A0A087Y8M3_POEFO Loading...

Replication factor C subunit 3

Subunit of the replication factor C (RFC) complex which acts during elongation of primed DNA templates by DNA polymerases delta and epsilon, and is necessary for ATP-dependent loading of proliferating cell nuclear antigen (PCNA) onto primed DNA.

AlphaFold DB , UniProt , Accession A0A087Y8M3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 356 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
1M50.9Low84.9Confident245 Ų24579 Ų79100%1.20740%0.4SS*.  0127.10-83.8172.1-141.100107.5
2S75.9Confident85.4Confident79 Ų7974.8 Ų74.855%0.55238%0.384SS*.  trans-78.3138.5172.646.20000109.6
3L88.7Confident85.6Confident84 Ų8469.4 Ų69.444%0.4436%0.356SS..  trans-58.4148.2172.7-66.1169.4000110L5 D6 K7 L228L3-L5 HydrophobicContact CB-CB 4.47Å; L3-L5 PolarHBondContact O-N 3.37Å; L3-D6 PolarHBondContact O-N 3.46Å; L3-D6 VanDerWaalsContact O-N 3.1Å; L3-K7 PolarHBondContact O-N 3.19Å; L3-L228 HydrophobicContact CD1-CD2 4.49Å
4W89.1Confident85.8Confident15 Ų1569.6 Ų69.66%0.05738%0.384CS..Hα-helixtrans-60.3-32.7179.7-67.83.4000112.1D6 K7 Y8 V199 E203 L205 E231 R234W4-D6 VanDerWaalsContact C-N 3.28Å; W4-D6 PolarHBondContact O-N 3.23Å; W4-K7 PolarHBondContact O-N 3.18Å; W4-Y8 HydrophobicContact CB-CD2 4.05Å; W4-Y8 HydrophobicContact CB-CE2 4.42Å; W4-Y8 HydrophobicContact CG-CD2 4.46Å; W4-Y8 HydrophobicContact CG-CE2 4.35Å; W4-Y8 WeakPolarHBondContact O-CB 3.29Å; W4-Y8 WeakPolarHBondContact O-CD2 3Å; W4-Y8 PolarHBondContact O-N 3.38Å; W4-V199 HydrophobicContact CB-CG1 4.46Å; W4-V199 HydrophobicContact CD2-CG1 4.4Å; W4-V199 HydrophobicContact CE3-CG1 3.92Å; W4-E203 HydrophobicContact CD2-CG 4.33Å; W4-E203 HydrophobicContact CZ2-CG 4.22Å; W4-L205 HydrophobicContact CH2-CD1 3.54Å; W4-L205 HydrophobicContact CZ2-CD1 4.03Å; W4-L205 HydrophobicContact CZ3-CD1 4.37Å; W4-E231 HydrophobicContact CD2-CB 4.22Å; W4-E231 HydrophobicContact CD2-CG 4.1Å; W4-E231 HydrophobicContact CE3-CB 4.09Å; W4-E231 HydrophobicContact CE3-CG 4.45Å; W4-E231 HydrophobicContact CG-CG 4.35Å; W4-E231 HydrophobicContact CZ2-CG 4.37Å; W4-E231 HydrophobicContact CZ3-CB 4.33Å; W4-E231 PolarHBondContact N-OE2 3.33Å; W4-E231 VanDerWaalsContact N-OE2 3.09Å; W4-R234 HydrophobicContact CH2-CB 4.13Å; W4-R234 VanDerWaalsContact CH2-CD 3.42Å; W4-R234 HydrophobicContact CH2-CG 4.39Å
5L88.8Confident86.1Confident42 Ų4274.1 Ų74.122%0.2240%0.398CS..Hα-helixtrans-50.6-46.1174.7179.769000112.6L3 R224 L227L3-L5 HydrophobicContact CB-CB 4.47Å; L3-L5 PolarHBondContact O-N 3.37Å; L5-R224 HydrophobicContact CD1-CB 4.25Å; L5-R224 HydrophobicContact CD1-CG 3.96Å; L5-R224 HydrophobicContact CD2-CG 3.7Å; L5-R224 HydrophobicContact CG-CG 4.5Å; L5-L227 HydrophobicContact CD1-CD1 3.9Å
6D87.8Confident86.4Confident96 Ų9670.1 Ų70.151%0.51338%0.376SS..Hα-helixtrans-86.8-35.8-177.5-68.5-38.5000111.6L3 W4 Y8L3-D6 PolarHBondContact O-N 3.46Å; L3-D6 VanDerWaalsContact O-N 3.1Å; W4-D6 VanDerWaalsContact C-N 3.28Å; W4-D6 PolarHBondContact O-N 3.23Å; D6-Y8 PolarHBondContact O-N 3.45Å
7K90.3Very high86.5Confident109 Ų10969.7 Ų69.747%0.47437%0.374SS..Hα-helixtrans-63.2-41179.7-174-178.8176.1-169.70112.6L3 W4 E203L3-K7 PolarHBondContact O-N 3.19Å; W4-K7 PolarHBondContact O-N 3.18Å; K7-E203 IonicContact NZ-OE1 3.14Å; K7-E203 PolarHBondContact NZ-OE1 2.92Å
8Y90.6Very high86.7Confident44 Ų4466.5 Ų66.517%0.17336%0.356CS..THydrogen-bonded Turntrans-100.65.5-175.7-66.6-67.7000113.9W4 D6 P10 V199 K202 E203W4-Y8 HydrophobicContact CB-CD2 4.05Å; W4-Y8 HydrophobicContact CB-CE2 4.42Å; W4-Y8 HydrophobicContact CG-CD2 4.46Å; W4-Y8 HydrophobicContact CG-CE2 4.35Å; W4-Y8 WeakPolarHBondContact O-CB 3.29Å; W4-Y8 WeakPolarHBondContact O-CD2 3Å; W4-Y8 PolarHBondContact O-N 3.38Å; D6-Y8 PolarHBondContact O-N 3.45Å; Y8-P10 WeakPolarHBondContact O-CD 3.44Å; Y8-V199 HydrophobicContact CD2-CG1 3.61Å; Y8-V199 HydrophobicContact CD2-CG2 4.4Å; Y8-V199 HydrophobicContact CE2-CG1 3.91Å; Y8-V199 HydrophobicContact CG-CG1 4.21Å; Y8-V199 HydrophobicContact CG-CG2 4.19Å; Y8-K202 HydrophobicContact CD1-CB 4.36Å; Y8-K202 HydrophobicContact CD1-CD 3.66Å; Y8-K202 HydrophobicContact CE1-CB 3.49Å; Y8-K202 VanDerWaalsContact CE1-CB 3.49Å; Y8-K202 HydrophobicContact CE1-CD 3.57Å; Y8-K202 HydrophobicContact CE1-CG 4.15Å; Y8-K202 PolarHBondContact OH-O 2.97Å; Y8-E203 HydrophobicContact CE2-CG 3.78Å; Y8-E203 VanDerWaalsContact CE2-OE1 3.3Å; Y8-E203 WeakPolarHBondContact CE2-OE1 3.34Å; Y8-E203 VanDerWaalsContact OH-CD 3.28Å; Y8-E203 WeakPolarHBondContact OH-CG 2.79Å; Y8-E203 PolarHBondContact OH-OE1 2.75Å
9R90.8Very high86.9Confident81 Ų8165.5 Ų65.531%0.30635%0.349SS..  trans-59124.1177.1-172.1171.4178.4-168.5-9.6110.4T11 K49 T50 M53R9-T11 PolarHBondContact O-N 2.99Å; R9-K49 PolarHBondContact NH2-O 3.43Å; R9-T50 HydrophobicContact CG-CG2 3.8Å; R9-T50 PolarHBondContact NE-OG1 3.11Å; R9-M53 VanDerWaalsContact NH2-CG 3.31Å
10P91.3Very high87.2Confident25 Ų2569.6 Ų69.616%0.16236%0.364CS..  trans-57.2136.6174.3-26.934000111.7Y8 T50 C54Y8-P10 WeakPolarHBondContact O-CD 3.44Å; P10-T50 HydrophobicContact CB-CG2 4.25Å; P10-T50 HydrophobicContact CG-CG2 4.41Å; P10-C54 PolarHBondContact O-SG 2.9Å; P10-C54 VanDerWaalsContact O-SG 3.35Å
11T89.3Confident87.5Confident49 Ų4973.4 Ų73.430%0.30138%0.38SS..  trans-104.9-15.9-179.255.80000113.9R9 R57R9-T11 PolarHBondContact O-N 2.99Å; T11-R57 VanDerWaalsContact CB-NH1 3.26Å; T11-R57 WeakPolarHBondContact O-CD 3.45Å; T11-R57 PolarHBondContact OG1-NH1 3.01Å
12S91Very high89.4Confident29 Ų2963.3 Ų63.320%0.20333%0.329CS..SBendtrans-130.1150.7-177.8-49.20000110.5G14 K15S12-G14 PolarHBondContact O-N 3.02Å; S12-K15 PolarHBondContact O-N 3.2Å
13L88.8Confident90.2Very high4 Ų459.8 Ų59.82%0.02131%0.305CS..G310 helixtrans-63.1-33.1-178.2-61.5178.5000111.9K15 L16 A23 L26 K27 C54 L55 E58L13-K15 PolarHBondContact O-N 2.87Å; L13-L16 HydrophobicContact CB-CD1 4.16Å; L13-L16 HydrophobicContact CD2-CD1 3.65Å; L13-L16 WeakPolarHBondContact O-CB 3.37Å; L13-L16 WeakPolarHBondContact O-CD1 3.35Å; L13-L16 PolarHBondContact O-N 3.39Å; L13-A23 HydrophobicContact CB-CB 4.5Å; L13-L26 HydrophobicContact CD1-CB 3.85Å; L13-K27 HydrophobicContact CD1-CB 4.08Å; L13-C54 HydrophobicContact CD2-CB 3.45Å; L13-C54 VanDerWaalsContact CD2-CB 3.45Å; L13-C54 HydrophobicContact CG-CB 3.98Å; L13-L55 HydrophobicContact CD1-CD1 4.37Å; L13-E58 WeakPolarHBondContact CB-OE1 3.5Å; L13-E58 VanDerWaalsContact CD1-OE2 3.23Å; L13-E58 WeakPolarHBondContact CD1-OE2 3.43Å; L13-E58 HydrophobicContact CG-CG 4.44Å; L13-E58 WeakPolarHBondContact CG-OE1 3.49Å; L13-E58 PolarHBondContact N-OE1 3.44Å
14G88.1Confident90.4Very high73 Ų7359.5 Ų59.575%0.75331%0.307SS*.G310 helixtrans-67.6-15.717500000115.1S12S12-G14 PolarHBondContact O-N 3.02Å
15K89.8Confident90.6Very high137 Ų13764.3 Ų64.360%0.59633%0.33SS*.G310 helixtrans-100.58178.2-64.7-176.2179.7-179.90112.8S12 L13 D17S12-K15 PolarHBondContact O-N 3.2Å; L13-K15 PolarHBondContact O-N 2.87Å; K15-D17 PolarHBondContact O-N 3.31Å
16L91.1Very high90.7Very high9 Ų962.9 Ų62.95%0.04732%0.323CS..  trans-66.6131175.5-80.8157.7000110.2L13 A23 R51L13-L16 HydrophobicContact CB-CD1 4.16Å; L13-L16 HydrophobicContact CD2-CD1 3.65Å; L13-L16 WeakPolarHBondContact O-CB 3.37Å; L13-L16 WeakPolarHBondContact O-CD1 3.35Å; L13-L16 PolarHBondContact O-N 3.39Å; L16-A23 HydrophobicContact CB-CB 4.42Å; L16-A23 HydrophobicContact CD1-CB 3.54Å; L16-R51 HydrophobicContact CD1-CG 4.33Å; L16-R51 HydrophobicContact CD2-CG 4.01Å
17D88.1Confident90.9Very high64 Ų6462.7 Ų62.734%0.34232%0.317SS..SBendtrans-75-27.7-175-53.3-63000112.7K15 I195K15-D17 PolarHBondContact O-N 3.31Å; D17-I195 HydrophobicContact CB-CD1 3.91Å; D17-I195 HydrophobicContact CB-CG1 3.69Å
18Y91Very high90.9Very high12 Ų1261.3 Ų61.35%0.04732%0.315CS..SBendtrans-142.3160-173.763.7-77.7000113.2A46 G47 R51 P187 I195 L223Y18-A46 PolarHBondContact OH-O 3.11Å; Y18-G47 WeakPolarHBondContact OH-CA 3.24Å; Y18-R51 PolarHBondContact O-NH2 2.98Å; Y18-R51 PolarHBondContact OH-NH1 2.85Å; Y18-P187 HydrophobicContact CD2-CB 3.82Å; Y18-P187 HydrophobicContact CE2-CB 4.02Å; Y18-P187 HydrophobicContact CE2-CG 4.28Å; Y18-P187 HydrophobicContact CG-CB 4.19Å; Y18-I195 HydrophobicContact CD1-CD1 3.69Å; Y18-I195 HydrophobicContact CE1-CD1 4.15Å; Y18-L223 HydrophobicContact CE1-CD2 3.81Å
19H90.8Very high90.9Very high47 Ų4760.8 Ų60.822%0.21832%0.315CS..  trans51.754.4-169.5-53.1-57.9000113.5E21 Q22 A23 R51H19-E21 VanDerWaalsContact C-N 3.26Å; H19-E21 PolarHBondContact O-N 3.49Å; H19-Q22 HydrophobicContact CB-CB 4.23Å; H19-Q22 PolarHBondContact O-N 3.31Å; H19-A23 PolarHBondContact O-N 3.17Å; H19-A23 VanDerWaalsContact O-N 3.09Å; H19-R51 PolarHBondContact CD2-NH2 3.41Å
20K91.6Very high90.8Very high148 Ų14857.7 Ų57.764%0.64331%0.305SS*.Hα-helixtrans-61.5-31.5-177.6-63.2-178.1-178.6176.10113.6A23 T24K20-A23 WeakPolarHBondContact O-CB 3.36Å; K20-A23 PolarHBondContact O-N 3.19Å; K20-T24 PolarHBondContact O-N 3.32Å; K20-T24 PolarHBondContact O-OG1 3.05Å
21E93Very high90.6Very high150 Ų15062.6 Ų62.670%0.70133%0.326SS*.Hα-helixtrans-65.4-48.1176.8-165.3-178.8-17100111.3H19 A23 T24 Q25H19-E21 VanDerWaalsContact C-N 3.26Å; H19-E21 PolarHBondContact O-N 3.49Å; E21-A23 VanDerWaalsContact C-N 3.29Å; E21-A23 PolarHBondContact O-N 2.98Å; E21-T24 WeakPolarHBondContact O-CB 3.46Å; E21-T24 PolarHBondContact O-N 3.06Å; E21-T24 VanDerWaalsContact O-N 3.07Å; E21-Q25 WeakPolarHBondContact O-CG 3.39Å; E21-Q25 PolarHBondContact O-N 3.28Å
22Q92.4Very high90.2Very high32 Ų3265.1 Ų65.115%0.1535%0.345CS..Hα-helixtrans-60.5-38.9173.5178.6174.96900111.8H19 T24 Q25 L26 R183H19-Q22 HydrophobicContact CB-CB 4.23Å; H19-Q22 PolarHBondContact O-N 3.31Å; Q22-T24 VanDerWaalsContact C-N 3.27Å; Q22-T24 PolarHBondContact O-N 3.29Å; Q22-Q25 PolarHBondContact O-N 2.98Å; Q22-L26 HydrophobicContact CG-CD1 4.3Å; Q22-L26 HydrophobicContact CG-CG 4.49Å; Q22-L26 WeakPolarHBondContact O-CG 3.4Å; Q22-L26 PolarHBondContact O-N 2.88Å; Q22-R183 PolarHBondContact NE2-O 3.1Å
23A91.9Very high89.4Confident6 Ų665.3 Ų65.35%0.0535%0.351CS..Hα-helixtrans-60.2-39.517500000111.9L13 L16 H19 K20 E21 L26 K27L13-A23 HydrophobicContact CB-CB 4.5Å; L16-A23 HydrophobicContact CB-CB 4.42Å; L16-A23 HydrophobicContact CD1-CB 3.54Å; H19-A23 PolarHBondContact O-N 3.17Å; H19-A23 VanDerWaalsContact O-N 3.09Å; K20-A23 WeakPolarHBondContact O-CB 3.36Å; K20-A23 PolarHBondContact O-N 3.19Å; E21-A23 VanDerWaalsContact C-N 3.29Å; E21-A23 PolarHBondContact O-N 2.98Å; A23-L26 PolarHBondContact O-N 3.36Å; A23-K27 WeakPolarHBondContact O-CB 3.2Å; A23-K27 PolarHBondContact O-N 3Å
