A0A5K4F698_SCHMA Loading...

Sugar transporter SWEET

AlphaFold DB , UniProt , Accession A0A5K4F698, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 262 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
1M72.6Confident77.5Confident208 Ų208128.1 Ų128.1100%1.02561%0.608SS**  0-45.50-159.7160.9179.700111.8R3 F4 K5M1-R3 PolarHBondContact O-N 3.23Å; M1-F4 PolarHBondContact O-N 3.28Å; M1-K5 PolarHBondContact O-N 2.98Å
2E80.3Confident76.8Confident169 Ų169131.3 Ų131.379%0.7961%0.61SS**Hα-helixtrans-58.2-46178.9-67.3-175.6154.300114.4F4 K5 E6E2-F4 PolarHBondContact O-N 3.04Å; E2-K5 WeakPolarHBondContact O-CA 3.28Å; E2-K5 WeakPolarHBondContact O-CB 3.39Å; E2-K5 PolarHBondContact O-N 3.21Å; E2-E6 PolarHBondContact O-N 3.08Å
3R81.3Confident76.4Confident216 Ų216129.7 Ų129.782%0.81560%0.603SS**Hα-helixtrans-56.6-35.2176.5-71.3-166.8-173.6-172.62.8113.9M1 A7M1-R3 PolarHBondContact O-N 3.23Å; R3-A7 VanDerWaalsContact O-CB 3.26Å; R3-A7 WeakPolarHBondContact O-CB 3.31Å; R3-A7 PolarHBondContact O-N 3.19Å
4F79.6Confident76.1Confident168 Ų168129.1 Ų129.174%0.73759%0.594SS**Hα-helixtrans-71.9-38.4176-75.7-72.6000111.7M1 E2 S8M1-F4 PolarHBondContact O-N 3.28Å; E2-F4 PolarHBondContact O-N 3.04Å; F4-S8 WeakPolarHBondContact O-CB 3.45Å; F4-S8 PolarHBondContact O-N 2.85Å; F4-S8 PolarHBondContact O-OG 3.47Å
5K78.7Confident76Confident145 Ų145123.9 Ų123.963%0.6358%0.578SS**Hα-helixtrans-63.5-46.9175.1-168.4179.4179.5-1760110.3M1 E2 S8 I9M1-K5 PolarHBondContact O-N 2.98Å; E2-K5 WeakPolarHBondContact O-CA 3.28Å; E2-K5 WeakPolarHBondContact O-CB 3.39Å; E2-K5 PolarHBondContact O-N 3.21Å; K5-S8 PolarHBondContact O-N 2.93Å; K5-S8 PolarHBondContact O-OG 2.81Å; K5-I9 HydrophobicContact CG-CD1 4.06Å; K5-I9 VanDerWaalsContact O-CG1 3.27Å; K5-I9 WeakPolarHBondContact O-CG1 3.34Å; K5-I9 PolarHBondContact O-N 3.47Å
6E78.8Confident76.2Confident120 Ų120122.4 Ų122.456%0.56158%0.575SS**Hα-helixtrans-61.9-46.2177-167.3174.4-168.700111.9E2 S8 I9 N10E2-E6 PolarHBondContact O-N 3.08Å; E6-S8 VanDerWaalsContact C-N 3.32Å; E6-S8 PolarHBondContact O-N 3.3Å; E6-I9 PolarHBondContact O-N 2.89Å; E6-N10 WeakPolarHBondContact O-CB 3.36Å; E6-N10 VanDerWaalsContact O-CG 3.24Å; E6-N10 PolarHBondContact O-N 3.4Å; E6-N10 PolarHBondContact O-ND2 3.29Å
7A76.9Confident76.6Confident47 Ų47119.9 Ų119.939%0.38857%0.567SS.*Hα-helixtrans-58.5-42.4173.900000112.3R3 I9 N10 Q11R3-A7 VanDerWaalsContact O-CB 3.26Å; R3-A7 WeakPolarHBondContact O-CB 3.31Å; R3-A7 PolarHBondContact O-N 3.19Å; A7-I9 VanDerWaalsContact C-N 3.34Å; A7-I9 PolarHBondContact O-N 3.48Å; A7-N10 PolarHBondContact O-N 3.22Å; A7-Q11 WeakPolarHBondContact O-CB 3.4Å; A7-Q11 WeakPolarHBondContact O-CG 3.39Å; A7-Q11 PolarHBondContact O-N 3.21Å
8S78.5Confident76.9Confident37 Ų37116 Ų11626%0.25955%0.548SS..Hα-helixtrans-67.5-32.5178.1790000113.3F4 K5 E6 R12F4-S8 WeakPolarHBondContact O-CB 3.45Å; F4-S8 PolarHBondContact O-N 2.85Å; F4-S8 PolarHBondContact O-OG 3.47Å; K5-S8 PolarHBondContact O-N 2.93Å; K5-S8 PolarHBondContact O-OG 2.81Å; E6-S8 VanDerWaalsContact C-N 3.32Å; E6-S8 PolarHBondContact O-N 3.3Å; S8-R12 WeakPolarHBondContact O-CG 3.46Å; S8-R12 PolarHBondContact O-N 2.96Å; S8-R12 VanDerWaalsContact O-N 3.15Å
9I77.3Confident77.4Confident72 Ų72114.5 Ų114.537%0.36954%0.544SS..Hα-helixtrans-71.7-46176-70.1164.8000109.4K5 E6 A7 Q11 R12 Q13K5-I9 HydrophobicContact CG-CD1 4.06Å; K5-I9 VanDerWaalsContact O-CG1 3.27Å; K5-I9 WeakPolarHBondContact O-CG1 3.34Å; K5-I9 PolarHBondContact O-N 3.47Å; E6-I9 PolarHBondContact O-N 2.89Å; A7-I9 VanDerWaalsContact C-N 3.34Å; A7-I9 PolarHBondContact O-N 3.48Å; I9-Q11 VanDerWaalsContact C-N 3.34Å; I9-Q11 PolarHBondContact O-N 2.79Å; I9-R12 PolarHBondContact O-N 2.96Å; I9-Q13 HydrophobicContact CG2-CG 4.47Å; I9-Q13 WeakPolarHBondContact O-CG 3.26Å; I9-Q13 PolarHBondContact O-N 2.92Å
10N76.5Confident77.9Confident83 Ų83115.5 Ų115.544%0.44455%0.546SS..Hα-helixtrans-61.2-42.2178-68.3-16.8000111.4E6 A7 Q13 Y14E6-N10 WeakPolarHBondContact O-CB 3.36Å; E6-N10 VanDerWaalsContact O-CG 3.24Å; E6-N10 PolarHBondContact O-N 3.4Å; E6-N10 PolarHBondContact O-ND2 3.29Å; A7-N10 PolarHBondContact O-N 3.22Å; N10-Q13 PolarHBondContact O-N 3.44Å; N10-Y14 VanDerWaalsContact O-CB 3.3Å; N10-Y14 WeakPolarHBondContact O-CB 3.43Å; N10-Y14 PolarHBondContact O-N 2.79Å
11Q72.2Confident78.5Confident144 Ų144110.8 Ų110.867%0.67352%0.523SS*.Hα-helixtrans-63.1-41.4174.7-77.4-173.6-28.400112.6A7 I9 Y14 S15A7-Q11 WeakPolarHBondContact O-CB 3.4Å; A7-Q11 WeakPolarHBondContact O-CG 3.39Å; A7-Q11 PolarHBondContact O-N 3.21Å; I9-Q11 VanDerWaalsContact C-N 3.34Å; I9-Q11 PolarHBondContact O-N 2.79Å; Q11-Y14 PolarHBondContact O-N 3.2Å; Q11-S15 WeakPolarHBondContact O-CB 3.3Å; Q11-S15 PolarHBondContact O-N 3.25Å
12R69.1Low79.2Confident167 Ų167102 Ų10263%0.6348%0.482SS*.Hα-helixtrans-65.9-43.8175.5-80.2-174.1-123.6-177.1-2.6112.4S8 I9 Y14 S15 N16S8-R12 WeakPolarHBondContact O-CG 3.46Å; S8-R12 PolarHBondContact O-N 2.96Å; S8-R12 VanDerWaalsContact O-N 3.15Å; I9-R12 PolarHBondContact O-N 2.96Å; R12-Y14 VanDerWaalsContact C-N 3.3Å; R12-Y14 PolarHBondContact O-N 2.88Å; R12-S15 PolarHBondContact O-N 2.61Å; R12-N16 WeakPolarHBondContact O-CB 3.5Å; R12-N16 PolarHBondContact O-N 3.19Å
13Q71.4Confident79.8Confident110 Ų11099.5 Ų99.551%0.51447%0.473SS..Hα-helixtrans-61.3-42.5176.4-76.2-177.7-32.700111.1I9 N10 N16 N17I9-Q13 HydrophobicContact CG2-CG 4.47Å; I9-Q13 WeakPolarHBondContact O-CG 3.26Å; I9-Q13 PolarHBondContact O-N 2.92Å; N10-Q13 PolarHBondContact O-N 3.44Å; Q13-N16 PolarHBondContact O-N 3.44Å; Q13-N17 WeakPolarHBondContact O-CB 3.33Å; Q13-N17 PolarHBondContact O-N 2.93Å; Q13-N17 PolarHBondContact O-ND2 3.36Å; Q13-N17 PolarHBondContact O-OD1 2.91Å
14Y71.9Confident80.3Confident122 Ų12291.7 Ų91.748%0.47845%0.448SS..Hα-helixtrans-60.1-51.6176.4-169-113.1000112N10 Q11 R12 N16 N17 E18 R203N10-Y14 VanDerWaalsContact O-CB 3.3Å; N10-Y14 WeakPolarHBondContact O-CB 3.43Å; N10-Y14 PolarHBondContact O-N 2.79Å; Q11-Y14 PolarHBondContact O-N 3.2Å; R12-Y14 VanDerWaalsContact C-N 3.3Å; R12-Y14 PolarHBondContact O-N 2.88Å; Y14-N16 VanDerWaalsContact C-N 3.34Å; Y14-N16 PolarHBondContact O-N 3.37Å; Y14-N17 PolarHBondContact O-N 3.37Å; Y14-E18 WeakPolarHBondContact CD1-OE1 3.26Å; Y14-E18 WeakPolarHBondContact CE1-OE1 3.39Å; Y14-E18 WeakPolarHBondContact O-CG 3.25Å; Y14-E18 PolarHBondContact O-N 3.3Å; Y14-R203 PolarHBondContact OH-NH2 3.14Å
15S74.4Confident81Confident51 Ų5183.7 Ų83.736%0.35741%0.412SS..Hα-helixtrans-61.3-39.5177.4-179.90000112.8Q11 R12 E18 N19Q11-S15 WeakPolarHBondContact O-CB 3.3Å; Q11-S15 PolarHBondContact O-N 3.25Å; R12-S15 PolarHBondContact O-N 2.61Å; S15-E18 PolarHBondContact O-N 3.49Å; S15-N19 PolarHBondContact O-N 3.19Å; S15-N19 PolarHBondContact O-ND2 2.95Å
16N79.7Confident81.7Confident100 Ų10078.8 Ų78.854%0.53539%0.393SS..Hα-helixtrans-63.8-42.1176.4-76.4-9000111.9R12 Q13 Y14 E18 N19 F20R12-N16 WeakPolarHBondContact O-CB 3.5Å; R12-N16 PolarHBondContact O-N 3.19Å; Q13-N16 PolarHBondContact O-N 3.44Å; Y14-N16 VanDerWaalsContact C-N 3.34Å; Y14-N16 PolarHBondContact O-N 3.37Å; N16-E18 VanDerWaalsContact C-N 3.32Å; N16-E18 PolarHBondContact O-N 2.7Å; N16-N19 PolarHBondContact O-N 3.38Å; N16-F20 WeakPolarHBondContact O-CB 3.26Å; N16-F20 PolarHBondContact O-N 3.07Å
17N82.7Confident82.5Confident80 Ų8075 Ų7543%0.42839%0.387SS..Hα-helixtrans-68.2-34.6179.5-63.3-15.6000111.6Q13 Y14 F21Q13-N17 WeakPolarHBondContact O-CB 3.33Å; Q13-N17 PolarHBondContact O-N 2.93Å; Q13-N17 PolarHBondContact O-ND2 3.36Å; Q13-N17 PolarHBondContact O-OD1 2.91Å; Y14-N17 PolarHBondContact O-N 3.37Å; N17-F21 WeakPolarHBondContact O-CB 3.49Å; N17-F21 PolarHBondContact O-N 3.35Å
18E83.1Confident83.3Confident49 Ų4975 Ų7523%0.22938%0.379CS..Hα-helixtrans-63.4-49.1172.3-71.3177.8174.400112Y14 S15 N16 F20 F21 T22 R203Y14-E18 WeakPolarHBondContact CD1-OE1 3.26Å; Y14-E18 WeakPolarHBondContact CE1-OE1 3.39Å; Y14-E18 WeakPolarHBondContact O-CG 3.25Å; Y14-E18 PolarHBondContact O-N 3.3Å; S15-E18 PolarHBondContact O-N 3.49Å; N16-E18 VanDerWaalsContact C-N 3.32Å; N16-E18 PolarHBondContact O-N 2.7Å; E18-F20 VanDerWaalsContact C-N 3.28Å; E18-F20 PolarHBondContact O-N 3.07Å; E18-F21 WeakPolarHBondContact O-CB 3.41Å; E18-F21 PolarHBondContact O-N 2.86Å; E18-T22 PolarHBondContact O-N 3.42Å; E18-T22 PolarHBondContact O-OG1 3.2Å; E18-T22 VanDerWaalsContact O-OG1 3.07Å; E18-R203 IonicContact OE1-CZ 3.19Å; E18-R203 IonicContact OE1-NH1 3.15Å; E18-R203 PolarHBondContact OE1-NH1 2.6Å; E18-R203 IonicContact OE1-NH2 2.67Å; E18-R203 PolarHBondContact OE1-NH2 2.89Å; E18-R203 VanDerWaalsContact OE1-NH2 3.16Å; E18-R203 IonicContact OE2-NH1 2.86Å
19N85.5Confident84.1Confident87 Ų8773.2 Ų73.247%0.46537%0.367SS..Hα-helixtrans-59.7-42177.9-69.7-24.7000111.4S15 N16 T22 L23S15-N19 PolarHBondContact O-N 3.19Å; S15-N19 PolarHBondContact O-ND2 2.95Å; N16-N19 PolarHBondContact O-N 3.38Å; N19-T22 PolarHBondContact O-N 3.29Å; N19-L23 WeakPolarHBondContact O-CB 3.46Å; N19-L23 VanDerWaalsContact O-CG 3.24Å; N19-L23 WeakPolarHBondContact O-CG 3.34Å; N19-L23 PolarHBondContact O-N 3.49Å
20F88.1Confident84.9Confident135 Ų13573.4 Ų73.459%0.59237%0.371SS*.Hα-helixtrans-63.3-43.9177-173.5-107.8000112.1N16 E18 N24N16-F20 WeakPolarHBondContact O-CB 3.26Å; N16-F20 PolarHBondContact O-N 3.07Å; E18-F20 VanDerWaalsContact C-N 3.28Å; E18-F20 PolarHBondContact O-N 3.07Å; F20-N24 WeakPolarHBondContact CD1-ND2 3.48Å; F20-N24 WeakPolarHBondContact CE1-ND2 3.47Å; F20-N24 WeakPolarHBondContact CZ-ND2 3.45Å; F20-N24 WeakPolarHBondContact O-CB 3.33Å; F20-N24 PolarHBondContact O-N 3.47Å; F20-N24 PolarHBondContact O-ND2 3.14Å; F20-N24 VanDerWaalsContact O-ND2 3.16Å
21F89.2Confident85.9Confident16 Ų1674.6 Ų74.67%0.0738%0.377CS..Hα-helixtrans-57.6-52.1174.4168.5-95.8000111.7N17 E18 L23 N24 A25 V196 S205 Q206 L209 A212N17-F21 WeakPolarHBondContact O-CB 3.49Å; N17-F21 PolarHBondContact O-N 3.35Å; E18-F21 WeakPolarHBondContact O-CB 3.41Å; E18-F21 PolarHBondContact O-N 2.86Å; F21-L23 PolarHBondContact O-N 3.5Å; F21-N24 PolarHBondContact O-N 3.33Å; F21-A25 WeakPolarHBondContact O-CB 3.33Å; F21-A25 PolarHBondContact O-N 2.86Å; F21-V196 HydrophobicContact CE1-CG1 4.39Å; F21-S205 VanDerWaalsContact CE2-O 3.24Å; F21-S205 WeakPolarHBondContact CE2-O 3.44Å; F21-Q206 HydrophobicContact CB-CG 4.24Å; F21-Q206 HydrophobicContact CD2-CB 4.35Å; F21-Q206 HydrophobicContact CD2-CG 4.25Å; F21-Q206 HydrophobicContact CG-CG 4.39Å; F21-L209 HydrophobicContact CD2-CB 4.15Å; F21-L209 HydrophobicContact CD2-CD1 3.84Å; F21-L209 VanDerWaalsContact CE2-CA 3.49Å; F21-L209 HydrophobicContact CE2-CB 3.96Å; F21-L209 HydrophobicContact CE2-CD1 4.05Å; F21-L209 WeakPolarHBondContact O-CD1 3.42Å; F21-A212 HydrophobicContact CZ-CB 3.91Å
22T88.9Confident87Confident24 Ų2467.9 Ų67.915%0.14735%0.345CS..Hα-helixtrans-62-44.5-177.2-59.50000111.8E18 N19 N24 A25 L26 V196 F197E18-T22 PolarHBondContact O-N 3.42Å; E18-T22 PolarHBondContact O-OG1 3.2Å; E18-T22 VanDerWaalsContact O-OG1 3.07Å; N19-T22 PolarHBondContact O-N 3.29Å; T22-N24 PolarHBondContact O-N 3.44Å; T22-A25 PolarHBondContact O-N 2.86Å; T22-L26 WeakPolarHBondContact O-CB 3.22Å; T22-L26 PolarHBondContact O-N 3.19Å; T22-V196 HydrophobicContact CG2-CG1 4.41Å; T22-V196 PolarHBondContact OG1-O 3.42Å; T22-F197 HydrophobicContact CG2-CD1 3.24Å; T22-F197 HydrophobicContact CG2-CD2 4.39Å; T22-F197 HydrophobicContact CG2-CE1 3.24Å; T22-F197 HydrophobicContact CG2-CE2 4.4Å; T22-F197 HydrophobicContact CG2-CG 3.85Å; T22-F197 HydrophobicContact CG2-CZ 3.86Å
23L91.5Very high88.2Confident116 Ų11660.5 Ų60.561%0.60732%0.318SS*.Hα-helixtrans-64.5-39.8177.4-72.3171.9000112.1N19 F21 G27N19-L23 WeakPolarHBondContact O-CB 3.46Å; N19-L23 VanDerWaalsContact O-CG 3.24Å; N19-L23 WeakPolarHBondContact O-CG 3.34Å; N19-L23 PolarHBondContact O-N 3.49Å; F21-L23 PolarHBondContact O-N 3.5Å; L23-G27 PolarHBondContact O-N 3.13Å
24N93.2Very high89.4Confident53 Ų5358.1 Ų58.128%0.28332%0.317SS..Hα-helixtrans-69.1-41.7177.4-70-19.7000111.9F20 F21 T22 L26 G27 I28 L209F20-N24 WeakPolarHBondContact CD1-ND2 3.48Å; F20-N24 WeakPolarHBondContact CE1-ND2 3.47Å; F20-N24 WeakPolarHBondContact CZ-ND2 3.45Å; F20-N24 WeakPolarHBondContact O-CB 3.33Å; F20-N24 PolarHBondContact O-N 3.47Å; F20-N24 PolarHBondContact O-ND2 3.14Å; F20-N24 VanDerWaalsContact O-ND2 3.16Å; F21-N24 PolarHBondContact O-N 3.33Å; T22-N24 PolarHBondContact O-N 3.44Å; N24-L26 VanDerWaalsContact C-N 3.31Å; N24-L26 PolarHBondContact O-N 3.19Å; N24-G27 PolarHBondContact O-N 3.37Å; N24-I28 VanDerWaalsContact O-CG1 3.3Å; N24-I28 WeakPolarHBondContact O-CG1 3.38Å; N24-I28 PolarHBondContact O-N 2.84Å; N24-L209 HydrophobicContact CB-CD1 3.75Å; N24-L209 HydrophobicContact CB-CD2 4.15Å
25A92.9Very high90.5Very high0 Ų056.2 Ų56.20%031%0.314CS..Hα-helixtrans-60.8-44.717700000110.5F21 T22 T29 V196 L209F21-A25 WeakPolarHBondContact O-CB 3.33Å; F21-A25 PolarHBondContact O-N 2.86Å; T22-A25 PolarHBondContact O-N 2.86Å; A25-T29 WeakPolarHBondContact O-CB 3.25Å; A25-T29 PolarHBondContact O-N 2.88Å; A25-T29 PolarHBondContact O-OG1 3.47Å; A25-V196 HydrophobicContact CB-CG1 4.25Å; A25-L209 HydrophobicContact CB-CD1 3.89Å
26L93.5Very high91.5Very high41 Ų4153.8 Ų53.822%0.21530%0.297CS..Hα-helixtrans-63.3-44.7174.7-177.263.8000111.7T22 N24 I28 T29 V30 F125 I129 F197T22-L26 WeakPolarHBondContact O-CB 3.22Å; T22-L26 PolarHBondContact O-N 3.19Å; N24-L26 VanDerWaalsContact C-N 3.31Å; N24-L26 PolarHBondContact O-N 3.19Å; L26-I28 PolarHBondContact O-N 3.06Å; L26-T29 WeakPolarHBondContact O-CB 3.37Å; L26-T29 PolarHBondContact O-N 3.47Å; L26-V30 HydrophobicContact CD1-CG2 4.08Å; L26-V30 HydrophobicContact CG-CG2 4.26Å; L26-V30 WeakPolarHBondContact O-CB 3.39Å; L26-V30 VanDerWaalsContact O-CG2 3.3Å; L26-V30 WeakPolarHBondContact O-CG2 3.45Å; L26-V30 PolarHBondContact O-N 2.97Å; L26-F125 HydrophobicContact CD1-CE1 3.9Å; L26-F125 HydrophobicContact CD1-CZ 4.46Å; L26-I129 HydrophobicContact CD1-CD1 3.91Å; L26-F197 HydrophobicContact CB-CZ 4.24Å; L26-F197 HydrophobicContact CD1-CZ 4.21Å; L26-F197 HydrophobicContact CD2-CZ 4.3Å; L26-F197 HydrophobicContact CG-CZ 4.49Å
27G95.1Very high92.2Very high42 Ų4251.9 Ų51.943%0.43328%0.284SS..Hα-helixtrans-59.4-43.9178.800000112.8L23 N24 L31L23-G27 PolarHBondContact O-N 3.13Å; N24-G27 PolarHBondContact O-N 3.37Å; G27-L31 WeakPolarHBondContact O-CB 3.01Å; G27-L31 PolarHBondContact O-N 3.4Å
28I94.6Very high92.8Very high46 Ų4649.5 Ų49.524%0.23628%0.279CS..Hα-helixtrans-63.2-46.3174.3-64.4164.7000110.1N24 L26 V30 L31 Q32 L91 L209 A213N24-I28 VanDerWaalsContact O-CG1 3.3Å; N24-I28 WeakPolarHBondContact O-CG1 3.38Å; N24-I28 PolarHBondContact O-N 2.84Å; L26-I28 PolarHBondContact O-N 3.06Å; I28-V30 PolarHBondContact O-N 3.21Å; I28-L31 WeakPolarHBondContact O-CB 3.37Å; I28-L31 PolarHBondContact O-N 3.21Å; I28-Q32 WeakPolarHBondContact O-CG 3.34Å; I28-Q32 PolarHBondContact O-N 3.43Å; I28-L91 HydrophobicContact CG2-CD1 3.62Å; I28-L91 HydrophobicContact CG2-CD2 4.26Å; I28-L209 HydrophobicContact CD1-CD2 4.4Å; I28-L209 HydrophobicContact CD1-CG 4.2Å; I28-A213 HydrophobicContact CB-CB 3.73Å; I28-A213 HydrophobicContact CD1-CB 4.3Å; I28-A213 HydrophobicContact CG2-CB 3.58Å
29T95Very high93.3Very high0 Ų047.9 Ų47.90%028%0.275CS..Hα-helixtrans-60.3-46-179.7-560000111.7A25 L26 L31 Q32 F33 F125 A213 L216A25-T29 WeakPolarHBondContact O-CB 3.25Å; A25-T29 PolarHBondContact O-N 2.88Å; A25-T29 PolarHBondContact O-OG1 3.47Å; L26-T29 WeakPolarHBondContact O-CB 3.37Å; L26-T29 PolarHBondContact O-N 3.47Å; T29-L31 VanDerWaalsContact C-N 3.32Å; T29-L31 PolarHBondContact O-N 2.92Å; T29-Q32 WeakPolarHBondContact O-CB 3.46Å; T29-Q32 PolarHBondContact O-N 3.26Å; T29-Q32 VanDerWaalsContact O-N 3.13Å; T29-F33 HydrophobicContact CG2-CD1 4.22Å; T29-F33 HydrophobicContact CG2-CE1 3.44Å; T29-F33 VanDerWaalsContact CG2-CE1 3.44Å; T29-F33 HydrophobicContact CG2-CE2 4.38Å; T29-F33 HydrophobicContact CG2-CZ 3.53Å; T29-F33 WeakPolarHBondContact O-CD1 3.47Å; T29-F33 PolarHBondContact O-N 2.89Å; T29-F125 HydrophobicContact CG2-CZ 4.13Å; T29-A213 WeakPolarHBondContact OG1-CA 3.33Å; T29-A213 PolarHBondContact OG1-O 3.4Å; T29-L216 HydrophobicContact CG2-CB 3.92Å
30V95Very high93.7Very high75 Ų7543.8 Ų43.846%0.45525%0.253SS..Hα-helixtrans-64.2-37.7177.9170.50000111.3L26 I28 Q32 F33 A34L26-V30 HydrophobicContact CD1-CG2 4.08Å; L26-V30 HydrophobicContact CG-CG2 4.26Å; L26-V30 WeakPolarHBondContact O-CB 3.39Å; L26-V30 VanDerWaalsContact O-CG2 3.3Å; L26-V30 WeakPolarHBondContact O-CG2 3.45Å; L26-V30 PolarHBondContact O-N 2.97Å; I28-V30 PolarHBondContact O-N 3.21Å; V30-Q32 VanDerWaalsContact C-N 3.32Å; V30-Q32 PolarHBondContact O-N 2.76Å; V30-F33 WeakPolarHBondContact O-CB 3.37Å; V30-F33 PolarHBondContact O-N 3.05Å; V30-A34 PolarHBondContact O-N 2.93Å
31L96.2Very high93.9Very high108 Ų10842 Ų4257%0.56524%0.243SC*.Hα-helixtrans-61.4-42.5173.1-177.965000111.1G27 I28 T29 F33 A34 I35G27-L31 WeakPolarHBondContact O-CB 3.01Å; G27-L31 PolarHBondContact O-N 3.4Å; I28-L31 WeakPolarHBondContact O-CB 3.37Å; I28-L31 PolarHBondContact O-N 3.21Å; T29-L31 VanDerWaalsContact C-N 3.32Å; T29-L31 PolarHBondContact O-N 2.92Å; L31-F33 VanDerWaalsContact C-N 3.33Å; L31-F33 PolarHBondContact O-N 3.42Å; L31-A34 PolarHBondContact O-N 3.35Å; L31-I35 HydrophobicContact CG-CD1 4.13Å; L31-I35 WeakPolarHBondContact O-CG1 3.2Å; L31-I35 PolarHBondContact O-N 2.8Å
32Q95.6Very high94Very high3 Ų346.2 Ų46.21%0.01427%0.266CS..Hα-helixtrans-64.3-36.6175.2-63.3176.4-69.800111.9I28 T29 V30 I35 T36 L91 T95 Y217I28-Q32 WeakPolarHBondContact O-CG 3.34Å; I28-Q32 PolarHBondContact O-N 3.43Å; T29-Q32 WeakPolarHBondContact O-CB 3.46Å; T29-Q32 PolarHBondContact O-N 3.26Å; T29-Q32 VanDerWaalsContact O-N 3.13Å; V30-Q32 VanDerWaalsContact C-N 3.32Å; V30-Q32 PolarHBondContact O-N 2.76Å; Q32-I35 PolarHBondContact O-N 2.93Å; Q32-T36 WeakPolarHBondContact O-CB 3.46Å; Q32-T36 PolarHBondContact O-N 3.01Å; Q32-T36 PolarHBondContact O-OG1 2.9Å; Q32-L91 HydrophobicContact CG-CD2 4.33Å; Q32-T95 HydrophobicContact CB-CG2 4.36Å; Q32-T95 HydrophobicContact CG-CG2 4.39Å; Q32-T95 WeakPolarHBondContact CG-OG1 3.15Å; Q32-T95 PolarHBondContact NE2-OG1 3.46Å; Q32-Y217 HydrophobicContact CB-CD2 3.32Å; Q32-Y217 HydrophobicContact CB-CE2 3.62Å; Q32-Y217 HydrophobicContact CB-CG 3.91Å; Q32-Y217 HydrophobicContact CG-CD2 4.33Å; Q32-Y217 HydrophobicContact CG-CG 4.49Å; Q32-Y217 VanDerWaalsContact OE1-CB 3.25Å
33F94.4Very high94Very high13 Ų1347.4 Ų47.46%0.05727%0.269CS..Hα-helixtrans-60.7-47.5173.3-66.50.8000111.1T29 V30 L31 I35 T36 F37 V122 F125 Y217 W220T29-F33 HydrophobicContact CG2-CD1 4.22Å; T29-F33 HydrophobicContact CG2-CE1 3.44Å; T29-F33 VanDerWaalsContact CG2-CE1 3.44Å; T29-F33 HydrophobicContact CG2-CE2 4.38Å; T29-F33 HydrophobicContact CG2-CZ 3.53Å; T29-F33 WeakPolarHBondContact O-CD1 3.47Å; T29-F33 PolarHBondContact O-N 2.89Å; V30-F33 WeakPolarHBondContact O-CB 3.37Å; V30-F33 PolarHBondContact O-N 3.05Å; L31-F33 VanDerWaalsContact C-N 3.33Å; L31-F33 PolarHBondContact O-N 3.42Å; F33-I35 PolarHBondContact O-N 3.05Å; F33-T36 PolarHBondContact O-N 3.33Å; F33-F37 WeakPolarHBondContact O-CB 3.24Å; F33-F37 PolarHBondContact O-N 2.99Å; F33-V122 HydrophobicContact CD2-CG2 4.49Å; F33-F125 AromaticContact CE2-CD1 3.8Å; F33-F125 HydrophobicContact CE2-CD1 3.8Å; F33-F125 HydrophobicContact CE2-CD2 4.45Å; F33-F125 AromaticContact CE2-CE1 3.93Å; F33-F125 HydrophobicContact CE2-CE1 3.93Å; F33-F125 HydrophobicContact CE2-CG 4.07Å; F33-F125 HydrophobicContact CE2-CZ 4.36Å; F33-F125 HydrophobicContact CZ-CD1 4.14Å; F33-F125 HydrophobicContact CZ-CD2 4.08Å; F33-F125 HydrophobicContact CZ-CE1 4.02Å; F33-F125 AromaticContact CZ-CE2 4Å; F33-F125 HydrophobicContact CZ-CE2 4Å; F33-F125 HydrophobicContact CZ-CG 4.16Å; F33-F125 AromaticContact CZ-CZ 3.97Å; F33-F125 HydrophobicContact CZ-CZ 3.97Å; F33-Y217 AromaticContact CD1-CD2 3.85Å; F33-Y217 HydrophobicContact CD1-CD2 3.85Å; F33-Y217 HydrophobicContact CD1-CE2 4.27Å; F33-Y217 AromaticContact CE1-CD2 4Å; F33-Y217 HydrophobicContact CE1-CD2 4Å; F33-W220 HydrophobicContact CD1-CB 4.45Å; F33-W220 AromaticContact CD1-CD2 3.42Å; F33-W220 HydrophobicContact CD1-CD2 3.42Å; F33-W220 VanDerWaalsContact CD1-CD2 3.42Å; F33-W220 AromaticContact CD1-CE3 3.27Å; F33-W220 HydrophobicContact CD1-CE3 3.27Å; F33-W220 AromaticContact CD1-CG 3.94Å; F33-W220 HydrophobicContact CD1-CG 3.94Å; F33-W220 HydrophobicContact CD1-CH2 4.38Å; F33-W220 HydrophobicContact CD1-CZ2 4.5Å; F33-W220 AromaticContact CD1-CZ3 3.79Å; F33-W220 HydrophobicContact CD1-CZ3 3.79Å; F33-W220 HydrophobicContact CD2-CD2 4.28Å; F33-W220 HydrophobicContact CD2-CG 4.41Å; F33-W220 HydrophobicContact CE1-CB 3.37Å; F33-W220 AromaticContact CE1-CD2 3.21Å; F33-W220 HydrophobicContact CE1-CD2 3.21Å; F33-W220 AromaticContact CE1-CE3 3.34Å; F33-W220 HydrophobicContact CE1-CE3 3.34Å; F33-W220 AromaticContact CE1-CG 3.23Å; F33-W220 HydrophobicContact CE1-CG 3.23Å; F33-W220 HydrophobicContact CE1-CZ3 4.3Å; F33-W220 HydrophobicContact CE2-CB 4.31Å; F33-W220 AromaticContact CE2-CD1 3.78Å; F33-W220 HydrophobicContact CE2-CD2 4.1Å; F33-W220 AromaticContact CE2-CG 3.77Å; F33-W220 HydrophobicContact CE2-CG 3.77Å; F33-W220 AromaticContact CG-CD2 3.98Å; F33-W220 HydrophobicContact CG-CD2 3.98Å; F33-W220 HydrophobicContact CG-CE3 4.12Å; F33-W220 HydrophobicContact CG-CG 4.49Å; F33-W220 HydrophobicContact CG-CZ2 4.46Å; F33-W220 HydrophobicContact CG-CZ3 4.4Å; F33-W220 HydrophobicContact CZ-CB 3.28Å; F33-W220 AromaticContact CZ-CD1 3.59Å; F33-W220 AromaticContact CZ-CD2 3.6Å; F33-W220 HydrophobicContact CZ-CD2 3.6Å; F33-W220 HydrophobicContact CZ-CE3 4.2Å; F33-W220 AromaticContact CZ-CG 3.13Å; F33-W220 HydrophobicContact CZ-CG 3.13Å
34A95.9Very high93.9Very high59 Ų5941.9 Ų41.949%0.48824%0.241SC..Hα-helixtrans-61.7-43.8-179.600000111.9V30 L31 F37 G38V30-A34 PolarHBondContact O-N 2.93Å; L31-A34 PolarHBondContact O-N 3.35Å; A34-F37 PolarHBondContact O-N 2.99Å; A34-G38 PolarHBondContact O-N 3.33Å
35I96.1Very high93.7Very high83 Ų8343.3 Ų43.343%0.42625%0.248SC..Hα-helixtrans-62-45.4175.7-66.7165.8000110.5L31 Q32 F33 G38 G39 T95L31-I35 HydrophobicContact CG-CD1 4.13Å; L31-I35 WeakPolarHBondContact O-CG1 3.2Å; L31-I35 PolarHBondContact O-N 2.8Å; Q32-I35 PolarHBondContact O-N 2.93Å; F33-I35 PolarHBondContact O-N 3.05Å; I35-G38 PolarHBondContact O-N 3.1Å; I35-G39 PolarHBondContact O-N 3.38Å; I35-T95 HydrophobicContact CB-CG2 4.04Å; I35-T95 HydrophobicContact CD1-CG2 4.3Å; I35-T95 HydrophobicContact CG2-CG2 3.69Å
36T95.7Very high93.6Very high0 Ų046.2 Ų46.20%027%0.265CS..Hα-helixtrans-64.4-44.6-178.6-52.10000111.2Q32 F33 T40 T99 I102 Y217 W220Q32-T36 WeakPolarHBondContact O-CB 3.46Å; Q32-T36 PolarHBondContact O-N 3.01Å; Q32-T36 PolarHBondContact O-OG1 2.9Å; F33-T36 PolarHBondContact O-N 3.33Å; T36-T40 WeakPolarHBondContact O-CB 3.19Å; T36-T40 PolarHBondContact O-N 3.29Å; T36-T40 PolarHBondContact O-OG1 2.86Å; T36-T99 WeakPolarHBondContact CA-OG1 3.41Å; T36-I102 HydrophobicContact CG2-CG2 3.64Å; T36-Y217 VanDerWaalsContact OG1-CE2 3.3Å; T36-Y217 WeakPolarHBondContact OG1-CE2 3.39Å; T36-Y217 PolarHBondContact OG1-OH 3.05Å; T36-W220 HydrophobicContact CG2-CH2 4.12Å; T36-W220 HydrophobicContact CG2-CZ3 4.05Å
