A0A089G6S9_HUMAN Loading...

C-C chemokine receptor type 5

Receptor for a number of inflammatory CC-chemokines including CCL3/MIP-1-alpha, CCL4/MIP-1-beta and RANTES and subsequently transduces a signal by increasing the intracellular calcium ion level. May play a role in the control of granulocytic lineage proliferation or differentiation. Participates in T-lymphocyte migration to the infection site by acting as a chemotactic receptor.

AlphaFold DB , UniProt , Accession A0A089G6S9, Species HUMAN (Homo sapiens, Human), Gene CCR5, Length 352 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
1M40.9Very low39.5Very low222 Ų222152.5 Ų152.5100%1.09479%0.786SS**  089.50-84.5-171.5-179.400104.8
2D35.3Very low39.7Very low156 Ų156152.1 Ų152.183%0.83478%0.784SS**  trans-90.2114.8-167.5-59.2-24000108.6Q4D2-Q4 PolarHBondContact O-N 3.28Å
3Y41.7Very low39.6Very low222 Ų222150.5 Ų150.587%0.87178%0.777SS**  trans-76.1103.5172.6-77.3-89.9000108.8V5Y3-V5 PolarHBondContact O-N 3.46Å
4Q37.1Very low39.5Very low183 Ų183154.5 Ų154.586%0.85578%0.78SS**  trans-83101.4165.7-81.6173.5-38.200109.3D2 S6D2-Q4 PolarHBondContact O-N 3.28Å; Q4-S6 PolarHBondContact O-N 3.39Å
5V45.3Very low39.6Very low141 Ų141158 Ų15886%0.85578%0.782SS**  trans-8895.9157.7179.30000106.7Y3Y3-V5 PolarHBondContact O-N 3.46Å
6S41.6Very low40.1Very low108 Ų108156.1 Ų156.176%0.75578%0.782SS**  trans-101.6105.2170.154.40000109.9Q4Q4-S6 PolarHBondContact O-N 3.39Å
7S40.8Very low40.5Very low81 Ų81153.2 Ų153.257%0.56678%0.78SS**  trans-156.2120.9153.6-178.40000109.5I9S7-I9 PolarHBondContact OG-N 3.08Å; S7-I9 VanDerWaalsContact OG-N 3.13Å
8P40.1Very low41Very low107 Ų107155 Ų15570%0.69579%0.785SS**  trans-115.565.2148.436.5-23.6000107.9Y10P8-Y10 HydrophobicContact CB-CE2 4.18Å; P8-Y10 PolarHBondContact O-N 3.41Å
9I38.2Very low42Very low130 Ų130152.8 Ų152.867%0.66778%0.782SS**  trans-80.6101.4149.6-65.5173.9000104.4S7 D11S7-I9 PolarHBondContact OG-N 3.08Å; S7-I9 VanDerWaalsContact OG-N 3.13Å; I9-D11 PolarHBondContact O-N 3.06Å
10Y38.2Very low43.2Very low206 Ų206147.3 Ų147.381%0.80876%0.758SS**  trans-6689.7169.3-74.6-86.5000107.9P8 I12P8-Y10 HydrophobicContact CB-CE2 4.18Å; P8-Y10 PolarHBondContact O-N 3.41Å; Y10-I12 PolarHBondContact O-N 3.24Å; Y10-I12 VanDerWaalsContact O-N 3.12Å
11D35.9Very low44.2Very low121 Ų121147.5 Ų147.565%0.64776%0.755SS**  trans-65.5106.3161.9-88.8-28.7000107.4I9 N13I9-D11 PolarHBondContact O-N 3.06Å; D11-N13 PolarHBondContact O-N 3.4Å
12I41.4Very low45.4Very low148 Ų148141.1 Ų141.176%0.75972%0.721SS**  trans-69.682.3165.9-59.5174.5000106.2Y10 Y14Y10-I12 PolarHBondContact O-N 3.24Å; Y10-I12 VanDerWaalsContact O-N 3.12Å; I12-Y14 VanDerWaalsContact C-N 3.35Å; I12-Y14 HydrophobicContact CG2-CD2 3.99Å; I12-Y14 HydrophobicContact CG2-CE2 4.42Å; I12-Y14 PolarHBondContact O-N 2.9Å
13N38.7Very low46.7Very low131 Ų131138.1 Ų138.170%0.70170%0.704SS**  trans-71.288.1173.2-84.8-49.5000109.6D11 Y15D11-N13 PolarHBondContact O-N 3.4Å; N13-Y15 PolarHBondContact O-N 3.47Å
14Y37.7Very low48Very low207 Ų207133.3 Ų133.381%0.81269%0.694SS**  trans-81.2100.7153.8-99.3-92.1000107.9I12 T16I12-Y14 VanDerWaalsContact C-N 3.35Å; I12-Y14 HydrophobicContact CG2-CD2 3.99Å; I12-Y14 HydrophobicContact CG2-CE2 4.42Å; I12-Y14 PolarHBondContact O-N 2.9Å; Y14-T16 PolarHBondContact O-N 3.12Å
15Y40.8Very low49.6Very low207 Ų207126.2 Ų126.281%0.81266%0.663SS**SBendtrans-53.7122.1168.7-115-105.5000109.1N13N13-Y15 PolarHBondContact O-N 3.47Å
16T48Very low51Low127 Ų127125.2 Ų125.278%0.77965%0.647SS**SBendtrans69.272.5174.660.30000117.7Y14Y14-T16 PolarHBondContact O-N 3.12Å
17S46.1Very low52.8Low108 Ų108125.4 Ų125.476%0.75564%0.636SS**  162.789.9122.138.40000109.2P19S17-P19 WeakPolarHBondContact O-CD 3.33Å
18E49.6Very low54.7Low185 Ų185126.6 Ų126.686%0.86464%0.635SS**  trans-57.3126.9167.2-73.5-174.4168.100108.6C20E18-C20 PolarHBondContact O-N 3.13Å; E18-C20 VanDerWaalsContact O-N 3.12Å
19P60.6Low56.8Low113 Ų113122.3 Ų122.373%0.73461%0.608SS**  trans-59.4121.9174.421.2-29.1000108.7S17 Q21S17-P19 WeakPolarHBondContact O-CD 3.33Å; P19-Q21 PolarHBondContact O-N 3.37Å
20C66.1Low59Low43 Ų43117.5 Ų117.529%0.29159%0.588SS.*  trans-49.4107.5-178.4-171.40000109.7E18 K22 C269E18-C20 PolarHBondContact O-N 3.13Å; E18-C20 VanDerWaalsContact O-N 3.12Å; C20-K22 PolarHBondContact O-N 3.31Å; C20-C269 HydrophobicContact CB-CB 4.12Å; C20-C269 WeakPolarHBondContact CB-SG 3.47Å; C20-C269 WeakPolarHBondContact SG-CB 3.44Å; C20-C269 PolarHBondContact SG-O 3.02Å; C20-C269 CovalentContact SG-SG 2.07Å; C20-C269 PolarHBondContact SG-SG 2.89Å
21Q63.3Low61.4Low151 Ų151117.4 Ų117.471%0.70659%0.586SS**  trans-72.9119.7-171.3-74.2-165.5-12.600111.8P19 I23P19-Q21 PolarHBondContact O-N 3.37Å; Q21-I23 HydrophobicContact CB-CD1 4.46Å; Q21-I23 HydrophobicContact CB-CG1 4.49Å
22K66.6Low64Low89 Ų89117 Ų11739%0.38758%0.583SS.*  trans-104.722.1-176.1-61.2178.2179.7179.60114.4C20 N24 V25 D276C20-K22 PolarHBondContact O-N 3.31Å; K22-N24 PolarHBondContact O-N 3.32Å; K22-V25 PolarHBondContact O-N 2.9Å; K22-D276 WeakPolarHBondContact CE-OD2 3.29Å; K22-D276 IonicContact NZ-OD1 3.36Å; K22-D276 PolarHBondContact NZ-OD1 3.08Å; K22-D276 VanDerWaalsContact NZ-OD1 3.12Å; K22-D276 IonicContact NZ-OD2 3.99Å; K22-D276 PolarHBondContact NZ-OD2 3.13Å
23I63.6Low66.3Low92 Ų92110.6 Ų110.647%0.47255%0.55SS.*Hα-helixtrans-57-42.5-164.2-60.6171.3000113Q21 V25Q21-I23 HydrophobicContact CB-CD1 4.46Å; Q21-I23 HydrophobicContact CB-CG1 4.49Å; I23-V25 VanDerWaalsContact C-N 3.34Å; I23-V25 PolarHBondContact O-N 2.99Å
24N67.8Low68.9Low122 Ų122105.4 Ų105.465%0.65252%0.524SS*.Hα-helixtrans-67.3-31-176.2-67.6-12.9000113.5K22 I28K22-N24 PolarHBondContact O-N 3.32Å; N24-I28 WeakPolarHBondContact O-CG1 3.35Å; N24-I28 PolarHBondContact O-N 2.84Å
25V72.1Confident71.6Confident33 Ų3399.2 Ų99.220%0.251%0.509CS..Hα-helixtrans-75.5-42.9-175.7-176.30000111K22 I23 Q27 I28 A29 Q277K22-V25 PolarHBondContact O-N 2.9Å; I23-V25 VanDerWaalsContact C-N 3.34Å; I23-V25 PolarHBondContact O-N 2.99Å; V25-Q27 VanDerWaalsContact C-N 3.32Å; V25-Q27 PolarHBondContact O-N 3.09Å; V25-I28 PolarHBondContact O-N 3.43Å; V25-A29 WeakPolarHBondContact O-CB 3.46Å; V25-A29 PolarHBondContact O-N 2.81Å; V25-Q277 HydrophobicContact CB-CG 4.32Å; V25-Q277 HydrophobicContact CG1-CG 3.83Å; V25-Q277 HydrophobicContact CG2-CG 3.46Å; V25-Q277 VanDerWaalsContact CG2-CG 3.46Å
26K73.8Confident74.2Confident120 Ų12092.5 Ų92.552%0.52249%0.487SS..Hα-helixtrans-62.9-39.6-179.1-168178.3179.3-176.70111.7A29 A30K26-A29 PolarHBondContact O-N 3.16Å; K26-A30 VanDerWaalsContact O-CB 3.3Å; K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 3.11Å
27Q79.8Confident76.4Confident113 Ų11386.7 Ų86.753%0.52845%0.451SS..Hα-helixtrans-68-40.2179-69.3-179.6-5.700113V25 A30 R31V25-Q27 VanDerWaalsContact C-N 3.32Å; V25-Q27 PolarHBondContact O-N 3.09Å; Q27-A30 PolarHBondContact O-N 3.43Å; Q27-R31 PolarHBondContact O-N 3.29Å
28I81.4Confident78.7Confident105 Ų10584.3 Ų84.354%0.53843%0.434SS..Hα-helixtrans-66.4-45.6176.2-67.1169.6000110N24 V25 A30 R31 L32N24-I28 WeakPolarHBondContact O-CG1 3.35Å; N24-I28 PolarHBondContact O-N 2.84Å; V25-I28 PolarHBondContact O-N 3.43Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 2.83Å; I28-R31 PolarHBondContact O-N 3.46Å; I28-L32 HydrophobicContact CG2-CD1 3.68Å; I28-L32 HydrophobicContact CG2-CG 4.45Å; I28-L32 PolarHBondContact O-N 2.84Å; I28-L32 VanDerWaalsContact O-N 3.08Å
29A82.4Confident80.8Confident17 Ų1779.6 Ų79.614%0.1442%0.415CS..Hα-helixtrans-58.6-43.6176.100000111.9V25 K26 R31 L32 L33V25-A29 WeakPolarHBondContact O-CB 3.46Å; V25-A29 PolarHBondContact O-N 2.81Å; K26-A29 PolarHBondContact O-N 3.16Å; A29-R31 PolarHBondContact O-N 2.84Å; A29-L32 PolarHBondContact O-N 3.45Å; A29-L33 HydrophobicContact CB-CD1 3.8Å; A29-L33 HydrophobicContact CB-CG 4.25Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.42Å; A29-L33 VanDerWaalsContact O-CG 3.24Å; A29-L33 WeakPolarHBondContact O-CG 3.28Å; A29-L33 PolarHBondContact O-N 3.22Å
30A84.8Confident82.5Confident29 Ų2974.6 Ų74.624%0.2438%0.382CS..Hα-helixtrans-62.8-25.4178.700000114.1K26 Q27 I28 P34 A90K26-A30 VanDerWaalsContact O-CB 3.3Å; K26-A30 WeakPolarHBondContact O-CB 3.49Å; K26-A30 PolarHBondContact O-N 3.11Å; Q27-A30 PolarHBondContact O-N 3.43Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 2.83Å; A30-P34 VanDerWaalsContact O-CD 3.28Å; A30-P34 WeakPolarHBondContact O-CD 3.27Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.45Å; A30-A90 VanDerWaalsContact CA-O 3.23Å; A30-A90 WeakPolarHBondContact CA-O 3.38Å; A30-A90 WeakPolarHBondContact CB-O 3.35Å
31R88.8Confident83.9Confident205 Ų20575.3 Ų75.377%0.77438%0.38SS*.Hα-helixtrans-88.5-35.9176.6-67.9-179.1-177.1-173.11.9113Q27 I28 A29 P35Q27-R31 PolarHBondContact O-N 3.29Å; I28-R31 PolarHBondContact O-N 3.46Å; A29-R31 PolarHBondContact O-N 2.84Å; R31-P35 WeakPolarHBondContact O-CD 3.49Å; R31-P35 WeakPolarHBondContact O-CG 3.47Å
32L90.1Very high85.5Confident112 Ų11272.7 Ų72.759%0.58637%0.37SS*.Hα-helixtrans-91.6-39.4-173.1-69175.6000113.8I28 A29 P35 L36I28-L32 HydrophobicContact CG2-CD1 3.68Å; I28-L32 HydrophobicContact CG2-CG 4.45Å; I28-L32 PolarHBondContact O-N 2.84Å; I28-L32 VanDerWaalsContact O-N 3.08Å; A29-L32 PolarHBondContact O-N 3.45Å; L32-P35 WeakPolarHBondContact O-CD 3.32Å; L32-P35 WeakPolarHBondContact O-CG 3.16Å; L32-L36 WeakPolarHBondContact O-CB 3.23Å; L32-L36 PolarHBondContact O-N 3.08Å
33L91Very high86.8Confident13 Ų1374.4 Ų74.47%0.06838%0.378CS..Hα-helixtrans-68.6-44.3-173.1-61.7178.7000113.4A29 L36 Y37 A90 Q280 T284A29-L33 HydrophobicContact CB-CD1 3.8Å; A29-L33 HydrophobicContact CB-CG 4.25Å; A29-L33 VanDerWaalsContact O-CB 3.27Å; A29-L33 WeakPolarHBondContact O-CB 3.42Å; A29-L33 VanDerWaalsContact O-CG 3.24Å; A29-L33 WeakPolarHBondContact O-CG 3.28Å; A29-L33 PolarHBondContact O-N 3.22Å; L33-L36 PolarHBondContact O-N 2.9Å; L33-Y37 HydrophobicContact CB-CD2 4.41Å; L33-Y37 HydrophobicContact CB-CE2 4.19Å; L33-Y37 HydrophobicContact CD2-CE1 4.29Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.36Å; L33-Y37 PolarHBondContact O-N 3.15Å; L33-A90 HydrophobicContact CB-CB 3.88Å; L33-A90 HydrophobicContact CD1-CB 3.89Å; L33-Q280 HydrophobicContact CD1-CG 4.46Å; L33-T284 HydrophobicContact CD2-CG2 3.51Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.39Å
34P93.1Very high88.3Confident23 Ų2370 Ų7015%0.14936%0.355CS..Hα-helixtrans-59.6-48.4-177.2-22.533.2000115A30 S38 A91A30-P34 VanDerWaalsContact O-CD 3.28Å; A30-P34 WeakPolarHBondContact O-CD 3.27Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.45Å; P34-S38 WeakPolarHBondContact O-CB 3.45Å; P34-S38 PolarHBondContact O-N 3.36Å; P34-S38 PolarHBondContact O-OG 3.12Å; P34-A91 HydrophobicContact CB-CB 4.43Å; P34-A91 HydrophobicContact CG-CB 3.68Å
35P94.6Very high89.6Confident77 Ų7767.7 Ų67.750%0.534%0.34SS..Hα-helixtrans-67-37.3177.225.5-32.9000112R31 L32 S38 L39R31-P35 WeakPolarHBondContact O-CD 3.49Å; R31-P35 WeakPolarHBondContact O-CG 3.47Å; L32-P35 WeakPolarHBondContact O-CD 3.32Å; L32-P35 WeakPolarHBondContact O-CG 3.16Å; P35-S38 PolarHBondContact O-N 3.35Å; P35-L39 PolarHBondContact O-N 3.12Å
36L94.2Very high90.7Very high65 Ų6570.6 Ų70.634%0.3436%0.357SS..Hα-helixtrans-63.8-48.7177.2179.262.5000111.7L32 L33 S38 L39 V40 T284L32-L36 WeakPolarHBondContact O-CB 3.23Å; L32-L36 PolarHBondContact O-N 3.08Å; L33-L36 PolarHBondContact O-N 2.9Å; L36-S38 VanDerWaalsContact C-N 3.31Å; L36-S38 PolarHBondContact O-N 2.89Å; L36-L39 WeakPolarHBondContact O-CB 3.36Å; L36-L39 PolarHBondContact O-N 3.37Å; L36-L39 VanDerWaalsContact O-N 3.16Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.31Å; L36-T284 HydrophobicContact CD2-CG2 3.49Å; L36-T284 VanDerWaalsContact CD2-CG2 3.49Å
37Y94.4Very high91.7Very high5 Ų565.6 Ų65.62%0.0234%0.339CS..Hα-helixtrans-64.8-35.4177.8-74.4-3.2000112.2L33 L39 V40 F41 V83 W86 A87 T284 M287L33-Y37 HydrophobicContact CB-CD2 4.41Å; L33-Y37 HydrophobicContact CB-CE2 4.19Å; L33-Y37 HydrophobicContact CD2-CE1 4.29Å; L33-Y37 VanDerWaalsContact O-CB 3.29Å; L33-Y37 WeakPolarHBondContact O-CB 3.36Å; L33-Y37 PolarHBondContact O-N 3.15Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; Y37-V40 PolarHBondContact O-N 3.48Å; Y37-F41 WeakPolarHBondContact O-CB 3.46Å; Y37-F41 PolarHBondContact O-N 3.17Å; Y37-V83 HydrophobicContact CG-CG1 4.05Å; Y37-V83 VanDerWaalsContact O-CG1 3.31Å; Y37-V83 WeakPolarHBondContact O-CG1 3.12Å; Y37-W86 HydrophobicContact CD2-CB 4.3Å; Y37-W86 HydrophobicContact CE2-CB 4.15Å; Y37-A87 HydrophobicContact CD2-CB 4.11Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; Y37-T284 HydrophobicContact CE1-CG2 3.87Å; Y37-T284 PolarHBondContact OH-OG1 3Å; Y37-M287 HydrophobicContact CE1-CB 4.17Å; Y37-M287 HydrophobicContact CE1-SD 3.79Å; Y37-M287 HydrophobicContact CE2-SD 3.83Å; Y37-M287 PolarHBondContact OH-SD 2.84Å
38S94.6Very high92.4Very high59 Ų5960.2 Ų60.241%0.41331%0.314SS..Hα-helixtrans-62-42.7172-58.90000111.5P34 P35 L36 F41 I42P34-S38 WeakPolarHBondContact O-CB 3.45Å; P34-S38 PolarHBondContact O-N 3.36Å; P34-S38 PolarHBondContact O-OG 3.12Å; P35-S38 PolarHBondContact O-N 3.35Å; L36-S38 VanDerWaalsContact C-N 3.31Å; L36-S38 PolarHBondContact O-N 2.89Å; S38-F41 PolarHBondContact O-N 3.42Å; S38-I42 VanDerWaalsContact O-CG1 3.31Å; S38-I42 WeakPolarHBondContact O-CG1 3.38Å; S38-I42 PolarHBondContact O-N 3.37Å
39L94.9Very high93.1Very high86 Ų8658.3 Ų58.345%0.4530%0.304SS..Hα-helixtrans-64.8-44.7176.5-167.468.6000112P35 L36 Y37 F41 I42 F43P35-L39 PolarHBondContact O-N 3.12Å; L36-L39 WeakPolarHBondContact O-CB 3.36Å; L36-L39 PolarHBondContact O-N 3.37Å; L36-L39 VanDerWaalsContact O-N 3.16Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.44Å; L39-I42 PolarHBondContact O-N 2.95Å; L39-F43 HydrophobicContact CD1-CD2 3.84Å; L39-F43 HydrophobicContact CD1-CE2 3.25Å; L39-F43 HydrophobicContact CD1-CZ 3.93Å; L39-F43 HydrophobicContact CD2-CD2 4.46Å; L39-F43 HydrophobicContact CD2-CE2 4.03Å; L39-F43 HydrophobicContact CG-CD2 3.68Å; L39-F43 HydrophobicContact CG-CE2 3.47Å; L39-F43 VanDerWaalsContact CG-CE2 3.47Å; L39-F43 WeakPolarHBondContact O-CD2 3.44Å; L39-F43 PolarHBondContact O-N 2.91Å
40V95.3Very high93.5Very high7 Ų759 Ų594%0.04231%0.305CS..Hα-helixtrans-59.3-43.8175170.80000110.5L36 Y37 G44 L80 T288L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.31Å; Y37-V40 PolarHBondContact O-N 3.48Å; V40-G44 WeakPolarHBondContact O-CA 3.28Å; V40-G44 PolarHBondContact O-N 2.7Å; V40-L80 HydrophobicContact CG1-CD2 4.28Å; V40-T288 HydrophobicContact CG2-CG2 3.73Å
41F96.2Very high93.9Very high58 Ų5857.8 Ų57.825%0.25430%0.295SS..Hα-helixtrans-61-49.9177.1179.5-102.7000111.7Y37 S38 L39 F45 L80 V83 P84Y37-F41 WeakPolarHBondContact O-CB 3.46Å; Y37-F41 PolarHBondContact O-N 3.17Å; S38-F41 PolarHBondContact O-N 3.42Å; L39-F41 VanDerWaalsContact C-N 3.31Å; L39-F41 PolarHBondContact O-N 3.44Å; F41-F45 HydrophobicContact CE2-CD2 4.38Å; F41-F45 HydrophobicContact CZ-CD2 4.32Å; F41-F45 WeakPolarHBondContact O-CB 3.34Å; F41-F45 PolarHBondContact O-N 3.47Å; F41-L80 HydrophobicContact CD2-CB 4.49Å; F41-L80 VanDerWaalsContact CD2-O 3.29Å; F41-L80 WeakPolarHBondContact CD2-O 3.44Å; F41-V83 HydrophobicContact CB-CG1 4.36Å; F41-P84 HydrophobicContact CD1-CG 4.35Å; F41-P84 HydrophobicContact CD2-CG 3.66Å; F41-P84 HydrophobicContact CE1-CG 4.46Å; F41-P84 HydrophobicContact CE2-CG 3.79Å; F41-P84 HydrophobicContact CG-CG 3.95Å; F41-P84 HydrophobicContact CZ-CG 4.2Å
42I95.6Very high94.1Very high97 Ų9749.2 Ų49.250%0.49726%0.264SS..Hα-helixtrans-60.9-54.6-178.6-68.1165000110.8S38 L39 V46S38-I42 VanDerWaalsContact O-CG1 3.31Å; S38-I42 WeakPolarHBondContact O-CG1 3.38Å; S38-I42 PolarHBondContact O-N 3.37Å; L39-I42 PolarHBondContact O-N 2.95Å; I42-V46 WeakPolarHBondContact O-CB 3.25Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.2Å; I42-V46 PolarHBondContact O-N 3.43Å; I42-V46 VanDerWaalsContact O-N 3.1Å
43F94.3Very high94.2Very high124 Ų12447.4 Ų47.454%0.54425%0.254SS..Hα-helixtrans-68.3-40.4-177.8-70.5-48.8000112.3L39 G47 C291L39-F43 HydrophobicContact CD1-CD2 3.84Å; L39-F43 HydrophobicContact CD1-CE2 3.25Å; L39-F43 HydrophobicContact CD1-CZ 3.93Å; L39-F43 HydrophobicContact CD2-CD2 4.46Å; L39-F43 HydrophobicContact CD2-CE2 4.03Å; L39-F43 HydrophobicContact CG-CD2 3.68Å; L39-F43 HydrophobicContact CG-CE2 3.47Å; L39-F43 VanDerWaalsContact CG-CE2 3.47Å; L39-F43 WeakPolarHBondContact O-CD2 3.44Å; L39-F43 PolarHBondContact O-N 2.91Å; F43-G47 WeakPolarHBondContact O-CA 3.22Å; F43-G47 PolarHBondContact O-N 3.15Å; F43-C291 HydrophobicContact CB-CB 4.42Å
44G95.3Very high94Very high0 Ų046.8 Ų46.80%025%0.251CS..Hα-helixtrans-64.7-45.3178.400000112V40 N48 L80 C291V40-G44 WeakPolarHBondContact O-CA 3.28Å; V40-G44 PolarHBondContact O-N 2.7Å; G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.29Å; G44-N48 PolarHBondContact O-N 3.42Å; G44-N48 PolarHBondContact O-ND2 2.88Å; G44-L80 WeakPolarHBondContact O-CD1 3.26Å; G44-C291 VanDerWaalsContact CA-CB 3.48Å
45F95.9Very high93.9Very high74 Ų7445.8 Ų45.833%0.32524%0.244SC..Hα-helixtrans-66.1-51.3-179.1-172.1-92.1000111.1F41 G47 M49 L77F41-F45 HydrophobicContact CE2-CD2 4.38Å; F41-F45 HydrophobicContact CZ-CD2 4.32Å; F41-F45 WeakPolarHBondContact O-CB 3.34Å; F41-F45 PolarHBondContact O-N 3.47Å; F45-G47 PolarHBondContact O-N 2.87Å; F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.39Å; F45-M49 HydrophobicContact CE1-CE 4.3Å; F45-M49 HydrophobicContact CE1-CG 3.95Å; F45-M49 HydrophobicContact CE2-CE 3.6Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.14Å; F45-M49 VanDerWaalsContact O-CB 3.25Å; F45-M49 WeakPolarHBondContact O-CB 3.36Å; F45-M49 WeakPolarHBondContact O-CG 3.36Å; F45-M49 PolarHBondContact O-N 3.14Å; F45-L77 HydrophobicContact CD2-CD2 3.93Å; F45-L77 HydrophobicContact CE2-CD2 4.33Å
46V94.7Very high93.7Very high94 Ų9445.9 Ų45.957%0.5724%0.24SC*.Hα-helixtrans-61.8-45178.81750000110.9I42 L50I42-V46 WeakPolarHBondContact O-CB 3.25Å; I42-V46 VanDerWaalsContact O-CG2 3.3Å; I42-V46 WeakPolarHBondContact O-CG2 3.2Å; I42-V46 PolarHBondContact O-N 3.43Å; I42-V46 VanDerWaalsContact O-N 3.1Å; V46-L50 WeakPolarHBondContact O-CB 3.46Å; V46-L50 PolarHBondContact O-N 3.05Å
47G93.6Very high93.2Very high14 Ų1447 Ų4714%0.14425%0.247CC..Hα-helixtrans-62.6-51.2-179.600000112.8F43 F45 L50 V51 P294F43-G47 WeakPolarHBondContact O-CA 3.22Å; F43-G47 PolarHBondContact O-N 3.15Å; F45-G47 PolarHBondContact O-N 2.87Å; G47-L50 PolarHBondContact O-N 3.18Å; G47-V51 WeakPolarHBondContact O-CG2 3.23Å; G47-V51 PolarHBondContact O-N 2.76Å; G47-P294 VanDerWaalsContact C-CG 3.4Å
48N95.7Very high92.7Very high0 Ų048.7 Ų48.70%026%0.258CS..Hα-helixtrans-69.7-36.2-178.6-74.3-63000112.2G44 L50 V51 I52 L77 C290G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.29Å; G44-N48 PolarHBondContact O-N 3.42Å; G44-N48 PolarHBondContact O-ND2 2.88Å; N48-L50 VanDerWaalsContact C-N 3.34Å; N48-L50 PolarHBondContact O-N 2.95Å; N48-V51 WeakPolarHBondContact O-CB 3.47Å; N48-V51 PolarHBondContact O-N 3.43Å; N48-I52 WeakPolarHBondContact O-CG1 3.4Å; N48-I52 PolarHBondContact O-N 2.99Å; N48-L77 HydrophobicContact CB-CD2 3.99Å; N48-L77 HydrophobicContact CB-CG 4.1Å; N48-C290 PolarHBondContact ND2-O 3.34Å
49M94.8Very high92.1Very high65 Ų6547.6 Ų47.632%0.3225%0.246SC..Hα-helixtrans-62-41.6171.9-74.2-62178.100111.9F45 V51 I52 L53 L77F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.39Å; F45-M49 HydrophobicContact CE1-CE 4.3Å; F45-M49 HydrophobicContact CE1-CG 3.95Å; F45-M49 HydrophobicContact CE2-CE 3.6Å; F45-M49 HydrophobicContact CZ-CE 3.54Å; F45-M49 HydrophobicContact CZ-CG 4.14Å; F45-M49 VanDerWaalsContact O-CB 3.25Å; F45-M49 WeakPolarHBondContact O-CB 3.36Å; F45-M49 WeakPolarHBondContact O-CG 3.36Å; F45-M49 PolarHBondContact O-N 3.14Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 3.09Å; M49-I52 PolarHBondContact O-N 2.69Å; M49-I52 HydrophobicContact SD-CD1 4.49Å; M49-L53 WeakPolarHBondContact O-CB 3.41Å; M49-L53 VanDerWaalsContact O-CG 3.31Å; M49-L53 WeakPolarHBondContact O-CG 3.3Å; M49-L53 PolarHBondContact O-N 3.44Å; M49-L77 HydrophobicContact CE-CD1 3.48Å; M49-L77 VanDerWaalsContact CE-CD1 3.48Å; M49-L77 HydrophobicContact CE-CD2 3.93Å; M49-L77 HydrophobicContact CE-CG 4.37Å; M49-L77 HydrophobicContact CG-CD2 4.41Å; M49-L77 HydrophobicContact SD-CD1 3.89Å
50L91.9Very high91.7Very high33 Ų3352.2 Ų52.217%0.17326%0.258CS..Hα-helixtrans-62.7-40.8175.3-176.462.4000111.7V46 G47 N48 L53 I54 L308 F311 F312V46-L50 WeakPolarHBondContact O-CB 3.46Å; V46-L50 PolarHBondContact O-N 3.05Å; G47-L50 PolarHBondContact O-N 3.18Å; N48-L50 VanDerWaalsContact C-N 3.34Å; N48-L50 PolarHBondContact O-N 2.95Å; L50-L53 PolarHBondContact O-N 2.93Å; L50-I54 HydrophobicContact CD1-CD1 4.02Å; L50-I54 HydrophobicContact CD1-CG1 4.32Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 WeakPolarHBondContact O-CB 3.38Å; L50-I54 VanDerWaalsContact O-CG1 3.31Å; L50-I54 WeakPolarHBondContact O-CG1 3.44Å; L50-I54 PolarHBondContact O-N 3.47Å; L50-L308 HydrophobicContact CD2-CD1 3.74Å; L50-L308 HydrophobicContact CD2-CG 4.29Å; L50-F311 HydrophobicContact CD1-CD1 3.81Å; L50-F311 HydrophobicContact CD1-CE1 3.7Å; L50-F311 HydrophobicContact CD1-CZ 4.37Å; L50-F312 HydrophobicContact CD2-CE2 4.45Å
51V92.3Very high91.4Very high3 Ų353.8 Ų53.82%0.01827%0.266CS..Hα-helixtrans-58.1-50.2174.3171.70000110.7G47 N48 M49 L53 I54 L55 A73 P294 Y297 F304G47-V51 WeakPolarHBondContact O-CG2 3.23Å; G47-V51 PolarHBondContact O-N 2.76Å; N48-V51 WeakPolarHBondContact O-CB 3.47Å; N48-V51 PolarHBondContact O-N 3.43Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 3.09Å; V51-L53 PolarHBondContact O-N 3.1Å; V51-I54 PolarHBondContact O-N 2.73Å; V51-L55 HydrophobicContact CG1-CD1 3.73Å; V51-L55 HydrophobicContact CG1-CG 4.25Å; V51-L55 WeakPolarHBondContact O-CB 2.91Å; V51-L55 VanDerWaalsContact O-CG 3.23Å; V51-L55 WeakPolarHBondContact O-CG 3.4Å; V51-L55 PolarHBondContact O-N 3.32Å; V51-A73 HydrophobicContact CB-CB 4.48Å; V51-A73 HydrophobicContact CG1-CB 4.06Å; V51-P294 HydrophobicContact CG2-CB 4.12Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; V51-Y297 HydrophobicContact CG1-CD2 4.33Å; V51-Y297 HydrophobicContact CG1-CE2 4.23Å; V51-Y297 HydrophobicContact CG2-CD2 3.71Å; V51-Y297 HydrophobicContact CG2-CE2 4.18Å; V51-F304 HydrophobicContact CB-CE2 4.36Å; V51-F304 HydrophobicContact CB-CZ 4.41Å; V51-F304 HydrophobicContact CG1-CE2 4.49Å; V51-F304 HydrophobicContact CG2-CE2 3.93Å; V51-F304 HydrophobicContact CG2-CZ 3.62Å
52I94.3Very high90.9Very high24 Ų2458.6 Ų58.612%0.12329%0.287CS..Hα-helixtrans-58.1-48.8178.4-68.7170.4000110.9N48 M49 I54 L55 I56 L70 A73 I74 L77N48-I52 WeakPolarHBondContact O-CG1 3.4Å; N48-I52 PolarHBondContact O-N 2.99Å; M49-I52 PolarHBondContact O-N 2.69Å; M49-I52 HydrophobicContact SD-CD1 4.49Å; I52-I54 VanDerWaalsContact C-N 3.34Å; I52-I54 PolarHBondContact O-N 3.11Å; I52-L55 PolarHBondContact O-N 3.48Å; I52-I56 HydrophobicContact CG2-CD1 3.66Å; I52-I56 HydrophobicContact CG2-CG1 4.46Å; I52-I56 WeakPolarHBondContact O-CG1 3.24Å; I52-I56 PolarHBondContact O-N 3.06Å; I52-L70 HydrophobicContact CB-CD1 4.27Å; I52-L70 HydrophobicContact CG1-CD1 4Å; I52-L70 HydrophobicContact CG2-CD1 3.96Å; I52-A73 HydrophobicContact CD1-CB 4.23Å; I52-A73 HydrophobicContact CG1-CB 3.8Å; I52-I74 HydrophobicContact CD1-CG1 4.22Å; I52-L77 HydrophobicContact CD1-CD1 3.37Å; I52-L77 HydrophobicContact CD1-CG 4.44Å
53L91.1Very high90.6Very high74 Ų7455.8 Ų55.839%0.38728%0.275SS..Hα-helixtrans-59.6-43179.3-73.3171.3000112.3M49 L50 V51 N57 F311M49-L53 WeakPolarHBondContact O-CB 3.41Å; M49-L53 VanDerWaalsContact O-CG 3.31Å; M49-L53 WeakPolarHBondContact O-CG 3.3Å; M49-L53 PolarHBondContact O-N 3.44Å; L50-L53 PolarHBondContact O-N 2.93Å; V51-L53 PolarHBondContact O-N 3.1Å; L53-N57 WeakPolarHBondContact O-CB 3.41Å; L53-N57 PolarHBondContact O-N 3.02Å; L53-N57 PolarHBondContact O-ND2 3.46Å; L53-F311 HydrophobicContact CD1-CZ 4.39Å
54I88.2Confident90.4Very high0 Ų050.9 Ų50.90%026%0.255CS..Iπ-helixtrans-66.5-42.6177.7-72.4169.2000110.9L50 V51 I52 C58 K59 F304 Y307 L308L50-I54 HydrophobicContact CD1-CD1 4.02Å; L50-I54 HydrophobicContact CD1-CG1 4.32Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 WeakPolarHBondContact O-CB 3.38Å; L50-I54 VanDerWaalsContact O-CG1 3.31Å; L50-I54 WeakPolarHBondContact O-CG1 3.44Å; L50-I54 PolarHBondContact O-N 3.47Å; V51-I54 PolarHBondContact O-N 2.73Å; I52-I54 VanDerWaalsContact C-N 3.34Å; I52-I54 PolarHBondContact O-N 3.11Å; I54-C58 HydrophobicContact CG2-CB 4.31Å; I54-C58 WeakPolarHBondContact O-CA 3.5Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.33Å; I54-C58 PolarHBondContact O-N 3.23Å; I54-K59 PolarHBondContact O-N 3.4Å; I54-F304 HydrophobicContact CB-CE2 4.1Å; I54-F304 HydrophobicContact CD1-CD2 4.44Å; I54-F304 HydrophobicContact CD1-CE1 4.29Å; I54-F304 HydrophobicContact CD1-CE2 3.69Å; I54-F304 HydrophobicContact CD1-CZ 3.6Å; I54-F304 HydrophobicContact CG2-CD2 4.11Å; I54-F304 HydrophobicContact CG2-CE2 3.96Å; I54-Y307 HydrophobicContact CG2-CG 4.31Å; I54-L308 HydrophobicContact CD1-CB 4.07Å; I54-L308 HydrophobicContact CD1-CG 4.44Å
55L89.3Confident90.2Very high2 Ų251.5 Ų51.51%0.0126%0.258CS..Iπ-helixtrans-63.6-43.3-179.6-72.3175.4000112V51 I52 K59 R60 L61 D66 L69 L70V51-L55 HydrophobicContact CG1-CD1 3.73Å; V51-L55 HydrophobicContact CG1-CG 4.25Å; V51-L55 WeakPolarHBondContact O-CB 2.91Å; V51-L55 VanDerWaalsContact O-CG 3.23Å; V51-L55 WeakPolarHBondContact O-CG 3.4Å; V51-L55 PolarHBondContact O-N 3.32Å; I52-L55 PolarHBondContact O-N 3.48Å; L55-K59 HydrophobicContact CD2-CD 4.02Å; L55-K59 CarbonylContact O-C 3.49Å; L55-R60 PolarHBondContact O-N 2.82Å; L55-L61 HydrophobicContact CB-CD2 3.92Å; L55-L61 PolarHBondContact O-N 2.89Å; L55-D66 HydrophobicContact CD2-CB 4.31Å; L55-L69 HydrophobicContact CD1-CB 3.96Å; L55-L69 HydrophobicContact CD2-CB 4.46Å; L55-L70 HydrophobicContact CD1-CB 4.01Å; L55-L70 HydrophobicContact CD1-CD1 4.43Å