24T92.7Very high89.1Confident77 Ų7770 Ų7047%0.47238%0.376SS..Hα-helixtrans-68.2-41.8177.4-52.30000111.4K20 E21 Q22 L26 K27 N28K20-T24 PolarHBondContact O-N 3.32Å; K20-T24 PolarHBondContact O-OG1 3.05Å; E21-T24 WeakPolarHBondContact O-CB 3.46Å; E21-T24 PolarHBondContact O-N 3.06Å; E21-T24 VanDerWaalsContact O-N 3.07Å; Q22-T24 VanDerWaalsContact C-N 3.27Å; Q22-T24 PolarHBondContact O-N 3.29Å; T24-L26 PolarHBondContact O-N 2.9Å; T24-K27 WeakPolarHBondContact O-CB 3.47Å; T24-K27 PolarHBondContact O-N 3.2Å; T24-N28 VanDerWaalsContact O-CG 3.24Å; T24-N28 PolarHBondContact O-N 3.49Å; T24-N28 PolarHBondContact O-OD1 3.42Å
25Q92.5Very high89.2Confident116 Ų11666.7 Ų66.754%0.54234%0.341SS..Hα-helixtrans-61.3-43.3174.4-68.1173.4-2.800112E21 Q22 K27 N28 L29E21-Q25 WeakPolarHBondContact O-CG 3.39Å; E21-Q25 PolarHBondContact O-N 3.28Å; Q22-Q25 PolarHBondContact O-N 2.98Å; Q25-K27 VanDerWaalsContact C-N 3.33Å; Q25-K27 PolarHBondContact O-N 3.3Å; Q25-N28 PolarHBondContact O-N 3.46Å; Q25-L29 WeakPolarHBondContact O-CB 3.41Å; Q25-L29 PolarHBondContact O-N 3.3Å
26L92Very high89.3Confident13 Ų1361.8 Ų61.87%0.06832%0.323CS..Hα-helixtrans-63.8-38175.6-72.8175.2000112.1L13 Q22 A23 T24 L29 V30 L55 V182L13-L26 HydrophobicContact CD1-CB 3.85Å; Q22-L26 HydrophobicContact CG-CD1 4.3Å; Q22-L26 HydrophobicContact CG-CG 4.49Å; Q22-L26 WeakPolarHBondContact O-CG 3.4Å; Q22-L26 PolarHBondContact O-N 2.88Å; A23-L26 PolarHBondContact O-N 3.36Å; T24-L26 PolarHBondContact O-N 2.9Å; L26-L29 WeakPolarHBondContact O-CB 3.29Å; L26-L29 PolarHBondContact O-N 3.21Å; L26-V30 WeakPolarHBondContact O-CG2 3.48Å; L26-V30 PolarHBondContact O-N 3.37Å; L26-L55 HydrophobicContact CB-CD1 4.18Å; L26-L55 HydrophobicContact CD2-CD1 4.41Å; L26-V182 HydrophobicContact CD2-CG1 4.31Å; L26-V182 HydrophobicContact CD2-CG2 4.17Å
27K91.4Very high89.5Confident91 Ų9161.7 Ų61.740%0.39632%0.323SS..Hα-helixtrans-63.5-45.3174.9-174.8176.9-177.7-174.10111.6L13 A23 T24 Q25 L29 V30 Q31L13-K27 HydrophobicContact CD1-CB 4.08Å; A23-K27 WeakPolarHBondContact O-CB 3.2Å; A23-K27 PolarHBondContact O-N 3Å; T24-K27 WeakPolarHBondContact O-CB 3.47Å; T24-K27 PolarHBondContact O-N 3.2Å; Q25-K27 VanDerWaalsContact C-N 3.33Å; Q25-K27 PolarHBondContact O-N 3.3Å; K27-L29 VanDerWaalsContact C-N 3.3Å; K27-L29 PolarHBondContact O-N 3.04Å; K27-V30 PolarHBondContact O-N 3.08Å; K27-Q31 WeakPolarHBondContact O-CG 3.43Å; K27-Q31 PolarHBondContact O-N 2.96Å
28N91.3Very high89.8Confident80 Ų8058.7 Ų58.743%0.42831%0.306SS..Hα-helixtrans-62.7-39176.7-65.5-10.8000111.3T24 Q25 V30 Q31 C32T24-N28 VanDerWaalsContact O-CG 3.24Å; T24-N28 PolarHBondContact O-N 3.49Å; T24-N28 PolarHBondContact O-OD1 3.42Å; Q25-N28 PolarHBondContact O-N 3.46Å; N28-V30 VanDerWaalsContact C-N 3.32Å; N28-V30 PolarHBondContact O-N 3.42Å; N28-Q31 PolarHBondContact O-N 3.23Å; N28-Q31 VanDerWaalsContact O-N 3.13Å; N28-C32 PolarHBondContact O-N 3.42Å; N28-C32 VanDerWaalsContact O-N 3.14Å; N28-C32 PolarHBondContact O-SG 2.96Å; N28-C32 VanDerWaalsContact O-SG 3.4Å
29L90.9Very high90.1Very high34 Ų3458.1 Ų58.118%0.17830%0.304CS..Hα-helixtrans-59-41.3176.6-177.369.5000112.4Q25 L26 K27 Q31 C32 P36 L38 L180Q25-L29 WeakPolarHBondContact O-CB 3.41Å; Q25-L29 PolarHBondContact O-N 3.3Å; L26-L29 WeakPolarHBondContact O-CB 3.29Å; L26-L29 PolarHBondContact O-N 3.21Å; K27-L29 VanDerWaalsContact C-N 3.3Å; K27-L29 PolarHBondContact O-N 3.04Å; L29-Q31 VanDerWaalsContact C-N 3.29Å; L29-Q31 PolarHBondContact O-N 3.25Å; L29-C32 PolarHBondContact O-N 3.46Å; L29-P36 HydrophobicContact CD1-CG 4.08Å; L29-L38 HydrophobicContact CD2-CD2 3.88Å; L29-L180 HydrophobicContact CD1-CD1 4.19Å; L29-L180 HydrophobicContact CD2-CD1 4.47Å
30V87.9Confident90.4Very high15 Ų1556.2 Ų56.29%0.09130%0.296CS..Hα-helixtrans-68.2-30.8177.8172.60000112.1L26 K27 N28 F35 L55 E58 L59 R127L26-V30 WeakPolarHBondContact O-CG2 3.48Å; L26-V30 PolarHBondContact O-N 3.37Å; K27-V30 PolarHBondContact O-N 3.08Å; N28-V30 VanDerWaalsContact C-N 3.32Å; N28-V30 PolarHBondContact O-N 3.42Å; V30-F35 HydrophobicContact CG2-CE2 4.49Å; V30-L55 HydrophobicContact CG2-CD1 3.31Å; V30-L55 HydrophobicContact CG2-CG 4.05Å; V30-E58 HydrophobicContact CG1-CB 4.27Å; V30-L59 HydrophobicContact CB-CD2 4.44Å; V30-L59 HydrophobicContact CG1-CD2 3.72Å; V30-L59 HydrophobicContact CG1-CG 3.9Å; V30-L59 HydrophobicContact CG2-CD2 4.22Å; V30-L59 HydrophobicContact CG2-CG 4.04Å; V30-R127 PolarHBondContact O-NH2 2.7Å
31Q86.4Confident90.6Very high128 Ų12851.7 Ų51.760%0.59828%0.275SS*.Hα-helixtrans-74.3-31.8179.1-69.1177.7-5.600112.8K27 N28 L29 G33K27-Q31 WeakPolarHBondContact O-CG 3.43Å; K27-Q31 PolarHBondContact O-N 2.96Å; N28-Q31 PolarHBondContact O-N 3.23Å; N28-Q31 VanDerWaalsContact O-N 3.13Å; L29-Q31 VanDerWaalsContact C-N 3.29Å; L29-Q31 PolarHBondContact O-N 3.25Å; Q31-G33 PolarHBondContact O-N 2.89Å
32C81.4Confident90.6Very high103 Ų10344.8 Ų44.870%0.69624%0.244SC*.THydrogen-bonded Turntrans-67.36.9-175.4-75.70000116.4N28 L29 D34N28-C32 PolarHBondContact O-N 3.42Å; N28-C32 VanDerWaalsContact O-N 3.14Å; N28-C32 PolarHBondContact O-SG 2.96Å; N28-C32 VanDerWaalsContact O-SG 3.4Å; L29-C32 PolarHBondContact O-N 3.46Å; C32-D34 PolarHBondContact O-N 3.29Å
33G74.1Confident90.6Very high33 Ų3345.9 Ų45.934%0.3425%0.254SS..SBendtrans82.6-49.3167.900000115.2Q31 R127Q31-G33 PolarHBondContact O-N 2.89Å; G33-R127 PolarHBondContact O-NH1 3.18Å
34D83.1Confident90.6Very high102 Ų10248.5 Ų48.555%0.54527%0.272SS..  trans-96.2113.6174.9-172.921.7000111C32 P36 R160C32-D34 PolarHBondContact O-N 3.29Å; D34-P36 WeakPolarHBondContact O-CD 3.5Å; D34-R160 IonicContact OD1-CZ 3.27Å; D34-R160 IonicContact OD1-NH1 2.96Å; D34-R160 PolarHBondContact OD1-NH1 2.96Å; D34-R160 IonicContact OD1-NH2 3.28Å; D34-R160 PolarHBondContact OD1-NH2 2.99Å
35F89Confident90.4Very high4 Ų445.3 Ų45.32%0.01826%0.255CS..  trans-99.2106.2-175.4-177.3-98.2000110.8V30 L38 L55 L59 F129 R160 I162V30-F35 HydrophobicContact CG2-CE2 4.49Å; F35-L38 HydrophobicContact CE1-CD1 4.23Å; F35-L38 HydrophobicContact CE1-CG 4.45Å; F35-L38 HydrophobicContact CE2-CD1 3.81Å; F35-L38 HydrophobicContact CZ-CD1 3.35Å; F35-L38 HydrophobicContact CZ-CG 3.98Å; F35-L55 HydrophobicContact CE2-CD1 4.46Å; F35-L55 HydrophobicContact CE2-CD2 3.79Å; F35-L55 HydrophobicContact CE2-CG 4.24Å; F35-L55 HydrophobicContact CZ-CD2 3.65Å; F35-L55 HydrophobicContact CZ-CG 4.45Å; F35-L59 HydrophobicContact CD2-CD1 4.14Å; F35-L59 HydrophobicContact CD2-CD2 4.08Å; F35-L59 HydrophobicContact CE1-CD1 4.29Å; F35-L59 HydrophobicContact CE2-CD1 3.77Å; F35-L59 HydrophobicContact CE2-CD2 4.49Å; F35-L59 HydrophobicContact CG-CD2 4.39Å; F35-L59 HydrophobicContact CZ-CD1 3.83Å; F35-F129 HydrophobicContact CB-CE1 4.11Å; F35-F129 HydrophobicContact CB-CE2 4.37Å; F35-F129 HydrophobicContact CB-CZ 3.56Å; F35-F129 AromaticContact CD1-CE2 3.99Å; F35-F129 HydrophobicContact CD1-CE2 3.99Å; F35-F129 HydrophobicContact CD1-CZ 4.02Å; F35-F129 HydrophobicContact CG-CE2 4.44Å; F35-F129 HydrophobicContact CG-CZ 4.02Å; F35-R160 HydrophobicContact CD1-CB 3.98Å; F35-R160 HydrophobicContact CD1-CG 4.15Å; F35-R160 HydrophobicContact CE1-CB 4.36Å; F35-R160 WeakPolarHBondContact O-CD 3.29Å; F35-R160 PolarHBondContact O-NE 3.48Å; F35-R160 PolarHBondContact O-NH1 2.96Å; F35-I162 HydrophobicContact CE1-CD1 4.41Å; F35-I162 HydrophobicContact CE1-CG1 4.39Å; F35-I162 HydrophobicContact CZ-CD1 4.16Å; F35-I162 HydrophobicContact CZ-CG1 4.48Å
36P92.6Very high90.4Very high34 Ų3439.8 Ų39.822%0.22123%0.229CC..  trans-68.8166.9-177.630.1-36000112.3L29 D34 L180L29-P36 HydrophobicContact CD1-CG 4.08Å; D34-P36 WeakPolarHBondContact O-CD 3.5Å; P36-L180 HydrophobicContact CB-CB 4.46Å; P36-L180 HydrophobicContact CG-CB 4.08Å; P36-L180 HydrophobicContact CG-CD1 4.13Å
37H94.6Very high90.4Very high7 Ų739.9 Ų39.93%0.03223%0.233CC..  trans-61.9139.1164.3-59.2-70.4000109.3M152 L161 C179 L180H37-M152 HydrophobicContact CB-CE 3.88Å; H37-L161 CarbonylContact C-O 3.6Å; H37-L161 WeakPolarHBondContact CA-O 3.23Å; H37-L161 PolarHBondContact ND1-N 3.27Å; H37-C179 HydrophobicContact CB-CB 4.47Å; H37-C179 CarbonylContact O-C 3.22Å; H37-C179 VanDerWaalsContact O-CA 3.3Å; H37-C179 WeakPolarHBondContact O-CA 3.26Å; H37-L180 PolarHBondContact O-N 3.03Å
38L95.9Very high90.5Very high0 Ų036.4 Ų36.40%022%0.218CC..EExtended strand (participates in β ladder)trans-112.7141.3-179.8-66176.1000111.4L29 F35 V40 L55 L161 I162 L163 L180 V182L29-L38 HydrophobicContact CD2-CD2 3.88Å; F35-L38 HydrophobicContact CE1-CD1 4.23Å; F35-L38 HydrophobicContact CE1-CG 4.45Å; F35-L38 HydrophobicContact CE2-CD1 3.81Å; F35-L38 HydrophobicContact CZ-CD1 3.35Å; F35-L38 HydrophobicContact CZ-CG 3.98Å; L38-V40 HydrophobicContact CB-CG2 4.5Å; L38-L55 HydrophobicContact CD1-CD2 3.38Å; L38-L161 PolarHBondContact N-O 3.4Å; L38-I162 HydrophobicContact CB-CG1 4.31Å; L38-I162 HydrophobicContact CB-CG2 4.38Å; L38-I162 HydrophobicContact CD1-CD1 4.47Å; L38-I162 HydrophobicContact CD1-CG1 4.47Å; L38-I162 CarbonylContact O-C 3.45Å; L38-I162 WeakPolarHBondContact O-CA 3.46Å; L38-L163 PolarHBondContact O-N 3.02Å; L38-L180 WeakPolarHBondContact CA-O 3.35Å; L38-L180 HydrophobicContact CD2-CB 3.88Å; L38-L180 HydrophobicContact CD2-CD2 3.67Å; L38-L180 HydrophobicContact CD2-CG 4.27Å; L38-V182 HydrophobicContact CD2-CG2 4.05Å
39L96.3Very high90.6Very high0 Ų036.5 Ų36.50%021%0.214CC..EExtended strand (participates in β ladder)trans-117.2101.5165.6174.663.9000108.5Y41 L163 T168 L176 C179 L180 A181 V182L39-Y41 HydrophobicContact CG-CD1 4.43Å; L39-L163 CarbonylContact C-O 3.55Å; L39-L163 WeakPolarHBondContact CA-O 3.22Å; L39-L163 HydrophobicContact CD1-CB 3.61Å; L39-L163 HydrophobicContact CD1-CD1 4.49Å; L39-T168 HydrophobicContact CD2-CG2 4.18Å; L39-L176 HydrophobicContact CD2-CD2 3.22Å; L39-C179 HydrophobicContact CB-CB 3.76Å; L39-L180 PolarHBondContact N-O 3.14Å; L39-A181 CarbonylContact O-C 3.59Å; L39-A181 WeakPolarHBondContact O-CA 3.36Å; L39-V182 PolarHBondContact O-N 3.15Å