37F94.4Very high93.1Very high59 Ų5949 Ų4926%0.25928%0.277SS..Hα-helixtrans-63.5-51.2177-174.8-115.6000111.7F33 A34 G39 T40 Y41 T115 F118F33-F37 WeakPolarHBondContact O-CB 3.24Å; F33-F37 PolarHBondContact O-N 2.99Å; A34-F37 PolarHBondContact O-N 2.99Å; F37-G39 VanDerWaalsContact C-N 3.34Å; F37-G39 PolarHBondContact O-N 2.84Å; F37-T40 PolarHBondContact O-N 3.38Å; F37-Y41 VanDerWaalsContact O-CB 3.27Å; F37-Y41 WeakPolarHBondContact O-CB 3.3Å; F37-Y41 PolarHBondContact O-N 3.11Å; F37-T115 HydrophobicContact CZ-CG2 4.43Å; F37-F118 HydrophobicContact CB-CD2 4.11Å; F37-F118 HydrophobicContact CB-CE1 4.1Å; F37-F118 HydrophobicContact CB-CE2 3.47Å; F37-F118 VanDerWaalsContact CB-CE2 3.47Å; F37-F118 HydrophobicContact CB-CZ 3.48Å; F37-F118 VanDerWaalsContact CB-CZ 3.48Å; F37-F118 HydrophobicContact CD1-CE1 4.34Å; F37-F118 HydrophobicContact CD2-CB 4.02Å; F37-F118 AromaticContact CD2-CD1 3.44Å; F37-F118 HydrophobicContact CD2-CD1 3.44Å; F37-F118 VanDerWaalsContact CD2-CD1 3.44Å; F37-F118 AromaticContact CD2-CD2 3.46Å; F37-F118 HydrophobicContact CD2-CD2 3.46Å; F37-F118 VanDerWaalsContact CD2-CD2 3.46Å; F37-F118 AromaticContact CD2-CE1 3.68Å; F37-F118 HydrophobicContact CD2-CE1 3.68Å; F37-F118 AromaticContact CD2-CE2 3.7Å; F37-F118 HydrophobicContact CD2-CE2 3.7Å; F37-F118 AromaticContact CD2-CG 3.33Å; F37-F118 HydrophobicContact CD2-CG 3.33Å; F37-F118 AromaticContact CD2-CZ 3.82Å; F37-F118 HydrophobicContact CD2-CZ 3.82Å; F37-F118 HydrophobicContact CE2-CB 4.01Å; F37-F118 AromaticContact CE2-CD1 3.64Å; F37-F118 HydrophobicContact CE2-CD1 3.64Å; F37-F118 HydrophobicContact CE2-CD2 4.29Å; F37-F118 HydrophobicContact CE2-CE1 4.2Å; F37-F118 AromaticContact CE2-CG 3.71Å; F37-F118 HydrophobicContact CE2-CG 3.71Å; F37-F118 HydrophobicContact CG-CD1 4.02Å; F37-F118 HydrophobicContact CG-CD2 4.12Å; F37-F118 AromaticContact CG-CE1 3.76Å; F37-F118 HydrophobicContact CG-CE1 3.76Å; F37-F118 AromaticContact CG-CE2 3.85Å; F37-F118 HydrophobicContact CG-CE2 3.85Å; F37-F118 HydrophobicContact CG-CG 4.21Å; F37-F118 AromaticContact CG-CZ 3.69Å; F37-F118 HydrophobicContact CG-CZ 3.69Å; F37-F118 HydrophobicContact CZ-CD1 4.38Å
38G94.8Very high92.7Very high31 Ų3155.5 Ų55.532%0.3229%0.294SS..Hα-helixtrans-59.3-45179.200000111.9A34 I35 Y41 L42A34-G38 PolarHBondContact O-N 3.33Å; I35-G38 PolarHBondContact O-N 3.1Å; G38-Y41 PolarHBondContact O-N 3.14Å; G38-L42 WeakPolarHBondContact O-CB 3.47Å; G38-L42 VanDerWaalsContact O-CG 3.28Å; G38-L42 WeakPolarHBondContact O-CG 3.49Å; G38-L42 PolarHBondContact O-N 2.97Å
39G93.8Very high92.3Very high14 Ų1456.1 Ų56.114%0.14430%0.297CS..Hα-helixtrans-64.2-44.3176.600000113I35 F37 Y41 L42 F43I35-G39 PolarHBondContact O-N 3.38Å; F37-G39 VanDerWaalsContact C-N 3.34Å; F37-G39 PolarHBondContact O-N 2.84Å; G39-Y41 PolarHBondContact O-N 3.37Å; G39-L42 PolarHBondContact O-N 3.45Å; G39-F43 WeakPolarHBondContact O-CD2 3.26Å; G39-F43 PolarHBondContact O-N 3.46Å; G39-F43 VanDerWaalsContact O-N 3.13Å
40T93.7Very high91.8Very high2 Ų256.1 Ų56.11%0.01230%0.297CS..Hα-helixtrans-61.1-45.8176.3-59.80000111.3T36 F37 L42 F43 I44 A106 V114T36-T40 WeakPolarHBondContact O-CB 3.19Å; T36-T40 PolarHBondContact O-N 3.29Å; T36-T40 PolarHBondContact O-OG1 2.86Å; F37-T40 PolarHBondContact O-N 3.38Å; T40-L42 PolarHBondContact O-N 3.43Å; T40-F43 PolarHBondContact O-N 2.87Å; T40-I44 HydrophobicContact CG2-CD1 3.94Å; T40-I44 WeakPolarHBondContact O-CG1 3.45Å; T40-I44 PolarHBondContact O-N 3.41Å; T40-I44 VanDerWaalsContact O-N 3.11Å; T40-A106 HydrophobicContact CG2-CB 3.56Å; T40-V114 HydrophobicContact CG2-CG1 3.94Å
41Y92.2Very high91.3Very high96 Ų9656.1 Ų56.138%0.37629%0.294SS..Hα-helixtrans-64.7-40.4180-165.1-114.1000112F37 G38 G39 F43 I44 L45F37-Y41 VanDerWaalsContact O-CB 3.27Å; F37-Y41 WeakPolarHBondContact O-CB 3.3Å; F37-Y41 PolarHBondContact O-N 3.11Å; G38-Y41 PolarHBondContact O-N 3.14Å; G39-Y41 PolarHBondContact O-N 3.37Å; Y41-F43 VanDerWaalsContact C-N 3.35Å; Y41-F43 PolarHBondContact O-N 3.49Å; Y41-I44 PolarHBondContact O-N 3.49Å; Y41-L45 HydrophobicContact CD1-CD1 3.58Å; Y41-L45 HydrophobicContact CD1-CG 4.14Å; Y41-L45 HydrophobicContact CE1-CD1 3.15Å; Y41-L45 HydrophobicContact CE1-CD2 4.46Å; Y41-L45 HydrophobicContact CE1-CG 3.88Å; Y41-L45 HydrophobicContact CE2-CD1 4.42Å; Y41-L45 HydrophobicContact CE2-CD2 4.43Å; Y41-L45 HydrophobicContact CE2-CG 4.3Å; Y41-L45 HydrophobicContact CG-CD1 4.39Å; Y41-L45 HydrophobicContact CG-CG 4.48Å; Y41-L45 WeakPolarHBondContact O-CB 3.49Å; Y41-L45 WeakPolarHBondContact O-CG 3.45Å; Y41-L45 PolarHBondContact O-N 3.47Å
42L91.7Very high90.8Very high105 Ų10557.1 Ų57.155%0.5529%0.29SS..Hα-helixtrans-60.1-41.7173.6-76.1172.3000112.6G38 G39 T40 I44 V46G38-L42 WeakPolarHBondContact O-CB 3.47Å; G38-L42 VanDerWaalsContact O-CG 3.28Å; G38-L42 WeakPolarHBondContact O-CG 3.49Å; G38-L42 PolarHBondContact O-N 2.97Å; G39-L42 PolarHBondContact O-N 3.45Å; T40-L42 PolarHBondContact O-N 3.43Å; L42-I44 VanDerWaalsContact C-N 3.3Å; L42-I44 PolarHBondContact O-N 3.44Å; L42-V46 WeakPolarHBondContact O-CB 3.19Å; L42-V46 VanDerWaalsContact O-CG2 3.27Å; L42-V46 WeakPolarHBondContact O-CG2 2.95Å; L42-V46 PolarHBondContact O-N 3.46Å
43F89.4Confident90.3Very high49 Ų4957.3 Ų57.322%0.21529%0.292CS..Hα-helixtrans-68.5-32.2179.9-83.6-139.9000112.3G39 T40 Y41 I49 M53 A103 T107G39-F43 WeakPolarHBondContact O-CD2 3.26Å; G39-F43 PolarHBondContact O-N 3.46Å; G39-F43 VanDerWaalsContact O-N 3.13Å; T40-F43 PolarHBondContact O-N 2.87Å; Y41-F43 VanDerWaalsContact C-N 3.35Å; Y41-F43 PolarHBondContact O-N 3.49Å; F43-I49 HydrophobicContact CB-CG2 4.31Å; F43-I49 HydrophobicContact CD1-CG2 3.98Å; F43-I49 HydrophobicContact CD2-CG2 4.26Å; F43-I49 HydrophobicContact CE1-CG2 4.41Å; F43-I49 HydrophobicContact CG-CG2 3.91Å; F43-M53 HydrophobicContact CD1-CE 4.21Å; F43-M53 HydrophobicContact CD1-CG 4.42Å; F43-M53 HydrophobicContact CE1-CE 3.66Å; F43-A103 HydrophobicContact CB-CB 3.96Å; F43-A103 HydrophobicContact CD1-CB 3.54Å; F43-A103 HydrophobicContact CD2-CB 4.41Å; F43-A103 HydrophobicContact CE1-CB 4.05Å; F43-A103 HydrophobicContact CG-CB 3.73Å; F43-T107 HydrophobicContact CB-CG2 4.32Å
44I89.2Confident89.7Confident1 Ų159 Ų591%0.00530%0.299CS..Hα-helixtrans-73-49.8176.7-67.8168.4000110.7T40 Y41 L42 A106 E111 V114T40-I44 HydrophobicContact CG2-CD1 3.94Å; T40-I44 WeakPolarHBondContact O-CG1 3.45Å; T40-I44 PolarHBondContact O-N 3.41Å; T40-I44 VanDerWaalsContact O-N 3.11Å; Y41-I44 PolarHBondContact O-N 3.49Å; L42-I44 VanDerWaalsContact C-N 3.3Å; L42-I44 PolarHBondContact O-N 3.44Å; I44-A106 HydrophobicContact CD1-CB 3.99Å; I44-A106 HydrophobicContact CG1-CB 4.45Å; I44-E111 HydrophobicContact CG2-CB 3.95Å; I44-E111 HydrophobicContact CG2-CG 3.42Å; I44-E111 VanDerWaalsContact CG2-CG 3.42Å; I44-V114 HydrophobicContact CD1-CB 3.94Å; I44-V114 HydrophobicContact CD1-CG1 3.76Å; I44-V114 HydrophobicContact CD1-CG2 3.87Å
45L88.7Confident89.1Confident83 Ų8359.9 Ų59.944%0.43530%0.301SS..Hα-helixtrans-70.2-36.4-175.3-74.4-173.9000113.7Y41 Q47Y41-L45 HydrophobicContact CD1-CD1 3.58Å; Y41-L45 HydrophobicContact CD1-CG 4.14Å; Y41-L45 HydrophobicContact CE1-CD1 3.15Å; Y41-L45 HydrophobicContact CE1-CD2 4.46Å; Y41-L45 HydrophobicContact CE1-CG 3.88Å; Y41-L45 HydrophobicContact CE2-CD1 4.42Å; Y41-L45 HydrophobicContact CE2-CD2 4.43Å; Y41-L45 HydrophobicContact CE2-CG 4.3Å; Y41-L45 HydrophobicContact CG-CD1 4.39Å; Y41-L45 HydrophobicContact CG-CG 4.48Å; Y41-L45 WeakPolarHBondContact O-CB 3.49Å; Y41-L45 WeakPolarHBondContact O-CG 3.45Å; Y41-L45 PolarHBondContact O-N 3.47Å; L45-Q47 PolarHBondContact O-N 2.88Å
46V90Very high88.6Confident61 Ų6160 Ų6037%0.3730%0.3SS..  trans-79.691.7179.3-177.30000108.4L42 K48 I49 S50L42-V46 WeakPolarHBondContact O-CB 3.19Å; L42-V46 VanDerWaalsContact O-CG2 3.27Å; L42-V46 WeakPolarHBondContact O-CG2 2.95Å; L42-V46 PolarHBondContact O-N 3.46Å; V46-K48 PolarHBondContact O-N 3.46Å; V46-I49 HydrophobicContact CB-CB 4.2Å; V46-I49 HydrophobicContact CB-CD1 3.87Å; V46-I49 HydrophobicContact CB-CG1 4.08Å; V46-I49 HydrophobicContact CG1-CB 4.16Å; V46-I49 HydrophobicContact CG1-CD1 3.72Å; V46-I49 HydrophobicContact CG1-CG1 3.65Å; V46-I49 HydrophobicContact CG2-CD1 4.35Å; V46-I49 WeakPolarHBondContact O-CA 3.49Å; V46-I49 WeakPolarHBondContact O-CB 3.21Å; V46-I49 PolarHBondContact O-N 3.06Å; V46-S50 PolarHBondContact O-N 3.22Å
47Q83.4Confident88Confident100 Ų10064.6 Ų64.647%0.46732%0.32SS..Hα-helixtrans-47.1-42.2-176.7-172.661.733.400113.1L45 I49 S50 D51L45-Q47 PolarHBondContact O-N 2.88Å; Q47-I49 VanDerWaalsContact C-N 3.33Å; Q47-I49 PolarHBondContact O-N 3.34Å; Q47-S50 WeakPolarHBondContact O-CB 3.23Å; Q47-S50 PolarHBondContact O-N 3.02Å; Q47-D51 WeakPolarHBondContact CG-OD2 3.36Å; Q47-D51 PolarHBondContact NE2-OD1 3.01Å; Q47-D51 PolarHBondContact NE2-OD2 2.92Å; Q47-D51 WeakPolarHBondContact O-CB 3.39Å; Q47-D51 PolarHBondContact O-N 3.08Å
48K86.2Confident87.6Confident178 Ų17867.8 Ų67.877%0.77434%0.339SS*.Hα-helixtrans-60.4-38.4177.4-172176.7-179179.80113.3V46 W52V46-K48 PolarHBondContact O-N 3.46Å; K48-W52 WeakPolarHBondContact O-CB 3.29Å; K48-W52 PolarHBondContact O-N 3.16Å
49I86.8Confident87.2Confident59 Ų5969.4 Ų69.430%0.30334%0.338SS..Hα-helixtrans-73.2-44176.3-63.5175.6000109.3F43 V46 Q47 D51 W52 M53F43-I49 HydrophobicContact CB-CG2 4.31Å; F43-I49 HydrophobicContact CD1-CG2 3.98Å; F43-I49 HydrophobicContact CD2-CG2 4.26Å; F43-I49 HydrophobicContact CE1-CG2 4.41Å; F43-I49 HydrophobicContact CG-CG2 3.91Å; V46-I49 HydrophobicContact CB-CB 4.2Å; V46-I49 HydrophobicContact CB-CD1 3.87Å; V46-I49 HydrophobicContact CB-CG1 4.08Å; V46-I49 HydrophobicContact CG1-CB 4.16Å; V46-I49 HydrophobicContact CG1-CD1 3.72Å; V46-I49 HydrophobicContact CG1-CG1 3.65Å; V46-I49 HydrophobicContact CG2-CD1 4.35Å; V46-I49 WeakPolarHBondContact O-CA 3.49Å; V46-I49 WeakPolarHBondContact O-CB 3.21Å; V46-I49 PolarHBondContact O-N 3.06Å; Q47-I49 VanDerWaalsContact C-N 3.33Å; Q47-I49 PolarHBondContact O-N 3.34Å; I49-D51 PolarHBondContact O-N 2.73Å; I49-W52 PolarHBondContact O-N 3.33Å; I49-M53 HydrophobicContact CG2-CG 4.41Å; I49-M53 WeakPolarHBondContact O-CG 3.34Å; I49-M53 PolarHBondContact O-N 3.14Å
50S84.7Confident87Confident0 Ų069 Ų690%033%0.332CS..Hα-helixtrans-56.5-48.3177.9-163.70000112.2V46 Q47 M53 K54V46-S50 PolarHBondContact O-N 3.22Å; Q47-S50 WeakPolarHBondContact O-CB 3.23Å; Q47-S50 PolarHBondContact O-N 3.02Å; S50-M53 PolarHBondContact O-N 3.33Å; S50-K54 WeakPolarHBondContact O-CG 3.49Å; S50-K54 PolarHBondContact O-N 3.5Å
51D85.1Confident86.7Confident74 Ų7472.8 Ų72.840%0.39635%0.346SS..Hα-helixtrans-69.3-38-179.8-67.2-25.3000111.9Q47 I49 M53 K54 S55Q47-D51 WeakPolarHBondContact CG-OD2 3.36Å; Q47-D51 PolarHBondContact NE2-OD1 3.01Å; Q47-D51 PolarHBondContact NE2-OD2 2.92Å; Q47-D51 WeakPolarHBondContact O-CB 3.39Å; Q47-D51 PolarHBondContact O-N 3.08Å; I49-D51 PolarHBondContact O-N 2.73Å; D51-M53 PolarHBondContact O-N 3.46Å; D51-K54 PolarHBondContact O-N 3.39Å; D51-S55 PolarHBondContact O-N 3.13Å; D51-S55 VanDerWaalsContact O-N 3.07Å
52W85.9Confident86.6Confident129 Ų12972.2 Ų72.249%0.48935%0.353SS..Hα-helixtrans-61-44.5173.3-174.173.9000111.5K48 I49 K54 S55 Q56 F59K48-W52 WeakPolarHBondContact O-CB 3.29Å; K48-W52 PolarHBondContact O-N 3.16Å; I49-W52 PolarHBondContact O-N 3.33Å; W52-K54 PolarHBondContact O-N 2.9Å; W52-S55 PolarHBondContact O-N 3.43Å; W52-S55 PolarHBondContact O-OG 2.98Å; W52-Q56 HydrophobicContact CD2-CG 4.28Å; W52-Q56 HydrophobicContact CZ2-CG 4.05Å; W52-Q56 WeakPolarHBondContact O-CB 3.43Å; W52-Q56 PolarHBondContact O-N 3.11Å; W52-F59 HydrophobicContact CH2-CD2 4.11Å; W52-F59 HydrophobicContact CZ3-CD2 4.1Å; W52-F59 HydrophobicContact CZ3-CE2 4.48Å; W52-F59 HydrophobicContact CZ3-CG 4.43Å
53M84.7Confident86.5Confident8 Ų867.4 Ų67.44%0.03933%0.328CS..Hα-helixtrans-63.6-41.7178.1-75-56.2171.600113.3F43 I49 S50 D51 S55 Q56 F59 T107F43-M53 HydrophobicContact CD1-CE 4.21Å; F43-M53 HydrophobicContact CD1-CG 4.42Å; F43-M53 HydrophobicContact CE1-CE 3.66Å; I49-M53 HydrophobicContact CG2-CG 4.41Å; I49-M53 WeakPolarHBondContact O-CG 3.34Å; I49-M53 PolarHBondContact O-N 3.14Å; S50-M53 PolarHBondContact O-N 3.33Å; D51-M53 PolarHBondContact O-N 3.46Å; M53-S55 VanDerWaalsContact C-N 3.26Å; M53-S55 PolarHBondContact O-N 2.93Å; M53-Q56 CarbonylContact O-C 3.5Å; M53-Q56 PolarHBondContact O-N 3.28Å; M53-F59 HydrophobicContact CE-CD1 3.45Å; M53-F59 VanDerWaalsContact CE-CD1 3.45Å; M53-F59 HydrophobicContact CE-CD2 4.17Å; M53-F59 HydrophobicContact CE-CE1 3.37Å; M53-F59 HydrophobicContact CE-CE2 4.09Å; M53-F59 HydrophobicContact CE-CG 3.85Å; M53-F59 HydrophobicContact CE-CZ 3.71Å; M53-F59 HydrophobicContact SD-CB 3.96Å; M53-F59 HydrophobicContact SD-CD1 3.25Å; M53-F59 WeakPolarHBondContact SD-CD1 3.16Å; M53-F59 HydrophobicContact SD-CD2 4.43Å; M53-F59 HydrophobicContact SD-CE1 3.81Å; M53-F59 HydrophobicContact SD-CG 3.62Å; M53-T107 HydrophobicContact CB-CG2 4.11Å; M53-T107 HydrophobicContact CG-CG2 4.42Å
54K81.3Confident86.4Confident48 Ų4865.7 Ų65.721%0.20932%0.322CS..Hα-helixtrans-62-36.3175.1-70.6170.3-171.7166.80112.2S50 D51 W52 T107 L108S50-K54 WeakPolarHBondContact O-CG 3.49Å; S50-K54 PolarHBondContact O-N 3.5Å; D51-K54 PolarHBondContact O-N 3.39Å; W52-K54 PolarHBondContact O-N 2.9Å; K54-T107 WeakPolarHBondContact CE-O 3.22Å; K54-L108 HydrophobicContact CG-CD2 4.23Å
55S83.6Confident86.5Confident77 Ų7767.7 Ų67.754%0.53834%0.338SS..Hα-helixtrans-73-38.3177.177.10000112.5D51 W52 M53 K57D51-S55 PolarHBondContact O-N 3.13Å; D51-S55 VanDerWaalsContact O-N 3.07Å; W52-S55 PolarHBondContact O-N 3.43Å; W52-S55 PolarHBondContact O-OG 2.98Å; M53-S55 VanDerWaalsContact C-N 3.26Å; M53-S55 PolarHBondContact O-N 2.93Å; S55-K57 PolarHBondContact O-N 3.46Å
56Q85.9Confident86.7Confident85 Ų8566.4 Ų66.440%0.39733%0.331SS..  trans-99.467.2-175.4-63.6-60.5-2500111.5W52 M53 L58 F59W52-Q56 HydrophobicContact CD2-CG 4.28Å; W52-Q56 HydrophobicContact CZ2-CG 4.05Å; W52-Q56 WeakPolarHBondContact O-CB 3.43Å; W52-Q56 PolarHBondContact O-N 3.11Å; M53-Q56 CarbonylContact O-C 3.5Å; M53-Q56 PolarHBondContact O-N 3.28Å; Q56-L58 PolarHBondContact O-N 3.02Å; Q56-F59 WeakPolarHBondContact O-CB 2.95Å; Q56-F59 PolarHBondContact O-N 3.5Å
57K81.6Confident86.8Confident98 Ų9863.6 Ų63.643%0.42631%0.314SS..Hα-helixtrans-51.3-28.6176.9-63.9-179.2177.6-171.40113.3S55 F59 L60 F165S55-K57 PolarHBondContact O-N 3.46Å; K57-F59 VanDerWaalsContact C-N 3.26Å; K57-F59 PolarHBondContact O-N 3.24Å; K57-L60 PolarHBondContact O-N 3.44Å; K57-F165 HydrophobicContact CB-CE1 4.13Å; K57-F165 HydrophobicContact CD-CD1 4.14Å; K57-F165 HydrophobicContact CD-CE1 3.84Å; K57-F165 HydrophobicContact CG-CE1 4.08Å
58L86.6Confident87Confident126 Ų12661 Ų6166%0.6630%0.301SS*.Hα-helixtrans-60.6-31.6176.1-73.7173.3000113.4Q56 L60 W61 V62Q56-L58 PolarHBondContact O-N 3.02Å; L58-L60 VanDerWaalsContact C-N 3.35Å; L58-L60 PolarHBondContact O-N 3.48Å; L58-W61 PolarHBondContact O-N 2.97Å; L58-V62 WeakPolarHBondContact O-CG2 3.22Å; L58-V62 PolarHBondContact O-N 2.83Å
59F87.6Confident87.3Confident65 Ų6557 Ų5729%0.28529%0.287SS..Hα-helixtrans-63.2-42.6-179.3-175.7-88.1000111.7W52 M53 Q56 K57 W61 V62 S63 A100W52-F59 HydrophobicContact CH2-CD2 4.11Å; W52-F59 HydrophobicContact CZ3-CD2 4.1Å; W52-F59 HydrophobicContact CZ3-CE2 4.48Å; W52-F59 HydrophobicContact CZ3-CG 4.43Å; M53-F59 HydrophobicContact CE-CD1 3.45Å; M53-F59 VanDerWaalsContact CE-CD1 3.45Å; M53-F59 HydrophobicContact CE-CD2 4.17Å; M53-F59 HydrophobicContact CE-CE1 3.37Å; M53-F59 HydrophobicContact CE-CE2 4.09Å; M53-F59 HydrophobicContact CE-CG 3.85Å; M53-F59 HydrophobicContact CE-CZ 3.71Å; M53-F59 HydrophobicContact SD-CB 3.96Å; M53-F59 HydrophobicContact SD-CD1 3.25Å; M53-F59 WeakPolarHBondContact SD-CD1 3.16Å; M53-F59 HydrophobicContact SD-CD2 4.43Å; M53-F59 HydrophobicContact SD-CE1 3.81Å; M53-F59 HydrophobicContact SD-CG 3.62Å; Q56-F59 WeakPolarHBondContact O-CB 2.95Å; Q56-F59 PolarHBondContact O-N 3.5Å; K57-F59 VanDerWaalsContact C-N 3.26Å; K57-F59 PolarHBondContact O-N 3.24Å; F59-W61 VanDerWaalsContact C-N 3.34Å; F59-W61 PolarHBondContact O-N 2.67Å; F59-V62 PolarHBondContact O-N 3.19Å; F59-S63 WeakPolarHBondContact O-CB 3.47Å; F59-S63 PolarHBondContact O-N 3.11Å; F59-S63 PolarHBondContact O-OG 3.07Å; F59-A100 HydrophobicContact CE1-CB 4.05Å; F59-A100 HydrophobicContact CZ-CB 4.1Å
60L88Confident87.5Confident5 Ų555 Ų553%0.02628%0.277CS..Hα-helixtrans-58.1-48.7174.8-177.765.7000110.8K57 L58 V62 S63 S64 A101 S104 D105 Q161 F165K57-L60 PolarHBondContact O-N 3.44Å; L58-L60 VanDerWaalsContact C-N 3.35Å; L58-L60 PolarHBondContact O-N 3.48Å; L60-V62 PolarHBondContact O-N 2.92Å; L60-S63 PolarHBondContact O-N 3.49Å; L60-S63 PolarHBondContact O-OG 2.88Å; L60-S64 VanDerWaalsContact O-CB 3.27Å; L60-S64 WeakPolarHBondContact O-CB 3.27Å; L60-S64 PolarHBondContact O-N 3.02Å; L60-S64 PolarHBondContact O-OG 3.23Å; L60-S64 VanDerWaalsContact O-OG 3.13Å; L60-A101 VanDerWaalsContact CD1-O 3.23Å; L60-A101 WeakPolarHBondContact CD1-O 3.1Å; L60-S104 WeakPolarHBondContact CB-OG 3.11Å; L60-D105 HydrophobicContact CD1-CB 3.99Å; L60-Q161 VanDerWaalsContact CD2-NE2 3.34Å; L60-F165 HydrophobicContact CD2-CE2 3.82Å; L60-F165 HydrophobicContact CD2-CZ 3.62Å
61W87.9Confident87.7Confident81 Ų8155.8 Ų55.831%0.30728%0.281SS..Hα-helixtrans-61.9-46.3179.9-8495.5000113.2L58 F59 A65 S162 F165L58-W61 PolarHBondContact O-N 2.97Å; F59-W61 VanDerWaalsContact C-N 3.34Å; F59-W61 PolarHBondContact O-N 2.67Å; W61-A65 WeakPolarHBondContact O-CB 3.38Å; W61-A65 PolarHBondContact O-N 3.3Å; W61-S162 VanDerWaalsContact CH2-CA 3.49Å; W61-S162 WeakPolarHBondContact CH2-OG 3.4Å; W61-F165 AromaticContact CD1-CE2 3.98Å; W61-F165 AromaticContact CE2-CD2 3.56Å; W61-F165 HydrophobicContact CZ2-CB 4.27Å; W61-F165 AromaticContact CZ2-CD2 3.67Å; W61-F165 HydrophobicContact CZ2-CD2 3.67Å; W61-F165 HydrophobicContact CZ2-CE2 4.48Å; W61-F165 HydrophobicContact CZ2-CG 4.29Å; W61-F165 AromaticContact NE1-CD2 3.04Å; W61-F165 AromaticContact NE1-CE2 3.28Å; W61-F165 VanDerWaalsContact NE1-CE2 3.28Å; W61-F165 AromaticContact NE1-CG 3.55Å; W61-F165 AromaticContact NE1-CZ 3.95Å
62V90.7Very high87.9Confident85 Ų8554.4 Ų54.452%0.51527%0.273SS..Hα-helixtrans-65.8-44.8-179.4172.30000110.6L58 F59 L60 A65 I66L58-V62 WeakPolarHBondContact O-CG2 3.22Å; L58-V62 PolarHBondContact O-N 2.83Å; F59-V62 PolarHBondContact O-N 3.19Å; L60-V62 PolarHBondContact O-N 2.92Å; V62-A65 PolarHBondContact O-N 3.14Å; V62-I66 HydrophobicContact CG1-CD1 3.77Å; V62-I66 HydrophobicContact CG1-CG1 4.49Å; V62-I66 VanDerWaalsContact O-CG1 3.26Å; V62-I66 WeakPolarHBondContact O-CG1 3.28Å; V62-I66 PolarHBondContact O-N 2.96Å
63S89.6Confident88Confident4 Ų451.1 Ų51.13%0.02827%0.265CS..Hα-helixtrans-65.7-44.6178.155.60000112.4F59 L60 A65 I66 Y67 A101F59-S63 WeakPolarHBondContact O-CB 3.47Å; F59-S63 PolarHBondContact O-N 3.11Å; F59-S63 PolarHBondContact O-OG 3.07Å; L60-S63 PolarHBondContact O-N 3.49Å; L60-S63 PolarHBondContact O-OG 2.88Å; S63-A65 PolarHBondContact O-N 3.14Å; S63-I66 PolarHBondContact O-N 3.49Å; S63-Y67 VanDerWaalsContact O-CB 3.32Å; S63-Y67 WeakPolarHBondContact O-CB 3.47Å; S63-Y67 PolarHBondContact O-N 3.28Å; S63-A101 WeakPolarHBondContact OG-CA 3.33Å
64S87.6Confident88Confident13 Ų1351.3 Ų51.39%0.09127%0.265CS..Hα-helixtrans-59.5-44.2173.3-72.60000112.2L60 Y67 F68 Q161L60-S64 VanDerWaalsContact O-CB 3.27Å; L60-S64 WeakPolarHBondContact O-CB 3.27Å; L60-S64 PolarHBondContact O-N 3.02Å; L60-S64 PolarHBondContact O-OG 3.23Å; L60-S64 VanDerWaalsContact O-OG 3.13Å; S64-Y67 PolarHBondContact O-N 3.34Å; S64-F68 VanDerWaalsContact O-CB 3.32Å; S64-F68 WeakPolarHBondContact O-CB 3.43Å; S64-F68 PolarHBondContact O-N 3.45Å; S64-Q161 PolarHBondContact OG-OE1 3.13Å
65A90Very high88.1Confident42 Ų4251.2 Ų51.235%0.34727%0.266SS..Hα-helixtrans-65.6-44.8-179.700000112W61 V62 S63 F68 I69W61-A65 WeakPolarHBondContact O-CB 3.38Å; W61-A65 PolarHBondContact O-N 3.3Å; V62-A65 PolarHBondContact O-N 3.14Å; S63-A65 PolarHBondContact O-N 3.14Å; A65-F68 PolarHBondContact O-N 2.86Å; A65-I69 VanDerWaalsContact O-CG1 3.27Å; A65-I69 WeakPolarHBondContact O-CG1 3.37Å; A65-I69 PolarHBondContact O-N 3.05Å
66I92.9Very high88.2Confident56 Ų5653.8 Ų53.829%0.28727%0.268SS..Hα-helixtrans-62.4-46.1176.1-67.3167000110.1V62 S63 F68 I69 L70 F97V62-I66 HydrophobicContact CG1-CD1 3.77Å; V62-I66 HydrophobicContact CG1-CG1 4.49Å; V62-I66 VanDerWaalsContact O-CG1 3.26Å; V62-I66 WeakPolarHBondContact O-CG1 3.28Å; V62-I66 PolarHBondContact O-N 2.96Å; S63-I66 PolarHBondContact O-N 3.49Å; I66-F68 VanDerWaalsContact C-N 3.35Å; I66-F68 PolarHBondContact O-N 3.13Å; I66-I69 PolarHBondContact O-N 2.61Å; I66-L70 HydrophobicContact CG2-CD1 3.98Å; I66-L70 HydrophobicContact CG2-CG 4.37Å; I66-L70 VanDerWaalsContact O-CG 3.32Å; I66-L70 WeakPolarHBondContact O-CG 3.45Å; I66-L70 PolarHBondContact O-N 3.22Å; I66-F97 HydrophobicContact CB-CD1 4.01Å; I66-F97 HydrophobicContact CB-CE1 4.22Å; I66-F97 HydrophobicContact CB-CG 4.31Å; I66-F97 HydrophobicContact CD1-CD1 4.16Å; I66-F97 HydrophobicContact CD1-CE1 3.6Å; I66-F97 HydrophobicContact CD1-CZ 4.11Å; I66-F97 HydrophobicContact CG2-CB 4.36Å; I66-F97 HydrophobicContact CG2-CD1 3.68Å; I66-F97 HydrophobicContact CG2-CD2 3.64Å; I66-F97 HydrophobicContact CG2-CE1 3.78Å; I66-F97 HydrophobicContact CG2-CE2 3.75Å; I66-F97 HydrophobicContact CG2-CG 3.62Å; I66-F97 HydrophobicContact CG2-CZ 3.82Å
67Y92Very high88.3Confident3 Ų352.8 Ų52.81%0.01227%0.267CS..Hα-helixtrans-60.1-44.2177.6175.9-124.9000112S63 S64 I69 L70 Q71 M94 N218 W221S63-Y67 VanDerWaalsContact O-CB 3.32Å; S63-Y67 WeakPolarHBondContact O-CB 3.47Å; S63-Y67 PolarHBondContact O-N 3.28Å; S64-Y67 PolarHBondContact O-N 3.34Å; Y67-I69 PolarHBondContact O-N 3.08Å; Y67-L70 PolarHBondContact O-N 3.16Å; Y67-Q71 HydrophobicContact CD2-CG 4.37Å; Y67-Q71 HydrophobicContact CE1-CG 4.41Å; Y67-Q71 HydrophobicContact CE2-CG 3.95Å; Y67-Q71 WeakPolarHBondContact O-CG 3.38Å; Y67-Q71 PolarHBondContact O-N 3.22Å; Y67-Q71 PolarHBondContact OH-NE2 2.93Å; Y67-M94 HydrophobicContact CD2-CE 4.13Å; Y67-M94 HydrophobicContact CD2-SD 3.67Å; Y67-M94 HydrophobicContact CE2-CE 3.51Å; Y67-M94 HydrophobicContact CE2-SD 3.69Å; Y67-N218 PolarHBondContact OH-OD1 3.37Å; Y67-W221 AromaticContact CD1-CH2 3.94Å; Y67-W221 HydrophobicContact CD1-CH2 3.94Å; Y67-W221 AromaticContact CD1-CZ2 3.95Å; Y67-W221 HydrophobicContact CD1-CZ2 3.95Å; Y67-W221 HydrophobicContact CD1-CZ3 4.34Å; Y67-W221 AromaticContact CE1-CD2 3.66Å; Y67-W221 HydrophobicContact CE1-CD2 3.66Å; Y67-W221 AromaticContact CE1-CE2 3.64Å; Y67-W221 AromaticContact CE1-CE3 3.6Å; Y67-W221 HydrophobicContact CE1-CE3 3.6Å; Y67-W221 HydrophobicContact CE1-CG 4.46Å; Y67-W221 AromaticContact CE1-CH2 3.59Å; Y67-W221 HydrophobicContact CE1-CH2 3.59Å; Y67-W221 AromaticContact CE1-CZ2 3.63Å; Y67-W221 HydrophobicContact CE1-CZ2 3.63Å; Y67-W221 AromaticContact CE1-CZ3 3.59Å; Y67-W221 HydrophobicContact CE1-CZ3 3.59Å; Y67-W221 AromaticContact CZ-CD2 3.99Å
68F89.4Confident88.2Confident45 Ų4550.3 Ų50.320%0.19726%0.261CS..Hα-helixtrans-60.8-44.9176178.3-110.1000112.1S64 A65 I66 L70 Q71 L72 D154 L158S64-F68 VanDerWaalsContact O-CB 3.32Å; S64-F68 WeakPolarHBondContact O-CB 3.43Å; S64-F68 PolarHBondContact O-N 3.45Å; A65-F68 PolarHBondContact O-N 2.86Å; I66-F68 VanDerWaalsContact C-N 3.35Å; I66-F68 PolarHBondContact O-N 3.13Å; F68-L70 VanDerWaalsContact C-N 3.3Å; F68-L70 PolarHBondContact O-N 2.96Å; F68-Q71 WeakPolarHBondContact O-CB 3.46Å; F68-Q71 PolarHBondContact O-N 3.41Å; F68-Q71 VanDerWaalsContact O-N 3.15Å; F68-L72 HydrophobicContact CD1-CD1 4.07Å; F68-L72 HydrophobicContact CE1-CD1 3.54Å; F68-L72 HydrophobicContact CE1-CG 4.18Å; F68-L72 HydrophobicContact CE2-CD2 4.26Å; F68-L72 HydrophobicContact CE2-CG 4.33Å; F68-L72 HydrophobicContact CZ-CD1 3.81Å; F68-L72 HydrophobicContact CZ-CD2 4.06Å; F68-L72 HydrophobicContact CZ-CG 4.07Å; F68-L72 WeakPolarHBondContact O-CG 3.27Å; F68-L72 PolarHBondContact O-N 2.74Å; F68-D154 HydrophobicContact CD2-CB 4.24Å; F68-D154 HydrophobicContact CE2-CB 3.8Å; F68-L158 HydrophobicContact CE1-CD2 4.43Å