56I90.3Very high90Very high80 Ų8048.8 Ų48.841%0.4125%0.247SC..Iπ-helixtrans-75.3-53.7-179.8-64.3173.8000110.9I52 R60 L61 L70I52-I56 HydrophobicContact CG2-CD1 3.66Å; I52-I56 HydrophobicContact CG2-CG1 4.46Å; I52-I56 WeakPolarHBondContact O-CG1 3.24Å; I52-I56 PolarHBondContact O-N 3.06Å; I56-R60 WeakPolarHBondContact O-CA 3.24Å; I56-R60 PolarHBondContact O-N 3.36Å; I56-L61 HydrophobicContact CG1-CD1 4.33Å; I56-L70 HydrophobicContact CD1-CD1 4.36Å; I56-L70 HydrophobicContact CG1-CD1 4.32Å
57N85.3Confident90Very high89 Ų8944.9 Ų44.948%0.47622%0.223SC..Iπ-helixtrans-85.3-37.4-168-61.3-38.6000113.5L53L53-N57 WeakPolarHBondContact O-CB 3.41Å; L53-N57 PolarHBondContact O-N 3.02Å; L53-N57 PolarHBondContact O-ND2 3.46Å
58C83.4Confident90.1Very high40 Ų4044.4 Ų44.427%0.2722%0.217SC..Iπ-helixtrans-95.2-48.9-175.1-54.90000111.7I54 Y307I54-C58 HydrophobicContact CG2-CB 4.31Å; I54-C58 WeakPolarHBondContact O-CA 3.5Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.33Å; I54-C58 PolarHBondContact O-N 3.23Å; C58-Y307 HydrophobicContact CB-CD1 3.66Å; C58-Y307 HydrophobicContact CB-CE1 4.25Å; C58-Y307 HydrophobicContact CB-CG 4.19Å
59K82.4Confident90Very high36 Ų3645.1 Ų45.116%0.15722%0.22CC..Iπ-helixtrans-85.8-23.4-178.7-77.3-160.7-179.6173.70114.5I54 L55 L61 D66 Y307I54-K59 PolarHBondContact O-N 3.4Å; L55-K59 HydrophobicContact CD2-CD 4.02Å; L55-K59 CarbonylContact O-C 3.49Å; K59-L61 PolarHBondContact O-N 3.36Å; K59-D66 WeakPolarHBondContact CD-OD1 3.27Å; K59-D66 IonicContact NZ-OD1 3.8Å; K59-D66 PolarHBondContact NZ-OD1 3.11Å; K59-Y307 HydrophobicContact CD-CE2 4.2Å; K59-Y307 HydrophobicContact CG-CD2 3.96Å; K59-Y307 HydrophobicContact CG-CE2 3.6Å
60R86.9Confident90Very high182 Ų18243.1 Ų43.169%0.68721%0.211SC*.THydrogen-bonded Turntrans55.432.5-180-53.7-175.4-179-177.4-0.4113.9L55 I56 K62L55-R60 PolarHBondContact O-N 2.82Å; I56-R60 WeakPolarHBondContact O-CA 3.24Å; I56-R60 PolarHBondContact O-N 3.36Å; R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 3Å
61L87.7Confident90.3Very high40 Ų4042.4 Ų42.421%0.20921%0.207CC..THydrogen-bonded Turntrans4740.4171.5-56175.1000115.2L55 I56 K59 S63 D66 I67 L70L55-L61 HydrophobicContact CB-CD2 3.92Å; L55-L61 PolarHBondContact O-N 2.89Å; I56-L61 HydrophobicContact CG1-CD1 4.33Å; K59-L61 PolarHBondContact O-N 3.36Å; L61-S63 PolarHBondContact O-N 3.5Å; L61-D66 HydrophobicContact CD2-CB 4.2Å; L61-I67 HydrophobicContact CB-CD1 3.92Å; L61-I67 HydrophobicContact CD1-CD1 4.26Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; L61-L70 HydrophobicContact CD1-CD2 3.8Å; L61-L70 HydrophobicContact CD2-CB 4.2Å; L61-L70 HydrophobicContact CD2-CD2 4.07Å
62K86.3Confident90.5Very high160 Ų16042.3 Ų42.370%0.69621%0.207SC*.  trans-75.8-5-172.2-64.9-175.4-179.9-172.70114.7R60R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 3Å
63S88.1Confident90.6Very high38 Ų3841.2 Ų41.227%0.26620%0.201SC..SBendtrans-135.6150.9-177.174.60000111.8L61 T65 D66 I67L61-S63 PolarHBondContact O-N 3.5Å; S63-T65 PolarHBondContact O-N 3.24Å; S63-T65 VanDerWaalsContact O-N 3.16Å; S63-D66 PolarHBondContact O-N 3.4Å; S63-D66 PolarHBondContact OG-N 2.9Å; S63-D66 PolarHBondContact OG-OD2 3Å; S63-I67 PolarHBondContact O-N 3Å
64M91.2Very high90.9Very high21 Ų2140 Ų4010%0.10320%0.195CC..Hα-helixtrans-51.6-36.4174.3-175.1173.2-175.600112.4I67 Y68 R140M64-I67 WeakPolarHBondContact O-CB 3.49Å; M64-I67 PolarHBondContact O-N 3.46Å; M64-Y68 HydrophobicContact CE-CE2 3.84Å; M64-Y68 WeakPolarHBondContact CE-OH 3.39Å; M64-Y68 HydrophobicContact CG-CD2 4.43Å; M64-Y68 HydrophobicContact CG-CE2 3.87Å; M64-Y68 PolarHBondContact O-N 3.26Å; M64-R140 HydrophobicContact SD-CB 3.97Å; M64-R140 HydrophobicContact SD-CG 4.13Å
65T90.7Very high91.3Very high13 Ų1340 Ų408%0.0820%0.195CC..Hα-helixtrans-66.4-39.3176.4-40.90000112.7S63 I67 Y68 L69 L122 D125 R126 R140S63-T65 PolarHBondContact O-N 3.24Å; S63-T65 VanDerWaalsContact O-N 3.16Å; T65-I67 VanDerWaalsContact C-N 3.25Å; T65-I67 PolarHBondContact O-N 3.41Å; T65-Y68 PolarHBondContact O-N 2.67Å; T65-L69 HydrophobicContact CG2-CD1 4.37Å; T65-L69 WeakPolarHBondContact O-CB 3.44Å; T65-L69 VanDerWaalsContact O-CG 3.28Å; T65-L69 WeakPolarHBondContact O-CG 3.25Å; T65-L69 PolarHBondContact O-N 2.82Å; T65-L122 HydrophobicContact CG2-CD2 3.7Å; T65-D125 PolarHBondContact OG1-OD2 2.81Å; T65-R126 PolarHBondContact OG1-NH2 3.41Å; T65-R140 PolarHBondContact OG1-NH2 3.31Å
66D91.4Very high91.7Very high16 Ų1640.3 Ų40.39%0.08620%0.196CC..Hα-helixtrans-67.3-31.8176.6-60.6-50.3000110.5L55 K59 L61 S63 L70L55-D66 HydrophobicContact CD2-CB 4.31Å; K59-D66 WeakPolarHBondContact CD-OD1 3.27Å; K59-D66 IonicContact NZ-OD1 3.8Å; K59-D66 PolarHBondContact NZ-OD1 3.11Å; L61-D66 HydrophobicContact CD2-CB 4.2Å; S63-D66 PolarHBondContact O-N 3.4Å; S63-D66 PolarHBondContact OG-N 2.9Å; S63-D66 PolarHBondContact OG-OD2 3Å; D66-L70 WeakPolarHBondContact O-CB 3.27Å; D66-L70 PolarHBondContact O-N 3.35Å
67I95Very high92Very high13 Ų1337.3 Ų37.37%0.06718%0.181CC..Hα-helixtrans-64.6-46.2171.5-58.6-64.8000111.1L61 S63 M64 T65 L70 N71 V142L61-I67 HydrophobicContact CB-CD1 3.92Å; L61-I67 HydrophobicContact CD1-CD1 4.26Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; S63-I67 PolarHBondContact O-N 3Å; M64-I67 WeakPolarHBondContact O-CB 3.49Å; M64-I67 PolarHBondContact O-N 3.46Å; T65-I67 VanDerWaalsContact C-N 3.25Å; T65-I67 PolarHBondContact O-N 3.41Å; I67-L70 WeakPolarHBondContact O-CB 3.42Å; I67-L70 PolarHBondContact O-N 3.37Å; I67-N71 PolarHBondContact O-N 3.07Å; I67-N71 PolarHBondContact O-ND2 3.4Å; I67-V142 HydrophobicContact CD1-CG1 4.22Å; I67-V142 HydrophobicContact CG1-CG1 4.23Å
68Y95.3Very high92.5Very high4 Ų436.3 Ų36.32%0.01617%0.172CC..Hα-helixtrans-67.4-39.2178-64.5-24.2000113.1M64 T65 L70 N71 L72 F118 L121 L122 D125 T148M64-Y68 HydrophobicContact CE-CE2 3.84Å; M64-Y68 WeakPolarHBondContact CE-OH 3.39Å; M64-Y68 HydrophobicContact CG-CD2 4.43Å; M64-Y68 HydrophobicContact CG-CE2 3.87Å; M64-Y68 PolarHBondContact O-N 3.26Å; T65-Y68 PolarHBondContact O-N 2.67Å; Y68-L70 VanDerWaalsContact C-N 3.28Å; Y68-L70 PolarHBondContact O-N 2.63Å; Y68-N71 PolarHBondContact O-N 2.93Å; Y68-L72 WeakPolarHBondContact O-CB 3.1Å; Y68-L72 PolarHBondContact O-N 3.42Å; Y68-F118 HydrophobicContact CD1-CD1 4.06Å; Y68-F118 HydrophobicContact CD1-CE1 4.19Å; Y68-L121 HydrophobicContact CD1-CD1 4.45Å; Y68-L121 HydrophobicContact CD2-CB 4Å; Y68-L121 HydrophobicContact CE1-CB 4.43Å; Y68-L121 HydrophobicContact CE1-CD1 3.99Å; Y68-L121 HydrophobicContact CE2-CB 3.79Å; Y68-L121 HydrophobicContact CG-CB 4.39Å; Y68-L122 HydrophobicContact CD2-CD2 4.36Å; Y68-D125 HydrophobicContact CD2-CB 4.33Å; Y68-D125 HydrophobicContact CE2-CB 4.17Å; Y68-T148 WeakPolarHBondContact CE1-OG1 3.35Å; Y68-T148 PolarHBondContact OH-OG1 2.99Å
69L93.4Very high93.1Very high14 Ų1434.7 Ų34.77%0.07316%0.161CC..Hα-helixtrans-62.7-36.2173.1-70.5171.7000112L55 T65 A73 L122 Y297L55-L69 HydrophobicContact CD1-CB 3.96Å; L55-L69 HydrophobicContact CD2-CB 4.46Å; T65-L69 HydrophobicContact CG2-CD1 4.37Å; T65-L69 WeakPolarHBondContact O-CB 3.44Å; T65-L69 VanDerWaalsContact O-CG 3.28Å; T65-L69 WeakPolarHBondContact O-CG 3.25Å; T65-L69 PolarHBondContact O-N 2.82Å; L69-A73 PolarHBondContact O-N 2.78Å; L69-A73 VanDerWaalsContact O-N 3.1Å; L69-L122 HydrophobicContact CD2-CD1 3.9Å; L69-L122 HydrophobicContact CD2-CD2 4.23Å; L69-L122 HydrophobicContact CG-CD2 4.13Å; L69-Y297 HydrophobicContact CD2-CE1 3.83Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.38Å
70L95.8Very high93.8Very high23 Ų2333 Ų3312%0.1215%0.154CC..Hα-helixtrans-64.3-48.9174.8178.471000111I52 L55 I56 L61 D66 I67 Y68 L72 A73 I74I52-L70 HydrophobicContact CB-CD1 4.27Å; I52-L70 HydrophobicContact CG1-CD1 4Å; I52-L70 HydrophobicContact CG2-CD1 3.96Å; L55-L70 HydrophobicContact CD1-CB 4.01Å; L55-L70 HydrophobicContact CD1-CD1 4.43Å; I56-L70 HydrophobicContact CD1-CD1 4.36Å; I56-L70 HydrophobicContact CG1-CD1 4.32Å; L61-L70 HydrophobicContact CD1-CD2 3.8Å; L61-L70 HydrophobicContact CD2-CB 4.2Å; L61-L70 HydrophobicContact CD2-CD2 4.07Å; D66-L70 WeakPolarHBondContact O-CB 3.27Å; D66-L70 PolarHBondContact O-N 3.35Å; I67-L70 WeakPolarHBondContact O-CB 3.42Å; I67-L70 PolarHBondContact O-N 3.37Å; Y68-L70 VanDerWaalsContact C-N 3.28Å; Y68-L70 PolarHBondContact O-N 2.63Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.18Å; L70-A73 PolarHBondContact O-N 2.86Å; L70-I74 HydrophobicContact CG-CD1 4.09Å; L70-I74 WeakPolarHBondContact O-CG1 3.36Å; L70-I74 PolarHBondContact O-N 3.4Å
71N97.7Very high94.2Very high19 Ų1928 Ų2810%0.10214%0.14CC..Hα-helixtrans-66.1-34.9179.9-75.7-82.1000112.3I67 Y68 I74 S75 F118 S149 W153I67-N71 PolarHBondContact O-N 3.07Å; I67-N71 PolarHBondContact O-ND2 3.4Å; Y68-N71 PolarHBondContact O-N 2.93Å; N71-I74 PolarHBondContact O-N 2.94Å; N71-S75 WeakPolarHBondContact O-CB 3.38Å; N71-S75 PolarHBondContact O-N 3.36Å; N71-F118 HydrophobicContact CB-CD1 3.79Å; N71-F118 HydrophobicContact CB-CD2 3.78Å; N71-F118 HydrophobicContact CB-CE1 3.46Å; N71-F118 VanDerWaalsContact CB-CE1 3.46Å; N71-F118 HydrophobicContact CB-CE2 3.47Å; N71-F118 VanDerWaalsContact CB-CE2 3.47Å; N71-F118 HydrophobicContact CB-CG 3.97Å; N71-F118 HydrophobicContact CB-CZ 3.31Å; N71-S149 PolarHBondContact ND2-OG 3.15Å; N71-W153 PolarHBondContact OD1-NE1 3.4Å
72L95.9Very high94.6Very high0 Ų026.1 Ų26.10%013%0.13CC..Hα-helixtrans-61.2-44.4172.4-177.958.9000111.5Y68 L70 I74 S75 D76 G115 F118 I119 L122 Y297Y68-L72 WeakPolarHBondContact O-CB 3.1Å; Y68-L72 PolarHBondContact O-N 3.42Å; L70-L72 VanDerWaalsContact C-N 3.32Å; L70-L72 PolarHBondContact O-N 3.18Å; L72-I74 VanDerWaalsContact C-N 3.34Å; L72-I74 PolarHBondContact O-N 3.26Å; L72-S75 VanDerWaalsContact O-CB 3.31Å; L72-S75 WeakPolarHBondContact O-CB 3.42Å; L72-S75 PolarHBondContact O-N 3.44Å; L72-D76 PolarHBondContact O-N 2.91Å; L72-G115 WeakPolarHBondContact CD1-O 3.38Å; L72-F118 HydrophobicContact CB-CB 4.16Å; L72-F118 HydrophobicContact CD1-CB 4.36Å; L72-I119 HydrophobicContact CD1-CD1 4.37Å; L72-I119 HydrophobicContact CD1-CG1 4.01Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; L72-L122 HydrophobicContact CD2-CD1 3.94Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.25Å
73A96.4Very high95.1Very high1 Ų118.5 Ų18.51%0.00810%0.097CC..Hα-helixtrans-64.9-36.2175.300000112.6V51 I52 L69 L70 D76 L77V51-A73 HydrophobicContact CB-CB 4.48Å; V51-A73 HydrophobicContact CG1-CB 4.06Å; I52-A73 HydrophobicContact CD1-CB 4.23Å; I52-A73 HydrophobicContact CG1-CB 3.8Å; L69-A73 PolarHBondContact O-N 2.78Å; L69-A73 VanDerWaalsContact O-N 3.1Å; L70-A73 PolarHBondContact O-N 2.86Å; A73-D76 PolarHBondContact O-N 3.46Å; A73-L77 WeakPolarHBondContact O-CG 3.08Å; A73-L77 PolarHBondContact O-N 2.99Å
74I97.7Very high95.4Very high50 Ų5019.2 Ų19.226%0.25610%0.101SC..Hα-helixtrans-65.9-41174-66.9167.1000110.9I52 L70 N71 L72 L77 F78 W153I52-I74 HydrophobicContact CD1-CG1 4.22Å; L70-I74 HydrophobicContact CG-CD1 4.09Å; L70-I74 WeakPolarHBondContact O-CG1 3.36Å; L70-I74 PolarHBondContact O-N 3.4Å; N71-I74 PolarHBondContact O-N 2.94Å; L72-I74 VanDerWaalsContact C-N 3.34Å; L72-I74 PolarHBondContact O-N 3.26Å; I74-L77 WeakPolarHBondContact O-CB 3.41Å; I74-L77 PolarHBondContact O-N 3.45Å; I74-F78 HydrophobicContact CG2-CE1 4.47Å; I74-F78 HydrophobicContact CG2-CE2 4.22Å; I74-F78 HydrophobicContact CG2-CZ 4.15Å; I74-F78 PolarHBondContact O-N 3.32Å; I74-W153 HydrophobicContact CB-CZ2 4.27Å; I74-W153 HydrophobicContact CG2-CH2 3.99Å; I74-W153 HydrophobicContact CG2-CZ2 3.78Å
75S97.6Very high95.6Very high0 Ų020.7 Ų20.70%011%0.107CC..Hα-helixtrans-59-47174.3-1790000112N71 L72 L77 F78 F79 G111 S114 G115N71-S75 WeakPolarHBondContact O-CB 3.38Å; N71-S75 PolarHBondContact O-N 3.36Å; L72-S75 VanDerWaalsContact O-CB 3.31Å; L72-S75 WeakPolarHBondContact O-CB 3.42Å; L72-S75 PolarHBondContact O-N 3.44Å; S75-L77 VanDerWaalsContact C-N 3.27Å; S75-L77 PolarHBondContact O-N 3.37Å; S75-F78 PolarHBondContact O-N 3.08Å; S75-F79 PolarHBondContact O-N 3.27Å; S75-F79 VanDerWaalsContact O-N 3.12Å; S75-G111 WeakPolarHBondContact O-CA 3.49Å; S75-G111 PolarHBondContact OG-O 3.4Å; S75-S114 WeakPolarHBondContact CB-OG 3.4Å; S75-S114 PolarHBondContact OG-OG 3.23Å; S75-G115 VanDerWaalsContact OG-CA 3.25Å; S75-G115 WeakPolarHBondContact OG-CA 3.33Å; S75-G115 PolarHBondContact OG-N 3.33Å
76D96.9Very high95.7Very high8 Ų821.7 Ų21.74%0.04311%0.109CC..Hα-helixtrans-61.3-37.3175.6-71.4-34.5000111.2L72 A73 F79 L80 C290 N293L72-D76 PolarHBondContact O-N 2.91Å; A73-D76 PolarHBondContact O-N 3.46Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 2.7Å; D76-L80 WeakPolarHBondContact O-CB 3.47Å; D76-L80 WeakPolarHBondContact O-CD1 3.34Å; D76-L80 WeakPolarHBondContact O-CG 3.46Å; D76-L80 PolarHBondContact O-N 2.96Å; D76-C290 HydrophobicContact CB-CB 4.41Å; D76-N293 PolarHBondContact OD2-ND2 3.37Å
77L97.2Very high95.8Very high17 Ų1721.3 Ų21.39%0.08911%0.108CC..Hα-helixtrans-65.5-42.7174.9-73.9177.4000113F45 N48 M49 I52 A73 I74 S75 F79 L80 L81F45-L77 HydrophobicContact CD2-CD2 3.93Å; F45-L77 HydrophobicContact CE2-CD2 4.33Å; N48-L77 HydrophobicContact CB-CD2 3.99Å; N48-L77 HydrophobicContact CB-CG 4.1Å; M49-L77 HydrophobicContact CE-CD1 3.48Å; M49-L77 VanDerWaalsContact CE-CD1 3.48Å; M49-L77 HydrophobicContact CE-CD2 3.93Å; M49-L77 HydrophobicContact CE-CG 4.37Å; M49-L77 HydrophobicContact CG-CD2 4.41Å; M49-L77 HydrophobicContact SD-CD1 3.89Å; I52-L77 HydrophobicContact CD1-CD1 3.37Å; I52-L77 HydrophobicContact CD1-CG 4.44Å; A73-L77 WeakPolarHBondContact O-CG 3.08Å; A73-L77 PolarHBondContact O-N 2.99Å; I74-L77 WeakPolarHBondContact O-CB 3.41Å; I74-L77 PolarHBondContact O-N 3.45Å; S75-L77 VanDerWaalsContact C-N 3.27Å; S75-L77 PolarHBondContact O-N 3.37Å; L77-F79 VanDerWaalsContact C-N 3.25Å; L77-F79 PolarHBondContact O-N 3.16Å; L77-L80 HydrophobicContact CD2-CD1 4.24Å; L77-L80 PolarHBondContact O-N 3.22Å; L77-L81 VanDerWaalsContact O-CG 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.41Å; L77-L81 PolarHBondContact O-N 3.43Å
78F96.5Very high95.8Very high67 Ų6724 Ų2429%0.29412%0.12SC..Hα-helixtrans-59.1-40.4174.4-73.5-17.6000111.9I74 S75 L81 L107 I110 W153I74-F78 HydrophobicContact CG2-CE1 4.47Å; I74-F78 HydrophobicContact CG2-CE2 4.22Å; I74-F78 HydrophobicContact CG2-CZ 4.15Å; I74-F78 PolarHBondContact O-N 3.32Å; S75-F78 PolarHBondContact O-N 3.08Å; F78-L81 HydrophobicContact CD1-CD1 4.44Å; F78-L107 HydrophobicContact CB-CD2 4.47Å; F78-L107 HydrophobicContact CD1-CD2 4.42Å; F78-L107 HydrophobicContact CG-CD2 4.35Å; F78-I110 HydrophobicContact CD2-CG2 4.07Å; F78-W153 AromaticContact CD2-CH2 3.51Å; F78-W153 HydrophobicContact CD2-CH2 3.51Å; F78-W153 AromaticContact CD2-CZ3 3.54Å; F78-W153 HydrophobicContact CD2-CZ3 3.54Å; F78-W153 HydrophobicContact CE2-CE3 4.32Å; F78-W153 AromaticContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CH2 3.4Å; F78-W153 VanDerWaalsContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CZ2 4.33Å; F78-W153 AromaticContact CE2-CZ3 3.4Å; F78-W153 HydrophobicContact CE2-CZ3 3.4Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.4Å
79F95.1Very high95.6Very high7 Ų727 Ų273%0.03113%0.132CC..Hα-helixtrans-63.6-49.3173.7-164.6-87000111.4S75 D76 L77 L81 T82 V83 Y108 W248 M287 C290S75-F79 PolarHBondContact O-N 3.27Å; S75-F79 VanDerWaalsContact O-N 3.12Å; D76-F79 WeakPolarHBondContact O-CB 3.39Å; D76-F79 PolarHBondContact O-N 2.7Å; L77-F79 VanDerWaalsContact C-N 3.25Å; L77-F79 PolarHBondContact O-N 3.16Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 3.48Å; F79-T82 WeakPolarHBondContact O-CB 3.34Å; F79-T82 PolarHBondContact O-N 3.5Å; F79-T82 PolarHBondContact O-OG1 2.96Å; F79-V83 HydrophobicContact CD1-CG2 4.34Å; F79-V83 HydrophobicContact CE1-CG2 4.47Å; F79-Y108 HydrophobicContact CD2-CD2 4.04Å; F79-Y108 HydrophobicContact CD2-CE2 4.33Å; F79-Y108 HydrophobicContact CE1-CE2 4.43Å; F79-Y108 AromaticContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CD2 3.39Å; F79-Y108 AromaticContact CE2-CE2 3.26Å; F79-Y108 HydrophobicContact CE2-CE2 3.26Å; F79-Y108 HydrophobicContact CE2-CG 4.13Å; F79-Y108 AromaticContact CE2-CZ 3.89Å; F79-Y108 AromaticContact CZ-CD2 3.74Å; F79-Y108 HydrophobicContact CZ-CD2 3.74Å; F79-Y108 AromaticContact CZ-CE2 3.34Å; F79-Y108 HydrophobicContact CZ-CE2 3.34Å; F79-W248 HydrophobicContact CE2-CH2 4.09Å; F79-W248 HydrophobicContact CE2-CZ2 4.19Å; F79-W248 AromaticContact CZ-CH2 3.98Å; F79-W248 HydrophobicContact CZ-CH2 3.98Å; F79-W248 HydrophobicContact CZ-CZ2 4.05Å; F79-M287 HydrophobicContact CE1-CB 4.12Å; F79-M287 HydrophobicContact CE1-CG 4.08Å; F79-M287 HydrophobicContact CZ-CB 4.41Å; F79-M287 HydrophobicContact CZ-CG 3.97Å; F79-C290 HydrophobicContact CD1-CB 4.02Å
80L96.7Very high95.4Very high0 Ų027.3 Ų27.30%014%0.137CC..Hα-helixtrans-59.8-36.7-179.5-78.6161.2000113.4V40 F41 G44 D76 L77 T82 V83 P84 C290V40-L80 HydrophobicContact CG1-CD2 4.28Å; F41-L80 HydrophobicContact CD2-CB 4.49Å; F41-L80 VanDerWaalsContact CD2-O 3.29Å; F41-L80 WeakPolarHBondContact CD2-O 3.44Å; G44-L80 WeakPolarHBondContact O-CD1 3.26Å; D76-L80 WeakPolarHBondContact O-CB 3.47Å; D76-L80 WeakPolarHBondContact O-CD1 3.34Å; D76-L80 WeakPolarHBondContact O-CG 3.46Å; D76-L80 PolarHBondContact O-N 2.96Å; L77-L80 HydrophobicContact CD2-CD1 4.24Å; L77-L80 PolarHBondContact O-N 3.22Å; L80-T82 PolarHBondContact O-N 3.06Å; L80-T82 VanDerWaalsContact O-N 3.13Å; L80-V83 WeakPolarHBondContact O-CB 3.2Å; L80-V83 PolarHBondContact O-N 3.45Å; L80-V83 VanDerWaalsContact O-N 3.08Å; L80-P84 VanDerWaalsContact O-CD 3.3Å; L80-P84 WeakPolarHBondContact O-CD 3.41Å; L80-C290 HydrophobicContact CD2-CB 4.5Å; L80-C290 WeakPolarHBondContact CD2-SG 3.31Å; L80-C290 HydrophobicContact CG-CB 4.2Å
81L96.4Very high95.1Very high78 Ų7828.9 Ų28.941%0.40815%0.153SC..Hα-helixtrans-60.1-23.3177.1-73.1171.8000112.7L77 F78 F79 F85L77-L81 VanDerWaalsContact O-CG 3.28Å; L77-L81 WeakPolarHBondContact O-CG 3.41Å; L77-L81 PolarHBondContact O-N 3.43Å; F78-L81 HydrophobicContact CD1-CD1 4.44Å; F79-L81 VanDerWaalsContact C-N 3.32Å; F79-L81 PolarHBondContact O-N 3.48Å; L81-F85 WeakPolarHBondContact O-CD2 3.13Å; L81-F85 WeakPolarHBondContact O-CE2 3.19Å
82T95.9Very high94.7Very high0 Ų030.4 Ų30.40%017%0.168CC..Hα-helixtrans-85.2-24.3177.374.80000113.5F79 L80 F85 W86 L104 L107F79-T82 WeakPolarHBondContact O-CB 3.34Å; F79-T82 PolarHBondContact O-N 3.5Å; F79-T82 PolarHBondContact O-OG1 2.96Å; L80-T82 PolarHBondContact O-N 3.06Å; L80-T82 VanDerWaalsContact O-N 3.13Å; T82-F85 WeakPolarHBondContact O-CB 3.33Å; T82-F85 PolarHBondContact O-N 3.25Å; T82-F85 VanDerWaalsContact O-N 3.08Å; T82-W86 PolarHBondContact O-N 2.96Å; T82-W86 PolarHBondContact OG1-NE1 3.09Å; T82-L104 HydrophobicContact CG2-CB 4.48Å; T82-L104 HydrophobicContact CG2-CD2 3.96Å; T82-L104 WeakPolarHBondContact CG2-O 3.38Å; T82-L107 HydrophobicContact CG2-CB 3.57Å
83V95.3Very high94.4Very high0 Ų032.8 Ų32.80%018%0.179CC..Hα-helixtrans-57.8-42.5-171.7175.40000113.7Y37 F41 F79 L80 F85 W86 A87Y37-V83 HydrophobicContact CG-CG1 4.05Å; Y37-V83 VanDerWaalsContact O-CG1 3.31Å; Y37-V83 WeakPolarHBondContact O-CG1 3.12Å; F41-V83 HydrophobicContact CB-CG1 4.36Å; F79-V83 HydrophobicContact CD1-CG2 4.34Å; F79-V83 HydrophobicContact CE1-CG2 4.47Å; L80-V83 WeakPolarHBondContact O-CB 3.2Å; L80-V83 PolarHBondContact O-N 3.45Å; L80-V83 VanDerWaalsContact O-N 3.08Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.21Å; V83-W86 PolarHBondContact O-N 2.89Å; V83-A87 WeakPolarHBondContact O-CB 3.36Å; V83-A87 PolarHBondContact O-N 3.4Å
84P95.3Very high94.3Very high53 Ų5332.9 Ų32.934%0.34418%0.179SC..Hα-helixtrans-60.5-34.2177.1-25.635.5000113.7F41 L80 A87 H88F41-P84 HydrophobicContact CD1-CG 4.35Å; F41-P84 HydrophobicContact CD2-CG 3.66Å; F41-P84 HydrophobicContact CE1-CG 4.46Å; F41-P84 HydrophobicContact CE2-CG 3.79Å; F41-P84 HydrophobicContact CG-CG 3.95Å; F41-P84 HydrophobicContact CZ-CG 4.2Å; L80-P84 VanDerWaalsContact O-CD 3.3Å; L80-P84 WeakPolarHBondContact O-CD 3.41Å; P84-A87 WeakPolarHBondContact O-CB 3.45Å; P84-A87 PolarHBondContact O-N 2.9Å; P84-H88 PolarHBondContact O-N 3.48Å
85F95.4Very high94Very high52 Ų5234.7 Ų34.723%0.22819%0.189CC..Hα-helixtrans-72.2-40178.5-61.4-91.2000111.2L81 T82 V83 A87 H88 Y89 F96 M100 L104L81-F85 WeakPolarHBondContact O-CD2 3.13Å; L81-F85 WeakPolarHBondContact O-CE2 3.19Å; T82-F85 WeakPolarHBondContact O-CB 3.33Å; T82-F85 PolarHBondContact O-N 3.25Å; T82-F85 VanDerWaalsContact O-N 3.08Å; V83-F85 VanDerWaalsContact C-N 3.26Å; V83-F85 PolarHBondContact O-N 3.21Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 3Å; F85-H88 PolarHBondContact O-N 3.45Å; F85-Y89 WeakPolarHBondContact O-CB 3.43Å; F85-Y89 PolarHBondContact O-N 3.4Å; F85-F96 HydrophobicContact CB-CE2 4.25Å; F85-F96 AromaticContact CD1-CD1 3.89Å; F85-F96 HydrophobicContact CD1-CD1 3.89Å; F85-F96 AromaticContact CD1-CD2 3.89Å; F85-F96 HydrophobicContact CD1-CD2 3.89Å; F85-F96 AromaticContact CD1-CE1 3.72Å; F85-F96 HydrophobicContact CD1-CE1 3.72Å; F85-F96 AromaticContact CD1-CE2 3.72Å; F85-F96 HydrophobicContact CD1-CE2 3.72Å; F85-F96 AromaticContact CD1-CG 3.98Å; F85-F96 HydrophobicContact CD1-CG 3.98Å; F85-F96 AromaticContact CD1-CZ 3.63Å; F85-F96 HydrophobicContact CD1-CZ 3.63Å; F85-F96 AromaticContact CE1-CD1 3.98Å; F85-F96 HydrophobicContact CE1-CD1 3.98Å; F85-F96 AromaticContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CG 4.41Å; F85-F96 HydrophobicContact CE1-CZ 4.26Å; F85-F96 HydrophobicContact CG-CE2 4.48Å; F85-M100 HydrophobicContact CE1-CE 3.74Å; F85-M100 HydrophobicContact CE2-CE 4.24Å; F85-M100 HydrophobicContact CZ-CE 3.56Å; F85-L104 HydrophobicContact CB-CD1 3.56Å; F85-L104 HydrophobicContact CD1-CD1 3.61Å; F85-L104 HydrophobicContact CD2-CD1 3.82Å; F85-L104 HydrophobicContact CD2-CD2 3.71Å; F85-L104 HydrophobicContact CD2-CG 4.45Å; F85-L104 HydrophobicContact CE1-CD1 4.23Å; F85-L104 HydrophobicContact CE2-CD1 4.42Å; F85-L104 HydrophobicContact CE2-CD2 3.96Å; F85-L104 HydrophobicContact CG-CD1 3.38Å; F85-L104 HydrophobicContact CG-CD2 4.17Å; F85-L104 HydrophobicContact CG-CG 4.44Å
86W93.6Very high93.8Very high34 Ų3438 Ų3813%0.12920%0.204CC..Hα-helixtrans-66.3-32.6172.8-59.9123000112.4Y37 T82 V83 Y89 A90 W94 M287Y37-W86 HydrophobicContact CD2-CB 4.3Å; Y37-W86 HydrophobicContact CE2-CB 4.15Å; T82-W86 PolarHBondContact O-N 2.96Å; T82-W86 PolarHBondContact OG1-NE1 3.09Å; V83-W86 PolarHBondContact O-N 2.89Å; W86-Y89 AromaticContact CE3-CD1 4Å; W86-Y89 HydrophobicContact CE3-CD1 4Å; W86-Y89 HydrophobicContact CZ3-CD1 4.22Å; W86-Y89 PolarHBondContact O-N 2.77Å; W86-A90 WeakPolarHBondContact O-CB 3.46Å; W86-A90 PolarHBondContact O-N 3.04Å; W86-W94 HydrophobicContact CE3-CZ3 4.28Å; W86-W94 HydrophobicContact CH2-CZ3 4.45Å; W86-W94 AromaticContact CZ3-CZ3 3.98Å; W86-W94 HydrophobicContact CZ3-CZ3 3.98Å; W86-M287 HydrophobicContact CG-CE 4.38Å
87A93.3Very high93.7Very high7 Ų739.3 Ų39.36%0.05822%0.219CC..Hα-helixtrans-64.1-47.1173.200000111.6Y37 V83 P84 F85 A90 A91Y37-A87 HydrophobicContact CD2-CB 4.11Å; Y37-A87 HydrophobicContact CG-CB 4.48Å; V83-A87 WeakPolarHBondContact O-CB 3.36Å; V83-A87 PolarHBondContact O-N 3.4Å; P84-A87 WeakPolarHBondContact O-CB 3.45Å; P84-A87 PolarHBondContact O-N 2.9Å; F85-A87 VanDerWaalsContact C-N 3.3Å; F85-A87 PolarHBondContact O-N 3Å; A87-A90 PolarHBondContact O-N 2.88Å; A87-A91 PolarHBondContact O-N 3.37Å; A87-A91 VanDerWaalsContact O-N 3.14Å
88H94.1Very high93.5Very high71 Ų7141.3 Ų41.333%0.32923%0.23SC..Hα-helixtrans-62.5-45174.2-177.677000111.8P84 F85 A90 A91 A92 D95 F96P84-H88 PolarHBondContact O-N 3.48Å; F85-H88 PolarHBondContact O-N 3.45Å; H88-A90 VanDerWaalsContact C-N 3.29Å; H88-A90 PolarHBondContact O-N 3.41Å; H88-A91 PolarHBondContact O-N 3.49Å; H88-A91 VanDerWaalsContact O-N 3.09Å; H88-A92 PolarHBondContact O-N 3.27Å; H88-D95 IonicContact CD2-OD2 3.82Å; H88-D95 IonicContact CE1-OD2 3.75Å; H88-D95 IonicContact NE2-OD2 2.82Å; H88-D95 PolarHBondContact NE2-OD2 3.3Å; H88-F96 HydrophobicContact CB-CE2 4.29Å; H88-F96 HydrophobicContact CB-CZ 4.16Å; H88-F96 AromaticContact CD2-CE2 3.65Å; H88-F96 AromaticContact CD2-CZ 3.66Å; H88-F96 AromaticContact CG-CZ 3.99Å
89Y92.1Very high93.4Very high66 Ų6643.5 Ų43.526%0.25925%0.249SC..Hα-helixtrans-59.1-40.2178.4179.3-122.5000112.4F85 W86 W94F85-Y89 WeakPolarHBondContact O-CB 3.43Å; F85-Y89 PolarHBondContact O-N 3.4Å; W86-Y89 AromaticContact CE3-CD1 4Å; W86-Y89 HydrophobicContact CE3-CD1 4Å; W86-Y89 HydrophobicContact CZ3-CD1 4.22Å; W86-Y89 PolarHBondContact O-N 2.77Å; Y89-W94 HydrophobicContact CD2-CB 3.89Å; Y89-W94 AromaticContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CE2-CB 3.92Å; Y89-W94 HydrophobicContact CG-CE3 4.01Å
90A88.8Confident93.4Very high21 Ų2145.7 Ų45.717%0.17426%0.26CS..Hα-helixtrans-67.1-36.1175.600000112.8A30 L33 W86 A87 H88A30-A90 VanDerWaalsContact CA-O 3.23Å; A30-A90 WeakPolarHBondContact CA-O 3.38Å; A30-A90 WeakPolarHBondContact CB-O 3.35Å; L33-A90 HydrophobicContact CB-CB 3.88Å; L33-A90 HydrophobicContact CD1-CB 3.89Å; W86-A90 WeakPolarHBondContact O-CB 3.46Å; W86-A90 PolarHBondContact O-N 3.04Å; A87-A90 PolarHBondContact O-N 2.88Å; H88-A90 VanDerWaalsContact C-N 3.29Å; H88-A90 PolarHBondContact O-N 3.41Å
91A88.8Confident93.3Very high56 Ų5645.7 Ų45.746%0.46326%0.26SS..Hα-helixtrans-74.1-36.1-179.700000113.1P34 A87 H88P34-A91 HydrophobicContact CB-CB 4.43Å; P34-A91 HydrophobicContact CG-CB 3.68Å; A87-A91 PolarHBondContact O-N 3.37Å; A87-A91 VanDerWaalsContact O-N 3.14Å; H88-A91 PolarHBondContact O-N 3.49Å; H88-A91 VanDerWaalsContact O-N 3.09Å
92A89.2Confident93.3Very high50 Ų5044.6 Ų44.641%0.41325%0.253SS..SBendtrans-134.6-104.8-171.800000111.6H88H88-A92 PolarHBondContact O-N 3.27Å
93Q89.7Confident93.3Very high50 Ų5049.4 Ų49.423%0.23428%0.278CS..  trans-150.2179.9-177.169.6-176.22.700110.3D95 H175Q93-D95 WeakPolarHBondContact CG-OD1 3.24Å; Q93-D95 PolarHBondContact NE2-OD1 3.04Å; Q93-D95 PolarHBondContact O-N 3.02Å; Q93-H175 HydrophobicContact CB-CB 4.3Å; Q93-H175 PolarHBondContact OE1-ND1 2.88Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.16Å