40V96.4Very high90.7Very high7 Ų736 Ų364%0.04221%0.213CC..EExtended strand (participates in β ladder)trans-92.9114.6176.9-173.20000108.7L38 K48 I52 I162 L163 C164 S165 V182 V184L38-V40 HydrophobicContact CB-CG2 4.5Å; V40-K48 HydrophobicContact CG1-CB 4.03Å; V40-K48 HydrophobicContact CG1-CD 4.4Å; V40-K48 HydrophobicContact CG1-CG 4.15Å; V40-I52 HydrophobicContact CB-CD1 4.11Å; V40-I52 HydrophobicContact CB-CG1 4.36Å; V40-I52 HydrophobicContact CG1-CD1 4.41Å; V40-I52 HydrophobicContact CG1-CG1 4.48Å; V40-I52 HydrophobicContact CG2-CD1 4.14Å; V40-I52 HydrophobicContact CG2-CG1 3.94Å; V40-I162 HydrophobicContact CG2-CG2 4.18Å; V40-L163 PolarHBondContact N-O 3.17Å; V40-C164 WeakPolarHBondContact O-CA 3.5Å; V40-S165 PolarHBondContact O-N 2.98Å; V40-S165 VanDerWaalsContact O-N 3.11Å; V40-V182 WeakPolarHBondContact CA-O 3.48Å; V40-V182 HydrophobicContact CG2-CB 4.27Å; V40-V184 HydrophobicContact CG1-CG2 3.7Å
41Y95.8Very high91Very high53 Ų5335.6 Ų35.621%0.20821%0.209CC..EExtended strand (participates in β ladder)trans-132.3159-176.171.9-84000112.7L39 S165 T168 A181 V182 R183 V184L39-Y41 HydrophobicContact CG-CD1 4.43Å; Y41-S165 WeakPolarHBondContact CA-O 3.44Å; Y41-S165 WeakPolarHBondContact CB-OG 3.28Å; Y41-T168 HydrophobicContact CD1-CG2 3.69Å; Y41-T168 HydrophobicContact CD2-CG2 3.56Å; Y41-T168 HydrophobicContact CE1-CG2 4.02Å; Y41-T168 HydrophobicContact CE2-CG2 3.87Å; Y41-T168 HydrophobicContact CG-CG2 3.43Å; Y41-T168 VanDerWaalsContact CG-CG2 3.43Å; Y41-A181 HydrophobicContact CE1-CB 3.99Å; Y41-V182 PolarHBondContact N-O 3.07Å; Y41-R183 HydrophobicContact CD2-CG 4.41Å; Y41-R183 HydrophobicContact CE1-CB 3.95Å; Y41-R183 HydrophobicContact CE2-CB 3.94Å; Y41-R183 HydrophobicContact CE2-CG 3.73Å; Y41-V184 PolarHBondContact O-N 3.09Å
42G94.1Very high91.4Very high5 Ų529.6 Ų29.65%0.05218%0.181CC..  trans148.1172.8-178.800000112.4K48 S165 T166G42-K48 WeakPolarHBondContact O-CE 3.45Å; G42-K48 PolarHBondContact O-NZ 2.95Å; G42-S165 PolarHBondContact N-O 3.46Å; G42-T166 CarbonylContact C-O 3.48Å; G42-T166 WeakPolarHBondContact CA-O 3.45Å; G42-T166 PolarHBondContact N-O 3.47Å; G42-T166 CarbonylContact O-C 3.5Å; G42-T166 VanDerWaalsContact O-CA 3.26Å; G42-T166 WeakPolarHBondContact O-CA 3.46Å
43P92.9Very high91.9Very high55 Ų5526.3 Ų26.336%0.35716%0.156SC..  trans-59159.2-178.121.5-32.3000113.8A46 K48 L186P43-A46 HydrophobicContact CG-CB 4.27Å; P43-A46 WeakPolarHBondContact O-CB 2.85Å; P43-K48 PolarHBondContact O-NZ 3.49Å; P43-L186 HydrophobicContact CB-CD1 4.13Å; P43-L186 HydrophobicContact CB-CD2 4.03Å; P43-L186 HydrophobicContact CB-CG 4.02Å; P43-L186 HydrophobicContact CG-CD1 3.84Å; P43-L186 HydrophobicContact CG-CD2 3.78Å; P43-L186 HydrophobicContact CG-CG 3.39Å
44S90.9Very high92.8Very high62 Ų6224.7 Ų24.743%0.43414%0.14SC..THydrogen-bonded Turntrans-65.2146176.2-166.90000110.5A46S44-A46 PolarHBondContact O-N 3.41Å
45G89.4Confident93.3Very high10 Ų1020 Ų2010%0.10312%0.115CC..THydrogen-bonded Turntrans78.6-5.9-17900000116.2G47 N222G45-G47 PolarHBondContact O-N 3.41Å; G45-G47 VanDerWaalsContact O-N 3.16Å; G45-N222 VanDerWaalsContact CA-OD1 3.24Å; G45-N222 WeakPolarHBondContact CA-OD1 3.43Å
46A91.9Very high93.4Very high0 Ų019.8 Ų19.80%011%0.114CC..SBendtrans-74.34179.600000115.2Y18 P43 S44 R51 V184 P185 L186Y18-A46 PolarHBondContact OH-O 3.11Å; P43-A46 HydrophobicContact CG-CB 4.27Å; P43-A46 WeakPolarHBondContact O-CB 2.85Å; S44-A46 PolarHBondContact O-N 3.41Å; A46-R51 PolarHBondContact O-NH1 3.12Å; A46-V184 HydrophobicContact CB-CG1 4.11Å; A46-V184 VanDerWaalsContact O-CG1 3.25Å; A46-V184 WeakPolarHBondContact O-CG1 3.49Å; A46-P185 WeakPolarHBondContact CB-O 3.43Å; A46-L186 HydrophobicContact CB-CD2 4.15Å
47G92.1Very high93.3Very high14 Ų1421.5 Ų21.514%0.14412%0.116CC..SBendtrans83.520.8177.500000116.1Y18 G45 T50 R51Y18-G47 WeakPolarHBondContact OH-CA 3.24Å; G45-G47 PolarHBondContact O-N 3.41Å; G45-G47 VanDerWaalsContact O-N 3.16Å; G47-T50 WeakPolarHBondContact O-CB 3.46Å; G47-T50 PolarHBondContact O-N 2.93Å; G47-R51 PolarHBondContact O-N 3.31Å
48K93.6Very high93.1Very high19 Ų1924.1 Ų24.18%0.08313%0.128CC..Hα-helixtrans-53.4-54.8176.6-62.4-170.7-61.6-82.60112.8V40 G42 P43 T50 R51 I52 S165 V184V40-K48 HydrophobicContact CG1-CB 4.03Å; V40-K48 HydrophobicContact CG1-CD 4.4Å; V40-K48 HydrophobicContact CG1-CG 4.15Å; G42-K48 WeakPolarHBondContact O-CE 3.45Å; G42-K48 PolarHBondContact O-NZ 2.95Å; P43-K48 PolarHBondContact O-NZ 3.49Å; K48-T50 VanDerWaalsContact C-N 3.28Å; K48-T50 PolarHBondContact O-N 3.3Å; K48-R51 PolarHBondContact O-N 3.42Å; K48-I52 WeakPolarHBondContact O-CG1 3.21Å; K48-I52 PolarHBondContact O-N 2.96Å; K48-S165 VanDerWaalsContact CE-O 3.25Å; K48-S165 WeakPolarHBondContact CE-O 3.43Å; K48-V184 HydrophobicContact CG-CB 4Å; K48-V184 HydrophobicContact CG-CG1 4.32Å; K48-V184 HydrophobicContact CG-CG2 4.28Å
49K92.6Very high92.7Very high81 Ų8124.9 Ų24.935%0.35213%0.132SC..Hα-helixtrans-60.3-36.6178.2-69.8-159.6178-1600111.9R9 I52 M53 E94R9-K49 PolarHBondContact NH2-O 3.43Å; K49-I52 PolarHBondContact O-N 3.23Å; K49-M53 WeakPolarHBondContact O-CG 3.29Å; K49-M53 PolarHBondContact O-N 3.45Å; K49-E94 IonicContact NZ-OE1 2.79Å; K49-E94 PolarHBondContact NZ-OE1 3.07Å
50T93.4Very high92.3Very high25 Ų2525.6 Ų25.615%0.15314%0.135CC..Hα-helixtrans-62.9-46.2176.7-55.60000111.5R9 P10 G47 K48 I52 M53 C54R9-T50 HydrophobicContact CG-CG2 3.8Å; R9-T50 PolarHBondContact NE-OG1 3.11Å; P10-T50 HydrophobicContact CB-CG2 4.25Å; P10-T50 HydrophobicContact CG-CG2 4.41Å; G47-T50 WeakPolarHBondContact O-CB 3.46Å; G47-T50 PolarHBondContact O-N 2.93Å; K48-T50 VanDerWaalsContact C-N 3.28Å; K48-T50 PolarHBondContact O-N 3.3Å; T50-I52 PolarHBondContact O-N 3.35Å; T50-M53 PolarHBondContact O-N 3.3Å; T50-C54 PolarHBondContact O-N 2.92Å; T50-C54 PolarHBondContact O-SG 3.29Å
51R94.1Very high91.9Very high5 Ų526.2 Ų26.22%0.01914%0.143CC..Hα-helixtrans-61.9-42.3176.1-71.7177.3172.779.89.4112L16 Y18 H19 A46 G47 K48 C54 L55L16-R51 HydrophobicContact CD1-CG 4.33Å; L16-R51 HydrophobicContact CD2-CG 4.01Å; Y18-R51 PolarHBondContact O-NH2 2.98Å; Y18-R51 PolarHBondContact OH-NH1 2.85Å; H19-R51 PolarHBondContact CD2-NH2 3.41Å; A46-R51 PolarHBondContact O-NH1 3.12Å; G47-R51 PolarHBondContact O-N 3.31Å; K48-R51 PolarHBondContact O-N 3.42Å; R51-C54 PolarHBondContact O-N 3.45Å; R51-L55 WeakPolarHBondContact O-CB 3.4Å; R51-L55 PolarHBondContact O-N 3.07Å
52I94.4Very high91.4Very high2 Ų228 Ų281%0.0116%0.161CC..Hα-helixtrans-61.7-46.5176.5-65.2166.7000111V40 K48 K49 T50 C54 L55 L56 L133 I162 C164V40-I52 HydrophobicContact CB-CD1 4.11Å; V40-I52 HydrophobicContact CB-CG1 4.36Å; V40-I52 HydrophobicContact CG1-CD1 4.41Å; V40-I52 HydrophobicContact CG1-CG1 4.48Å; V40-I52 HydrophobicContact CG2-CD1 4.14Å; V40-I52 HydrophobicContact CG2-CG1 3.94Å; K48-I52 WeakPolarHBondContact O-CG1 3.21Å; K48-I52 PolarHBondContact O-N 2.96Å; K49-I52 PolarHBondContact O-N 3.23Å; T50-I52 PolarHBondContact O-N 3.35Å; I52-C54 PolarHBondContact O-N 3.14Å; I52-L55 WeakPolarHBondContact O-CB 3.33Å; I52-L55 PolarHBondContact O-N 3.31Å; I52-L56 HydrophobicContact CG2-CD1 4.17Å; I52-L56 HydrophobicContact CG2-CG 4.47Å; I52-L56 WeakPolarHBondContact O-CG 3.25Å; I52-L56 PolarHBondContact O-N 3.39Å; I52-L133 HydrophobicContact CD1-CD1 3.9Å; I52-L133 HydrophobicContact CG2-CD1 4.1Å; I52-L133 HydrophobicContact CG2-CD2 3.93Å; I52-I162 HydrophobicContact CD1-CG2 3.84Å; I52-I162 HydrophobicContact CG1-CG2 3.91Å; I52-I162 HydrophobicContact CG2-CD1 4.12Å; I52-I162 HydrophobicContact CG2-CG2 4.04Å; I52-C164 HydrophobicContact CD1-CB 4.01Å
53M93.1Very high90.9Very high34 Ų3428.6 Ų28.617%0.16717%0.168CC..Hα-helixtrans-65.4-39178.2-68.2-54.3-68.600112.5R9 K49 T50 L55 L56 R57 V64R9-M53 VanDerWaalsContact NH2-CG 3.31Å; K49-M53 WeakPolarHBondContact O-CG 3.29Å; K49-M53 PolarHBondContact O-N 3.45Å; T50-M53 PolarHBondContact O-N 3.3Å; M53-L55 VanDerWaalsContact C-N 3.32Å; M53-L55 PolarHBondContact O-N 3.21Å; M53-L56 PolarHBondContact O-N 3.4Å; M53-L56 HydrophobicContact SD-CD1 4.05Å; M53-R57 WeakPolarHBondContact O-CB 3.42Å; M53-R57 PolarHBondContact O-N 2.98Å; M53-V64 HydrophobicContact CE-CG1 4.05Å
54C92.9Very high90.6Very high0 Ų026 Ų260%015%0.151CC..Hα-helixtrans-62.1-41.6173.9-67.80000111.5P10 L13 T50 R51 I52 R57 E58P10-C54 PolarHBondContact O-SG 2.9Å; P10-C54 VanDerWaalsContact O-SG 3.35Å; L13-C54 HydrophobicContact CD2-CB 3.45Å; L13-C54 VanDerWaalsContact CD2-CB 3.45Å; L13-C54 HydrophobicContact CG-CB 3.98Å; T50-C54 PolarHBondContact O-N 2.92Å; T50-C54 PolarHBondContact O-SG 3.29Å; R51-C54 PolarHBondContact O-N 3.45Å; I52-C54 PolarHBondContact O-N 3.14Å; C54-R57 PolarHBondContact O-N 3.45Å; C54-E58 PolarHBondContact O-N 2.92Å
55L92.6Very high90.3Very high3 Ų327.6 Ų27.62%0.01615%0.151CC..Hα-helixtrans-62.4-45.1176.5-170.479.4000111.5L13 L26 V30 F35 L38 R51 I52 M53 R57 E58 L59 I162L13-L55 HydrophobicContact CD1-CD1 4.37Å; L26-L55 HydrophobicContact CB-CD1 4.18Å; L26-L55 HydrophobicContact CD2-CD1 4.41Å; V30-L55 HydrophobicContact CG2-CD1 3.31Å; V30-L55 HydrophobicContact CG2-CG 4.05Å; F35-L55 HydrophobicContact CE2-CD1 4.46Å; F35-L55 HydrophobicContact CE2-CD2 3.79Å; F35-L55 HydrophobicContact CE2-CG 4.24Å; F35-L55 HydrophobicContact CZ-CD2 3.65Å; F35-L55 HydrophobicContact CZ-CG 4.45Å; L38-L55 HydrophobicContact CD1-CD2 3.38Å; R51-L55 WeakPolarHBondContact O-CB 3.4Å; R51-L55 PolarHBondContact O-N 3.07Å; I52-L55 WeakPolarHBondContact O-CB 3.33Å; I52-L55 PolarHBondContact O-N 3.31Å; M53-L55 VanDerWaalsContact C-N 3.32Å; M53-L55 PolarHBondContact O-N 3.21Å; L55-R57 VanDerWaalsContact C-N 3.33Å; L55-R57 PolarHBondContact O-N 3.35Å; L55-E58 PolarHBondContact O-N 2.83Å; L55-L59 HydrophobicContact CG-CD1 4.26Å; L55-L59 WeakPolarHBondContact O-CG 3.38Å; L55-L59 PolarHBondContact O-N 3.21Å; L55-I162 HydrophobicContact CD2-CD1 4.1Å
56L91.6Very high90.1Very high0 Ų034.6 Ų34.60%018%0.179CC..Hα-helixtrans-62.6-40.6176.1-70.2174000111.7I52 M53 E58 L59 Y60 V64 H92 V131 I162I52-L56 HydrophobicContact CG2-CD1 4.17Å; I52-L56 HydrophobicContact CG2-CG 4.47Å; I52-L56 WeakPolarHBondContact O-CG 3.25Å; I52-L56 PolarHBondContact O-N 3.39Å; M53-L56 PolarHBondContact O-N 3.4Å; M53-L56 HydrophobicContact SD-CD1 4.05Å; L56-E58 VanDerWaalsContact C-N 3.31Å; L56-E58 PolarHBondContact O-N 3.4Å; L56-L59 PolarHBondContact O-N 2.79Å; L56-Y60 HydrophobicContact CD2-CD2 4.25Å; L56-Y60 HydrophobicContact CD2-CE2 4.05Å; L56-Y60 PolarHBondContact O-N 3.24Å; L56-V64 HydrophobicContact CB-CG1 3.71Å; L56-V64 HydrophobicContact CB-CG2 4.42Å; L56-V64 HydrophobicContact CD1-CG1 4.43Å; L56-H92 HydrophobicContact CD1-CB 4.32Å; L56-H92 HydrophobicContact CD2-CB 4.34Å; L56-V131 HydrophobicContact CD2-CB 3.85Å; L56-V131 HydrophobicContact CD2-CG1 3.84Å; L56-V131 HydrophobicContact CD2-CG2 3.96Å; L56-I162 HydrophobicContact CD2-CD1 4.31Å