69I91.9Very high88.1Confident93 Ų9346.8 Ų46.848%0.47725%0.25SS..Hα-helixtrans-60-43.6175.4-68.9164.8000110.7A65 I66 Y67 Q71 L72 I73A65-I69 VanDerWaalsContact O-CG1 3.27Å; A65-I69 WeakPolarHBondContact O-CG1 3.37Å; A65-I69 PolarHBondContact O-N 3.05Å; I66-I69 PolarHBondContact O-N 2.61Å; Y67-I69 PolarHBondContact O-N 3.08Å; I69-Q71 VanDerWaalsContact C-N 3.31Å; I69-Q71 PolarHBondContact O-N 3.16Å; I69-L72 PolarHBondContact O-N 3.1Å; I69-I73 HydrophobicContact CG2-CD1 3.93Å; I69-I73 WeakPolarHBondContact O-CG1 3.34Å; I69-I73 PolarHBondContact O-N 2.84Å
70L91.3Very high87.7Confident19 Ų1946.9 Ų46.910%0.09925%0.253CS..Hα-helixtrans-65.2-35.4177.5-68.4170.3000111.8I66 Y67 F68 W74 Y90 L93 M94 F97I66-L70 HydrophobicContact CG2-CD1 3.98Å; I66-L70 HydrophobicContact CG2-CG 4.37Å; I66-L70 VanDerWaalsContact O-CG 3.32Å; I66-L70 WeakPolarHBondContact O-CG 3.45Å; I66-L70 PolarHBondContact O-N 3.22Å; Y67-L70 PolarHBondContact O-N 3.16Å; F68-L70 VanDerWaalsContact C-N 3.3Å; F68-L70 PolarHBondContact O-N 2.96Å; L70-W74 WeakPolarHBondContact O-CB 3.31Å; L70-W74 PolarHBondContact O-N 3.35Å; L70-Y90 VanDerWaalsContact C-OH 3.22Å; L70-Y90 WeakPolarHBondContact CA-OH 3.02Å; L70-Y90 HydrophobicContact CD2-CD2 4.49Å; L70-Y90 HydrophobicContact CD2-CE2 3.61Å; L70-Y90 WeakPolarHBondContact CD2-OH 3.33Å; L70-Y90 PolarHBondContact O-OH 3.45Å; L70-L93 HydrophobicContact CD1-CB 4.3Å; L70-M94 HydrophobicContact CB-CG 3.87Å; L70-M94 HydrophobicContact CB-SD 3.22Å; L70-M94 WeakPolarHBondContact CB-SD 3.4Å; L70-M94 HydrophobicContact CD1-CG 4.19Å; L70-M94 HydrophobicContact CD1-SD 4.16Å; L70-M94 HydrophobicContact CG-SD 4.32Å; L70-F97 HydrophobicContact CD1-CB 4.43Å; L70-F97 HydrophobicContact CD1-CD2 3.76Å; L70-F97 HydrophobicContact CD1-CG 4.41Å
71Q89.3Confident87.3Confident15 Ų1546.8 Ų46.87%0.0725%0.253CS..Hα-helixtrans-63-45.1172.1-74.6-171.754.400112.2Y67 F68 I69 I73 W74 M75 M94 N218Y67-Q71 HydrophobicContact CD2-CG 4.37Å; Y67-Q71 HydrophobicContact CE1-CG 4.41Å; Y67-Q71 HydrophobicContact CE2-CG 3.95Å; Y67-Q71 WeakPolarHBondContact O-CG 3.38Å; Y67-Q71 PolarHBondContact O-N 3.22Å; Y67-Q71 PolarHBondContact OH-NE2 2.93Å; F68-Q71 WeakPolarHBondContact O-CB 3.46Å; F68-Q71 PolarHBondContact O-N 3.41Å; F68-Q71 VanDerWaalsContact O-N 3.15Å; I69-Q71 VanDerWaalsContact C-N 3.31Å; I69-Q71 PolarHBondContact O-N 3.16Å; Q71-I73 PolarHBondContact O-N 2.92Å; Q71-W74 WeakPolarHBondContact O-CB 3.27Å; Q71-W74 PolarHBondContact O-N 3.42Å; Q71-W74 VanDerWaalsContact O-N 3.1Å; Q71-M75 PolarHBondContact O-N 2.92Å; Q71-M94 HydrophobicContact CG-CE 3.73Å; Q71-M94 HydrophobicContact CG-SD 4.41Å; Q71-N218 VanDerWaalsContact CD-OD1 3.25Å; Q71-N218 PolarHBondContact NE2-OD1 2.94Å; Q71-N218 VanDerWaalsContact OE1-CG 3.29Å; Q71-N218 PolarHBondContact OE1-ND2 3.41Å; Q71-N218 PolarHBondContact OE1-OD1 2.84Å; Q71-N218 VanDerWaalsContact OE1-OD1 3.04Å
72L87.6Confident87.1Confident45 Ų4548.8 Ų48.824%0.23626%0.261CS..Hα-helixtrans-61.2-45.1178.7-68178.7000111.5F68 I69 W74 M75 F76 L151F68-L72 HydrophobicContact CD1-CD1 4.07Å; F68-L72 HydrophobicContact CE1-CD1 3.54Å; F68-L72 HydrophobicContact CE1-CG 4.18Å; F68-L72 HydrophobicContact CE2-CD2 4.26Å; F68-L72 HydrophobicContact CE2-CG 4.33Å; F68-L72 HydrophobicContact CZ-CD1 3.81Å; F68-L72 HydrophobicContact CZ-CD2 4.06Å; F68-L72 HydrophobicContact CZ-CG 4.07Å; F68-L72 WeakPolarHBondContact O-CG 3.27Å; F68-L72 PolarHBondContact O-N 2.74Å; I69-L72 PolarHBondContact O-N 3.1Å; L72-W74 VanDerWaalsContact C-N 3.26Å; L72-W74 PolarHBondContact O-N 2.95Å; L72-M75 PolarHBondContact O-N 3.43Å; L72-F76 HydrophobicContact CB-CD2 4.36Å; L72-F76 HydrophobicContact CD2-CE2 4.09Å; L72-F76 WeakPolarHBondContact O-CD2 3.45Å; L72-F76 PolarHBondContact O-N 3.49Å; L72-L151 HydrophobicContact CD2-CD2 4.38Å
73I88.3Confident86.8Confident60 Ų6051.6 Ų51.631%0.30827%0.266SS..Hα-helixtrans-60.9-39175.3-69165000110.4I69 Q71 M75 V77 L80 Y90I69-I73 HydrophobicContact CG2-CD1 3.93Å; I69-I73 WeakPolarHBondContact O-CG1 3.34Å; I69-I73 PolarHBondContact O-N 2.84Å; Q71-I73 PolarHBondContact O-N 2.92Å; I73-M75 VanDerWaalsContact C-N 3.32Å; I73-M75 PolarHBondContact O-N 3.45Å; I73-V77 CarbonylContact O-C 3.59Å; I73-V77 WeakPolarHBondContact O-CA 3.28Å; I73-V77 WeakPolarHBondContact O-CB 3.45Å; I73-V77 PolarHBondContact O-N 3.25Å; I73-L80 HydrophobicContact CG2-CD1 3.58Å; I73-Y90 WeakPolarHBondContact CB-OH 2.92Å; I73-Y90 HydrophobicContact CG2-CE2 3.99Å; I73-Y90 WeakPolarHBondContact CG2-OH 3.5Å
74W85.5Confident86.5Confident12 Ų1260.3 Ų60.35%0.04530%0.299CS..Hα-helixtrans-62.4-41.4176.7-148.3-49.8000111.4L70 Q71 L72 Y90 L91 M94 V210L70-W74 WeakPolarHBondContact O-CB 3.31Å; L70-W74 PolarHBondContact O-N 3.35Å; Q71-W74 WeakPolarHBondContact O-CB 3.27Å; Q71-W74 PolarHBondContact O-N 3.42Å; Q71-W74 VanDerWaalsContact O-N 3.1Å; L72-W74 VanDerWaalsContact C-N 3.26Å; L72-W74 PolarHBondContact O-N 2.95Å; W74-Y90 HydrophobicContact CB-CE1 4.08Å; W74-Y90 AromaticContact CD2-CD1 3.81Å; W74-Y90 HydrophobicContact CD2-CD1 3.81Å; W74-Y90 AromaticContact CD2-CE1 3.66Å; W74-Y90 HydrophobicContact CD2-CE1 3.66Å; W74-Y90 AromaticContact CE3-CD1 3.28Å; W74-Y90 HydrophobicContact CE3-CD1 3.28Å; W74-Y90 AromaticContact CE3-CE1 3.19Å; W74-Y90 HydrophobicContact CE3-CE1 3.19Å; W74-Y90 HydrophobicContact CG-CE1 4.1Å; W74-Y90 AromaticContact CH2-CD1 3.92Å; W74-Y90 HydrophobicContact CH2-CD1 3.92Å; W74-Y90 HydrophobicContact CZ2-CD1 4.42Å; W74-Y90 AromaticContact CZ3-CD1 3.34Å; W74-Y90 HydrophobicContact CZ3-CD1 3.34Å; W74-Y90 AromaticContact CZ3-CE1 3.76Å; W74-Y90 HydrophobicContact CZ3-CE1 3.76Å; W74-Y90 HydrophobicContact CZ3-CG 4.49Å; W74-L91 HydrophobicContact CH2-CB 4.08Å; W74-L91 HydrophobicContact CH2-CD1 4.34Å; W74-L91 HydrophobicContact CH2-CG 4.42Å; W74-M94 HydrophobicContact CE3-CB 4.28Å; W74-M94 HydrophobicContact CE3-CE 3.73Å; W74-M94 HydrophobicContact CE3-CG 3.59Å; W74-M94 HydrophobicContact CE3-SD 4.27Å; W74-M94 HydrophobicContact CZ3-CB 3.77Å; W74-M94 HydrophobicContact CZ3-CE 4.27Å; W74-M94 HydrophobicContact CZ3-CG 3.54Å; W74-V210 HydrophobicContact CH2-CG1 4.31Å; W74-V210 HydrophobicContact CZ2-CG1 4.1Å; W74-V210 WeakPolarHBondContact CZ2-O 3.32Å
75M82.9Confident86.5Confident46 Ų4662.4 Ų62.423%0.22731%0.312CS..Hα-helixtrans-69.5-46.2179.8-172178.7-131.500112.8Q71 L72 I73 L147 T150 L151Q71-M75 PolarHBondContact O-N 2.92Å; L72-M75 PolarHBondContact O-N 3.43Å; I73-M75 VanDerWaalsContact C-N 3.32Å; I73-M75 PolarHBondContact O-N 3.45Å; M75-L147 HydrophobicContact CE-CB 4.2Å; M75-L147 HydrophobicContact CE-CD1 4.43Å; M75-L147 HydrophobicContact CE-CG 3.67Å; M75-L147 HydrophobicContact SD-CG 4.4Å; M75-T150 HydrophobicContact CE-CG2 3.45Å; M75-T150 VanDerWaalsContact CE-CG2 3.45Å; M75-T150 HydrophobicContact SD-CG2 4.29Å; M75-L151 HydrophobicContact SD-CD2 4.22Å
76F85.4Confident86.4Confident132 Ų13267.2 Ų67.258%0.57932%0.323SS*.Hα-helixtrans-89.1-22.7-173.8-68.8-65.5000114L72 P78L72-F76 HydrophobicContact CB-CD2 4.36Å; L72-F76 HydrophobicContact CD2-CE2 4.09Å; L72-F76 WeakPolarHBondContact O-CD2 3.45Å; L72-F76 PolarHBondContact O-N 3.49Å; F76-P78 VanDerWaalsContact C-CD 3.44Å; F76-P78 WeakPolarHBondContact O-CD 3.27Å
77V87.4Confident86.2Confident64 Ų6465.5 Ų65.539%0.38831%0.314SS..  trans-12865.4-176.7-162.90000110.8I73 A79 L80I73-V77 CarbonylContact O-C 3.59Å; I73-V77 WeakPolarHBondContact O-CA 3.28Å; I73-V77 WeakPolarHBondContact O-CB 3.45Å; I73-V77 PolarHBondContact O-N 3.25Å; V77-A79 PolarHBondContact O-N 2.91Å; V77-L80 HydrophobicContact CB-CD1 4.2Å; V77-L80 HydrophobicContact CB-CG 4.5Å; V77-L80 HydrophobicContact CG1-CD1 4Å; V77-L80 HydrophobicContact CG1-CG 3.88Å; V77-L80 PolarHBondContact O-N 3.35Å
78P81.4Confident86.1Confident45 Ų4569 Ų6929%0.29233%0.332SS..THydrogen-bonded Turntrans-61.3-21179.325.2-34.5000112.5F76 L80 S81 L211F76-P78 VanDerWaalsContact C-CD 3.44Å; F76-P78 WeakPolarHBondContact O-CD 3.27Å; P78-L80 PolarHBondContact O-N 3.09Å; P78-L80 VanDerWaalsContact O-N 3.16Å; P78-S81 PolarHBondContact O-N 2.82Å; P78-S81 PolarHBondContact O-OG 2.82Å; P78-L211 HydrophobicContact CB-CD1 4.39Å; P78-L211 HydrophobicContact CB-CD2 3.85Å
79A83.9Confident86.2Confident53 Ų5371.1 Ų71.144%0.43835%0.345SS..Hα-helixtrans-56.5-29.6177.400000114.2V77 S81 R82V77-A79 PolarHBondContact O-N 2.91Å; A79-S81 VanDerWaalsContact C-N 3.31Å; A79-S81 PolarHBondContact O-N 3.44Å; A79-R82 PolarHBondContact O-N 3.02Å
80L79.2Confident86.1Confident66 Ų6667.9 Ų67.935%0.34633%0.327SS..Hα-helixtrans-66.9-34.5177.4-70.1172.2000112I73 V77 P78 R82 N87I73-L80 HydrophobicContact CG2-CD1 3.58Å; V77-L80 HydrophobicContact CB-CD1 4.2Å; V77-L80 HydrophobicContact CB-CG 4.5Å; V77-L80 HydrophobicContact CG1-CD1 4Å; V77-L80 HydrophobicContact CG1-CG 3.88Å; V77-L80 PolarHBondContact O-N 3.35Å; P78-L80 PolarHBondContact O-N 3.09Å; P78-L80 VanDerWaalsContact O-N 3.16Å; L80-R82 PolarHBondContact O-N 3.09Å; L80-N87 PolarHBondContact O-N 3.02Å
81S79.3Confident86.1Confident3 Ų368.1 Ų68.12%0.02133%0.328CS..Hα-helixtrans-75.6-10.6179.972.80000113.8P78 A79 N87 L211P78-S81 PolarHBondContact O-N 2.82Å; P78-S81 PolarHBondContact O-OG 2.82Å; A79-S81 VanDerWaalsContact C-N 3.31Å; A79-S81 PolarHBondContact O-N 3.44Å; S81-N87 WeakPolarHBondContact O-CB 3.37Å; S81-L211 WeakPolarHBondContact OG-CB 3.32Å
82R83.9Confident86.3Confident124 Ų12472.1 Ų72.147%0.46835%0.349SS..Hα-helixtrans-93.4-20.8-178.3-65176.9177.5176.8-4.9113.8A79 L80 D208A79-R82 PolarHBondContact O-N 3.02Å; L80-R82 PolarHBondContact O-N 3.09Å; R82-D208 IonicContact CZ-OD1 3.16Å; R82-D208 IonicContact NE-OD1 3.62Å; R82-D208 PolarHBondContact NE-OD1 3.46Å; R82-D208 IonicContact NH2-OD1 2.6Å; R82-D208 PolarHBondContact NH2-OD1 2.92Å; R82-D208 IonicContact NH2-OD2 3.21Å; R82-D208 PolarHBondContact NH2-OD2 3.44Å; R82-D208 VanDerWaalsContact NH2-OD2 3.15Å
83K84.8Confident86.6Confident143 Ų14373.3 Ų73.362%0.62236%0.355SS*.SBendtrans-104.7124.6-173-67.3-173.7179.6-177.60111.5Y86 N87K83-Y86 HydrophobicContact CB-CD2 4.21Å; K83-Y86 WeakPolarHBondContact O-CB 3.32Å; K83-Y86 PolarHBondContact O-N 3.36Å; K83-N87 PolarHBondContact O-N 3.38Å
84Y83.4Confident86.8Confident187 Ų18770.6 Ų70.673%0.73334%0.341SS*.THydrogen-bonded Turntrans-74.1141.1166.6-174.5-93.6000110.1N87 I88Y84-N87 WeakPolarHBondContact CA-OD1 3.22Å; Y84-I88 HydrophobicContact CD2-CG1 4.2Å; Y84-I88 HydrophobicContact CE2-CG1 4.13Å
85P87.7Confident87.3Confident57 Ų5770.3 Ų70.337%0.3734%0.341SS..THydrogen-bonded Turncis-89.2-1.6-0.335.8-35.6000114.5N87 I88 I89P85-N87 VanDerWaalsContact C-N 3.26Å; P85-N87 PolarHBondContact O-N 3.07Å; P85-I88 PolarHBondContact O-N 3.28Å; P85-I89 HydrophobicContact CB-CD1 4.38Å; P85-I89 HydrophobicContact CG-CD1 4.39Å; P85-I89 PolarHBondContact O-N 3.36Å
86Y87.1Confident87.8Confident143 Ų14373 Ų7356%0.56136%0.356SS*.Hα-helixtrans-56.1-39.4-174.2-60.1-74.2000112.8K83 I88 I89 Y90K83-Y86 HydrophobicContact CB-CD2 4.21Å; K83-Y86 WeakPolarHBondContact O-CB 3.32Å; K83-Y86 PolarHBondContact O-N 3.36Å; Y86-I88 PolarHBondContact O-N 2.97Å; Y86-I89 PolarHBondContact O-N 2.89Å; Y86-Y90 WeakPolarHBondContact O-CB 3.22Å; Y86-Y90 PolarHBondContact O-N 2.69Å
87N89.2Confident88.3Confident21 Ų2169.2 Ų69.211%0.11234%0.339CS..Hα-helixtrans-56.7-44.8178.664.4-12.4000113.4L80 S81 K83 Y84 P85 L91 V210L80-N87 PolarHBondContact O-N 3.02Å; S81-N87 WeakPolarHBondContact O-CB 3.37Å; K83-N87 PolarHBondContact O-N 3.38Å; Y84-N87 WeakPolarHBondContact CA-OD1 3.22Å; P85-N87 VanDerWaalsContact C-N 3.26Å; P85-N87 PolarHBondContact O-N 3.07Å; N87-L91 WeakPolarHBondContact O-CB 3.34Å; N87-L91 PolarHBondContact O-N 3.42Å; N87-V210 HydrophobicContact CB-CB 4.23Å; N87-V210 HydrophobicContact CB-CG1 4.06Å; N87-V210 HydrophobicContact CB-CG2 4.14Å
88I89.2Confident88.6Confident75 Ų7566.2 Ų66.239%0.38532%0.321SS..Hα-helixtrans-71.9-44.9179.4-59.1-51.6000110.8Y84 P85 Y86 Y90 L91 I92Y84-I88 HydrophobicContact CD2-CG1 4.2Å; Y84-I88 HydrophobicContact CE2-CG1 4.13Å; P85-I88 PolarHBondContact O-N 3.28Å; Y86-I88 PolarHBondContact O-N 2.97Å; I88-Y90 PolarHBondContact O-N 2.91Å; I88-L91 PolarHBondContact O-N 2.86Å; I88-I92 HydrophobicContact CG2-CD1 3.84Å; I88-I92 HydrophobicContact CG2-CG1 4.41Å; I88-I92 WeakPolarHBondContact O-CG1 3.49Å; I88-I92 PolarHBondContact O-N 2.95Å
89I91.3Very high89.3Confident91 Ų9164.7 Ų64.747%0.46731%0.31SS..Hα-helixtrans-57.2-44.9177.8-65.8169.6000109.8P85 Y86 I92 L93P85-I89 HydrophobicContact CB-CD1 4.38Å; P85-I89 HydrophobicContact CG-CD1 4.39Å; P85-I89 PolarHBondContact O-N 3.36Å; Y86-I89 PolarHBondContact O-N 2.89Å; I89-I92 PolarHBondContact O-N 2.63Å; I89-L93 HydrophobicContact CG2-CD1 3.96Å; I89-L93 WeakPolarHBondContact O-CG 3.17Å; I89-L93 PolarHBondContact O-N 2.86Å
90Y89.6Confident89.8Confident25 Ų2562.8 Ų62.810%0.09830%0.295CS..Hα-helixtrans-65.3-42.7-179.6-155.6-98.2000112.3L70 I73 W74 Y86 I88 I92 L93 M94L70-Y90 VanDerWaalsContact C-OH 3.22Å; L70-Y90 WeakPolarHBondContact CA-OH 3.02Å; L70-Y90 HydrophobicContact CD2-CD2 4.49Å; L70-Y90 HydrophobicContact CD2-CE2 3.61Å; L70-Y90 WeakPolarHBondContact CD2-OH 3.33Å; L70-Y90 PolarHBondContact O-OH 3.45Å; I73-Y90 WeakPolarHBondContact CB-OH 2.92Å; I73-Y90 HydrophobicContact CG2-CE2 3.99Å; I73-Y90 WeakPolarHBondContact CG2-OH 3.5Å; W74-Y90 HydrophobicContact CB-CE1 4.08Å; W74-Y90 AromaticContact CD2-CD1 3.81Å; W74-Y90 HydrophobicContact CD2-CD1 3.81Å; W74-Y90 AromaticContact CD2-CE1 3.66Å; W74-Y90 HydrophobicContact CD2-CE1 3.66Å; W74-Y90 AromaticContact CE3-CD1 3.28Å; W74-Y90 HydrophobicContact CE3-CD1 3.28Å; W74-Y90 AromaticContact CE3-CE1 3.19Å; W74-Y90 HydrophobicContact CE3-CE1 3.19Å; W74-Y90 HydrophobicContact CG-CE1 4.1Å; W74-Y90 AromaticContact CH2-CD1 3.92Å; W74-Y90 HydrophobicContact CH2-CD1 3.92Å; W74-Y90 HydrophobicContact CZ2-CD1 4.42Å; W74-Y90 AromaticContact CZ3-CD1 3.34Å; W74-Y90 HydrophobicContact CZ3-CD1 3.34Å; W74-Y90 AromaticContact CZ3-CE1 3.76Å; W74-Y90 HydrophobicContact CZ3-CE1 3.76Å; W74-Y90 HydrophobicContact CZ3-CG 4.49Å; Y86-Y90 WeakPolarHBondContact O-CB 3.22Å; Y86-Y90 PolarHBondContact O-N 2.69Å; I88-Y90 PolarHBondContact O-N 2.91Å; Y90-I92 PolarHBondContact O-N 3.28Å; Y90-L93 PolarHBondContact O-N 2.84Å; Y90-M94 HydrophobicContact CD1-CG 4.23Å; Y90-M94 HydrophobicContact CE1-CG 3.98Å; Y90-M94 WeakPolarHBondContact O-CB 3.41Å; Y90-M94 WeakPolarHBondContact O-CG 3.17Å; Y90-M94 PolarHBondContact O-N 2.95Å
91L91.9Very high90.4Very high24 Ų2459.7 Ų59.713%0.12628%0.279CS..Hα-helixtrans-61.3-43175.9-170.8135.1000111.9I28 Q32 W74 N87 I88 M94 T95 V210I28-L91 HydrophobicContact CG2-CD1 3.62Å; I28-L91 HydrophobicContact CG2-CD2 4.26Å; Q32-L91 HydrophobicContact CG-CD2 4.33Å; W74-L91 HydrophobicContact CH2-CB 4.08Å; W74-L91 HydrophobicContact CH2-CD1 4.34Å; W74-L91 HydrophobicContact CH2-CG 4.42Å; N87-L91 WeakPolarHBondContact O-CB 3.34Å; N87-L91 PolarHBondContact O-N 3.42Å; I88-L91 PolarHBondContact O-N 2.86Å; L91-M94 PolarHBondContact O-N 3.34Å; L91-T95 PolarHBondContact O-N 2.82Å; L91-T95 PolarHBondContact O-OG1 2.87Å; L91-T95 VanDerWaalsContact O-OG1 3.1Å; L91-V210 HydrophobicContact CB-CG1 4.17Å; L91-V210 HydrophobicContact CD1-CG1 3.67Å
92I93.6Very high91.1Very high99 Ų9959.5 Ų59.551%0.50828%0.278SS..Hα-helixtrans-62.7-48.8176.4-68.8167.6000111I88 I89 Y90 M94 T95 L96I88-I92 HydrophobicContact CG2-CD1 3.84Å; I88-I92 HydrophobicContact CG2-CG1 4.41Å; I88-I92 WeakPolarHBondContact O-CG1 3.49Å; I88-I92 PolarHBondContact O-N 2.95Å; I89-I92 PolarHBondContact O-N 2.63Å; Y90-I92 PolarHBondContact O-N 3.28Å; I92-M94 VanDerWaalsContact C-N 3.31Å; I92-M94 PolarHBondContact O-N 2.91Å; I92-T95 PolarHBondContact O-N 3.34Å; I92-L96 WeakPolarHBondContact O-CB 3.36Å; I92-L96 PolarHBondContact O-N 3.09Å
93L93.8Very high91.6Very high69 Ų6953.6 Ų53.636%0.36126%0.255SS..Hα-helixtrans-58.4-46.5178.8-74.2168.7000110.8L70 I89 Y90 T95 L96 F97L70-L93 HydrophobicContact CD1-CB 4.3Å; I89-L93 HydrophobicContact CG2-CD1 3.96Å; I89-L93 WeakPolarHBondContact O-CG 3.17Å; I89-L93 PolarHBondContact O-N 2.86Å; Y90-L93 PolarHBondContact O-N 2.84Å; L93-T95 PolarHBondContact O-N 3.48Å; L93-L96 PolarHBondContact O-N 2.9Å; L93-F97 HydrophobicContact CD2-CE2 4.01Å; L93-F97 WeakPolarHBondContact O-CD2 3.47Å; L93-F97 PolarHBondContact O-N 2.85Å
94M92.2Very high91.9Very high3 Ų347 Ų472%0.01523%0.227CC..Hα-helixtrans-59.6-48.5178.2-86.4-80.4-72.500112.3Y67 L70 Q71 W74 Y90 L91 I92 L96 S98Y67-M94 HydrophobicContact CD2-CE 4.13Å; Y67-M94 HydrophobicContact CD2-SD 3.67Å; Y67-M94 HydrophobicContact CE2-CE 3.51Å; Y67-M94 HydrophobicContact CE2-SD 3.69Å; L70-M94 HydrophobicContact CB-CG 3.87Å; L70-M94 HydrophobicContact CB-SD 3.22Å; L70-M94 WeakPolarHBondContact CB-SD 3.4Å; L70-M94 HydrophobicContact CD1-CG 4.19Å; L70-M94 HydrophobicContact CD1-SD 4.16Å; L70-M94 HydrophobicContact CG-SD 4.32Å; Q71-M94 HydrophobicContact CG-CE 3.73Å; Q71-M94 HydrophobicContact CG-SD 4.41Å; W74-M94 HydrophobicContact CE3-CB 4.28Å; W74-M94 HydrophobicContact CE3-CE 3.73Å; W74-M94 HydrophobicContact CE3-CG 3.59Å; W74-M94 HydrophobicContact CE3-SD 4.27Å; W74-M94 HydrophobicContact CZ3-CB 3.77Å; W74-M94 HydrophobicContact CZ3-CE 4.27Å; W74-M94 HydrophobicContact CZ3-CG 3.54Å; Y90-M94 HydrophobicContact CD1-CG 4.23Å; Y90-M94 HydrophobicContact CE1-CG 3.98Å; Y90-M94 WeakPolarHBondContact O-CB 3.41Å; Y90-M94 WeakPolarHBondContact O-CG 3.17Å; Y90-M94 PolarHBondContact O-N 2.95Å; L91-M94 PolarHBondContact O-N 3.34Å; I92-M94 VanDerWaalsContact C-N 3.31Å; I92-M94 PolarHBondContact O-N 2.91Å; M94-L96 VanDerWaalsContact C-N 3.32Å; M94-L96 PolarHBondContact O-N 3.13Å; M94-S98 WeakPolarHBondContact O-CB 3.3Å; M94-S98 PolarHBondContact O-N 2.85Å; M94-S98 PolarHBondContact O-OG 3.27Å
95T95.5Very high92.2Very high7 Ų738.3 Ų38.34%0.04319%0.194CC..Hα-helixtrans-63.5-37177.2-60.60000112.4Q32 I35 L91 I92 L93 S98 T99Q32-T95 HydrophobicContact CB-CG2 4.36Å; Q32-T95 HydrophobicContact CG-CG2 4.39Å; Q32-T95 WeakPolarHBondContact CG-OG1 3.15Å; Q32-T95 PolarHBondContact NE2-OG1 3.46Å; I35-T95 HydrophobicContact CB-CG2 4.04Å; I35-T95 HydrophobicContact CD1-CG2 4.3Å; I35-T95 HydrophobicContact CG2-CG2 3.69Å; L91-T95 PolarHBondContact O-N 2.82Å; L91-T95 PolarHBondContact O-OG1 2.87Å; L91-T95 VanDerWaalsContact O-OG1 3.1Å; I92-T95 PolarHBondContact O-N 3.34Å; L93-T95 PolarHBondContact O-N 3.48Å; T95-S98 WeakPolarHBondContact CA-OG 3.22Å; T95-S98 PolarHBondContact O-OG 3.46Å; T95-T99 WeakPolarHBondContact O-CB 3.27Å; T95-T99 PolarHBondContact O-N 3.34Å; T95-T99 PolarHBondContact O-OG1 3.45Å
96L95Very high92.4Very high103 Ų10335.6 Ų35.654%0.53918%0.176SC..Hα-helixtrans-68.8-48.2180-174.5140.7000111.7I92 L93 M94 T99 A100I92-L96 WeakPolarHBondContact O-CB 3.36Å; I92-L96 PolarHBondContact O-N 3.09Å; L93-L96 PolarHBondContact O-N 2.9Å; M94-L96 VanDerWaalsContact C-N 3.32Å; M94-L96 PolarHBondContact O-N 3.13Å; L96-T99 PolarHBondContact O-N 2.92Å; L96-A100 WeakPolarHBondContact O-CB 3.45Å; L96-A100 PolarHBondContact O-N 2.97Å
97F95.2Very high92.5Very high52 Ų5228.9 Ų28.923%0.22815%0.149CC..Hα-helixtrans-72.3-36-179.6-76-70000112.8I66 L70 L93 T99 A100 A101I66-F97 HydrophobicContact CB-CD1 4.01Å; I66-F97 HydrophobicContact CB-CE1 4.22Å; I66-F97 HydrophobicContact CB-CG 4.31Å; I66-F97 HydrophobicContact CD1-CD1 4.16Å; I66-F97 HydrophobicContact CD1-CE1 3.6Å; I66-F97 HydrophobicContact CD1-CZ 4.11Å; I66-F97 HydrophobicContact CG2-CB 4.36Å; I66-F97 HydrophobicContact CG2-CD1 3.68Å; I66-F97 HydrophobicContact CG2-CD2 3.64Å; I66-F97 HydrophobicContact CG2-CE1 3.78Å; I66-F97 HydrophobicContact CG2-CE2 3.75Å; I66-F97 HydrophobicContact CG2-CG 3.62Å; I66-F97 HydrophobicContact CG2-CZ 3.82Å; L70-F97 HydrophobicContact CD1-CB 4.43Å; L70-F97 HydrophobicContact CD1-CD2 3.76Å; L70-F97 HydrophobicContact CD1-CG 4.41Å; L93-F97 HydrophobicContact CD2-CE2 4.01Å; L93-F97 WeakPolarHBondContact O-CD2 3.47Å; L93-F97 PolarHBondContact O-N 2.85Å; F97-T99 VanDerWaalsContact C-N 3.34Å; F97-A100 PolarHBondContact O-N 3.46Å; F97-A101 WeakPolarHBondContact O-CB 3.17Å; F97-A101 PolarHBondContact O-N 2.86Å
98S93.7Very high92.4Very high0 Ų029.7 Ų29.70%015%0.154CC..Hα-helixtrans-65.2-39173.364.50000112M94 T95 I102 Y217 W221M94-S98 WeakPolarHBondContact O-CB 3.3Å; M94-S98 PolarHBondContact O-N 2.85Å; M94-S98 PolarHBondContact O-OG 3.27Å; T95-S98 WeakPolarHBondContact CA-OG 3.22Å; T95-S98 PolarHBondContact O-OG 3.46Å; S98-I102 VanDerWaalsContact O-CG2 3.3Å; S98-I102 WeakPolarHBondContact O-CG2 3.19Å; S98-I102 PolarHBondContact O-N 3.46Å; S98-Y217 WeakPolarHBondContact CB-OH 3.26Å; S98-Y217 WeakPolarHBondContact OG-CE1 3.28Å; S98-Y217 PolarHBondContact OG-OH 3.28Å; S98-W221 PolarHBondContact O-NE1 2.82Å; S98-W221 VanDerWaalsContact O-NE1 3.09Å
99T95.8Very high92.4Very high13 Ų1326.1 Ų26.18%0.0814%0.135CC..Hα-helixtrans-65-46.1173.8-59.20000110T36 T95 L96 F97 A101 A103T36-T99 WeakPolarHBondContact CA-OG1 3.41Å; T95-T99 WeakPolarHBondContact O-CB 3.27Å; T95-T99 PolarHBondContact O-N 3.34Å; T95-T99 PolarHBondContact O-OG1 3.45Å; L96-T99 PolarHBondContact O-N 2.92Å; F97-T99 VanDerWaalsContact C-N 3.34Å; T99-A101 VanDerWaalsContact C-N 3.35Å; T99-A101 PolarHBondContact O-N 3.49Å; T99-A103 WeakPolarHBondContact O-CA 3.24Å; T99-A103 WeakPolarHBondContact O-CB 3.21Å; T99-A103 PolarHBondContact O-N 3.46Å
100A93.8Very high92.2Very high13 Ų1325.9 Ų25.911%0.10713%0.131CC..Hα-helixtrans-60-43.4177.400000112.5F59 L96 F97 S104F59-A100 HydrophobicContact CE1-CB 4.05Å; F59-A100 HydrophobicContact CZ-CB 4.1Å; L96-A100 WeakPolarHBondContact O-CB 3.45Å; L96-A100 PolarHBondContact O-N 2.97Å; F97-A100 PolarHBondContact O-N 3.46Å; A100-S104 WeakPolarHBondContact O-CB 3.24Å; A100-S104 PolarHBondContact O-N 2.97Å
101A92.9Very high92.3Very high1 Ų127.6 Ų27.61%0.00814%0.14CC..Hα-helixtrans-64.3-52.7179.500000111.6L60 S63 F97 T99 S104 D105 W221L60-A101 VanDerWaalsContact CD1-O 3.23Å; L60-A101 WeakPolarHBondContact CD1-O 3.1Å; S63-A101 WeakPolarHBondContact OG-CA 3.33Å; F97-A101 WeakPolarHBondContact O-CB 3.17Å; F97-A101 PolarHBondContact O-N 2.86Å; T99-A101 VanDerWaalsContact C-N 3.35Å; T99-A101 PolarHBondContact O-N 3.49Å; A101-S104 PolarHBondContact O-N 3.45Å; A101-D105 PolarHBondContact O-N 3.4Å; A101-W221 HydrophobicContact CB-CZ2 4.29Å
102I94.1Very high92.2Very high0 Ų032.7 Ų32.70%017%0.167CC..Hα-helixtrans-72.3-34-178-158.1152.9000112.5T36 S98 D105 A106 W221 F224 L225 M228T36-I102 HydrophobicContact CG2-CG2 3.64Å; S98-I102 VanDerWaalsContact O-CG2 3.3Å; S98-I102 WeakPolarHBondContact O-CG2 3.19Å; S98-I102 PolarHBondContact O-N 3.46Å; I102-D105 PolarHBondContact O-N 3.27Å; I102-A106 WeakPolarHBondContact O-CB 3.28Å; I102-A106 PolarHBondContact O-N 2.99Å; I102-W221 HydrophobicContact CB-CZ2 4.27Å; I102-F224 HydrophobicContact CD1-CB 4.5Å; I102-F224 HydrophobicContact CD1-CD1 3.19Å; I102-F224 HydrophobicContact CD1-CE1 3.49Å; I102-F224 VanDerWaalsContact CD1-CE1 3.49Å; I102-F224 HydrophobicContact CD1-CG 4.07Å; I102-F224 HydrophobicContact CG1-CD1 4.14Å; I102-F224 HydrophobicContact CG1-CE1 3.92Å; I102-L225 HydrophobicContact CD1-CB 4.2Å; I102-L225 HydrophobicContact CD1-CD1 4.45Å; I102-L225 HydrophobicContact CG1-CD1 4.39Å; I102-M228 HydrophobicContact CG1-SD 4.27Å