94W93.9Very high93.4Very high3 Ų349.5 Ų49.51%0.01128%0.278CS..  trans-8597.1178.2-170.1-93.5000112.4W86 Y89 F96 G97 M100 C101 L104 Y176 C178W86-W94 HydrophobicContact CE3-CZ3 4.28Å; W86-W94 HydrophobicContact CH2-CZ3 4.45Å; W86-W94 AromaticContact CZ3-CZ3 3.98Å; W86-W94 HydrophobicContact CZ3-CZ3 3.98Å; Y89-W94 HydrophobicContact CD2-CB 3.89Å; Y89-W94 AromaticContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CD2-CE3 3.88Å; Y89-W94 HydrophobicContact CE2-CB 3.92Å; Y89-W94 HydrophobicContact CG-CE3 4.01Å; W94-F96 HydrophobicContact CD2-CD2 4.22Å; W94-F96 HydrophobicContact CE3-CD2 4.26Å; W94-F96 HydrophobicContact CH2-CD2 4.15Å; W94-F96 HydrophobicContact CZ2-CB 3.9Å; W94-F96 HydrophobicContact CZ2-CD2 4.03Å; W94-F96 HydrophobicContact CZ2-CG 4.43Å; W94-F96 HydrophobicContact CZ3-CD2 4.24Å; W94-G97 PolarHBondContact NE1-O 3.25Å; W94-M100 HydrophobicContact CZ2-CB 4.49Å; W94-C101 HydrophobicContact CH2-CB 4.47Å; W94-C101 HydrophobicContact CZ2-CB 3.62Å; W94-L104 HydrophobicContact CH2-CB 4.5Å; W94-L104 HydrophobicContact CH2-CD1 3.58Å; W94-L104 HydrophobicContact CZ2-CD1 4.11Å; W94-Y176 WeakPolarHBondContact CB-O 3.5Å; W94-Y176 PolarHBondContact N-O 3Å; W94-Y176 WeakPolarHBondContact O-CB 3.39Å; W94-C178 HydrophobicContact CB-CB 4.4Å; W94-C178 HydrophobicContact CD2-CB 3.45Å; W94-C178 VanDerWaalsContact CD2-CB 3.45Å; W94-C178 HydrophobicContact CE3-CB 3.59Å; W94-C178 HydrophobicContact CG-CB 3.8Å; W94-C178 HydrophobicContact CH2-CB 4.43Å; W94-C178 HydrophobicContact CZ2-CB 4.39Å; W94-C178 HydrophobicContact CZ3-CB 4.08Å
95D93.3Very high93.4Very high88 Ų8847.3 Ų47.347%0.47126%0.264SS..  trans-96-2.7-177.8-59.1-51.1000114.2H88 Q93H88-D95 IonicContact CD2-OD2 3.82Å; H88-D95 IonicContact CE1-OD2 3.75Å; H88-D95 IonicContact NE2-OD2 2.82Å; H88-D95 PolarHBondContact NE2-OD2 3.3Å; Q93-D95 WeakPolarHBondContact CG-OD1 3.24Å; Q93-D95 PolarHBondContact NE2-OD1 3.04Å; Q93-D95 PolarHBondContact O-N 3.02Å
96F93.1Very high93.4Very high71 Ų7145 Ų4531%0.31125%0.254SS..SBendtrans-91.40.8-170-50.7-74.7000114.8F85 H88 W94 M100F85-F96 HydrophobicContact CB-CE2 4.25Å; F85-F96 AromaticContact CD1-CD1 3.89Å; F85-F96 HydrophobicContact CD1-CD1 3.89Å; F85-F96 AromaticContact CD1-CD2 3.89Å; F85-F96 HydrophobicContact CD1-CD2 3.89Å; F85-F96 AromaticContact CD1-CE1 3.72Å; F85-F96 HydrophobicContact CD1-CE1 3.72Å; F85-F96 AromaticContact CD1-CE2 3.72Å; F85-F96 HydrophobicContact CD1-CE2 3.72Å; F85-F96 AromaticContact CD1-CG 3.98Å; F85-F96 HydrophobicContact CD1-CG 3.98Å; F85-F96 AromaticContact CD1-CZ 3.63Å; F85-F96 HydrophobicContact CD1-CZ 3.63Å; F85-F96 AromaticContact CE1-CD1 3.98Å; F85-F96 HydrophobicContact CE1-CD1 3.98Å; F85-F96 AromaticContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CE1 3.89Å; F85-F96 HydrophobicContact CE1-CG 4.41Å; F85-F96 HydrophobicContact CE1-CZ 4.26Å; F85-F96 HydrophobicContact CG-CE2 4.48Å; H88-F96 HydrophobicContact CB-CE2 4.29Å; H88-F96 HydrophobicContact CB-CZ 4.16Å; H88-F96 AromaticContact CD2-CE2 3.65Å; H88-F96 AromaticContact CD2-CZ 3.66Å; H88-F96 AromaticContact CG-CZ 3.99Å; W94-F96 HydrophobicContact CD2-CD2 4.22Å; W94-F96 HydrophobicContact CE3-CD2 4.26Å; W94-F96 HydrophobicContact CH2-CD2 4.15Å; W94-F96 HydrophobicContact CZ2-CB 3.9Å; W94-F96 HydrophobicContact CZ2-CD2 4.03Å; W94-F96 HydrophobicContact CZ2-CG 4.43Å; W94-F96 HydrophobicContact CZ3-CD2 4.24Å; F96-M100 HydrophobicContact CB-CB 3.75Å; F96-M100 HydrophobicContact CB-CG 3.86Å; F96-M100 VanDerWaalsContact O-CB 3.23Å; F96-M100 WeakPolarHBondContact O-CB 3.28Å
97G93.3Very high93.6Very high34 Ų3445.3 Ų45.335%0.35126%0.258SS..Hα-helixtrans72.8176.9-179.700000114.9W94 C101W94-G97 PolarHBondContact NE1-O 3.25Å; G97-C101 PolarHBondContact O-N 2.99Å
98N94Very high93.7Very high59 Ų5945.6 Ų45.632%0.31626%0.258SS..Hα-helixtrans-70-39.8-171.9-176.472.9000113.8M100 C101 Q102 R168 S169N98-M100 VanDerWaalsContact C-N 3.34Å; N98-M100 PolarHBondContact O-N 3.19Å; N98-C101 WeakPolarHBondContact O-CB 3.39Å; N98-C101 PolarHBondContact O-N 3.46Å; N98-Q102 PolarHBondContact ND2-OE1 3.16Å; N98-Q102 PolarHBondContact O-N 2.96Å; N98-R168 VanDerWaalsContact OD1-CA 3.27Å; N98-R168 WeakPolarHBondContact OD1-CA 3.37Å; N98-S169 PolarHBondContact OD1-N 3.22Å
99T94.1Very high93.8Very high113 Ų11343.3 Ų43.369%0.69325%0.247SC*.Hα-helixtrans-61.2-44.2-17946.80000111.5Q102 L103T99-Q102 PolarHBondContact O-N 3.03Å; T99-L103 PolarHBondContact O-N 3.38Å
100M94.9Very high94.1Very high53 Ų5341.3 Ų41.326%0.26124%0.241SC..Hα-helixtrans-70.2-33.7178-157.657.2173.300111.9F85 W94 F96 N98 Q102 L103 L104F85-M100 HydrophobicContact CE1-CE 3.74Å; F85-M100 HydrophobicContact CE2-CE 4.24Å; F85-M100 HydrophobicContact CZ-CE 3.56Å; W94-M100 HydrophobicContact CZ2-CB 4.49Å; F96-M100 HydrophobicContact CB-CB 3.75Å; F96-M100 HydrophobicContact CB-CG 3.86Å; F96-M100 VanDerWaalsContact O-CB 3.23Å; F96-M100 WeakPolarHBondContact O-CB 3.28Å; N98-M100 VanDerWaalsContact C-N 3.34Å; N98-M100 PolarHBondContact O-N 3.19Å; M100-Q102 PolarHBondContact O-N 2.78Å; M100-L103 PolarHBondContact O-N 2.9Å; M100-L103 HydrophobicContact SD-CD2 3.92Å; M100-L104 HydrophobicContact CE-CD1 4.15Å; M100-L104 HydrophobicContact CE-CD2 4.1Å; M100-L104 HydrophobicContact CE-CG 4.13Å; M100-L104 HydrophobicContact CG-CD1 3.7Å; M100-L104 HydrophobicContact CG-CG 4.11Å; M100-L104 VanDerWaalsContact O-CB 3.27Å; M100-L104 WeakPolarHBondContact O-CB 3.39Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.26Å; M100-L104 PolarHBondContact O-N 3.25Å; M100-L104 HydrophobicContact SD-CD1 4.45Å; M100-L104 HydrophobicContact SD-CG 4.33Å
101C95.7Very high94.5Very high0 Ų040.5 Ų40.50%023%0.234CC..Hα-helixtrans-60-46.1174.81720000111.4W94 G97 N98 T105 T167 C178W94-C101 HydrophobicContact CH2-CB 4.47Å; W94-C101 HydrophobicContact CZ2-CB 3.62Å; G97-C101 PolarHBondContact O-N 2.99Å; N98-C101 WeakPolarHBondContact O-CB 3.39Å; N98-C101 PolarHBondContact O-N 3.46Å; C101-T105 WeakPolarHBondContact O-CB 3.49Å; C101-T105 PolarHBondContact O-N 3.08Å; C101-T105 PolarHBondContact O-OG1 3.33Å; C101-T167 WeakPolarHBondContact SG-CG2 3.26Å; C101-C178 VanDerWaalsContact CA-SG 3.57Å; C101-C178 HydrophobicContact CB-CB 3.94Å; C101-C178 WeakPolarHBondContact CB-SG 3.46Å; C101-C178 VanDerWaalsContact SG-CA 3.59Å; C101-C178 WeakPolarHBondContact SG-CB 3.35Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.92Å
102Q95.6Very high94.8Very high56 Ų5638.2 Ų38.226%0.26221%0.214SC..Hα-helixtrans-66.1-45.1176.4-70.1-179.5-35.500112.4N98 T99 M100 G106 I164 T167N98-Q102 PolarHBondContact ND2-OE1 3.16Å; N98-Q102 PolarHBondContact O-N 2.96Å; T99-Q102 PolarHBondContact O-N 3.03Å; M100-Q102 PolarHBondContact O-N 2.78Å; Q102-G106 PolarHBondContact O-N 2.73Å; Q102-I164 HydrophobicContact CB-CG2 4.2Å; Q102-T167 WeakPolarHBondContact CG-O 3.28Å
103L96.1Very high95.2Very high100 Ų10035.9 Ų35.952%0.52420%0.195SC..Hα-helixtrans-62.3-48.8178.9-179.563.8000112T99 M100 G106 L107T99-L103 PolarHBondContact O-N 3.38Å; M100-L103 PolarHBondContact O-N 2.9Å; M100-L103 HydrophobicContact SD-CD2 3.92Å; L103-G106 WeakPolarHBondContact O-CA 3.42Å; L103-G106 PolarHBondContact O-N 2.88Å; L103-G106 VanDerWaalsContact O-N 3.15Å; L103-L107 HydrophobicContact CG-CD1 4.43Å; L103-L107 PolarHBondContact O-N 2.83Å
104L96.6Very high95.6Very high2 Ų233.5 Ų33.51%0.0118%0.183CC..Hα-helixtrans-68.3-36.8-178.3-70172.1000111.8T82 F85 W94 M100 G106 L107 Y108T82-L104 HydrophobicContact CG2-CB 4.48Å; T82-L104 HydrophobicContact CG2-CD2 3.96Å; T82-L104 WeakPolarHBondContact CG2-O 3.38Å; F85-L104 HydrophobicContact CB-CD1 3.56Å; F85-L104 HydrophobicContact CD1-CD1 3.61Å; F85-L104 HydrophobicContact CD2-CD1 3.82Å; F85-L104 HydrophobicContact CD2-CD2 3.71Å; F85-L104 HydrophobicContact CD2-CG 4.45Å; F85-L104 HydrophobicContact CE1-CD1 4.23Å; F85-L104 HydrophobicContact CE2-CD1 4.42Å; F85-L104 HydrophobicContact CE2-CD2 3.96Å; F85-L104 HydrophobicContact CG-CD1 3.38Å; F85-L104 HydrophobicContact CG-CD2 4.17Å; F85-L104 HydrophobicContact CG-CG 4.44Å; W94-L104 HydrophobicContact CH2-CB 4.5Å; W94-L104 HydrophobicContact CH2-CD1 3.58Å; W94-L104 HydrophobicContact CZ2-CD1 4.11Å; M100-L104 HydrophobicContact CE-CD1 4.15Å; M100-L104 HydrophobicContact CE-CD2 4.1Å; M100-L104 HydrophobicContact CE-CG 4.13Å; M100-L104 HydrophobicContact CG-CD1 3.7Å; M100-L104 HydrophobicContact CG-CG 4.11Å; M100-L104 VanDerWaalsContact O-CB 3.27Å; M100-L104 WeakPolarHBondContact O-CB 3.39Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.26Å; M100-L104 PolarHBondContact O-N 3.25Å; M100-L104 HydrophobicContact SD-CD1 4.45Å; M100-L104 HydrophobicContact SD-CG 4.33Å; L104-G106 VanDerWaalsContact C-N 3.3Å; L104-G106 PolarHBondContact O-N 3.41Å; L104-L107 PolarHBondContact O-N 3.31Å; L104-Y108 VanDerWaalsContact O-CB 3.29Å; L104-Y108 WeakPolarHBondContact O-CB 3.28Å; L104-Y108 PolarHBondContact O-N 2.99Å
105T95.6Very high95.7Very high7 Ų733.6 Ų33.64%0.04319%0.186CC..Hα-helixtrans-63.3-39.8171.4-64.70000111C101 Y108 F109 T167C101-T105 WeakPolarHBondContact O-CB 3.49Å; C101-T105 PolarHBondContact O-N 3.08Å; C101-T105 PolarHBondContact O-OG1 3.33Å; T105-Y108 PolarHBondContact O-N 3.37Å; T105-F109 HydrophobicContact CG2-CD2 3.7Å; T105-F109 HydrophobicContact CG2-CE2 3.64Å; T105-F109 VanDerWaalsContact O-CD2 3.27Å; T105-F109 WeakPolarHBondContact O-CD2 3.22Å; T105-F109 PolarHBondContact O-N 3.16Å; T105-T167 HydrophobicContact CG2-CG2 4.1Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.27Å
106G96.6Very high95.9Very high3 Ų329.5 Ų29.53%0.03116%0.164CC..Hα-helixtrans-60.4-51.9173.300000112.5Q102 L103 L104 Y108 F109 I110 I164Q102-G106 PolarHBondContact O-N 2.73Å; L103-G106 WeakPolarHBondContact O-CA 3.42Å; L103-G106 PolarHBondContact O-N 2.88Å; L103-G106 VanDerWaalsContact O-N 3.15Å; L104-G106 VanDerWaalsContact C-N 3.3Å; L104-G106 PolarHBondContact O-N 3.41Å; G106-Y108 VanDerWaalsContact C-N 3.31Å; G106-Y108 PolarHBondContact O-N 3.32Å; G106-F109 PolarHBondContact O-N 2.9Å; G106-I110 VanDerWaalsContact O-CB 3.26Å; G106-I110 WeakPolarHBondContact O-CB 3.47Å; G106-I110 WeakPolarHBondContact O-CD1 3.46Å; G106-I110 WeakPolarHBondContact O-CG1 3.16Å; G106-I110 PolarHBondContact O-N 2.65Å; G106-I164 VanDerWaalsContact CA-CG1 3.5Å
107L97.1Very high96.1Very high41 Ų4127.1 Ų27.122%0.21515%0.153CC..Hα-helixtrans-60.7-39.3177.8-71.7175000112.4F78 T82 L103 L104 G111F78-L107 HydrophobicContact CB-CD2 4.47Å; F78-L107 HydrophobicContact CD1-CD2 4.42Å; F78-L107 HydrophobicContact CG-CD2 4.35Å; T82-L107 HydrophobicContact CG2-CB 3.57Å; L103-L107 HydrophobicContact CG-CD1 4.43Å; L103-L107 PolarHBondContact O-N 2.83Å; L104-L107 PolarHBondContact O-N 3.31Å; L107-G111 PolarHBondContact O-N 3.37Å
108Y96.1Very high96.3Very high14 Ų1425.5 Ų25.56%0.05514%0.137CC..Hα-helixtrans-59-53.6175174.1-87.7000111.3F79 L104 T105 G106 G111 F112 M287F79-Y108 HydrophobicContact CD2-CD2 4.04Å; F79-Y108 HydrophobicContact CD2-CE2 4.33Å; F79-Y108 HydrophobicContact CE1-CE2 4.43Å; F79-Y108 AromaticContact CE2-CD2 3.39Å; F79-Y108 HydrophobicContact CE2-CD2 3.39Å; F79-Y108 AromaticContact CE2-CE2 3.26Å; F79-Y108 HydrophobicContact CE2-CE2 3.26Å; F79-Y108 HydrophobicContact CE2-CG 4.13Å; F79-Y108 AromaticContact CE2-CZ 3.89Å; F79-Y108 AromaticContact CZ-CD2 3.74Å; F79-Y108 HydrophobicContact CZ-CD2 3.74Å; F79-Y108 AromaticContact CZ-CE2 3.34Å; F79-Y108 HydrophobicContact CZ-CE2 3.34Å; L104-Y108 VanDerWaalsContact O-CB 3.29Å; L104-Y108 WeakPolarHBondContact O-CB 3.28Å; L104-Y108 PolarHBondContact O-N 2.99Å; T105-Y108 PolarHBondContact O-N 3.37Å; G106-Y108 VanDerWaalsContact C-N 3.31Å; G106-Y108 PolarHBondContact O-N 3.32Å; Y108-G111 PolarHBondContact O-N 3.37Å; Y108-F112 WeakPolarHBondContact O-CB 3.46Å; Y108-F112 PolarHBondContact O-N 3.01Å; Y108-M287 HydrophobicContact CE2-CE 3.91Å
109F96.4Very high96.4Very high22 Ų2222.8 Ų22.810%0.09612%0.122CC..Hα-helixtrans-70.1-37.2-179.1-78.1-61000112.7T105 G106 F112 F113 S160 I198T105-F109 HydrophobicContact CG2-CD2 3.7Å; T105-F109 HydrophobicContact CG2-CE2 3.64Å; T105-F109 VanDerWaalsContact O-CD2 3.27Å; T105-F109 WeakPolarHBondContact O-CD2 3.22Å; T105-F109 PolarHBondContact O-N 3.16Å; G106-F109 PolarHBondContact O-N 2.9Å; F109-F112 PolarHBondContact O-N 3.35Å; F109-F113 HydrophobicContact CB-CD2 4.19Å; F109-F113 HydrophobicContact CB-CE2 4.11Å; F109-F113 AromaticContact CD1-CE2 3.87Å; F109-F113 HydrophobicContact CD1-CE2 3.87Å; F109-F113 HydrophobicContact CD1-CZ 4.45Å; F109-F113 HydrophobicContact CG-CE2 4.33Å; F109-F113 WeakPolarHBondContact O-CD2 3.43Å; F109-F113 PolarHBondContact O-N 2.94Å; F109-S160 VanDerWaalsContact C-OG 3.24Å; F109-S160 WeakPolarHBondContact CB-OG 3Å; F109-I198 HydrophobicContact CE1-CD1 4.03Å
110I97.6Very high96.5Very high24 Ų2418.1 Ų18.112%0.1239%0.093CC..Hα-helixtrans-60.9-47.8175.6-73167000109.4F78 G106 F112 S114 W153 V157 S160F78-I110 HydrophobicContact CD2-CG2 4.07Å; G106-I110 VanDerWaalsContact O-CB 3.26Å; G106-I110 WeakPolarHBondContact O-CB 3.47Å; G106-I110 WeakPolarHBondContact O-CD1 3.46Å; G106-I110 WeakPolarHBondContact O-CG1 3.16Å; G106-I110 PolarHBondContact O-N 2.65Å; I110-F112 VanDerWaalsContact C-N 3.35Å; I110-F112 PolarHBondContact O-N 3.06Å; I110-S114 VanDerWaalsContact O-CB 3.26Å; I110-S114 WeakPolarHBondContact O-CB 3.27Å; I110-S114 PolarHBondContact O-N 2.99Å; I110-S114 PolarHBondContact O-OG 2.66Å; I110-W153 HydrophobicContact CG2-CE3 4.1Å; I110-W153 HydrophobicContact CG2-CZ3 3.6Å; I110-V157 HydrophobicContact CD1-CG2 3.98Å; I110-V157 HydrophobicContact CG1-CG2 4.22Å; I110-S160 WeakPolarHBondContact CG1-OG 3.48Å; I110-S160 PolarHBondContact N-OG 3.05Å
111G96.9Very high96.5Very high4 Ų417.1 Ų17.14%0.0419%0.088CC..Hα-helixtrans-64.1-36.317600000113.1S75 L107 Y108 G115S75-G111 WeakPolarHBondContact O-CA 3.49Å; S75-G111 PolarHBondContact OG-O 3.4Å; L107-G111 PolarHBondContact O-N 3.37Å; Y108-G111 PolarHBondContact O-N 3.37Å; G111-G115 PolarHBondContact O-N 2.99Å; G111-G115 VanDerWaalsContact O-N 3.16Å
112F95.8Very high96.4Very high9 Ų917.2 Ų17.24%0.0399%0.089CC..Hα-helixtrans-65.6-55.2174.9174.3-101.3000112.3Y108 F109 I110 G115 I116 I198 W248Y108-F112 WeakPolarHBondContact O-CB 3.46Å; Y108-F112 PolarHBondContact O-N 3.01Å; F109-F112 PolarHBondContact O-N 3.35Å; I110-F112 VanDerWaalsContact C-N 3.35Å; I110-F112 PolarHBondContact O-N 3.06Å; F112-G115 PolarHBondContact O-N 3.43Å; F112-I116 PolarHBondContact O-N 3.26Å; F112-I198 HydrophobicContact CE1-CG2 4.19Å; F112-I198 HydrophobicContact CZ-CG2 4.26Å; F112-W248 HydrophobicContact CD2-CD2 4.2Å; F112-W248 HydrophobicContact CD2-CE3 4.05Å; F112-W248 AromaticContact CD2-CH2 3.59Å; F112-W248 HydrophobicContact CD2-CH2 3.59Å; F112-W248 AromaticContact CD2-CZ2 3.77Å; F112-W248 HydrophobicContact CD2-CZ2 3.77Å; F112-W248 AromaticContact CD2-CZ3 3.75Å; F112-W248 HydrophobicContact CD2-CZ3 3.75Å; F112-W248 AromaticContact CE2-CD2 3.71Å; F112-W248 HydrophobicContact CE2-CD2 3.71Å; F112-W248 AromaticContact CE2-CE3 3.48Å; F112-W248 HydrophobicContact CE2-CE3 3.48Å; F112-W248 VanDerWaalsContact CE2-CE3 3.48Å; F112-W248 HydrophobicContact CE2-CG 4.42Å; F112-W248 AromaticContact CE2-CH2 3.92Å; F112-W248 HydrophobicContact CE2-CH2 3.92Å; F112-W248 HydrophobicContact CE2-CZ2 4.15Å; F112-W248 AromaticContact CE2-CZ3 3.59Å; F112-W248 HydrophobicContact CE2-CZ3 3.59Å; F112-W248 HydrophobicContact CZ-CE3 4.48Å
113F97.3Very high96.3Very high0 Ų014.5 Ų14.50%08%0.076CC..Hα-helixtrans-69.3-45.6-176.1-72.7-58.8000112.5F109 G115 I116 F117 A156 A159 K197 I198 L201F109-F113 HydrophobicContact CB-CD2 4.19Å; F109-F113 HydrophobicContact CB-CE2 4.11Å; F109-F113 AromaticContact CD1-CE2 3.87Å; F109-F113 HydrophobicContact CD1-CE2 3.87Å; F109-F113 HydrophobicContact CD1-CZ 4.45Å; F109-F113 HydrophobicContact CG-CE2 4.33Å; F109-F113 WeakPolarHBondContact O-CD2 3.43Å; F109-F113 PolarHBondContact O-N 2.94Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.26Å; F113-I116 VanDerWaalsContact O-CG2 3.24Å; F113-I116 WeakPolarHBondContact O-CG2 3.21Å; F113-I116 PolarHBondContact O-N 3.44Å; F113-F117 HydrophobicContact CB-CD2 4.45Å; F113-F117 HydrophobicContact CB-CE2 3.99Å; F113-F117 HydrophobicContact CB-CZ 4.38Å; F113-F117 HydrophobicContact CD1-CZ 4.41Å; F113-F117 WeakPolarHBondContact O-CB 3.49Å; F113-F117 WeakPolarHBondContact O-CD2 3.23Å; F113-F117 WeakPolarHBondContact O-CG 3.46Å; F113-F117 PolarHBondContact O-N 3.42Å; F113-A156 HydrophobicContact CB-CB 4.16Å; F113-A159 HydrophobicContact CD1-CB 4.39Å; F113-A159 HydrophobicContact CD2-CB 3.8Å; F113-A159 HydrophobicContact CE2-CB 4.1Å; F113-A159 HydrophobicContact CG-CB 4Å; F113-K197 HydrophobicContact CZ-CD 4.48Å; F113-I198 HydrophobicContact CZ-CG1 4.23Å; F113-L201 HydrophobicContact CD1-CB 4.25Å; F113-L201 HydrophobicContact CD1-CD1 4.29Å; F113-L201 HydrophobicContact CE1-CB 4.02Å; F113-L201 HydrophobicContact CE1-CD1 4.01Å
114S97.9Very high96.1Very high0 Ų012.7 Ų12.70%07%0.066CC..Hα-helixtrans-64.3-3517861.80000111.4S75 I110 F117 F118 W153S75-S114 WeakPolarHBondContact CB-OG 3.4Å; S75-S114 PolarHBondContact OG-OG 3.23Å; I110-S114 VanDerWaalsContact O-CB 3.26Å; I110-S114 WeakPolarHBondContact O-CB 3.27Å; I110-S114 PolarHBondContact O-N 2.99Å; I110-S114 PolarHBondContact O-OG 2.66Å; S114-F117 PolarHBondContact O-N 3.13Å; S114-F118 WeakPolarHBondContact O-CD2 3.36Å; S114-F118 PolarHBondContact O-N 3.14Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.26Å
115G96.7Very high95.8Very high6 Ų612.8 Ų12.86%0.0627%0.067CC..Hα-helixtrans-57.3-53.417600000112.3L72 S75 G111 F112 F113 F118 I119L72-G115 WeakPolarHBondContact CD1-O 3.38Å; S75-G115 VanDerWaalsContact OG-CA 3.25Å; S75-G115 WeakPolarHBondContact OG-CA 3.33Å; S75-G115 PolarHBondContact OG-N 3.33Å; G111-G115 PolarHBondContact O-N 2.99Å; G111-G115 VanDerWaalsContact O-N 3.16Å; F112-G115 PolarHBondContact O-N 3.43Å; F113-G115 VanDerWaalsContact C-N 3.26Å; F113-G115 PolarHBondContact O-N 3.26Å; G115-F118 PolarHBondContact O-N 3.4Å; G115-I119 WeakPolarHBondContact O-CG1 3.17Å; G115-I119 PolarHBondContact O-N 2.96Å; G115-I119 VanDerWaalsContact O-N 3.08Å
116I96.6Very high95.5Very high1 Ų114.4 Ų14.41%0.0057%0.072CC..Hα-helixtrans-67.5-36.9178.4-171.250.9000112.7F112 F113 F118 I119 I120 P206 Y244F112-I116 PolarHBondContact O-N 3.26Å; F113-I116 VanDerWaalsContact O-CG2 3.24Å; F113-I116 WeakPolarHBondContact O-CG2 3.21Å; F113-I116 PolarHBondContact O-N 3.44Å; I116-F118 PolarHBondContact O-N 3.33Å; I116-I119 HydrophobicContact CD1-CB 4.31Å; I116-I119 HydrophobicContact CD1-CG2 4.35Å; I116-I119 PolarHBondContact O-N 2.94Å; I116-I120 HydrophobicContact CG1-CD1 4.21Å; I116-I120 WeakPolarHBondContact O-CG1 3.16Å; I116-I120 PolarHBondContact O-N 2.83Å; I116-P206 HydrophobicContact CD1-CB 3.57Å; I116-P206 HydrophobicContact CD1-CG 3.81Å; I116-P206 HydrophobicContact CG1-CB 3.99Å; I116-P206 HydrophobicContact CG1-CG 3.83Å; I116-Y244 HydrophobicContact CB-CE2 4.07Å; I116-Y244 HydrophobicContact CD1-CD1 3.7Å; I116-Y244 HydrophobicContact CD1-CD2 4.17Å; I116-Y244 HydrophobicContact CD1-CE1 3.33Å; I116-Y244 HydrophobicContact CD1-CE2 3.83Å; I116-Y244 HydrophobicContact CD1-CG 4.12Å; I116-Y244 HydrophobicContact CG1-CE1 3.99Å; I116-Y244 HydrophobicContact CG1-CE2 4.25Å
117F98Very high95.2Very high21 Ų2116.4 Ų16.49%0.0928%0.079CC..Hα-helixtrans-64.9-40.2176.7-63.6-24.4000112.4F113 S114 I119 I120 L121 T152 V155 A156 L201 L205F113-F117 HydrophobicContact CB-CD2 4.45Å; F113-F117 HydrophobicContact CB-CE2 3.99Å; F113-F117 HydrophobicContact CB-CZ 4.38Å; F113-F117 HydrophobicContact CD1-CZ 4.41Å; F113-F117 WeakPolarHBondContact O-CB 3.49Å; F113-F117 WeakPolarHBondContact O-CD2 3.23Å; F113-F117 WeakPolarHBondContact O-CG 3.46Å; F113-F117 PolarHBondContact O-N 3.42Å; S114-F117 PolarHBondContact O-N 3.13Å; F117-I119 VanDerWaalsContact C-N 3.35Å; F117-I120 HydrophobicContact CD1-CD1 4.35Å; F117-I120 WeakPolarHBondContact O-CB 3.44Å; F117-I120 PolarHBondContact O-N 3.08Å; F117-L121 WeakPolarHBondContact O-CG 3.39Å; F117-L121 PolarHBondContact O-N 3.44Å; F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 VanDerWaalsContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.14Å; F117-T152 HydrophobicContact CG-CG2 4.3Å; F117-V155 HydrophobicContact CD2-CG1 4.5Å; F117-V155 HydrophobicContact CE2-CG1 3.82Å; F117-V155 HydrophobicContact CZ-CG1 4.33Å; F117-A156 HydrophobicContact CD2-CB 4.35Å; F117-A156 HydrophobicContact CE2-CB 4.43Å; F117-L201 HydrophobicContact CE1-CB 4.38Å; F117-L201 HydrophobicContact CE1-CD2 4.47Å; F117-L201 HydrophobicContact CZ-CD1 4.34Å; F117-L201 HydrophobicContact CZ-CD2 4.49Å; F117-L205 HydrophobicContact CE1-CD2 4.31Å
118F97.3Very high94.8Very high0 Ų016.3 Ų16.30%08%0.079CC..Hα-helixtrans-68.2-33.4174.4-76.1-60.9000112.5Y68 N71 L72 S114 G115 I116 L121 L122 S149 T152 W153Y68-F118 HydrophobicContact CD1-CD1 4.06Å; Y68-F118 HydrophobicContact CD1-CE1 4.19Å; N71-F118 HydrophobicContact CB-CD1 3.79Å; N71-F118 HydrophobicContact CB-CD2 3.78Å; N71-F118 HydrophobicContact CB-CE1 3.46Å; N71-F118 VanDerWaalsContact CB-CE1 3.46Å; N71-F118 HydrophobicContact CB-CE2 3.47Å; N71-F118 VanDerWaalsContact CB-CE2 3.47Å; N71-F118 HydrophobicContact CB-CG 3.97Å; N71-F118 HydrophobicContact CB-CZ 3.31Å; L72-F118 HydrophobicContact CB-CB 4.16Å; L72-F118 HydrophobicContact CD1-CB 4.36Å; S114-F118 WeakPolarHBondContact O-CD2 3.36Å; S114-F118 PolarHBondContact O-N 3.14Å; G115-F118 PolarHBondContact O-N 3.4Å; I116-F118 PolarHBondContact O-N 3.33Å; F118-L121 HydrophobicContact CD1-CD1 4Å; F118-L121 HydrophobicContact CE1-CD1 4.16Å; F118-L121 PolarHBondContact O-N 2.86Å; F118-L122 WeakPolarHBondContact O-CB 3.26Å; F118-L122 VanDerWaalsContact O-CG 3.26Å; F118-L122 WeakPolarHBondContact O-CG 3.36Å; F118-L122 PolarHBondContact O-N 3.25Å; F118-S149 WeakPolarHBondContact CE1-OG 3.49Å; F118-T152 HydrophobicContact CD2-CG2 4.5Å; F118-T152 HydrophobicContact CE1-CG2 4.16Å; F118-T152 HydrophobicContact CE2-CG2 4.06Å; F118-T152 HydrophobicContact CZ-CG2 3.86Å; F118-W153 AromaticContact CE2-CE2 3.95Å; F118-W153 HydrophobicContact CE2-CZ2 4.17Å; F118-W153 AromaticContact CE2-NE1 3.9Å; F118-W153 AromaticContact CZ-NE1 3.76Å
119I95Very high94.3Very high2 Ų216.9 Ų16.91%0.019%0.086CC..Hα-helixtrans-63.3-43.4170.9-70.5169.5000111L72 G115 I116 F117 L122 T123 I240 M241 Y244L72-I119 HydrophobicContact CD1-CD1 4.37Å; L72-I119 HydrophobicContact CD1-CG1 4.01Å; L72-I119 HydrophobicContact CD2-CG1 4.06Å; G115-I119 WeakPolarHBondContact O-CG1 3.17Å; G115-I119 PolarHBondContact O-N 2.96Å; G115-I119 VanDerWaalsContact O-N 3.08Å; I116-I119 HydrophobicContact CD1-CB 4.31Å; I116-I119 HydrophobicContact CD1-CG2 4.35Å; I116-I119 PolarHBondContact O-N 2.94Å; F117-I119 VanDerWaalsContact C-N 3.35Å; I119-L122 WeakPolarHBondContact O-CB 3.24Å; I119-L122 PolarHBondContact O-N 3.01Å; I119-T123 PolarHBondContact O-N 3.29Å; I119-T123 PolarHBondContact O-OG1 3.44Å; I119-I240 HydrophobicContact CD1-CG2 4.16Å; I119-I240 HydrophobicContact CG1-CG2 4.07Å; I119-M241 HydrophobicContact CG2-CE 3.4Å; I119-M241 VanDerWaalsContact CG2-CE 3.4Å; I119-M241 HydrophobicContact CG2-SD 3.62Å; I119-Y244 HydrophobicContact CD1-CD2 3.97Å; I119-Y244 HydrophobicContact CD1-CG 4.26Å
120I96.2Very high93.8Very high15 Ų1516.4 Ų16.48%0.0779%0.085CC..Hα-helixtrans-59.9-48.3174.1-73.4164.5000110.8I116 F117 L122 T123 I124 L205 P206 V209I116-I120 HydrophobicContact CG1-CD1 4.21Å; I116-I120 WeakPolarHBondContact O-CG1 3.16Å; I116-I120 PolarHBondContact O-N 2.83Å; F117-I120 HydrophobicContact CD1-CD1 4.35Å; F117-I120 WeakPolarHBondContact O-CB 3.44Å; F117-I120 PolarHBondContact O-N 3.08Å; I120-L122 VanDerWaalsContact C-N 3.32Å; I120-L122 PolarHBondContact O-N 3.37Å; I120-T123 WeakPolarHBondContact O-CB 3.34Å; I120-T123 PolarHBondContact O-N 3.37Å; I120-T123 VanDerWaalsContact O-N 3.11Å; I120-I124 HydrophobicContact CG2-CD1 3.79Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.43Å; I120-I124 PolarHBondContact O-N 3.49Å; I120-L205 HydrophobicContact CD1-CD2 3.93Å; I120-L205 HydrophobicContact CD1-CG 3.97Å; I120-P206 HydrophobicContact CD1-CB 4Å; I120-P206 HydrophobicContact CG1-CB 3.97Å; I120-V209 HydrophobicContact CG2-CG1 4.24Å; I120-V209 HydrophobicContact CG2-CG2 4.08Å
121L96.1Very high93.2Very high33 Ų3317.2 Ų17.217%0.1739%0.091CC..Hα-helixtrans-62.2-37.8178.2-73.2175.9000112.3Y68 F117 F118 I124 D125 T152Y68-L121 HydrophobicContact CD1-CD1 4.45Å; Y68-L121 HydrophobicContact CD2-CB 4Å; Y68-L121 HydrophobicContact CE1-CB 4.43Å; Y68-L121 HydrophobicContact CE1-CD1 3.99Å; Y68-L121 HydrophobicContact CE2-CB 3.79Å; Y68-L121 HydrophobicContact CG-CB 4.39Å; F117-L121 WeakPolarHBondContact O-CG 3.39Å; F117-L121 PolarHBondContact O-N 3.44Å; F118-L121 HydrophobicContact CD1-CD1 4Å; F118-L121 HydrophobicContact CE1-CD1 4.16Å; F118-L121 PolarHBondContact O-N 2.86Å; L121-I124 PolarHBondContact O-N 2.89Å; L121-D125 VanDerWaalsContact O-CB 3.24Å; L121-D125 WeakPolarHBondContact O-CB 3.06Å; L121-D125 PolarHBondContact O-N 2.7Å; L121-T152 HydrophobicContact CD1-CG2 4.3Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.41Å
122L93.1Very high92.6Very high1 Ų121.1 Ų21.11%0.00511%0.108CC..Hα-helixtrans-61.7-42.9172.3-77.3167.6000111.5T65 Y68 L69 L72 F118 I119 I120 D125 R126 I237T65-L122 HydrophobicContact CG2-CD2 3.7Å; Y68-L122 HydrophobicContact CD2-CD2 4.36Å; L69-L122 HydrophobicContact CD2-CD1 3.9Å; L69-L122 HydrophobicContact CD2-CD2 4.23Å; L69-L122 HydrophobicContact CG-CD2 4.13Å; L72-L122 HydrophobicContact CD2-CD1 3.94Å; F118-L122 WeakPolarHBondContact O-CB 3.26Å; F118-L122 VanDerWaalsContact O-CG 3.26Å; F118-L122 WeakPolarHBondContact O-CG 3.36Å; F118-L122 PolarHBondContact O-N 3.25Å; I119-L122 WeakPolarHBondContact O-CB 3.24Å; I119-L122 PolarHBondContact O-N 3.01Å; I120-L122 VanDerWaalsContact C-N 3.32Å; I120-L122 PolarHBondContact O-N 3.37Å; L122-D125 PolarHBondContact O-N 3.24Å; L122-R126 WeakPolarHBondContact O-CG 3.44Å; L122-R126 PolarHBondContact O-N 3.15Å; L122-I237 HydrophobicContact CB-CD1 4.31Å; L122-I237 HydrophobicContact CB-CG2 4.36Å; L122-I237 HydrophobicContact CD2-CD1 4.43Å
123T92.4Very high91.9Very high0 Ų023.3 Ų23.30%013%0.128CC..Hα-helixtrans-64.6-42.9176.6-66.90000111.7I119 I120 R126 Y127 V209 C213 Y214 M241I119-T123 PolarHBondContact O-N 3.29Å; I119-T123 PolarHBondContact O-OG1 3.44Å; I120-T123 WeakPolarHBondContact O-CB 3.34Å; I120-T123 PolarHBondContact O-N 3.37Å; I120-T123 VanDerWaalsContact O-N 3.11Å; T123-R126 PolarHBondContact O-N 2.93Å; T123-Y127 WeakPolarHBondContact O-CB 3.37Å; T123-Y127 PolarHBondContact O-N 3.46Å; T123-V209 HydrophobicContact CG2-CG1 4.07Å; T123-C213 HydrophobicContact CG2-CB 3.61Å; T123-Y214 HydrophobicContact CG2-CE2 3.92Å; T123-M241 HydrophobicContact CG2-CE 4.41Å; T123-M241 WeakPolarHBondContact OG1-CE 3.35Å