57R91.4Very high89.9Confident70 Ų7038.5 Ų38.526%0.26420%0.199SC..Hα-helixtrans-63-36.7175.5-169.1-172.1172.1134.5-5.3111.9T11 M53 C54 L55 G61 E65T11-R57 VanDerWaalsContact CB-NH1 3.26Å; T11-R57 WeakPolarHBondContact O-CD 3.45Å; T11-R57 PolarHBondContact OG1-NH1 3.01Å; M53-R57 WeakPolarHBondContact O-CB 3.42Å; M53-R57 PolarHBondContact O-N 2.98Å; C54-R57 PolarHBondContact O-N 3.45Å; L55-R57 VanDerWaalsContact C-N 3.33Å; L55-R57 PolarHBondContact O-N 3.35Å; R57-G61 CarbonylContact O-C 3.56Å; R57-G61 WeakPolarHBondContact O-CA 3.46Å; R57-G61 PolarHBondContact O-N 3.44Å; R57-E65 IonicContact CZ-OE1 3.82Å; R57-E65 IonicContact NH1-OE1 3.82Å; R57-E65 PolarHBondContact NH1-OE1 2.9Å; R57-E65 IonicContact NH1-OE2 2.9Å; R57-E65 PolarHBondContact NH1-OE2 3.39Å
58E89.5Confident89.8Confident61 Ų6145.8 Ų45.829%0.28522%0.222SC..Hα-helixtrans-72.2-31.9174.3-72-167.3-176.600113.1L13 V30 C54 L55 L56L13-E58 WeakPolarHBondContact CB-OE1 3.5Å; L13-E58 VanDerWaalsContact CD1-OE2 3.23Å; L13-E58 WeakPolarHBondContact CD1-OE2 3.43Å; L13-E58 HydrophobicContact CG-CG 4.44Å; L13-E58 WeakPolarHBondContact CG-OE1 3.49Å; L13-E58 PolarHBondContact N-OE1 3.44Å; V30-E58 HydrophobicContact CG1-CB 4.27Å; C54-E58 PolarHBondContact O-N 2.92Å; L55-E58 PolarHBondContact O-N 2.83Å; L56-E58 VanDerWaalsContact C-N 3.31Å; L56-E58 PolarHBondContact O-N 3.4Å
59L88.3Confident89.6Confident17 Ų1750.7 Ų50.79%0.08925%0.248CC..Hα-helixtrans-73.2-46177.9-79.9162.9000113.6V30 F35 L55 L56 F129V30-L59 HydrophobicContact CB-CD2 4.44Å; V30-L59 HydrophobicContact CG1-CD2 3.72Å; V30-L59 HydrophobicContact CG1-CG 3.9Å; V30-L59 HydrophobicContact CG2-CD2 4.22Å; V30-L59 HydrophobicContact CG2-CG 4.04Å; F35-L59 HydrophobicContact CD2-CD1 4.14Å; F35-L59 HydrophobicContact CD2-CD2 4.08Å; F35-L59 HydrophobicContact CE1-CD1 4.29Å; F35-L59 HydrophobicContact CE2-CD1 3.77Å; F35-L59 HydrophobicContact CE2-CD2 4.49Å; F35-L59 HydrophobicContact CG-CD2 4.39Å; F35-L59 HydrophobicContact CZ-CD1 3.83Å; L55-L59 HydrophobicContact CG-CD1 4.26Å; L55-L59 WeakPolarHBondContact O-CG 3.38Å; L55-L59 PolarHBondContact O-N 3.21Å; L56-L59 PolarHBondContact O-N 2.79Å; L59-F129 HydrophobicContact CD2-CZ 4.43Å
60Y87.4Confident89.4Confident14 Ų1450.8 Ų50.86%0.05525%0.25CC..Hα-helixtrans-118.4-5.1-168-62.8-70.4000113.8L56 V64 Y91 Q126 R127 F129 V131L56-Y60 HydrophobicContact CD2-CD2 4.25Å; L56-Y60 HydrophobicContact CD2-CE2 4.05Å; L56-Y60 PolarHBondContact O-N 3.24Å; Y60-V64 VanDerWaalsContact CB-CG2 3.48Å; Y60-V64 HydrophobicContact CD2-CG2 4.21Å; Y60-V64 HydrophobicContact CG-CG2 4.29Å; Y60-Y91 HydrophobicContact CD1-CD1 4.41Å; Y60-Y91 HydrophobicContact CD1-CG 4.14Å; Y60-Y91 HydrophobicContact CG-CD2 4.45Å; Y60-Y91 HydrophobicContact CG-CG 4.06Å; Y60-Q126 HydrophobicContact CD1-CG 4.07Å; Y60-Q126 PolarHBondContact O-NE2 3.03Å; Y60-R127 HydrophobicContact CE1-CB 4.3Å; Y60-F129 VanDerWaalsContact OH-CD2 3.29Å; Y60-F129 WeakPolarHBondContact OH-CD2 3.48Å; Y60-F129 VanDerWaalsContact OH-CE2 3.32Å; Y60-F129 WeakPolarHBondContact OH-CE2 3.41Å; Y60-F129 PolarHBondContact OH-O 3.39Å; Y60-V131 HydrophobicContact CE2-CB 4.37Å; Y60-V131 HydrophobicContact CE2-CG2 3.85Å; Y60-V131 WeakPolarHBondContact OH-CG2 3.48Å
61G87.6Confident89.1Confident21 Ų2156.1 Ų56.122%0.21627%0.273CS..  trans85.1-171-177.200000114.2R57 G63 V64R57-G61 CarbonylContact O-C 3.56Å; R57-G61 WeakPolarHBondContact O-CA 3.46Å; R57-G61 PolarHBondContact O-N 3.44Å; G61-G63 PolarHBondContact O-N 3.46Å; G61-V64 WeakPolarHBondContact O-CG2 3.14Å; G61-V64 PolarHBondContact O-N 2.87Å
62P86.1Confident88.5Confident90 Ų9057.9 Ų57.958%0.58428%0.281SS*.G310 helixtrans-69-14.8-173.928.4-35.1000114V64 E65P62-V64 PolarHBondContact O-N 3.48Å; P62-V64 VanDerWaalsContact O-N 3.15Å; P62-E65 PolarHBondContact O-N 2.8Å
63G83.7Confident88.1Confident18 Ų1862.2 Ų62.219%0.18631%0.308CS..G310 helixtrans-64.4-16.9179.300000114.3G61 E65 K66G61-G63 PolarHBondContact O-N 3.46Å; G63-E65 PolarHBondContact O-N 2.82Å; G63-K66 PolarHBondContact O-N 3.49Å
64V85.9Confident87.6Confident1 Ų161.1 Ų61.11%0.00630%0.303CS..G310 helixtrans-60.1-29.6175.1171.60000112.7M53 L56 Y60 G61 P62 K66 L67 S89 Y91 H92M53-V64 HydrophobicContact CE-CG1 4.05Å; L56-V64 HydrophobicContact CB-CG1 3.71Å; L56-V64 HydrophobicContact CB-CG2 4.42Å; L56-V64 HydrophobicContact CD1-CG1 4.43Å; Y60-V64 VanDerWaalsContact CB-CG2 3.48Å; Y60-V64 HydrophobicContact CD2-CG2 4.21Å; Y60-V64 HydrophobicContact CG-CG2 4.29Å; G61-V64 WeakPolarHBondContact O-CG2 3.14Å; G61-V64 PolarHBondContact O-N 2.87Å; P62-V64 PolarHBondContact O-N 3.48Å; P62-V64 VanDerWaalsContact O-N 3.15Å; V64-K66 PolarHBondContact O-N 3.35Å; V64-L67 WeakPolarHBondContact O-CD2 3.35Å; V64-S89 PolarHBondContact O-OG 3.38Å; V64-Y91 HydrophobicContact CG2-CD2 3.84Å; V64-H92 VanDerWaalsContact CG1-CE1 3.44Å; V64-H92 WeakPolarHBondContact CG1-CE1 3.44Å
65E83.6Confident87.1Confident94 Ų9465.4 Ų65.444%0.43933%0.328SS..G310 helixtrans-74.4-13.9-176.4-63.1177.6168.800112.5R57 P62 G63 L67R57-E65 IonicContact CZ-OE1 3.82Å; R57-E65 IonicContact NH1-OE1 3.82Å; R57-E65 PolarHBondContact NH1-OE1 2.9Å; R57-E65 IonicContact NH1-OE2 2.9Å; R57-E65 PolarHBondContact NH1-OE2 3.39Å; P62-E65 PolarHBondContact O-N 2.8Å; G63-E65 PolarHBondContact O-N 2.82Å; E65-L67 PolarHBondContact O-N 3.18Å
66K85.9Confident86.4Confident158 Ų15865.4 Ų65.469%0.68733%0.329SS*.  trans-78.989.9172.4-61.7-176-178.2-178.70108.7G63 V64 S89G63-K66 PolarHBondContact O-N 3.49Å; V64-K66 PolarHBondContact O-N 3.35Å; K66-S89 PolarHBondContact O-OG 3.2Å
67L87.6Confident85.7Confident81 Ų8170.7 Ų70.742%0.42436%0.363SS..  trans-95.2144.6178.8-56.5175.2000110.5V64 E65 I87 A88V64-L67 WeakPolarHBondContact O-CD2 3.35Å; E65-L67 PolarHBondContact O-N 3.18Å; L67-I87 HydrophobicContact CB-CG2 3.97Å; L67-I87 HydrophobicContact CD1-CG2 4.03Å; L67-I87 HydrophobicContact CD2-CG2 4.07Å; L67-I87 HydrophobicContact CG-CG2 4.23Å; L67-A88 CarbonylContact C-O 3.58Å
68R90.7Very high85Confident168 Ų16871 Ų7163%0.63438%0.376SS*.EExtended strand (participates in β ladder)trans-126.1140.9172-63.8178.9-178.7170.2-0.4108.1A88R68-A88 PolarHBondContact N-O 3.35Å; R68-A88 PolarHBondContact O-N 2.94Å
69I89.9Confident84.6Confident122 Ų12277 Ų7763%0.62640%0.401SS*.EExtended strand (participates in β ladder)trans-91.4122.1173.4-58.5175.1000107
70E88.2Confident84.3Confident82 Ų8282.6 Ų82.638%0.38343%0.425SS..EExtended strand (participates in β ladder)trans-114.7127176.9-68.8-178.6-176.600109.3T86 A88E70-T86 WeakPolarHBondContact CB-OG1 3.19Å; E70-T86 PolarHBondContact N-O 3.2Å; E70-T86 PolarHBondContact O-N 2.9Å; E70-T86 PolarHBondContact O-OG1 3.32Å; E70-A88 HydrophobicContact CG-CB 4.1Å
71H86.9Confident84.1Confident137 Ų13789.4 Ų89.463%0.63446%0.455SS*.EExtended strand (participates in β ladder)trans-92111.1173.2-61.4-74.2000108.7N85H71-N85 PolarHBondContact CE1-OD1 2.96Å; H71-N85 VanDerWaalsContact CE1-OD1 3.31Å; H71-N85 PolarHBondContact ND1-OD1 2.92Å
72Q81.4Confident84Confident42 Ų4289.4 Ų89.420%0.19645%0.45CS..EExtended strand (participates in β ladder)trans-104.7130.8178.3-62-166.713.400109.7I84Q72-I84 PolarHBondContact N-O 3.45Å; Q72-I84 PolarHBondContact O-N 3.48Å
73T85.6Confident83.9Confident93 Ų9392.2 Ų92.257%0.57146%0.455SS*.EExtended strand (participates in β ladder)trans-102.3120.217567.30000109.2I82 E83T73-I82 WeakPolarHBondContact CA-O 3.38Å; T73-E83 HydrophobicContact CG2-CG 4.03Å
74I82.4Confident84.1Confident12 Ų1291.5 Ų91.56%0.06245%0.447CS..EExtended strand (participates in β ladder)trans-113.3125.6-178.4-55.7179.5000107.6I82 I84 V106 V107 L111I74-I82 PolarHBondContact N-O 2.95Å; I74-I82 PolarHBondContact O-N 2.87Å; I74-I84 HydrophobicContact CD1-CD1 4.11Å; I74-V106 HydrophobicContact CG2-CG1 3.97Å; I74-V107 HydrophobicContact CD1-CB 4.17Å; I74-V107 HydrophobicContact CD1-CG1 4.01Å; I74-V107 HydrophobicContact CD1-CG2 4.04Å; I74-L111 HydrophobicContact CD1-CD2 4.39Å; I74-L111 HydrophobicContact CD1-CG 4.33Å
75V82.3Confident84.2Confident89 Ų8996 Ų9654%0.53947%0.471SS..EExtended strand (participates in β ladder)trans-89.1115.2177.6-1750000108.3K81V75-K81 HydrophobicContact CG2-CG 4.49Å
76A78.3Confident84.4Confident3 Ų391.6 Ų91.63%0.02545%0.45CS..  trans-70159.1174.100000111.3S78 K79 K80 I82 Q103A76-S78 PolarHBondContact O-N 3.1Å; A76-K79 WeakPolarHBondContact O-CA 3.49Å; A76-K79 PolarHBondContact O-N 2.71Å; A76-K80 HydrophobicContact CB-CB 4.49Å; A76-K80 WeakPolarHBondContact CB-O 3.46Å; A76-K80 PolarHBondContact N-O 3.1Å; A76-I82 HydrophobicContact CB-CD1 4.46Å; A76-Q103 VanDerWaalsContact CB-CD 3.46Å; A76-Q103 HydrophobicContact CB-CG 4.48Å
77P76.9Confident84.7Confident111 Ų11186.8 Ų86.872%0.72143%0.432SS*.THydrogen-bonded Turntrans-57-22.1173.621.4-33.2000113.3K79P77-K79 PolarHBondContact O-N 3.34Å
78S77.3Confident84.7Confident77 Ų7783.3 Ų83.354%0.53841%0.414SS..THydrogen-bonded Turntrans-81.310.5173.661.60000114.5A76 K80 Q103A76-S78 PolarHBondContact O-N 3.1Å; S78-K80 PolarHBondContact O-N 3.11Å; S78-Q103 PolarHBondContact OG-NE2 3.41Å; S78-Q103 VanDerWaalsContact OG-NE2 3.1Å
79K79.8Confident84.6Confident187 Ų18776.1 Ų76.181%0.81339%0.39SS*.SBendtrans603.9-171.9-58.2-178.6179.3177.60115.3A76 P77 K81A76-K79 WeakPolarHBondContact O-CA 3.49Å; A76-K79 PolarHBondContact O-N 2.71Å; P77-K79 PolarHBondContact O-N 3.34Å; K79-K81 PolarHBondContact O-N 2.94Å
80K82.4Confident84.3Confident135 Ų13574.5 Ų74.559%0.58738%0.383SS*.  trans-68.2127.5170.4-170.1179.4179.6-175.30108.9A76 S78A76-K80 HydrophobicContact CB-CB 4.49Å; A76-K80 WeakPolarHBondContact CB-O 3.46Å; A76-K80 PolarHBondContact N-O 3.1Å; S78-K80 PolarHBondContact O-N 3.11Å
81K84.4Confident84.3Confident156 Ų15672.9 Ų72.968%0.67837%0.373SS*.EExtended strand (participates in β ladder)trans-82.9130171.4-63-175.5-179.8-178.10108.7V75 K79V75-K81 HydrophobicContact CG2-CG 4.49Å; K79-K81 PolarHBondContact O-N 2.94Å
82I84Confident84.4Confident21 Ų2166.6 Ų66.611%0.10834%0.344CS..EExtended strand (participates in β ladder)trans-114129.2173.8-45172.6000106.8T73 I74 A76 I84 A100 Q103T73-I82 WeakPolarHBondContact CA-O 3.38Å; I74-I82 PolarHBondContact N-O 2.95Å; I74-I82 PolarHBondContact O-N 2.87Å; A76-I82 HydrophobicContact CB-CD1 4.46Å; I82-I84 HydrophobicContact CG2-CD1 4.19Å; I82-I84 HydrophobicContact CG2-CG1 3.91Å; I82-A100 HydrophobicContact CD1-CB 4.32Å; I82-A100 HydrophobicContact CG2-CB 4.13Å; I82-Q103 HydrophobicContact CD1-CB 3.37Å; I82-Q103 HydrophobicContact CD1-CG 4.12Å