103A93.5Very high92.1Very high0 Ų029.5 Ų29.50%015%0.151CC..Hα-helixtrans-64.6-43175.200000111F43 T99 A106 T107F43-A103 HydrophobicContact CB-CB 3.96Å; F43-A103 HydrophobicContact CD1-CB 3.54Å; F43-A103 HydrophobicContact CD2-CB 4.41Å; F43-A103 HydrophobicContact CE1-CB 4.05Å; F43-A103 HydrophobicContact CG-CB 3.73Å; T99-A103 WeakPolarHBondContact O-CA 3.24Å; T99-A103 WeakPolarHBondContact O-CB 3.21Å; T99-A103 PolarHBondContact O-N 3.46Å; A103-A106 PolarHBondContact O-N 3.24Å; A103-T107 WeakPolarHBondContact O-CG2 3.31Å; A103-T107 PolarHBondContact O-N 3.43Å; A103-T107 VanDerWaalsContact O-N 3.14Å
104S91.3Very high92.2Very high5 Ų526.4 Ų26.44%0.03514%0.135CC..Hα-helixtrans-61.6-43.7175.1-174.70000111.4L60 A100 A101 T107L60-S104 WeakPolarHBondContact CB-OG 3.11Å; A100-S104 WeakPolarHBondContact O-CB 3.24Å; A100-S104 PolarHBondContact O-N 2.97Å; A101-S104 PolarHBondContact O-N 3.45Å; S104-T107 PolarHBondContact O-N 3.45Å; S104-T107 PolarHBondContact O-OG1 3.15Å
105D89.3Confident92.2Very high4 Ų429.1 Ų29.12%0.02115%0.151CC..Hα-helixtrans-64.1-43.3176.5-16062.6000111.1L60 A101 I102 T107 L108 Y109 L225 W229L60-D105 HydrophobicContact CD1-CB 3.99Å; A101-D105 PolarHBondContact O-N 3.4Å; I102-D105 PolarHBondContact O-N 3.27Å; D105-T107 PolarHBondContact O-N 3.24Å; D105-L108 VanDerWaalsContact O-CB 3.29Å; D105-L108 WeakPolarHBondContact O-CB 3.32Å; D105-L108 WeakPolarHBondContact O-CG 3.42Å; D105-L108 PolarHBondContact O-N 3.26Å; D105-L108 VanDerWaalsContact O-N 3.08Å; D105-Y109 WeakPolarHBondContact O-CD2 3.43Å; D105-L225 WeakPolarHBondContact OD2-CD1 3.27Å; D105-W229 PolarHBondContact OD2-NE1 3.07Å
106A92Very high92.1Very high0 Ų033.3 Ų33.30%017%0.174CC..Hα-helixtrans-65.2-23.1-178.300000114.4T40 I44 I102 A103 L108 Y109 V114 M228T40-A106 HydrophobicContact CG2-CB 3.56Å; I44-A106 HydrophobicContact CD1-CB 3.99Å; I44-A106 HydrophobicContact CG1-CB 4.45Å; I102-A106 WeakPolarHBondContact O-CB 3.28Å; I102-A106 PolarHBondContact O-N 2.99Å; A103-A106 PolarHBondContact O-N 3.24Å; A106-L108 PolarHBondContact O-N 3Å; A106-L108 VanDerWaalsContact O-N 3.16Å; A106-Y109 PolarHBondContact O-N 3.41Å; A106-V114 HydrophobicContact CB-CG1 4.08Å; A106-V114 HydrophobicContact CB-CG2 3.99Å; A106-M228 HydrophobicContact CB-CE 3.66Å; A106-M228 HydrophobicContact CB-SD 4.44Å
107T90.1Very high92.1Very high1 Ų129.6 Ų29.61%0.00615%0.154CC..THydrogen-bonded Turntrans-61.4-21.1173.469.20000113.5F43 M53 K54 A103 S104 D105 Y109F43-T107 HydrophobicContact CB-CG2 4.32Å; M53-T107 HydrophobicContact CB-CG2 4.11Å; M53-T107 HydrophobicContact CG-CG2 4.42Å; K54-T107 WeakPolarHBondContact CE-O 3.22Å; A103-T107 WeakPolarHBondContact O-CG2 3.31Å; A103-T107 PolarHBondContact O-N 3.43Å; A103-T107 VanDerWaalsContact O-N 3.14Å; S104-T107 PolarHBondContact O-N 3.45Å; S104-T107 PolarHBondContact O-OG1 3.15Å; D105-T107 PolarHBondContact O-N 3.24Å; T107-Y109 VanDerWaalsContact C-N 3.32Å
108L86.8Confident92.1Very high38 Ų3828.5 Ų28.520%0.19915%0.149CC..THydrogen-bonded Turntrans-76.5-20176.1-55.2177.8000112.6K54 D105 A106 Y164 L236 K237K54-L108 HydrophobicContact CG-CD2 4.23Å; D105-L108 VanDerWaalsContact O-CB 3.29Å; D105-L108 WeakPolarHBondContact O-CB 3.32Å; D105-L108 WeakPolarHBondContact O-CG 3.42Å; D105-L108 PolarHBondContact O-N 3.26Å; D105-L108 VanDerWaalsContact O-N 3.08Å; A106-L108 PolarHBondContact O-N 3Å; A106-L108 VanDerWaalsContact O-N 3.16Å; L108-Y164 HydrophobicContact CD1-CE1 4.49Å; L108-L236 HydrophobicContact CB-CD2 3.75Å; L108-L236 WeakPolarHBondContact O-CA 3.44Å; L108-L236 WeakPolarHBondContact O-CD2 3.36Å; L108-K237 PolarHBondContact O-N 3.22Å
109Y89.1Confident92.2Very high1 Ų130 Ų300%0.00417%0.165CC..BIsolated β-bridgetrans-101.6158.9-174.7-64.7-101.7000112D105 A106 T107 M228 T232 G235 L236 K237D105-Y109 WeakPolarHBondContact O-CD2 3.43Å; A106-Y109 PolarHBondContact O-N 3.41Å; T107-Y109 VanDerWaalsContact C-N 3.32Å; Y109-M228 HydrophobicContact CD2-CE 3.51Å; Y109-M228 WeakPolarHBondContact CE1-O 3.43Å; Y109-M228 HydrophobicContact CE2-CE 3.73Å; Y109-M228 HydrophobicContact CG-CE 3.99Å; Y109-T232 PolarHBondContact OH-OG1 3.37Å; Y109-T232 VanDerWaalsContact OH-OG1 3.08Å; Y109-G235 CarbonylContact C-O 3.47Å; Y109-G235 WeakPolarHBondContact CA-O 3.38Å; Y109-L236 HydrophobicContact CD1-CD2 4.31Å; Y109-L236 HydrophobicContact CD2-CD2 4.3Å; Y109-L236 HydrophobicContact CE1-CD2 4.22Å; Y109-L236 HydrophobicContact CE2-CD2 4.22Å; Y109-L236 HydrophobicContact CG-CD2 4.34Å; Y109-K237 WeakPolarHBondContact O-CD 3.44Å; Y109-K237 WeakPolarHBondContact O-CE 3.47Å
110K88.2Confident92.2Very high85 Ų8531.7 Ų31.737%0.3718%0.175SC..  trans-68.5145.1170.1-66.9173.8-174.6170.90110.4D112 I113 V114 G235 K237K110-D112 VanDerWaalsContact C-N 3.32Å; K110-D112 PolarHBondContact O-N 2.56Å; K110-I113 HydrophobicContact CB-CD1 4.28Å; K110-I113 HydrophobicContact CB-CG1 4.39Å; K110-I113 HydrophobicContact CD-CD1 4.4Å; K110-I113 PolarHBondContact O-N 3Å; K110-V114 PolarHBondContact O-N 3.45Å; K110-V114 VanDerWaalsContact O-N 3.09Å; K110-G235 PolarHBondContact N-O 3.33Å; K110-K237 HydrophobicContact CG-CG 3.84Å
111E90.5Very high92.3Very high62 Ų6231.1 Ų31.129%0.2917%0.17SC..Hα-helixtrans-63.3-40.4-172.8-35.7-166.8164.900111.6I44 I113 V114 T115 K237I44-E111 HydrophobicContact CG2-CB 3.95Å; I44-E111 HydrophobicContact CG2-CG 3.42Å; I44-E111 VanDerWaalsContact CG2-CG 3.42Å; E111-I113 PolarHBondContact O-N 3.04Å; E111-V114 PolarHBondContact O-N 2.92Å; E111-T115 WeakPolarHBondContact O-CB 3.41Å; E111-T115 PolarHBondContact O-N 2.8Å; E111-T115 PolarHBondContact O-OG1 3.25Å; E111-K237 IonicContact OE1-NZ 3.59Å
112D90.4Very high92.4Very high131 Ų13132.9 Ų32.970%0.70118%0.181SC*.Hα-helixtrans-57.2-38.6176.1-56.6-32.6000111.4K110 N116K110-D112 VanDerWaalsContact C-N 3.32Å; K110-D112 PolarHBondContact O-N 2.56Å; D112-N116 WeakPolarHBondContact O-CB 3.21Å; D112-N116 PolarHBondContact O-N 2.91Å
113I91.9Very high92.5Very high32 Ų3237.1 Ų37.116%0.16421%0.207CC..Hα-helixtrans-78.8-41.6-175-63.8176.6000110.2K110 E111 T115 N116 M117 S234K110-I113 HydrophobicContact CB-CD1 4.28Å; K110-I113 HydrophobicContact CB-CG1 4.39Å; K110-I113 HydrophobicContact CD-CD1 4.4Å; K110-I113 PolarHBondContact O-N 3Å; E111-I113 PolarHBondContact O-N 3.04Å; I113-T115 VanDerWaalsContact C-N 3.33Å; I113-T115 PolarHBondContact O-N 2.87Å; I113-N116 PolarHBondContact O-N 3.48Å; I113-M117 HydrophobicContact CG2-CG 4.3Å; I113-M117 WeakPolarHBondContact O-CB 3.2Å; I113-M117 VanDerWaalsContact O-CG 3.27Å; I113-M117 WeakPolarHBondContact O-CG 3.21Å; I113-M117 PolarHBondContact O-N 3.4Å; I113-S234 VanDerWaalsContact CD1-C 3.47Å; I113-S234 WeakPolarHBondContact CD1-O 3.08Å
114V94Very high92.6Very high4 Ų439.3 Ų39.32%0.02422%0.218CC..Hα-helixtrans-60.8-45.1174.1-179.50000110.6T40 I44 A106 K110 E111 M117 F118 F224 M228T40-V114 HydrophobicContact CG2-CG1 3.94Å; I44-V114 HydrophobicContact CD1-CB 3.94Å; I44-V114 HydrophobicContact CD1-CG1 3.76Å; I44-V114 HydrophobicContact CD1-CG2 3.87Å; A106-V114 HydrophobicContact CB-CG1 4.08Å; A106-V114 HydrophobicContact CB-CG2 3.99Å; K110-V114 PolarHBondContact O-N 3.45Å; K110-V114 VanDerWaalsContact O-N 3.09Å; E111-V114 PolarHBondContact O-N 2.92Å; V114-M117 PolarHBondContact O-N 3.4Å; V114-F118 WeakPolarHBondContact O-CB 3.14Å; V114-F118 PolarHBondContact O-N 3.42Å; V114-F224 HydrophobicContact CG1-CZ 4.06Å; V114-M228 HydrophobicContact CG2-CE 4.12Å
115T93.5Very high92.8Very high59 Ų5939.2 Ų39.236%0.36222%0.217SC..Hα-helixtrans-65.1-42.7179.3-53.90000111.5F37 E111 I113 F118 G119F37-T115 HydrophobicContact CZ-CG2 4.43Å; E111-T115 WeakPolarHBondContact O-CB 3.41Å; E111-T115 PolarHBondContact O-N 2.8Å; E111-T115 PolarHBondContact O-OG1 3.25Å; I113-T115 VanDerWaalsContact C-N 3.33Å; I113-T115 PolarHBondContact O-N 2.87Å; T115-F118 PolarHBondContact O-N 2.95Å; T115-G119 PolarHBondContact O-N 3.43Å
116N93.4Very high93Very high96 Ų9643.2 Ų43.251%0.51324%0.238SC..Hα-helixtrans-64.1-46.4176.3-171.441000111.6D112 I113 F118 G119 V120D112-N116 WeakPolarHBondContact O-CB 3.21Å; D112-N116 PolarHBondContact O-N 2.91Å; I113-N116 PolarHBondContact O-N 3.48Å; N116-F118 VanDerWaalsContact C-N 3.3Å; N116-F118 PolarHBondContact O-N 3.21Å; N116-G119 PolarHBondContact O-N 3.01Å; N116-G119 VanDerWaalsContact O-N 3.15Å; N116-V120 WeakPolarHBondContact O-CG2 3.46Å; N116-V120 PolarHBondContact O-N 2.98Å
117M94.9Very high93.1Very high24 Ų2447.9 Ų47.912%0.11826%0.263CS..Hα-helixtrans-64.5-35177.9-69.8-53.2123.100112.5I113 V114 V120 S121 F224 L227 M228 S231I113-M117 HydrophobicContact CG2-CG 4.3Å; I113-M117 WeakPolarHBondContact O-CB 3.2Å; I113-M117 VanDerWaalsContact O-CG 3.27Å; I113-M117 WeakPolarHBondContact O-CG 3.21Å; I113-M117 PolarHBondContact O-N 3.4Å; V114-M117 PolarHBondContact O-N 3.4Å; M117-V120 PolarHBondContact O-N 2.99Å; M117-S121 WeakPolarHBondContact O-CB 3.39Å; M117-S121 PolarHBondContact O-N 3.37Å; M117-S121 PolarHBondContact O-OG 2.6Å; M117-F224 HydrophobicContact CB-CD2 4.29Å; M117-F224 HydrophobicContact CB-CE2 3.96Å; M117-L227 HydrophobicContact CB-CB 4.39Å; M117-L227 HydrophobicContact CG-CB 4.44Å; M117-L227 HydrophobicContact SD-CB 3.85Å; M117-M228 HydrophobicContact CB-CG 4.17Å; M117-M228 HydrophobicContact CG-CG 4.5Å; M117-S231 WeakPolarHBondContact CE-OG 3.17Å; M117-S231 PolarHBondContact SD-OG 3.27Å
118F95.7Very high93.2Very high29 Ų2948.6 Ų48.613%0.12727%0.267CS..Hα-helixtrans-62-48.7171.8-177.8-91.4000110.6F37 V114 T115 N116 V120 S121 V122 W220 F224F37-F118 HydrophobicContact CB-CD2 4.11Å; F37-F118 HydrophobicContact CB-CE1 4.1Å; F37-F118 HydrophobicContact CB-CE2 3.47Å; F37-F118 VanDerWaalsContact CB-CE2 3.47Å; F37-F118 HydrophobicContact CB-CZ 3.48Å; F37-F118 VanDerWaalsContact CB-CZ 3.48Å; F37-F118 HydrophobicContact CD1-CE1 4.34Å; F37-F118 HydrophobicContact CD2-CB 4.02Å; F37-F118 AromaticContact CD2-CD1 3.44Å; F37-F118 HydrophobicContact CD2-CD1 3.44Å; F37-F118 VanDerWaalsContact CD2-CD1 3.44Å; F37-F118 AromaticContact CD2-CD2 3.46Å; F37-F118 HydrophobicContact CD2-CD2 3.46Å; F37-F118 VanDerWaalsContact CD2-CD2 3.46Å; F37-F118 AromaticContact CD2-CE1 3.68Å; F37-F118 HydrophobicContact CD2-CE1 3.68Å; F37-F118 AromaticContact CD2-CE2 3.7Å; F37-F118 HydrophobicContact CD2-CE2 3.7Å; F37-F118 AromaticContact CD2-CG 3.33Å; F37-F118 HydrophobicContact CD2-CG 3.33Å; F37-F118 AromaticContact CD2-CZ 3.82Å; F37-F118 HydrophobicContact CD2-CZ 3.82Å; F37-F118 HydrophobicContact CE2-CB 4.01Å; F37-F118 AromaticContact CE2-CD1 3.64Å; F37-F118 HydrophobicContact CE2-CD1 3.64Å; F37-F118 HydrophobicContact CE2-CD2 4.29Å; F37-F118 HydrophobicContact CE2-CE1 4.2Å; F37-F118 AromaticContact CE2-CG 3.71Å; F37-F118 HydrophobicContact CE2-CG 3.71Å; F37-F118 HydrophobicContact CG-CD1 4.02Å; F37-F118 HydrophobicContact CG-CD2 4.12Å; F37-F118 AromaticContact CG-CE1 3.76Å; F37-F118 HydrophobicContact CG-CE1 3.76Å; F37-F118 AromaticContact CG-CE2 3.85Å; F37-F118 HydrophobicContact CG-CE2 3.85Å; F37-F118 HydrophobicContact CG-CG 4.21Å; F37-F118 AromaticContact CG-CZ 3.69Å; F37-F118 HydrophobicContact CG-CZ 3.69Å; F37-F118 HydrophobicContact CZ-CD1 4.38Å; V114-F118 WeakPolarHBondContact O-CB 3.14Å; V114-F118 PolarHBondContact O-N 3.42Å; T115-F118 PolarHBondContact O-N 2.95Å; N116-F118 VanDerWaalsContact C-N 3.3Å; N116-F118 PolarHBondContact O-N 3.21Å; F118-V120 VanDerWaalsContact C-N 3.35Å; F118-V120 PolarHBondContact O-N 3.25Å; F118-S121 PolarHBondContact O-N 2.98Å; F118-S121 VanDerWaalsContact O-N 3.17Å; F118-S121 PolarHBondContact O-OG 2.69Å; F118-V122 HydrophobicContact CD1-CG2 4.17Å; F118-V122 HydrophobicContact CE1-CG2 3.7Å; F118-V122 HydrophobicContact CE2-CG2 4.36Å; F118-V122 HydrophobicContact CZ-CG2 3.79Å; F118-V122 WeakPolarHBondContact O-CG2 3.37Å; F118-V122 PolarHBondContact O-N 2.85Å; F118-W220 AromaticContact CD2-CH2 4Å; F118-W220 HydrophobicContact CD2-CH2 4Å; F118-W220 AromaticContact CD2-CZ2 3.55Å; F118-W220 HydrophobicContact CD2-CZ2 3.55Å; F118-W220 AromaticContact CE2-CH2 3.53Å; F118-W220 HydrophobicContact CE2-CH2 3.53Å; F118-W220 AromaticContact CE2-CZ2 3.2Å; F118-W220 HydrophobicContact CE2-CZ2 3.2Å; F118-W220 HydrophobicContact CZ-CZ2 4.14Å; F118-F224 HydrophobicContact CB-CD2 4.47Å; F118-F224 HydrophobicContact CB-CE2 3.84Å; F118-F224 HydrophobicContact CB-CZ 4.07Å; F118-F224 HydrophobicContact CD2-CE1 4.25Å; F118-F224 HydrophobicContact CD2-CE2 4.49Å; F118-F224 HydrophobicContact CD2-CZ 4.24Å
119G95.6Very high93.5Very high32 Ų3247.9 Ų47.933%0.3326%0.263SS..Hα-helixtrans-56.8-44.9174.900000113T115 N116 S121 V122 T123T115-G119 PolarHBondContact O-N 3.43Å; N116-G119 PolarHBondContact O-N 3.01Å; N116-G119 VanDerWaalsContact O-N 3.15Å; G119-S121 PolarHBondContact O-N 3.32Å; G119-V122 PolarHBondContact O-N 3.42Å; G119-T123 WeakPolarHBondContact O-CB 3.13Å; G119-T123 WeakPolarHBondContact O-CG2 3.46Å; G119-T123 PolarHBondContact O-N 2.85Å; G119-T123 PolarHBondContact O-OG1 3.1Å
120V95.6Very high93.5Very high48 Ų4855.2 Ų55.229%0.29129%0.291SS..Hα-helixtrans-62-43.7175.7175.50000111.2N116 M117 F118 V122 T123 L124 L227N116-V120 WeakPolarHBondContact O-CG2 3.46Å; N116-V120 PolarHBondContact O-N 2.98Å; M117-V120 PolarHBondContact O-N 2.99Å; F118-V120 VanDerWaalsContact C-N 3.35Å; F118-V120 PolarHBondContact O-N 3.25Å; V120-V122 PolarHBondContact O-N 3.11Å; V120-T123 VanDerWaalsContact CA-OG1 3.29Å; V120-T123 WeakPolarHBondContact CA-OG1 3.45Å; V120-T123 PolarHBondContact O-N 3.28Å; V120-T123 PolarHBondContact O-OG1 3.48Å; V120-L124 HydrophobicContact CG1-CD1 3.9Å; V120-L124 HydrophobicContact CG1-CG 4.37Å; V120-L124 WeakPolarHBondContact O-CB 3.43Å; V120-L124 VanDerWaalsContact O-CG 3.32Å; V120-L124 WeakPolarHBondContact O-CG 3.39Å; V120-L124 PolarHBondContact O-N 3.04Å; V120-L227 HydrophobicContact CB-CD1 4.38Å; V120-L227 HydrophobicContact CG1-CD1 3.93Å; V120-L227 HydrophobicContact CG1-CD2 4.22Å
121S95.2Very high93.5Very high1 Ų153.9 Ų53.91%0.00729%0.291CS..Hα-helixtrans-63.7-40.6179.475.10000112.9M117 F118 G119 F125 W220M117-S121 WeakPolarHBondContact O-CB 3.39Å; M117-S121 PolarHBondContact O-N 3.37Å; M117-S121 PolarHBondContact O-OG 2.6Å; F118-S121 PolarHBondContact O-N 2.98Å; F118-S121 VanDerWaalsContact O-N 3.17Å; F118-S121 PolarHBondContact O-OG 2.69Å; G119-S121 PolarHBondContact O-N 3.32Å; S121-F125 WeakPolarHBondContact O-CB 3.21Å; S121-F125 PolarHBondContact O-N 3.36Å; S121-W220 PolarHBondContact OG-NE1 2.97Å
122V95.8Very high93.4Very high38 Ų3851 Ų5123%0.2328%0.277CS..Hα-helixtrans-71.4-40.2179172.50000111F33 F118 G119 V120 F125 N126F33-V122 HydrophobicContact CD2-CG2 4.49Å; F118-V122 HydrophobicContact CD1-CG2 4.17Å; F118-V122 HydrophobicContact CE1-CG2 3.7Å; F118-V122 HydrophobicContact CE2-CG2 4.36Å; F118-V122 HydrophobicContact CZ-CG2 3.79Å; F118-V122 WeakPolarHBondContact O-CG2 3.37Å; F118-V122 PolarHBondContact O-N 2.85Å; G119-V122 PolarHBondContact O-N 3.42Å; V120-V122 PolarHBondContact O-N 3.11Å; V122-F125 PolarHBondContact O-N 3.21Å; V122-N126 PolarHBondContact O-N 3.37Å; V122-N126 PolarHBondContact O-ND2 3.47Å
123T95.5Very high93.1Very high89 Ų8949.6 Ų49.655%0.54627%0.273SS..Hα-helixtrans-64.6-41.7175.349.60000111.7G119 V120 N126 L127G119-T123 WeakPolarHBondContact O-CB 3.13Å; G119-T123 WeakPolarHBondContact O-CG2 3.46Å; G119-T123 PolarHBondContact O-N 2.85Å; G119-T123 PolarHBondContact O-OG1 3.1Å; V120-T123 VanDerWaalsContact CA-OG1 3.29Å; V120-T123 WeakPolarHBondContact CA-OG1 3.45Å; V120-T123 PolarHBondContact O-N 3.28Å; V120-T123 PolarHBondContact O-OG1 3.48Å; T123-N126 PolarHBondContact O-N 3.39Å; T123-L127 WeakPolarHBondContact O-CB 3.2Å; T123-L127 PolarHBondContact O-N 3.24Å
124L94.9Very high92.8Very high46 Ų4652.9 Ų52.924%0.24129%0.29CS..Hα-helixtrans-61.2-43.2172.7-76.2170.5000112.4V120 N126 L127 I128 L186 L227V120-L124 HydrophobicContact CG1-CD1 3.9Å; V120-L124 HydrophobicContact CG1-CG 4.37Å; V120-L124 WeakPolarHBondContact O-CB 3.43Å; V120-L124 VanDerWaalsContact O-CG 3.32Å; V120-L124 WeakPolarHBondContact O-CG 3.39Å; V120-L124 PolarHBondContact O-N 3.04Å; L124-N126 PolarHBondContact O-N 2.88Å; L124-L127 PolarHBondContact O-N 3.34Å; L124-I128 WeakPolarHBondContact O-CG1 3.49Å; L124-I128 PolarHBondContact O-N 2.93Å; L124-L186 HydrophobicContact CD1-CD2 4.43Å; L124-L227 HydrophobicContact CD1-CD1 4.05Å; L124-L227 HydrophobicContact CD1-CD2 4.49Å
125F95.4Very high92.1Very high3 Ų356 Ų561%0.01331%0.306CS..Hα-helixtrans-58.9-47.4176.4-174.1-98.6000111.9L26 T29 F33 S121 V122 I128 I129 L189 V193 W220L26-F125 HydrophobicContact CD1-CE1 3.9Å; L26-F125 HydrophobicContact CD1-CZ 4.46Å; T29-F125 HydrophobicContact CG2-CZ 4.13Å; F33-F125 AromaticContact CE2-CD1 3.8Å; F33-F125 HydrophobicContact CE2-CD1 3.8Å; F33-F125 HydrophobicContact CE2-CD2 4.45Å; F33-F125 AromaticContact CE2-CE1 3.93Å; F33-F125 HydrophobicContact CE2-CE1 3.93Å; F33-F125 HydrophobicContact CE2-CG 4.07Å; F33-F125 HydrophobicContact CE2-CZ 4.36Å; F33-F125 HydrophobicContact CZ-CD1 4.14Å; F33-F125 HydrophobicContact CZ-CD2 4.08Å; F33-F125 HydrophobicContact CZ-CE1 4.02Å; F33-F125 AromaticContact CZ-CE2 4Å; F33-F125 HydrophobicContact CZ-CE2 4Å; F33-F125 HydrophobicContact CZ-CG 4.16Å; F33-F125 AromaticContact CZ-CZ 3.97Å; F33-F125 HydrophobicContact CZ-CZ 3.97Å; S121-F125 WeakPolarHBondContact O-CB 3.21Å; S121-F125 PolarHBondContact O-N 3.36Å; V122-F125 PolarHBondContact O-N 3.21Å; F125-I128 PolarHBondContact O-N 2.94Å; F125-I129 HydrophobicContact CD1-CD1 3.71Å; F125-I129 HydrophobicContact CE1-CD1 3.34Å; F125-I129 HydrophobicContact CE1-CG1 4.38Å; F125-I129 HydrophobicContact CZ-CD1 3.98Å; F125-I129 WeakPolarHBondContact O-CG1 3.36Å; F125-I129 PolarHBondContact O-N 2.85Å; F125-L189 HydrophobicContact CD2-CD1 3.5Å; F125-L189 HydrophobicContact CD2-CD2 4.08Å; F125-L189 HydrophobicContact CD2-CG 4.37Å; F125-L189 HydrophobicContact CE2-CD1 3.61Å; F125-V193 HydrophobicContact CE2-CG2 4.39Å; F125-W220 HydrophobicContact CD2-CB 4.11Å; F125-W220 HydrophobicContact CE2-CB 4.41Å
126N94.1Very high91.2Very high88 Ų8864.6 Ų64.647%0.47133%0.332SS..Hα-helixtrans-65.2-40.8176.6-76.6-67.1000112.6V122 T123 L124 I128 I129 Y130V122-N126 PolarHBondContact O-N 3.37Å; V122-N126 PolarHBondContact O-ND2 3.47Å; T123-N126 PolarHBondContact O-N 3.39Å; L124-N126 PolarHBondContact O-N 2.88Å; N126-I128 VanDerWaalsContact C-N 3.28Å; N126-I128 PolarHBondContact O-N 3.23Å; N126-I129 PolarHBondContact O-N 2.68Å; N126-Y130 WeakPolarHBondContact O-CB 3.46Å; N126-Y130 PolarHBondContact O-N 3.19Å
127L94.2Very high90.3Very high99 Ų9967.3 Ų67.352%0.51834%0.336SS..Hα-helixtrans-59.5-41.2176.2-179.267.6000111.1T123 L124 Y130 T131T123-L127 WeakPolarHBondContact O-CB 3.2Å; T123-L127 PolarHBondContact O-N 3.24Å; L124-L127 PolarHBondContact O-N 3.34Å; L127-Y130 PolarHBondContact O-N 3.24Å; L127-T131 WeakPolarHBondContact O-CB 3.4Å; L127-T131 PolarHBondContact O-N 3.49Å; L127-T131 PolarHBondContact O-OG1 3.4Å
128I92.9Very high89.3Confident16 Ų1668.2 Ų68.28%0.08234%0.342CS..Hα-helixtrans-67.7-43.9177.7-71.1166.3000111L124 F125 N126 Y130 T131 I132 L186 L189 L190 V193L124-I128 WeakPolarHBondContact O-CG1 3.49Å; L124-I128 PolarHBondContact O-N 2.93Å; F125-I128 PolarHBondContact O-N 2.94Å; N126-I128 VanDerWaalsContact C-N 3.28Å; N126-I128 PolarHBondContact O-N 3.23Å; I128-Y130 VanDerWaalsContact C-N 3.31Å; I128-Y130 PolarHBondContact O-N 3.05Å; I128-T131 PolarHBondContact O-N 3.1Å; I128-I132 HydrophobicContact CG2-CG1 4.23Å; I128-I132 WeakPolarHBondContact O-CB 3.35Å; I128-I132 WeakPolarHBondContact O-CG1 3.34Å; I128-I132 PolarHBondContact O-N 2.93Å; I128-L186 HydrophobicContact CD1-CD2 4.29Å; I128-L189 HydrophobicContact CD1-CB 4.22Å; I128-L189 HydrophobicContact CD1-CD2 3.43Å; I128-L189 VanDerWaalsContact CD1-CD2 3.43Å; I128-L189 HydrophobicContact CD1-CG 3.69Å; I128-L189 HydrophobicContact CG2-CG 4.39Å; I128-L190 HydrophobicContact CG2-CB 4.22Å; I128-V193 HydrophobicContact CG2-CB 4.02Å; I128-V193 HydrophobicContact CG2-CG1 4.16Å; I128-V193 HydrophobicContact CG2-CG2 4.06Å
129I91.8Very high88.3Confident22 Ų2267.9 Ų67.911%0.11334%0.34CS..Hα-helixtrans-55.8-48.5173.8-70.5171000110.7L26 F125 N126 T131 I132 T133 V193 F197L26-I129 HydrophobicContact CD1-CD1 3.91Å; F125-I129 HydrophobicContact CD1-CD1 3.71Å; F125-I129 HydrophobicContact CE1-CD1 3.34Å; F125-I129 HydrophobicContact CE1-CG1 4.38Å; F125-I129 HydrophobicContact CZ-CD1 3.98Å; F125-I129 WeakPolarHBondContact O-CG1 3.36Å; F125-I129 PolarHBondContact O-N 2.85Å; N126-I129 PolarHBondContact O-N 2.68Å; I129-T131 PolarHBondContact O-N 3.47Å; I129-I132 PolarHBondContact O-N 3Å; I129-T133 WeakPolarHBondContact O-CB 3.35Å; I129-T133 PolarHBondContact O-N 2.94Å; I129-T133 PolarHBondContact O-OG1 3.09Å; I129-V193 HydrophobicContact CB-CG1 4.44Å; I129-V193 HydrophobicContact CG1-CG1 3.83Å; I129-V193 HydrophobicContact CG1-CG2 4.4Å; I129-F197 HydrophobicContact CD1-CE2 4.28Å; I129-F197 HydrophobicContact CD1-CZ 4.03Å; I129-F197 HydrophobicContact CG1-CE2 4.18Å; I129-F197 HydrophobicContact CG1-CZ 4.24Å; I129-F197 HydrophobicContact CG2-CD1 4.28Å; I129-F197 HydrophobicContact CG2-CE1 4.04Å; I129-F197 HydrophobicContact CG2-CZ 4.33Å
130Y90.2Very high87.3Confident155 Ų15566.4 Ų66.461%0.60833%0.325SS*.Hα-helixtrans-60-47.8178.1-177.4-102.4000111.9N126 L127 I128 I132 T133 I134N126-Y130 WeakPolarHBondContact O-CB 3.46Å; N126-Y130 PolarHBondContact O-N 3.19Å; L127-Y130 PolarHBondContact O-N 3.24Å; I128-Y130 VanDerWaalsContact C-N 3.31Å; I128-Y130 PolarHBondContact O-N 3.05Å; Y130-I132 PolarHBondContact O-N 3Å; Y130-T133 PolarHBondContact O-N 3.47Å; Y130-I134 HydrophobicContact CD1-CD1 3.81Å; Y130-I134 HydrophobicContact CD2-CD1 4.41Å; Y130-I134 HydrophobicContact CE1-CD1 3.27Å; Y130-I134 HydrophobicContact CE2-CD1 3.94Å; Y130-I134 HydrophobicContact CG-CD1 4.35Å; Y130-I134 PolarHBondContact O-N 2.85Å
131T89Confident86.3Confident58 Ų5870 Ų7036%0.35634%0.337SS..Hα-helixtrans-58.5-46.9178.8-56.90000111.5L127 I128 I129 T133 I134 L135L127-T131 WeakPolarHBondContact O-CB 3.4Å; L127-T131 PolarHBondContact O-N 3.49Å; L127-T131 PolarHBondContact O-OG1 3.4Å; I128-T131 PolarHBondContact O-N 3.1Å; I129-T131 PolarHBondContact O-N 3.47Å; T131-T133 PolarHBondContact O-N 3.41Å; T131-I134 PolarHBondContact O-N 2.9Å; T131-L135 WeakPolarHBondContact O-CB 3.27Å; T131-L135 PolarHBondContact O-N 3.26Å
132I88.2Confident85.3Confident2 Ų276.8 Ų76.81%0.0136%0.363CS..Hα-helixtrans-67-36-179.6-72-54.5000112.5I128 I129 Y130 I134 L135 F139 L190 V193 K194 F197I128-I132 HydrophobicContact CG2-CG1 4.23Å; I128-I132 WeakPolarHBondContact O-CB 3.35Å; I128-I132 WeakPolarHBondContact O-CG1 3.34Å; I128-I132 PolarHBondContact O-N 2.93Å; I129-I132 PolarHBondContact O-N 3Å; Y130-I132 PolarHBondContact O-N 3Å; I132-I134 PolarHBondContact O-N 3.28Å; I132-L135 HydrophobicContact CD1-CD2 4.25Å; I132-L135 PolarHBondContact O-N 2.98Å; I132-F139 HydrophobicContact CD1-CE1 4.32Å; I132-F139 HydrophobicContact CD1-CZ 3.83Å; I132-L190 HydrophobicContact CD1-CD2 3.95Å; I132-L190 HydrophobicContact CD1-CG 3.91Å; I132-L190 HydrophobicContact CG1-CG 4.49Å; I132-V193 HydrophobicContact CB-CG1 4.02Å; I132-V193 HydrophobicContact CG1-CB 4.44Å; I132-V193 HydrophobicContact CG1-CG1 3.96Å; I132-V193 HydrophobicContact CG2-CG1 4.15Å; I132-K194 HydrophobicContact CD1-CB 4.13Å; I132-K194 HydrophobicContact CD1-CD 4.11Å; I132-K194 HydrophobicContact CG2-CB 4.27Å; I132-K194 HydrophobicContact CG2-CD 3.81Å; I132-F197 HydrophobicContact CG2-CB 4.28Å