124I93.1Very high91Very high62 Ų6229.4 Ų29.432%0.31817%0.165SC..Hα-helixtrans-65.4-44.5176.1-65168.8000110.9I120 L121 R126 Y127 L128 V209I120-I124 HydrophobicContact CG2-CD1 3.79Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.43Å; I120-I124 PolarHBondContact O-N 3.49Å; L121-I124 PolarHBondContact O-N 2.89Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 3.12Å; I124-Y127 WeakPolarHBondContact O-CB 3.23Å; I124-Y127 PolarHBondContact O-N 3.49Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; I124-L128 HydrophobicContact CG2-CD1 4.04Å; I124-L128 HydrophobicContact CG2-CG 4.28Å; I124-L128 WeakPolarHBondContact O-CG 3.35Å; I124-L128 PolarHBondContact O-N 2.95Å; I124-V209 HydrophobicContact CG1-CG1 4.14Å
125D91Very high90.1Very high3 Ų335.6 Ų35.62%0.01619%0.192CC..Hα-helixtrans-56.1-43.9175.5168.871.1000111.6T65 Y68 L121 L122 A129 R140T65-D125 PolarHBondContact OG1-OD2 2.81Å; Y68-D125 HydrophobicContact CD2-CB 4.33Å; Y68-D125 HydrophobicContact CE2-CB 4.17Å; L121-D125 VanDerWaalsContact O-CB 3.24Å; L121-D125 WeakPolarHBondContact O-CB 3.06Å; L121-D125 PolarHBondContact O-N 2.7Å; L122-D125 PolarHBondContact O-N 3.24Å; D125-A129 WeakPolarHBondContact O-CB 3.44Å; D125-A129 PolarHBondContact O-N 3.39Å; D125-A129 VanDerWaalsContact O-N 3.12Å; D125-R140 PolarHBondContact O-NE 2.88Å; D125-R140 IonicContact OD1-CZ 2.83Å; D125-R140 IonicContact OD1-NE 2.7Å; D125-R140 PolarHBondContact OD1-NE 3.25Å; D125-R140 IonicContact OD1-NH2 3.69Å; D125-R140 PolarHBondContact OD1-NH2 2.84Å; D125-R140 IonicContact OD2-NH2 3.61Å; D125-R140 PolarHBondContact OD2-NH2 3.42Å
126R89Confident89.1Confident41 Ų4135.6 Ų35.616%0.15519%0.191CC..Hα-helixtrans-67.1-43.4175-71.1-54.992.9-170.312112.5T65 L122 T123 I124 A129 V130 I237T65-R126 PolarHBondContact OG1-NH2 3.41Å; L122-R126 WeakPolarHBondContact O-CG 3.44Å; L122-R126 PolarHBondContact O-N 3.15Å; T123-R126 PolarHBondContact O-N 2.93Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 3.12Å; R126-A129 PolarHBondContact O-N 3.17Å; R126-V130 WeakPolarHBondContact O-CG2 3.44Å; R126-V130 PolarHBondContact O-N 3.11Å; R126-V130 VanDerWaalsContact O-N 3.09Å; R126-I237 HydrophobicContact CG-CB 4.04Å; R126-I237 HydrophobicContact CG-CG1 3.47Å; R126-I237 VanDerWaalsContact CG-CG1 3.47Å; R126-I237 HydrophobicContact CG-CG2 4.28Å
127Y89.6Confident88.2Confident46 Ų4642.7 Ų42.718%0.1823%0.229CC..Hα-helixtrans-57.7-51.5178.3173.6-99.8000111.2T123 I124 A129 V130 V131 H132 C213 I217T123-Y127 WeakPolarHBondContact O-CB 3.37Å; T123-Y127 PolarHBondContact O-N 3.46Å; I124-Y127 WeakPolarHBondContact O-CB 3.23Å; I124-Y127 PolarHBondContact O-N 3.49Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.11Å; Y127-V130 PolarHBondContact O-N 3.19Å; Y127-V130 VanDerWaalsContact O-N 3.14Å; Y127-V131 HydrophobicContact CD2-CB 4.36Å; Y127-V131 HydrophobicContact CD2-CG2 3.72Å; Y127-V131 HydrophobicContact CE2-CB 4.07Å; Y127-V131 HydrophobicContact CE2-CG1 4.28Å; Y127-V131 HydrophobicContact CE2-CG2 3.59Å; Y127-V131 HydrophobicContact CG-CG2 4.46Å; Y127-V131 WeakPolarHBondContact O-CB 3.41Å; Y127-V131 PolarHBondContact O-N 2.85Å; Y127-H132 AromaticContact CE1-CD2 3.72Å; Y127-H132 AromaticContact CE1-NE2 3.84Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.86Å; Y127-C213 VanDerWaalsContact CD2-O 3.29Å; Y127-C213 WeakPolarHBondContact CD2-O 3.44Å; Y127-C213 HydrophobicContact CG-CB 4.09Å; Y127-I217 HydrophobicContact CD2-CG1 4.15Å
128L88.9Confident87.3Confident39 Ų3950.1 Ų50.120%0.20426%0.261CS..Hα-helixtrans-59.6-43177.9-68.1175.8000111.4I124 V130 H132 F135I124-L128 HydrophobicContact CG2-CD1 4.04Å; I124-L128 HydrophobicContact CG2-CG 4.28Å; I124-L128 WeakPolarHBondContact O-CG 3.35Å; I124-L128 PolarHBondContact O-N 2.95Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 3.44Å; L128-H132 HydrophobicContact CD2-CB 4.44Å; L128-H132 CarbonylContact O-C 3.58Å; L128-H132 WeakPolarHBondContact O-CA 3.36Å; L128-H132 PolarHBondContact O-N 2.85Å; L128-F135 HydrophobicContact CD2-CD1 4.32Å; L128-F135 HydrophobicContact CD2-CE1 4.46Å
129A86.4Confident86.4Confident25 Ų2551.2 Ų51.221%0.20727%0.27CS..Hα-helixtrans-62.9-29.8178.600000114D125 R126 Y127D125-A129 WeakPolarHBondContact O-CB 3.44Å; D125-A129 PolarHBondContact O-N 3.39Å; D125-A129 VanDerWaalsContact O-N 3.12Å; R126-A129 PolarHBondContact O-N 3.17Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.11Å
130V84Confident86Confident13 Ų1354.4 Ų54.48%0.07928%0.282CS..Hα-helixtrans-94.5-47.7-176.1172.80000112.1R126 Y127 L128 I217 T220 R230 V234R126-V130 WeakPolarHBondContact O-CG2 3.44Å; R126-V130 PolarHBondContact O-N 3.11Å; R126-V130 VanDerWaalsContact O-N 3.09Å; Y127-V130 PolarHBondContact O-N 3.19Å; Y127-V130 VanDerWaalsContact O-N 3.14Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 3.44Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG2 4.31Å; V130-T220 HydrophobicContact CG1-CG2 4.16Å; V130-R230 HydrophobicContact CG2-CG 3.85Å; V130-V234 HydrophobicContact CG2-CG2 4.04Å
131V86.3Confident85.6Confident40 Ų4056.1 Ų56.124%0.24229%0.293CS..Hα-helixtrans-89.3-35.8-171.8-1770000111.4Y127 I217Y127-V131 HydrophobicContact CD2-CB 4.36Å; Y127-V131 HydrophobicContact CD2-CG2 3.72Å; Y127-V131 HydrophobicContact CE2-CB 4.07Å; Y127-V131 HydrophobicContact CE2-CG1 4.28Å; Y127-V131 HydrophobicContact CE2-CG2 3.59Å; Y127-V131 HydrophobicContact CG-CG2 4.46Å; Y127-V131 WeakPolarHBondContact O-CB 3.41Å; Y127-V131 PolarHBondContact O-N 2.85Å; V131-I217 HydrophobicContact CG2-CG1 4.29Å
132H84.8Confident85.4Confident86 Ų8657.2 Ų57.240%0.39830%0.301SS..  trans-121.351.2-175.3-61.5-70.3000112.1Y127 L128 V134 F135 A136Y127-H132 AromaticContact CE1-CD2 3.72Å; Y127-H132 AromaticContact CE1-NE2 3.84Å; L128-H132 HydrophobicContact CD2-CB 4.44Å; L128-H132 CarbonylContact O-C 3.58Å; L128-H132 WeakPolarHBondContact O-CA 3.36Å; L128-H132 PolarHBondContact O-N 2.85Å; H132-V134 VanDerWaalsContact C-N 3.28Å; H132-V134 PolarHBondContact O-N 3.38Å; H132-V134 VanDerWaalsContact O-N 3.13Å; H132-F135 HydrophobicContact CB-CB 4.27Å; H132-F135 PolarHBondContact O-N 3.16Å; H132-F135 VanDerWaalsContact O-N 3.12Å; H132-A136 WeakPolarHBondContact O-CB 3.23Å; H132-A136 PolarHBondContact O-N 2.88Å
133A80Confident85.3Confident56 Ų5662.1 Ų62.146%0.46333%0.331SS..Hα-helixtrans-54.1-36.2-171.300000114.8A136 L137A133-A136 WeakPolarHBondContact O-CB 3.24Å; A133-L137 PolarHBondContact O-N 3Å
134V78.6Confident85.3Confident127 Ų12767.8 Ų67.877%0.7736%0.356SS*.Hα-helixtrans-70-45.8178.9-179.40000111.5H132 A136 L137H132-V134 VanDerWaalsContact C-N 3.28Å; H132-V134 PolarHBondContact O-N 3.38Å; H132-V134 VanDerWaalsContact O-N 3.13Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 3.44Å; V134-L137 PolarHBondContact O-N 3.31Å
135F79.3Confident85.3Confident130 Ų13064.9 Ų64.957%0.5734%0.341SS*.Hα-helixtrans-64.7-38.4175.4177.5-100.8000111.6L128 H132 L137 K138 A139L128-F135 HydrophobicContact CD2-CD1 4.32Å; L128-F135 HydrophobicContact CD2-CE1 4.46Å; H132-F135 HydrophobicContact CB-CB 4.27Å; H132-F135 PolarHBondContact O-N 3.16Å; H132-F135 VanDerWaalsContact O-N 3.12Å; F135-L137 PolarHBondContact O-N 2.91Å; F135-K138 PolarHBondContact O-N 2.8Å; F135-K138 VanDerWaalsContact O-N 3.08Å; F135-A139 HydrophobicContact CD1-CB 4.07Å; F135-A139 HydrophobicContact CE1-CB 3.61Å; F135-A139 HydrophobicContact CZ-CB 3.88Å; F135-A139 PolarHBondContact O-N 3.43Å
136A76.1Confident85.6Confident6 Ų668.1 Ų68.15%0.0536%0.361CS..Hα-helixtrans-58.5-31.7179.100000113.6H132 A133 V134 K138 R140H132-A136 WeakPolarHBondContact O-CB 3.23Å; H132-A136 PolarHBondContact O-N 2.88Å; A133-A136 WeakPolarHBondContact O-CB 3.24Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 3.44Å; A136-K138 VanDerWaalsContact C-N 3.29Å; A136-K138 PolarHBondContact O-N 3.01Å; A136-R140 HydrophobicContact CB-CG 4.27Å; A136-R140 VanDerWaalsContact O-CB 3.23Å; A136-R140 WeakPolarHBondContact O-CB 3.45Å; A136-R140 WeakPolarHBondContact O-CG 3.4Å; A136-R140 PolarHBondContact O-N 3.29Å; A136-R140 VanDerWaalsContact O-N 3.08Å
137L77.3Confident85.9Confident151 Ų15169.8 Ų69.879%0.79138%0.375SS*.Hα-helixtrans-62.6-34.8176.3-74.2163000112.6A133 V134 F135A133-L137 PolarHBondContact O-N 3Å; V134-L137 PolarHBondContact O-N 3.31Å; F135-L137 PolarHBondContact O-N 2.91Å
138K78.2Confident86.3Confident176 Ų17669.5 Ų69.577%0.76538%0.378SS*.Hα-helixtrans-88.1-36.6-179.7-170.3176.1179.9178.80112.6F135 A136F135-K138 PolarHBondContact O-N 2.8Å; F135-K138 VanDerWaalsContact O-N 3.08Å; A136-K138 VanDerWaalsContact C-N 3.29Å; A136-K138 PolarHBondContact O-N 3.01Å
139A78.3Confident86.7Confident24 Ų2467.8 Ų67.820%0.19837%0.37CS..Hα-helixtrans-87.6-25.9-172.100000114.4F135 T141 F144F135-A139 HydrophobicContact CD1-CB 4.07Å; F135-A139 HydrophobicContact CE1-CB 3.61Å; F135-A139 HydrophobicContact CZ-CB 3.88Å; F135-A139 PolarHBondContact O-N 3.43Å; A139-T141 VanDerWaalsContact C-N 3.28Å; A139-T141 PolarHBondContact O-N 3.31Å; A139-T141 VanDerWaalsContact O-N 3.12Å; A139-F144 WeakPolarHBondContact O-CD2 3.41Å
140R86.9Confident87.2Confident68 Ų6870.7 Ų70.726%0.25739%0.385SS..  trans-91.547.5-171.7-60.5173.668.5-122.4-15.9113.4M64 T65 D125 A136M64-R140 HydrophobicContact SD-CB 3.97Å; M64-R140 HydrophobicContact SD-CG 4.13Å; T65-R140 PolarHBondContact OG1-NH2 3.31Å; D125-R140 PolarHBondContact O-NE 2.88Å; D125-R140 IonicContact OD1-CZ 2.83Å; D125-R140 IonicContact OD1-NE 2.7Å; D125-R140 PolarHBondContact OD1-NE 3.25Å; D125-R140 IonicContact OD1-NH2 3.69Å; D125-R140 PolarHBondContact OD1-NH2 2.84Å; D125-R140 IonicContact OD2-NH2 3.61Å; D125-R140 PolarHBondContact OD2-NH2 3.42Å; A136-R140 HydrophobicContact CB-CG 4.27Å; A136-R140 VanDerWaalsContact O-CB 3.23Å; A136-R140 WeakPolarHBondContact O-CB 3.45Å; A136-R140 WeakPolarHBondContact O-CG 3.4Å; A136-R140 PolarHBondContact O-N 3.29Å; A136-R140 VanDerWaalsContact O-N 3.08Å
141T88.8Confident87.9Confident51 Ų5174.8 Ų74.831%0.31341%0.405SS..  trans-84.4156.8176.273.40000111.2A139 T143 F144 G145A139-T141 VanDerWaalsContact C-N 3.28Å; A139-T141 PolarHBondContact O-N 3.31Å; A139-T141 VanDerWaalsContact O-N 3.12Å; T141-T143 VanDerWaalsContact C-N 3.26Å; T141-T143 PolarHBondContact O-N 3.48Å; T141-F144 HydrophobicContact CG2-CD2 4.38Å; T141-F144 PolarHBondContact O-N 2.68Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.5Å; T141-F144 PolarHBondContact OG1-N 3.05Å; T141-G145 PolarHBondContact O-N 3.29Å
142V90.8Very high88.5Confident57 Ų5773.6 Ų73.635%0.34540%0.398SS..Hα-helixtrans-61.2-38.1176.5175.30000110.9I67 F144 G145 V146I67-V142 HydrophobicContact CD1-CG1 4.22Å; I67-V142 HydrophobicContact CG1-CG1 4.23Å; V142-F144 PolarHBondContact O-N 3.2Å; V142-G145 CarbonylContact O-C 3.58Å; V142-G145 WeakPolarHBondContact O-CA 3.25Å; V142-G145 PolarHBondContact O-N 2.88Å; V142-G145 VanDerWaalsContact O-N 3.11Å; V142-V146 HydrophobicContact CG1-CG2 4.4Å; V142-V146 WeakPolarHBondContact O-CG2 3.5Å; V142-V146 PolarHBondContact O-N 3.1Å
143T92.2Very high89.1Confident103 Ų10371.8 Ų71.863%0.63239%0.388SS*.Hα-helixtrans-59.3-47.9177.7-46.70000111.9T141 G145 V146 V147T141-T143 VanDerWaalsContact C-N 3.26Å; T141-T143 PolarHBondContact O-N 3.48Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 3.43Å; T143-V146 PolarHBondContact O-N 3.01Å; T143-V147 WeakPolarHBondContact O-CG2 3.44Å; T143-V147 PolarHBondContact O-N 2.8Å
144F92.4Very high90Very high120 Ų12072.6 Ų72.653%0.52639%0.387SS..Hα-helixtrans-63.6-37.5174.7-77.9-61.9000111.8A139 T141 V142 V146 V147 T148A139-F144 WeakPolarHBondContact O-CD2 3.41Å; T141-F144 HydrophobicContact CG2-CD2 4.38Å; T141-F144 PolarHBondContact O-N 2.68Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.5Å; T141-F144 PolarHBondContact OG1-N 3.05Å; V142-F144 PolarHBondContact O-N 3.2Å; F144-V146 PolarHBondContact O-N 3.46Å; F144-V147 PolarHBondContact O-N 2.93Å; F144-T148 WeakPolarHBondContact O-CB 3.46Å; F144-T148 VanDerWaalsContact O-CG2 3.3Å; F144-T148 WeakPolarHBondContact O-CG2 3.36Å; F144-T148 PolarHBondContact O-N 3.47Å; F144-T148 PolarHBondContact O-OG1 2.81Å
145G93.4Very high90.9Very high0 Ų069.9 Ų69.90%037%0.371CS..Hα-helixtrans-56.4-46.4171.900000113.1T141 V142 T143 T148 S149T141-G145 PolarHBondContact O-N 3.29Å; V142-G145 CarbonylContact O-C 3.58Å; V142-G145 WeakPolarHBondContact O-CA 3.25Å; V142-G145 PolarHBondContact O-N 2.88Å; V142-G145 VanDerWaalsContact O-N 3.11Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 3.43Å; G145-T148 PolarHBondContact O-OG1 3.45Å; G145-S149 WeakPolarHBondContact O-CB 2.98Å; G145-S149 PolarHBondContact O-N 3.25Å; G145-S149 PolarHBondContact O-OG 2.99Å; G145-S149 VanDerWaalsContact O-OG 3.09Å
146V95.5Very high91.8Very high72 Ų7263.7 Ų63.744%0.43634%0.343SS..Hα-helixtrans-66.1-47.9178.7173.80000111.4V142 T143 F144 T148 S149 V150V142-V146 HydrophobicContact CG1-CG2 4.4Å; V142-V146 WeakPolarHBondContact O-CG2 3.5Å; V142-V146 PolarHBondContact O-N 3.1Å; T143-V146 PolarHBondContact O-N 3.01Å; F144-V146 PolarHBondContact O-N 3.46Å; V146-T148 PolarHBondContact O-N 2.97Å; V146-S149 WeakPolarHBondContact O-CB 3.32Å; V146-S149 PolarHBondContact O-N 3.07Å; V146-V150 WeakPolarHBondContact O-CG2 3.18Å; V146-V150 PolarHBondContact O-N 3.11Å
147V96.6Very high92.8Very high75 Ų7566.3 Ų66.346%0.45536%0.359SS..Hα-helixtrans-60.5-46.8-179.9172.90000111.1T143 F144 S149 V150 I151T143-V147 WeakPolarHBondContact O-CG2 3.44Å; T143-V147 PolarHBondContact O-N 2.8Å; F144-V147 PolarHBondContact O-N 2.93Å; V147-S149 VanDerWaalsContact C-N 3.33Å; V147-S149 PolarHBondContact O-N 3.43Å; V147-V150 PolarHBondContact O-N 3.21Å; V147-I151 HydrophobicContact CG1-CD1 3.99Å; V147-I151 WeakPolarHBondContact O-CG1 3.38Å; V147-I151 PolarHBondContact O-N 3.43Å
148T96.7Very high93.8Very high40 Ų4065.8 Ų65.825%0.24535%0.35CS..Hα-helixtrans-64.1-36.9177.451.70000112.4Y68 F144 G145 V146 I151 T152Y68-T148 WeakPolarHBondContact CE1-OG1 3.35Å; Y68-T148 PolarHBondContact OH-OG1 2.99Å; F144-T148 WeakPolarHBondContact O-CB 3.46Å; F144-T148 VanDerWaalsContact O-CG2 3.3Å; F144-T148 WeakPolarHBondContact O-CG2 3.36Å; F144-T148 PolarHBondContact O-N 3.47Å; F144-T148 PolarHBondContact O-OG1 2.81Å; G145-T148 PolarHBondContact O-OG1 3.45Å; V146-T148 PolarHBondContact O-N 2.97Å; T148-I151 PolarHBondContact O-N 3.24Å; T148-T152 WeakPolarHBondContact O-CB 3.26Å; T148-T152 PolarHBondContact O-N 3.27Å; T148-T152 PolarHBondContact O-OG1 3.37Å
149S97.6Very high94.6Very high4 Ų458 Ų583%0.02832%0.319CS..Hα-helixtrans-62.1-45.2172.4-71.60000112.5N71 F118 G145 V146 V147 I151 T152 W153N71-S149 PolarHBondContact ND2-OG 3.15Å; F118-S149 WeakPolarHBondContact CE1-OG 3.49Å; G145-S149 WeakPolarHBondContact O-CB 2.98Å; G145-S149 PolarHBondContact O-N 3.25Å; G145-S149 PolarHBondContact O-OG 2.99Å; G145-S149 VanDerWaalsContact O-OG 3.09Å; V146-S149 WeakPolarHBondContact O-CB 3.32Å; V146-S149 PolarHBondContact O-N 3.07Å; V147-S149 VanDerWaalsContact C-N 3.33Å; V147-S149 PolarHBondContact O-N 3.43Å; S149-I151 PolarHBondContact O-N 3.43Å; S149-T152 WeakPolarHBondContact O-CB 3.43Å; S149-T152 PolarHBondContact O-N 3Å; S149-T152 VanDerWaalsContact O-N 3.16Å; S149-W153 PolarHBondContact O-N 3.42Å
150V98.1Very high95.4Very high86 Ų8656.9 Ų56.952%0.52131%0.31SS..Hα-helixtrans-60.4-46.6178.4171.70000110.9V146 V147 T152 W153 V154V146-V150 WeakPolarHBondContact O-CG2 3.18Å; V146-V150 PolarHBondContact O-N 3.11Å; V147-V150 PolarHBondContact O-N 3.21Å; V150-T152 VanDerWaalsContact C-N 3.27Å; V150-T152 PolarHBondContact O-N 3.11Å; V150-W153 PolarHBondContact O-N 3Å; V150-V154 WeakPolarHBondContact O-CG2 3Å; V150-V154 PolarHBondContact O-N 3.25Å; V150-V154 VanDerWaalsContact O-N 3.08Å
151I98.2Very high95.8Very high98 Ų9856.9 Ų56.950%0.50331%0.314SS..Hα-helixtrans-58.8-43.1175.8-65.6166.6000110.4V147 T148 S149 W153 V154 V155V147-I151 HydrophobicContact CG1-CD1 3.99Å; V147-I151 WeakPolarHBondContact O-CG1 3.38Å; V147-I151 PolarHBondContact O-N 3.43Å; T148-I151 PolarHBondContact O-N 3.24Å; S149-I151 PolarHBondContact O-N 3.43Å; I151-W153 VanDerWaalsContact C-N 3.35Å; I151-W153 PolarHBondContact O-N 3.11Å; I151-V154 PolarHBondContact O-N 3.46Å; I151-V155 HydrophobicContact CG2-CG2 4.32Å; I151-V155 WeakPolarHBondContact O-CG2 3.47Å; I151-V155 PolarHBondContact O-N 3.1Å
152T98.2Very high95.9Very high16 Ų1655.6 Ų55.610%0.09831%0.307CS..Hα-helixtrans-62.2-41.4180-58.30000112.2F117 F118 L121 T148 S149 V150 V155 A156F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 VanDerWaalsContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.14Å; F117-T152 HydrophobicContact CG-CG2 4.3Å; F118-T152 HydrophobicContact CD2-CG2 4.5Å; F118-T152 HydrophobicContact CE1-CG2 4.16Å; F118-T152 HydrophobicContact CE2-CG2 4.06Å; F118-T152 HydrophobicContact CZ-CG2 3.86Å; L121-T152 HydrophobicContact CD1-CG2 4.3Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.41Å; T148-T152 WeakPolarHBondContact O-CB 3.26Å; T148-T152 PolarHBondContact O-N 3.27Å; T148-T152 PolarHBondContact O-OG1 3.37Å; S149-T152 WeakPolarHBondContact O-CB 3.43Å; S149-T152 PolarHBondContact O-N 3Å; S149-T152 VanDerWaalsContact O-N 3.16Å; V150-T152 VanDerWaalsContact C-N 3.27Å; V150-T152 PolarHBondContact O-N 3.11Å; T152-V155 PolarHBondContact O-N 2.78Å; T152-A156 WeakPolarHBondContact O-CB 3.44Å; T152-A156 PolarHBondContact O-N 2.92Å
153W98.3Very high95.8Very high48 Ų4853 Ų5318%0.18229%0.291CS..Hα-helixtrans-61.6-45.5174.3-80.9111.6000112.1N71 I74 F78 I110 S114 F118 S149 V150 I151 V155 A156 V157N71-W153 PolarHBondContact OD1-NE1 3.4Å; I74-W153 HydrophobicContact CB-CZ2 4.27Å; I74-W153 HydrophobicContact CG2-CH2 3.99Å; I74-W153 HydrophobicContact CG2-CZ2 3.78Å; F78-W153 AromaticContact CD2-CH2 3.51Å; F78-W153 HydrophobicContact CD2-CH2 3.51Å; F78-W153 AromaticContact CD2-CZ3 3.54Å; F78-W153 HydrophobicContact CD2-CZ3 3.54Å; F78-W153 HydrophobicContact CE2-CE3 4.32Å; F78-W153 AromaticContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CH2 3.4Å; F78-W153 VanDerWaalsContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CZ2 4.33Å; F78-W153 AromaticContact CE2-CZ3 3.4Å; F78-W153 HydrophobicContact CE2-CZ3 3.4Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.4Å; I110-W153 HydrophobicContact CG2-CE3 4.1Å; I110-W153 HydrophobicContact CG2-CZ3 3.6Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.26Å; F118-W153 AromaticContact CE2-CE2 3.95Å; F118-W153 HydrophobicContact CE2-CZ2 4.17Å; F118-W153 AromaticContact CE2-NE1 3.9Å; F118-W153 AromaticContact CZ-NE1 3.76Å; S149-W153 PolarHBondContact O-N 3.42Å; V150-W153 PolarHBondContact O-N 3Å; I151-W153 VanDerWaalsContact C-N 3.35Å; I151-W153 PolarHBondContact O-N 3.11Å; W153-V155 VanDerWaalsContact C-N 3.34Å; W153-V155 PolarHBondContact O-N 3.34Å; W153-A156 PolarHBondContact O-N 3.28Å; W153-V157 WeakPolarHBondContact O-CG2 3.32Å; W153-V157 PolarHBondContact O-N 3.25Å
154V98.3Very high95.8Very high72 Ų7250 Ų5044%0.43627%0.271SS..Hα-helixtrans-58.8-47.8176.6172.90000110.4V150 I151 A156 V157 F158V150-V154 WeakPolarHBondContact O-CG2 3Å; V150-V154 PolarHBondContact O-N 3.25Å; V150-V154 VanDerWaalsContact O-N 3.08Å; I151-V154 PolarHBondContact O-N 3.46Å; V154-A156 PolarHBondContact O-N 2.94Å; V154-V157 PolarHBondContact O-N 3.22Å; V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.52Å; V154-F158 WeakPolarHBondContact O-CD2 3.36Å; V154-F158 PolarHBondContact O-N 3.13Å
155V98.1Very high95.9Very high71 Ų7149.1 Ų49.143%0.4327%0.271SS..Hα-helixtrans-61.2-42177.4174.60000111.7F117 I151 T152 W153 V157 F158 A159F117-V155 HydrophobicContact CD2-CG1 4.5Å; F117-V155 HydrophobicContact CE2-CG1 3.82Å; F117-V155 HydrophobicContact CZ-CG1 4.33Å; I151-V155 HydrophobicContact CG2-CG2 4.32Å; I151-V155 WeakPolarHBondContact O-CG2 3.47Å; I151-V155 PolarHBondContact O-N 3.1Å; T152-V155 PolarHBondContact O-N 2.78Å; W153-V155 VanDerWaalsContact C-N 3.34Å; W153-V155 PolarHBondContact O-N 3.34Å; V155-V157 PolarHBondContact O-N 3.47Å; V155-F158 PolarHBondContact O-N 3.27Å; V155-A159 WeakPolarHBondContact O-CB 3.27Å; V155-A159 PolarHBondContact O-N 3.41Å
156A97.9Very high95.8Very high0 Ų050.2 Ų50.20%028%0.276CS..Hα-helixtrans-63.9-39.3177.600000112.4F113 F117 T152 W153 V154 A159 S160F113-A156 HydrophobicContact CB-CB 4.16Å; F117-A156 HydrophobicContact CD2-CB 4.35Å; F117-A156 HydrophobicContact CE2-CB 4.43Å; T152-A156 WeakPolarHBondContact O-CB 3.44Å; T152-A156 PolarHBondContact O-N 2.92Å; W153-A156 PolarHBondContact O-N 3.28Å; V154-A156 PolarHBondContact O-N 2.94Å; A156-A159 PolarHBondContact O-N 3.11Å; A156-S160 WeakPolarHBondContact O-CB 3.49Å; A156-S160 PolarHBondContact O-N 2.97Å; A156-S160 VanDerWaalsContact O-N 3.15Å; A156-S160 PolarHBondContact O-OG 2.87Å
157V97.6Very high95.7Very high61 Ų6147 Ų4737%0.3726%0.256SS..Hα-helixtrans-62.5-50.2173.5172.10000110.3I110 W153 V154 V155 A159 S160 L161I110-V157 HydrophobicContact CD1-CG2 3.98Å; I110-V157 HydrophobicContact CG1-CG2 4.22Å; W153-V157 WeakPolarHBondContact O-CG2 3.32Å; W153-V157 PolarHBondContact O-N 3.25Å; V154-V157 PolarHBondContact O-N 3.22Å; V155-V157 PolarHBondContact O-N 3.47Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 3.4Å; V157-S160 WeakPolarHBondContact O-CA 3.18Å; V157-S160 WeakPolarHBondContact O-CB 3.33Å; V157-S160 PolarHBondContact O-N 3.45Å; V157-L161 PolarHBondContact O-N 3.29Å; V157-L161 VanDerWaalsContact O-N 3.12Å
158F97.1Very high95.5Very high139 Ų13950.4 Ų50.461%0.6126%0.261SS*.Hα-helixtrans-59.2-41.9177.8-83.5-70.4000112.8V154 V155 S160 L161V154-F158 HydrophobicContact CG1-CD2 3.65Å; V154-F158 HydrophobicContact CG1-CE2 3.52Å; V154-F158 WeakPolarHBondContact O-CD2 3.36Å; V154-F158 PolarHBondContact O-N 3.13Å; V155-F158 PolarHBondContact O-N 3.27Å; F158-S160 PolarHBondContact O-N 2.96Å; F158-L161 HydrophobicContact CD1-CD1 3.63Å; F158-L161 HydrophobicContact CE1-CD1 4.08Å; F158-L161 HydrophobicContact CG-CD1 4.45Å; F158-L161 PolarHBondContact O-N 2.91Å
159A95.9Very high95.3Very high14 Ų1449.7 Ų49.712%0.11626%0.258CS..Hα-helixtrans-62.6-27176.100000112.9F113 V155 A156 V157 K197 L201F113-A159 HydrophobicContact CD1-CB 4.39Å; F113-A159 HydrophobicContact CD2-CB 3.8Å; F113-A159 HydrophobicContact CE2-CB 4.1Å; F113-A159 HydrophobicContact CG-CB 4Å; V155-A159 WeakPolarHBondContact O-CB 3.27Å; V155-A159 PolarHBondContact O-N 3.41Å; A156-A159 PolarHBondContact O-N 3.11Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 3.4Å; A159-K197 PolarHBondContact O-NZ 2.82Å; A159-L201 HydrophobicContact CB-CD1 4.32Å
160S95.7Very high94.9Very high0 Ų053.4 Ų53.40%027%0.274CS..Hα-helixtrans-84.4-25.5-179.3-55.70000113.2F109 I110 A156 V157 F158 G163 I164F109-S160 VanDerWaalsContact C-OG 3.24Å; F109-S160 WeakPolarHBondContact CB-OG 3Å; I110-S160 WeakPolarHBondContact CG1-OG 3.48Å; I110-S160 PolarHBondContact N-OG 3.05Å; A156-S160 WeakPolarHBondContact O-CB 3.49Å; A156-S160 PolarHBondContact O-N 2.97Å; A156-S160 VanDerWaalsContact O-N 3.15Å; A156-S160 PolarHBondContact O-OG 2.87Å; V157-S160 WeakPolarHBondContact O-CA 3.18Å; V157-S160 WeakPolarHBondContact O-CB 3.33Å; V157-S160 PolarHBondContact O-N 3.45Å; F158-S160 PolarHBondContact O-N 2.96Å; S160-G163 PolarHBondContact O-N 3.34Å; S160-I164 PolarHBondContact O-N 2.94Å
161L94.2Very high94.4Very high67 Ų6755.4 Ų55.435%0.35128%0.276SS..Hα-helixtrans-51.9-46.7-174.7-72176.3000114.6V157 F158 G163 I164 I165V157-L161 PolarHBondContact O-N 3.29Å; V157-L161 VanDerWaalsContact O-N 3.12Å; F158-L161 HydrophobicContact CD1-CD1 3.63Å; F158-L161 HydrophobicContact CE1-CD1 4.08Å; F158-L161 HydrophobicContact CG-CD1 4.45Å; F158-L161 PolarHBondContact O-N 2.91Å; L161-G163 VanDerWaalsContact C-N 3.25Å; L161-G163 PolarHBondContact O-N 3.44Å; L161-I164 PolarHBondContact O-N 3.46Å; L161-I164 VanDerWaalsContact O-N 3.09Å; L161-I165 WeakPolarHBondContact O-CG1 3.38Å; L161-I165 PolarHBondContact O-N 2.83Å
162P91.3Very high93.7Very high25 Ų2554.8 Ų54.816%0.16227%0.271CS..Hα-helixtrans-59.1-39.1178.6-24.234.7000112.2I164 I165 F166 F193P162-I164 VanDerWaalsContact C-N 3.33Å; P162-I164 PolarHBondContact O-N 2.93Å; P162-I165 PolarHBondContact O-N 3.14Å; P162-F166 HydrophobicContact CB-CD2 4.45Å; P162-F166 HydrophobicContact CB-CE2 4.33Å; P162-F166 WeakPolarHBondContact O-CD2 3.46Å; P162-F166 PolarHBondContact O-N 3.08Å; P162-F166 VanDerWaalsContact O-N 3.13Å; P162-F193 HydrophobicContact CB-CE1 4.46Å; P162-F193 HydrophobicContact CG-CE1 4.23Å
163G89.1Confident92.9Very high1 Ų157.3 Ų57.31%0.0130%0.3CS..Hα-helixtrans-63.1-39.1176.800000112.4S160 L161 T167S160-G163 PolarHBondContact O-N 3.34Å; L161-G163 VanDerWaalsContact C-N 3.25Å; L161-G163 PolarHBondContact O-N 3.44Å; G163-T167 VanDerWaalsContact O-CB 3.24Å; G163-T167 WeakPolarHBondContact O-CB 3.45Å; G163-T167 PolarHBondContact O-N 3.34Å; G163-T167 VanDerWaalsContact O-N 3.12Å; G163-T167 PolarHBondContact O-OG1 3.13Å
164I92.5Very high92.1Very high42 Ų4262.2 Ų62.222%0.21533%0.329CS..Hα-helixtrans-68.3-41.7178.9-59.3168.3000111.1Q102 G106 S160 L161 P162Q102-I164 HydrophobicContact CB-CG2 4.2Å; G106-I164 VanDerWaalsContact CA-CG1 3.5Å; S160-I164 PolarHBondContact O-N 2.94Å; L161-I164 PolarHBondContact O-N 3.46Å; L161-I164 VanDerWaalsContact O-N 3.09Å; P162-I164 VanDerWaalsContact C-N 3.33Å; P162-I164 PolarHBondContact O-N 2.93Å
165I93Very high91.5Very high101 Ų10162.6 Ų62.652%0.51833%0.326SS..Hα-helixtrans-67.7-42.1-176.7-66.8164.6000111.4L161 P162L161-I165 WeakPolarHBondContact O-CG1 3.38Å; L161-I165 PolarHBondContact O-N 2.83Å; P162-I165 PolarHBondContact O-N 3.14Å