83E85.3Confident84.9Confident150 Ų15065.1 Ų65.170%0.70134%0.338SS*.EExtended strand (participates in β ladder)trans-102127.4174.7-56.3-171.616600108.1T73T73-E83 HydrophobicContact CG2-CG 4.03Å
84I86.4Confident85.3Confident3 Ų361.9 Ų61.92%0.01532%0.316CS..EExtended strand (participates in β ladder)trans-128.1134.4-178.4-55.7179.2000108.5Q72 I74 I82 T86 V95 A100 V107Q72-I84 PolarHBondContact N-O 3.45Å; Q72-I84 PolarHBondContact O-N 3.48Å; I74-I84 HydrophobicContact CD1-CD1 4.11Å; I82-I84 HydrophobicContact CG2-CD1 4.19Å; I82-I84 HydrophobicContact CG2-CG1 3.91Å; I84-T86 HydrophobicContact CG2-CG2 4.4Å; I84-V95 HydrophobicContact CG2-CG2 4Å; I84-A100 HydrophobicContact CD1-CB 3.9Å; I84-V107 HydrophobicContact CD1-CB 3.96Å; I84-V107 HydrophobicContact CD1-CG1 3.35Å; I84-V107 HydrophobicContact CD1-CG2 3.32Å
85N88.4Confident85.7Confident96 Ų9661.4 Ų61.451%0.51331%0.313SS..EExtended strand (participates in β ladder)trans-87.7120.5175.8-61.7-19.2000108.2H71H71-N85 PolarHBondContact CE1-OD1 2.96Å; H71-N85 VanDerWaalsContact CE1-OD1 3.31Å; H71-N85 PolarHBondContact ND1-OD1 2.92Å
86T88.4Confident86.2Confident0 Ų058.4 Ų58.40%030%0.295CS..EExtended strand (participates in β ladder)trans-114.9138.8175.5580000109.1E70 I84 V95 L111E70-T86 WeakPolarHBondContact CB-OG1 3.19Å; E70-T86 PolarHBondContact N-O 3.2Å; E70-T86 PolarHBondContact O-N 2.9Å; E70-T86 PolarHBondContact O-OG1 3.32Å; I84-T86 HydrophobicContact CG2-CG2 4.4Å; T86-V95 HydrophobicContact CG2-CB 4.07Å; T86-V95 HydrophobicContact CG2-CG2 3.82Å; T86-L111 HydrophobicContact CG2-CD2 4.19Å
87I91.1Very high86.5Confident58 Ų5858.3 Ų58.330%0.29729%0.293SS..EExtended strand (participates in β ladder)trans-101.2105.5175.1-60.3173.2000106L67 E94L67-I87 HydrophobicContact CB-CG2 3.97Å; L67-I87 HydrophobicContact CD1-CG2 4.03Å; L67-I87 HydrophobicContact CD2-CG2 4.07Å; L67-I87 HydrophobicContact CG-CG2 4.23Å; I87-E94 HydrophobicContact CB-CB 4.19Å; I87-E94 PolarHBondContact N-O 3.25Å; I87-E94 PolarHBondContact O-N 2.86Å
88A89.1Confident86.8Confident7 Ų754.2 Ų54.26%0.05827%0.267CS..EExtended strand (participates in β ladder)trans-103139-176.900000110.7L67 R68 E70 L93L67-A88 CarbonylContact C-O 3.58Å; R68-A88 PolarHBondContact N-O 3.35Å; R68-A88 PolarHBondContact O-N 2.94Å; E70-A88 HydrophobicContact CG-CB 4.1Å; A88-L93 HydrophobicContact CB-CD1 4.07Å
89S87.7Confident87.1Confident17 Ų1755.7 Ų55.712%0.11927%0.269CS..  trans-116.6171.7160.9-171.30000108.3V64 K66 Y91 H92V64-S89 PolarHBondContact O-OG 3.38Å; K66-S89 PolarHBondContact O-OG 3.2Å; S89-Y91 PolarHBondContact O-N 3.12Å; S89-H92 WeakPolarHBondContact CB-CE1 3.5Å; S89-H92 VanDerWaalsContact CB-ND1 3.32Å; S89-H92 WeakPolarHBondContact CB-ND1 3.3Å; S89-H92 PolarHBondContact N-O 3.4Å
90N84.5Confident87.2Confident89 Ų8947.4 Ų47.448%0.47624%0.236SC..SBendtrans-59.1-23.5174.6-65-17.9000112.5
91Y86.9Confident87.2Confident48 Ų4842.8 Ų42.819%0.18823%0.226CC..SBendtrans-116.7-23.2-169.9-45.3-55.6000114.6Y60 V64 S89 V131Y60-Y91 HydrophobicContact CD1-CD1 4.41Å; Y60-Y91 HydrophobicContact CD1-CG 4.14Å; Y60-Y91 HydrophobicContact CG-CD2 4.45Å; Y60-Y91 HydrophobicContact CG-CG 4.06Å; V64-Y91 HydrophobicContact CG2-CD2 3.84Å; S89-Y91 PolarHBondContact O-N 3.12Å; Y91-V131 PolarHBondContact O-N 3.17Å
92H90.4Very high87.2Confident5 Ų542.6 Ų42.62%0.02323%0.233CC..EExtended strand (participates in β ladder)trans-143.6157.4-178.175.1-78.4000112.1L56 V64 S89 V131L56-H92 HydrophobicContact CD1-CB 4.32Å; L56-H92 HydrophobicContact CD2-CB 4.34Å; V64-H92 VanDerWaalsContact CG1-CE1 3.44Å; V64-H92 WeakPolarHBondContact CG1-CE1 3.44Å; S89-H92 WeakPolarHBondContact CB-CE1 3.5Å; S89-H92 VanDerWaalsContact CB-ND1 3.32Å; S89-H92 WeakPolarHBondContact CB-ND1 3.3Å; S89-H92 PolarHBondContact N-O 3.4Å; H92-V131 CarbonylContact C-O 3.58Å; H92-V131 WeakPolarHBondContact CA-O 3.43Å; H92-V131 HydrophobicContact CB-CB 4.06Å; H92-V131 VanDerWaalsContact CB-O 3.27Å; H92-V131 WeakPolarHBondContact CB-O 3.47Å
93L91.8Very high87.2Confident11 Ų1143.6 Ų43.66%0.05824%0.237CC..EExtended strand (participates in β ladder)trans-123.7120174.7-174.6104.6000108.7A88 V95 V115 V131 V132 L133A88-L93 HydrophobicContact CB-CD1 4.07Å; L93-V95 HydrophobicContact CD2-CB 4.4Å; L93-V95 HydrophobicContact CD2-CG1 4.2Å; L93-V115 HydrophobicContact CB-CG2 4.09Å; L93-V115 HydrophobicContact CD1-CG2 4.45Å; L93-V115 HydrophobicContact CD2-CG2 3.96Å; L93-V115 HydrophobicContact CG-CG2 4.39Å; L93-V131 PolarHBondContact N-O 3.05Å; L93-V132 HydrophobicContact CD2-CG1 4.49Å; L93-L133 PolarHBondContact O-N 2.76Å
94E93.1Very high87.3Confident24 Ų2436.6 Ų36.611%0.11220%0.204CC..EExtended strand (participates in β ladder)trans-96.6128.8168.3176176.5-176.700109.7K49 I87 L133 T135K49-E94 IonicContact NZ-OE1 2.79Å; K49-E94 PolarHBondContact NZ-OE1 3.07Å; I87-E94 HydrophobicContact CB-CB 4.19Å; I87-E94 PolarHBondContact N-O 3.25Å; I87-E94 PolarHBondContact O-N 2.86Å; E94-L133 WeakPolarHBondContact CA-O 3.27Å; E94-L133 HydrophobicContact CB-CB 4.24Å; E94-L133 HydrophobicContact CB-CD2 4.08Å; E94-L133 HydrophobicContact CB-CG 4.32Å; E94-L133 HydrophobicContact CG-CD2 3.89Å; E94-L133 HydrophobicContact CG-CG 4.12Å; E94-T135 HydrophobicContact CG-CG2 4.26Å
95V91.8Very high87.5Confident2 Ų241.1 Ų41.11%0.01222%0.221CC..EExtended strand (participates in β ladder)trans-143.3144.417760.40000111.1I84 T86 L93 P97 L111 L133 L134 T135I84-V95 HydrophobicContact CG2-CG2 4Å; T86-V95 HydrophobicContact CG2-CB 4.07Å; T86-V95 HydrophobicContact CG2-CG2 3.82Å; L93-V95 HydrophobicContact CD2-CB 4.4Å; L93-V95 HydrophobicContact CD2-CG1 4.2Å; V95-P97 VanDerWaalsContact O-CD 3.22Å; V95-P97 WeakPolarHBondContact O-CD 3.45Å; V95-L111 HydrophobicContact CB-CD1 4.16Å; V95-L111 HydrophobicContact CG1-CD1 3.92Å; V95-L111 HydrophobicContact CG2-CD1 3.6Å; V95-L133 PolarHBondContact N-O 3.48Å; V95-L134 HydrophobicContact CG1-CD2 3.32Å; V95-T135 PolarHBondContact O-N 3.35Å; V95-T135 VanDerWaalsContact O-N 3.12Å; V95-T135 PolarHBondContact O-OG1 3.44Å
96N91.3Very high87.5Confident27 Ų2737.8 Ų37.814%0.14421%0.205CC..  trans-102.591.9168.3-161.428000110.6S98 D99 T135N96-S98 VanDerWaalsContact CG-OG 3.26Å; N96-S98 PolarHBondContact ND2-OG 2.99Å; N96-S98 VanDerWaalsContact ND2-OG 3.09Å; N96-S98 PolarHBondContact O-N 2.97Å; N96-S98 PolarHBondContact OD1-OG 3.04Å; N96-S98 VanDerWaalsContact OD1-OG 3.04Å; N96-D99 PolarHBondContact ND2-OD1 3.34Å; N96-D99 PolarHBondContact O-N 3.41Å; N96-T135 WeakPolarHBondContact CB-OG1 3.31Å; N96-T135 PolarHBondContact OD1-O 2.92Å; N96-T135 VanDerWaalsContact OD1-O 3.14Å; N96-T135 PolarHBondContact OD1-OG1 2.89Å; N96-T135 VanDerWaalsContact OD1-OG1 3.07Å
97P85.7Confident87.5Confident0 Ų037.8 Ų37.80%021%0.205CC..G310 helixtrans-68.8-15.8-176.228.7-36.3000113.5V95 D99 A100 V107 I108 L134 L140V95-P97 VanDerWaalsContact O-CD 3.22Å; V95-P97 WeakPolarHBondContact O-CD 3.45Å; P97-D99 PolarHBondContact O-N 3.14Å; P97-A100 PolarHBondContact O-N 3.41Å; P97-V107 HydrophobicContact CB-CG1 4.39Å; P97-I108 HydrophobicContact CB-CD1 4.39Å; P97-I108 HydrophobicContact CB-CG1 3.94Å; P97-I108 HydrophobicContact CG-CG1 4.45Å; P97-L134 HydrophobicContact CG-CD2 4.42Å; P97-L140 HydrophobicContact CB-CD2 3.9Å; P97-L140 HydrophobicContact CG-CD1 4.2Å; P97-L140 HydrophobicContact CG-CD2 3.69Å; P97-L140 HydrophobicContact CG-CG 4.25Å
98S83.3Confident87.5Confident25 Ų2535.1 Ų35.118%0.17519%0.191CC..G310 helixtrans-66.9-21.5177.757.20000113.6N96 A100 G101N96-S98 VanDerWaalsContact CG-OG 3.26Å; N96-S98 PolarHBondContact ND2-OG 2.99Å; N96-S98 VanDerWaalsContact ND2-OG 3.09Å; N96-S98 PolarHBondContact O-N 2.97Å; N96-S98 PolarHBondContact OD1-OG 3.04Å; N96-S98 VanDerWaalsContact OD1-OG 3.04Å; S98-A100 PolarHBondContact O-N 3.48Å; S98-A100 VanDerWaalsContact O-N 3.17Å; S98-G101 PolarHBondContact O-N 3.31Å
99D84.2Confident87.5Confident108 Ų10837.9 Ų37.958%0.57820%0.203SC*.G310 helixtrans-65.4-20.3-179.3-62.6-8.9000111.7N96 P97 G101N96-D99 PolarHBondContact ND2-OD1 3.34Å; N96-D99 PolarHBondContact O-N 3.41Å; P97-D99 PolarHBondContact O-N 3.14Å; D99-G101 VanDerWaalsContact C-N 3.28Å; D99-G101 PolarHBondContact O-N 3.24Å
100A81Confident87.6Confident13 Ų1340.7 Ų40.711%0.10721%0.214CC..G310 helixtrans-81.5-0.3175.300000114.4I82 I84 P97 S98 N102 Q103 V107I82-A100 HydrophobicContact CD1-CB 4.32Å; I82-A100 HydrophobicContact CG2-CB 4.13Å; I84-A100 HydrophobicContact CD1-CB 3.9Å; P97-A100 PolarHBondContact O-N 3.41Å; S98-A100 PolarHBondContact O-N 3.48Å; S98-A100 VanDerWaalsContact O-N 3.17Å; A100-N102 PolarHBondContact O-N 2.95Å; A100-Q103 PolarHBondContact O-N 3.37Å; A100-V107 HydrophobicContact CB-CG2 3.58Å
101G82.6Confident87.8Confident38 Ų3836.6 Ų36.639%0.39219%0.192SC..G310 helixtrans54.7-127-177.400000112.1S98 D99 Q103 D104S98-G101 PolarHBondContact O-N 3.31Å; D99-G101 VanDerWaalsContact C-N 3.28Å; D99-G101 PolarHBondContact O-N 3.24Å; G101-Q103 PolarHBondContact O-N 3.09Å; G101-Q103 VanDerWaalsContact O-N 3.1Å; G101-D104 WeakPolarHBondContact O-CB 3.42Å; G101-D104 VanDerWaalsContact O-CG 3.31Å; G101-D104 PolarHBondContact O-N 3.31Å
102N83.4Confident87.9Confident153 Ų15334.4 Ų34.482%0.81818%0.183SC*.G310 helixtrans-69.8-4.9-176.9-68.3-6.7000115A100A100-N102 PolarHBondContact O-N 2.95Å
103Q84.6Confident87.9Confident42 Ų4237.4 Ų37.420%0.19620%0.196CC..G310 helixtrans-103.87.9-178.8-61.3-173.6-44.900112.4A76 S78 I82 A100 G101 R105 V106A76-Q103 VanDerWaalsContact CB-CD 3.46Å; A76-Q103 HydrophobicContact CB-CG 4.48Å; S78-Q103 PolarHBondContact OG-NE2 3.41Å; S78-Q103 VanDerWaalsContact OG-NE2 3.1Å; I82-Q103 HydrophobicContact CD1-CB 3.37Å; I82-Q103 HydrophobicContact CD1-CG 4.12Å; A100-Q103 PolarHBondContact O-N 3.37Å; G101-Q103 PolarHBondContact O-N 3.09Å; G101-Q103 VanDerWaalsContact O-N 3.1Å; Q103-R105 PolarHBondContact O-N 2.95Å; Q103-R105 VanDerWaalsContact O-N 3.12Å; Q103-V106 PolarHBondContact O-N 3.26Å; Q103-V106 VanDerWaalsContact O-N 3.09Å