133T84Confident84.3Confident100 Ų10080.6 Ų80.661%0.61337%0.374SS*.Hα-helixtrans-63.8-32.9177.4-56.70000111.3I129 Y130 T131I129-T133 WeakPolarHBondContact O-CB 3.35Å; I129-T133 PolarHBondContact O-N 2.94Å; I129-T133 PolarHBondContact O-OG1 3.09Å; Y130-T133 PolarHBondContact O-N 3.47Å; T131-T133 PolarHBondContact O-N 3.41Å
134I84Confident83.4Confident102 Ų10281.9 Ų81.952%0.52338%0.377SS..Hα-helixtrans-83.2-34.9176.1-64168.6000111.3Y130 T131 I132 R136Y130-I134 HydrophobicContact CD1-CD1 3.81Å; Y130-I134 HydrophobicContact CD2-CD1 4.41Å; Y130-I134 HydrophobicContact CE1-CD1 3.27Å; Y130-I134 HydrophobicContact CE2-CD1 3.94Å; Y130-I134 HydrophobicContact CG-CD1 4.35Å; Y130-I134 PolarHBondContact O-N 2.85Å; T131-I134 PolarHBondContact O-N 2.9Å; I132-I134 PolarHBondContact O-N 3.28Å; I134-R136 PolarHBondContact O-N 2.98Å
135L80.8Confident82.7Confident69 Ų6982.8 Ų82.836%0.36138%0.384SS..  trans-74.9107.2-173-171.466.6000112T131 I132 Y137 F139 K194T131-L135 WeakPolarHBondContact O-CB 3.27Å; T131-L135 PolarHBondContact O-N 3.26Å; I132-L135 HydrophobicContact CD1-CD2 4.25Å; I132-L135 PolarHBondContact O-N 2.98Å; L135-Y137 PolarHBondContact O-N 3.26Å; L135-F139 HydrophobicContact CD2-CE1 3.89Å; L135-K194 PolarHBondContact O-NZ 2.88Å
136R73.5Confident82.1Confident240 Ų24082.8 Ų82.891%0.90639%0.385SS*.  trans-74.6-20.6179.4-63.6-175.6178.3-176.5-0.8114.6I134I134-R136 PolarHBondContact O-N 2.98Å
137Y75.3Confident81.6Confident153 Ų15380.6 Ų80.660%0.637%0.373SS*.  trans-69.3132.4-177.6-174.7-111.2000111.3L135 F139 K194L135-Y137 PolarHBondContact O-N 3.26Å; Y137-F139 HydrophobicContact CD1-CB 4.26Å; Y137-F139 AromaticContact CD1-CD1 3.84Å; Y137-F139 HydrophobicContact CD1-CD1 3.84Å; Y137-F139 HydrophobicContact CE1-CB 3.92Å; Y137-F139 HydrophobicContact CE1-CD1 4.35Å; Y137-K194 WeakPolarHBondContact O-CE 3.39Å; Y137-K194 PolarHBondContact O-NZ 2.66Å
138D72.9Confident81.3Confident43 Ų4381.5 Ų81.523%0.2337%0.372CS..  trans-103.8111.3177.8-172.810000110.6T140 G200 E201D138-T140 WeakPolarHBondContact OD1-CB 3.39Å; D138-T140 PolarHBondContact OD1-N 2.91Å; D138-T140 PolarHBondContact OD1-OG1 3.38Å; D138-G200 WeakPolarHBondContact OD2-CA 3.4Å; D138-E201 PolarHBondContact OD2-N 3.49Å
139F75.3Confident81Confident22 Ų2281.3 Ų81.310%0.09637%0.372CS..  trans-109.811.8176.748.2-85.7000111.9I132 L135 Y137 K141 Y142 L190 Y191 K194I132-F139 HydrophobicContact CD1-CE1 4.32Å; I132-F139 HydrophobicContact CD1-CZ 3.83Å; L135-F139 HydrophobicContact CD2-CE1 3.89Å; Y137-F139 HydrophobicContact CD1-CB 4.26Å; Y137-F139 AromaticContact CD1-CD1 3.84Å; Y137-F139 HydrophobicContact CD1-CD1 3.84Å; Y137-F139 HydrophobicContact CE1-CB 3.92Å; Y137-F139 HydrophobicContact CE1-CD1 4.35Å; F139-K141 PolarHBondContact O-N 3.32Å; F139-Y142 WeakPolarHBondContact O-CD2 3.33Å; F139-Y142 PolarHBondContact O-N 3.17Å; F139-L190 HydrophobicContact CE1-CD2 4.1Å; F139-L190 HydrophobicContact CE2-CD2 3.42Å; F139-L190 VanDerWaalsContact CE2-CD2 3.42Å; F139-L190 HydrophobicContact CZ-CD2 3.17Å; F139-L190 HydrophobicContact CZ-CG 4.44Å; F139-Y191 HydrophobicContact CD2-CD2 4.02Å; F139-Y191 HydrophobicContact CE2-CD2 4.26Å; F139-K194 HydrophobicContact CE1-CB 4.45Å; F139-K194 HydrophobicContact CE1-CD 3.99Å; F139-K194 HydrophobicContact CE1-CG 3.99Å; F139-K194 HydrophobicContact CE2-CB 3.95Å; F139-K194 HydrophobicContact CE2-CG 4.13Å; F139-K194 HydrophobicContact CZ-CB 3.63Å; F139-K194 HydrophobicContact CZ-CD 4.01Å; F139-K194 HydrophobicContact CZ-CG 3.66Å
140T74.2Confident80.7Confident0 Ų080.7 Ų80.70%037%0.37CS..THydrogen-bonded Turntrans-70.5-2.7-177.4-36.60000113.4D138 Y142 Y191 M195 F202D138-T140 WeakPolarHBondContact OD1-CB 3.39Å; D138-T140 PolarHBondContact OD1-N 2.91Å; D138-T140 PolarHBondContact OD1-OG1 3.38Å; T140-Y142 PolarHBondContact O-N 3.4Å; T140-Y191 HydrophobicContact CG2-CE1 4.41Å; T140-Y191 PolarHBondContact O-OH 2.84Å; T140-M195 HydrophobicContact CG2-CB 4.36Å; T140-M195 HydrophobicContact CG2-CG 3.42Å; T140-M195 VanDerWaalsContact CG2-CG 3.42Å; T140-M195 HydrophobicContact CG2-SD 3.31Å; T140-M195 WeakPolarHBondContact CG2-SD 3.48Å; T140-F202 HydrophobicContact CG2-CB 3.7Å
141K74.6Confident80.5Confident125 Ų12575.5 Ų75.554%0.54335%0.352SS..THydrogen-bonded Turntrans-66.9-20.4176.1-61.2-168.4174.5-1650113F139 Y143 E201 F202F139-K141 PolarHBondContact O-N 3.32Å; K141-Y143 VanDerWaalsContact C-N 3.32Å; K141-Y143 PolarHBondContact O-N 3.38Å; K141-E201 WeakPolarHBondContact CE-OE2 3.39Å; K141-E201 IonicContact NZ-OE2 3.11Å; K141-E201 PolarHBondContact NZ-OE2 2.91Å; K141-F202 HydrophobicContact CB-CE2 4.47Å; K141-F202 HydrophobicContact CG-CD2 4.28Å; K141-F202 HydrophobicContact CG-CE2 4.07Å
142Y74.1Confident80.5Confident142 Ų14276.4 Ų76.456%0.55735%0.354SS*.  trans-92.745.9-174.9-57.8-70.5000113.4F139 T140 L144 T145 N146F139-Y142 WeakPolarHBondContact O-CD2 3.33Å; F139-Y142 PolarHBondContact O-N 3.17Å; T140-Y142 PolarHBondContact O-N 3.4Å; Y142-L144 VanDerWaalsContact C-N 3.29Å; Y142-L144 PolarHBondContact O-N 2.99Å; Y142-T145 WeakPolarHBondContact O-CB 3.3Å; Y142-T145 PolarHBondContact O-N 2.84Å; Y142-T145 VanDerWaalsContact O-N 3.09Å; Y142-N146 PolarHBondContact O-N 3.38Å; Y142-N146 VanDerWaalsContact O-N 3.11Å
143Y74.6Confident80.6Confident118 Ų11876.3 Ų76.346%0.46335%0.353SS..Hα-helixtrans-55.5-42.5-179.2175.3-97.1000113.1K141 T145 N146 L147 Y191K141-Y143 VanDerWaalsContact C-N 3.32Å; K141-Y143 PolarHBondContact O-N 3.38Å; Y143-T145 VanDerWaalsContact C-N 3.29Å; Y143-T145 PolarHBondContact O-N 2.9Å; Y143-N146 WeakPolarHBondContact O-CB 3.38Å; Y143-N146 PolarHBondContact O-N 3.5Å; Y143-N146 VanDerWaalsContact O-N 3.12Å; Y143-L147 PolarHBondContact O-N 2.92Å; Y143-Y191 WeakPolarHBondContact CA-OH 3.49Å; Y143-Y191 PolarHBondContact N-OH 2.95Å
144L77.4Confident80.6Confident117 Ų11772 Ų7261%0.61333%0.327SS*.Hα-helixtrans-65.4-34.5-179.8-168.5143.5000111.8Y142 L147 F148Y142-L144 VanDerWaalsContact C-N 3.29Å; Y142-L144 PolarHBondContact O-N 2.99Å; L144-L147 PolarHBondContact O-N 3.33Å; L144-F148 HydrophobicContact CD2-CD2 3.77Å; L144-F148 HydrophobicContact CD2-CE2 3.39Å; L144-F148 HydrophobicContact CG-CE2 4.26Å; L144-F148 VanDerWaalsContact O-CD2 3.27Å; L144-F148 WeakPolarHBondContact O-CD2 3.33Å; L144-F148 PolarHBondContact O-N 3.21Å
145T80.9Confident80.8Confident64 Ų6471.2 Ų71.239%0.39332%0.323SS..Hα-helixtrans-64.4-43.8171.7-51.20000111Y142 Y143 L147 F148 V149Y142-T145 WeakPolarHBondContact O-CB 3.3Å; Y142-T145 PolarHBondContact O-N 2.84Å; Y142-T145 VanDerWaalsContact O-N 3.09Å; Y143-T145 VanDerWaalsContact C-N 3.29Å; Y143-T145 PolarHBondContact O-N 2.9Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 3.17Å; T145-F148 PolarHBondContact O-N 3.46Å; T145-V149 HydrophobicContact CG2-CG2 4.45Å; T145-V149 WeakPolarHBondContact O-CG2 3.28Å; T145-V149 PolarHBondContact O-N 3.1Å
146N82.8Confident81.1Confident4 Ų469.3 Ų69.32%0.02131%0.314CS..Hα-helixtrans-63.4-36.4178.2-177.958.9000112.8Y142 Y143 V149 T150 Y191 E192Y142-N146 PolarHBondContact O-N 3.38Å; Y142-N146 VanDerWaalsContact O-N 3.11Å; Y143-N146 WeakPolarHBondContact O-CB 3.38Å; Y143-N146 PolarHBondContact O-N 3.5Å; Y143-N146 VanDerWaalsContact O-N 3.12Å; N146-V149 PolarHBondContact O-N 3.09Å; N146-T150 WeakPolarHBondContact O-CB 3.31Å; N146-T150 PolarHBondContact O-N 3.01Å; N146-T150 PolarHBondContact O-OG1 2.94Å; N146-Y191 HydrophobicContact CB-CD1 3.65Å; N146-Y191 HydrophobicContact CB-CD2 4.34Å; N146-Y191 HydrophobicContact CB-CE1 3.52Å; N146-Y191 HydrophobicContact CB-CE2 4.23Å; N146-Y191 HydrophobicContact CB-CG 4.09Å; N146-Y191 VanDerWaalsContact CG-CE1 3.49Å; N146-Y191 WeakPolarHBondContact ND2-CD1 3.44Å; N146-Y191 WeakPolarHBondContact ND2-CE1 3.39Å; N146-Y191 WeakPolarHBondContact OD1-CD1 3.38Å; N146-E192 PolarHBondContact ND2-OE1 2.69Å
147L83Confident81.8Confident42 Ų4258.4 Ų58.422%0.2227%0.274CS..Hα-helixtrans-60.8-47.8173.3-174.8153.6000111.2M75 Y143 L144 T145 T150 L151M75-L147 HydrophobicContact CE-CB 4.2Å; M75-L147 HydrophobicContact CE-CD1 4.43Å; M75-L147 HydrophobicContact CE-CG 3.67Å; M75-L147 HydrophobicContact SD-CG 4.4Å; Y143-L147 PolarHBondContact O-N 2.92Å; L144-L147 PolarHBondContact O-N 3.33Å; T145-L147 VanDerWaalsContact C-N 3.32Å; T145-L147 PolarHBondContact O-N 3.17Å; L147-T150 WeakPolarHBondContact O-CB 3.19Å; L147-T150 PolarHBondContact O-N 3.04Å; L147-L151 HydrophobicContact CD2-CD1 3.76Å; L147-L151 HydrophobicContact CD2-CG 4.41Å; L147-L151 PolarHBondContact O-N 3.25Å; L147-L151 VanDerWaalsContact O-N 3.09Å
148F87.3Confident82.3Confident117 Ų11753.5 Ų53.551%0.51326%0.258SS..Hα-helixtrans-63.9-42.3176.7-78.6-59.7000112.7L144 T145 T150 L151 I152L144-F148 HydrophobicContact CD2-CD2 3.77Å; L144-F148 HydrophobicContact CD2-CE2 3.39Å; L144-F148 HydrophobicContact CG-CE2 4.26Å; L144-F148 VanDerWaalsContact O-CD2 3.27Å; L144-F148 WeakPolarHBondContact O-CD2 3.33Å; L144-F148 PolarHBondContact O-N 3.21Å; T145-F148 PolarHBondContact O-N 3.46Å; F148-T150 VanDerWaalsContact C-N 3.27Å; F148-T150 PolarHBondContact O-N 2.93Å; F148-L151 PolarHBondContact O-N 2.93Å; F148-I152 WeakPolarHBondContact O-CB 3.44Å; F148-I152 VanDerWaalsContact O-CG1 3.27Å; F148-I152 WeakPolarHBondContact O-CG1 3.12Å; F148-I152 PolarHBondContact O-N 3.39Å
149V87.7Confident83.1Confident13 Ų1355.9 Ų55.98%0.07927%0.27CS..Hα-helixtrans-58.8-42.5176170.50000110.7T145 N146 I152 I153 F184 F187 K188T145-V149 HydrophobicContact CG2-CG2 4.45Å; T145-V149 WeakPolarHBondContact O-CG2 3.28Å; T145-V149 PolarHBondContact O-N 3.1Å; N146-V149 PolarHBondContact O-N 3.09Å; V149-I152 PolarHBondContact O-N 3.46Å; V149-I153 HydrophobicContact CG1-CD1 3.72Å; V149-I153 HydrophobicContact CG1-CG1 4.42Å; V149-I153 WeakPolarHBondContact O-CD1 3.36Å; V149-I153 VanDerWaalsContact O-CG1 3.28Å; V149-I153 WeakPolarHBondContact O-CG1 3.22Å; V149-I153 PolarHBondContact O-N 3.08Å; V149-F184 HydrophobicContact CG1-CB 4.13Å; V149-F184 HydrophobicContact CG1-CD1 4.27Å; V149-F187 HydrophobicContact CG1-CD1 4.17Å; V149-F187 HydrophobicContact CG2-CD1 4.12Å; V149-F187 HydrophobicContact CG2-CE1 4.15Å; V149-K188 HydrophobicContact CG1-CB 4.21Å
150T85.4Confident83.6Confident9 Ų955 Ų556%0.05527%0.267CS..Hα-helixtrans-59.2-50.7176.2-65.90000111.7M75 N146 L147 F148 I152 I153 D154 K188M75-T150 HydrophobicContact CE-CG2 3.45Å; M75-T150 VanDerWaalsContact CE-CG2 3.45Å; M75-T150 HydrophobicContact SD-CG2 4.29Å; N146-T150 WeakPolarHBondContact O-CB 3.31Å; N146-T150 PolarHBondContact O-N 3.01Å; N146-T150 PolarHBondContact O-OG1 2.94Å; L147-T150 WeakPolarHBondContact O-CB 3.19Å; L147-T150 PolarHBondContact O-N 3.04Å; F148-T150 VanDerWaalsContact C-N 3.27Å; F148-T150 PolarHBondContact O-N 2.93Å; T150-I152 VanDerWaalsContact C-N 3.31Å; T150-I152 PolarHBondContact O-N 2.96Å; T150-I153 PolarHBondContact O-N 3.39Å; T150-D154 WeakPolarHBondContact CG2-OD2 3.42Å; T150-D154 VanDerWaalsContact O-CG 3.24Å; T150-D154 PolarHBondContact O-N 2.79Å; T150-K188 VanDerWaalsContact CG2-NZ 3.28Å; T150-K188 WeakPolarHBondContact OG1-CD 3.47Å; T150-K188 WeakPolarHBondContact OG1-CE 3.19Å
151L86.2Confident84.2Confident46 Ų4655.6 Ų55.624%0.24127%0.269CS..Hα-helixtrans-61.8-38.8178.4-68.5175.9000112.3L72 M75 L147 F148 L155L72-L151 HydrophobicContact CD2-CD2 4.38Å; M75-L151 HydrophobicContact SD-CD2 4.22Å; L147-L151 HydrophobicContact CD2-CD1 3.76Å; L147-L151 HydrophobicContact CD2-CG 4.41Å; L147-L151 PolarHBondContact O-N 3.25Å; L147-L151 VanDerWaalsContact O-N 3.09Å; F148-L151 PolarHBondContact O-N 2.93Å; L151-L155 VanDerWaalsContact O-CB 3.24Å; L151-L155 WeakPolarHBondContact O-CB 3.38Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 2.8Å
152I89.1Confident84.7Confident76 Ų7650.9 Ų50.939%0.3925%0.252SS..Hα-helixtrans-63.4-44.7177.5-71.4167.1000110.9F148 V149 T150 T156F148-I152 WeakPolarHBondContact O-CB 3.44Å; F148-I152 VanDerWaalsContact O-CG1 3.27Å; F148-I152 WeakPolarHBondContact O-CG1 3.12Å; F148-I152 PolarHBondContact O-N 3.39Å; V149-I152 PolarHBondContact O-N 3.46Å; T150-I152 VanDerWaalsContact C-N 3.31Å; T150-I152 PolarHBondContact O-N 2.96Å; I152-T156 WeakPolarHBondContact O-CB 3.47Å; I152-T156 PolarHBondContact O-N 3.34Å; I152-T156 PolarHBondContact O-OG1 3.05Å
153I88.5Confident85.2Confident0 Ų047.5 Ų47.50%024%0.243CC..Hα-helixtrans-60.8-54.2177.3-68.8158.2000109.9V149 T150 L155 T156 L157 F184 T185 K188 N222V149-I153 HydrophobicContact CG1-CD1 3.72Å; V149-I153 HydrophobicContact CG1-CG1 4.42Å; V149-I153 WeakPolarHBondContact O-CD1 3.36Å; V149-I153 VanDerWaalsContact O-CG1 3.28Å; V149-I153 WeakPolarHBondContact O-CG1 3.22Å; V149-I153 PolarHBondContact O-N 3.08Å; T150-I153 PolarHBondContact O-N 3.39Å; I153-L155 VanDerWaalsContact C-N 3.29Å; I153-L155 PolarHBondContact O-N 3.16Å; I153-T156 PolarHBondContact O-N 3.49Å; I153-T156 VanDerWaalsContact O-N 3.09Å; I153-L157 HydrophobicContact CG2-CD1 3.84Å; I153-L157 HydrophobicContact CG2-CG 4.37Å; I153-L157 WeakPolarHBondContact O-CG 3.48Å; I153-L157 PolarHBondContact O-N 3.34Å; I153-F184 HydrophobicContact CD1-CB 3.83Å; I153-F184 WeakPolarHBondContact CD1-O 3.41Å; I153-F184 HydrophobicContact CG1-CB 3.49Å; I153-F184 VanDerWaalsContact CG1-CB 3.49Å; I153-T185 HydrophobicContact CD1-CG2 4.15Å; I153-T185 HydrophobicContact CG1-CG2 4.18Å; I153-T185 HydrophobicContact CG2-CG2 3.66Å; I153-K188 HydrophobicContact CD1-CB 3.85Å; I153-K188 HydrophobicContact CD1-CD 3.58Å; I153-K188 HydrophobicContact CD1-CG 4.36Å; I153-N222 HydrophobicContact CG2-CB 4.28Å
154D85Confident85.7Confident10 Ų1042.6 Ų42.65%0.05322%0.224CC..Hα-helixtrans-64.8-37.5-172.7-57.9-22.9000110.6F68 T150 L158 K188F68-D154 HydrophobicContact CD2-CB 4.24Å; F68-D154 HydrophobicContact CE2-CB 3.8Å; T150-D154 WeakPolarHBondContact CG2-OD2 3.42Å; T150-D154 VanDerWaalsContact O-CG 3.24Å; T150-D154 PolarHBondContact O-N 2.79Å; D154-L158 VanDerWaalsContact O-CB 3.31Å; D154-L158 WeakPolarHBondContact O-CB 3.45Å; D154-L158 PolarHBondContact O-N 3.02Å; D154-K188 IonicContact OD1-NZ 3.93Å
155L88.1Confident85.9Confident85 Ų8539 Ų3945%0.44520%0.204SC..Hα-helixtrans-68.4-41.1172.5-71.7178.1000112.7L151 I153 L157 L158 I159L151-L155 VanDerWaalsContact O-CB 3.24Å; L151-L155 WeakPolarHBondContact O-CB 3.38Å; L151-L155 WeakPolarHBondContact O-CG 3.36Å; L151-L155 PolarHBondContact O-N 2.8Å; I153-L155 VanDerWaalsContact C-N 3.29Å; I153-L155 PolarHBondContact O-N 3.16Å; L155-L157 VanDerWaalsContact C-N 3.3Å; L155-L157 PolarHBondContact O-N 2.63Å; L155-L158 PolarHBondContact O-N 3.04Å; L155-I159 VanDerWaalsContact O-CB 3.28Å; L155-I159 WeakPolarHBondContact O-CB 3.46Å; L155-I159 WeakPolarHBondContact O-CD1 3.48Å; L155-I159 WeakPolarHBondContact O-CG1 3.38Å; L155-I159 PolarHBondContact O-N 3.5Å
156T87.7Confident86.1Confident30 Ų3042.2 Ų42.218%0.18422%0.217CC..Hα-helixtrans-62.4-42178-61.50000110.6I152 I153 G160 I180 A181I152-T156 WeakPolarHBondContact O-CB 3.47Å; I152-T156 PolarHBondContact O-N 3.34Å; I152-T156 PolarHBondContact O-OG1 3.05Å; I153-T156 PolarHBondContact O-N 3.49Å; I153-T156 VanDerWaalsContact O-N 3.09Å; T156-G160 PolarHBondContact O-N 3.38Å; T156-I180 HydrophobicContact CG2-CG2 4.28Å; T156-A181 HydrophobicContact CG2-CB 4.3Å
157L87Confident86.1Confident10 Ų1046.3 Ų46.35%0.05224%0.238CC..Hα-helixtrans-65.3-51.7175-64.3174.4000110.1I153 L155 I159 G160 Q161 A181 N222 L225 W229I153-L157 HydrophobicContact CG2-CD1 3.84Å; I153-L157 HydrophobicContact CG2-CG 4.37Å; I153-L157 WeakPolarHBondContact O-CG 3.48Å; I153-L157 PolarHBondContact O-N 3.34Å; L155-L157 VanDerWaalsContact C-N 3.3Å; L155-L157 PolarHBondContact O-N 2.63Å; L157-I159 VanDerWaalsContact C-N 3.32Å; L157-I159 PolarHBondContact O-N 3.36Å; L157-G160 PolarHBondContact O-N 2.92Å; L157-G160 VanDerWaalsContact O-N 3.13Å; L157-Q161 PolarHBondContact O-N 2.96Å; L157-A181 HydrophobicContact CD2-CB 4.22Å; L157-N222 HydrophobicContact CD1-CB 4.43Å; L157-N222 WeakPolarHBondContact CD1-OD1 3.49Å; L157-L225 HydrophobicContact CD1-CD2 4.31Å; L157-L225 HydrophobicContact CD2-CD2 4.45Å; L157-W229 HydrophobicContact CB-CH2 3.96Å; L157-W229 HydrophobicContact CB-CZ3 4.14Å; L157-W229 HydrophobicContact CD2-CD2 4.45Å; L157-W229 HydrophobicContact CD2-CE3 3.75Å; L157-W229 HydrophobicContact CD2-CH2 3.87Å; L157-W229 HydrophobicContact CD2-CZ3 3.44Å; L157-W229 VanDerWaalsContact CD2-CZ3 3.44Å; L157-W229 HydrophobicContact CG-CZ3 4.38Å; L157-W229 WeakPolarHBondContact O-CH2 3.36Å
158L87.3Confident85.9Confident51 Ų5150.9 Ų50.927%0.26726%0.263SS..Hα-helixtrans-56.7-44.5179.1-172.169.9000112.7F68 D154 L155 S162F68-L158 HydrophobicContact CE1-CD2 4.43Å; D154-L158 VanDerWaalsContact O-CB 3.31Å; D154-L158 WeakPolarHBondContact O-CB 3.45Å; D154-L158 PolarHBondContact O-N 3.02Å; L155-L158 PolarHBondContact O-N 3.04Å; L158-S162 WeakPolarHBondContact O-CB 3.26Å; L158-S162 PolarHBondContact O-N 3.16Å; L158-S162 PolarHBondContact O-OG 2.91Å
159I89.2Confident85.4Confident93 Ų9347.4 Ų47.448%0.47725%0.25SS..Hα-helixtrans-67.1-43.2177.6-67.8165.7000110.7L155 L157 Q161 S162 L163L155-I159 VanDerWaalsContact O-CB 3.28Å; L155-I159 WeakPolarHBondContact O-CB 3.46Å; L155-I159 WeakPolarHBondContact O-CD1 3.48Å; L155-I159 WeakPolarHBondContact O-CG1 3.38Å; L155-I159 PolarHBondContact O-N 3.5Å; L157-I159 VanDerWaalsContact C-N 3.32Å; L157-I159 PolarHBondContact O-N 3.36Å; I159-Q161 PolarHBondContact O-N 3.28Å; I159-S162 WeakPolarHBondContact O-CB 3.26Å; I159-S162 PolarHBondContact O-N 2.82Å; I159-L163 HydrophobicContact CG2-CD1 3.75Å; I159-L163 HydrophobicContact CG2-CG 4.14Å; I159-L163 WeakPolarHBondContact O-CB 3.39Å; I159-L163 WeakPolarHBondContact O-CG 3.37Å; I159-L163 PolarHBondContact O-N 3.04Å
160G85.5Confident84.9Confident3 Ų350 Ų503%0.03126%0.263CS..Hα-helixtrans-58.9-47177.200000112T156 L157 L163 Y164T156-G160 PolarHBondContact O-N 3.38Å; L157-G160 PolarHBondContact O-N 2.92Å; L157-G160 VanDerWaalsContact O-N 3.13Å; G160-L163 PolarHBondContact O-N 3.49Å; G160-Y164 WeakPolarHBondContact O-CB 3.49Å; G160-Y164 PolarHBondContact O-N 2.94Å
161Q85.8Confident84.8Confident12 Ų1252.1 Ų52.16%0.05628%0.275CS..Hα-helixtrans-63.3-42.4174.6-173.4163.960.300111.2L60 S64 L157 I159 Y164 F165 W229L60-Q161 VanDerWaalsContact CD2-NE2 3.34Å; S64-Q161 PolarHBondContact OG-OE1 3.13Å; L157-Q161 PolarHBondContact O-N 2.96Å; I159-Q161 PolarHBondContact O-N 3.28Å; Q161-Y164 PolarHBondContact O-N 2.97Å; Q161-F165 HydrophobicContact CG-CD2 4.38Å; Q161-F165 HydrophobicContact CG-CE2 4.01Å; Q161-F165 WeakPolarHBondContact O-CD2 3.29Å; Q161-F165 PolarHBondContact O-N 3.48Å; Q161-W229 HydrophobicContact CB-CH2 3.89Å; Q161-W229 HydrophobicContact CB-CZ2 4.09Å
162S85.1Confident84.8Confident27 Ų2752.5 Ų52.519%0.18928%0.279CS..Hα-helixtrans-60.5-49.4177.8-58.40000112.7W61 L158 I159 Y164 F165 I166W61-S162 VanDerWaalsContact CH2-CA 3.49Å; W61-S162 WeakPolarHBondContact CH2-OG 3.4Å; L158-S162 WeakPolarHBondContact O-CB 3.26Å; L158-S162 PolarHBondContact O-N 3.16Å; L158-S162 PolarHBondContact O-OG 2.91Å; I159-S162 WeakPolarHBondContact O-CB 3.26Å; I159-S162 PolarHBondContact O-N 2.82Å; S162-Y164 VanDerWaalsContact C-N 3.32Å; S162-Y164 PolarHBondContact O-N 3.28Å; S162-F165 PolarHBondContact O-N 3.41Å; S162-I166 WeakPolarHBondContact O-CG1 3.46Å; S162-I166 PolarHBondContact O-N 3.17Å; S162-I166 VanDerWaalsContact O-N 3.1Å
163L86.6Confident84.8Confident71 Ų7149.9 Ų49.937%0.37227%0.266SS..Hα-helixtrans-66.5-33.8-179.6-73.1176000112.1I159 G160 F165 I166 L167 V173I159-L163 HydrophobicContact CG2-CD1 3.75Å; I159-L163 HydrophobicContact CG2-CG 4.14Å; I159-L163 WeakPolarHBondContact O-CB 3.39Å; I159-L163 WeakPolarHBondContact O-CG 3.37Å; I159-L163 PolarHBondContact O-N 3.04Å; G160-L163 PolarHBondContact O-N 3.49Å; L163-F165 VanDerWaalsContact C-N 3.29Å; L163-F165 PolarHBondContact O-N 2.69Å; L163-I166 PolarHBondContact O-N 3.5Å; L163-L167 HydrophobicContact CB-CD1 4.36Å; L163-L167 VanDerWaalsContact O-CB 3.24Å; L163-L167 WeakPolarHBondContact O-CB 3.39Å; L163-L167 WeakPolarHBondContact O-CG 3.07Å; L163-L167 PolarHBondContact O-N 3.32Å; L163-V173 HydrophobicContact CB-CG1 3.54Å; L163-V173 HydrophobicContact CD1-CG1 4.49Å
164Y83.9Confident84.8Confident14 Ų1450 Ų506%0.05527%0.267CS..Hα-helixtrans-56.9-43.3174.7177.3-105.4000111.8L108 G160 Q161 S162 N169 N170 L174L108-Y164 HydrophobicContact CD1-CE1 4.49Å; G160-Y164 WeakPolarHBondContact O-CB 3.49Å; G160-Y164 PolarHBondContact O-N 2.94Å; Q161-Y164 PolarHBondContact O-N 2.97Å; S162-Y164 VanDerWaalsContact C-N 3.32Å; S162-Y164 PolarHBondContact O-N 3.28Å; Y164-N169 HydrophobicContact CE1-CB 4.22Å; Y164-N169 VanDerWaalsContact CE2-CA 3.49Å; Y164-N169 HydrophobicContact CE2-CB 4.02Å; Y164-N169 WeakPolarHBondContact CE2-O 3.21Å; Y164-N169 VanDerWaalsContact O-CA 3.3Å; Y164-N169 WeakPolarHBondContact O-CA 3.39Å; Y164-N169 PolarHBondContact O-N 2.87Å; Y164-N170 WeakPolarHBondContact CD2-O 3.35Å; Y164-L174 HydrophobicContact CD1-CD1 4.21Å; Y164-L174 HydrophobicContact CD2-CD1 3.44Å; Y164-L174 VanDerWaalsContact CD2-CD1 3.44Å; Y164-L174 HydrophobicContact CD2-CD2 4.29Å; Y164-L174 HydrophobicContact CD2-CG 3.52Å; Y164-L174 HydrophobicContact CE1-CD1 4.3Å; Y164-L174 HydrophobicContact CE2-CD1 3.53Å; Y164-L174 HydrophobicContact CE2-CG 4.12Å; Y164-L174 HydrophobicContact CG-CD1 3.78Å; Y164-L174 HydrophobicContact CG-CD2 4.06Å; Y164-L174 HydrophobicContact CG-CG 3.8Å
165F81.6Confident85.1Confident42 Ų4250.6 Ų50.618%0.18427%0.271CS..Hα-helixtrans-73.5-40.5177.2-73.7-70.6000113.3K57 L60 W61 Q161 S162 L163 N168K57-F165 HydrophobicContact CB-CE1 4.13Å; K57-F165 HydrophobicContact CD-CD1 4.14Å; K57-F165 HydrophobicContact CD-CE1 3.84Å; K57-F165 HydrophobicContact CG-CE1 4.08Å; L60-F165 HydrophobicContact CD2-CE2 3.82Å; L60-F165 HydrophobicContact CD2-CZ 3.62Å; W61-F165 AromaticContact CD1-CE2 3.98Å; W61-F165 AromaticContact CE2-CD2 3.56Å; W61-F165 HydrophobicContact CZ2-CB 4.27Å; W61-F165 AromaticContact CZ2-CD2 3.67Å; W61-F165 HydrophobicContact CZ2-CD2 3.67Å; W61-F165 HydrophobicContact CZ2-CE2 4.48Å; W61-F165 HydrophobicContact CZ2-CG 4.29Å; W61-F165 AromaticContact NE1-CD2 3.04Å; W61-F165 AromaticContact NE1-CE2 3.28Å; W61-F165 VanDerWaalsContact NE1-CE2 3.28Å; W61-F165 AromaticContact NE1-CG 3.55Å; W61-F165 AromaticContact NE1-CZ 3.95Å; Q161-F165 HydrophobicContact CG-CD2 4.38Å; Q161-F165 HydrophobicContact CG-CE2 4.01Å; Q161-F165 WeakPolarHBondContact O-CD2 3.29Å; Q161-F165 PolarHBondContact O-N 3.48Å; S162-F165 PolarHBondContact O-N 3.41Å; L163-F165 VanDerWaalsContact C-N 3.29Å; L163-F165 PolarHBondContact O-N 2.69Å; F165-N168 PolarHBondContact O-N 3.47Å
166I84.9Confident85.2Confident131 Ų13150.5 Ų50.567%0.67227%0.274SS*.Hα-helixtrans-66.1-40.2180-67166.6000110.9S162 L163 N168S162-I166 WeakPolarHBondContact O-CG1 3.46Å; S162-I166 PolarHBondContact O-N 3.17Å; S162-I166 VanDerWaalsContact O-N 3.1Å; L163-I166 PolarHBondContact O-N 3.5Å; I166-N168 PolarHBondContact O-N 3.42Å
167L83.5Confident85.4Confident90 Ų9049.5 Ų49.547%0.47127%0.269SS..THydrogen-bonded Turntrans-88.128.4-178.5-61173.5000112.8L163 N169 N170 V173L163-L167 HydrophobicContact CB-CD1 4.36Å; L163-L167 VanDerWaalsContact O-CB 3.24Å; L163-L167 WeakPolarHBondContact O-CB 3.39Å; L163-L167 WeakPolarHBondContact O-CG 3.07Å; L163-L167 PolarHBondContact O-N 3.32Å; L167-N169 PolarHBondContact O-N 2.94Å; L167-N170 HydrophobicContact CB-CB 4.19Å; L167-N170 WeakPolarHBondContact O-CB 3.41Å; L167-N170 PolarHBondContact O-N 3.21Å; L167-V173 HydrophobicContact CB-CG2 4.5Å; L167-V173 HydrophobicContact CD1-CG2 3.6Å