166F92.4Very high91.2Very high23 Ų2364.5 Ų64.510%0.10133%0.326CS..Hα-helixtrans-83.7-20.4-177.2-64.9-58000113.5P162 H181 F182 P183 W190P162-F166 HydrophobicContact CB-CD2 4.45Å; P162-F166 HydrophobicContact CB-CE2 4.33Å; P162-F166 WeakPolarHBondContact O-CD2 3.46Å; P162-F166 PolarHBondContact O-N 3.08Å; P162-F166 VanDerWaalsContact O-N 3.13Å; F166-H181 PolarHBondContact O-N 3.5Å; F166-F182 HydrophobicContact CB-CD1 3.93Å; F166-F182 HydrophobicContact CB-CE1 3.87Å; F166-F182 AromaticContact CD1-CD1 4Å; F166-F182 HydrophobicContact CD1-CD1 4Å; F166-F182 AromaticContact CD2-CD1 3.88Å; F166-F182 HydrophobicContact CD2-CD1 3.88Å; F166-F182 AromaticContact CD2-CE1 3.8Å; F166-F182 HydrophobicContact CD2-CE1 3.8Å; F166-F182 HydrophobicContact CE2-CD1 4.47Å; F166-F182 AromaticContact CG-CD1 3.66Å; F166-F182 HydrophobicContact CG-CD1 3.66Å; F166-F182 AromaticContact CG-CE1 3.85Å; F166-F182 HydrophobicContact CG-CE1 3.85Å; F166-P183 HydrophobicContact CE1-CG 4.07Å; F166-W190 HydrophobicContact CD2-CE3 4.42Å; F166-W190 HydrophobicContact CE1-CD2 4.3Å; F166-W190 AromaticContact CE2-CD2 3.74Å; F166-W190 HydrophobicContact CE2-CD2 3.74Å; F166-W190 AromaticContact CE2-CE3 3.28Å; F166-W190 HydrophobicContact CE2-CE3 3.28Å; F166-W190 HydrophobicContact CE2-CG 4.39Å; F166-W190 HydrophobicContact CE2-CH2 4.22Å; F166-W190 AromaticContact CE2-CZ3 3.56Å; F166-W190 HydrophobicContact CE2-CZ3 3.56Å; F166-W190 AromaticContact CZ-CD2 3.4Å; F166-W190 HydrophobicContact CZ-CD2 3.4Å; F166-W190 AromaticContact CZ-CE2 3.65Å; F166-W190 AromaticContact CZ-CE3 3.42Å; F166-W190 HydrophobicContact CZ-CE3 3.42Å; F166-W190 VanDerWaalsContact CZ-CE3 3.42Å; F166-W190 HydrophobicContact CZ-CG 4Å; F166-W190 AromaticContact CZ-CH2 3.9Å; F166-W190 HydrophobicContact CZ-CH2 3.9Å; F166-W190 AromaticContact CZ-CZ2 3.89Å; F166-W190 HydrophobicContact CZ-CZ2 3.89Å; F166-W190 AromaticContact CZ-CZ3 3.68Å; F166-W190 HydrophobicContact CZ-CZ3 3.68Å
167T92.5Very high90.8Very high4 Ų465.3 Ų65.33%0.02533%0.331CS..EExtended strand (participates in β ladder)trans-81128.5178.2-66.30000111.7C101 Q102 T105 G163 S179 S180C101-T167 WeakPolarHBondContact SG-CG2 3.26Å; Q102-T167 WeakPolarHBondContact CG-O 3.28Å; T105-T167 HydrophobicContact CG2-CG2 4.1Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.27Å; G163-T167 VanDerWaalsContact O-CB 3.24Å; G163-T167 WeakPolarHBondContact O-CB 3.45Å; G163-T167 PolarHBondContact O-N 3.34Å; G163-T167 VanDerWaalsContact O-N 3.12Å; G163-T167 PolarHBondContact O-OG1 3.13Å; T167-S179 WeakPolarHBondContact CA-O 3.16Å; T167-S180 PolarHBondContact OG1-OG 3.31Å
168R92.4Very high90.6Very high146 Ų14663 Ų6355%0.55132%0.318SS*.EExtended strand (participates in β ladder)trans-140.5156.2179.1-63.4-170.9-179.2-159.4-0.3110.5N98 S179N98-R168 VanDerWaalsContact OD1-CA 3.27Å; N98-R168 WeakPolarHBondContact OD1-CA 3.37Å; R168-S179 PolarHBondContact N-O 2.89Å; R168-S179 PolarHBondContact O-N 3.22Å; R168-S179 VanDerWaalsContact O-N 3.12Å
169S92.7Very high90.3Very high26 Ų2658 Ų5818%0.18230%0.3CS..EExtended strand (participates in β ladder)trans-94.6126.3167.6-1730000110.5N98 T177N98-S169 PolarHBondContact OD1-N 3.22Å; S169-T177 WeakPolarHBondContact CA-O 3.25Å; S169-T177 WeakPolarHBondContact CB-O 3.41Å; S169-T177 PolarHBondContact OG-O 3.17Å
170Q89.6Confident90Very high81 Ų8159.8 Ų59.838%0.37931%0.312SS..EExtended strand (participates in β ladder)trans-141.4159.9176.961171.831.300111.2E172 T177 H181Q170-E172 HydrophobicContact CG-CG 4.15Å; Q170-E172 PolarHBondContact NE2-OE1 2.92Å; Q170-T177 PolarHBondContact N-O 3.06Å; Q170-T177 PolarHBondContact O-N 3.22Å; Q170-T177 PolarHBondContact O-OG1 3.39Å; Q170-H181 PolarHBondContact NE2-CE1 3.09Å; Q170-H181 PolarHBondContact NE2-NE2 3.28Å
171K88.4Confident89.6Confident129 Ų12962.5 Ų62.556%0.56132%0.324SS*.EExtended strand (participates in β ladder)trans-86.4112.9176.2-171.2178178.7-177.40109.1G173 Y176K171-G173 WeakPolarHBondContact CE-O 3.37Å; K171-Y176 HydrophobicContact CB-CD1 4.09Å; K171-Y176 HydrophobicContact CB-CE1 3.89Å; K171-Y176 HydrophobicContact CG-CE1 4.46Å
172E82Confident89.5Confident85 Ų8560.7 Ų60.740%0.39731%0.314SS..EExtended strand (participates in β ladder)trans-109.3103.9176.2-72.5178.4169.300109.1Q170 L174 H175 T177 H181Q170-E172 HydrophobicContact CG-CG 4.15Å; Q170-E172 PolarHBondContact NE2-OE1 2.92Å; E172-L174 PolarHBondContact O-N 3.19Å; E172-H175 PolarHBondContact N-O 3Å; E172-H175 PolarHBondContact O-N 3.44Å; E172-T177 HydrophobicContact CB-CG2 4.25Å; E172-T177 VanDerWaalsContact CD-OG1 3.22Å; E172-T177 PolarHBondContact OE2-OG1 3.26Å; E172-H181 IonicContact OE1-CE1 3.63Å; E172-H181 PolarHBondContact OE1-CE1 3.42Å; E172-H181 IonicContact OE1-NE2 2.78Å
173G81.6Confident89.4Confident69 Ų6962 Ų6271%0.71132%0.322SS*.THydrogen-bonded Turntrans65.5-118.6-171.800000111.8K171K171-G173 WeakPolarHBondContact CE-O 3.37Å
174L82.6Confident89.3Confident151 Ų15172.5 Ų72.579%0.79136%0.363SS*.THydrogen-bonded Turntrans-90.2-10.1-178.6-72.1164.7000113.9E172E172-L174 PolarHBondContact O-N 3.19Å
175H85.7Confident89.3Confident79 Ų7975.8 Ų75.837%0.36639%0.39SS..EExtended strand (participates in β ladder)trans-122150.2-170.1-63.9-67.1000112.6Q93 E172Q93-H175 HydrophobicContact CB-CB 4.3Å; Q93-H175 PolarHBondContact OE1-ND1 2.88Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.16Å; E172-H175 PolarHBondContact N-O 3Å; E172-H175 PolarHBondContact O-N 3.44Å
176Y90.4Very high89.2Confident111 Ų11175.9 Ų75.944%0.43539%0.388SS..EExtended strand (participates in β ladder)trans-83.2131.4167.1-72.5-85.5000110.1W94 K171W94-Y176 WeakPolarHBondContact CB-O 3.5Å; W94-Y176 PolarHBondContact N-O 3Å; W94-Y176 WeakPolarHBondContact O-CB 3.39Å; K171-Y176 HydrophobicContact CB-CD1 4.09Å; K171-Y176 HydrophobicContact CB-CE1 3.89Å; K171-Y176 HydrophobicContact CG-CE1 4.46Å
177T90.8Very high89.1Confident18 Ų1879.8 Ų79.811%0.1140%0.403CS..EExtended strand (participates in β ladder)trans-116.1161.2176.558.10000110.5S169 Q170 E172S169-T177 WeakPolarHBondContact CA-O 3.25Å; S169-T177 WeakPolarHBondContact CB-O 3.41Å; S169-T177 PolarHBondContact OG-O 3.17Å; Q170-T177 PolarHBondContact N-O 3.06Å; Q170-T177 PolarHBondContact O-N 3.22Å; Q170-T177 PolarHBondContact O-OG1 3.39Å; E172-T177 HydrophobicContact CB-CG2 4.25Å; E172-T177 VanDerWaalsContact CD-OG1 3.22Å; E172-T177 PolarHBondContact OE2-OG1 3.26Å
178C93.5Very high88.9Confident12 Ų1283.6 Ų83.68%0.08142%0.42CS..EExtended strand (participates in β ladder)trans-124.7102.3169.5173.30000106.9W94 C101W94-C178 HydrophobicContact CB-CB 4.4Å; W94-C178 HydrophobicContact CD2-CB 3.45Å; W94-C178 VanDerWaalsContact CD2-CB 3.45Å; W94-C178 HydrophobicContact CE3-CB 3.59Å; W94-C178 HydrophobicContact CG-CB 3.8Å; W94-C178 HydrophobicContact CH2-CB 4.43Å; W94-C178 HydrophobicContact CZ2-CB 4.39Å; W94-C178 HydrophobicContact CZ3-CB 4.08Å; C101-C178 VanDerWaalsContact CA-SG 3.57Å; C101-C178 HydrophobicContact CB-CB 3.94Å; C101-C178 WeakPolarHBondContact CB-SG 3.46Å; C101-C178 VanDerWaalsContact SG-CA 3.59Å; C101-C178 WeakPolarHBondContact SG-CB 3.35Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.92Å
179S89.5Confident89Confident34 Ų3482.6 Ų82.624%0.23842%0.42CS..EExtended strand (participates in β ladder)trans-143.2158.9-17041.40000112T167 R168 H181T167-S179 WeakPolarHBondContact CA-O 3.16Å; R168-S179 PolarHBondContact N-O 2.89Å; R168-S179 PolarHBondContact O-N 3.22Å; R168-S179 VanDerWaalsContact O-N 3.12Å; S179-H181 PolarHBondContact O-CD2 3.03Å; S179-H181 PolarHBondContact O-NE2 2.83Å; S179-H181 PolarHBondContact OG-CE1 2.61Å; S179-H181 PolarHBondContact OG-NE2 2.71Å
180S89.4Confident89Confident52 Ų5284.4 Ų84.436%0.36442%0.423SS..EExtended strand (participates in β ladder)trans-80.4122.8176.1-57.20000111T167T167-S180 PolarHBondContact OG1-OG 3.31Å
181H89.1Confident89.1Confident56 Ų5682 Ų8226%0.25941%0.411SS..  trans-113.8110.4177-63.3-75.1000109.9F166 Q170 E172 S179F166-H181 PolarHBondContact O-N 3.5Å; Q170-H181 PolarHBondContact NE2-CE1 3.09Å; Q170-H181 PolarHBondContact NE2-NE2 3.28Å; E172-H181 IonicContact OE1-CE1 3.63Å; E172-H181 PolarHBondContact OE1-CE1 3.42Å; E172-H181 IonicContact OE1-NE2 2.78Å; S179-H181 PolarHBondContact O-CD2 3.03Å; S179-H181 PolarHBondContact O-NE2 2.83Å; S179-H181 PolarHBondContact OG-CE1 2.61Å; S179-H181 PolarHBondContact OG-NE2 2.71Å
182F90.3Very high89.3Confident30 Ų3077.7 Ų77.713%0.13239%0.394CS..  trans-89.9148176.8-55.7-60.2000111.2F166 Y184 Y187 W190 K191 Q194F166-F182 HydrophobicContact CB-CD1 3.93Å; F166-F182 HydrophobicContact CB-CE1 3.87Å; F166-F182 AromaticContact CD1-CD1 4Å; F166-F182 HydrophobicContact CD1-CD1 4Å; F166-F182 AromaticContact CD2-CD1 3.88Å; F166-F182 HydrophobicContact CD2-CD1 3.88Å; F166-F182 AromaticContact CD2-CE1 3.8Å; F166-F182 HydrophobicContact CD2-CE1 3.8Å; F166-F182 HydrophobicContact CE2-CD1 4.47Å; F166-F182 AromaticContact CG-CD1 3.66Å; F166-F182 HydrophobicContact CG-CD1 3.66Å; F166-F182 AromaticContact CG-CE1 3.85Å; F166-F182 HydrophobicContact CG-CE1 3.85Å; F182-Y184 PolarHBondContact O-N 3.12Å; F182-Y187 HydrophobicContact CB-CD2 3.92Å; F182-Y187 HydrophobicContact CB-CE2 4.4Å; F182-Y187 HydrophobicContact CD2-CD2 4.42Å; F182-Y187 HydrophobicContact CD2-CE2 4.15Å; F182-W190 HydrophobicContact CB-CB 4Å; F182-W190 HydrophobicContact CD1-CB 3.57Å; F182-W190 HydrophobicContact CD1-CG 4.49Å; F182-W190 HydrophobicContact CE1-CB 4.24Å; F182-W190 HydrophobicContact CG-CB 3.86Å; F182-K191 HydrophobicContact CD2-CB 4.22Å; F182-K191 HydrophobicContact CE2-CB 4.2Å; F182-K191 HydrophobicContact CE2-CG 4.47Å; F182-Q194 HydrophobicContact CE1-CB 4.5Å; F182-Q194 HydrophobicContact CZ-CB 4.17Å; F182-Q194 HydrophobicContact CZ-CG 4.37Å
183P89.4Confident89.9Confident52 Ų5277.8 Ų77.834%0.33839%0.394SS..  trans-59.3130.7176.3-2131.4000111.7F166 S185 Q186 Y187F166-P183 HydrophobicContact CE1-CG 4.07Å; P183-S185 VanDerWaalsContact C-N 3.27Å; P183-S185 PolarHBondContact O-N 3.26Å; P183-Q186 CarbonylContact O-C 3.48Å; P183-Q186 PolarHBondContact O-N 3.4Å; P183-Y187 WeakPolarHBondContact O-CA 3.31Å; P183-Y187 PolarHBondContact O-N 2.9Å
184Y88.1Confident90.5Very high222 Ų22275.2 Ų75.287%0.87136%0.363SS*.G310 helixtrans-56.5-37.7-177.2-67.4-72.9000113.6F182 Q186F182-Y184 PolarHBondContact O-N 3.12Å; Y184-Q186 PolarHBondContact O-N 2.86Å
185S91.3Very high91Very high111 Ų11168.3 Ų68.378%0.77633%0.327SS*.G310 helixtrans-63.1-24.2179.655.90000114P183P183-S185 VanDerWaalsContact C-N 3.27Å; P183-S185 PolarHBondContact O-N 3.26Å
186Q91.8Very high91.5Very high102 Ų10268 Ų6848%0.47733%0.328SS..G310 helixtrans-134.527.7-175.8-66.3-178.1-25.700111.5P183 Y184 Q188 F189 W190P183-Q186 CarbonylContact O-C 3.48Å; P183-Q186 PolarHBondContact O-N 3.4Å; Y184-Q186 PolarHBondContact O-N 2.86Å; Q186-Q188 PolarHBondContact O-N 3.24Å; Q186-F189 HydrophobicContact CB-CB 4.45Å; Q186-F189 PolarHBondContact O-N 3.18Å; Q186-F189 VanDerWaalsContact O-N 3.14Å; Q186-W190 VanDerWaalsContact O-CD1 3.31Å; Q186-W190 PolarHBondContact O-N 3.23Å; Q186-W190 VanDerWaalsContact O-N 3.08Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.14Å
187Y89.6Confident91.7Very high106 Ų10663.9 Ų63.942%0.41631%0.312SS..Hα-helixtrans-55.8-50.3-170.5177.4-94000112F182 P183 F189 W190 K191F182-Y187 HydrophobicContact CB-CD2 3.92Å; F182-Y187 HydrophobicContact CB-CE2 4.4Å; F182-Y187 HydrophobicContact CD2-CD2 4.42Å; F182-Y187 HydrophobicContact CD2-CE2 4.15Å; P183-Y187 WeakPolarHBondContact O-CA 3.31Å; P183-Y187 PolarHBondContact O-N 2.9Å; Y187-F189 VanDerWaalsContact C-N 3.33Å; Y187-F189 PolarHBondContact O-N 3.27Å; Y187-W190 PolarHBondContact O-N 3.45Å; Y187-K191 HydrophobicContact CE1-CD 3.89Å; Y187-K191 VanDerWaalsContact O-CB 3.27Å; Y187-K191 WeakPolarHBondContact O-CB 3.45Å; Y187-K191 PolarHBondContact O-N 3.46Å
188Q89.8Confident92Very high84 Ų8463.4 Ų63.439%0.39331%0.309SS..Hα-helixtrans-64.6-37.3-178.9-167.462.838.900112.3Q186 N192Q186-Q188 PolarHBondContact O-N 3.24Å; Q188-N192 PolarHBondContact NE2-OD1 3.3Å; Q188-N192 VanDerWaalsContact O-CB 3.23Å; Q188-N192 WeakPolarHBondContact O-CB 3.39Å; Q188-N192 PolarHBondContact O-N 2.97Å; Q188-N192 PolarHBondContact O-ND2 2.97Å; Q188-N192 PolarHBondContact O-OD1 3.39Å
189F92.8Very high92.1Very high125 Ų12563.4 Ų63.455%0.54831%0.309SS..Hα-helixtrans-63-51.6178.6175-93.8000111.1Q186 Y187 N192 F193Q186-F189 HydrophobicContact CB-CB 4.45Å; Q186-F189 PolarHBondContact O-N 3.18Å; Q186-F189 VanDerWaalsContact O-N 3.14Å; Y187-F189 VanDerWaalsContact C-N 3.33Å; Y187-F189 PolarHBondContact O-N 3.27Å; F189-N192 PolarHBondContact O-N 3.45Å; F189-F193 VanDerWaalsContact O-CB 3.27Å; F189-F193 WeakPolarHBondContact O-CB 3.25Å; F189-F193 PolarHBondContact O-N 3Å
190W93Very high92.4Very high63 Ų6366 Ų6624%0.23932%0.319CS..Hα-helixtrans-68.6-37.7-178.6-73.4108.9000112.7F166 F182 Q186 Y187 F193 Q194F166-W190 HydrophobicContact CD2-CE3 4.42Å; F166-W190 HydrophobicContact CE1-CD2 4.3Å; F166-W190 AromaticContact CE2-CD2 3.74Å; F166-W190 HydrophobicContact CE2-CD2 3.74Å; F166-W190 AromaticContact CE2-CE3 3.28Å; F166-W190 HydrophobicContact CE2-CE3 3.28Å; F166-W190 HydrophobicContact CE2-CG 4.39Å; F166-W190 HydrophobicContact CE2-CH2 4.22Å; F166-W190 AromaticContact CE2-CZ3 3.56Å; F166-W190 HydrophobicContact CE2-CZ3 3.56Å; F166-W190 AromaticContact CZ-CD2 3.4Å; F166-W190 HydrophobicContact CZ-CD2 3.4Å; F166-W190 AromaticContact CZ-CE2 3.65Å; F166-W190 AromaticContact CZ-CE3 3.42Å; F166-W190 HydrophobicContact CZ-CE3 3.42Å; F166-W190 VanDerWaalsContact CZ-CE3 3.42Å; F166-W190 HydrophobicContact CZ-CG 4Å; F166-W190 AromaticContact CZ-CH2 3.9Å; F166-W190 HydrophobicContact CZ-CH2 3.9Å; F166-W190 AromaticContact CZ-CZ2 3.89Å; F166-W190 HydrophobicContact CZ-CZ2 3.89Å; F166-W190 AromaticContact CZ-CZ3 3.68Å; F166-W190 HydrophobicContact CZ-CZ3 3.68Å; F182-W190 HydrophobicContact CB-CB 4Å; F182-W190 HydrophobicContact CD1-CB 3.57Å; F182-W190 HydrophobicContact CD1-CG 4.49Å; F182-W190 HydrophobicContact CE1-CB 4.24Å; F182-W190 HydrophobicContact CG-CB 3.86Å; Q186-W190 VanDerWaalsContact O-CD1 3.31Å; Q186-W190 PolarHBondContact O-N 3.23Å; Q186-W190 VanDerWaalsContact O-N 3.08Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.14Å; Y187-W190 PolarHBondContact O-N 3.45Å; W190-F193 HydrophobicContact CE3-CD1 4.14Å; W190-F193 HydrophobicContact CZ3-CD1 4.15Å; W190-F193 HydrophobicContact CZ3-CE1 4.41Å; W190-F193 PolarHBondContact O-N 3.41Å; W190-Q194 WeakPolarHBondContact O-CB 3.37Å; W190-Q194 PolarHBondContact O-N 2.77Å
191K91.1Very high92.8Very high32 Ų3265.6 Ų65.614%0.13931%0.312CS..Hα-helixtrans-59.4-50.9172.6-171.3-176.4177.4-174.40110.8F182 Y187 Q194 T195 T259F182-K191 HydrophobicContact CD2-CB 4.22Å; F182-K191 HydrophobicContact CE2-CB 4.2Å; F182-K191 HydrophobicContact CE2-CG 4.47Å; Y187-K191 HydrophobicContact CE1-CD 3.89Å; Y187-K191 VanDerWaalsContact O-CB 3.27Å; Y187-K191 WeakPolarHBondContact O-CB 3.45Å; Y187-K191 PolarHBondContact O-N 3.46Å; K191-Q194 PolarHBondContact O-N 2.97Å; K191-T195 PolarHBondContact O-N 2.95Å; K191-T195 VanDerWaalsContact O-N 3.11Å; K191-T195 PolarHBondContact O-OG1 3.02Å; K191-T259 HydrophobicContact CG-CG2 4.2Å
192N93.4Very high93Very high38 Ų3862.9 Ų62.920%0.20330%0.3CS..Hα-helixtrans-61.8-45.9177.5-71.7-7000111.8Q188 F189 Q194 T195 L196 T259Q188-N192 PolarHBondContact NE2-OD1 3.3Å; Q188-N192 VanDerWaalsContact O-CB 3.23Å; Q188-N192 WeakPolarHBondContact O-CB 3.39Å; Q188-N192 PolarHBondContact O-N 2.97Å; Q188-N192 PolarHBondContact O-ND2 2.97Å; Q188-N192 PolarHBondContact O-OD1 3.39Å; F189-N192 PolarHBondContact O-N 3.45Å; N192-Q194 PolarHBondContact O-N 3.45Å; N192-T195 PolarHBondContact O-N 3.23Å; N192-L196 VanDerWaalsContact O-CB 3.31Å; N192-L196 WeakPolarHBondContact O-CB 3.35Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.44Å; N192-L196 PolarHBondContact O-N 2.92Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.25Å
193F94.8Very high93.2Very high87 Ų8762.5 Ų62.538%0.38230%0.299SS..Hα-helixtrans-58.9-47.1179.5176.9-98000111.5P162 F189 W190 K197P162-F193 HydrophobicContact CB-CE1 4.46Å; P162-F193 HydrophobicContact CG-CE1 4.23Å; F189-F193 VanDerWaalsContact O-CB 3.27Å; F189-F193 WeakPolarHBondContact O-CB 3.25Å; F189-F193 PolarHBondContact O-N 3Å; W190-F193 HydrophobicContact CE3-CD1 4.14Å; W190-F193 HydrophobicContact CZ3-CD1 4.15Å; W190-F193 HydrophobicContact CZ3-CE1 4.41Å; W190-F193 PolarHBondContact O-N 3.41Å; F193-K197 WeakPolarHBondContact O-CB 3.25Å; F193-K197 PolarHBondContact O-N 2.96Å
194Q93.3Very high93.5Very high14 Ų1463.7 Ų63.77%0.06531%0.305CS..Hα-helixtrans-63.9-45-179.7-173.670.7-8.800111.7F182 W190 K191 N192 I198F182-Q194 HydrophobicContact CE1-CB 4.5Å; F182-Q194 HydrophobicContact CZ-CB 4.17Å; F182-Q194 HydrophobicContact CZ-CG 4.37Å; W190-Q194 WeakPolarHBondContact O-CB 3.37Å; W190-Q194 PolarHBondContact O-N 2.77Å; K191-Q194 PolarHBondContact O-N 2.97Å; N192-Q194 PolarHBondContact O-N 3.45Å; Q194-I198 HydrophobicContact CG-CD1 4.22Å; Q194-I198 WeakPolarHBondContact O-CG1 3.37Å; Q194-I198 PolarHBondContact O-N 3.22Å; Q194-I198 VanDerWaalsContact O-N 3.11Å
195T94Very high93.9Very high7 Ų756.3 Ų56.34%0.04328%0.28CS..Hα-helixtrans-61.8-52.5176.5-65.80000111.5K191 N192 K197 I198 V199 L255 L256 T259 F260K191-T195 PolarHBondContact O-N 2.95Å; K191-T195 VanDerWaalsContact O-N 3.11Å; K191-T195 PolarHBondContact O-OG1 3.02Å; N192-T195 PolarHBondContact O-N 3.23Å; T195-K197 VanDerWaalsContact C-N 3.3Å; T195-K197 PolarHBondContact O-N 3.27Å; T195-I198 PolarHBondContact O-N 2.68Å; T195-V199 HydrophobicContact CG2-CG2 4.43Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 2.81Å; T195-L255 HydrophobicContact CG2-CG 4.2Å; T195-L256 HydrophobicContact CG2-CD1 4.33Å; T195-T259 WeakPolarHBondContact CB-OG1 3.27Å; T195-T259 HydrophobicContact CG2-CG2 3.97Å; T195-T259 VanDerWaalsContact CG2-OG1 3.23Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.39Å; T195-T259 PolarHBondContact OG1-OG1 3.44Å; T195-F260 HydrophobicContact CG2-CE2 4.49Å
196L95.8Very high94Very high73 Ų7351 Ų5138%0.38224%0.243SC..Hα-helixtrans-61.6-40-179.1-71.1175.2000111.3N192 I198 V199 I200 F260N192-L196 VanDerWaalsContact O-CB 3.31Å; N192-L196 WeakPolarHBondContact O-CB 3.35Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.44Å; N192-L196 PolarHBondContact O-N 2.92Å; L196-I198 PolarHBondContact O-N 3.29Å; L196-V199 PolarHBondContact O-N 3Å; L196-I200 HydrophobicContact CB-CD1 4.22Å; L196-I200 WeakPolarHBondContact O-CB 3.43Å; L196-I200 WeakPolarHBondContact O-CD1 3.49Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 2.89Å; L196-F260 HydrophobicContact CD2-CE2 4.4Å; L196-F260 HydrophobicContact CD2-CZ 4.44Å
197K96Very high94.1Very high23 Ų2349.6 Ų49.610%0.124%0.239CC..Hα-helixtrans-57.7-49.4174.7-178.8-16073.3177.10111.5F113 A159 F193 T195 L201F113-K197 HydrophobicContact CZ-CD 4.48Å; A159-K197 PolarHBondContact O-NZ 2.82Å; F193-K197 WeakPolarHBondContact O-CB 3.25Å; F193-K197 PolarHBondContact O-N 2.96Å; T195-K197 VanDerWaalsContact C-N 3.3Å; T195-K197 PolarHBondContact O-N 3.27Å; K197-L201 HydrophobicContact CG-CD1 3.89Å; K197-L201 WeakPolarHBondContact O-CB 3.1Å; K197-L201 WeakPolarHBondContact O-CG 3.46Å; K197-L201 PolarHBondContact O-N 3.21Å
198I95.3Very high94.4Very high8 Ų850.2 Ų50.24%0.04125%0.245CC..Hα-helixtrans-62.9-47.3179.8-68166000110.3F109 F112 F113 Q194 T195 L196 G202 N252 L255F109-I198 HydrophobicContact CE1-CD1 4.03Å; F112-I198 HydrophobicContact CE1-CG2 4.19Å; F112-I198 HydrophobicContact CZ-CG2 4.26Å; F113-I198 HydrophobicContact CZ-CG1 4.23Å; Q194-I198 HydrophobicContact CG-CD1 4.22Å; Q194-I198 WeakPolarHBondContact O-CG1 3.37Å; Q194-I198 PolarHBondContact O-N 3.22Å; Q194-I198 VanDerWaalsContact O-N 3.11Å; T195-I198 PolarHBondContact O-N 2.68Å; L196-I198 PolarHBondContact O-N 3.29Å; I198-G202 VanDerWaalsContact O-CA 3.24Å; I198-G202 WeakPolarHBondContact O-CA 3.44Å; I198-G202 PolarHBondContact O-N 3.42Å; I198-N252 PolarHBondContact O-OD1 3.46Å; I198-L255 HydrophobicContact CB-CD2 4.05Å; I198-L255 HydrophobicContact CD1-CD2 3.99Å; I198-L255 HydrophobicContact CG2-CD2 3.79Å
199V96Very high94.6Very high13 Ų1347.1 Ų47.18%0.07923%0.232CC..Hα-helixtrans-67.1-43.7-178.9173.50000111.9T195 L196 L203 V204 N252 L256T195-V199 HydrophobicContact CG2-CG2 4.43Å; T195-V199 WeakPolarHBondContact O-CG2 3.39Å; T195-V199 PolarHBondContact O-N 2.81Å; L196-V199 PolarHBondContact O-N 3Å; V199-L203 WeakPolarHBondContact O-CA 3.21Å; V199-L203 VanDerWaalsContact O-CB 3.28Å; V199-L203 WeakPolarHBondContact O-CB 3.43Å; V199-L203 PolarHBondContact O-N 3.3Å; V199-V204 HydrophobicContact CG1-CG2 4.25Å; V199-V204 PolarHBondContact O-N 3.07Å; V199-N252 HydrophobicContact CG2-CB 4.42Å; V199-L256 HydrophobicContact CG2-CB 4.49Å; V199-L256 HydrophobicContact CG2-CD1 4.41Å
200I96.9Very high94.5Very high87 Ų8742.9 Ų42.945%0.44621%0.214SC..Iπ-helixtrans-65.6-50.6-179-69.6166.6000110.1L196 V204 L205L196-I200 HydrophobicContact CB-CD1 4.22Å; L196-I200 WeakPolarHBondContact O-CB 3.43Å; L196-I200 WeakPolarHBondContact O-CD1 3.49Å; L196-I200 WeakPolarHBondContact O-CG1 3.3Å; L196-I200 PolarHBondContact O-N 2.89Å; I200-V204 PolarHBondContact O-N 3.1Å; I200-L205 VanDerWaalsContact O-CB 3.24Å; I200-L205 WeakPolarHBondContact O-CB 3.15Å; I200-L205 PolarHBondContact O-N 3.03Å
201L96.5Very high94.5Very high44 Ų4444.7 Ų44.723%0.2323%0.232CC..Iπ-helixtrans-77.1-34.6-176-61.5178000112.6F113 F117 A159 K197 L205 P206F113-L201 HydrophobicContact CD1-CB 4.25Å; F113-L201 HydrophobicContact CD1-CD1 4.29Å; F113-L201 HydrophobicContact CE1-CB 4.02Å; F113-L201 HydrophobicContact CE1-CD1 4.01Å; F117-L201 HydrophobicContact CE1-CB 4.38Å; F117-L201 HydrophobicContact CE1-CD2 4.47Å; F117-L201 HydrophobicContact CZ-CD1 4.34Å; F117-L201 HydrophobicContact CZ-CD2 4.49Å; A159-L201 HydrophobicContact CB-CD1 4.32Å; K197-L201 HydrophobicContact CG-CD1 3.89Å; K197-L201 WeakPolarHBondContact O-CB 3.1Å; K197-L201 WeakPolarHBondContact O-CG 3.46Å; K197-L201 PolarHBondContact O-N 3.21Å; L201-L205 HydrophobicContact CD2-CD2 4.28Å; L201-P206 WeakPolarHBondContact O-CD 3.31Å
202G93.3Very high94.6Very high0 Ų047 Ų470%025%0.245CC..Iπ-helixtrans-91.2-19.5-174.700000114.9I198 P206 Y244I198-G202 VanDerWaalsContact O-CA 3.24Å; I198-G202 WeakPolarHBondContact O-CA 3.44Å; I198-G202 PolarHBondContact O-N 3.42Å; G202-P206 WeakPolarHBondContact O-CG 3.35Å; G202-Y244 VanDerWaalsContact O-CE1 3.28Å; G202-Y244 WeakPolarHBondContact O-CE1 3.47Å; G202-Y244 PolarHBondContact O-OH 2.94Å
203L94.6Very high94.5Very high22 Ų2245.6 Ų45.612%0.11524%0.238CC..Iπ-helixtrans-130.1-56.4-177.6-177.364.1000112.7V199 P206 L207 F245 A249 N252V199-L203 WeakPolarHBondContact O-CA 3.21Å; V199-L203 VanDerWaalsContact O-CB 3.28Å; V199-L203 WeakPolarHBondContact O-CB 3.43Å; V199-L203 PolarHBondContact O-N 3.3Å; L203-P206 WeakPolarHBondContact O-CD 3.45Å; L203-P206 WeakPolarHBondContact O-CG 3.28Å; L203-L207 HydrophobicContact CD1-CD1 3.67Å; L203-L207 HydrophobicContact CD1-CG 4.29Å; L203-L207 HydrophobicContact CG-CD1 3.85Å; L203-L207 VanDerWaalsContact O-CB 3.27Å; L203-L207 WeakPolarHBondContact O-CB 3.49Å; L203-L207 WeakPolarHBondContact O-CD1 3.31Å; L203-L207 VanDerWaalsContact O-CG 3.25Å; L203-L207 WeakPolarHBondContact O-CG 3.25Å; L203-L207 PolarHBondContact O-N 2.83Å; L203-F245 HydrophobicContact CD1-CD1 3.78Å; L203-F245 HydrophobicContact CD1-CE1 3.89Å; L203-A249 HydrophobicContact CD1-CB 3.76Å; L203-N252 HydrophobicContact CB-CB 4.22Å; L203-N252 HydrophobicContact CD2-CB 3.95Å
204V96.5Very high94.1Very high77 Ų7742.8 Ų42.847%0.46723%0.225SC..Iπ-helixtrans-67.3-49.4-172.4-179.40000111.8V199 I200 L207 H208V199-V204 HydrophobicContact CG1-CG2 4.25Å; V199-V204 PolarHBondContact O-N 3.07Å; I200-V204 PolarHBondContact O-N 3.1Å; V204-L207 PolarHBondContact O-N 3.08Å; V204-H208 WeakPolarHBondContact O-CB 3.25Å; V204-H208 PolarHBondContact O-N 2.94Å
205L95.9Very high93.9Very high66 Ų6645.5 Ų45.535%0.34625%0.246SC..Hα-helixtrans-58.5-53.8178.9178.867.3000112.5F117 I120 I200 L201 L207 H208 V209F117-L205 HydrophobicContact CE1-CD2 4.31Å; I120-L205 HydrophobicContact CD1-CD2 3.93Å; I120-L205 HydrophobicContact CD1-CG 3.97Å; I200-L205 VanDerWaalsContact O-CB 3.24Å; I200-L205 WeakPolarHBondContact O-CB 3.15Å; I200-L205 PolarHBondContact O-N 3.03Å; L201-L205 HydrophobicContact CD2-CD2 4.28Å; L205-L207 VanDerWaalsContact C-N 3.32Å; L205-L207 PolarHBondContact O-N 3.32Å; L205-H208 PolarHBondContact O-N 3.21Å; L205-V209 WeakPolarHBondContact O-CG2 3.46Å; L205-V209 PolarHBondContact O-N 2.9Å
206P93.8Very high93.5Very high0 Ų045.9 Ų45.90%025%0.251CS..Hα-helixtrans-64.8-33.8178.624.8-34.5000112.7I116 I120 L201 G202 L203 M210 M241 Y244 F245I116-P206 HydrophobicContact CD1-CB 3.57Å; I116-P206 HydrophobicContact CD1-CG 3.81Å; I116-P206 HydrophobicContact CG1-CB 3.99Å; I116-P206 HydrophobicContact CG1-CG 3.83Å; I120-P206 HydrophobicContact CD1-CB 4Å; I120-P206 HydrophobicContact CG1-CB 3.97Å; L201-P206 WeakPolarHBondContact O-CD 3.31Å; G202-P206 WeakPolarHBondContact O-CG 3.35Å; L203-P206 WeakPolarHBondContact O-CD 3.45Å; L203-P206 WeakPolarHBondContact O-CG 3.28Å; P206-M210 VanDerWaalsContact O-CB 3.27Å; P206-M210 WeakPolarHBondContact O-CB 3.31Å; P206-M210 PolarHBondContact O-N 3.13Å; P206-M241 HydrophobicContact CB-SD 4.36Å; P206-Y244 HydrophobicContact CG-CE1 4.47Å; P206-F245 HydrophobicContact CB-CE1 4.24Å; P206-F245 HydrophobicContact CB-CZ 3.82Å; P206-F245 HydrophobicContact CG-CE1 3.99Å; P206-F245 HydrophobicContact CG-CZ 4.08Å
207L94.3Very high93.1Very high72 Ų7242.5 Ų42.538%0.37723%0.233SC..Hα-helixtrans-63.1-45.1173.8-83.3169.1000111.1L203 V204 L205 V209 M210 V211 F245L203-L207 HydrophobicContact CD1-CD1 3.67Å; L203-L207 HydrophobicContact CD1-CG 4.29Å; L203-L207 HydrophobicContact CG-CD1 3.85Å; L203-L207 VanDerWaalsContact O-CB 3.27Å; L203-L207 WeakPolarHBondContact O-CB 3.49Å; L203-L207 WeakPolarHBondContact O-CD1 3.31Å; L203-L207 VanDerWaalsContact O-CG 3.25Å; L203-L207 WeakPolarHBondContact O-CG 3.25Å; L203-L207 PolarHBondContact O-N 2.83Å; V204-L207 PolarHBondContact O-N 3.08Å; L205-L207 VanDerWaalsContact C-N 3.32Å; L205-L207 PolarHBondContact O-N 3.32Å; L207-V209 PolarHBondContact O-N 3.04Å; L207-M210 WeakPolarHBondContact O-CB 3.31Å; L207-M210 PolarHBondContact O-N 2.97Å; L207-V211 WeakPolarHBondContact O-CG2 3.39Å; L207-V211 PolarHBondContact O-N 3.33Å; L207-F245 HydrophobicContact CB-CZ 4.29Å; L207-F245 HydrophobicContact CD1-CE1 4.45Å; L207-F245 HydrophobicContact CD2-CD1 4.37Å; L207-F245 HydrophobicContact CD2-CD2 4.43Å; L207-F245 HydrophobicContact CD2-CE1 3.96Å; L207-F245 HydrophobicContact CD2-CE2 3.98Å; L207-F245 HydrophobicContact CD2-CZ 3.74Å; L207-F245 HydrophobicContact CG-CD1 4.33Å; L207-F245 HydrophobicContact CG-CE1 3.61Å; L207-F245 HydrophobicContact CG-CE2 4.38Å; L207-F245 HydrophobicContact CG-CZ 3.63Å