104D87.1Confident87.7Confident2 Ų239.2 Ų39.21%0.01121%0.208CC..Hα-helixtrans-47-35.3174.160.1-11.6000114.1G101 V106 V107 I108 L140 T141 A144G101-D104 WeakPolarHBondContact O-CB 3.42Å; G101-D104 VanDerWaalsContact O-CG 3.31Å; G101-D104 PolarHBondContact O-N 3.31Å; D104-V106 PolarHBondContact O-N 3.11Å; D104-V107 WeakPolarHBondContact O-CB 3.42Å; D104-V107 PolarHBondContact O-N 3.19Å; D104-I108 WeakPolarHBondContact O-CG1 3.36Å; D104-I108 PolarHBondContact O-N 3.22Å; D104-L140 HydrophobicContact CB-CD2 3.84Å; D104-T141 VanDerWaalsContact CG-OG1 3.3Å; D104-T141 PolarHBondContact OD1-OG1 2.92Å; D104-T141 WeakPolarHBondContact OD2-CB 3.5Å; D104-T141 WeakPolarHBondContact OD2-CG2 3.19Å; D104-T141 PolarHBondContact OD2-N 3.21Å; D104-T141 PolarHBondContact OD2-OG1 3.39Å; D104-A144 HydrophobicContact CB-CB 4.13Å; D104-A144 WeakPolarHBondContact OD2-CB 3.41Å
105R90.3Very high87.4Confident98 Ų9838.7 Ų38.737%0.3721%0.206SC..Hα-helixtrans-56.1-45176.8-169.8-172.368.373.7-5.3113.3Q103 Q109 A144 A147Q103-R105 PolarHBondContact O-N 2.95Å; Q103-R105 VanDerWaalsContact O-N 3.12Å; R105-Q109 WeakPolarHBondContact O-CG 3.25Å; R105-Q109 PolarHBondContact O-N 3.27Å; R105-A144 HydrophobicContact CB-CB 4.27Å; R105-A147 HydrophobicContact CG-CB 3.66Å
106V89.2Confident87.1Confident27 Ų2739.5 Ų39.516%0.16421%0.213CC..Hα-helixtrans-72.1-39.5-176.6179.70000109.9I74 Q103 D104 Q109 E110I74-V106 HydrophobicContact CG2-CG1 3.97Å; Q103-V106 PolarHBondContact O-N 3.26Å; Q103-V106 VanDerWaalsContact O-N 3.09Å; D104-V106 PolarHBondContact O-N 3.11Å; V106-Q109 PolarHBondContact O-N 3.3Å; V106-E110 PolarHBondContact O-N 2.69Å
107V88.4Confident86.8Confident0 Ų044.3 Ų44.30%024%0.235CC..Hα-helixtrans-57.5-51.8178176.10000111I74 I84 P97 A100 D104 Q109 E110 L111I74-V107 HydrophobicContact CD1-CB 4.17Å; I74-V107 HydrophobicContact CD1-CG1 4.01Å; I74-V107 HydrophobicContact CD1-CG2 4.04Å; I84-V107 HydrophobicContact CD1-CB 3.96Å; I84-V107 HydrophobicContact CD1-CG1 3.35Å; I84-V107 HydrophobicContact CD1-CG2 3.32Å; P97-V107 HydrophobicContact CB-CG1 4.39Å; A100-V107 HydrophobicContact CB-CG2 3.58Å; D104-V107 WeakPolarHBondContact O-CB 3.42Å; D104-V107 PolarHBondContact O-N 3.19Å; V107-Q109 VanDerWaalsContact C-N 3.29Å; V107-Q109 PolarHBondContact O-N 2.65Å; V107-E110 PolarHBondContact O-N 2.74Å; V107-L111 HydrophobicContact CG1-CD1 3.41Å; V107-L111 VanDerWaalsContact CG1-CD1 3.41Å; V107-L111 HydrophobicContact CG1-CG 4.14Å; V107-L111 VanDerWaalsContact O-CB 3.31Å; V107-L111 WeakPolarHBondContact O-CB 3.49Å; V107-L111 WeakPolarHBondContact O-CG 3.39Å; V107-L111 PolarHBondContact O-N 2.75Å
108I91.1Very high86.5Confident1 Ų146.6 Ų46.61%0.00525%0.251CS..Hα-helixtrans-59.6-41.8179.4-68.7176.2000111.5P97 D104 I112 L140 A144 L148P97-I108 HydrophobicContact CB-CD1 4.39Å; P97-I108 HydrophobicContact CB-CG1 3.94Å; P97-I108 HydrophobicContact CG-CG1 4.45Å; D104-I108 WeakPolarHBondContact O-CG1 3.36Å; D104-I108 PolarHBondContact O-N 3.22Å; I108-I112 HydrophobicContact CG2-CD1 3.64Å; I108-I112 WeakPolarHBondContact O-CB 3.35Å; I108-I112 WeakPolarHBondContact O-CD1 3.4Å; I108-I112 VanDerWaalsContact O-CG1 3.27Å; I108-I112 WeakPolarHBondContact O-CG1 3.42Å; I108-I112 PolarHBondContact O-N 2.75Å; I108-L140 HydrophobicContact CD1-CD1 3.67Å; I108-L140 HydrophobicContact CD1-CD2 3.89Å; I108-L140 HydrophobicContact CD1-CG 4.42Å; I108-A144 HydrophobicContact CD1-CB 3.94Å; I108-L148 HydrophobicContact CD1-CB 4.4Å; I108-L148 HydrophobicContact CG2-CB 3.99Å; I108-L148 HydrophobicContact CG2-CD1 3.76Å; I108-L148 HydrophobicContact CG2-CG 4.48Å
109Q89.8Confident85.5Confident66 Ų6653.9 Ų53.931%0.30828%0.282SS..Hα-helixtrans-66.1-46.8-178.4-72.8179.9-1400112.1R105 V106 V107 K113 A147 T151R105-Q109 WeakPolarHBondContact O-CG 3.25Å; R105-Q109 PolarHBondContact O-N 3.27Å; V106-Q109 PolarHBondContact O-N 3.3Å; V107-Q109 VanDerWaalsContact C-N 3.29Å; V107-Q109 PolarHBondContact O-N 2.65Å; Q109-K113 WeakPolarHBondContact O-CB 3.43Å; Q109-K113 PolarHBondContact O-N 2.94Å; Q109-A147 HydrophobicContact CG-CB 4.13Å; Q109-T151 HydrophobicContact CG-CG2 4.19Å
110E89Confident84.4Confident76 Ų7650.8 Ų50.836%0.35526%0.264SS..Hα-helixtrans-73.7-41.3-177.1-158.160.5-151.300111.4V106 V107 I112 K113 T114V106-E110 PolarHBondContact O-N 2.69Å; V107-E110 PolarHBondContact O-N 2.74Å; E110-I112 PolarHBondContact O-N 3.47Å; E110-K113 WeakPolarHBondContact O-CB 3.4Å; E110-K113 PolarHBondContact O-N 3.47Å; E110-K113 IonicContact OE1-NZ 2.75Å; E110-K113 PolarHBondContact OE1-NZ 3.4Å; E110-K113 VanDerWaalsContact OE1-NZ 3.16Å; E110-K113 IonicContact OE2-NZ 3.2Å; E110-T114 WeakPolarHBondContact O-CG2 3.5Å; E110-T114 PolarHBondContact O-N 2.89Å; E110-T114 PolarHBondContact O-OG1 3.49Å
111L88Confident83.3Confident3 Ų358.3 Ų58.32%0.01630%0.301CS..Hα-helixtrans-63.8-44.6179.4-68.5175000112.8I74 T86 V95 V107 K113 T114 V115I74-L111 HydrophobicContact CD1-CD2 4.39Å; I74-L111 HydrophobicContact CD1-CG 4.33Å; T86-L111 HydrophobicContact CG2-CD2 4.19Å; V95-L111 HydrophobicContact CB-CD1 4.16Å; V95-L111 HydrophobicContact CG1-CD1 3.92Å; V95-L111 HydrophobicContact CG2-CD1 3.6Å; V107-L111 HydrophobicContact CG1-CD1 3.41Å; V107-L111 VanDerWaalsContact CG1-CD1 3.41Å; V107-L111 HydrophobicContact CG1-CG 4.14Å; V107-L111 VanDerWaalsContact O-CB 3.31Å; V107-L111 WeakPolarHBondContact O-CB 3.49Å; V107-L111 WeakPolarHBondContact O-CG 3.39Å; V107-L111 PolarHBondContact O-N 2.75Å; L111-K113 VanDerWaalsContact C-N 3.26Å; L111-K113 PolarHBondContact O-N 3.36Å; L111-T114 WeakPolarHBondContact CA-OG1 3.37Å; L111-T114 PolarHBondContact O-N 2.88Å; L111-T114 PolarHBondContact O-OG1 2.81Å; L111-V115 VanDerWaalsContact O-CG2 3.29Å; L111-V115 WeakPolarHBondContact O-CG2 3.37Å; L111-V115 PolarHBondContact O-N 3.31Å
112I89.9Confident82.1Confident1 Ų162.8 Ų62.81%0.00531%0.312CS..Hα-helixtrans-67.5-35.6178.5-65.1170.9000109.8I108 E110 A116 L148 T151 Y155 L161I108-I112 HydrophobicContact CG2-CD1 3.64Å; I108-I112 WeakPolarHBondContact O-CB 3.35Å; I108-I112 WeakPolarHBondContact O-CD1 3.4Å; I108-I112 VanDerWaalsContact O-CG1 3.27Å; I108-I112 WeakPolarHBondContact O-CG1 3.42Å; I108-I112 PolarHBondContact O-N 2.75Å; E110-I112 PolarHBondContact O-N 3.47Å; I112-A116 WeakPolarHBondContact O-CB 3.35Å; I112-A116 PolarHBondContact O-N 3.35Å; I112-L148 HydrophobicContact CD1-CD1 3.62Å; I112-T151 WeakPolarHBondContact CD1-OG1 3.43Å; I112-Y155 HydrophobicContact CG2-CD2 3.72Å; I112-Y155 HydrophobicContact CG2-CE2 4.41Å; I112-Y155 HydrophobicContact CG2-CG 4.45Å; I112-L161 HydrophobicContact CD1-CD2 4.01Å
113K89.9Confident80.8Confident68 Ų6860 Ų6030%0.29630%0.304SS..Hα-helixtrans-65.7-44.4176.3178.9-172.1166-150.70111.9Q109 E110 L111 A116 Q117Q109-K113 WeakPolarHBondContact O-CB 3.43Å; Q109-K113 PolarHBondContact O-N 2.94Å; E110-K113 WeakPolarHBondContact O-CB 3.4Å; E110-K113 PolarHBondContact O-N 3.47Å; E110-K113 IonicContact OE1-NZ 2.75Å; E110-K113 PolarHBondContact OE1-NZ 3.4Å; E110-K113 VanDerWaalsContact OE1-NZ 3.16Å; E110-K113 IonicContact OE2-NZ 3.2Å; L111-K113 VanDerWaalsContact C-N 3.26Å; L111-K113 PolarHBondContact O-N 3.36Å; K113-A116 PolarHBondContact O-N 2.9Å; K113-Q117 WeakPolarHBondContact O-CB 3.19Å; K113-Q117 VanDerWaalsContact O-CG 3.26Å; K113-Q117 WeakPolarHBondContact O-CG 3.47Å; K113-Q117 PolarHBondContact O-N 3.44Å
114T88.3Confident79.5Confident50 Ų5063.1 Ų63.131%0.30733%0.331SS..Hα-helixtrans-64.1-42.8177.854.70000111.1E110 L111 Q117 S118E110-T114 WeakPolarHBondContact O-CG2 3.5Å; E110-T114 PolarHBondContact O-N 2.89Å; E110-T114 PolarHBondContact O-OG1 3.49Å; L111-T114 WeakPolarHBondContact CA-OG1 3.37Å; L111-T114 PolarHBondContact O-N 2.88Å; L111-T114 PolarHBondContact O-OG1 2.81Å; T114-Q117 PolarHBondContact O-N 3.45Å; T114-S118 WeakPolarHBondContact O-CB 3.22Å; T114-S118 PolarHBondContact O-N 3.15Å
115V87.1Confident77.9Confident12 Ų1268.4 Ų68.47%0.07336%0.363CS..Hα-helixtrans-64-43.3175.6178.60000111.1L93 L111 Q117 S118 K130 V132L93-V115 HydrophobicContact CB-CG2 4.09Å; L93-V115 HydrophobicContact CD1-CG2 4.45Å; L93-V115 HydrophobicContact CD2-CG2 3.96Å; L93-V115 HydrophobicContact CG-CG2 4.39Å; L111-V115 VanDerWaalsContact O-CG2 3.29Å; L111-V115 WeakPolarHBondContact O-CG2 3.37Å; L111-V115 PolarHBondContact O-N 3.31Å; V115-Q117 VanDerWaalsContact C-N 3.31Å; V115-Q117 PolarHBondContact O-N 3.25Å; V115-S118 PolarHBondContact O-N 3.45Å; V115-S118 PolarHBondContact O-OG 2.91Å; V115-K130 HydrophobicContact CG1-CB 3.92Å; V115-K130 HydrophobicContact CG1-CD 4.1Å; V115-V132 HydrophobicContact CB-CG2 4.1Å; V115-V132 HydrophobicContact CG1-CG2 3.8Å; V115-V132 HydrophobicContact CG2-CG2 4.15Å
116A85.6Confident76.6Confident19 Ų1965.5 Ų65.516%0.15735%0.353CS..Hα-helixtrans-65.4-31.2178.600000113.6I112 K113 Y155 C159I112-A116 WeakPolarHBondContact O-CB 3.35Å; I112-A116 PolarHBondContact O-N 3.35Å; K113-A116 PolarHBondContact O-N 2.9Å; A116-Y155 HydrophobicContact CB-CD1 3.48Å; A116-Y155 VanDerWaalsContact CB-CD1 3.48Å; A116-Y155 HydrophobicContact CB-CD2 4.34Å; A116-Y155 HydrophobicContact CB-CE1 3.95Å; A116-Y155 HydrophobicContact CB-CG 3.7Å; A116-C159 VanDerWaalsContact CA-SG 3.52Å
117Q84.7Confident75.7Confident128 Ų12868.5 Ų68.560%0.59836%0.362SS*.Hα-helixtrans-81-21.6176.5-72.2177.3-17.200113K113 T114 V115 Q119K113-Q117 WeakPolarHBondContact O-CB 3.19Å; K113-Q117 VanDerWaalsContact O-CG 3.26Å; K113-Q117 WeakPolarHBondContact O-CG 3.47Å; K113-Q117 PolarHBondContact O-N 3.44Å; T114-Q117 PolarHBondContact O-N 3.45Å; V115-Q117 VanDerWaalsContact C-N 3.31Å; V115-Q117 PolarHBondContact O-N 3.25Å; Q117-Q119 PolarHBondContact O-N 2.91Å
118S79.1Confident75.1Confident48 Ų4876.8 Ų76.834%0.33640%0.401SS..  trans-73.396.5-178.970.50000111.4T114 V115 K130T114-S118 WeakPolarHBondContact O-CB 3.22Å; T114-S118 PolarHBondContact O-N 3.15Å; V115-S118 PolarHBondContact O-N 3.45Å; V115-S118 PolarHBondContact O-OG 2.91Å; S118-K130 PolarHBondContact O-NZ 3.49Å; S118-K130 VanDerWaalsContact O-NZ 3.08Å; S118-K130 PolarHBondContact OG-NZ 3.4Å
119Q61.4Low74.9Confident179 Ų17977.4 Ų77.484%0.83640%0.403SS*.  trans-60.9140.7176.1-78.6-166.2-10.700111.9Q117Q117-Q119 PolarHBondContact O-N 2.91Å
120Q62.5Low74.8Confident43 Ų4375.9 Ų75.920%0.20140%0.396CS..  trans-77.7122.3169.9-68.3177.7-10.700108.6Q122 R127 F129 K130Q120-Q122 PolarHBondContact O-N 3.35Å; Q120-R127 PolarHBondContact NE2-O 3.18Å; Q120-R127 PolarHBondContact OE1-O 3.27Å; Q120-F129 PolarHBondContact NE2-O 2.92Å; Q120-K130 HydrophobicContact CG-CG 4.33Å
121I58.3Low75Confident171 Ų17172.3 Ų72.388%0.87738%0.379SS*.SBendtrans-73-15.2-177.1-56.8172.3000111.4
