2-ND1 3.92Å; Y121-H125 HydrophobicContact CE1-CB 4.31Å; Y121-H125 HydrophobicContact CE2-CB 4.39Å; Y121-H125 VanDerWaalsContact O-CB 3.27Å; Y121-H125 WeakPolarHBondContact O-CB 3.37Å; Y121-H125 PolarHBondContact O-N 3.38Å; Y121-H125 PolarHBondContact O-ND1 3.3Å; H125-D127 PolarHBondContact O-N 2.85Å
126F69.7Low83.5Confident167 Ų16790 Ų9073%0.73247%0.465SS*.  trans-70.7111.8164.6-127.3-106.2000108.3T122T122-F126 HydrophobicContact CG2-CD2 3.36Å; T122-F126 HydrophobicContact CG2-CE2 3.49Å; T122-F126 VanDerWaalsContact CG2-CE2 3.49Å; T122-F126 WeakPolarHBondContact O-CB 3.44Å; T122-F126 WeakPolarHBondContact O-CD2 3.17Å; T122-F126 PolarHBondContact O-N 3.41Å
127D57.2Low82.7Confident228 Ų22896.7 Ų96.7100%1.21950%0.499SS*.  trans-104.20157.7-116-44.9000107.8H125H125-D127 PolarHBondContact O-N 2.85Å

Retrieved 127 of 127 residues in 156.1 ms (Link to these results)