208H95.8Very high92.5Very high119 Ų11946.3 Ų46.355%0.55125%0.254SS*.Hα-helixtrans-61.6-46.6179.1-167.573.4000111.4V204 L205 M210 V211 I212V204-H208 WeakPolarHBondContact O-CB 3.25Å; V204-H208 PolarHBondContact O-N 2.94Å; L205-H208 PolarHBondContact O-N 3.21Å; H208-M210 VanDerWaalsContact C-N 3.31Å; H208-M210 PolarHBondContact O-N 3.38Å; H208-V211 PolarHBondContact O-N 3.27Å; H208-I212 WeakPolarHBondContact NE2-CD1 3.42Å; H208-I212 WeakPolarHBondContact O-CG1 3.31Å; H208-I212 PolarHBondContact O-N 3.41Å; H208-I212 VanDerWaalsContact O-N 3.17Å
209V94.3Very high92.1Very high19 Ų1953.8 Ų53.812%0.11529%0.286CS..Hα-helixtrans-60.1-42.7173.9173.20000110.9I120 T123 I124 L205 L207 I212 C213I120-V209 HydrophobicContact CG2-CG1 4.24Å; I120-V209 HydrophobicContact CG2-CG2 4.08Å; T123-V209 HydrophobicContact CG2-CG1 4.07Å; I124-V209 HydrophobicContact CG1-CG1 4.14Å; L205-V209 WeakPolarHBondContact O-CG2 3.46Å; L205-V209 PolarHBondContact O-N 2.9Å; L207-V209 PolarHBondContact O-N 3.04Å; V209-I212 PolarHBondContact O-N 3.32Å; V209-C213 VanDerWaalsContact O-CB 3.25Å; V209-C213 WeakPolarHBondContact O-CB 3.35Å; V209-C213 PolarHBondContact O-N 3.02Å; V209-C213 PolarHBondContact O-SG 3.13Å; V209-C213 VanDerWaalsContact O-SG 3.42Å
210M90.1Very high91.4Very high36 Ų3654.7 Ų54.718%0.17729%0.292CS..Hα-helixtrans-58.6-50.8178.5-176.3-175.3-18000111.1P206 L207 H208 I212 C213 Y214 F238 M241 I242 F245P206-M210 VanDerWaalsContact O-CB 3.27Å; P206-M210 WeakPolarHBondContact O-CB 3.31Å; P206-M210 PolarHBondContact O-N 3.13Å; L207-M210 WeakPolarHBondContact O-CB 3.31Å; L207-M210 PolarHBondContact O-N 2.97Å; H208-M210 VanDerWaalsContact C-N 3.31Å; H208-M210 PolarHBondContact O-N 3.38Å; M210-I212 PolarHBondContact O-N 2.81Å; M210-C213 PolarHBondContact O-N 3.36Å; M210-Y214 HydrophobicContact CB-CD2 4.3Å; M210-Y214 HydrophobicContact CG-CD2 3.53Å; M210-Y214 HydrophobicContact CG-CE2 3.94Å; M210-Y214 WeakPolarHBondContact O-CB 3.46Å; M210-Y214 VanDerWaalsContact O-CD2 3.28Å; M210-Y214 WeakPolarHBondContact O-CD2 3.23Å; M210-Y214 PolarHBondContact O-N 3.38Å; M210-F238 HydrophobicContact CE-CD2 4.17Å; M210-F238 HydrophobicContact CE-CE2 3.61Å; M210-F238 HydrophobicContact CE-CZ 4.44Å; M210-M241 HydrophobicContact CG-CG 4.26Å; M210-M241 HydrophobicContact SD-CG 4Å; M210-I242 HydrophobicContact CE-CG1 4.07Å; M210-F245 HydrophobicContact SD-CD2 4.07Å; M210-F245 HydrophobicContact SD-CE2 3.58Å; M210-F245 VanDerWaalsContact SD-CE2 3.58Å
211V92.6Very high90.4Very high101 Ų10151.7 Ų51.761%0.61228%0.276SS*.Hα-helixtrans-59.3-47.2-178.9172.30000111.3L207 H208 S215L207-V211 WeakPolarHBondContact O-CG2 3.39Å; L207-V211 PolarHBondContact O-N 3.33Å; H208-V211 PolarHBondContact O-N 3.27Å; V211-S215 WeakPolarHBondContact O-CB 3.5Å; V211-S215 PolarHBondContact O-N 3.05Å; V211-S215 VanDerWaalsContact O-N 3.15Å; V211-S215 PolarHBondContact O-OG 2.91Å
212I93.3Very high89.6Confident82 Ų8255.9 Ų55.942%0.42130%0.299SS..Hα-helixtrans-66.8-50.2-179.3-65.2171.3000111.2H208 V209 M210 S215 G216H208-I212 WeakPolarHBondContact NE2-CD1 3.42Å; H208-I212 WeakPolarHBondContact O-CG1 3.31Å; H208-I212 PolarHBondContact O-N 3.41Å; H208-I212 VanDerWaalsContact O-N 3.17Å; V209-I212 PolarHBondContact O-N 3.32Å; M210-I212 PolarHBondContact O-N 2.81Å; I212-S215 PolarHBondContact O-OG 3.17Å; I212-G216 PolarHBondContact O-N 3.37Å
213C91Very high88.8Confident8 Ų866.6 Ų66.65%0.05434%0.339CS..Hα-helixtrans-68.5-45.7-174.6-71.50000111.8T123 Y127 V209 M210 G216 I217T123-C213 HydrophobicContact CG2-CB 3.61Å; Y127-C213 VanDerWaalsContact CD2-CA 3.46Å; Y127-C213 HydrophobicContact CD2-CB 3.86Å; Y127-C213 VanDerWaalsContact CD2-O 3.29Å; Y127-C213 WeakPolarHBondContact CD2-O 3.44Å; Y127-C213 HydrophobicContact CG-CB 4.09Å; V209-C213 VanDerWaalsContact O-CB 3.25Å; V209-C213 WeakPolarHBondContact O-CB 3.35Å; V209-C213 PolarHBondContact O-N 3.02Å; V209-C213 PolarHBondContact O-SG 3.13Å; V209-C213 VanDerWaalsContact O-SG 3.42Å; M210-C213 PolarHBondContact O-N 3.36Å; C213-G216 PolarHBondContact O-N 3.01Å; C213-I217 WeakPolarHBondContact O-CB 3.33Å; C213-I217 WeakPolarHBondContact O-CD1 3.21Å; C213-I217 WeakPolarHBondContact O-CG1 3.28Å; C213-I217 PolarHBondContact O-N 3Å
214Y87Confident87.5Confident28 Ų2868.5 Ų68.511%0.1135%0.353CS..Hα-helixtrans-73.7-30.5-176.8-75.7-76.9000113.2T123 M210 I217 L218 V234 I237 F238T123-Y214 HydrophobicContact CG2-CE2 3.92Å; M210-Y214 HydrophobicContact CB-CD2 4.3Å; M210-Y214 HydrophobicContact CG-CD2 3.53Å; M210-Y214 HydrophobicContact CG-CE2 3.94Å; M210-Y214 WeakPolarHBondContact O-CB 3.46Å; M210-Y214 VanDerWaalsContact O-CD2 3.28Å; M210-Y214 WeakPolarHBondContact O-CD2 3.23Å; M210-Y214 PolarHBondContact O-N 3.38Å; Y214-I217 HydrophobicContact CD1-CD1 4.24Å; Y214-I217 HydrophobicContact CE1-CD1 4.34Å; Y214-I217 PolarHBondContact O-N 3.12Å; Y214-L218 VanDerWaalsContact O-CB 3.23Å; Y214-L218 WeakPolarHBondContact O-CB 3.24Å; Y214-L218 PolarHBondContact O-N 3.02Å; Y214-V234 HydrophobicContact CE1-CG1 4.16Å; Y214-I237 VanDerWaalsContact OH-C 3.26Å; Y214-F238 AromaticContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CE2 4.26Å; Y214-F238 HydrophobicContact CD2-CD2 4.24Å; Y214-F238 HydrophobicContact CE1-CB 3.68Å; Y214-F238 AromaticContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CD2 3.43Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CE2 4.41Å; Y214-F238 AromaticContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE2-CD2 4.01Å; Y214-F238 HydrophobicContact CG-CD2 4.11Å; Y214-F238 HydrophobicContact CG-CE2 4.39Å; Y214-F238 AromaticContact CZ-CD2 3.61Å; Y214-F238 WeakPolarHBondContact OH-CA 3.41Å; Y214-F238 PolarHBondContact OH-N 2.8Å
215S88.3Confident85.9Confident71 Ų7175.4 Ų75.450%0.49737%0.371SS..Hα-helixtrans-62.4-45.517259.10000111.6V211 I212 L218 K219V211-S215 WeakPolarHBondContact O-CB 3.5Å; V211-S215 PolarHBondContact O-N 3.05Å; V211-S215 VanDerWaalsContact O-N 3.15Å; V211-S215 PolarHBondContact O-OG 2.91Å; I212-S215 PolarHBondContact O-OG 3.17Å; S215-L218 PolarHBondContact O-N 2.96Å; S215-K219 WeakPolarHBondContact O-CB 3.17Å; S215-K219 PolarHBondContact O-N 2.92Å
216G87.1Confident84Confident14 Ų1479.2 Ų79.214%0.14439%0.392CS..Hα-helixtrans-67.4-39.217600000113.6I212 C213 T220I212-G216 PolarHBondContact O-N 3.37Å; C213-G216 PolarHBondContact O-N 3.01Å; G216-T220 WeakPolarHBondContact O-CB 3.46Å; G216-T220 PolarHBondContact O-N 3.4Å; G216-T220 VanDerWaalsContact O-N 3.09Å; G216-T220 PolarHBondContact O-OG1 3.46Å
217I85.7Confident82.6Confident3 Ų384.7 Ų84.72%0.01542%0.417CS..Hα-helixtrans-61.1-49.5173.5-71.1164.1000110.1Y127 V130 V131 C213 Y214 K219 T220 L221 V234Y127-I217 HydrophobicContact CD2-CG1 4.15Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG2 4.31Å; V131-I217 HydrophobicContact CG2-CG1 4.29Å; C213-I217 WeakPolarHBondContact O-CB 3.33Å; C213-I217 WeakPolarHBondContact O-CD1 3.21Å; C213-I217 WeakPolarHBondContact O-CG1 3.28Å; C213-I217 PolarHBondContact O-N 3Å; Y214-I217 HydrophobicContact CD1-CD1 4.24Å; Y214-I217 HydrophobicContact CE1-CD1 4.34Å; Y214-I217 PolarHBondContact O-N 3.12Å; I217-K219 PolarHBondContact O-N 2.88Å; I217-T220 PolarHBondContact O-N 2.83Å; I217-T220 VanDerWaalsContact O-N 3.16Å; I217-L221 HydrophobicContact CG2-CD1 3.65Å; I217-L221 HydrophobicContact CG2-CG 4.04Å; I217-L221 WeakPolarHBondContact O-CB 3.29Å; I217-L221 VanDerWaalsContact O-CG 3.28Å; I217-L221 WeakPolarHBondContact O-CG 3.42Å; I217-L221 PolarHBondContact O-N 2.75Å; I217-V234 HydrophobicContact CG2-CG1 3.77Å; I217-V234 HydrophobicContact CG2-CG2 3.98Å
218L84.4Confident81.2Confident102 Ų10289.3 Ų89.353%0.53443%0.434SS..Hα-helixtrans-61.4-45.6-178.3-17462.4000111.3Y214 S215 T220 L221 L222Y214-L218 VanDerWaalsContact O-CB 3.23Å; Y214-L218 WeakPolarHBondContact O-CB 3.24Å; Y214-L218 PolarHBondContact O-N 3.02Å; S215-L218 PolarHBondContact O-N 2.96Å; L218-T220 VanDerWaalsContact C-N 3.26Å; L218-T220 PolarHBondContact O-N 3.31Å; L218-L221 PolarHBondContact O-N 2.88Å; L218-L222 HydrophobicContact CD1-CD1 4.45Å; L218-L222 HydrophobicContact CD1-CG 4.37Å; L218-L222 HydrophobicContact CG-CD1 4.09Å; L218-L222 HydrophobicContact CG-CG 4.45Å; L218-L222 WeakPolarHBondContact O-CB 3.35Å; L218-L222 VanDerWaalsContact O-CG 3.27Å; L218-L222 WeakPolarHBondContact O-CG 3.48Å; L218-L222 PolarHBondContact O-N 2.92Å
219K86.3Confident79.5Confident166 Ų16691 Ų9172%0.72244%0.44SS*.Hα-helixtrans-55.6-41.8174.9-173.2176.7-177.7176.40112.1S215 I217 R223S215-K219 WeakPolarHBondContact O-CB 3.17Å; S215-K219 PolarHBondContact O-N 2.92Å; I217-K219 PolarHBondContact O-N 2.88Å; K219-R223 PolarHBondContact O-N 3.4Å
220T81Confident78.2Confident32 Ų3292.8 Ų92.820%0.19645%0.445CS..Hα-helixtrans-74.7-36.6-179.2-540000112.3V130 G216 I217 L218 R223 C224V130-T220 HydrophobicContact CG1-CG2 4.16Å; G216-T220 WeakPolarHBondContact O-CB 3.46Å; G216-T220 PolarHBondContact O-N 3.4Å; G216-T220 VanDerWaalsContact O-N 3.09Å; G216-T220 PolarHBondContact O-OG1 3.46Å; I217-T220 PolarHBondContact O-N 2.83Å; I217-T220 VanDerWaalsContact O-N 3.16Å; L218-T220 VanDerWaalsContact C-N 3.26Å; L218-T220 PolarHBondContact O-N 3.31Å; T220-R223 PolarHBondContact O-N 3.15Å; T220-C224 PolarHBondContact O-N 3.49Å; T220-C224 VanDerWaalsContact O-N 3.11Å
221L77.1Confident77.2Confident23 Ų2394.9 Ų94.912%0.1245%0.454CS..Hα-helixtrans-67.9-39.9176-72.1-179.9000111.9I217 L218 R223 C224 R230 V234I217-L221 HydrophobicContact CG2-CD1 3.65Å; I217-L221 HydrophobicContact CG2-CG 4.04Å; I217-L221 WeakPolarHBondContact O-CB 3.29Å; I217-L221 VanDerWaalsContact O-CG 3.28Å; I217-L221 WeakPolarHBondContact O-CG 3.42Å; I217-L221 PolarHBondContact O-N 2.75Å; L218-L221 PolarHBondContact O-N 2.88Å; L221-R223 VanDerWaalsContact C-N 3.29Å; L221-R223 PolarHBondContact O-N 3.36Å; L221-C224 CarbonylContact O-C 3.07Å; L221-C224 PolarHBondContact O-N 3.38Å; L221-R230 HydrophobicContact CD2-CG 4.29Å; L221-R230 VanDerWaalsContact CD2-NE 3.33Å; L221-V234 HydrophobicContact CD1-CG1 4.47Å
222L78.6Confident76.2Confident133 Ų13396 Ų9670%0.69645%0.447SS*.Hα-helixtrans-64.2-35175.5-70171.5000112L218L218-L222 HydrophobicContact CD1-CD1 4.45Å; L218-L222 HydrophobicContact CD1-CG 4.37Å; L218-L222 HydrophobicContact CG-CD1 4.09Å; L218-L222 HydrophobicContact CG-CG 4.45Å; L218-L222 WeakPolarHBondContact O-CB 3.35Å; L218-L222 VanDerWaalsContact O-CG 3.27Å; L218-L222 WeakPolarHBondContact O-CG 3.48Å; L218-L222 PolarHBondContact O-N 2.92Å
223R77.8Confident75.1Confident224 Ų22493.7 Ų93.785%0.84544%0.441SS*.Hα-helixtrans-76.9-27.8178.6-165.5173.6-178.3-176.71.1113.7K219 T220 L221K219-R223 PolarHBondContact O-N 3.4Å; T220-R223 PolarHBondContact O-N 3.15Å; L221-R223 VanDerWaalsContact C-N 3.29Å; L221-R223 PolarHBondContact O-N 3.36Å
224C66.1Low74.4Confident62 Ų6294 Ų9442%0.41944%0.442SS..  trans-125.390.6-174.2-65.50000110.8T220 L221 N226 R230T220-C224 PolarHBondContact O-N 3.49Å; T220-C224 VanDerWaalsContact O-N 3.11Å; L221-C224 CarbonylContact O-C 3.07Å; L221-C224 PolarHBondContact O-N 3.38Å; C224-N226 PolarHBondContact O-N 2.9Å; C224-R230 PolarHBondContact O-NH2 3.23Å
225R62.9Low74.2Confident222 Ų22298.6 Ų98.684%0.83846%0.459SS*.THydrogen-bonded Turntrans-76.4-7.5-168.6-169.2164.7130.8165.5-3.5116.2
226N56.3Low73.8Confident146 Ų14696.7 Ų96.778%0.78144%0.443SS*.THydrogen-bonded Turntrans-1056.3-158.6-71.8-7.6000118.1C224C224-N226 PolarHBondContact O-N 2.9Å
227E65.6Low73.5Confident115 Ų11596.3 Ų96.354%0.53744%0.438SS..  trans-117.382.1-172.6-75.9-66.2161.800114.4K229 R230 H231E227-K229 PolarHBondContact O-N 3.21Å; E227-K229 VanDerWaalsContact O-N 3.1Å; E227-R230 HydrophobicContact CB-CB 4.08Å; E227-R230 WeakPolarHBondContact O-CB 3.37Å; E227-R230 PolarHBondContact O-N 3.23Å; E227-H231 PolarHBondContact O-CD2 3.46Å
228K64.1Low73.5Confident170 Ų170100.1 Ų100.174%0.73946%0.455SS*.Hα-helixtrans-52-34179.5-70.1-178.5-179.2176.30113.7
229K60.7Low73.7Confident154 Ų15497 Ų9767%0.6744%0.44SS*.Hα-helixtrans-69.3-32.2-178.8-166.4176.6-178.4179.40112.6E227E227-K229 PolarHBondContact O-N 3.21Å; E227-K229 VanDerWaalsContact O-N 3.1Å
230R66.6Low73.8Confident57 Ų5789.2 Ų89.222%0.21541%0.406CS..Hα-helixtrans-69.5-41.5178.5-170.2172.763.2172.6-0.8111.4V130 L221 C224 E227 R232 A233 V234V130-R230 HydrophobicContact CG2-CG 3.85Å; L221-R230 HydrophobicContact CD2-CG 4.29Å; L221-R230 VanDerWaalsContact CD2-NE 3.33Å; C224-R230 PolarHBondContact O-NH2 3.23Å; E227-R230 HydrophobicContact CB-CB 4.08Å; E227-R230 WeakPolarHBondContact O-CB 3.37Å; E227-R230 PolarHBondContact O-N 3.23Å; R230-R232 VanDerWaalsContact C-N 3.31Å; R230-R232 PolarHBondContact O-N 2.85Å; R230-A233 PolarHBondContact O-N 2.96Å; R230-V234 WeakPolarHBondContact O-CG2 3.45Å; R230-V234 PolarHBondContact O-N 3.29Å
231H69.9Low74.1Confident79 Ų7987.7 Ų87.737%0.36640%0.397SS..Hα-helixtrans-60.3-37.5176.8-67.5-80.6000112.9E227 R235E227-H231 PolarHBondContact O-CD2 3.46Å; H231-R235 WeakPolarHBondContact O-CB 3.45Å; H231-R235 PolarHBondContact O-N 2.61Å
232R71.8Confident74.9Confident124 Ų12489.4 Ų89.447%0.46841%0.406SS..Hα-helixtrans-65.6-43.5-178.8-66.7-178.7-171.51743112.9R230 R235 L236 E302R230-R232 VanDerWaalsContact C-N 3.31Å; R230-R232 PolarHBondContact O-N 2.85Å; R232-R235 PolarHBondContact O-N 3.11Å; R232-L236 PolarHBondContact O-N 2.87Å; R232-L236 VanDerWaalsContact O-N 3.13Å; R232-E302 WeakPolarHBondContact CD-OE2 3.25Å; R232-E302 IonicContact CZ-OE1 3.31Å; R232-E302 IonicContact CZ-OE2 2.61Å; R232-E302 VanDerWaalsContact CZ-OE2 3.31Å; R232-E302 IonicContact NE-OE1 3.26Å; R232-E302 IonicContact NE-OE2 3.17Å; R232-E302 IonicContact NH1-OE1 2.66Å; R232-E302 IonicContact NH1-OE2 3.12Å; R232-E302 PolarHBondContact NH1-OE2 2.9Å
233A68.9Low75.6Confident35 Ų3584.1 Ų84.129%0.28938%0.379SS..Hα-helixtrans-69.7-38.2179.700000112R230 L236 I237R230-A233 PolarHBondContact O-N 2.96Å; A233-L236 PolarHBondContact O-N 2.93Å; A233-I237 PolarHBondContact O-N 3.4Å
234V77.1Confident76.4Confident14 Ų1473.7 Ų73.79%0.08534%0.339CS..Hα-helixtrans-62.6-44173.2172.90000110.5V130 Y214 I217 L221 R230 L236 I237 F238V130-V234 HydrophobicContact CG2-CG2 4.04Å; Y214-V234 HydrophobicContact CE1-CG1 4.16Å; I217-V234 HydrophobicContact CG2-CG1 3.77Å; I217-V234 HydrophobicContact CG2-CG2 3.98Å; L221-V234 HydrophobicContact CD1-CG1 4.47Å; R230-V234 WeakPolarHBondContact O-CG2 3.45Å; R230-V234 PolarHBondContact O-N 3.29Å; V234-L236 VanDerWaalsContact C-N 3.35Å; V234-L236 PolarHBondContact O-N 2.98Å; V234-I237 PolarHBondContact O-N 3.47Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.29Å; V234-F238 PolarHBondContact O-N 3.47Å
235R81.6Confident77.7Confident125 Ų12571.8 Ų71.847%0.47232%0.324SS..Hα-helixtrans-57.6-45.4177.4-172.3177.370.2-173.52.7112H231 R232 F238 T239H231-R235 WeakPolarHBondContact O-CB 3.45Å; H231-R235 PolarHBondContact O-N 2.61Å; R232-R235 PolarHBondContact O-N 3.11Å; R235-F238 PolarHBondContact O-N 3.12Å; R235-T239 PolarHBondContact O-N 3.31Å; R235-T239 PolarHBondContact O-OG1 3.37Å
236L80.6Confident79.3Confident30 Ų3066.5 Ų66.516%0.15731%0.312CS..Hα-helixtrans-59.2-52.9179.2179.264.7000112.1R232 A233 V234 F238 T239 I240 I296 Y297 V300R232-L236 PolarHBondContact O-N 2.87Å; R232-L236 VanDerWaalsContact O-N 3.13Å; A233-L236 PolarHBondContact O-N 2.93Å; V234-L236 VanDerWaalsContact C-N 3.35Å; V234-L236 PolarHBondContact O-N 2.98Å; L236-F238 VanDerWaalsContact C-N 3.31Å; L236-F238 PolarHBondContact O-N 2.99Å; L236-T239 PolarHBondContact O-N 3.49Å; L236-I240 HydrophobicContact CD1-CD1 4.38Å; L236-I240 HydrophobicContact CG-CD1 4.16Å; L236-I240 WeakPolarHBondContact O-CG1 3.31Å; L236-I240 PolarHBondContact O-N 3.27Å; L236-I296 HydrophobicContact CD1-CG2 3.89Å; L236-Y297 HydrophobicContact CD1-CD1 4.23Å; L236-V300 HydrophobicContact CB-CG1 4.33Å; L236-V300 HydrophobicContact CD1-CB 3.85Å; L236-V300 HydrophobicContact CD1-CG1 3.86Å
237I80.8Confident81.1Confident7 Ų761.4 Ų61.44%0.03628%0.283CS..Hα-helixtrans-68-34.4-177.3-58.2-49000111.3L122 R126 Y214 A233 V234 I240 M241L122-I237 HydrophobicContact CB-CD1 4.31Å; L122-I237 HydrophobicContact CB-CG2 4.36Å; L122-I237 HydrophobicContact CD2-CD1 4.43Å; R126-I237 HydrophobicContact CG-CB 4.04Å; R126-I237 HydrophobicContact CG-CG1 3.47Å; R126-I237 VanDerWaalsContact CG-CG1 3.47Å; R126-I237 HydrophobicContact CG-CG2 4.28Å; Y214-I237 VanDerWaalsContact OH-C 3.26Å; A233-I237 PolarHBondContact O-N 3.4Å; V234-I237 PolarHBondContact O-N 3.47Å; I237-I240 HydrophobicContact CD1-CD1 3.9Å; I237-I240 PolarHBondContact O-N 2.79Å; I237-M241 PolarHBondContact O-N 2.65Å
238F85.5Confident82.6Confident82 Ų8256.4 Ų56.436%0.3626%0.259SS..Hα-helixtrans-62.8-43.1173.8-174.4-113.3000112.2M210 Y214 V234 R235 L236 M241 I242M210-F238 HydrophobicContact CE-CD2 4.17Å; M210-F238 HydrophobicContact CE-CE2 3.61Å; M210-F238 HydrophobicContact CE-CZ 4.44Å; Y214-F238 AromaticContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CE2 4.26Å; Y214-F238 HydrophobicContact CD2-CD2 4.24Å; Y214-F238 HydrophobicContact CE1-CB 3.68Å; Y214-F238 AromaticContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CD2 3.43Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CE2 4.41Å; Y214-F238 AromaticContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE1-CG 3.96Å; Y214-F238 HydrophobicContact CE2-CD2 4.01Å; Y214-F238 HydrophobicContact CG-CD2 4.11Å; Y214-F238 HydrophobicContact CG-CE2 4.39Å; Y214-F238 AromaticContact CZ-CD2 3.61Å; Y214-F238 WeakPolarHBondContact OH-CA 3.41Å; Y214-F238 PolarHBondContact OH-N 2.8Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.29Å; V234-F238 PolarHBondContact O-N 3.47Å; R235-F238 PolarHBondContact O-N 3.12Å; L236-F238 VanDerWaalsContact C-N 3.31Å; L236-F238 PolarHBondContact O-N 2.99Å; F238-M241 PolarHBondContact O-N 2.99Å; F238-I242 HydrophobicContact CD1-CD1 3.65Å; F238-I242 HydrophobicContact CD2-CD1 4.26Å; F238-I242 HydrophobicContact CE1-CD1 3.19Å; F238-I242 HydrophobicContact CE1-CG1 4.41Å; F238-I242 HydrophobicContact CE2-CD1 3.89Å; F238-I242 HydrophobicContact CE2-CG1 4.41Å; F238-I242 HydrophobicContact CG-CD1 4.18Å; F238-I242 HydrophobicContact CZ-CD1 3.35Å; F238-I242 HydrophobicContact CZ-CG1 4.32Å; F238-I242 WeakPolarHBondContact O-CG1 3.26Å; F238-I242 PolarHBondContact O-N 2.86Å
239T88.8Confident84Confident38 Ų3849.1 Ų49.123%0.23323%0.23CC..Hα-helixtrans-61.8-45.6175-58.90000111.6R235 L236 M241 I242 V243 I296 V300R235-T239 PolarHBondContact O-N 3.31Å; R235-T239 PolarHBondContact O-OG1 3.37Å; L236-T239 PolarHBondContact O-N 3.49Å; T239-M241 VanDerWaalsContact C-N 3.31Å; T239-M241 PolarHBondContact O-N 3.32Å; T239-I242 PolarHBondContact O-N 3.4Å; T239-V243 HydrophobicContact CG2-CG2 4.19Å; T239-V243 WeakPolarHBondContact O-CB 2.97Å; T239-V243 VanDerWaalsContact O-CG2 3.26Å; T239-V243 WeakPolarHBondContact O-CG2 3.34Å; T239-V243 PolarHBondContact O-N 3.39Å; T239-I296 HydrophobicContact CG2-CG2 4.07Å; T239-V300 HydrophobicContact CG2-CG2 4.25Å
240I88.1Confident85.7Confident2 Ų243.8 Ų43.81%0.0121%0.212CC..Hα-helixtrans-57.7-46.1177.7-64164.9000110.6I119 L236 I237 V243 Y244 I296 Y297I119-I240 HydrophobicContact CD1-CG2 4.16Å; I119-I240 HydrophobicContact CG1-CG2 4.07Å; L236-I240 HydrophobicContact CD1-CD1 4.38Å; L236-I240 HydrophobicContact CG-CD1 4.16Å; L236-I240 WeakPolarHBondContact O-CG1 3.31Å; L236-I240 PolarHBondContact O-N 3.27Å; I237-I240 HydrophobicContact CD1-CD1 3.9Å; I237-I240 PolarHBondContact O-N 2.79Å; I240-V243 PolarHBondContact O-N 2.81Å; I240-Y244 PolarHBondContact O-N 3.14Å; I240-I296 HydrophobicContact CG1-CD1 4.32Å; I240-I296 HydrophobicContact CG1-CG2 3.87Å; I240-Y297 HydrophobicContact CD1-CD1 4.49Å; I240-Y297 HydrophobicContact CD1-CE1 3.61Å; I240-Y297 HydrophobicContact CG1-CE1 4.43Å
241M88.1Confident87.1Confident0 Ų042.2 Ų42.20%021%0.206CC..Hα-helixtrans-64.8-44.6-179.4-172.467.777.100112.6I119 T123 P206 M210 I237 F238 T239 Y244 F245I119-M241 HydrophobicContact CG2-CE 3.4Å; I119-M241 VanDerWaalsContact CG2-CE 3.4Å; I119-M241 HydrophobicContact CG2-SD 3.62Å; T123-M241 HydrophobicContact CG2-CE 4.41Å; T123-M241 WeakPolarHBondContact OG1-CE 3.35Å; P206-M241 HydrophobicContact CB-SD 4.36Å; M210-M241 HydrophobicContact CG-CG 4.26Å; M210-M241 HydrophobicContact SD-CG 4Å; I237-M241 PolarHBondContact O-N 2.65Å; F238-M241 PolarHBondContact O-N 2.99Å; T239-M241 VanDerWaalsContact C-N 3.31Å; T239-M241 PolarHBondContact O-N 3.32Å; M241-Y244 WeakPolarHBondContact O-CB 3.18Å; M241-Y244 PolarHBondContact O-N 3.46Å; M241-F245 HydrophobicContact CG-CD2 4.13Å; M241-F245 HydrophobicContact CG-CE2 3.6Å; M241-F245 WeakPolarHBondContact O-CD2 3.45Å; M241-F245 PolarHBondContact O-N 3.46Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CE2 3.7Å; M241-F245 HydrophobicContact SD-CZ 4.07Å
242I92.3Very high88.3Confident59 Ų5938.5 Ų38.530%0.30319%0.189SC..Hα-helixtrans-63.9-45.1177.7-71.1171.8000110.8M210 F238 T239 Y244 F245 L246M210-I242 HydrophobicContact CE-CG1 4.07Å; F238-I242 HydrophobicContact CD1-CD1 3.65Å; F238-I242 HydrophobicContact CD2-CD1 4.26Å; F238-I242 HydrophobicContact CE1-CD1 3.19Å; F238-I242 HydrophobicContact CE1-CG1 4.41Å; F238-I242 HydrophobicContact CE2-CD1 3.89Å; F238-I242 HydrophobicContact CE2-CG1 4.41Å; F238-I242 HydrophobicContact CG-CD1 4.18Å; F238-I242 HydrophobicContact CZ-CD1 3.35Å; F238-I242 HydrophobicContact CZ-CG1 4.32Å; F238-I242 WeakPolarHBondContact O-CG1 3.26Å; F238-I242 PolarHBondContact O-N 2.86Å; T239-I242 PolarHBondContact O-N 3.4Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.36Å; I242-F245 PolarHBondContact O-N 3.25Å; I242-F245 VanDerWaalsContact O-N 3.11Å; I242-L246 HydrophobicContact CG2-CD1 3.91Å; I242-L246 HydrophobicContact CG2-CG 4.15Å; I242-L246 WeakPolarHBondContact O-CG 3.48Å; I242-L246 PolarHBondContact O-N 3.34Å
243V94.5Very high89.4Confident22 Ų2236.8 Ų36.813%0.13319%0.188CC..Hα-helixtrans-61.8-39.6179.4172.50000110.7T239 I240 F245 L246 F247 I292 I296T239-V243 HydrophobicContact CG2-CG2 4.19Å; T239-V243 WeakPolarHBondContact O-CB 2.97Å; T239-V243 VanDerWaalsContact O-CG2 3.26Å; T239-V243 WeakPolarHBondContact O-CG2 3.34Å; T239-V243 PolarHBondContact O-N 3.39Å; I240-V243 PolarHBondContact O-N 2.81Å; V243-F245 VanDerWaalsContact C-N 3.35Å; V243-F245 PolarHBondContact O-N 3.27Å; V243-L246 PolarHBondContact O-N 3.29Å; V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.84Å; V243-F247 WeakPolarHBondContact O-CD2 3.33Å; V243-F247 PolarHBondContact O-N 3.17Å; V243-F247 VanDerWaalsContact O-N 3.13Å; V243-I292 HydrophobicContact CG1-CB 4.5Å; V243-I292 HydrophobicContact CG1-CG2 3.71Å; V243-I296 HydrophobicContact CB-CD1 3.94Å; V243-I296 HydrophobicContact CG1-CD1 3.97Å; V243-I296 HydrophobicContact CG2-CD1 4.01Å
244Y93.2Very high90.6Very high4 Ų435.9 Ų35.92%0.01618%0.179CC..Hα-helixtrans-55-49.3171.8173.3-90.7000111.9I116 I119 G202 P206 I240 M241 I242 L246 F247 W248 H289I116-Y244 HydrophobicContact CB-CE2 4.07Å; I116-Y244 HydrophobicContact CD1-CD1 3.7Å; I116-Y244 HydrophobicContact CD1-CD2 4.17Å; I116-Y244 HydrophobicContact CD1-CE1 3.33Å; I116-Y244 HydrophobicContact CD1-CE2 3.83Å; I116-Y244 HydrophobicContact CD1-CG 4.12Å; I116-Y244 HydrophobicContact CG1-CE1 3.99Å; I116-Y244 HydrophobicContact CG1-CE2 4.25Å; I119-Y244 HydrophobicContact CD1-CD2 3.97Å; I119-Y244 HydrophobicContact CD1-CG 4.26Å; G202-Y244 VanDerWaalsContact O-CE1 3.28Å; G202-Y244 WeakPolarHBondContact O-CE1 3.47Å; G202-Y244 PolarHBondContact O-OH 2.94Å; P206-Y244 HydrophobicContact CG-CE1 4.47Å; I240-Y244 PolarHBondContact O-N 3.14Å; M241-Y244 WeakPolarHBondContact O-CB 3.18Å; M241-Y244 PolarHBondContact O-N 3.46Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 3.36Å; Y244-L246 PolarHBondContact O-N 3.08Å; Y244-F247 PolarHBondContact O-N 3.1Å; Y244-W248 AromaticContact CD2-CD1 3.48Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.48Å; Y244-W248 HydrophobicContact CD2-CG 4.27Å; Y244-W248 HydrophobicContact CE1-CB 4.27Å; Y244-W248 HydrophobicContact CE2-CB 4.13Å; Y244-W248 AromaticContact CE2-CD1 3.35Å; Y244-W248 AromaticContact CE2-CG 3.81Å; Y244-W248 HydrophobicContact CE2-CG 3.81Å; Y244-W248 AromaticContact CE2-NE1 3.99Å; Y244-W248 WeakPolarHBondContact O-CB 3.46Å; Y244-W248 PolarHBondContact O-N 2.98Å; Y244-H289 AromaticContact CD2-CE1 3.88Å; Y244-H289 AromaticContact CD2-NE2 3.95Å
245F94.4Very high91.4Very high22 Ų2236 Ų3610%0.09618%0.179CC..Hα-helixtrans-65-38.7178.8-71.1-56.6000113.3L203 P206 L207 M210 M241 I242 V243 F247 A249L203-F245 HydrophobicContact CD1-CD1 3.78Å; L203-F245 HydrophobicContact CD1-CE1 3.89Å; P206-F245 HydrophobicContact CB-CE1 4.24Å; P206-F245 HydrophobicContact CB-CZ 3.82Å; P206-F245 HydrophobicContact CG-CE1 3.99Å; P206-F245 HydrophobicContact CG-CZ 4.08Å; L207-F245 HydrophobicContact CB-CZ 4.29Å; L207-F245 HydrophobicContact CD1-CE1 4.45Å; L207-F245 HydrophobicContact CD2-CD1 4.37Å; L207-F245 HydrophobicContact CD2-CD2 4.43Å; L207-F245 HydrophobicContact CD2-CE1 3.96Å; L207-F245 HydrophobicContact CD2-CE2 3.98Å; L207-F245 HydrophobicContact CD2-CZ 3.74Å; L207-F245 HydrophobicContact CG-CD1 4.33Å; L207-F245 HydrophobicContact CG-CE1 3.61Å; L207-F245 HydrophobicContact CG-CE2 4.38Å; L207-F245 HydrophobicContact CG-CZ 3.63Å; M210-F245 HydrophobicContact SD-CD2 4.07Å; M210-F245 HydrophobicContact SD-CE2 3.58Å; M210-F245 VanDerWaalsContact SD-CE2 3.58Å; M241-F245 HydrophobicContact CG-CD2 4.13Å; M241-F245 HydrophobicContact CG-CE2 3.6Å; M241-F245 WeakPolarHBondContact O-CD2 3.45Å; M241-F245 PolarHBondContact O-N 3.46Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CE2 3.7Å; M241-F245 HydrophobicContact SD-CZ 4.07Å; I242-F245 PolarHBondContact O-N 3.25Å; I242-F245 VanDerWaalsContact O-N 3.11Å; V243-F245 VanDerWaalsContact C-N 3.35Å; V243-F245 PolarHBondContact O-N 3.27Å; F245-F247 PolarHBondContact O-N 3.11Å; F245-A249 WeakPolarHBondContact O-CA 3.43Å; F245-A249 WeakPolarHBondContact O-CB 3.23Å; F245-A249 PolarHBondContact O-N 2.92Å