122Q56.9Low75.3Confident132 Ų13272.1 Ų72.162%0.61738%0.378SS*.  trans-134.189.3-179.4-68.4-177.7-17.900110.9Q120Q120-Q122 PolarHBondContact O-N 3.35Å
123S55.4Low75.6Confident93 Ų9372.2 Ų72.265%0.6538%0.378SS*.  trans-82.1-9.717848.20000114.2
124S56.7Low75.8Confident109 Ų10969.1 Ų69.176%0.76237%0.365SS*.SBendtrans-83-18.1-169.656.70000115.4
125T54.8Low76Confident112 Ų11267.2 Ų67.269%0.68735%0.353SS*.SBendtrans-116.62.3-177.649.80000113.5
126Q63.1Low76.2Confident37 Ų3770 Ų7017%0.17337%0.366CS..SBendtrans-145159.2-163.2-121.4174.59.600115.3Y60Y60-Q126 HydrophobicContact CD1-CG 4.07Å; Y60-Q126 PolarHBondContact O-NE2 3.03Å
127R70.2Confident76.5Confident90 Ų9069 Ų6934%0.3436%0.358SS..  trans-62.3137.8174.6-64.4-68-170.8178.71110.2V30 G33 Y60 Q120 F129V30-R127 PolarHBondContact O-NH2 2.7Å; G33-R127 PolarHBondContact O-NH1 3.18Å; Y60-R127 HydrophobicContact CE1-CB 4.3Å; Q120-R127 PolarHBondContact NE2-O 3.18Å; Q120-R127 PolarHBondContact OE1-O 3.27Å; R127-F129 HydrophobicContact CB-CD1 4.2Å; R127-F129 HydrophobicContact CB-CE1 3.9Å; R127-F129 HydrophobicContact CB-CZ 4.27Å; R127-F129 HydrophobicContact CG-CE1 4.31Å; R127-F129 HydrophobicContact CG-CZ 4.49Å; R127-F129 PolarHBondContact O-N 2.9Å
128E75.8Confident76.8Confident174 Ų17463.8 Ų63.881%0.81333%0.334SS*.SBendtrans-67-4.5-173.3-59.6179.7166.500115.3
129F86.2Confident77.3Confident15 Ų1567.8 Ų67.87%0.06634%0.342CS..  trans-116.4153.3-178.464.2-95.7000112.3F35 L59 Y60 Q120 R127 V131 T158 R160F35-F129 HydrophobicContact CB-CE1 4.11Å; F35-F129 HydrophobicContact CB-CE2 4.37Å; F35-F129 HydrophobicContact CB-CZ 3.56Å; F35-F129 AromaticContact CD1-CE2 3.99Å; F35-F129 HydrophobicContact CD1-CE2 3.99Å; F35-F129 HydrophobicContact CD1-CZ 4.02Å; F35-F129 HydrophobicContact CG-CE2 4.44Å; F35-F129 HydrophobicContact CG-CZ 4.02Å; L59-F129 HydrophobicContact CD2-CZ 4.43Å; Y60-F129 VanDerWaalsContact OH-CD2 3.29Å; Y60-F129 WeakPolarHBondContact OH-CD2 3.48Å; Y60-F129 VanDerWaalsContact OH-CE2 3.32Å; Y60-F129 WeakPolarHBondContact OH-CE2 3.41Å; Y60-F129 PolarHBondContact OH-O 3.39Å; Q120-F129 PolarHBondContact NE2-O 2.92Å; R127-F129 HydrophobicContact CB-CD1 4.2Å; R127-F129 HydrophobicContact CB-CE1 3.9Å; R127-F129 HydrophobicContact CB-CZ 4.27Å; R127-F129 HydrophobicContact CG-CE1 4.31Å; R127-F129 HydrophobicContact CG-CZ 4.49Å; R127-F129 PolarHBondContact O-N 2.9Å; F129-V131 HydrophobicContact CD2-CG2 4.27Å; F129-V131 HydrophobicContact CE2-CG2 3.96Å; F129-T158 VanDerWaalsContact CA-O 3.31Å; F129-T158 WeakPolarHBondContact CA-O 3.37Å; F129-R160 HydrophobicContact CB-CG 4.16Å; F129-R160 HydrophobicContact CD1-CG 4.1Å; F129-R160 HydrophobicContact CD2-CB 3.69Å; F129-R160 HydrophobicContact CD2-CG 3.28Å; F129-R160 HydrophobicContact CE1-CG 4.34Å; F129-R160 HydrophobicContact CE2-CB 3.88Å; F129-R160 HydrophobicContact CE2-CG 3.57Å; F129-R160 HydrophobicContact CG-CB 4.44Å; F129-R160 HydrophobicContact CG-CG 3.58Å; F129-R160 HydrophobicContact CZ-CG 4.1Å
130K89Confident78.7Confident34 Ų3459.7 Ų59.715%0.14830%0.304CS..EExtended strand (participates in β ladder)trans-97.4153.7166.9-72-177176.6173.90111.1V115 S118 Q120 T158 C159 R160V115-K130 HydrophobicContact CG1-CB 3.92Å; V115-K130 HydrophobicContact CG1-CD 4.1Å; S118-K130 PolarHBondContact O-NZ 3.49Å; S118-K130 VanDerWaalsContact O-NZ 3.08Å; S118-K130 PolarHBondContact OG-NZ 3.4Å; Q120-K130 HydrophobicContact CG-CG 4.33Å; K130-T158 PolarHBondContact N-O 3.08Å; K130-C159 CarbonylContact O-C 3.6Å; K130-C159 WeakPolarHBondContact O-CA 3.48Å; K130-R160 PolarHBondContact O-N 3.33Å
131V91.9Very high80.1Confident0 Ų059.7 Ų59.70%031%0.307CS..EExtended strand (participates in β ladder)trans-101.4130.7175.1172.70000111.5L56 Y60 Y91 H92 L93 F129 R160 I162L56-V131 HydrophobicContact CD2-CB 3.85Å; L56-V131 HydrophobicContact CD2-CG1 3.84Å; L56-V131 HydrophobicContact CD2-CG2 3.96Å; Y60-V131 HydrophobicContact CE2-CB 4.37Å; Y60-V131 HydrophobicContact CE2-CG2 3.85Å; Y60-V131 WeakPolarHBondContact OH-CG2 3.48Å; Y91-V131 PolarHBondContact O-N 3.17Å; H92-V131 CarbonylContact C-O 3.58Å; H92-V131 WeakPolarHBondContact CA-O 3.43Å; H92-V131 HydrophobicContact CB-CB 4.06Å; H92-V131 VanDerWaalsContact CB-O 3.27Å; H92-V131 WeakPolarHBondContact CB-O 3.47Å; L93-V131 PolarHBondContact N-O 3.05Å; F129-V131 HydrophobicContact CD2-CG2 4.27Å; F129-V131 HydrophobicContact CE2-CG2 3.96Å; V131-R160 CarbonylContact C-O 3.51Å; V131-R160 VanDerWaalsContact CA-O 3.31Å; V131-R160 WeakPolarHBondContact CA-O 3.45Å; V131-R160 HydrophobicContact CG2-CB 4.42Å; V131-I162 HydrophobicContact CG1-CB 4.36Å; V131-I162 HydrophobicContact CG1-CD1 3.71Å; V131-I162 HydrophobicContact CG1-CG1 3.73Å
132V94.3Very high81.7Confident0 Ų059 Ų590%030%0.298CS..EExtended strand (participates in β ladder)trans-105116.7167.6-176.70000108.9L93 V115 L134 R160 L161 I162L93-V132 HydrophobicContact CD2-CG1 4.49Å; V115-V132 HydrophobicContact CB-CG2 4.1Å; V115-V132 HydrophobicContact CG1-CG2 3.8Å; V115-V132 HydrophobicContact CG2-CG2 4.15Å; V132-L134 HydrophobicContact CG1-CD2 3.84Å; V132-L134 HydrophobicContact CG1-CG 4.27Å; V132-R160 PolarHBondContact N-O 3.46Å; V132-L161 HydrophobicContact CB-CG 4.4Å; V132-L161 WeakPolarHBondContact O-CA 3.4Å; V132-I162 PolarHBondContact O-N 3.2Å
133L95.6Very high83.4Confident2 Ų258 Ų581%0.0130%0.297CS..EExtended strand (participates in β ladder)trans-95.1110.9174.7172.557.7000109.4I52 L93 E94 V95 T135 I162 C164I52-L133 HydrophobicContact CD1-CD1 3.9Å; I52-L133 HydrophobicContact CG2-CD1 4.1Å; I52-L133 HydrophobicContact CG2-CD2 3.93Å; L93-L133 PolarHBondContact O-N 2.76Å; E94-L133 WeakPolarHBondContact CA-O 3.27Å; E94-L133 HydrophobicContact CB-CB 4.24Å; E94-L133 HydrophobicContact CB-CD2 4.08Å; E94-L133 HydrophobicContact CB-CG 4.32Å; E94-L133 HydrophobicContact CG-CD2 3.89Å; E94-L133 HydrophobicContact CG-CG 4.12Å; V95-L133 PolarHBondContact N-O 3.48Å; L133-T135 HydrophobicContact CG-CG2 4.4Å; L133-I162 WeakPolarHBondContact CA-O 3.42Å; L133-I162 HydrophobicContact CD1-CB 4.13Å; L133-I162 HydrophobicContact CD1-CG2 3.91Å; L133-I162 WeakPolarHBondContact CD1-O 3.44Å; L133-C164 HydrophobicContact CD1-CB 4.27Å
134L94.2Very high85.2Confident3 Ų353.6 Ų53.62%0.01627%0.266CS..EExtended strand (participates in β ladder)trans-99120.2172.6-57.8-176.9000109.2V95 P97 V132 V137 L148 L161 I162 L163 C164V95-L134 HydrophobicContact CG1-CD2 3.32Å; P97-L134 HydrophobicContact CG-CD2 4.42Å; V132-L134 HydrophobicContact CG1-CD2 3.84Å; V132-L134 HydrophobicContact CG1-CG 4.27Å; L134-V137 HydrophobicContact CB-CG2 3.75Å; L134-V137 WeakPolarHBondContact O-CG2 3.42Å; L134-L148 HydrophobicContact CD1-CD1 3.53Å; L134-L148 HydrophobicContact CD1-CD2 3.85Å; L134-L148 HydrophobicContact CD1-CG 4.37Å; L134-L161 HydrophobicContact CD1-CD2 4.27Å; L134-I162 PolarHBondContact N-O 2.86Å; L134-L163 HydrophobicContact CB-CD2 3.96Å; L134-L163 HydrophobicContact CD1-CD2 3.78Å; L134-L163 HydrophobicContact CG-CD2 4.12Å; L134-C164 PolarHBondContact O-N 3.45Å
135T93.4Very high87Confident10 Ų1048.5 Ų48.56%0.06123%0.23CC..EExtended strand (participates in β ladder)trans-92.4157.1174600000111.7E94 V95 N96 L133 V137 C164E94-T135 HydrophobicContact CG-CG2 4.26Å; V95-T135 PolarHBondContact O-N 3.35Å; V95-T135 VanDerWaalsContact O-N 3.12Å; V95-T135 PolarHBondContact O-OG1 3.44Å; N96-T135 WeakPolarHBondContact CB-OG1 3.31Å; N96-T135 PolarHBondContact OD1-O 2.92Å; N96-T135 VanDerWaalsContact OD1-O 3.14Å; N96-T135 PolarHBondContact OD1-OG1 2.89Å; N96-T135 VanDerWaalsContact OD1-OG1 3.07Å; L133-T135 HydrophobicContact CG-CG2 4.4Å; T135-V137 VanDerWaalsContact C-N 3.26Å; T135-V137 PolarHBondContact O-N 3.45Å; T135-C164 CarbonylContact C-O 3.56Å
136E90.5Very high88.9Confident70 Ų7046.7 Ų46.733%0.32721%0.214SC..  trans52.540.1176.2-52-165.2161.600114D138 R139 C164E136-D138 VanDerWaalsContact C-OD1 3.29Å; E136-D138 WeakPolarHBondContact CA-OD1 3.41Å; E136-D138 PolarHBondContact O-N 3.28Å; E136-D138 VanDerWaalsContact O-N 3.08Å; E136-R139 WeakPolarHBondContact O-CB 3.18Å; E136-R139 PolarHBondContact O-N 3.23Å; E136-R139 IonicContact OE1-NH1 3.16Å; E136-R139 WeakPolarHBondContact OE2-CD 3.42Å; E136-R139 IonicContact OE2-CZ 3.6Å; E136-R139 IonicContact OE2-NE 3.61Å; E136-R139 IonicContact OE2-NH1 3.72Å; E136-R139 PolarHBondContact OE2-NH1 3.43Å; E136-C164 PolarHBondContact N-O 3.35Å
137V92.1Very high90.3Very high0 Ų045.1 Ų45.10%021%0.207CC..G310 helixtrans-59.5-24.2-178.1176.50000112.5L134 T135 R139 L140 L163 C164L134-V137 HydrophobicContact CB-CG2 3.75Å; L134-V137 WeakPolarHBondContact O-CG2 3.42Å; T135-V137 VanDerWaalsContact C-N 3.26Å; T135-V137 PolarHBondContact O-N 3.45Å; V137-R139 PolarHBondContact O-N 3.37Å; V137-L140 HydrophobicContact CB-CD1 4.47Å; V137-L140 HydrophobicContact CG1-CD1 4.12Å; V137-L140 WeakPolarHBondContact O-CB 3.1Å; V137-L140 PolarHBondContact O-N 3.08Å; V137-L163 HydrophobicContact CG1-CD1 4.49Å; V137-L163 HydrophobicContact CG2-CB 4Å; V137-L163 HydrophobicContact CG2-CD2 4.09Å; V137-C164 PolarHBondContact N-O 3.15Å
138D90.4Very high91.4Very high17 Ų1740.8 Ų40.89%0.09119%0.191CC..G310 helixtrans-68.9-14.9174.149.4-29.8000114.6E136 T166 K170E136-D138 VanDerWaalsContact C-OD1 3.29Å; E136-D138 WeakPolarHBondContact CA-OD1 3.41Å; E136-D138 PolarHBondContact O-N 3.28Å; E136-D138 VanDerWaalsContact O-N 3.08Å; D138-T166 WeakPolarHBondContact OD2-CB 3.45Å; D138-T166 PolarHBondContact OD2-N 3.48Å; D138-T166 PolarHBondContact OD2-OG1 2.88Å; D138-K170 HydrophobicContact CB-CB 4.32Å; D138-K170 VanDerWaalsContact O-CD 3.29Å; D138-K170 WeakPolarHBondContact O-CD 3.39Å
139R90.1Very high92.3Very high132 Ų13236.4 Ų36.450%0.49817%0.167SC..G310 helixtrans-94.5-6.2174.1-67.2-176.8170.2175.8-9.7113.6E136 V137E136-R139 WeakPolarHBondContact O-CB 3.18Å; E136-R139 PolarHBondContact O-N 3.23Å; E136-R139 IonicContact OE1-NH1 3.16Å; E136-R139 WeakPolarHBondContact OE2-CD 3.42Å; E136-R139 IonicContact OE2-CZ 3.6Å; E136-R139 IonicContact OE2-NE 3.61Å; E136-R139 IonicContact OE2-NH1 3.72Å; E136-R139 PolarHBondContact OE2-NH1 3.43Å; V137-R139 PolarHBondContact O-N 3.37Å