168N79.4Confident85.5Confident139 Ų13949 Ų4974%0.74327%0.266SS*.THydrogen-bonded Turntrans53.553.1174.1-164.737000114F165 I166 N170F165-N168 PolarHBondContact O-N 3.47Å; I166-N168 PolarHBondContact O-N 3.42Å; N168-N170 PolarHBondContact O-N 3.13Å
169N75Confident85.7Confident44 Ų4449.4 Ų49.424%0.23528%0.276CS..SBendtrans62.237.2177.8-61-8.4000113.7Y164 L167 N171Y164-N169 HydrophobicContact CE1-CB 4.22Å; Y164-N169 VanDerWaalsContact CE2-CA 3.49Å; Y164-N169 HydrophobicContact CE2-CB 4.02Å; Y164-N169 WeakPolarHBondContact CE2-O 3.21Å; Y164-N169 VanDerWaalsContact O-CA 3.3Å; Y164-N169 WeakPolarHBondContact O-CA 3.39Å; Y164-N169 PolarHBondContact O-N 2.87Å; L167-N169 PolarHBondContact O-N 2.94Å; N169-N171 PolarHBondContact O-N 3.45Å; N169-N171 VanDerWaalsContact O-N 3.11Å; N169-N171 PolarHBondContact O-OD1 3.01Å; N169-N171 VanDerWaalsContact O-OD1 3.14Å
170N78.1Confident85.9Confident67 Ų6749.1 Ų49.136%0.35828%0.275SS..  trans-71.1108.2176.3-172.9-0.1000111.5Y164 L167 N168 T172 V173Y164-N170 WeakPolarHBondContact CD2-O 3.35Å; L167-N170 HydrophobicContact CB-CB 4.19Å; L167-N170 WeakPolarHBondContact O-CB 3.41Å; L167-N170 PolarHBondContact O-N 3.21Å; N168-N170 PolarHBondContact O-N 3.13Å; N170-T172 VanDerWaalsContact CG-OG1 3.29Å; N170-T172 PolarHBondContact ND2-OG1 3.4Å; N170-T172 VanDerWaalsContact ND2-OG1 3.11Å; N170-T172 PolarHBondContact O-N 3.41Å; N170-T172 VanDerWaalsContact O-N 3.14Å; N170-T172 VanDerWaalsContact OD1-CG2 3.27Å; N170-T172 WeakPolarHBondContact OD1-CG2 3.48Å; N170-T172 PolarHBondContact OD1-N 2.88Å; N170-T172 VanDerWaalsContact OD1-N 3.14Å; N170-T172 PolarHBondContact OD1-OG1 2.96Å; N170-T172 VanDerWaalsContact OD1-OG1 3.07Å; N170-V173 HydrophobicContact CB-CG2 4.01Å; N170-V173 WeakPolarHBondContact O-CB 3.41Å; N170-V173 PolarHBondContact O-N 3.15Å; N170-V173 VanDerWaalsContact O-N 3.13Å
171N82.8Confident86.2Confident54 Ų5449 Ų4929%0.28927%0.273SS..Hα-helixtrans-56.2-30.4-179.3-60.4-9.5000113.5N169 V173 L174 T175 T232 L236N169-N171 PolarHBondContact O-N 3.45Å; N169-N171 VanDerWaalsContact O-N 3.11Å; N169-N171 PolarHBondContact O-OD1 3.01Å; N169-N171 VanDerWaalsContact O-OD1 3.14Å; N171-V173 PolarHBondContact O-N 3.17Å; N171-L174 PolarHBondContact O-N 3Å; N171-T175 PolarHBondContact O-N 2.87Å; N171-T232 HydrophobicContact CB-CG2 3.73Å; N171-L236 HydrophobicContact CB-CD1 4.29Å; N171-L236 WeakPolarHBondContact ND2-CD1 3.33Å; N171-L236 WeakPolarHBondContact OD1-CD1 3.4Å
172T86.3Confident86.6Confident53 Ų5351 Ų5133%0.32528%0.284SS..Hα-helixtrans-61.2-32.4-178.372.70000111.5N170 T175 V176 Y233N170-T172 VanDerWaalsContact CG-OG1 3.29Å; N170-T172 PolarHBondContact ND2-OG1 3.4Å; N170-T172 VanDerWaalsContact ND2-OG1 3.11Å; N170-T172 PolarHBondContact O-N 3.41Å; N170-T172 VanDerWaalsContact O-N 3.14Å; N170-T172 VanDerWaalsContact OD1-CG2 3.27Å; N170-T172 WeakPolarHBondContact OD1-CG2 3.48Å; N170-T172 PolarHBondContact OD1-N 2.88Å; N170-T172 VanDerWaalsContact OD1-N 3.14Å; N170-T172 PolarHBondContact OD1-OG1 2.96Å; N170-T172 VanDerWaalsContact OD1-OG1 3.07Å; T172-T175 PolarHBondContact O-N 3.22Å; T172-V176 WeakPolarHBondContact O-CB 3.45Å; T172-V176 VanDerWaalsContact O-CG2 3.24Å; T172-V176 WeakPolarHBondContact O-CG2 3.5Å; T172-V176 PolarHBondContact O-N 3.03Å; T172-Y233 WeakPolarHBondContact CA-OH 3.45Å; T172-Y233 WeakPolarHBondContact CB-OH 3.33Å; T172-Y233 HydrophobicContact CG2-CE1 4.38Å; T172-Y233 WeakPolarHBondContact CG2-OH 3.3Å
173V89.5Confident87Confident21 Ų2153.1 Ų53.113%0.12730%0.297CS..Hα-helixtrans-66.5-46.4-177.3179.40000110.9L163 L167 N170 N171 V176 A177L163-V173 HydrophobicContact CB-CG1 3.54Å; L163-V173 HydrophobicContact CD1-CG1 4.49Å; L167-V173 HydrophobicContact CB-CG2 4.5Å; L167-V173 HydrophobicContact CD1-CG2 3.6Å; N170-V173 HydrophobicContact CB-CG2 4.01Å; N170-V173 WeakPolarHBondContact O-CB 3.41Å; N170-V173 PolarHBondContact O-N 3.15Å; N170-V173 VanDerWaalsContact O-N 3.13Å; N171-V173 PolarHBondContact O-N 3.17Å; V173-V176 PolarHBondContact O-N 2.83Å; V173-A177 VanDerWaalsContact O-CB 3.32Å; V173-A177 WeakPolarHBondContact O-CB 3.39Å; V173-A177 PolarHBondContact O-N 3.29Å
174L89.2Confident87.3Confident2 Ų253.3 Ų53.31%0.0130%0.295CS..Hα-helixtrans-64.3-45178.7-69.2175.8000110.8Y164 N171 V176 A177 G178 W229 T232Y164-L174 HydrophobicContact CD1-CD1 4.21Å; Y164-L174 HydrophobicContact CD2-CD1 3.44Å; Y164-L174 VanDerWaalsContact CD2-CD1 3.44Å; Y164-L174 HydrophobicContact CD2-CD2 4.29Å; Y164-L174 HydrophobicContact CD2-CG 3.52Å; Y164-L174 HydrophobicContact CE1-CD1 4.3Å; Y164-L174 HydrophobicContact CE2-CD1 3.53Å; Y164-L174 HydrophobicContact CE2-CG 4.12Å; Y164-L174 HydrophobicContact CG-CD1 3.78Å; Y164-L174 HydrophobicContact CG-CD2 4.06Å; Y164-L174 HydrophobicContact CG-CG 3.8Å; N171-L174 PolarHBondContact O-N 3Å; L174-V176 PolarHBondContact O-N 3.21Å; L174-A177 PolarHBondContact O-N 2.92Å; L174-G178 PolarHBondContact O-N 3.41Å; L174-W229 HydrophobicContact CB-CB 4.34Å; L174-W229 HydrophobicContact CB-CG 4.37Å; L174-W229 HydrophobicContact CD2-CD2 3.85Å; L174-W229 HydrophobicContact CD2-CE3 4.08Å; L174-W229 HydrophobicContact CD2-CG 4.29Å; L174-W229 HydrophobicContact CD2-CH2 4.44Å; L174-W229 HydrophobicContact CD2-CZ2 4.2Å; L174-W229 HydrophobicContact CD2-CZ3 4.35Å; L174-T232 HydrophobicContact CB-CG2 4.32Å; L174-T232 HydrophobicContact CD1-CG2 4.13Å
175T89.6Confident87.7Confident23 Ų2352.8 Ų52.814%0.14129%0.293CS..Hα-helixtrans-63.9-41.6179-59.30000112.3N171 T172 G178 A179 W229 Y233N171-T175 PolarHBondContact O-N 2.87Å; T172-T175 PolarHBondContact O-N 3.22Å; T175-G178 PolarHBondContact O-N 3.39Å; T175-A179 VanDerWaalsContact O-CB 3.27Å; T175-A179 WeakPolarHBondContact O-CB 3.47Å; T175-A179 PolarHBondContact O-N 3.48Å; T175-W229 VanDerWaalsContact CA-O 3.31Å; T175-W229 WeakPolarHBondContact CA-O 3.46Å; T175-W229 PolarHBondContact N-O 3.45Å; T175-W229 PolarHBondContact OG1-O 2.71Å; T175-Y233 HydrophobicContact CG2-CD2 3.77Å; T175-Y233 HydrophobicContact CG2-CE2 3.75Å; T175-Y233 WeakPolarHBondContact OG1-CD2 3.27Å; T175-Y233 WeakPolarHBondContact OG1-CE2 3.41Å
176V90.9Very high88.2Confident84 Ų8453.3 Ų53.351%0.50930%0.298SS..Hα-helixtrans-65.5-45.2176.3170.80000110.9T172 V173 L174 G178 A179 I180T172-V176 WeakPolarHBondContact O-CB 3.45Å; T172-V176 VanDerWaalsContact O-CG2 3.24Å; T172-V176 WeakPolarHBondContact O-CG2 3.5Å; T172-V176 PolarHBondContact O-N 3.03Å; V173-V176 PolarHBondContact O-N 2.83Å; L174-V176 PolarHBondContact O-N 3.21Å; V176-G178 VanDerWaalsContact C-N 3.34Å; V176-G178 PolarHBondContact O-N 3.01Å; V176-A179 PolarHBondContact O-N 3.24Å; V176-I180 HydrophobicContact CG1-CD1 3.83Å; V176-I180 VanDerWaalsContact O-CG1 3.28Å; V176-I180 WeakPolarHBondContact O-CG1 3.38Å; V176-I180 PolarHBondContact O-N 2.98Å
177A91.4Very high88.5Confident9 Ų951.3 Ų51.37%0.07429%0.285CS..Hα-helixtrans-60.9-43.6176.800000111.7V173 L174 I180 A181 W229V173-A177 VanDerWaalsContact O-CB 3.32Å; V173-A177 WeakPolarHBondContact O-CB 3.39Å; V173-A177 PolarHBondContact O-N 3.29Å; L174-A177 PolarHBondContact O-N 2.92Å; A177-I180 PolarHBondContact O-N 3.33Å; A177-A181 VanDerWaalsContact O-CB 3.31Å; A177-A181 WeakPolarHBondContact O-CB 3.28Å; A177-A181 PolarHBondContact O-N 2.86Å; A177-W229 HydrophobicContact CB-CE3 4.12Å; A177-W229 HydrophobicContact CB-CZ3 4.14Å
178G90.6Very high88.9Confident0 Ų047.2 Ų47.20%026%0.263CS..Hα-helixtrans-64.2-44176.100000112.5L174 T175 V176 I180 A181 L182 T226L174-G178 PolarHBondContact O-N 3.41Å; T175-G178 PolarHBondContact O-N 3.39Å; V176-G178 VanDerWaalsContact C-N 3.34Å; V176-G178 PolarHBondContact O-N 3.01Å; G178-I180 VanDerWaalsContact C-N 3.3Å; G178-I180 PolarHBondContact O-N 3.35Å; G178-A181 PolarHBondContact O-N 2.86Å; G178-L182 WeakPolarHBondContact O-CB 3.18Å; G178-L182 PolarHBondContact O-N 2.93Å; G178-T226 WeakPolarHBondContact O-CG2 3.4Å
179A91.9Very high89.5Confident58 Ų5840.7 Ų40.748%0.47923%0.228SC..Hα-helixtrans-61.6-38.9177.400000112.2T175 V176 P183T175-A179 VanDerWaalsContact O-CB 3.27Å; T175-A179 WeakPolarHBondContact O-CB 3.47Å; T175-A179 PolarHBondContact O-N 3.48Å; V176-A179 PolarHBondContact O-N 3.24Å; A179-P183 WeakPolarHBondContact O-CD 3.46Å
180I92Very high90.3Very high88 Ų8841 Ų4145%0.45123%0.23SC..Hα-helixtrans-68-43174.3-66.8166.6000110.6T156 V176 A177 G178 P183 F184T156-I180 HydrophobicContact CG2-CG2 4.28Å; V176-I180 HydrophobicContact CG1-CD1 3.83Å; V176-I180 VanDerWaalsContact O-CG1 3.28Å; V176-I180 WeakPolarHBondContact O-CG1 3.38Å; V176-I180 PolarHBondContact O-N 2.98Å; A177-I180 PolarHBondContact O-N 3.33Å; G178-I180 VanDerWaalsContact C-N 3.3Å; G178-I180 PolarHBondContact O-N 3.35Å; I180-P183 WeakPolarHBondContact O-CD 3.36Å; I180-P183 WeakPolarHBondContact O-CG 3.47Å; I180-F184 HydrophobicContact CG2-CE2 4.45Å; I180-F184 WeakPolarHBondContact O-CD2 3.47Å
181A93.2Very high90.9Very high0 Ų038 Ų380%021%0.213CC..Hα-helixtrans-71.8-30.5-17600000113.7T156 L157 A177 G178 F184 T185 T226T156-A181 HydrophobicContact CG2-CB 4.3Å; L157-A181 HydrophobicContact CD2-CB 4.22Å; A177-A181 VanDerWaalsContact O-CB 3.31Å; A177-A181 WeakPolarHBondContact O-CB 3.28Å; A177-A181 PolarHBondContact O-N 2.86Å; G178-A181 PolarHBondContact O-N 2.86Å; A181-F184 PolarHBondContact O-N 3.5Å; A181-F184 VanDerWaalsContact O-N 3.08Å; A181-T185 WeakPolarHBondContact O-CG2 3.34Å; A181-T185 PolarHBondContact O-N 2.89Å; A181-T185 PolarHBondContact O-OG1 2.79Å; A181-T226 HydrophobicContact CB-CG2 4.04Å
182L93Very high91.3Very high53 Ų5335.8 Ų35.828%0.27720%0.201SC..Hα-helixtrans-53.5-51.5-173.9-174.2147.7000115.1G178 F184 T185 L186 T226 L227 I230G178-L182 WeakPolarHBondContact O-CB 3.18Å; G178-L182 PolarHBondContact O-N 2.93Å; L182-F184 PolarHBondContact O-N 3.31Å; L182-T185 WeakPolarHBondContact CA-OG1 3.44Å; L182-T185 PolarHBondContact O-N 2.67Å; L182-T185 PolarHBondContact O-OG1 3.45Å; L182-L186 HydrophobicContact CD2-CD1 3.59Å; L182-L186 HydrophobicContact CD2-CG 4.33Å; L182-L186 HydrophobicContact CG-CD1 4.27Å; L182-L186 WeakPolarHBondContact O-CG 3.17Å; L182-L186 PolarHBondContact O-N 3.31Å; L182-T226 HydrophobicContact CB-CG2 3.78Å; L182-L227 HydrophobicContact CD1-CD2 4.27Å; L182-I230 HydrophobicContact CB-CD1 3.92Å; L182-I230 HydrophobicContact CD1-CD1 3.29Å; L182-I230 HydrophobicContact CG-CD1 4.23Å
183P92.8Very high91.5Very high72 Ų7233.2 Ų33.247%0.46819%0.186SC..Hα-helixtrans-61.3-35.9178.423-34.3000112.1A179 I180 F187A179-P183 WeakPolarHBondContact O-CD 3.46Å; I180-P183 WeakPolarHBondContact O-CD 3.36Å; I180-P183 WeakPolarHBondContact O-CG 3.47Å; P183-F187 WeakPolarHBondContact O-CB 3.46Å; P183-F187 PolarHBondContact O-N 3.16Å
184F92.7Very high91.5Very high75 Ų7532.5 Ų32.533%0.32918%0.181SC..Hα-helixtrans-71.6-42.1178.9-63.2-71.9000112V149 I153 I180 A181 L182 L186 F187 K188V149-F184 HydrophobicContact CG1-CB 4.13Å; V149-F184 HydrophobicContact CG1-CD1 4.27Å; I153-F184 HydrophobicContact CD1-CB 3.83Å; I153-F184 WeakPolarHBondContact CD1-O 3.41Å; I153-F184 HydrophobicContact CG1-CB 3.49Å; I153-F184 VanDerWaalsContact CG1-CB 3.49Å; I180-F184 HydrophobicContact CG2-CE2 4.45Å; I180-F184 WeakPolarHBondContact O-CD2 3.47Å; A181-F184 PolarHBondContact O-N 3.5Å; A181-F184 VanDerWaalsContact O-N 3.08Å; L182-F184 PolarHBondContact O-N 3.31Å; F184-L186 PolarHBondContact O-N 3.08Å; F184-F187 PolarHBondContact O-N 3.05Å; F184-K188 WeakPolarHBondContact O-CB 3.35Å; F184-K188 PolarHBondContact O-N 3.17Å
185T93.7Very high91.5Very high3 Ų332.8 Ų32.82%0.01818%0.182CC..Hα-helixtrans-64.4-40.3177.754.30000111.8I153 A181 L182 K188 L189 N222I153-T185 HydrophobicContact CD1-CG2 4.15Å; I153-T185 HydrophobicContact CG1-CG2 4.18Å; I153-T185 HydrophobicContact CG2-CG2 3.66Å; A181-T185 WeakPolarHBondContact O-CG2 3.34Å; A181-T185 PolarHBondContact O-N 2.89Å; A181-T185 PolarHBondContact O-OG1 2.79Å; L182-T185 WeakPolarHBondContact CA-OG1 3.44Å; L182-T185 PolarHBondContact O-N 2.67Å; L182-T185 PolarHBondContact O-OG1 3.45Å; T185-K188 PolarHBondContact O-N 2.94Å; T185-L189 VanDerWaalsContact O-CB 3.28Å; T185-L189 WeakPolarHBondContact O-CB 3.1Å; T185-L189 PolarHBondContact O-N 2.86Å; T185-N222 HydrophobicContact CG2-CB 4Å
186L92.6Very high91.4Very high53 Ų5332.1 Ų32.128%0.27718%0.178SC..Hα-helixtrans-65.4-43174-67.6-180000112.2L124 I128 L182 F184 L189 L190L124-L186 HydrophobicContact CD1-CD2 4.43Å; I128-L186 HydrophobicContact CD1-CD2 4.29Å; L182-L186 HydrophobicContact CD2-CD1 3.59Å; L182-L186 HydrophobicContact CD2-CG 4.33Å; L182-L186 HydrophobicContact CG-CD1 4.27Å; L182-L186 WeakPolarHBondContact O-CG 3.17Å; L182-L186 PolarHBondContact O-N 3.31Å; F184-L186 PolarHBondContact O-N 3.08Å; L186-L189 PolarHBondContact O-N 3.35Å; L186-L190 VanDerWaalsContact O-CB 3.28Å; L186-L190 WeakPolarHBondContact O-CB 3.35Å; L186-L190 PolarHBondContact O-N 3.41Å
187F91Very high91.1Very high90 Ų9030.4 Ų30.440%0.39516%0.164SC..Hα-helixtrans-61.9-47176178.1-94.5000111.7V149 P183 F184 L189 L190 Y191V149-F187 HydrophobicContact CG1-CD1 4.17Å; V149-F187 HydrophobicContact CG2-CD1 4.12Å; V149-F187 HydrophobicContact CG2-CE1 4.15Å; P183-F187 WeakPolarHBondContact O-CB 3.46Å; P183-F187 PolarHBondContact O-N 3.16Å; F184-F187 PolarHBondContact O-N 3.05Å; F187-L189 PolarHBondContact O-N 2.92Å; F187-L190 PolarHBondContact O-N 3.44Å; F187-Y191 WeakPolarHBondContact O-CB 3.28Å; F187-Y191 PolarHBondContact O-N 3.36Å
188K91.1Very high90.1Very high4 Ų430.6 Ų30.62%0.01717%0.167CC..Hα-helixtrans-58.9-46.9176.2-179.7179.2172.6-177.30110.8V149 T150 I153 D154 F184 T185 L190 Y191 E192 N222V149-K188 HydrophobicContact CG1-CB 4.21Å; T150-K188 VanDerWaalsContact CG2-NZ 3.28Å; T150-K188 WeakPolarHBondContact OG1-CD 3.47Å; T150-K188 WeakPolarHBondContact OG1-CE 3.19Å; I153-K188 HydrophobicContact CD1-CB 3.85Å; I153-K188 HydrophobicContact CD1-CD 3.58Å; I153-K188 HydrophobicContact CD1-CG 4.36Å; D154-K188 IonicContact OD1-NZ 3.93Å; F184-K188 WeakPolarHBondContact O-CB 3.35Å; F184-K188 PolarHBondContact O-N 3.17Å; T185-K188 PolarHBondContact O-N 2.94Å; K188-L190 PolarHBondContact O-N 3.36Å; K188-Y191 PolarHBondContact O-N 3.07Å; K188-E192 HydrophobicContact CG-CG 4.36Å; K188-E192 WeakPolarHBondContact O-CB 3.32Å; K188-E192 WeakPolarHBondContact O-CG 3.39Å; K188-E192 PolarHBondContact O-N 3.44Å; K188-N222 PolarHBondContact NZ-ND2 2.99Å
189L92.8Very high88.9Confident1 Ų133.5 Ų33.51%0.00520%0.196CC..Hα-helixtrans-61.5-43.8178.3178.156.4000111.8F125 I128 T185 L186 F187 Y191 E192 V193 C219F125-L189 HydrophobicContact CD2-CD1 3.5Å; F125-L189 HydrophobicContact CD2-CD2 4.08Å; F125-L189 HydrophobicContact CD2-CG 4.37Å; F125-L189 HydrophobicContact CE2-CD1 3.61Å; I128-L189 HydrophobicContact CD1-CB 4.22Å; I128-L189 HydrophobicContact CD1-CD2 3.43Å; I128-L189 VanDerWaalsContact CD1-CD2 3.43Å; I128-L189 HydrophobicContact CD1-CG 3.69Å; I128-L189 HydrophobicContact CG2-CG 4.39Å; T185-L189 VanDerWaalsContact O-CB 3.28Å; T185-L189 WeakPolarHBondContact O-CB 3.1Å; T185-L189 PolarHBondContact O-N 2.86Å; L186-L189 PolarHBondContact O-N 3.35Å; F187-L189 PolarHBondContact O-N 2.92Å; L189-Y191 VanDerWaalsContact C-N 3.33Å; L189-Y191 PolarHBondContact O-N 3.35Å; L189-E192 PolarHBondContact O-N 3.25Å; L189-V193 HydrophobicContact CD1-CG2 3.76Å; L189-V193 HydrophobicContact CG-CG2 4.4Å; L189-V193 VanDerWaalsContact O-CB 3.29Å; L189-V193 WeakPolarHBondContact O-CB 3.4Å; L189-V193 WeakPolarHBondContact O-CG2 3.5Å; L189-V193 PolarHBondContact O-N 2.99Å; L189-C219 HydrophobicContact CB-CB 4.15Å; L189-C219 HydrophobicContact CD1-CB 3.67Å; L189-C219 HydrophobicContact CG-CB 4.48Å
190L91.1Very high87.7Confident52 Ų5231 Ų3127%0.27218%0.177SC..Hα-helixtrans-62-41176.9-171.6151.6000111.7I128 I132 F139 L186 F187 K188 K194I128-L190 HydrophobicContact CG2-CB 4.22Å; I132-L190 HydrophobicContact CD1-CD2 3.95Å; I132-L190 HydrophobicContact CD1-CG 3.91Å; I132-L190 HydrophobicContact CG1-CG 4.49Å; F139-L190 HydrophobicContact CE1-CD2 4.1Å; F139-L190 HydrophobicContact CE2-CD2 3.42Å; F139-L190 VanDerWaalsContact CE2-CD2 3.42Å; F139-L190 HydrophobicContact CZ-CD2 3.17Å; F139-L190 HydrophobicContact CZ-CG 4.44Å; L186-L190 VanDerWaalsContact O-CB 3.28Å; L186-L190 WeakPolarHBondContact O-CB 3.35Å; L186-L190 PolarHBondContact O-N 3.41Å; F187-L190 PolarHBondContact O-N 3.44Å; K188-L190 PolarHBondContact O-N 3.36Å; L190-K194 WeakPolarHBondContact O-CB 3.3Å; L190-K194 PolarHBondContact O-N 2.84Å
191Y90Very high86.5Confident2 Ų233.7 Ų33.71%0.00819%0.188CC..Hα-helixtrans-65-50.5176.1-172.6-84.3000112.8F139 T140 Y143 N146 F187 K188 L189 V193 K194 M195F139-Y191 HydrophobicContact CD2-CD2 4.02Å; F139-Y191 HydrophobicContact CE2-CD2 4.26Å; T140-Y191 HydrophobicContact CG2-CE1 4.41Å; T140-Y191 PolarHBondContact O-OH 2.84Å; Y143-Y191 WeakPolarHBondContact CA-OH 3.49Å; Y143-Y191 PolarHBondContact N-OH 2.95Å; N146-Y191 HydrophobicContact CB-CD1 3.65Å; N146-Y191 HydrophobicContact CB-CD2 4.34Å; N146-Y191 HydrophobicContact CB-CE1 3.52Å; N146-Y191 HydrophobicContact CB-CE2 4.23Å; N146-Y191 HydrophobicContact CB-CG 4.09Å; N146-Y191 VanDerWaalsContact CG-CE1 3.49Å; N146-Y191 WeakPolarHBondContact ND2-CD1 3.44Å; N146-Y191 WeakPolarHBondContact ND2-CE1 3.39Å; N146-Y191 WeakPolarHBondContact OD1-CD1 3.38Å; F187-Y191 WeakPolarHBondContact O-CB 3.28Å; F187-Y191 PolarHBondContact O-N 3.36Å; K188-Y191 PolarHBondContact O-N 3.07Å; L189-Y191 VanDerWaalsContact C-N 3.33Å; L189-Y191 PolarHBondContact O-N 3.35Å; Y191-V193 PolarHBondContact O-N 2.73Å; Y191-K194 WeakPolarHBondContact O-CA 3.38Å; Y191-K194 WeakPolarHBondContact O-CB 3.34Å; Y191-K194 PolarHBondContact O-N 3.01Å; Y191-K194 VanDerWaalsContact O-N 3.09Å; Y191-M195 HydrophobicContact CD1-CG 3.93Å; Y191-M195 HydrophobicContact CD1-SD 4.15Å; Y191-M195 HydrophobicContact CE1-CE 4.2Å; Y191-M195 HydrophobicContact CE1-CG 3.67Å; Y191-M195 HydrophobicContact CE1-SD 3.32Å; Y191-M195 WeakPolarHBondContact CE1-SD 3.49Å; Y191-M195 VanDerWaalsContact O-CG 3.27Å; Y191-M195 WeakPolarHBondContact O-CG 3.45Å; Y191-M195 PolarHBondContact O-N 3.02Å
192E91Very high85.4Confident8 Ų839 Ų394%0.03721%0.211CC..Hα-helixtrans-68.4-37.6-177.6-66.6-66.3175.100112.1N146 K188 L189 K194 M195 V196 Y204 I215 L216 C219N146-E192 PolarHBondContact ND2-OE1 2.69Å; K188-E192 HydrophobicContact CG-CG 4.36Å; K188-E192 WeakPolarHBondContact O-CB 3.32Å; K188-E192 WeakPolarHBondContact O-CG 3.39Å; K188-E192 PolarHBondContact O-N 3.44Å; L189-E192 PolarHBondContact O-N 3.25Å; E192-K194 VanDerWaalsContact C-N 3.3Å; E192-K194 PolarHBondContact O-N 2.83Å; E192-M195 PolarHBondContact O-N 3.46Å; E192-M195 VanDerWaalsContact O-N 3.15Å; E192-M195 WeakPolarHBondContact OE2-CE 3.34Å; E192-V196 WeakPolarHBondContact O-CG2 3.3Å; E192-V196 PolarHBondContact O-N 3.4Å; E192-V196 VanDerWaalsContact O-N 3.1Å; E192-Y204 WeakPolarHBondContact OE2-CE2 3.32Å; E192-Y204 PolarHBondContact OE2-OH 3.09Å; E192-I215 HydrophobicContact CB-CG2 4.17Å; E192-I215 HydrophobicContact CG-CG2 3.7Å; E192-I215 WeakPolarHBondContact OE2-CG2 3.36Å; E192-L216 HydrophobicContact CB-CD2 4.25Å; E192-C219 VanDerWaalsContact CG-SG 3.57Å
193V91.9Very high84.8Confident0 Ų040.9 Ų40.90%021%0.214CC..Hα-helixtrans-62.7-37.9171172.80000110.6F125 I128 I129 I132 L189 Y191 M195 V196 F197 L216F125-V193 HydrophobicContact CE2-CG2 4.39Å; I128-V193 HydrophobicContact CG2-CB 4.02Å; I128-V193 HydrophobicContact CG2-CG1 4.16Å; I128-V193 HydrophobicContact CG2-CG2 4.06Å; I129-V193 HydrophobicContact CB-CG1 4.44Å; I129-V193 HydrophobicContact CG1-CG1 3.83Å; I129-V193 HydrophobicContact CG1-CG2 4.4Å; I132-V193 HydrophobicContact CB-CG1 4.02Å; I132-V193 HydrophobicContact CG1-CB 4.44Å; I132-V193 HydrophobicContact CG1-CG1 3.96Å; I132-V193 HydrophobicContact CG2-CG1 4.15Å; L189-V193 HydrophobicContact CD1-CG2 3.76Å; L189-V193 HydrophobicContact CG-CG2 4.4Å; L189-V193 VanDerWaalsContact O-CB 3.29Å; L189-V193 WeakPolarHBondContact O-CB 3.4Å; L189-V193 WeakPolarHBondContact O-CG2 3.5Å; L189-V193 PolarHBondContact O-N 2.99Å; Y191-V193 PolarHBondContact O-N 2.73Å; V193-M195 VanDerWaalsContact C-N 3.34Å; V193-M195 PolarHBondContact O-N 3.09Å; V193-V196 PolarHBondContact O-N 3.44Å; V193-F197 HydrophobicContact CG1-CD2 3.71Å; V193-F197 HydrophobicContact CG1-CE2 4.26Å; V193-F197 HydrophobicContact CG1-CG 4.37Å; V193-F197 WeakPolarHBondContact O-CB 3.44Å; V193-F197 WeakPolarHBondContact O-CD2 3.49Å; V193-F197 PolarHBondContact O-N 3.42Å; V193-L216 HydrophobicContact CG2-CD2 3.76Å
194K89.7Confident84.3Confident6 Ų638.9 Ų38.93%0.02620%0.197CC..Hα-helixtrans-63.8-37.6172.8-172.373.3-172.8171.20112.2I132 L135 Y137 F139 L190 Y191 E192 V196 G198I132-K194 HydrophobicContact CD1-CB 4.13Å; I132-K194 HydrophobicContact CD1-CD 4.11Å; I132-K194 HydrophobicContact CG2-CB 4.27Å; I132-K194 HydrophobicContact CG2-CD 3.81Å; L135-K194 PolarHBondContact O-NZ 2.88Å; Y137-K194 WeakPolarHBondContact O-CE 3.39Å; Y137-K194 PolarHBondContact O-NZ 2.66Å; F139-K194 HydrophobicContact CE1-CB 4.45Å; F139-K194 HydrophobicContact CE1-CD 3.99Å; F139-K194 HydrophobicContact CE1-CG 3.99Å; F139-K194 HydrophobicContact CE2-CB 3.95Å; F139-K194 HydrophobicContact CE2-CG 4.13Å; F139-K194 HydrophobicContact CZ-CB 3.63Å; F139-K194 HydrophobicContact CZ-CD 4.01Å; F139-K194 HydrophobicContact CZ-CG 3.66Å; L190-K194 WeakPolarHBondContact O-CB 3.3Å; L190-K194 PolarHBondContact O-N 2.84Å; Y191-K194 WeakPolarHBondContact O-CA 3.38Å; Y191-K194 WeakPolarHBondContact O-CB 3.34Å; Y191-K194 PolarHBondContact O-N 3.01Å; Y191-K194 VanDerWaalsContact O-N 3.09Å; E192-K194 VanDerWaalsContact C-N 3.3Å; E192-K194 PolarHBondContact O-N 2.83Å; K194-V196 VanDerWaalsContact C-N 3.29Å; K194-V196 PolarHBondContact O-N 3.29Å; K194-G198 VanDerWaalsContact CE-O 3.26Å; K194-G198 WeakPolarHBondContact CE-O 3.27Å; K194-G198 PolarHBondContact NZ-O 2.71Å; K194-G198 WeakPolarHBondContact O-CA 3.42Å; K194-G198 PolarHBondContact O-N 3Å
195M87.7Confident83.9Confident7 Ų737.7 Ų37.73%0.03420%0.199CC..Hα-helixtrans-67.8-28.6177.4-56.2-131.8-56.600113.3T140 Y191 E192 V193 R203 Y204T140-M195 HydrophobicContact CG2-CB 4.36Å; T140-M195 HydrophobicContact CG2-CG 3.42Å; T140-M195 VanDerWaalsContact CG2-CG 3.42Å; T140-M195 HydrophobicContact CG2-SD 3.31Å; T140-M195 WeakPolarHBondContact CG2-SD 3.48Å; Y191-M195 HydrophobicContact CD1-CG 3.93Å; Y191-M195 HydrophobicContact CD1-SD 4.15Å; Y191-M195 HydrophobicContact CE1-CE 4.2Å; Y191-M195 HydrophobicContact CE1-CG 3.67Å; Y191-M195 HydrophobicContact CE1-SD 3.32Å; Y191-M195 WeakPolarHBondContact CE1-SD 3.49Å; Y191-M195 VanDerWaalsContact O-CG 3.27Å; Y191-M195 WeakPolarHBondContact O-CG 3.45Å; Y191-M195 PolarHBondContact O-N 3.02Å; E192-M195 PolarHBondContact O-N 3.46Å; E192-M195 VanDerWaalsContact O-N 3.15Å; E192-M195 WeakPolarHBondContact OE2-CE 3.34Å; V193-M195 VanDerWaalsContact C-N 3.34Å; V193-M195 PolarHBondContact O-N 3.09Å; M195-R203 WeakPolarHBondContact O-CA 3.33Å; M195-R203 WeakPolarHBondContact O-CB 3.32Å; M195-Y204 HydrophobicContact CB-CD2 3.76Å; M195-Y204 HydrophobicContact CB-CE2 3.6Å; M195-Y204 HydrophobicContact CE-CD2 4.17Å; M195-Y204 HydrophobicContact CE-CE1 3.85Å; M195-Y204 HydrophobicContact CE-CE2 3.38Å; M195-Y204 WeakPolarHBondContact CE-OH 3.49Å; M195-Y204 HydrophobicContact CG-CE2 4.48Å; M195-Y204 PolarHBondContact O-N 3.47Å