246L95.8Very high92Very high111 Ų11132.7 Ų32.758%0.58117%0.17SC*.Hα-helixtrans-60.2-34.2177.1-70.9174.2000112.2I242 V243 Y244 P250I242-L246 HydrophobicContact CG2-CD1 3.91Å; I242-L246 HydrophobicContact CG2-CG 4.15Å; I242-L246 WeakPolarHBondContact O-CG 3.48Å; I242-L246 PolarHBondContact O-N 3.34Å; V243-L246 PolarHBondContact O-N 3.29Å; Y244-L246 PolarHBondContact O-N 3.08Å; L246-P250 WeakPolarHBondContact O-CG 3.34Å
247F95.5Very high92.5Very high39 Ų3933.6 Ų33.617%0.17118%0.175CC..Hα-helixtrans-90.4-39.3-177-78-116000112.5V243 Y244 F245 L285 T288 H289 I292V243-F247 HydrophobicContact CG1-CD2 3.87Å; V243-F247 HydrophobicContact CG1-CE2 3.84Å; V243-F247 WeakPolarHBondContact O-CD2 3.33Å; V243-F247 PolarHBondContact O-N 3.17Å; V243-F247 VanDerWaalsContact O-N 3.13Å; Y244-F247 PolarHBondContact O-N 3.1Å; F245-F247 PolarHBondContact O-N 3.11Å; F247-L285 HydrophobicContact CD1-CD1 3.93Å; F247-L285 HydrophobicContact CD1-CG 4.23Å; F247-L285 VanDerWaalsContact CD1-O 3.31Å; F247-L285 WeakPolarHBondContact CD1-O 3.41Å; F247-L285 HydrophobicContact CE1-CD1 4.02Å; F247-L285 HydrophobicContact CG-CD1 4.43Å; F247-L285 HydrophobicContact CG-CG 4.47Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.25Å; F247-T288 VanDerWaalsContact CE1-OG1 3.25Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.33Å; F247-H289 HydrophobicContact CB-CB 3.95Å; F247-H289 HydrophobicContact CD1-CB 3.97Å; F247-H289 HydrophobicContact CG-CB 4.19Å; F247-I292 HydrophobicContact CE1-CD1 4.24Å; F247-I292 HydrophobicContact CE1-CG1 3.82Å; F247-I292 HydrophobicContact CZ-CD1 4.16Å; F247-I292 HydrophobicContact CZ-CG1 3.89Å
248W95.7Very high92.9Very high10 Ų1034.6 Ų34.64%0.03818%0.18CC..Hα-helixtrans-101.1-27.7-172.6-76.2104.2000115.1F79 F112 Y244 P250 Y251 N252 G286 H289F79-W248 HydrophobicContact CE2-CH2 4.09Å; F79-W248 HydrophobicContact CE2-CZ2 4.19Å; F79-W248 AromaticContact CZ-CH2 3.98Å; F79-W248 HydrophobicContact CZ-CH2 3.98Å; F79-W248 HydrophobicContact CZ-CZ2 4.05Å; F112-W248 HydrophobicContact CD2-CD2 4.2Å; F112-W248 HydrophobicContact CD2-CE3 4.05Å; F112-W248 AromaticContact CD2-CH2 3.59Å; F112-W248 HydrophobicContact CD2-CH2 3.59Å; F112-W248 AromaticContact CD2-CZ2 3.77Å; F112-W248 HydrophobicContact CD2-CZ2 3.77Å; F112-W248 AromaticContact CD2-CZ3 3.75Å; F112-W248 HydrophobicContact CD2-CZ3 3.75Å; F112-W248 AromaticContact CE2-CD2 3.71Å; F112-W248 HydrophobicContact CE2-CD2 3.71Å; F112-W248 AromaticContact CE2-CE3 3.48Å; F112-W248 HydrophobicContact CE2-CE3 3.48Å; F112-W248 VanDerWaalsContact CE2-CE3 3.48Å; F112-W248 HydrophobicContact CE2-CG 4.42Å; F112-W248 AromaticContact CE2-CH2 3.92Å; F112-W248 HydrophobicContact CE2-CH2 3.92Å; F112-W248 HydrophobicContact CE2-CZ2 4.15Å; F112-W248 AromaticContact CE2-CZ3 3.59Å; F112-W248 HydrophobicContact CE2-CZ3 3.59Å; F112-W248 HydrophobicContact CZ-CE3 4.48Å; Y244-W248 AromaticContact CD2-CD1 3.48Å; Y244-W248 VanDerWaalsContact CD2-CD1 3.48Å; Y244-W248 HydrophobicContact CD2-CG 4.27Å; Y244-W248 HydrophobicContact CE1-CB 4.27Å; Y244-W248 HydrophobicContact CE2-CB 4.13Å; Y244-W248 AromaticContact CE2-CD1 3.35Å; Y244-W248 AromaticContact CE2-CG 3.81Å; Y244-W248 HydrophobicContact CE2-CG 3.81Å; Y244-W248 AromaticContact CE2-NE1 3.99Å; Y244-W248 WeakPolarHBondContact O-CB 3.46Å; Y244-W248 PolarHBondContact O-N 2.98Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; W248-Y251 HydrophobicContact CE3-CD1 4.1Å; W248-Y251 HydrophobicContact CZ3-CD1 4.1Å; W248-Y251 PolarHBondContact O-N 2.88Å; W248-N252 PolarHBondContact O-N 2.88Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 2.9Å; W248-G286 VanDerWaalsContact CZ2-O 3.25Å; W248-G286 WeakPolarHBondContact CZ2-O 3.34Å; W248-H289 AromaticContact CD1-CG 3.87Å; W248-H289 AromaticContact NE1-CG 3.53Å; W248-H289 AromaticContact NE1-ND1 3.56Å
249A94.8Very high93.1Very high17 Ų1731 Ų3114%0.1417%0.165CC..Hα-helixtrans-60.8-40.2178.900000112.9L203 F245 Y251 N252 I253L203-A249 HydrophobicContact CD1-CB 3.76Å; F245-A249 WeakPolarHBondContact O-CA 3.43Å; F245-A249 WeakPolarHBondContact O-CB 3.23Å; F245-A249 PolarHBondContact O-N 2.92Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 3.01Å; A249-N252 PolarHBondContact O-N 3.33Å; A249-I253 WeakPolarHBondContact O-CD1 3.5Å; A249-I253 VanDerWaalsContact O-CG1 3.25Å; A249-I253 WeakPolarHBondContact O-CG1 3.44Å; A249-I253 PolarHBondContact O-N 2.91Å
250P96.6Very high93.1Very high42 Ų4231.7 Ų31.727%0.27317%0.165SC..Hα-helixtrans-55.4-45.7175.9-26.936.2000112.5L246 W248 I253 V254 T282 L285L246-P250 WeakPolarHBondContact O-CG 3.34Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; P250-I253 PolarHBondContact O-N 3.5Å; P250-V254 WeakPolarHBondContact O-CG2 3.29Å; P250-V254 PolarHBondContact O-N 3.44Å; P250-T282 HydrophobicContact CB-CG2 3.58Å; P250-L285 HydrophobicContact CG-CD2 4.29Å
251Y95.2Very high93Very high24 Ų2433.7 Ų33.79%0.09417%0.174CC..Hα-helixtrans-63.3-46.6177.9173.7-103.2000112W248 A249 I253 V254 L255 M279 E283W248-Y251 HydrophobicContact CE3-CD1 4.1Å; W248-Y251 HydrophobicContact CZ3-CD1 4.1Å; W248-Y251 PolarHBondContact O-N 2.88Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 3.01Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.46Å; Y251-V254 PolarHBondContact O-N 2.96Å; Y251-L255 HydrophobicContact CE1-CD2 4.12Å; Y251-L255 VanDerWaalsContact O-CB 3.25Å; Y251-L255 WeakPolarHBondContact O-CB 3.38Å; Y251-L255 PolarHBondContact O-N 3.16Å; Y251-M279 HydrophobicContact CE2-CG 4.31Å; Y251-E283 HydrophobicContact CD2-CB 3.68Å; Y251-E283 HydrophobicContact CD2-CG 4.32Å; Y251-E283 HydrophobicContact CE2-CB 3.72Å; Y251-E283 HydrophobicContact CE2-CG 4.01Å
252N94.9Very high92.7Very high1 Ų140.7 Ų40.71%0.00521%0.207CC..Hα-helixtrans-61.8-38.2179.6-77.9-86.7000112.3I198 V199 L203 W248 A249 L256I198-N252 PolarHBondContact O-OD1 3.46Å; V199-N252 HydrophobicContact CG2-CB 4.42Å; L203-N252 HydrophobicContact CB-CB 4.22Å; L203-N252 HydrophobicContact CD2-CB 3.95Å; W248-N252 PolarHBondContact O-N 2.88Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 2.9Å; A249-N252 PolarHBondContact O-N 3.33Å; N252-L256 PolarHBondContact O-N 2.94Å; N252-L256 VanDerWaalsContact O-N 3.11Å
253I94.9Very high92.4Very high89 Ų8946 Ų4646%0.45623%0.228SC..Hα-helixtrans-67.2-47.6176.6-66.8164.1000110.2A249 P250 Y251 L255 L256 L257A249-I253 WeakPolarHBondContact O-CD1 3.5Å; A249-I253 VanDerWaalsContact O-CG1 3.25Å; A249-I253 WeakPolarHBondContact O-CG1 3.44Å; A249-I253 PolarHBondContact O-N 2.91Å; P250-I253 PolarHBondContact O-N 3.5Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.46Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.1Å; I253-L256 WeakPolarHBondContact O-CB 3.36Å; I253-L256 PolarHBondContact O-N 2.86Å; I253-L257 HydrophobicContact CG2-CD1 4.22Å; I253-L257 WeakPolarHBondContact O-CG 3.25Å; I253-L257 PolarHBondContact O-N 3.32Å
254V94.4Very high91.9Very high16 Ų1649.5 Ų49.510%0.09724%0.242CC..Hα-helixtrans-65-38.1178.9175.80000111.4P250 Y251 L256 L257 N258 A278 M279 T282P250-V254 WeakPolarHBondContact O-CG2 3.29Å; P250-V254 PolarHBondContact O-N 3.44Å; Y251-V254 PolarHBondContact O-N 2.96Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 2.94Å; V254-L257 PolarHBondContact O-N 3.1Å; V254-N258 VanDerWaalsContact O-CB 3.3Å; V254-N258 WeakPolarHBondContact O-CB 3.29Å; V254-N258 PolarHBondContact O-N 3.42Å; V254-A278 HydrophobicContact CG1-CB 4.07Å; V254-A278 HydrophobicContact CG2-CB 4.15Å; V254-M279 HydrophobicContact CG1-CB 3.88Å; V254-T282 HydrophobicContact CG2-CG2 4.12Å
255L93.4Very high91.3Very high17 Ų1751.6 Ų51.69%0.08926%0.264CS..Hα-helixtrans-61-40175.2-177.864.9000111.8T195 I198 Y251 I253 T259T195-L255 HydrophobicContact CG2-CG 4.2Å; I198-L255 HydrophobicContact CB-CD2 4.05Å; I198-L255 HydrophobicContact CD1-CD2 3.99Å; I198-L255 HydrophobicContact CG2-CD2 3.79Å; Y251-L255 HydrophobicContact CE1-CD2 4.12Å; Y251-L255 VanDerWaalsContact O-CB 3.25Å; Y251-L255 WeakPolarHBondContact O-CB 3.38Å; Y251-L255 PolarHBondContact O-N 3.16Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.1Å; L255-T259 WeakPolarHBondContact O-CB 3.46Å; L255-T259 PolarHBondContact O-N 2.91Å; L255-T259 PolarHBondContact O-OG1 3.01Å
256L93.8Very high90.6Very high54 Ų5452.8 Ų52.828%0.28327%0.271SS..Hα-helixtrans-63.9-49174-169.277.5000111T195 V199 N252 I253 V254 N258 T259 F260T195-L256 HydrophobicContact CG2-CD1 4.33Å; V199-L256 HydrophobicContact CG2-CB 4.49Å; V199-L256 HydrophobicContact CG2-CD1 4.41Å; N252-L256 PolarHBondContact O-N 2.94Å; N252-L256 VanDerWaalsContact O-N 3.11Å; I253-L256 WeakPolarHBondContact O-CB 3.36Å; I253-L256 PolarHBondContact O-N 2.86Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 2.94Å; L256-N258 VanDerWaalsContact C-N 3.34Å; L256-N258 PolarHBondContact O-N 3.22Å; L256-T259 PolarHBondContact O-N 3.42Å; L256-F260 HydrophobicContact CD1-CD2 3.75Å; L256-F260 HydrophobicContact CD1-CE2 3.61Å; L256-F260 HydrophobicContact CG-CD2 4.05Å; L256-F260 HydrophobicContact CG-CE2 4.42Å; L256-F260 WeakPolarHBondContact O-CD2 3.38Å; L256-F260 PolarHBondContact O-N 2.94Å
257L92.1Very high89.6Confident49 Ų4952.3 Ų52.326%0.25727%0.269SS..Hα-helixtrans-60.1-42.5178.1-68.9173.5000112I253 V254 T259 F260 Q261 F264 L275I253-L257 HydrophobicContact CG2-CD1 4.22Å; I253-L257 WeakPolarHBondContact O-CG 3.25Å; I253-L257 PolarHBondContact O-N 3.32Å; V254-L257 PolarHBondContact O-N 3.1Å; L257-T259 VanDerWaalsContact C-N 3.31Å; L257-T259 PolarHBondContact O-N 2.89Å; L257-F260 CarbonylContact O-C 3.36Å; L257-F260 PolarHBondContact O-N 2.66Å; L257-Q261 WeakPolarHBondContact O-CA 3.07Å; L257-Q261 PolarHBondContact O-N 2.84Å; L257-Q261 VanDerWaalsContact O-N 3.11Å; L257-F264 HydrophobicContact CD2-CD1 4.48Å; L257-F264 HydrophobicContact CD2-CD2 3.76Å; L257-F264 HydrophobicContact CD2-CE2 3.86Å; L257-F264 HydrophobicContact CD2-CG 4.1Å; L257-F264 HydrophobicContact CD2-CZ 4.27Å; L257-L275 HydrophobicContact CB-CD2 3.96Å; L257-L275 HydrophobicContact CD1-CD2 4.47Å
258N89.4Confident89Confident28 Ų2855 Ų5515%0.1529%0.285CS..Hα-helixtrans-65.7-34.4177.9-174.648.2000112.4V254 L256V254-N258 VanDerWaalsContact O-CB 3.3Å; V254-N258 WeakPolarHBondContact O-CB 3.29Å; V254-N258 PolarHBondContact O-N 3.42Å; L256-N258 VanDerWaalsContact C-N 3.34Å; L256-N258 PolarHBondContact O-N 3.22Å
259T89Confident88.2Confident6 Ų658 Ų584%0.03731%0.307CS..Hα-helixtrans-74.5-40.9179.1-58.30000111.9K191 N192 T195 L255 L256 L257K191-T259 HydrophobicContact CG-CG2 4.2Å; N192-T259 WeakPolarHBondContact OD1-CG2 3.25Å; T195-T259 WeakPolarHBondContact CB-OG1 3.27Å; T195-T259 HydrophobicContact CG2-CG2 3.97Å; T195-T259 VanDerWaalsContact CG2-OG1 3.23Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.39Å; T195-T259 PolarHBondContact OG1-OG1 3.44Å; L255-T259 WeakPolarHBondContact O-CB 3.46Å; L255-T259 PolarHBondContact O-N 2.91Å; L255-T259 PolarHBondContact O-OG1 3.01Å; L256-T259 PolarHBondContact O-N 3.42Å; L257-T259 VanDerWaalsContact C-N 3.31Å; L257-T259 PolarHBondContact O-N 2.89Å
260F89.3Confident87.6Confident53 Ų5360.6 Ų60.623%0.23232%0.324CS..THydrogen-bonded Turntrans-104.535.2-176.3-61.9-72.5000112.5T195 L196 L256 L257 E262 F263 F264T195-F260 HydrophobicContact CG2-CE2 4.49Å; L196-F260 HydrophobicContact CD2-CE2 4.4Å; L196-F260 HydrophobicContact CD2-CZ 4.44Å; L256-F260 HydrophobicContact CD1-CD2 3.75Å; L256-F260 HydrophobicContact CD1-CE2 3.61Å; L256-F260 HydrophobicContact CG-CD2 4.05Å; L256-F260 HydrophobicContact CG-CE2 4.42Å; L256-F260 WeakPolarHBondContact O-CD2 3.38Å; L256-F260 PolarHBondContact O-N 2.94Å; L257-F260 CarbonylContact O-C 3.36Å; L257-F260 PolarHBondContact O-N 2.66Å; F260-E262 PolarHBondContact O-N 3.34Å; F260-F263 HydrophobicContact CB-CB 4.25Å; F260-F263 WeakPolarHBondContact O-CB 3.07Å; F260-F263 PolarHBondContact O-N 2.87Å; F260-F263 VanDerWaalsContact O-N 3.11Å; F260-F264 HydrophobicContact CB-CD2 4.03Å; F260-F264 HydrophobicContact CB-CE2 3.9Å; F260-F264 VanDerWaalsContact O-CD2 3.24Å; F260-F264 WeakPolarHBondContact O-CD2 3.24Å; F260-F264 PolarHBondContact O-N 3.28Å; F260-F264 VanDerWaalsContact O-N 3.15Å
261Q85.9Confident86.9Confident45 Ų4560 Ų6021%0.2132%0.321CS..THydrogen-bonded Turntrans-55.7-37.2-177.762.9177.4-27.900113.3L257 F264 G265 L266L257-Q261 WeakPolarHBondContact O-CA 3.07Å; L257-Q261 PolarHBondContact O-N 2.84Å; L257-Q261 VanDerWaalsContact O-N 3.11Å; Q261-F264 PolarHBondContact O-N 2.87Å; Q261-G265 PolarHBondContact O-N 3.44Å; Q261-G265 VanDerWaalsContact O-N 3.07Å; Q261-L266 HydrophobicContact CB-CB 4.3Å; Q261-L266 PolarHBondContact O-N 3.44Å
262E82.1Confident86.2Confident146 Ų14660 Ų6068%0.68233%0.325SS*.THydrogen-bonded Turntrans-67.3-41.4179.5-69.1174.6-168.500111.2F260 F264 G265F260-E262 PolarHBondContact O-N 3.34Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 3.5Å; E262-G265 PolarHBondContact O-N 3.04Å
263F85.3Confident85.6Confident171 Ų17161.8 Ų61.875%0.7533%0.334SS*.THydrogen-bonded Turntrans-65.2-35.8178.2-175.7-95.9000112.2F260F260-F263 HydrophobicContact CB-CB 4.25Å; F260-F263 WeakPolarHBondContact O-CB 3.07Å; F260-F263 PolarHBondContact O-N 2.87Å; F260-F263 VanDerWaalsContact O-N 3.11Å
264F84.2Confident85.1Confident96 Ų9666 Ų6642%0.42135%0.345SS..THydrogen-bonded Turntrans-89.61.8178.2-67.2-66.3000114.2L257 F260 Q261 E262 L266L257-F264 HydrophobicContact CD2-CD1 4.48Å; L257-F264 HydrophobicContact CD2-CD2 3.76Å; L257-F264 HydrophobicContact CD2-CE2 3.86Å; L257-F264 HydrophobicContact CD2-CG 4.1Å; L257-F264 HydrophobicContact CD2-CZ 4.27Å; F260-F264 HydrophobicContact CB-CD2 4.03Å; F260-F264 HydrophobicContact CB-CE2 3.9Å; F260-F264 VanDerWaalsContact O-CD2 3.24Å; F260-F264 WeakPolarHBondContact O-CD2 3.24Å; F260-F264 PolarHBondContact O-N 3.28Å; F260-F264 VanDerWaalsContact O-N 3.15Å; Q261-F264 PolarHBondContact O-N 2.87Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 3.5Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.95Å; F264-L266 HydrophobicContact CB-CG 4.05Å; F264-L266 PolarHBondContact O-N 3.07Å
265G79.6Confident84.7Confident47 Ų4766 Ų6649%0.48534%0.344SS..THydrogen-bonded Turntrans66.729.1-178.400000114.4Q261 E262Q261-G265 PolarHBondContact O-N 3.44Å; Q261-G265 VanDerWaalsContact O-N 3.07Å; E262-G265 PolarHBondContact O-N 3.04Å
266L80.4Confident84.2Confident47 Ų4766.5 Ų66.525%0.24635%0.347CS..  trans-101.915.6-177-62.2174.4000113.5Q261 F264 N268 S271 L275Q261-L266 HydrophobicContact CB-CB 4.3Å; Q261-L266 PolarHBondContact O-N 3.44Å; F264-L266 VanDerWaalsContact C-N 3.32Å; F264-L266 HydrophobicContact CB-CD1 3.95Å; F264-L266 HydrophobicContact CB-CG 4.05Å; F264-L266 PolarHBondContact O-N 3.07Å; L266-N268 PolarHBondContact O-N 3.22Å; L266-S271 WeakPolarHBondContact O-CB 3.27Å; L266-L275 HydrophobicContact CB-CD1 3.97Å; L266-L275 HydrophobicContact CD1-CD1 3.94Å; L266-L275 HydrophobicContact CD1-CD2 4.48Å
267N75.8Confident83.8Confident101 Ų10167.9 Ų67.954%0.5435%0.352SS..  trans-73.9-0.5-175.763.7-23.2000115.2
268N82.6Confident83.7Confident95 Ų9567.2 Ų67.251%0.50835%0.353SS..SBendtrans-72.4141174.8-64.2-32.4000111L266 S270 S271 S272L266-N268 PolarHBondContact O-N 3.22Å; N268-S270 PolarHBondContact O-N 2.86Å; N268-S270 VanDerWaalsContact O-N 3.16Å; N268-S271 WeakPolarHBondContact O-CA 3.47Å; N268-S271 WeakPolarHBondContact O-CB 3.31Å; N268-S271 PolarHBondContact O-N 3.47Å; N268-S272 PolarHBondContact O-N 2.78Å
269C79.3Confident83.7Confident74 Ų7468 Ų6850%0.536%0.356SS..Hα-helixtrans-57-34.9-178.5164.10000112.9C20 N273C20-C269 HydrophobicContact CB-CB 4.12Å; C20-C269 WeakPolarHBondContact CB-SG 3.47Å; C20-C269 WeakPolarHBondContact SG-CB 3.44Å; C20-C269 PolarHBondContact SG-O 3.02Å; C20-C269 CovalentContact SG-SG 2.07Å; C20-C269 PolarHBondContact SG-SG 2.89Å; C269-N273 VanDerWaalsContact O-CB 3.29Å; C269-N273 WeakPolarHBondContact O-CB 3.5Å; C269-N273 PolarHBondContact O-N 3.44Å
270S81Confident83.7Confident71 Ų7170.8 Ų70.850%0.49737%0.369SS..Hα-helixtrans-66.5-37.817561.70000113.1N268 R274N268-S270 PolarHBondContact O-N 2.86Å; N268-S270 VanDerWaalsContact O-N 3.16Å; S270-R274 WeakPolarHBondContact O-CG 3.48Å; S270-R274 PolarHBondContact O-N 2.03Å
271S81.9Confident83.7Confident29 Ų2973.1 Ų73.120%0.20339%0.388CS..Hα-helixtrans-73.4-44.3176.3-64.20000111.5L266 N268 N273 R274 L275L266-S271 WeakPolarHBondContact O-CB 3.27Å; N268-S271 WeakPolarHBondContact O-CA 3.47Å; N268-S271 WeakPolarHBondContact O-CB 3.31Å; N268-S271 PolarHBondContact O-N 3.47Å; S271-N273 VanDerWaalsContact C-N 3.33Å; S271-N273 PolarHBondContact O-N 2.98Å; S271-R274 PolarHBondContact O-N 3.49Å; S271-L275 PolarHBondContact O-N 3.23Å
272S80.8Confident84.1Confident24 Ų2471.8 Ų71.817%0.16838%0.383CS..Hα-helixtrans-57-45.9174-179.70000111.1N268 R274 L275 D276N268-S272 PolarHBondContact O-N 2.78Å; S272-R274 VanDerWaalsContact C-N 3.33Å; S272-R274 PolarHBondContact O-N 3.41Å; S272-L275 WeakPolarHBondContact O-CB 3.42Å; S272-L275 PolarHBondContact O-N 3.36Å; S272-L275 VanDerWaalsContact O-N 3.11Å; S272-D276 PolarHBondContact O-N 3.13Å; S272-D276 PolarHBondContact OG-OD2 3.05Å
273N81.9Confident84.6Confident40 Ų4067 Ų6721%0.21436%0.36CS..Hα-helixtrans-63.5-37.4179.9-16623.3000112.3C269 S271 D276 Q277C269-N273 VanDerWaalsContact O-CB 3.29Å; C269-N273 WeakPolarHBondContact O-CB 3.5Å; C269-N273 PolarHBondContact O-N 3.44Å; S271-N273 VanDerWaalsContact C-N 3.33Å; S271-N273 PolarHBondContact O-N 2.98Å; N273-D276 PolarHBondContact O-N 3.19Å; N273-Q277 WeakPolarHBondContact O-CG 3.41Å; N273-Q277 PolarHBondContact O-N 3.12Å; N273-Q277 VanDerWaalsContact O-N 3.1Å
274R85.5Confident84.9Confident177 Ų17759.5 Ų59.567%0.66833%0.329SS*.Hα-helixtrans-67.1-38.8173.1-68.8179.9-145.8-156.55112S270 S271 S272 Q277 A278S270-R274 WeakPolarHBondContact O-CG 3.48Å; S270-R274 PolarHBondContact O-N 2.03Å; S271-R274 PolarHBondContact O-N 3.49Å; S272-R274 VanDerWaalsContact C-N 3.33Å; S272-R274 PolarHBondContact O-N 3.41Å; R274-Q277 PolarHBondContact O-N 3.33Å; R274-A278 WeakPolarHBondContact O-CB 3.3Å; R274-A278 PolarHBondContact O-N 3.19Å
275L85.8Confident85.4Confident17 Ų1758.1 Ų58.19%0.08933%0.325CS..Hα-helixtrans-64.3-41.6175.5-78.7171.3000111.7L257 L266 S271 S272 A278 M279L257-L275 HydrophobicContact CB-CD2 3.96Å; L257-L275 HydrophobicContact CD1-CD2 4.47Å; L266-L275 HydrophobicContact CB-CD1 3.97Å; L266-L275 HydrophobicContact CD1-CD1 3.94Å; L266-L275 HydrophobicContact CD1-CD2 4.48Å; S271-L275 PolarHBondContact O-N 3.23Å; S272-L275 WeakPolarHBondContact O-CB 3.42Å; S272-L275 PolarHBondContact O-N 3.36Å; S272-L275 VanDerWaalsContact O-N 3.11Å; L275-A278 PolarHBondContact O-N 2.87Å; L275-M279 WeakPolarHBondContact O-CB 3.07Å; L275-M279 PolarHBondContact O-N 3.38Å
276D83.2Confident86.1Confident27 Ų2755.9 Ų55.914%0.14430%0.302CS..Hα-helixtrans-62.6-42.3175.8-70.8-63.7000111.9K22 S272 N273 M279 Q280K22-D276 WeakPolarHBondContact CE-OD2 3.29Å; K22-D276 IonicContact NZ-OD1 3.36Å; K22-D276 PolarHBondContact NZ-OD1 3.08Å; K22-D276 VanDerWaalsContact NZ-OD1 3.12Å; K22-D276 IonicContact NZ-OD2 3.99Å; K22-D276 PolarHBondContact NZ-OD2 3.13Å; S272-D276 PolarHBondContact O-N 3.13Å; S272-D276 PolarHBondContact OG-OD2 3.05Å; N273-D276 PolarHBondContact O-N 3.19Å; D276-M279 PolarHBondContact O-N 2.71Å; D276-Q280 PolarHBondContact O-N 3.22Å
277Q85.1Confident86.6Confident82 Ų8253.9 Ų53.938%0.38329%0.291SS..Hα-helixtrans-61.3-47.4173-72.3174.37.800111.6V25 N273 R274 M279 Q280 V281V25-Q277 HydrophobicContact CB-CG 4.32Å; V25-Q277 HydrophobicContact CG1-CG 3.83Å; V25-Q277 HydrophobicContact CG2-CG 3.46Å; V25-Q277 VanDerWaalsContact CG2-CG 3.46Å; N273-Q277 WeakPolarHBondContact O-CG 3.41Å; N273-Q277 PolarHBondContact O-N 3.12Å; N273-Q277 VanDerWaalsContact O-N 3.1Å; R274-Q277 PolarHBondContact O-N 3.33Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 3.12Å; Q277-Q280 PolarHBondContact O-N 3.47Å; Q277-V281 WeakPolarHBondContact O-CG2 3.22Å; Q277-V281 PolarHBondContact O-N 2.84Å
278A89.9Confident87.5Confident35 Ų3550 Ų5029%0.28927%0.272SS..Hα-helixtrans-60.7-39.2177.100000111.3V254 R274 L275 V281 T282V254-A278 HydrophobicContact CG1-CB 4.07Å; V254-A278 HydrophobicContact CG2-CB 4.15Å; R274-A278 WeakPolarHBondContact O-CB 3.3Å; R274-A278 PolarHBondContact O-N 3.19Å; L275-A278 PolarHBondContact O-N 2.87Å; A278-V281 PolarHBondContact O-N 3.36Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.24Å; A278-T282 VanDerWaalsContact O-CG2 3.25Å; A278-T282 WeakPolarHBondContact O-CG2 3.35Å; A278-T282 PolarHBondContact O-N 3.46Å; A278-T282 PolarHBondContact O-OG1 2.9Å
279M89.8Confident88Confident44 Ų4446 Ų4622%0.21725%0.25CC..Hα-helixtrans-63.6-47.5178.3-171.5169.964.700110.5Y251 V254 L275 D276 Q277 V281 T282 E283Y251-M279 HydrophobicContact CE2-CG 4.31Å; V254-M279 HydrophobicContact CG1-CB 3.88Å; L275-M279 WeakPolarHBondContact O-CB 3.07Å; L275-M279 PolarHBondContact O-N 3.38Å; D276-M279 PolarHBondContact O-N 2.71Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 3.12Å; M279-V281 PolarHBondContact O-N 3.08Å; M279-T282 PolarHBondContact O-N 3.45Å; M279-T282 PolarHBondContact O-OG1 2.82Å; M279-E283 WeakPolarHBondContact O-CB 3.19Å; M279-E283 PolarHBondContact O-N 2.07Å
280Q87.8Confident88.6Confident66 Ų6642.6 Ų42.631%0.30823%0.227SC..Hα-helixtrans-60.3-46.5177.2-172.365.858.500112.1L33 D276 Q277 T284L33-Q280 HydrophobicContact CD1-CG 4.46Å; D276-Q280 PolarHBondContact O-N 3.22Å; Q277-Q280 PolarHBondContact O-N 3.47Å; Q280-T284 WeakPolarHBondContact O-CB 3.14Å; Q280-T284 PolarHBondContact O-N 3.37Å; Q280-T284 PolarHBondContact O-OG1 3.46Å
281V90.9Very high89.1Confident102 Ų10239.8 Ų39.862%0.61821%0.207SC*.Hα-helixtrans-66.4-45.3-178.7171.80000111.2Q277 A278 M279 T284 L285Q277-V281 WeakPolarHBondContact O-CG2 3.22Å; Q277-V281 PolarHBondContact O-N 2.84Å; A278-V281 PolarHBondContact O-N 3.36Å; M279-V281 PolarHBondContact O-N 3.08Å; V281-T284 WeakPolarHBondContact O-CB 3.3Å; V281-T284 PolarHBondContact O-N 3.35Å; V281-L285 PolarHBondContact O-N 2.95Å
282T94Very high89.6Confident17 Ų1740 Ų4010%0.10421%0.206CC..Hα-helixtrans-71.9-33.4-178.955.20000112.6P250 V254 A278 M279 L285 G286P250-T282 HydrophobicContact CB-CG2 3.58Å; V254-T282 HydrophobicContact CG2-CG2 4.12Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.24Å; A278-T282 VanDerWaalsContact O-CG2 3.25Å; A278-T282 WeakPolarHBondContact O-CG2 3.35Å; A278-T282 PolarHBondContact O-N 3.46Å; A278-T282 PolarHBondContact O-OG1 2.9Å; M279-T282 PolarHBondContact O-N 3.45Å; M279-T282 PolarHBondContact O-OG1 2.82Å; T282-L285 WeakPolarHBondContact O-CB 3.29Å; T282-L285 PolarHBondContact O-N 2.8Å; T282-G286 PolarHBondContact O-N 3.39Å
283E92.2Very high90.1Very high44 Ų4438.9 Ų38.921%0.20620%0.198CC..Hα-helixtrans-63.9-45.8170.6-175.8175.3-162.900110.9Y251 M279 L285 G286 M287Y251-E283 HydrophobicContact CD2-CB 3.68Å; Y251-E283 HydrophobicContact CD2-CG 4.32Å; Y251-E283 HydrophobicContact CE2-CB 3.72Å; Y251-E283 HydrophobicContact CE2-CG 4.01Å; M279-E283 WeakPolarHBondContact O-CB 3.19Å; M279-E283 PolarHBondContact O-N 2.07Å; E283-L285 VanDerWaalsContact C-N 3.29Å; E283-L285 PolarHBondContact O-N 3.01Å; E283-G286 CarbonylContact O-C 3.56Å; E283-G286 WeakPolarHBondContact O-CA 3.37Å; E283-G286 PolarHBondContact O-N 2.78Å; E283-G286 VanDerWaalsContact O-N 3.1Å; E283-M287 HydrophobicContact CG-CE 4.15Å; E283-M287 WeakPolarHBondContact O-CG 3.33Å; E283-M287 PolarHBondContact O-N 3.1Å
284T91.9Very high90.4Very high15 Ų1537.6 Ų37.69%0.09219%0.191CC..Hα-helixtrans-57.9-44.1176.1-57.30000110.9L33 L36 Y37 Q280 V281 M287 T288L33-T284 HydrophobicContact CD2-CG2 3.51Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.39Å; L36-T284 HydrophobicContact CD2-CG2 3.49Å; L36-T284 VanDerWaalsContact CD2-CG2 3.49Å; Y37-T284 HydrophobicContact CE1-CG2 3.87Å; Y37-T284 PolarHBondContact OH-OG1 3Å; Q280-T284 WeakPolarHBondContact O-CB 3.14Å; Q280-T284 PolarHBondContact O-N 3.37Å; Q280-T284 PolarHBondContact O-OG1 3.46Å; V281-T284 WeakPolarHBondContact O-CB 3.3Å; V281-T284 PolarHBondContact O-N 3.35Å; T284-M287 PolarHBondContact O-N 3.41Å; T284-T288 VanDerWaalsContact O-CG2 3.25Å; T284-T288 WeakPolarHBondContact O-CG2 3.45Å; T284-T288 PolarHBondContact O-N 3.44Å; T284-T288 VanDerWaalsContact O-N 3.14Å
285L94.4Very high90.6Very high66 Ų6632.9 Ų32.935%0.34618%0.179SC..Hα-helixtrans-58.2-50.7173.5-179.565.8000110.5F247 P250 V281 T282 E283 M287 T288F247-L285 HydrophobicContact CD1-CD1 3.93Å; F247-L285 HydrophobicContact CD1-CG 4.23Å; F247-L285 VanDerWaalsContact CD1-O 3.31Å; F247-L285 WeakPolarHBondContact CD1-O 3.41Å; F247-L285 HydrophobicContact CE1-CD1 4.02Å; F247-L285 HydrophobicContact CG-CD1 4.43Å; F247-L285 HydrophobicContact CG-CG 4.47Å; P250-L285 HydrophobicContact CG-CD2 4.29Å; V281-L285 PolarHBondContact O-N 2.95Å; T282-L285 WeakPolarHBondContact O-CB 3.29Å; T282-L285 PolarHBondContact O-N 2.8Å; E283-L285 VanDerWaalsContact C-N 3.29Å; E283-L285 PolarHBondContact O-N 3.01Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 2.92Å; L285-T288 PolarHBondContact O-N 2.99Å; L285-T288 VanDerWaalsContact O-N 3.08Å; L285-T288 PolarHBondContact O-OG1 2.86Å
286G94Very high90.6Very high0 Ų032.6 Ų32.60%018%0.177CC..Hα-helixtrans-55-43.2175.200000113W248 T282 E283 T288 H289W248-G286 VanDerWaalsContact CZ2-O 3.25Å; W248-G286 WeakPolarHBondContact CZ2-O 3.34Å; T282-G286 PolarHBondContact O-N 3.39Å; E283-G286 CarbonylContact O-C 3.56Å; E283-G286 WeakPolarHBondContact O-CA 3.37Å; E283-G286 PolarHBondContact O-N 2.78Å; E283-G286 VanDerWaalsContact O-N 3.1Å; G286-T288 VanDerWaalsContact C-N 3.28Å; G286-T288 PolarHBondContact O-N 3.38Å; G286-H289 WeakPolarHBondContact O-CB 3.43Å; G286-H289 PolarHBondContact O-N 3.31Å; G286-H289 VanDerWaalsContact O-N 3.07Å
287M91.5Very high90.7Very high5 Ų531.7 Ų31.73%0.02517%0.172CC..Hα-helixtrans-60.6-36177.3-70.1-160.3-177.700112.6Y37 F79 W86 Y108 E283 T284 L285 H289 C290Y37-M287 HydrophobicContact CE1-CB 4.17Å; Y37-M287 HydrophobicContact CE1-SD 3.79Å; Y37-M287 HydrophobicContact CE2-SD 3.83Å; Y37-M287 PolarHBondContact OH-SD 2.84Å; F79-M287 HydrophobicContact CE1-CB 4.12Å; F79-M287 HydrophobicContact CE1-CG 4.08Å; F79-M287 HydrophobicContact CZ-CB 4.41Å; F79-M287 HydrophobicContact CZ-CG 3.97Å; W86-M287 HydrophobicContact CG-CE 4.38Å; Y108-M287 HydrophobicContact CE2-CE 3.91Å; E283-M287 HydrophobicContact CG-CE 4.15Å; E283-M287 WeakPolarHBondContact O-CG 3.33Å; E283-M287 PolarHBondContact O-N 3.1Å; T284-M287 PolarHBondContact O-N 3.41Å; L285-M287 VanDerWaalsContact C-N 3.31Å; L285-M287 PolarHBondContact O-N 2.92Å; M287-H289 PolarHBondContact O-N 3.24Å; M287-C290 PolarHBondContact O-SG 2.95Å
288T93.9Very high90.5Very high21 Ų2129.3 Ų29.313%0.12917%0.166CC..Hα-helixtrans-67.6-18.6178.369.50000113.5V40 F247 T284 L285 G286 C290 C291V40-T288 HydrophobicContact CG2-CG2 3.73Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.25Å; F247-T288 VanDerWaalsContact CE1-OG1 3.25Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.33Å; T284-T288 VanDerWaalsContact O-CG2 3.25Å; T284-T288 WeakPolarHBondContact O-CG2 3.45Å; T284-T288 PolarHBondContact O-N 3.44Å; T284-T288 VanDerWaalsContact O-N 3.14Å; L285-T288 PolarHBondContact O-N 2.99Å; L285-T288 VanDerWaalsContact O-N 3.08Å; L285-T288 PolarHBondContact O-OG1 2.86Å; G286-T288 VanDerWaalsContact C-N 3.28Å; G286-T288 PolarHBondContact O-N 3.38Å; T288-C290 PolarHBondContact O-N 2.94Å; T288-C291 PolarHBondContact O-N 3.47Å; T288-C291 PolarHBondContact O-SG 3.02Å
289H94.3Very high89.8Confident9 Ų935.8 Ų35.84%0.04219%0.188CC..G310 helixtrans-55.6-35.4-180176.3-97000113.5Y244 F247 W248 G286 M287 C291 I292Y244-H289 AromaticContact CD2-CE1 3.88Å; Y244-H289 AromaticContact CD2-NE2 3.95Å; F247-H289 HydrophobicContact CB-CB 3.95Å; F247-H289 HydrophobicContact CD1-CB 3.97Å; F247-H289 HydrophobicContact CG-CB 4.19Å; W248-H289 AromaticContact CD1-CG 3.87Å; W248-H289 AromaticContact NE1-CG 3.53Å; W248-H289 AromaticContact NE1-ND1 3.56Å; G286-H289 WeakPolarHBondContact O-CB 3.43Å; G286-H289 PolarHBondContact O-N 3.31Å; G286-H289 VanDerWaalsContact O-N 3.07Å; M287-H289 PolarHBondContact O-N 3.24Å; H289-C291 PolarHBondContact O-N 2.91Å; H289-C291 VanDerWaalsContact O-N 3.08Å; H289-I292 WeakPolarHBondContact O-CB 3.31Å; H289-I292 PolarHBondContact O-N 3.41Å
290C91.3Very high89.1Confident3 Ų335.2 Ų35.22%0.0219%0.187CC..G310 helixtrans-61.4-20.4-175.264.80000114.2N48 D76 F79 L80 M287 T288N48-C290 PolarHBondContact ND2-O 3.34Å; D76-C290 HydrophobicContact CB-CB 4.41Å; F79-C290 HydrophobicContact CD1-CB 4.02Å; L80-C290 HydrophobicContact CD2-CB 4.5Å; L80-C290 WeakPolarHBondContact CD2-SG 3.31Å; L80-C290 HydrophobicContact CG-CB 4.2Å; M287-C290 PolarHBondContact O-SG 2.95Å; T288-C290 PolarHBondContact O-N 2.94Å
291C91.8Very high88.4Confident12 Ų1232.5 Ų32.58%0.08118%0.177CC..G310 helixtrans-95.4-7.5175.2730000113.8F43 G44 T288 H289F43-C291 HydrophobicContact CB-CB 4.42Å; G44-C291 VanDerWaalsContact CA-CB 3.48Å; T288-C291 PolarHBondContact O-N 3.47Å; T288-C291 PolarHBondContact O-SG 3.02Å; H289-C291 PolarHBondContact O-N 2.91Å; H289-C291 VanDerWaalsContact O-N 3.08Å
292I92.7Very high87.6Confident35 Ų3531.2 Ų31.218%0.17916%0.164CC..Hα-helixtrans-82.4-29.6-175.2-53.1-60.1000112.1V243 F247 H289 I295 I296V243-I292 HydrophobicContact CG1-CB 4.5Å; V243-I292 HydrophobicContact CG1-CG2 3.71Å; F247-I292 HydrophobicContact CE1-CD1 4.24Å; F247-I292 HydrophobicContact CE1-CG1 3.82Å; F247-I292 HydrophobicContact CZ-CD1 4.16Å; F247-I292 HydrophobicContact CZ-CG1 3.89Å; H289-I292 WeakPolarHBondContact O-CB 3.31Å; H289-I292 PolarHBondContact O-N 3.41Å; I292-I295 HydrophobicContact CD1-CD1 4.23Å; I292-I295 WeakPolarHBondContact O-CA 3.35Å; I292-I295 VanDerWaalsContact O-CB 3.31Å; I292-I295 WeakPolarHBondContact O-CB 3.39Å; I292-I295 PolarHBondContact O-N 2.87Å; I292-I296 HydrophobicContact CG2-CD1 3.95Å; I292-I296 HydrophobicContact CG2-CG1 4.01Å; I292-I296 WeakPolarHBondContact O-CG1 3.23Å; I292-I296 PolarHBondContact O-N 3.39Å
293N89.4Confident86.5Confident0 Ų036.7 Ų36.70%019%0.186CC..Hα-helixtrans-55.3-50.8-179.7-76-30000113.2D76 I295 I296 Y297D76-N293 PolarHBondContact OD2-ND2 3.37Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.14Å; N293-I296 PolarHBondContact O-N 3.37Å; N293-Y297 HydrophobicContact CB-CE2 4.13Å; N293-Y297 WeakPolarHBondContact O-CD2 3.33Å; N293-Y297 WeakPolarHBondContact O-CE2 3.34Å; N293-Y297 VanDerWaalsContact O-CG 3.28Å; N293-Y297 PolarHBondContact O-N 3.48Å
294P89Confident85.5Confident12 Ų1235.3 Ų35.38%0.07818%0.18CC..Hα-helixtrans-56.7-38.3172.9-26.234.7000114.1G47 V51 Y297 A298G47-P294 VanDerWaalsContact C-CG 3.4Å; V51-P294 HydrophobicContact CG2-CB 4.12Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; P294-Y297 PolarHBondContact O-N 2.93Å; P294-A298 PolarHBondContact O-N 3.18Å
295I88.8Confident84.9Confident78 Ų7840.7 Ų40.740%0.420%0.199SC..Hα-helixtrans-63.3-47.7177.8-62.1175.9000109.4I292 N293 Y297 A298 F299I292-I295 HydrophobicContact CD1-CD1 4.23Å; I292-I295 WeakPolarHBondContact O-CA 3.35Å; I292-I295 VanDerWaalsContact O-CB 3.31Å; I292-I295 WeakPolarHBondContact O-CB 3.39Å; I292-I295 PolarHBondContact O-N 2.87Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.14Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 3.23Å; I295-A298 PolarHBondContact O-N 3.42Å; I295-A298 VanDerWaalsContact O-N 3.13Å; I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.35Å; I295-F299 PolarHBondContact O-N 3.05Å
296I87.6Confident84.2Confident11 Ų1141.9 Ų41.96%0.05621%0.205CC..Hα-helixtrans-57.2-44175.5-64166.8000110.5L236 T239 I240 V243 I292 N293 A298 F299 V300L236-I296 HydrophobicContact CD1-CG2 3.89Å; T239-I296 HydrophobicContact CG2-CG2 4.07Å; I240-I296 HydrophobicContact CG1-CD1 4.32Å; I240-I296 HydrophobicContact CG1-CG2 3.87Å; V243-I296 HydrophobicContact CB-CD1 3.94Å; V243-I296 HydrophobicContact CG1-CD1 3.97Å; V243-I296 HydrophobicContact CG2-CD1 4.01Å; I292-I296 HydrophobicContact CG2-CD1 3.95Å; I292-I296 HydrophobicContact CG2-CG1 4.01Å; I292-I296 WeakPolarHBondContact O-CG1 3.23Å; I292-I296 PolarHBondContact O-N 3.39Å; N293-I296 PolarHBondContact O-N 3.37Å; I296-A298 VanDerWaalsContact C-N 3.34Å; I296-A298 PolarHBondContact O-N 2.89Å; I296-F299 PolarHBondContact O-N 3.23Å; I296-V300 HydrophobicContact CG2-CB 4.26Å; I296-V300 HydrophobicContact CG2-CG2 4.08Å; I296-V300 WeakPolarHBondContact O-CA 3.5Å; I296-V300 VanDerWaalsContact O-CB 3.26Å; I296-V300 WeakPolarHBondContact O-CB 3.17Å; I296-V300 PolarHBondContact O-N 3.3Å
297Y84.3Confident83.4Confident9 Ų946 Ų464%0.03522%0.221CC..Hα-helixtrans-63.6-38.6178.4-56.6-38.8000112.8V51 L69 L72 L236 I240 N293 P294 I295 G301V51-Y297 HydrophobicContact CG1-CD2 4.33Å; V51-Y297 HydrophobicContact CG1-CE2 4.23Å; V51-Y297 HydrophobicContact CG2-CD2 3.71Å; V51-Y297 HydrophobicContact CG2-CE2 4.18Å; L69-Y297 HydrophobicContact CD2-CE1 3.83Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.38Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.25Å; L236-Y297 HydrophobicContact CD1-CD1 4.23Å; I240-Y297 HydrophobicContact CD1-CD1 4.49Å; I240-Y297 HydrophobicContact CD1-CE1 3.61Å; I240-Y297 HydrophobicContact CG1-CE1 4.43Å; N293-Y297 HydrophobicContact CB-CE2 4.13Å; N293-Y297 WeakPolarHBondContact O-CD2 3.33Å; N293-Y297 WeakPolarHBondContact O-CE2 3.34Å; N293-Y297 VanDerWaalsContact O-CG 3.28Å; N293-Y297 PolarHBondContact O-N 3.48Å; P294-Y297 PolarHBondContact O-N 2.93Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 3.23Å; Y297-G301 WeakPolarHBondContact O-CA 3.43Å; Y297-G301 PolarHBondContact O-N 2.9Å
298A80.3Confident82.7Confident32 Ų3247.3 Ų47.326%0.26423%0.229SC..Hα-helixtrans-67.4-40.917900000112.9P294 I295 I296P294-A298 PolarHBondContact O-N 3.18Å; I295-A298 PolarHBondContact O-N 3.42Å; I295-A298 VanDerWaalsContact O-N 3.13Å; I296-A298 VanDerWaalsContact C-N 3.34Å; I296-A298 PolarHBondContact O-N 2.89Å
299F76.6Confident82Confident170 Ų17050.6 Ų50.675%0.74625%0.245SC*.Hα-helixtrans-89.9-39.5-175.8-72.1-73.3000113.7I295 I296I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.23Å; I295-F299 WeakPolarHBondContact O-CD2 3.35Å; I295-F299 PolarHBondContact O-N 3.05Å; I296-F299 PolarHBondContact O-N 3.23Å
300V74.3Confident81.3Confident32 Ų3253.8 Ų53.819%0.19427%0.265CS..Hα-helixtrans-96.5-28.8-174.6-172.40000111.6L236 T239 I296 E302L236-V300 HydrophobicContact CB-CG1 4.33Å; L236-V300 HydrophobicContact CD1-CB 3.85Å; L236-V300 HydrophobicContact CD1-CG1 3.86Å; T239-V300 HydrophobicContact CG2-CG2 4.25Å; I296-V300 HydrophobicContact CG2-CB 4.26Å; I296-V300 HydrophobicContact CG2-CG2 4.08Å; I296-V300 WeakPolarHBondContact O-CA 3.5Å; I296-V300 VanDerWaalsContact O-CB 3.26Å; I296-V300 WeakPolarHBondContact O-CB 3.17Å; I296-V300 PolarHBondContact O-N 3.3Å; V300-E302 PolarHBondContact O-N 3.49Å
301G73.2Confident80.7Confident10 Ų1054.9 Ų54.910%0.10327%0.269CS..  trans-89.586.3-176.100000113.9Y297 K303 F304 R305Y297-G301 WeakPolarHBondContact O-CA 3.43Å; Y297-G301 PolarHBondContact O-N 2.9Å; G301-K303 VanDerWaalsContact C-N 3.25Å; G301-K303 PolarHBondContact O-N 3.49Å; G301-K303 VanDerWaalsContact O-N 3.14Å; G301-F304 WeakPolarHBondContact O-CA 3.49Å; G301-F304 WeakPolarHBondContact O-CB 3.19Å; G301-F304 PolarHBondContact O-N 2.74Å; G301-R305 PolarHBondContact O-N 3.43Å
302E73.1Confident80.1Confident74 Ų7458.4 Ų58.435%0.34628%0.283SS..Hα-helixtrans-51.2-41.6177.4-69.8174.3-170.900113.7R232 V300 N306R232-E302 WeakPolarHBondContact CD-OE2 3.25Å; R232-E302 IonicContact CZ-OE1 3.31Å; R232-E302 IonicContact CZ-OE2 2.61Å; R232-E302 VanDerWaalsContact CZ-OE2 3.31Å; R232-E302 IonicContact NE-OE1 3.26Å; R232-E302 IonicContact NE-OE2 3.17Å; R232-E302 IonicContact NH1-OE1 2.66Å; R232-E302 IonicContact NH1-OE2 3.12Å; R232-E302 PolarHBondContact NH1-OE2 2.9Å; V300-E302 PolarHBondContact O-N 3.49Å; E302-N306 PolarHBondContact O-N 3.23Å; E302-N306 VanDerWaalsContact O-N 3.13Å
303K71.4Confident79.4Confident132 Ų13262.9 Ų62.957%0.57430%0.303SS*.Hα-helixtrans-64.5-43.1176.8-69.6-173.7-180-177.90111.7G301 N306 Y307G301-K303 VanDerWaalsContact C-N 3.25Å; G301-K303 PolarHBondContact O-N 3.49Å; G301-K303 VanDerWaalsContact O-N 3.14Å; K303-N306 PolarHBondContact O-N 3.31Å; K303-Y307 HydrophobicContact CB-CE2 4.41Å; K303-Y307 WeakPolarHBondContact O-CD2 3.3Å; K303-Y307 PolarHBondContact O-N 2.81Å; K303-Y307 VanDerWaalsContact O-N 3.08Å
304F72.3Confident78.6Confident16 Ų1669.5 Ų69.57%0.0733%0.332CS..Hα-helixtrans-65.2-43.3-179.3-175.1-96.3000110.5V51 I54 G301 N306 Y307 L308V51-F304 HydrophobicContact CB-CE2 4.36Å; V51-F304 HydrophobicContact CB-CZ 4.41Å; V51-F304 HydrophobicContact CG1-CE2 4.49Å; V51-F304 HydrophobicContact CG2-CE2 3.93Å; V51-F304 HydrophobicContact CG2-CZ 3.62Å; I54-F304 HydrophobicContact CB-CE2 4.1Å; I54-F304 HydrophobicContact CD1-CD2 4.44Å; I54-F304 HydrophobicContact CD1-CE1 4.29Å; I54-F304 HydrophobicContact CD1-CE2 3.69Å; I54-F304 HydrophobicContact CD1-CZ 3.6Å; I54-F304 HydrophobicContact CG2-CD2 4.11Å; I54-F304 HydrophobicContact CG2-CE2 3.96Å; G301-F304 WeakPolarHBondContact O-CA 3.49Å; G301-F304 WeakPolarHBondContact O-CB 3.19Å; G301-F304 PolarHBondContact O-N 2.74Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 2.97Å; F304-Y307 PolarHBondContact O-N 3.29Å; F304-Y307 VanDerWaalsContact O-N 3.17Å; F304-L308 HydrophobicContact CD1-CD1 4.39Å; F304-L308 HydrophobicContact CE1-CD1 3.77Å; F304-L308 HydrophobicContact CZ-CD1 4.49Å; F304-L308 VanDerWaalsContact O-CB 3.31Å; F304-L308 WeakPolarHBondContact O-CB 3.28Å; F304-L308 PolarHBondContact O-N 3.43Å
305R78.3Confident77.7Confident128 Ų12873.1 Ų73.148%0.48335%0.348SS..Hα-helixtrans-56.6-43.6173.7-169.5177.569-172.93112.8G301 L308 L309G301-R305 PolarHBondContact O-N 3.43Å; R305-L308 WeakPolarHBondContact O-CB 3.27Å; R305-L308 PolarHBondContact O-N 3.45Å; R305-L309 WeakPolarHBondContact O-CG 3.23Å; R305-L309 PolarHBondContact O-N 3.4Å
306N79.6Confident76.7Confident91 Ų9172.2 Ų72.249%0.48734%0.343SS..Hα-helixtrans-65.2-41.5177.1-70.8-2.7000112.1E302 K303 F304 L308 L309 V310E302-N306 PolarHBondContact O-N 3.23Å; E302-N306 VanDerWaalsContact O-N 3.13Å; K303-N306 PolarHBondContact O-N 3.31Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 2.97Å; N306-L308 VanDerWaalsContact C-N 3.33Å; N306-L309 PolarHBondContact O-N 3.23Å; N306-V310 WeakPolarHBondContact O-CG2 3.36Å; N306-V310 PolarHBondContact O-N 3.04Å
307Y77.9Confident75.5Confident85 Ų8573.8 Ų73.833%0.33336%0.358SS..Hα-helixtrans-66.3-37.2174.9-72-61.4000112.6I54 C58 K59 K303 F304 V310 F311I54-Y307 HydrophobicContact CG2-CG 4.31Å; C58-Y307 HydrophobicContact CB-CD1 3.66Å; C58-Y307 HydrophobicContact CB-CE1 4.25Å; C58-Y307 HydrophobicContact CB-CG 4.19Å; K59-Y307 HydrophobicContact CD-CE2 4.2Å; K59-Y307 HydrophobicContact CG-CD2 3.96Å; K59-Y307 HydrophobicContact CG-CE2 3.6Å; K303-Y307 HydrophobicContact CB-CE2 4.41Å; K303-Y307 WeakPolarHBondContact O-CD2 3.3Å; K303-Y307 PolarHBondContact O-N 2.81Å; K303-Y307 VanDerWaalsContact O-N 3.08Å; F304-Y307 PolarHBondContact O-N 3.29Å; F304-Y307 VanDerWaalsContact O-N 3.17Å; Y307-V310 PolarHBondContact O-N 3.01Å; Y307-F311 VanDerWaalsContact O-CB 3.28Å; Y307-F311 WeakPolarHBondContact O-CB 3.35Å; Y307-F311 PolarHBondContact O-N 3.16Å
308L77.5Confident74.2Confident34 Ų3480.7 Ų80.718%0.17839%0.388CS..Hα-helixtrans-61.1-50.1174.7-171148.2000109.4L50 I54 F304 R305 N306 V310 F311 F312L50-L308 HydrophobicContact CD2-CD1 3.74Å; L50-L308 HydrophobicContact CD2-CG 4.29Å; I54-L308 HydrophobicContact CD1-CB 4.07Å; I54-L308 HydrophobicContact CD1-CG 4.44Å; F304-L308 HydrophobicContact CD1-CD1 4.39Å; F304-L308 HydrophobicContact CE1-CD1 3.77Å; F304-L308 HydrophobicContact CZ-CD1 4.49Å; F304-L308 VanDerWaalsContact O-CB 3.31Å; F304-L308 WeakPolarHBondContact O-CB 3.28Å; F304-L308 PolarHBondContact O-N 3.43Å; R305-L308 WeakPolarHBondContact O-CB 3.27Å; R305-L308 PolarHBondContact O-N 3.45Å; N306-L308 VanDerWaalsContact C-N 3.33Å; L308-V310 PolarHBondContact O-N 3.46Å; L308-F311 WeakPolarHBondContact O-CB 3.31Å; L308-F311 PolarHBondContact O-N 2.98Å; L308-F311 VanDerWaalsContact O-N 3.1Å; L308-F312 HydrophobicContact CD1-CE2 4.44Å; L308-F312 HydrophobicContact CD2-CD2 3.4Å; L308-F312 HydrophobicContact CD2-CE2 3.35Å; L308-F312 HydrophobicContact CG-CD2 3.84Å; L308-F312 HydrophobicContact CG-CE2 3.69Å; L308-F312 VanDerWaalsContact O-CD2 3.25Å; L308-F312 WeakPolarHBondContact O-CD2 3.38Å; L308-F312 PolarHBondContact O-N 3.19Å
309L78.6Confident73Confident89 Ų8988.7 Ų88.747%0.46641%0.411SS..Hα-helixtrans-56-46.4174.8-73.2169.3000112.9R305 N306 F311 F312 Q313R305-L309 WeakPolarHBondContact O-CG 3.23Å; R305-L309 PolarHBondContact O-N 3.4Å; N306-L309 PolarHBondContact O-N 3.23Å; L309-F311 VanDerWaalsContact C-N 3.33Å; L309-F311 PolarHBondContact O-N 3.36Å; L309-F312 PolarHBondContact O-N 3.08Å; L309-Q313 WeakPolarHBondContact O-CB 3.38Å; L309-Q313 VanDerWaalsContact O-CG 3.29Å; L309-Q313 WeakPolarHBondContact O-CG 3.42Å; L309-Q313 PolarHBondContact O-N 3.4Å
310V79.6Confident71.9Confident76 Ų7687.7 Ų87.746%0.46141%0.407SS..Hα-helixtrans-63.4-39.6176.8171.80000111.6N306 Y307 L308 Q313 K314N306-V310 WeakPolarHBondContact O-CG2 3.36Å; N306-V310 PolarHBondContact O-N 3.04Å; Y307-V310 PolarHBondContact O-N 3.01Å; L308-V310 PolarHBondContact O-N 3.46Å; V310-Q313 PolarHBondContact O-N 3.41Å; V310-K314 VanDerWaalsContact O-CB 3.23Å; V310-K314 WeakPolarHBondContact O-CB 3.43Å; V310-K314 PolarHBondContact O-N 2.82Å
311F77.5Confident70.7Confident26 Ų2689.7 Ų89.711%0.11442%0.422CS..Hα-helixtrans-63.9-46.7176.4-179.1-92.8000111.2L50 L53 Y307 L308 L309 Q313 K314 H315 I316L50-F311 HydrophobicContact CD1-CD1 3.81Å; L50-F311 HydrophobicContact CD1-CE1 3.7Å; L50-F311 HydrophobicContact CD1-CZ 4.37Å; L53-F311 HydrophobicContact CD1-CZ 4.39Å; Y307-F311 VanDerWaalsContact O-CB 3.28Å; Y307-F311 WeakPolarHBondContact O-CB 3.35Å; Y307-F311 PolarHBondContact O-N 3.16Å; L308-F311 WeakPolarHBondContact O-CB 3.31Å; L308-F311 PolarHBondContact O-N 2.98Å; L308-F311 VanDerWaalsContact O-N 3.1Å; L309-F311 VanDerWaalsContact C-N 3.33Å; L309-F311 PolarHBondContact O-N 3.36Å; F311-Q313 PolarHBondContact O-N 3.37Å; F311-K314 PolarHBondContact O-N 3.49Å; F311-H315 AromaticContact CD2-CD2 3.64Å; F311-H315 AromaticContact CE2-CD2 3.68Å; F311-H315 HydrophobicContact CZ-CB 4.42Å; F311-H315 WeakPolarHBondContact O-CB 3.43Å; F311-H315 PolarHBondContact O-N 3.44Å; F311-I316 HydrophobicContact CE1-CD1 4.46Å
312F80.3Confident69.4Low87 Ų8798.1 Ų98.138%0.38246%0.456SS..Iπ-helixtrans-59.6-46.5174.8-88.4-87.8000111.1L50 L308 L309 K314 I316 A317L50-F312 HydrophobicContact CD2-CE2 4.45Å; L308-F312 HydrophobicContact CD1-CE2 4.44Å; L308-F312 HydrophobicContact CD2-CD2 3.4Å; L308-F312 HydrophobicContact CD2-CE2 3.35Å; L308-F312 HydrophobicContact CG-CD2 3.84Å; L308-F312 HydrophobicContact CG-CE2 3.69Å; L308-F312 VanDerWaalsContact O-CD2 3.25Å; L308-F312 WeakPolarHBondContact O-CD2 3.38Å; L308-F312 PolarHBondContact O-N 3.19Å; L309-F312 PolarHBondContact O-N 3.08Å; F312-K314 PolarHBondContact O-N 3.37Å; F312-I316 HydrophobicContact CD1-CB 4.06Å; F312-I316 HydrophobicContact CD1-CD1 3.26Å; F312-I316 HydrophobicContact CD1-CG1 4.2Å; F312-I316 HydrophobicContact CD1-CG2 4.14Å; F312-I316 HydrophobicContact CE1-CD1 3.29Å; F312-I316 HydrophobicContact CG-CD1 3.94Å; F312-I316 HydrophobicContact CZ-CD1 3.99Å; F312-I316 CarbonylContact O-C 3.51Å; F312-I316 WeakPolarHBondContact O-CA 3.37Å; F312-I316 WeakPolarHBondContact O-CB 3.12Å; F312-I316 PolarHBondContact O-N 3.32Å; F312-A317 PolarHBondContact O-N 2.74Å
313Q77.1Confident68.1Low129 Ų129100 Ų10060%0.60348%0.475SS*.Iπ-helixtrans-61.4-44.1177.1-73.5171.5-9.200112.5L309 V310 F311 K318L309-Q313 WeakPolarHBondContact O-CB 3.38Å; L309-Q313 VanDerWaalsContact O-CG 3.29Å; L309-Q313 WeakPolarHBondContact O-CG 3.42Å; L309-Q313 PolarHBondContact O-N 3.4Å; V310-Q313 PolarHBondContact O-N 3.41Å; F311-Q313 PolarHBondContact O-N 3.37Å; Q313-K318 PolarHBondContact O-N 3.29Å
314K72.6Confident66.6Low139 Ų13997.4 Ų97.460%0.60447%0.473SS*.Iπ-helixtrans-76.7-37.6-174-170.2177.5179.8-176.30113.7V310 F311 F312 K318V310-K314 VanDerWaalsContact O-CB 3.23Å; V310-K314 WeakPolarHBondContact O-CB 3.43Å; V310-K314 PolarHBondContact O-N 2.82Å; F311-K314 PolarHBondContact O-N 3.49Å; F312-K314 PolarHBondContact O-N 3.37Å; K314-K318 VanDerWaalsContact O-CB 3.31Å; K314-K318 WeakPolarHBondContact O-CB 3.49Å
315H70.9Confident64.7Low88 Ų88102.2 Ų102.241%0.40751%0.509SS..Iπ-helixtrans-110.7-31.1-170.5-69.7-79.4000114.2F311 R319F311-H315 AromaticContact CD2-CD2 3.64Å; F311-H315 AromaticContact CE2-CD2 3.68Å; F311-H315 HydrophobicContact CZ-CB 4.42Å; F311-H315 WeakPolarHBondContact O-CB 3.43Å; F311-H315 PolarHBondContact O-N 3.44Å; H315-R319 WeakPolarHBondContact O-CB 3.49Å
316I68.1Low63Low59 Ų59103.3 Ų103.330%0.30352%0.523SS..Iπ-helixtrans-100-55.9-175.4-64.3169.9000109F311 F312 K318 R319 F320F311-I316 HydrophobicContact CE1-CD1 4.46Å; F312-I316 HydrophobicContact CD1-CB 4.06Å; F312-I316 HydrophobicContact CD1-CD1 3.26Å; F312-I316 HydrophobicContact CD1-CG1 4.2Å; F312-I316 HydrophobicContact CD1-CG2 4.14Å; F312-I316 HydrophobicContact CE1-CD1 3.29Å; F312-I316 HydrophobicContact CG-CD1 3.94Å; F312-I316 HydrophobicContact CZ-CD1 3.99Å; F312-I316 CarbonylContact O-C 3.51Å; F312-I316 WeakPolarHBondContact O-CA 3.37Å; F312-I316 WeakPolarHBondContact O-CB 3.12Å; F312-I316 PolarHBondContact O-N 3.32Å; I316-K318 VanDerWaalsContact C-N 3.31Å; I316-K318 PolarHBondContact O-N 3.35Å; I316-R319 PolarHBondContact O-N 2.82Å; I316-F320 HydrophobicContact CG2-CD2 3.64Å; I316-F320 HydrophobicContact CG2-CE2 3.83Å; I316-F320 WeakPolarHBondContact O-CD2 3.17Å; I316-F320 PolarHBondContact O-N 3.12Å
317A61.8Low61Low44 Ų44107.3 Ų107.336%0.36454%0.536SS..Iπ-helixtrans-61.7-37177.700000112.1F312 R319 F320 C321F312-A317 PolarHBondContact O-N 2.74Å; A317-R319 VanDerWaalsContact C-N 3.34Å; A317-R319 PolarHBondContact O-N 2.88Å; A317-F320 PolarHBondContact O-N 2.94Å; A317-C321 WeakPolarHBondContact O-CA 3.2Å; A317-C321 WeakPolarHBondContact O-CB 3.28Å; A317-C321 PolarHBondContact O-N 3.09Å; A317-C321 PolarHBondContact O-SG 3.34Å; A317-C321 VanDerWaalsContact O-SG 3.32Å
318K56.8Low59.3Low153 Ų153112.2 Ų112.267%0.66556%0.562SS**Hα-helixtrans-70.6-25.3175-151.8176.1-174178.20113.9Q313 K314 I316 K322Q313-K318 PolarHBondContact O-N 3.29Å; K314-K318 VanDerWaalsContact O-CB 3.31Å; K314-K318 WeakPolarHBondContact O-CB 3.49Å; I316-K318 VanDerWaalsContact C-N 3.31Å; I316-K318 PolarHBondContact O-N 3.35Å; K318-K322 PolarHBondContact O-N 3.16Å
319R55.4Low57.3Low201 Ų201118.1 Ų118.176%0.75859%0.588SS**Hα-helixtrans-81-42172.4-95.5-178.4167.9177.9-3.9111.5H315 I316 A317 K322 C323H315-R319 WeakPolarHBondContact O-CB 3.49Å; I316-R319 PolarHBondContact O-N 2.82Å; A317-R319 VanDerWaalsContact C-N 3.34Å; A317-R319 PolarHBondContact O-N 2.88Å; R319-K322 WeakPolarHBondContact O-CB 3.36Å; R319-K322 PolarHBondContact O-N 3.31Å; R319-C323 PolarHBondContact O-N 2.82Å
320F53.4Low55.2Low148 Ų148121.6 Ų121.665%0.64960%0.603SS**Hα-helixtrans-70.6-36.4175.5-84.1-83.5000112.4I316 A317 K322 C323 C324I316-F320 HydrophobicContact CG2-CD2 3.64Å; I316-F320 HydrophobicContact CG2-CE2 3.83Å; I316-F320 WeakPolarHBondContact O-CD2 3.17Å; I316-F320 PolarHBondContact O-N 3.12Å; A317-F320 PolarHBondContact O-N 2.94Å; F320-K322 PolarHBondContact O-N 2.85Å; F320-C323 CarbonylContact O-C 3.51Å; F320-C323 WeakPolarHBondContact O-CA 3.46Å; F320-C323 PolarHBondContact O-N 3.01Å; F320-C324 PolarHBondContact O-N 3Å
321C48.4Very low53.1Low75 Ų75122.2 Ų122.251%0.50762%0.615SS.*Hα-helixtrans-68.7-18.9169.8-76.80000113.2A317 C323 C324A317-C321 WeakPolarHBondContact O-CA 3.2Å; A317-C321 WeakPolarHBondContact O-CB 3.28Å; A317-C321 PolarHBondContact O-N 3.09Å; A317-C321 PolarHBondContact O-SG 3.34Å; A317-C321 VanDerWaalsContact O-SG 3.32Å; C321-C323 VanDerWaalsContact C-N 3.32Å; C321-C324 VanDerWaalsContact O-O 3.06Å
322K46.1Very low51.1Low187 Ų187127.1 Ų127.181%0.81365%0.65SS**Hα-helixtrans-75.4-22.2167.3-94.9-172.1173-167.80112.6K318 R319 F320K318-K322 PolarHBondContact O-N 3.16Å; R319-K322 WeakPolarHBondContact O-CB 3.36Å; R319-K322 PolarHBondContact O-N 3.31Å; F320-K322 PolarHBondContact O-N 2.85Å
323C45.7Very low48.9Very low113 Ų113131.8 Ų131.876%0.76467%0.673SS**Hα-helixtrans-92.3-11.3172.4-75.60000113.5R319 F320 C321R319-C323 PolarHBondContact O-N 2.82Å; F320-C323 CarbonylContact O-C 3.51Å; F320-C323 WeakPolarHBondContact O-CA 3.46Å; F320-C323 PolarHBondContact O-N 3.01Å; C321-C323 VanDerWaalsContact C-N 3.32Å
324C39.7Very low47Very low77 Ų77137.3 Ų137.352%0.5269%0.688SS.*  trans-114.794.3172.2-71.20000110.1F320 C321 I326F320-C324 PolarHBondContact O-N 3Å; C321-C324 VanDerWaalsContact O-O 3.06Å; C324-I326 PolarHBondContact O-N 2.85Å
325S33.8Very low45.2Very low117 Ų117135.5 Ų135.582%0.81870%0.699SS**THydrogen-bonded Turntrans-70.137.2171.659.50000113.5
326I43.1Very low43.5Very low152 Ų152136.1 Ų136.178%0.77971%0.713SS**THydrogen-bonded Turntrans-122.7-10.1-175.9-64.8-178.1000112.4C324C324-I326 PolarHBondContact O-N 2.85Å
327F36.4Very low42.2Very low174 Ų174138.5 Ų138.576%0.76374%0.735SS**  trans-116.131.5-179.9-122.8-85.5000114.5
328Q41.5Very low41Very low188 Ų188142.7 Ų142.788%0.87976%0.756SS**  trans-101.360.3172.6-158.6170.2-15.100110.6
329Q37.3Very low39.9Very low158 Ų158145.1 Ų145.174%0.73876%0.763SS**  trans-163.4118.6169.3-152.11613.200105.2
330E33.9Very low38.8Very low163 Ų163141.8 Ų141.876%0.76277%0.765SS**  cis-143.5142.314.5-96.4148.2-171.200107.9
331A34.5Very low37.7Very low88 Ų88144.6 Ų144.673%0.72777%0.771SS**PPolyproline II helixtrans-79.3129158.700000107.4E333A331-E333 PolarHBondContact O-N 3.42Å
332P36.7Very low36.9Very low129 Ų129146.5 Ų146.584%0.83879%0.785SS**PPolyproline II helixtrans-66.5127.6170.317.1-14.4000108.6
333E34.5Very low36.4Very low186 Ų186143 Ų14387%0.86978%0.78SS**PPolyproline II helixtrans-49.8142.8-175.8-64.9175.3144.700112.4A331 A335A331-E333 PolarHBondContact O-N 3.42Å; E333-A335 PolarHBondContact O-N 3.13Å
334R36.2Very low35.8Very low244 Ų244141.1 Ų141.192%0.92178%0.779SS**  trans-55.7108.6160.2-82.5175.4173164.2-3.2107.5S336R334-S336 PolarHBondContact O-N 3.4Å
335A35.4Very low35.5Very low102 Ų102146.3 Ų146.384%0.84380%0.796SS**  trans-55.2114.1164.200000108.2E333E333-A335 PolarHBondContact O-N 3.13Å
336S35.5Very low35.4Very low100 Ų100150.1 Ų150.170%0.69980%0.801SS**  trans-60.7144.9177.8370000111R334 V338R334-S336 PolarHBondContact O-N 3.4Å; S336-V338 PolarHBondContact O-N 3.5Å
337S39.7Very low35.1Very low109 Ų109151 Ų15176%0.76280%0.802SS**  trans-46.8118.6167.650.30000112.4
338V36.7Very low35Very low133 Ų133150.9 Ų150.981%0.80681%0.807SS**  trans-94.699.9156.2179.30000107.3S336S336-V338 PolarHBondContact O-N 3.5Å
339Y33.1Very low34.8Very low204 Ų204146.7 Ų146.780%0.880%0.798SS**  trans-81.8104.8169.7-154-87000106.8R341Y339-R341 HydrophobicContact CD1-CB 4.41Å; Y339-R341 PolarHBondContact O-N 3.25Å
340T33Very low34.7Very low131 Ų131146.2 Ų146.280%0.80481%0.806SS**  trans-82.698.3172.6-350000108.4
341R31.1Very low34.9Very low206 Ų206141.5 Ų141.578%0.77780%0.801SS**  trans-89.6112.1167.7-170.9178.6-175.9165.91.3107.4Y339Y339-R341 HydrophobicContact CD1-CB 4.41Å; Y339-R341 PolarHBondContact O-N 3.25Å
342S30Very low34.9Very low116 Ų116149.4 Ų149.481%0.81183%0.83SS**  trans-106.4116.9167.5175.20000107.9
343T37.3Very low34.8Very low113 Ų113150.5 Ų150.569%0.69383%0.83SS**  trans-142.7120.1168.235.70000108.5
344G31.5Very low34.8Very low73 Ų73148.6 Ų148.675%0.75383%0.828SS**  trans65.3148.7155.200000116.8
345E33.6Very low34.7Very low187 Ų187143.3 Ų143.387%0.87482%0.822SS**  cis176.8136.1-0.3-124.5171-179.400103
346Q32.6Very low34.7Very low196 Ų196145.7 Ų145.792%0.91682%0.821SS**  trans-179.1137.1134.6-102.7170.7-15.500112.8
347E36.7Very low34.6Very low171 Ų171148.6 Ų148.680%0.79983%0.829SS**  trans-47.2156-178.2-61.6162.8143.300116.3
348I34.6Very low34.3Very low172 Ų172151.2 Ų151.288%0.88283%0.833SS**  -160.1132.8124-89.2146.5000109.3
349S36.9Very low34.1Very low99 Ų99152.5 Ų152.569%0.69284%0.835SS**  trans-71.7172.1-176.5-56.50000116.1
350V36Very low34.2Very low148 Ų148148.5 Ų148.590%0.89784%0.838SS**  trans107.6116.1145.5-166.70000116.8
351G37.4Very low34.3Very low64 Ų64150 Ų15066%0.6684%0.841SS**  133.797.712600000118.2
352L33.6Very low34.6Very low255 Ų255144.9 Ų144.9100%1.33585%0.847SS**  trans72.80158.8-82.6117.3000120.2

Retrieved 352 of 352 residues in 366.7 ms (Link to these results)