196V89Confident83.3Confident9 Ų942.2 Ų42.26%0.05522%0.22CC..Hα-helixtrans-88.4-46.2178.8178.40000112.2F21 T22 A25 E192 V193 K194 Y204 A212 L216F21-V196 HydrophobicContact CE1-CG1 4.39Å; T22-V196 HydrophobicContact CG2-CG1 4.41Å; T22-V196 PolarHBondContact OG1-O 3.42Å; A25-V196 HydrophobicContact CB-CG1 4.25Å; E192-V196 WeakPolarHBondContact O-CG2 3.3Å; E192-V196 PolarHBondContact O-N 3.4Å; E192-V196 VanDerWaalsContact O-N 3.1Å; V193-V196 PolarHBondContact O-N 3.44Å; K194-V196 VanDerWaalsContact C-N 3.29Å; K194-V196 PolarHBondContact O-N 3.29Å; V196-Y204 HydrophobicContact CG2-CD2 3.61Å; V196-Y204 HydrophobicContact CG2-CE2 3.91Å; V196-A212 HydrophobicContact CG2-CB 3.97Å; V196-L216 HydrophobicContact CB-CD1 4.2Å; V196-L216 HydrophobicContact CG1-CD1 4.04Å; V196-L216 HydrophobicContact CG2-CD1 3.89Å; V196-L216 HydrophobicContact CG2-CD2 4.18Å; V196-L216 HydrophobicContact CG2-CG 3.99Å
197F84.4Confident82.9Confident48 Ų4846.2 Ų46.221%0.21124%0.238CC..Hα-helixtrans-101.2-22.1-172.5-67.4-99000113.8T22 L26 I129 I132 V193 G199 L216T22-F197 HydrophobicContact CG2-CD1 3.24Å; T22-F197 HydrophobicContact CG2-CD2 4.39Å; T22-F197 HydrophobicContact CG2-CE1 3.24Å; T22-F197 HydrophobicContact CG2-CE2 4.4Å; T22-F197 HydrophobicContact CG2-CG 3.85Å; T22-F197 HydrophobicContact CG2-CZ 3.86Å; L26-F197 HydrophobicContact CB-CZ 4.24Å; L26-F197 HydrophobicContact CD1-CZ 4.21Å; L26-F197 HydrophobicContact CD2-CZ 4.3Å; L26-F197 HydrophobicContact CG-CZ 4.49Å; I129-F197 HydrophobicContact CD1-CE2 4.28Å; I129-F197 HydrophobicContact CD1-CZ 4.03Å; I129-F197 HydrophobicContact CG1-CE2 4.18Å; I129-F197 HydrophobicContact CG1-CZ 4.24Å; I129-F197 HydrophobicContact CG2-CD1 4.28Å; I129-F197 HydrophobicContact CG2-CE1 4.04Å; I129-F197 HydrophobicContact CG2-CZ 4.33Å; I132-F197 HydrophobicContact CG2-CB 4.28Å; V193-F197 HydrophobicContact CG1-CD2 3.71Å; V193-F197 HydrophobicContact CG1-CE2 4.26Å; V193-F197 HydrophobicContact CG1-CG 4.37Å; V193-F197 WeakPolarHBondContact O-CB 3.44Å; V193-F197 WeakPolarHBondContact O-CD2 3.49Å; V193-F197 PolarHBondContact O-N 3.42Å; F197-G199 PolarHBondContact O-N 3.12Å; F197-L216 HydrophobicContact CE2-CD1 4.27Å
198G68.9Low82.6Confident14 Ų1442.4 Ų42.414%0.14422%0.222CC..SBendtrans-90.75.6-154.400000118.6K194 G200K194-G198 VanDerWaalsContact CE-O 3.26Å; K194-G198 WeakPolarHBondContact CE-O 3.27Å; K194-G198 PolarHBondContact NZ-O 2.71Å; K194-G198 WeakPolarHBondContact O-CA 3.42Å; K194-G198 PolarHBondContact O-N 3Å; G198-G200 VanDerWaalsContact C-N 3.27Å; G198-G200 PolarHBondContact O-N 3.11Å
199G67.2Low82.5Confident60 Ų6044.3 Ų44.362%0.61923%0.232SC*.  trans62.223.3172.100000116.6F197F197-G199 PolarHBondContact O-N 3.12Å
200G65.9Low82.4Confident7 Ų744.9 Ų44.97%0.07224%0.236CC..  trans-85.7172.2-177.700000115.5D138 G198 F202D138-G200 WeakPolarHBondContact OD2-CA 3.4Å; G198-G200 VanDerWaalsContact C-N 3.27Å; G198-G200 PolarHBondContact O-N 3.11Å; G200-F202 VanDerWaalsContact C-N 3.25Å; G200-F202 PolarHBondContact O-N 3.01Å
201E66.1Low82.4Confident144 Ų14442.9 Ų42.967%0.67323%0.225SC*.THydrogen-bonded Turntrans-61.2-33.6178.7-72.5-178.7153.100112.4D138 K141D138-E201 PolarHBondContact OD2-N 3.49Å; K141-E201 WeakPolarHBondContact CE-OE2 3.39Å; K141-E201 IonicContact NZ-OE2 3.11Å; K141-E201 PolarHBondContact NZ-OE2 2.91Å
202F71.5Confident82.5Confident111 Ų11142.8 Ų42.849%0.48723%0.225SC..THydrogen-bonded Turntrans-105.941.4-174.8-66.7-83.2000112.7T140 K141 G200T140-F202 HydrophobicContact CG2-CB 3.7Å; K141-F202 HydrophobicContact CB-CE2 4.47Å; K141-F202 HydrophobicContact CG-CD2 4.28Å; K141-F202 HydrophobicContact CG-CE2 4.07Å; G200-F202 VanDerWaalsContact C-N 3.25Å; G200-F202 PolarHBondContact O-N 3.01Å
203R79.4Confident82.5Confident93 Ų9342.4 Ų42.435%0.35122%0.223SC..PPolyproline II helixtrans-72.6156.7174.561.1174.4150.3-152.2-2.2112.8Y14 E18 M195Y14-R203 PolarHBondContact OH-NH2 3.14Å; E18-R203 IonicContact OE1-CZ 3.19Å; E18-R203 IonicContact OE1-NH1 3.15Å; E18-R203 PolarHBondContact OE1-NH1 2.6Å; E18-R203 IonicContact OE1-NH2 2.67Å; E18-R203 PolarHBondContact OE1-NH2 2.89Å; E18-R203 VanDerWaalsContact OE1-NH2 3.16Å; E18-R203 IonicContact OE2-NH1 2.86Å; M195-R203 WeakPolarHBondContact O-CA 3.33Å; M195-R203 WeakPolarHBondContact O-CB 3.32Å
204Y83.3Confident82.6Confident29 Ų2942.5 Ų42.511%0.11422%0.224CC..PPolyproline II helixtrans-61.6141.1169-72.3-70.4000111.3E192 M195 V196 D208 L211 A212 I215E192-Y204 WeakPolarHBondContact OE2-CE2 3.32Å; E192-Y204 PolarHBondContact OE2-OH 3.09Å; M195-Y204 HydrophobicContact CB-CD2 3.76Å; M195-Y204 HydrophobicContact CB-CE2 3.6Å; M195-Y204 HydrophobicContact CE-CD2 4.17Å; M195-Y204 HydrophobicContact CE-CE1 3.85Å; M195-Y204 HydrophobicContact CE-CE2 3.38Å; M195-Y204 WeakPolarHBondContact CE-OH 3.49Å; M195-Y204 HydrophobicContact CG-CE2 4.48Å; M195-Y204 PolarHBondContact O-N 3.47Å; V196-Y204 HydrophobicContact CG2-CD2 3.61Å; V196-Y204 HydrophobicContact CG2-CE2 3.91Å; Y204-D208 HydrophobicContact CD1-CB 4.14Å; Y204-L211 HydrophobicContact CD1-CD2 4.38Å; Y204-L211 HydrophobicContact CE1-CD2 4.23Å; Y204-L211 HydrophobicContact CE1-CG 4.21Å; Y204-A212 HydrophobicContact CD1-CB 4.5Å; Y204-A212 HydrophobicContact CD2-CB 3.92Å; Y204-A212 HydrophobicContact CE2-CB 4.42Å; Y204-A212 HydrophobicContact CG-CB 3.95Å; Y204-I215 HydrophobicContact CE1-CD1 4.01Å; Y204-I215 WeakPolarHBondContact OH-CD1 3.47Å
205S83.5Confident82.7Confident51 Ų5143.8 Ų43.836%0.35723%0.231SC..PPolyproline II helixtrans-73.6157.8172.6-172.50000110.5F21 M207 D208F21-S205 VanDerWaalsContact CE2-O 3.24Å; F21-S205 WeakPolarHBondContact CE2-O 3.44Å; S205-M207 PolarHBondContact O-N 3.49Å; S205-D208 WeakPolarHBondContact CB-OD2 3.36Å; S205-D208 PolarHBondContact N-OD2 3.29Å; S205-D208 WeakPolarHBondContact O-CA 3.45Å; S205-D208 VanDerWaalsContact O-CB 3.26Å; S205-D208 WeakPolarHBondContact O-CB 3.44Å; S205-D208 PolarHBondContact O-N 2.96Å
206Q81.5Confident83Confident98 Ų9843.5 Ų43.546%0.45823%0.229SC..G310 helixtrans-60.3-29.2173.5-69.9174.1-0.100112.7F21 D208 L209F21-Q206 HydrophobicContact CB-CG 4.24Å; F21-Q206 HydrophobicContact CD2-CB 4.35Å; F21-Q206 HydrophobicContact CD2-CG 4.25Å; F21-Q206 HydrophobicContact CG-CG 4.39Å; Q206-D208 PolarHBondContact O-N 3.25Å; Q206-L209 PolarHBondContact O-N 2.92Å
207M83.1Confident83.2Confident136 Ų13643.1 Ų43.167%0.6723%0.227SC*.G310 helixtrans-67.4-18.6173.3-65.4-177-72.400112.9S205 L209S205-M207 PolarHBondContact O-N 3.49Å; M207-L209 VanDerWaalsContact C-N 3.31Å
208D85.8Confident83.7Confident11 Ų1141.5 Ų41.56%0.05922%0.221CC..G310 helixtrans-93.722.2179.5-64-41.1000111.7R82 Y204 S205 Q206 V210 L211 A212R82-D208 IonicContact CZ-OD1 3.16Å; R82-D208 IonicContact NE-OD1 3.62Å; R82-D208 PolarHBondContact NE-OD1 3.46Å; R82-D208 IonicContact NH2-OD1 2.6Å; R82-D208 PolarHBondContact NH2-OD1 2.92Å; R82-D208 IonicContact NH2-OD2 3.21Å; R82-D208 PolarHBondContact NH2-OD2 3.44Å; R82-D208 VanDerWaalsContact NH2-OD2 3.15Å; Y204-D208 HydrophobicContact CD1-CB 4.14Å; S205-D208 WeakPolarHBondContact CB-OD2 3.36Å; S205-D208 PolarHBondContact N-OD2 3.29Å; S205-D208 WeakPolarHBondContact O-CA 3.45Å; S205-D208 VanDerWaalsContact O-CB 3.26Å; S205-D208 WeakPolarHBondContact O-CB 3.44Å; S205-D208 PolarHBondContact O-N 2.96Å; Q206-D208 PolarHBondContact O-N 3.25Å; D208-V210 PolarHBondContact O-N 3.4Å; D208-L211 HydrophobicContact CB-CB 3.96Å; D208-L211 HydrophobicContact CB-CD2 3.92Å; D208-L211 HydrophobicContact CB-CG 4.39Å; D208-L211 VanDerWaalsContact O-CB 3.32Å; D208-L211 WeakPolarHBondContact O-CB 3.32Å; D208-L211 PolarHBondContact O-N 3.42Å; D208-L211 VanDerWaalsContact O-N 3.16Å; D208-A212 WeakPolarHBondContact O-CB 3.27Å; D208-A212 PolarHBondContact O-N 3.1Å
209L89.2Confident84.9Confident44 Ų4440.9 Ų40.923%0.2321%0.214CC..Hα-helixtrans-54.8-50.1-178.4175.864.9000112.7F21 N24 A25 I28 Q206 M207 L211 A213F21-L209 HydrophobicContact CD2-CB 4.15Å; F21-L209 HydrophobicContact CD2-CD1 3.84Å; F21-L209 VanDerWaalsContact CE2-CA 3.49Å; F21-L209 HydrophobicContact CE2-CB 3.96Å; F21-L209 HydrophobicContact CE2-CD1 4.05Å; F21-L209 WeakPolarHBondContact O-CD1 3.42Å; N24-L209 HydrophobicContact CB-CD1 3.75Å; N24-L209 HydrophobicContact CB-CD2 4.15Å; A25-L209 HydrophobicContact CB-CD1 3.89Å; I28-L209 HydrophobicContact CD1-CD2 4.4Å; I28-L209 HydrophobicContact CD1-CG 4.2Å; Q206-L209 PolarHBondContact O-N 2.92Å; M207-L209 VanDerWaalsContact C-N 3.31Å; L209-L211 VanDerWaalsContact C-N 3.32Å; L209-A213 WeakPolarHBondContact O-CB 3.07Å; L209-A213 PolarHBondContact O-N 3.48Å; L209-A213 VanDerWaalsContact O-N 3.07Å
210V90.8Very high86.2Confident12 Ų1238 Ų387%0.07319%0.185CC..Hα-helixtrans-69.4-36.1-179.8-177.90000110.6W74 N87 L91 D208 G214W74-V210 HydrophobicContact CH2-CG1 4.31Å; W74-V210 HydrophobicContact CZ2-CG1 4.1Å; W74-V210 WeakPolarHBondContact CZ2-O 3.32Å; N87-V210 HydrophobicContact CB-CB 4.23Å; N87-V210 HydrophobicContact CB-CG1 4.06Å; N87-V210 HydrophobicContact CB-CG2 4.14Å; L91-V210 HydrophobicContact CB-CG1 4.17Å; L91-V210 HydrophobicContact CD1-CG1 3.67Å; D208-V210 PolarHBondContact O-N 3.4Å; V210-G214 PolarHBondContact O-N 3.3Å
211L90.2Very high87.5Confident11 Ų1138.3 Ų38.36%0.05818%0.184CC..Hα-helixtrans-59.2-53.9174.5178.757.9000111.3P78 S81 Y204 D208 L209 A213 G214 I215P78-L211 HydrophobicContact CB-CD1 4.39Å; P78-L211 HydrophobicContact CB-CD2 3.85Å; S81-L211 WeakPolarHBondContact OG-CB 3.32Å; Y204-L211 HydrophobicContact CD1-CD2 4.38Å; Y204-L211 HydrophobicContact CE1-CD2 4.23Å; Y204-L211 HydrophobicContact CE1-CG 4.21Å; D208-L211 HydrophobicContact CB-CB 3.96Å; D208-L211 HydrophobicContact CB-CD2 3.92Å; D208-L211 HydrophobicContact CB-CG 4.39Å; D208-L211 VanDerWaalsContact O-CB 3.32Å; D208-L211 WeakPolarHBondContact O-CB 3.32Å; D208-L211 PolarHBondContact O-N 3.42Å; D208-L211 VanDerWaalsContact O-N 3.16Å; L209-L211 VanDerWaalsContact C-N 3.32Å; L211-A213 PolarHBondContact O-N 3.15Å; L211-G214 PolarHBondContact O-N 3.15Å; L211-I215 HydrophobicContact CD1-CD1 3.56Å; L211-I215 HydrophobicContact CD1-CG1 4.2Å; L211-I215 HydrophobicContact CG-CD1 3.88Å; L211-I215 WeakPolarHBondContact O-CB 3.31Å; L211-I215 VanDerWaalsContact O-CG1 3.3Å; L211-I215 WeakPolarHBondContact O-CG1 3.5Å; L211-I215 PolarHBondContact O-N 2.94Å
212A91.5Very high88.9Confident0 Ų031.6 Ų31.60%015%0.152CC..Hα-helixtrans-59.3-46-179.700000111.4F21 V196 Y204 D208 I215 L216F21-A212 HydrophobicContact CZ-CB 3.91Å; V196-A212 HydrophobicContact CG2-CB 3.97Å; Y204-A212 HydrophobicContact CD1-CB 4.5Å; Y204-A212 HydrophobicContact CD2-CB 3.92Å; Y204-A212 HydrophobicContact CE2-CB 4.42Å; Y204-A212 HydrophobicContact CG-CB 3.95Å; D208-A212 WeakPolarHBondContact O-CB 3.27Å; D208-A212 PolarHBondContact O-N 3.1Å; A212-I215 PolarHBondContact O-N 2.95Å; A212-L216 WeakPolarHBondContact O-CG 3.43Å; A212-L216 PolarHBondContact O-N 3.33Å
213A93Very high89.9Confident0 Ų026.5 Ų26.50%013%0.131CC..Hα-helixtrans-61.6-47176.800000112.3I28 T29 L209 L211 I215 L216 Y217I28-A213 HydrophobicContact CB-CB 3.73Å; I28-A213 HydrophobicContact CD1-CB 4.3Å; I28-A213 HydrophobicContact CG2-CB 3.58Å; T29-A213 WeakPolarHBondContact OG1-CA 3.33Å; T29-A213 PolarHBondContact OG1-O 3.4Å; L209-A213 WeakPolarHBondContact O-CB 3.07Å; L209-A213 PolarHBondContact O-N 3.48Å; L209-A213 VanDerWaalsContact O-N 3.07Å; L211-A213 PolarHBondContact O-N 3.15Å; A213-I215 VanDerWaalsContact C-N 3.31Å; A213-I215 PolarHBondContact O-N 3.4Å; A213-L216 PolarHBondContact O-N 3.31Å; A213-Y217 WeakPolarHBondContact O-CB 3.42Å; A213-Y217 PolarHBondContact O-N 3.48Å
214G92.4Very high90.7Very high2 Ų222.1 Ų22.12%0.02111%0.114CC..Hα-helixtrans-62.1-36.9177.700000113.2V210 L211 N218V210-G214 PolarHBondContact O-N 3.3Å; L211-G214 PolarHBondContact O-N 3.15Å; G214-N218 WeakPolarHBondContact O-CB 3.46Å; G214-N218 PolarHBondContact O-N 3.44Å
215I91.4Very high91.2Very high33 Ų3321.1 Ų21.117%0.16911%0.111CC..Hα-helixtrans-71-44.9177.3-70.3172.7000111.3E192 Y204 L211 A212 A213 Y217 N218 C219E192-I215 HydrophobicContact CB-CG2 4.17Å; E192-I215 HydrophobicContact CG-CG2 3.7Å; E192-I215 WeakPolarHBondContact OE2-CG2 3.36Å; Y204-I215 HydrophobicContact CE1-CD1 4.01Å; Y204-I215 WeakPolarHBondContact OH-CD1 3.47Å; L211-I215 HydrophobicContact CD1-CD1 3.56Å; L211-I215 HydrophobicContact CD1-CG1 4.2Å; L211-I215 HydrophobicContact CG-CD1 3.88Å; L211-I215 WeakPolarHBondContact O-CB 3.31Å; L211-I215 VanDerWaalsContact O-CG1 3.3Å; L211-I215 WeakPolarHBondContact O-CG1 3.5Å; L211-I215 PolarHBondContact O-N 2.94Å; A212-I215 PolarHBondContact O-N 2.95Å; A213-I215 VanDerWaalsContact C-N 3.31Å; A213-I215 PolarHBondContact O-N 3.4Å; I215-Y217 VanDerWaalsContact C-N 3.28Å; I215-Y217 PolarHBondContact O-N 3.31Å; I215-N218 WeakPolarHBondContact O-CB 3.17Å; I215-N218 PolarHBondContact O-N 2.88Å; I215-N218 VanDerWaalsContact O-N 3.16Å; I215-C219 PolarHBondContact O-N 3.46Å; I215-C219 PolarHBondContact O-SG 3Å
216L94.1Very high91.7Very high0 Ų018.7 Ų18.70%09%0.094CC..Hα-helixtrans-59.3-42.7174.3-74-179.3000111.3T29 E192 V193 V196 F197 A212 A213 N218 C219 W220T29-L216 HydrophobicContact CG2-CB 3.92Å; E192-L216 HydrophobicContact CB-CD2 4.25Å; V193-L216 HydrophobicContact CG2-CD2 3.76Å; V196-L216 HydrophobicContact CB-CD1 4.2Å; V196-L216 HydrophobicContact CG1-CD1 4.04Å; V196-L216 HydrophobicContact CG2-CD1 3.89Å; V196-L216 HydrophobicContact CG2-CD2 4.18Å; V196-L216 HydrophobicContact CG2-CG 3.99Å; F197-L216 HydrophobicContact CE2-CD1 4.27Å; A212-L216 WeakPolarHBondContact O-CG 3.43Å; A212-L216 PolarHBondContact O-N 3.33Å; A213-L216 PolarHBondContact O-N 3.31Å; L216-N218 PolarHBondContact O-N 2.94Å; L216-C219 PolarHBondContact O-N 3.2Å; L216-W220 PolarHBondContact O-N 3.5Å
217Y94.9Very high92.4Very high1 Ų115 Ų150%0.0048%0.077CC..Hα-helixtrans-57.9-47.4173.9173.1-102.6000112.1Q32 F33 T36 S98 A213 I215 C219 W220 W221Q32-Y217 HydrophobicContact CB-CD2 3.32Å; Q32-Y217 HydrophobicContact CB-CE2 3.62Å; Q32-Y217 HydrophobicContact CB-CG 3.91Å; Q32-Y217 HydrophobicContact CG-CD2 4.33Å; Q32-Y217 HydrophobicContact CG-CG 4.49Å; Q32-Y217 VanDerWaalsContact OE1-CB 3.25Å; F33-Y217 AromaticContact CD1-CD2 3.85Å; F33-Y217 HydrophobicContact CD1-CD2 3.85Å; F33-Y217 HydrophobicContact CD1-CE2 4.27Å; F33-Y217 AromaticContact CE1-CD2 4Å; F33-Y217 HydrophobicContact CE1-CD2 4Å; T36-Y217 VanDerWaalsContact OG1-CE2 3.3Å; T36-Y217 WeakPolarHBondContact OG1-CE2 3.39Å; T36-Y217 PolarHBondContact OG1-OH 3.05Å; S98-Y217 WeakPolarHBondContact CB-OH 3.26Å; S98-Y217 WeakPolarHBondContact OG-CE1 3.28Å; S98-Y217 PolarHBondContact OG-OH 3.28Å; A213-Y217 WeakPolarHBondContact O-CB 3.42Å; A213-Y217 PolarHBondContact O-N 3.48Å; I215-Y217 VanDerWaalsContact C-N 3.28Å; I215-Y217 PolarHBondContact O-N 3.31Å; Y217-C219 VanDerWaalsContact C-N 3.3Å; Y217-C219 PolarHBondContact O-N 2.96Å; Y217-W220 HydrophobicContact CD2-CE3 4.1Å; Y217-W220 HydrophobicContact CD2-CZ3 4.42Å; Y217-W220 AromaticContact CE2-CE3 3.91Å; Y217-W220 HydrophobicContact CE2-CE3 3.91Å; Y217-W220 AromaticContact CE2-CZ3 3.79Å; Y217-W220 HydrophobicContact CE2-CZ3 3.79Å; Y217-W220 PolarHBondContact O-N 2.86Å; Y217-W221 HydrophobicContact CE1-CB 4.49Å; Y217-W221 WeakPolarHBondContact O-CB 3.24Å; Y217-W221 PolarHBondContact O-N 3.2Å
218N93.3Very high92.9Very high15 Ų158.6 Ų8.68%0.085%0.045CC..Hα-helixtrans-61.9-37.4177.7-172.531.6000112.6Y67 Q71 G214 I215 L216 W221 N222Y67-N218 PolarHBondContact OH-OD1 3.37Å; Q71-N218 VanDerWaalsContact CD-OD1 3.25Å; Q71-N218 PolarHBondContact NE2-OD1 2.94Å; Q71-N218 VanDerWaalsContact OE1-CG 3.29Å; Q71-N218 PolarHBondContact OE1-ND2 3.41Å; Q71-N218 PolarHBondContact OE1-OD1 2.84Å; Q71-N218 VanDerWaalsContact OE1-OD1 3.04Å; G214-N218 WeakPolarHBondContact O-CB 3.46Å; G214-N218 PolarHBondContact O-N 3.44Å; I215-N218 WeakPolarHBondContact O-CB 3.17Å; I215-N218 PolarHBondContact O-N 2.88Å; I215-N218 VanDerWaalsContact O-N 3.16Å; L216-N218 PolarHBondContact O-N 2.94Å; N218-W221 PolarHBondContact O-N 3.38Å; N218-N222 WeakPolarHBondContact O-CB 3.29Å; N218-N222 PolarHBondContact O-N 3.25Å; N218-N222 PolarHBondContact O-ND2 2.85Å; N218-N222 PolarHBondContact OD1-ND2 3.24Å; N218-N222 VanDerWaalsContact OD1-ND2 3.09Å
219C94.1Very high93.2Very high1 Ų18 Ų81%0.0074%0.043CC..Hα-helixtrans-64.8-44.4177-65.60000111.8L189 E192 I215 L216 Y217 S223L189-C219 HydrophobicContact CB-CB 4.15Å; L189-C219 HydrophobicContact CD1-CB 3.67Å; L189-C219 HydrophobicContact CG-CB 4.48Å; E192-C219 VanDerWaalsContact CG-SG 3.57Å; I215-C219 PolarHBondContact O-N 3.46Å; I215-C219 PolarHBondContact O-SG 3Å; L216-C219 PolarHBondContact O-N 3.2Å; Y217-C219 VanDerWaalsContact C-N 3.3Å; Y217-C219 PolarHBondContact O-N 2.96Å; C219-S223 WeakPolarHBondContact O-CB 3.49Å; C219-S223 PolarHBondContact O-N 3.29Å; C219-S223 PolarHBondContact O-OG 3.16Å
220W94.8Very high93.4Very high0 Ų08.7 Ų8.70%05%0.045CC..Hα-helixtrans-65.6-44.8174.9169.680.9000111.9F33 T36 F118 S121 F125 L216 Y217 N222 S223 F224F33-W220 HydrophobicContact CD1-CB 4.45Å; F33-W220 AromaticContact CD1-CD2 3.42Å; F33-W220 HydrophobicContact CD1-CD2 3.42Å; F33-W220 VanDerWaalsContact CD1-CD2 3.42Å; F33-W220 AromaticContact CD1-CE3 3.27Å; F33-W220 HydrophobicContact CD1-CE3 3.27Å; F33-W220 AromaticContact CD1-CG 3.94Å; F33-W220 HydrophobicContact CD1-CG 3.94Å; F33-W220 HydrophobicContact CD1-CH2 4.38Å; F33-W220 HydrophobicContact CD1-CZ2 4.5Å; F33-W220 AromaticContact CD1-CZ3 3.79Å; F33-W220 HydrophobicContact CD1-CZ3 3.79Å; F33-W220 HydrophobicContact CD2-CD2 4.28Å; F33-W220 HydrophobicContact CD2-CG 4.41Å; F33-W220 HydrophobicContact CE1-CB 3.37Å; F33-W220 AromaticContact CE1-CD2 3.21Å; F33-W220 HydrophobicContact CE1-CD2 3.21Å; F33-W220 AromaticContact CE1-CE3 3.34Å; F33-W220 HydrophobicContact CE1-CE3 3.34Å; F33-W220 AromaticContact CE1-CG 3.23Å; F33-W220 HydrophobicContact CE1-CG 3.23Å; F33-W220 HydrophobicContact CE1-CZ3 4.3Å; F33-W220 HydrophobicContact CE2-CB 4.31Å; F33-W220 AromaticContact CE2-CD1 3.78Å; F33-W220 HydrophobicContact CE2-CD2 4.1Å; F33-W220 AromaticContact CE2-CG 3.77Å; F33-W220 HydrophobicContact CE2-CG 3.77Å; F33-W220 AromaticContact CG-CD2 3.98Å; F33-W220 HydrophobicContact CG-CD2 3.98Å; F33-W220 HydrophobicContact CG-CE3 4.12Å; F33-W220 HydrophobicContact CG-CG 4.49Å; F33-W220 HydrophobicContact CG-CZ2 4.46Å; F33-W220 HydrophobicContact CG-CZ3 4.4Å; F33-W220 HydrophobicContact CZ-CB 3.28Å; F33-W220 AromaticContact CZ-CD1 3.59Å; F33-W220 AromaticContact CZ-CD2 3.6Å; F33-W220 HydrophobicContact CZ-CD2 3.6Å; F33-W220 HydrophobicContact CZ-CE3 4.2Å; F33-W220 AromaticContact CZ-CG 3.13Å; F33-W220 HydrophobicContact CZ-CG 3.13Å; T36-W220 HydrophobicContact CG2-CH2 4.12Å; T36-W220 HydrophobicContact CG2-CZ3 4.05Å; F118-W220 AromaticContact CD2-CH2 4Å; F118-W220 HydrophobicContact CD2-CH2 4Å; F118-W220 AromaticContact CD2-CZ2 3.55Å; F118-W220 HydrophobicContact CD2-CZ2 3.55Å; F118-W220 AromaticContact CE2-CH2 3.53Å; F118-W220 HydrophobicContact CE2-CH2 3.53Å; F118-W220 AromaticContact CE2-CZ2 3.2Å; F118-W220 HydrophobicContact CE2-CZ2 3.2Å; F118-W220 HydrophobicContact CZ-CZ2 4.14Å; S121-W220 PolarHBondContact OG-NE1 2.97Å; F125-W220 HydrophobicContact CD2-CB 4.11Å; F125-W220 HydrophobicContact CE2-CB 4.41Å; L216-W220 PolarHBondContact O-N 3.5Å; Y217-W220 HydrophobicContact CD2-CE3 4.1Å; Y217-W220 HydrophobicContact CD2-CZ3 4.42Å; Y217-W220 AromaticContact CE2-CE3 3.91Å; Y217-W220 HydrophobicContact CE2-CE3 3.91Å; Y217-W220 AromaticContact CE2-CZ3 3.79Å; Y217-W220 HydrophobicContact CE2-CZ3 3.79Å; Y217-W220 PolarHBondContact O-N 2.86Å; W220-N222 VanDerWaalsContact C-N 3.33Å; W220-N222 PolarHBondContact O-N 3.2Å; W220-S223 CarbonylContact O-C 3.58Å; W220-S223 WeakPolarHBondContact O-CA 3.34Å; W220-S223 WeakPolarHBondContact O-CB 3.44Å; W220-S223 PolarHBondContact O-N 3.46Å; W220-S223 VanDerWaalsContact O-N 3.08Å; W220-F224 AromaticContact CH2-CD1 3.85Å; W220-F224 HydrophobicContact CH2-CD1 3.85Å; W220-F224 HydrophobicContact CH2-CG 4.44Å; W220-F224 HydrophobicContact CZ2-CB 4.15Å; W220-F224 AromaticContact CZ2-CD1 4Å; W220-F224 HydrophobicContact CZ2-CD1 4Å; W220-F224 HydrophobicContact CZ2-CG 4.16Å; W220-F224 WeakPolarHBondContact O-CB 3.34Å; W220-F224 PolarHBondContact O-N 3.06Å
221W94.5Very high93.4Very high13 Ų139 Ų95%0.0495%0.048CC..Hα-helixtrans-57.8-46.4178.8-176.897.7000111.2Y67 S98 A101 I102 Y217 N218 S223 F224 L225Y67-W221 AromaticContact CD1-CH2 3.94Å; Y67-W221 HydrophobicContact CD1-CH2 3.94Å; Y67-W221 AromaticContact CD1-CZ2 3.95Å; Y67-W221 HydrophobicContact CD1-CZ2 3.95Å; Y67-W221 HydrophobicContact CD1-CZ3 4.34Å; Y67-W221 AromaticContact CE1-CD2 3.66Å; Y67-W221 HydrophobicContact CE1-CD2 3.66Å; Y67-W221 AromaticContact CE1-CE2 3.64Å; Y67-W221 AromaticContact CE1-CE3 3.6Å; Y67-W221 HydrophobicContact CE1-CE3 3.6Å; Y67-W221 HydrophobicContact CE1-CG 4.46Å; Y67-W221 AromaticContact CE1-CH2 3.59Å; Y67-W221 HydrophobicContact CE1-CH2 3.59Å; Y67-W221 AromaticContact CE1-CZ2 3.63Å; Y67-W221 HydrophobicContact CE1-CZ2 3.63Å; Y67-W221 AromaticContact CE1-CZ3 3.59Å; Y67-W221 HydrophobicContact CE1-CZ3 3.59Å; Y67-W221 AromaticContact CZ-CD2 3.99Å; S98-W221 PolarHBondContact O-NE1 2.82Å; S98-W221 VanDerWaalsContact O-NE1 3.09Å; A101-W221 HydrophobicContact CB-CZ2 4.29Å; I102-W221 HydrophobicContact CB-CZ2 4.27Å; Y217-W221 HydrophobicContact CE1-CB 4.49Å; Y217-W221 WeakPolarHBondContact O-CB 3.24Å; Y217-W221 PolarHBondContact O-N 3.2Å; N218-W221 PolarHBondContact O-N 3.38Å; W221-S223 VanDerWaalsContact C-N 3.32Å; W221-S223 PolarHBondContact O-N 2.95Å; W221-F224 PolarHBondContact O-N 3.42Å; W221-L225 HydrophobicContact CH2-CD2 3.43Å; W221-L225 VanDerWaalsContact CH2-CD2 3.43Å; W221-L225 HydrophobicContact CZ2-CD2 4.21Å; W221-L225 HydrophobicContact CZ3-CB 4.39Å; W221-L225 HydrophobicContact CZ3-CD2 3.63Å; W221-L225 PolarHBondContact O-N 2.93Å
222N93.9Very high93.3Very high2 Ų28.5 Ų8.51%0.0115%0.046CC..Hα-helixtrans-62.1-40.3175.8-79.1-45.5000111.9I153 L157 T185 K188 N218 W220 T226I153-N222 HydrophobicContact CG2-CB 4.28Å; L157-N222 HydrophobicContact CD1-CB 4.43Å; L157-N222 WeakPolarHBondContact CD1-OD1 3.49Å; T185-N222 HydrophobicContact CG2-CB 4Å; K188-N222 PolarHBondContact NZ-ND2 2.99Å; N218-N222 WeakPolarHBondContact O-CB 3.29Å; N218-N222 PolarHBondContact O-N 3.25Å; N218-N222 PolarHBondContact O-ND2 2.85Å; N218-N222 PolarHBondContact OD1-ND2 3.24Å; N218-N222 VanDerWaalsContact OD1-ND2 3.09Å; W220-N222 VanDerWaalsContact C-N 3.33Å; W220-N222 PolarHBondContact O-N 3.2Å; N222-T226 VanDerWaalsContact O-CB 3.26Å; N222-T226 WeakPolarHBondContact O-CB 3.47Å; N222-T226 PolarHBondContact O-N 2.83Å; N222-T226 PolarHBondContact O-OG1 3.4Å
223S93.9Very high92.9Very high5 Ų515.5 Ų15.54%0.0357%0.073CC..Hα-helixtrans-64.1-44.2176.1-58.10000111.3C219 W220 W221 T226 L227C219-S223 WeakPolarHBondContact O-CB 3.49Å; C219-S223 PolarHBondContact O-N 3.29Å; C219-S223 PolarHBondContact O-OG 3.16Å; W220-S223 CarbonylContact O-C 3.58Å; W220-S223 WeakPolarHBondContact O-CA 3.34Å; W220-S223 WeakPolarHBondContact O-CB 3.44Å; W220-S223 PolarHBondContact O-N 3.46Å; W220-S223 VanDerWaalsContact O-N 3.08Å; W221-S223 VanDerWaalsContact C-N 3.32Å; W221-S223 PolarHBondContact O-N 2.95Å; S223-T226 PolarHBondContact O-N 2.87Å; S223-L227 VanDerWaalsContact O-CG 3.26Å; S223-L227 WeakPolarHBondContact O-CG 3.38Å; S223-L227 PolarHBondContact O-N 3.25Å
224F95.7Very high92.4Very high1 Ų120 Ų200%0.00410%0.104CC..Hα-helixtrans-64.4-47.7178.9176.8-139.7000111.8I102 V114 M117 F118 W220 W221 T226 L227 M228I102-F224 HydrophobicContact CD1-CB 4.5Å; I102-F224 HydrophobicContact CD1-CD1 3.19Å; I102-F224 HydrophobicContact CD1-CE1 3.49Å; I102-F224 VanDerWaalsContact CD1-CE1 3.49Å; I102-F224 HydrophobicContact CD1-CG 4.07Å; I102-F224 HydrophobicContact CG1-CD1 4.14Å; I102-F224 HydrophobicContact CG1-CE1 3.92Å; V114-F224 HydrophobicContact CG1-CZ 4.06Å; M117-F224 HydrophobicContact CB-CD2 4.29Å; M117-F224 HydrophobicContact CB-CE2 3.96Å; F118-F224 HydrophobicContact CB-CD2 4.47Å; F118-F224 HydrophobicContact CB-CE2 3.84Å; F118-F224 HydrophobicContact CB-CZ 4.07Å; F118-F224 HydrophobicContact CD2-CE1 4.25Å; F118-F224 HydrophobicContact CD2-CE2 4.49Å; F118-F224 HydrophobicContact CD2-CZ 4.24Å; W220-F224 AromaticContact CH2-CD1 3.85Å; W220-F224 HydrophobicContact CH2-CD1 3.85Å; W220-F224 HydrophobicContact CH2-CG 4.44Å; W220-F224 HydrophobicContact CZ2-CB 4.15Å; W220-F224 AromaticContact CZ2-CD1 4Å; W220-F224 HydrophobicContact CZ2-CD1 4Å; W220-F224 HydrophobicContact CZ2-CG 4.16Å; W220-F224 WeakPolarHBondContact O-CB 3.34Å; W220-F224 PolarHBondContact O-N 3.06Å; W221-F224 PolarHBondContact O-N 3.42Å; F224-T226 VanDerWaalsContact C-N 3.31Å; F224-T226 PolarHBondContact O-N 3.42Å; F224-L227 PolarHBondContact O-N 2.56Å; F224-M228 HydrophobicContact CD2-CG 4.22Å; F224-M228 HydrophobicContact CD2-SD 4.42Å; F224-M228 HydrophobicContact CE1-SD 4.11Å; F224-M228 HydrophobicContact CE2-CG 3.83Å; F224-M228 HydrophobicContact CE2-SD 3.79Å; F224-M228 HydrophobicContact CZ-CG 4.28Å; F224-M228 HydrophobicContact CZ-SD 3.6Å; F224-M228 VanDerWaalsContact CZ-SD 3.6Å; F224-M228 WeakPolarHBondContact O-CG 3.24Å; F224-M228 PolarHBondContact O-N 3.06Å
225L94.1Very high91.6Very high7 Ų719.9 Ų19.94%0.03710%0.103CC..Hα-helixtrans-60.1-42.6176-174.765.8000111.7I102 D105 L157 W221 L227 M228 W229I102-L225 HydrophobicContact CD1-CB 4.2Å; I102-L225 HydrophobicContact CD1-CD1 4.45Å; I102-L225 HydrophobicContact CG1-CD1 4.39Å; D105-L225 WeakPolarHBondContact OD2-CD1 3.27Å; L157-L225 HydrophobicContact CD1-CD2 4.31Å; L157-L225 HydrophobicContact CD2-CD2 4.45Å; W221-L225 HydrophobicContact CH2-CD2 3.43Å; W221-L225 VanDerWaalsContact CH2-CD2 3.43Å; W221-L225 HydrophobicContact CZ2-CD2 4.21Å; W221-L225 HydrophobicContact CZ3-CB 4.39Å; W221-L225 HydrophobicContact CZ3-CD2 3.63Å; W221-L225 PolarHBondContact O-N 2.93Å; L225-L227 VanDerWaalsContact C-N 3.34Å; L225-L227 PolarHBondContact O-N 3.33Å; L225-M228 WeakPolarHBondContact O-CB 3.13Å; L225-M228 PolarHBondContact O-N 2.79Å; L225-W229 HydrophobicContact CD1-CZ2 4.25Å; L225-W229 VanDerWaalsContact CD1-NE1 3.33Å; L225-W229 HydrophobicContact CD2-CH2 4.42Å; L225-W229 HydrophobicContact CD2-CZ2 3.83Å; L225-W229 HydrophobicContact CG-CD2 4.42Å; L225-W229 HydrophobicContact CG-CZ2 4.06Å; L225-W229 PolarHBondContact O-N 3.48Å
226T94.3Very high91Very high1 Ų119.5 Ų19.51%0.00610%0.102CC..Hα-helixtrans-60.9-42.9178.1-61.80000112.1G178 A181 L182 N222 S223 F224 M228 W229 I230G178-T226 WeakPolarHBondContact O-CG2 3.4Å; A181-T226 HydrophobicContact CB-CG2 4.04Å; L182-T226 HydrophobicContact CB-CG2 3.78Å; N222-T226 VanDerWaalsContact O-CB 3.26Å; N222-T226 WeakPolarHBondContact O-CB 3.47Å; N222-T226 PolarHBondContact O-N 2.83Å; N222-T226 PolarHBondContact O-OG1 3.4Å; S223-T226 PolarHBondContact O-N 2.87Å; F224-T226 VanDerWaalsContact C-N 3.31Å; F224-T226 PolarHBondContact O-N 3.42Å; T226-M228 VanDerWaalsContact C-N 3.35Å; T226-W229 PolarHBondContact O-N 3.4Å; T226-I230 HydrophobicContact CG2-CD1 4.17Å; T226-I230 WeakPolarHBondContact O-CG1 3.42Å; T226-I230 PolarHBondContact O-N 2.75Å
227L94.5Very high90.1Very high20 Ų2021.9 Ų21.911%0.10511%0.112CC..Hα-helixtrans-64.5-39.3176.3-72.4167.6000112.1M117 V120 L124 L182 S223 F224 L225 S231M117-L227 HydrophobicContact CB-CB 4.39Å; M117-L227 HydrophobicContact CG-CB 4.44Å; M117-L227 HydrophobicContact SD-CB 3.85Å; V120-L227 HydrophobicContact CB-CD1 4.38Å; V120-L227 HydrophobicContact CG1-CD1 3.93Å; V120-L227 HydrophobicContact CG1-CD2 4.22Å; L124-L227 HydrophobicContact CD1-CD1 4.05Å; L124-L227 HydrophobicContact CD1-CD2 4.49Å; L182-L227 HydrophobicContact CD1-CD2 4.27Å; S223-L227 VanDerWaalsContact O-CG 3.26Å; S223-L227 WeakPolarHBondContact O-CG 3.38Å; S223-L227 PolarHBondContact O-N 3.25Å; F224-L227 PolarHBondContact O-N 2.56Å; L225-L227 VanDerWaalsContact C-N 3.34Å; L225-L227 PolarHBondContact O-N 3.33Å; L227-S231 WeakPolarHBondContact O-CB 3.21Å; L227-S231 PolarHBondContact O-N 2.89Å; L227-S231 VanDerWaalsContact O-N 3.11Å; L227-S231 PolarHBondContact O-OG 3.43Å
228M93.7Very high88.6Confident1 Ų127 Ų271%0.00514%0.139CC..Hα-helixtrans-59.5-47.7172.6-73.5-173.758.200111.4I102 A106 Y109 V114 M117 F224 L225 T226 I230 S231 T232I102-M228 HydrophobicContact CG1-SD 4.27Å; A106-M228 HydrophobicContact CB-CE 3.66Å; A106-M228 HydrophobicContact CB-SD 4.44Å; Y109-M228 HydrophobicContact CD2-CE 3.51Å; Y109-M228 WeakPolarHBondContact CE1-O 3.43Å; Y109-M228 HydrophobicContact CE2-CE 3.73Å; Y109-M228 HydrophobicContact CG-CE 3.99Å; V114-M228 HydrophobicContact CG2-CE 4.12Å; M117-M228 HydrophobicContact CB-CG 4.17Å; M117-M228 HydrophobicContact CG-CG 4.5Å; F224-M228 HydrophobicContact CD2-CG 4.22Å; F224-M228 HydrophobicContact CD2-SD 4.42Å; F224-M228 HydrophobicContact CE1-SD 4.11Å; F224-M228 HydrophobicContact CE2-CG 3.83Å; F224-M228 HydrophobicContact CE2-SD 3.79Å; F224-M228 HydrophobicContact CZ-CG 4.28Å; F224-M228 HydrophobicContact CZ-SD 3.6Å; F224-M228 VanDerWaalsContact CZ-SD 3.6Å; F224-M228 WeakPolarHBondContact O-CG 3.24Å; F224-M228 PolarHBondContact O-N 3.06Å; L225-M228 WeakPolarHBondContact O-CB 3.13Å; L225-M228 PolarHBondContact O-N 2.79Å; T226-M228 VanDerWaalsContact C-N 3.35Å; M228-I230 PolarHBondContact O-N 3.5Å; M228-S231 CarbonylContact O-C 3.58Å; M228-S231 WeakPolarHBondContact O-CA 2.93Å; M228-S231 WeakPolarHBondContact O-CB 3.41Å; M228-S231 PolarHBondContact O-N 3.22Å; M228-T232 PolarHBondContact O-N 2.97Å
229W93Very high86.9Confident0 Ų031.9 Ų31.90%017%0.165CC..Hα-helixtrans-66.5-36-177.9-73.312000113.5D105 L157 Q161 L174 T175 A177 L225 T226 S231 T232D105-W229 PolarHBondContact OD2-NE1 3.07Å; L157-W229 HydrophobicContact CB-CH2 3.96Å; L157-W229 HydrophobicContact CB-CZ3 4.14Å; L157-W229 HydrophobicContact CD2-CD2 4.45Å; L157-W229 HydrophobicContact CD2-CE3 3.75Å; L157-W229 HydrophobicContact CD2-CH2 3.87Å; L157-W229 HydrophobicContact CD2-CZ3 3.44Å; L157-W229 VanDerWaalsContact CD2-CZ3 3.44Å; L157-W229 HydrophobicContact CG-CZ3 4.38Å; L157-W229 WeakPolarHBondContact O-CH2 3.36Å; Q161-W229 HydrophobicContact CB-CH2 3.89Å; Q161-W229 HydrophobicContact CB-CZ2 4.09Å; L174-W229 HydrophobicContact CB-CB 4.34Å; L174-W229 HydrophobicContact CB-CG 4.37Å; L174-W229 HydrophobicContact CD2-CD2 3.85Å; L174-W229 HydrophobicContact CD2-CE3 4.08Å; L174-W229 HydrophobicContact CD2-CG 4.29Å; L174-W229 HydrophobicContact CD2-CH2 4.44Å; L174-W229 HydrophobicContact CD2-CZ2 4.2Å; L174-W229 HydrophobicContact CD2-CZ3 4.35Å; T175-W229 VanDerWaalsContact CA-O 3.31Å; T175-W229 WeakPolarHBondContact CA-O 3.46Å; T175-W229 PolarHBondContact N-O 3.45Å; T175-W229 PolarHBondContact OG1-O 2.71Å; A177-W229 HydrophobicContact CB-CE3 4.12Å; A177-W229 HydrophobicContact CB-CZ3 4.14Å; L225-W229 HydrophobicContact CD1-CZ2 4.25Å; L225-W229 VanDerWaalsContact CD1-NE1 3.33Å; L225-W229 HydrophobicContact CD2-CH2 4.42Å; L225-W229 HydrophobicContact CD2-CZ2 3.83Å; L225-W229 HydrophobicContact CG-CD2 4.42Å; L225-W229 HydrophobicContact CG-CZ2 4.06Å; L225-W229 PolarHBondContact O-N 3.48Å; T226-W229 PolarHBondContact O-N 3.4Å; W229-S231 PolarHBondContact O-N 3.42Å; W229-T232 WeakPolarHBondContact CA-OG1 3.48Å; W229-T232 VanDerWaalsContact O-CB 3.28Å; W229-T232 WeakPolarHBondContact O-CB 3.44Å; W229-T232 PolarHBondContact O-N 3.34Å; W229-T232 PolarHBondContact O-OG1 3.03Å
230I92.4Very high84.8Confident57 Ų5737.1 Ų37.129%0.29219%0.193SC..Hα-helixtrans-62.8-36.9170.9-70.8168.1000110.6L182 T226 M228 T232L182-I230 HydrophobicContact CB-CD1 3.92Å; L182-I230 HydrophobicContact CD1-CD1 3.29Å; L182-I230 HydrophobicContact CG-CD1 4.23Å; T226-I230 HydrophobicContact CG2-CD1 4.17Å; T226-I230 WeakPolarHBondContact O-CG1 3.42Å; T226-I230 PolarHBondContact O-N 2.75Å; M228-I230 PolarHBondContact O-N 3.5Å; I230-T232 PolarHBondContact O-N 3.35Å
231S91.7Very high82.5Confident19 Ų1939.9 Ų39.913%0.13321%0.212CC..THydrogen-bonded Turntrans-76.2-2-179.4-57.60000114.2M117 L227 M228 W229 Y233 S234 G235M117-S231 WeakPolarHBondContact CE-OG 3.17Å; M117-S231 PolarHBondContact SD-OG 3.27Å; L227-S231 WeakPolarHBondContact O-CB 3.21Å; L227-S231 PolarHBondContact O-N 2.89Å; L227-S231 VanDerWaalsContact O-N 3.11Å; L227-S231 PolarHBondContact O-OG 3.43Å; M228-S231 CarbonylContact O-C 3.58Å; M228-S231 WeakPolarHBondContact O-CA 2.93Å; M228-S231 WeakPolarHBondContact O-CB 3.41Å; M228-S231 PolarHBondContact O-N 3.22Å; W229-S231 PolarHBondContact O-N 3.42Å; S231-Y233 VanDerWaalsContact C-N 3.29Å; S231-Y233 PolarHBondContact O-N 3.5Å; S231-Y233 VanDerWaalsContact O-N 3.16Å; S231-S234 PolarHBondContact O-N 3.33Å; S231-S234 VanDerWaalsContact O-N 3.1Å; S231-G235 WeakPolarHBondContact O-CA 3.4Å; S231-G235 PolarHBondContact O-N 2.96Å
232T89Confident80.2Confident1 Ų143.7 Ų43.71%0.00624%0.237CC..Hα-helixtrans-49.6-42.7-175.8-57.40000113.9Y109 N171 L174 M228 W229 I230 S234 G235 L236Y109-T232 PolarHBondContact OH-OG1 3.37Å; Y109-T232 VanDerWaalsContact OH-OG1 3.08Å; N171-T232 HydrophobicContact CB-CG2 3.73Å; L174-T232 HydrophobicContact CB-CG2 4.32Å; L174-T232 HydrophobicContact CD1-CG2 4.13Å; M228-T232 PolarHBondContact O-N 2.97Å; W229-T232 WeakPolarHBondContact CA-OG1 3.48Å; W229-T232 VanDerWaalsContact O-CB 3.28Å; W229-T232 WeakPolarHBondContact O-CB 3.44Å; W229-T232 PolarHBondContact O-N 3.34Å; W229-T232 PolarHBondContact O-OG1 3.03Å; I230-T232 PolarHBondContact O-N 3.35Å; T232-S234 VanDerWaalsContact C-N 3.33Å; T232-S234 PolarHBondContact O-N 2.98Å; T232-G235 PolarHBondContact O-N 3.02Å; T232-G235 VanDerWaalsContact O-N 3.16Å; T232-L236 HydrophobicContact CG2-CD1 3.3Å; T232-L236 HydrophobicContact CG2-CD2 4.38Å; T232-L236 HydrophobicContact CG2-CG 3.67Å; T232-L236 PolarHBondContact O-N 3.39Å
233Y83Confident77.9Confident146 Ų14648.9 Ų48.957%0.57327%0.265SS*.Hα-helixtrans-62.4-35.2-178.7-82.9-77.4000114.4T172 T175 S231T172-Y233 WeakPolarHBondContact CA-OH 3.45Å; T172-Y233 WeakPolarHBondContact CB-OH 3.33Å; T172-Y233 HydrophobicContact CG2-CE1 4.38Å; T172-Y233 WeakPolarHBondContact CG2-OH 3.3Å; T175-Y233 HydrophobicContact CG2-CD2 3.77Å; T175-Y233 HydrophobicContact CG2-CE2 3.75Å; T175-Y233 WeakPolarHBondContact OG1-CD2 3.27Å; T175-Y233 WeakPolarHBondContact OG1-CE2 3.41Å; S231-Y233 VanDerWaalsContact C-N 3.29Å; S231-Y233 PolarHBondContact O-N 3.5Å; S231-Y233 VanDerWaalsContact O-N 3.16Å
234S81.3Confident75.7Confident94 Ų9453.1 Ų53.166%0.65729%0.286SS*.Hα-helixtrans-93.3-21175-51.30000111.8I113 S231 T232I113-S234 VanDerWaalsContact CD1-C 3.47Å; I113-S234 WeakPolarHBondContact CD1-O 3.08Å; S231-S234 PolarHBondContact O-N 3.33Å; S231-S234 VanDerWaalsContact O-N 3.1Å; T232-S234 VanDerWaalsContact C-N 3.33Å; T232-S234 PolarHBondContact O-N 2.98Å
235G76.3Confident73.4Confident0 Ų057.1 Ų57.10%031%0.311CS..Hα-helixtrans-79.9-48.5-161.400000116.4Y109 K110 S231 T232Y109-G235 CarbonylContact C-O 3.47Å; Y109-G235 WeakPolarHBondContact CA-O 3.38Å; K110-G235 PolarHBondContact N-O 3.33Å; S231-G235 WeakPolarHBondContact O-CA 3.4Å; S231-G235 PolarHBondContact O-N 2.96Å; T232-G235 PolarHBondContact O-N 3.02Å; T232-G235 VanDerWaalsContact O-N 3.16Å
236L78.4Confident71.4Confident25 Ų2561.5 Ų61.513%0.13133%0.334CS..BIsolated β-bridgetrans-68.8140.1-163.7-72174.2000111.8L108 Y109 N171 T232 D238L108-L236 HydrophobicContact CB-CD2 3.75Å; L108-L236 WeakPolarHBondContact O-CA 3.44Å; L108-L236 WeakPolarHBondContact O-CD2 3.36Å; Y109-L236 HydrophobicContact CD1-CD2 4.31Å; Y109-L236 HydrophobicContact CD2-CD2 4.3Å; Y109-L236 HydrophobicContact CE1-CD2 4.22Å; Y109-L236 HydrophobicContact CE2-CD2 4.22Å; Y109-L236 HydrophobicContact CG-CD2 4.34Å; N171-L236 HydrophobicContact CB-CD1 4.29Å; N171-L236 WeakPolarHBondContact ND2-CD1 3.33Å; N171-L236 WeakPolarHBondContact OD1-CD1 3.4Å; T232-L236 HydrophobicContact CG2-CD1 3.3Å; T232-L236 HydrophobicContact CG2-CD2 4.38Å; T232-L236 HydrophobicContact CG2-CG 3.67Å; T232-L236 PolarHBondContact O-N 3.39Å; L236-D238 PolarHBondContact O-N 3.23Å
237K74.7Confident69.5Low50 Ų5064.5 Ų64.522%0.21736%0.355CS..  trans-67.7120.4169.9-74.5177.5171-179.90107.3L108 Y109 K110 E111 L239L108-K237 PolarHBondContact O-N 3.22Å; Y109-K237 WeakPolarHBondContact O-CD 3.44Å; Y109-K237 WeakPolarHBondContact O-CE 3.47Å; K110-K237 HydrophobicContact CG-CG 3.84Å; E111-K237 IonicContact OE1-NZ 3.59Å; K237-L239 PolarHBondContact O-N 3.2Å
238D64.8Low67.6Low108 Ų10867.5 Ų67.558%0.57837%0.371SS*.  trans-60105.3171.4-78.1-39.4000108.7L236 N240 S241L236-D238 PolarHBondContact O-N 3.23Å; D238-N240 PolarHBondContact O-N 3.45Å; D238-S241 PolarHBondContact O-N 2.96Å; D238-S241 PolarHBondContact O-OG 3.31Å
239L56Low66Low118 Ų11871.5 Ų71.562%0.61840%0.395SS*.THydrogen-bonded Turntrans-56.8-22.6177-74.8165.1000112K237K237-L239 PolarHBondContact O-N 3.2Å
240N50.4Low64.5Low111 Ų11176.7 Ų76.759%0.59442%0.42SS*.THydrogen-bonded Turntrans-89.1-16.6178.6-75.4-9.5000114.7D238 T242 N243 I244D238-N240 PolarHBondContact O-N 3.45Å; N240-T242 VanDerWaalsContact C-N 3.31Å; N240-T242 PolarHBondContact O-N 3.02Å; N240-N243 PolarHBondContact O-N 3.37Å; N240-N243 VanDerWaalsContact O-N 3.14Å; N240-I244 HydrophobicContact CB-CD1 4.46Å; N240-I244 WeakPolarHBondContact O-CG1 3.24Å; N240-I244 PolarHBondContact O-N 2.86Å; N240-I244 VanDerWaalsContact O-N 3.07Å
241S46.6Very low63.1Low58 Ų5877 Ų7741%0.40643%0.426SS..Hα-helixtrans-63.8-36.4-174.260.80000112.5D238 I244 T245D238-S241 PolarHBondContact O-N 2.96Å; D238-S241 PolarHBondContact O-OG 3.31Å; S241-I244 PolarHBondContact O-N 3.27Å; S241-T245 WeakPolarHBondContact O-CG2 3.36Å; S241-T245 PolarHBondContact O-N 2.88Å; S241-T245 VanDerWaalsContact O-N 3.13Å; S241-T245 PolarHBondContact O-OG1 2.91Å
242T47.1Very low61.8Low94 Ų9479 Ų7958%0.57744%0.441SS*.Hα-helixtrans-66.9-33.8175.29.20000113N240 T245 L246N240-T242 VanDerWaalsContact C-N 3.31Å; N240-T242 PolarHBondContact O-N 3.02Å; T242-T245 PolarHBondContact O-OG1 3.45Å; T242-L246 WeakPolarHBondContact O-CB 2.76Å; T242-L246 PolarHBondContact O-N 3.47Å
243N44.1Very low60.7Low111 Ų11182.6 Ų82.659%0.59446%0.463SS*.Hα-helixtrans-74.9-38.2177.8-75.4-8.4000111.5N240 S247N240-N243 PolarHBondContact O-N 3.37Å; N240-N243 VanDerWaalsContact O-N 3.14Å; N243-S247 VanDerWaalsContact O-CB 3.3Å; N243-S247 WeakPolarHBondContact O-CB 3.01Å; N243-S247 PolarHBondContact O-N 3.27Å
244I48.1Very low59.9Low94 Ų9480.2 Ų80.248%0.48246%0.46SS..Hα-helixtrans-68.3-41.2179.7-63.2166000110.6N240 S241 S247 N248N240-I244 HydrophobicContact CB-CD1 4.46Å; N240-I244 WeakPolarHBondContact O-CG1 3.24Å; N240-I244 PolarHBondContact O-N 2.86Å; N240-I244 VanDerWaalsContact O-N 3.07Å; S241-I244 PolarHBondContact O-N 3.27Å; I244-S247 PolarHBondContact O-N 3.48Å; I244-N248 VanDerWaalsContact O-CB 3.22Å; I244-N248 WeakPolarHBondContact O-CB 3.2Å; I244-N248 PolarHBondContact O-N 2.68Å; I244-N248 PolarHBondContact O-ND2 3.16Å; I244-N248 PolarHBondContact O-OD1 2.6Å
245T49Very low59Low84 Ų8481.3 Ų81.352%0.51546%0.458SS..Hα-helixtrans-67.2-41.2177.954.30000111.9S241 T242 N248 V249S241-T245 WeakPolarHBondContact O-CG2 3.36Å; S241-T245 PolarHBondContact O-N 2.88Å; S241-T245 VanDerWaalsContact O-N 3.13Å; S241-T245 PolarHBondContact O-OG1 2.91Å; T242-T245 PolarHBondContact O-OG1 3.45Å; T245-N248 PolarHBondContact O-N 2.98Å; T245-V249 WeakPolarHBondContact O-CB 3.26Å; T245-V249 VanDerWaalsContact O-CG2 3.25Å; T245-V249 WeakPolarHBondContact O-CG2 3.2Å; T245-V249 PolarHBondContact O-N 3.4Å
246L51.6Low58.6Low100 Ų10086.1 Ų86.152%0.52448%0.482SS..Hα-helixtrans-65.2-45.8175.4-165.874.5000111.5T242 N248 V249 E250T242-L246 WeakPolarHBondContact O-CB 2.76Å; T242-L246 PolarHBondContact O-N 3.47Å; L246-N248 VanDerWaalsContact C-N 3.3Å; L246-N248 PolarHBondContact O-N 3.41Å; L246-V249 PolarHBondContact O-N 3.22Å; L246-E250 WeakPolarHBondContact O-CB 3.41Å; L246-E250 WeakPolarHBondContact O-CG 3.47Å; L246-E250 PolarHBondContact O-N 3.39Å
247S53Low57.8Low64 Ų6488 Ų8845%0.44850%0.495SS..Hα-helixtrans-58.6-41.9174.7135.40000111.7N243 I244 E250 S251N243-S247 VanDerWaalsContact O-CB 3.3Å; N243-S247 WeakPolarHBondContact O-CB 3.01Å; N243-S247 PolarHBondContact O-N 3.27Å; I244-S247 PolarHBondContact O-N 3.48Å; S247-E250 PolarHBondContact O-N 2.86Å; S247-S251 WeakPolarHBondContact O-CB 3.35Å; S247-S251 PolarHBondContact O-N 3.5Å; S247-S251 PolarHBondContact O-OG 3.34Å
248N56Low57Low82 Ų8291.5 Ų91.544%0.43952%0.515SS..Hα-helixtrans-69.8-36.1179.3-71.4-5.4000111.8I244 T245 L246 S251 S252I244-N248 VanDerWaalsContact O-CB 3.22Å; I244-N248 WeakPolarHBondContact O-CB 3.2Å; I244-N248 PolarHBondContact O-N 2.68Å; I244-N248 PolarHBondContact O-ND2 3.16Å; I244-N248 PolarHBondContact O-OD1 2.6Å; T245-N248 PolarHBondContact O-N 2.98Å; L246-N248 VanDerWaalsContact C-N 3.3Å; L246-N248 PolarHBondContact O-N 3.41Å; N248-S251 WeakPolarHBondContact CA-OG 3.33Å; N248-S251 PolarHBondContact O-OG 2.94Å; N248-S252 VanDerWaalsContact O-CB 3.26Å; N248-S252 WeakPolarHBondContact O-CB 3.3Å; N248-S252 PolarHBondContact O-N 3.43Å; N248-S252 PolarHBondContact O-OG 3.15Å
249V60.3Low56.8Low85 Ų8590.9 Ų90.952%0.51552%0.515SS..Hα-helixtrans-69.1-45173.9171.20000110T245 L246 S251 S252 V253T245-V249 WeakPolarHBondContact O-CB 3.26Å; T245-V249 VanDerWaalsContact O-CG2 3.25Å; T245-V249 WeakPolarHBondContact O-CG2 3.2Å; T245-V249 PolarHBondContact O-N 3.4Å; L246-V249 PolarHBondContact O-N 3.22Å; V249-S251 PolarHBondContact O-N 3.19Å; V249-S252 PolarHBondContact O-N 3.41Å; V249-V253 HydrophobicContact CG1-CG2 4.22Å; V249-V253 WeakPolarHBondContact O-CB 3.47Å; V249-V253 VanDerWaalsContact O-CG2 3.26Å; V249-V253 WeakPolarHBondContact O-CG2 3.48Å; V249-V253 PolarHBondContact O-N 2.9Å
250E61.9Low56.9Low110 Ų11093.3 Ų93.351%0.51452%0.521SS..Hα-helixtrans-60.3-44175.5-75.3179.6173.500111.7L246 S247 S252 V253 N254L246-E250 WeakPolarHBondContact O-CB 3.41Å; L246-E250 WeakPolarHBondContact O-CG 3.47Å; L246-E250 PolarHBondContact O-N 3.39Å; S247-E250 PolarHBondContact O-N 2.86Å; E250-S252 VanDerWaalsContact C-N 3.33Å; E250-S252 PolarHBondContact O-N 2.87Å; E250-V253 PolarHBondContact O-N 3.21Å; E250-N254 VanDerWaalsContact O-CB 3.28Å; E250-N254 WeakPolarHBondContact O-CB 3.26Å; E250-N254 PolarHBondContact O-N 3.41Å; E250-N254 PolarHBondContact O-ND2 3.36Å
251S62Low57Low62 Ų6297 Ų9743%0.43453%0.532SS..Hα-helixtrans-65.2-37.5175.6660000112S247 N248 V249 L255S247-S251 WeakPolarHBondContact O-CB 3.35Å; S247-S251 PolarHBondContact O-N 3.5Å; S247-S251 PolarHBondContact O-OG 3.34Å; N248-S251 WeakPolarHBondContact CA-OG 3.33Å; N248-S251 PolarHBondContact O-OG 2.94Å; V249-S251 PolarHBondContact O-N 3.19Å; S251-L255 WeakPolarHBondContact O-CB 3.47Å; S251-L255 PolarHBondContact O-N 3.41Å
252S64.1Low57.1Low63 Ų63104.1 Ų104.144%0.44157%0.566SS.*Hα-helixtrans-68.6-42.7176.9-57.90000111.5N248 V249 E250 L255 I256N248-S252 VanDerWaalsContact O-CB 3.26Å; N248-S252 WeakPolarHBondContact O-CB 3.3Å; N248-S252 PolarHBondContact O-N 3.43Å; N248-S252 PolarHBondContact O-OG 3.15Å; V249-S252 PolarHBondContact O-N 3.41Å; E250-S252 VanDerWaalsContact C-N 3.33Å; E250-S252 PolarHBondContact O-N 2.87Å; S252-L255 PolarHBondContact O-N 2.87Å; S252-I256 VanDerWaalsContact O-CG1 3.26Å; S252-I256 WeakPolarHBondContact O-CG1 3.11Å; S252-I256 PolarHBondContact O-N 3.18Å
253V66.4Low57.6Low76 Ų76104.6 Ų104.646%0.46157%0.565SS.*Hα-helixtrans-64.3-42.9175.8171.40000110.2V249 E250 L255 I256 T257V249-V253 HydrophobicContact CG1-CG2 4.22Å; V249-V253 WeakPolarHBondContact O-CB 3.47Å; V249-V253 VanDerWaalsContact O-CG2 3.26Å; V249-V253 WeakPolarHBondContact O-CG2 3.48Å; V249-V253 PolarHBondContact O-N 2.9Å; E250-V253 PolarHBondContact O-N 3.21Å; V253-L255 VanDerWaalsContact C-N 3.32Å; V253-L255 PolarHBondContact O-N 2.96Å; V253-I256 PolarHBondContact O-N 3.47Å; V253-T257 WeakPolarHBondContact O-CG2 3.49Å; V253-T257 PolarHBondContact O-N 2.92Å; V253-T257 PolarHBondContact O-OG1 3.21Å
254N65.9Low58.3Low96 Ų96104.3 Ų104.351%0.51356%0.564SS.*Hα-helixtrans-64.1-34.6175.5-72.9-20.7000112.5E250 T257 L258E250-N254 VanDerWaalsContact O-CB 3.28Å; E250-N254 WeakPolarHBondContact O-CB 3.26Å; E250-N254 PolarHBondContact O-N 3.41Å; E250-N254 PolarHBondContact O-ND2 3.36Å; N254-T257 WeakPolarHBondContact CA-OG1 3.44Å; N254-T257 PolarHBondContact O-OG1 2.93Å; N254-L258 WeakPolarHBondContact O-CB 3.35Å; N254-L258 VanDerWaalsContact O-CG 3.31Å; N254-L258 WeakPolarHBondContact O-CG 3.27Å; N254-L258 PolarHBondContact O-N 3.18Å
255L63Low58.9Low117 Ų117104.8 Ų104.861%0.61357%0.568SS**Hα-helixtrans-69-38.8173.9-161.682.7000111.7S251 S252 V253 T259S251-L255 WeakPolarHBondContact O-CB 3.47Å; S251-L255 PolarHBondContact O-N 3.41Å; S252-L255 PolarHBondContact O-N 2.87Å; V253-L255 VanDerWaalsContact C-N 3.32Å; V253-L255 PolarHBondContact O-N 2.96Å; L255-T259 WeakPolarHBondContact O-CG2 3.39Å; L255-T259 PolarHBondContact O-N 3.2Å; L255-T259 VanDerWaalsContact O-N 3.08Å; L255-T259 PolarHBondContact O-OG1 2.72Å
256I66.4Low59.4Low100 Ų100106.1 Ų106.151%0.51357%0.571SS.*Hα-helixtrans-69.7-35.3177.1-67163.9000111.3S252 V253 T259 K260S252-I256 VanDerWaalsContact O-CG1 3.26Å; S252-I256 WeakPolarHBondContact O-CG1 3.11Å; S252-I256 PolarHBondContact O-N 3.18Å; V253-I256 PolarHBondContact O-N 3.47Å; I256-T259 PolarHBondContact O-OG1 3.47Å; I256-K260 PolarHBondContact O-N 3.24Å
257T62.9Low59.9Low66 Ų66106.4 Ų106.441%0.40557%0.574SS.*Hα-helixtrans-71.8-40175.952.10000111.6V253 N254 K260 F261V253-T257 WeakPolarHBondContact O-CG2 3.49Å; V253-T257 PolarHBondContact O-N 2.92Å; V253-T257 PolarHBondContact O-OG1 3.21Å; N254-T257 WeakPolarHBondContact CA-OG1 3.44Å; N254-T257 PolarHBondContact O-OG1 2.93Å; T257-K260 PolarHBondContact O-N 3Å; T257-F261 WeakPolarHBondContact O-CD2 3.42Å
258L57.7Low60.4Low122 Ų122109.3 Ų109.364%0.63958%0.583SS**Hα-helixtrans-63.3-41.1175.6-75.6168.7000112.5N254 K260 F261N254-L258 WeakPolarHBondContact O-CB 3.35Å; N254-L258 VanDerWaalsContact O-CG 3.31Å; N254-L258 WeakPolarHBondContact O-CG 3.27Å; N254-L258 PolarHBondContact O-N 3.18Å; L258-K260 PolarHBondContact O-N 3.22Å; L258-F261 PolarHBondContact O-N 3.47Å
259T60.9Low60.7Low95 Ų95111.2 Ų111.258%0.58359%0.593SS**THydrogen-bonded Turntrans-72.3-8.9179.350.70000114.7L255 I256L255-T259 WeakPolarHBondContact O-CG2 3.39Å; L255-T259 PolarHBondContact O-N 3.2Å; L255-T259 VanDerWaalsContact O-N 3.08Å; L255-T259 PolarHBondContact O-OG1 2.72Å; I256-T259 PolarHBondContact O-OG1 3.47Å
260K56.7Low60.8Low170 Ų170113.2 Ų113.274%0.73960%0.599SS**THydrogen-bonded Turntrans-92.7-8.5173.2-84.9-173.3176.1-178.30114.2I256 T257 L258I256-K260 PolarHBondContact O-N 3.24Å; T257-K260 PolarHBondContact O-N 3Å; L258-K260 PolarHBondContact O-N 3.22Å
261F53.5Low60.7Low187 Ų187113.5 Ų113.582%0.8261%0.606SS**  trans-1061.8-178.8-83.8-73.9000114.3T257 L258T257-F261 WeakPolarHBondContact O-CD2 3.42Å; L258-F261 PolarHBondContact O-N 3.47Å
262D48.5Very low60.5Low208 Ų208118.2 Ų118.2100%1.11262%0.622SS**  trans-100.90165.3-70.2-23.9000110.3

Retrieved 262 of 262 residues in 65.8 ms (Link to these results)

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