140L91.8Very high92.5Very high9 Ų944.2 Ų44.25%0.04720%0.196CC..SBendtrans-68143.1177.4-74176.5000112.4P97 D104 I108 V137 A144 Q145P97-L140 HydrophobicContact CB-CD2 3.9Å; P97-L140 HydrophobicContact CG-CD1 4.2Å; P97-L140 HydrophobicContact CG-CD2 3.69Å; P97-L140 HydrophobicContact CG-CG 4.25Å; D104-L140 HydrophobicContact CB-CD2 3.84Å; I108-L140 HydrophobicContact CD1-CD1 3.67Å; I108-L140 HydrophobicContact CD1-CD2 3.89Å; I108-L140 HydrophobicContact CD1-CG 4.42Å; V137-L140 HydrophobicContact CB-CD1 4.47Å; V137-L140 HydrophobicContact CG1-CD1 4.12Å; V137-L140 WeakPolarHBondContact O-CB 3.1Å; V137-L140 PolarHBondContact O-N 3.08Å; L140-A144 HydrophobicContact CB-CB 4.46Å; L140-A144 HydrophobicContact CD2-CB 4.24Å; L140-Q145 HydrophobicContact CB-CG 3.91Å; L140-Q145 PolarHBondContact O-NE2 2.87Å; L140-Q145 VanDerWaalsContact O-NE2 3.14Å
141T92.3Very high92.7Very high44 Ų4443.2 Ų43.227%0.2719%0.192SC..  trans-62.8152.9171.964.90000111D104 D143 A144 Q145D104-T141 VanDerWaalsContact CG-OG1 3.3Å; D104-T141 PolarHBondContact OD1-OG1 2.92Å; D104-T141 WeakPolarHBondContact OD2-CB 3.5Å; D104-T141 WeakPolarHBondContact OD2-CG2 3.19Å; D104-T141 PolarHBondContact OD2-N 3.21Å; D104-T141 PolarHBondContact OD2-OG1 3.39Å; T141-D143 PolarHBondContact O-N 3.41Å; T141-A144 PolarHBondContact O-N 3.21Å; T141-A144 VanDerWaalsContact O-N 3.15Å; T141-A144 VanDerWaalsContact OG1-CB 3.22Å; T141-A144 WeakPolarHBondContact OG1-CB 3.24Å; T141-A144 PolarHBondContact OG1-N 3Å; T141-Q145 WeakPolarHBondContact O-CG 3.48Å; T141-Q145 PolarHBondContact O-N 3.29Å
142K91.6Very high92.7Very high156 Ų15643.3 Ų43.368%0.67819%0.193SC*.Hα-helixtrans-58.7-36.4177.8-69.2-174.6179.5178.90111.8Q145 H146K142-Q145 PolarHBondContact O-N 3.04Å; K142-H146 PolarHBondContact O-CD2 3.12Å; K142-H146 PolarHBondContact O-N 3.1Å
143D92.6Very high92.5Very high111 Ų11147.9 Ų47.959%0.59421%0.214SC*.Hα-helixtrans-67-40.7177.6-65.4-27.2000112T141 H146 A147T141-D143 PolarHBondContact O-N 3.41Å; D143-H146 PolarHBondContact O-N 3.06Å; D143-A147 WeakPolarHBondContact O-CB 3.25Å; D143-A147 PolarHBondContact O-N 3.43Å
144A93.3Very high92.3Very high0 Ų054.9 Ų54.90%025%0.245CC..Hα-helixtrans-64.7-39.9173.300000111.9D104 R105 I108 L140 T141 A147 L148D104-A144 HydrophobicContact CB-CB 4.13Å; D104-A144 WeakPolarHBondContact OD2-CB 3.41Å; R105-A144 HydrophobicContact CB-CB 4.27Å; I108-A144 HydrophobicContact CD1-CB 3.94Å; L140-A144 HydrophobicContact CB-CB 4.46Å; L140-A144 HydrophobicContact CD2-CB 4.24Å; T141-A144 PolarHBondContact O-N 3.21Å; T141-A144 VanDerWaalsContact O-N 3.15Å; T141-A144 VanDerWaalsContact OG1-CB 3.22Å; T141-A144 WeakPolarHBondContact OG1-CB 3.24Å; T141-A144 PolarHBondContact OG1-N 3Å; A144-A147 WeakPolarHBondContact O-CB 3.44Å; A144-A147 PolarHBondContact O-N 2.87Å; A144-L148 WeakPolarHBondContact O-CB 3.48Å; A144-L148 PolarHBondContact O-N 3.02Å
145Q94.3Very high92.1Very high2 Ų256.8 Ų56.81%0.00925%0.252CS..Hα-helixtrans-63.7-40.1173.9-68.3-174.241.200112.2L140 T141 K142 L148 R149 K170 I172 I175L140-Q145 HydrophobicContact CB-CG 3.91Å; L140-Q145 PolarHBondContact O-NE2 2.87Å; L140-Q145 VanDerWaalsContact O-NE2 3.14Å; T141-Q145 WeakPolarHBondContact O-CG 3.48Å; T141-Q145 PolarHBondContact O-N 3.29Å; K142-Q145 PolarHBondContact O-N 3.04Å; Q145-L148 WeakPolarHBondContact O-CB 3.4Å; Q145-L148 PolarHBondContact O-N 3.06Å; Q145-R149 PolarHBondContact O-N 3.41Å; Q145-K170 PolarHBondContact NE2-O 3.2Å; Q145-K170 PolarHBondContact OE1-O 3.43Å; Q145-I172 HydrophobicContact CB-CD1 3.86Å; Q145-I172 HydrophobicContact CB-CG1 4.07Å; Q145-I172 HydrophobicContact CB-CG2 4.46Å; Q145-I175 HydrophobicContact CB-CD1 3.78Å; Q145-I175 HydrophobicContact CG-CD1 4.18Å
146H93.9Very high91.8Very high74 Ų7460.6 Ų60.634%0.34327%0.27SS..Hα-helixtrans-66.2-37173.4-76.3-56.7000112.7K142 D143 R150K142-H146 PolarHBondContact O-CD2 3.12Å; K142-H146 PolarHBondContact O-N 3.1Å; D143-H146 PolarHBondContact O-N 3.06Å; H146-R150 WeakPolarHBondContact O-CG 3.42Å; H146-R150 PolarHBondContact O-N 2.83Å
147A93Very high91.6Very high4 Ų461.5 Ų61.53%0.03329%0.289CS..Hα-helixtrans-64.9-44172.900000111.7R105 Q109 D143 A144 R149 R150 T151R105-A147 HydrophobicContact CG-CB 3.66Å; Q109-A147 HydrophobicContact CG-CB 4.13Å; D143-A147 WeakPolarHBondContact O-CB 3.25Å; D143-A147 PolarHBondContact O-N 3.43Å; A144-A147 WeakPolarHBondContact O-CB 3.44Å; A144-A147 PolarHBondContact O-N 2.87Å; A147-R149 VanDerWaalsContact C-N 3.35Å; A147-R149 PolarHBondContact O-N 2.93Å; A147-R150 PolarHBondContact O-N 2.92Å; A147-R150 VanDerWaalsContact O-N 3.17Å; A147-T151 PolarHBondContact O-N 3.27Å; A147-T151 PolarHBondContact O-OG1 3.26Å
148L93.8Very high91.4Very high0 Ų064.3 Ų64.30%031%0.307CS..Hα-helixtrans-56.6-47.3175.4-18059.8000111.2I108 I112 L134 A144 Q145 R150 T151 M152 L161 L163 I175I108-L148 HydrophobicContact CD1-CB 4.4Å; I108-L148 HydrophobicContact CG2-CB 3.99Å; I108-L148 HydrophobicContact CG2-CD1 3.76Å; I108-L148 HydrophobicContact CG2-CG 4.48Å; I112-L148 HydrophobicContact CD1-CD1 3.62Å; L134-L148 HydrophobicContact CD1-CD1 3.53Å; L134-L148 HydrophobicContact CD1-CD2 3.85Å; L134-L148 HydrophobicContact CD1-CG 4.37Å; A144-L148 WeakPolarHBondContact O-CB 3.48Å; A144-L148 PolarHBondContact O-N 3.02Å; Q145-L148 WeakPolarHBondContact O-CB 3.4Å; Q145-L148 PolarHBondContact O-N 3.06Å; L148-R150 VanDerWaalsContact C-N 3.31Å; L148-R150 PolarHBondContact O-N 3.13Å; L148-T151 WeakPolarHBondContact CA-OG1 3.37Å; L148-T151 PolarHBondContact O-N 3.13Å; L148-T151 PolarHBondContact O-OG1 3.38Å; L148-M152 HydrophobicContact CD1-CG 4.12Å; L148-M152 HydrophobicContact CD1-SD 4.35Å; L148-M152 HydrophobicContact CG-CG 4.27Å; L148-M152 HydrophobicContact CG-SD 3.95Å; L148-M152 WeakPolarHBondContact O-CB 3.25Å; L148-M152 WeakPolarHBondContact O-CG 3.36Å; L148-M152 PolarHBondContact O-N 3.33Å; L148-L161 HydrophobicContact CD1-CD2 3.52Å; L148-L163 HydrophobicContact CD2-CD1 4.41Å; L148-L163 HydrophobicContact CD2-CD2 4.02Å; L148-I175 HydrophobicContact CD2-CD1 4.08Å
149R93.6Very high91.3Very high82 Ų8263.5 Ų63.531%0.30930%0.302SS..Hα-helixtrans-54-46.6175.8-179.9-155.6163.9-168.9-8.9112Q145 A147 E153 P174 I175Q145-R149 PolarHBondContact O-N 3.41Å; A147-R149 VanDerWaalsContact C-N 3.35Å; A147-R149 PolarHBondContact O-N 2.93Å; R149-E153 IonicContact NE-OE1 3.75Å; R149-E153 PolarHBondContact O-N 2.89Å; R149-P174 HydrophobicContact CG-CB 4.3Å; R149-I175 HydrophobicContact CB-CG1 4.42Å
150R91.8Very high91.4Very high179 Ų17958.6 Ų58.668%0.67528%0.284SS*.Hα-helixtrans-67.1-40.1-178.9-65.2179.4-162.6179.44.4111.8H146 A147 L148 K154H146-R150 WeakPolarHBondContact O-CG 3.42Å; H146-R150 PolarHBondContact O-N 2.83Å; A147-R150 PolarHBondContact O-N 2.92Å; A147-R150 VanDerWaalsContact O-N 3.17Å; L148-R150 VanDerWaalsContact C-N 3.31Å; L148-R150 PolarHBondContact O-N 3.13Å; R150-K154 WeakPolarHBondContact O-CB 3.47Å; R150-K154 PolarHBondContact O-N 3.48Å; R150-K154 VanDerWaalsContact O-N 3.09Å
151T91.9Very high91.6Very high13 Ų1358.2 Ų58.28%0.0828%0.282CS..Hα-helixtrans-72.3-34.1179.551.90000112.3Q109 I112 A147 L148 K154 Y155Q109-T151 HydrophobicContact CG-CG2 4.19Å; I112-T151 WeakPolarHBondContact CD1-OG1 3.43Å; A147-T151 PolarHBondContact O-N 3.27Å; A147-T151 PolarHBondContact O-OG1 3.26Å; L148-T151 WeakPolarHBondContact CA-OG1 3.37Å; L148-T151 PolarHBondContact O-N 3.13Å; L148-T151 PolarHBondContact O-OG1 3.38Å; T151-K154 PolarHBondContact O-N 3.41Å; T151-Y155 WeakPolarHBondContact O-CD2 3.29Å; T151-Y155 PolarHBondContact O-N 3.26Å
152M91.6Very high91.7Very high2 Ų256.1 Ų56.11%0.0127%0.269CS..Hα-helixtrans-56.9-48172-74.1174.47500111.5H37 L148 M156 L161 C179H37-M152 HydrophobicContact CB-CE 3.88Å; L148-M152 HydrophobicContact CD1-CG 4.12Å; L148-M152 HydrophobicContact CD1-SD 4.35Å; L148-M152 HydrophobicContact CG-CG 4.27Å; L148-M152 HydrophobicContact CG-SD 3.95Å; L148-M152 WeakPolarHBondContact O-CB 3.25Å; L148-M152 WeakPolarHBondContact O-CG 3.36Å; L148-M152 PolarHBondContact O-N 3.33Å; M152-M156 PolarHBondContact O-N 3.26Å; M152-L161 HydrophobicContact CG-CD1 3.9Å; M152-L161 HydrophobicContact CG-CD2 3.68Å; M152-L161 HydrophobicContact CG-CG 4.32Å; M152-L161 HydrophobicContact SD-CD2 4.39Å; M152-C179 VanDerWaalsContact CE-SG 3.57Å
153E90.3Very high91.9Very high95 Ų9548.7 Ų48.744%0.44424%0.237SC..Hα-helixtrans-67.1-42.5178.3-69.2173.5167.700111.8R149 Y155 R178R149-E153 IonicContact NE-OE1 3.75Å; R149-E153 PolarHBondContact O-N 2.89Å; E153-Y155 PolarHBondContact O-N 2.99Å; E153-R178 IonicContact OE1-CZ 3.64Å; E153-R178 IonicContact OE1-NE 2.75Å; E153-R178 PolarHBondContact OE1-NE 3.32Å; E153-R178 IonicContact OE1-NH2 3.8Å; E153-R178 PolarHBondContact OE1-NH2 3.03Å
154K91.6Very high92.1Very high150 Ų15043.9 Ų43.965%0.65221%0.212SC*.Hα-helixtrans-64.4-36.7-176.8-174.3176.9179.8-173.80113.3R150 T151R150-K154 WeakPolarHBondContact O-CB 3.47Å; R150-K154 PolarHBondContact O-N 3.48Å; R150-K154 VanDerWaalsContact O-N 3.09Å; T151-K154 PolarHBondContact O-N 3.41Å
155Y90.4Very high92.1Very high43 Ų4344 Ų4417%0.16921%0.212CC..THydrogen-bonded Turntrans-115.221.6-172.8-57.1-66.2000113.6I112 A116 T151 E153 A157 T158 C159I112-Y155 HydrophobicContact CG2-CD2 3.72Å; I112-Y155 HydrophobicContact CG2-CE2 4.41Å; I112-Y155 HydrophobicContact CG2-CG 4.45Å; A116-Y155 HydrophobicContact CB-CD1 3.48Å; A116-Y155 VanDerWaalsContact CB-CD1 3.48Å; A116-Y155 HydrophobicContact CB-CD2 4.34Å; A116-Y155 HydrophobicContact CB-CE1 3.95Å; A116-Y155 HydrophobicContact CB-CG 3.7Å; T151-Y155 WeakPolarHBondContact O-CD2 3.29Å; T151-Y155 PolarHBondContact O-N 3.26Å; E153-Y155 PolarHBondContact O-N 2.99Å; Y155-A157 PolarHBondContact O-N 3.28Å; Y155-T158 PolarHBondContact O-N 3.49Å; Y155-T158 PolarHBondContact O-OG1 2.97Å; Y155-C159 PolarHBondContact O-N 2.97Å
156M87.8Confident92Very high90 Ų9047.3 Ų47.344%0.44323%0.233SC..THydrogen-bonded Turntrans-57.4-32.5-177.7-173.7177.3-175.700113.7M152 R160M152-M156 PolarHBondContact O-N 3.26Å; M156-R160 PolarHBondContact O-NE 3.36Å
157A86.1Confident91.8Very high88 Ų8846 Ų4673%0.72723%0.232SC*.THydrogen-bonded Turntrans-70.6-36.5-179.500000112.9Y155Y155-A157 PolarHBondContact O-N 3.28Å
158T87.4Confident91.8Very high60 Ų6047.7 Ų47.737%0.36824%0.242SC..THydrogen-bonded Turntrans-102.3-22.4-173.657.70000113.3F129 K130 Y155F129-T158 VanDerWaalsContact CA-O 3.31Å; F129-T158 WeakPolarHBondContact CA-O 3.37Å; K130-T158 PolarHBondContact N-O 3.08Å; Y155-T158 PolarHBondContact O-N 3.49Å; Y155-T158 PolarHBondContact O-OG1 2.97Å
159C88.8Confident91.6Very high0 Ų052.9 Ų52.90%028%0.278CS..EExtended strand (participates in β ladder)trans-134.8130.9-175.3-64.60000111.9A116 K130 Y155A116-C159 VanDerWaalsContact CA-SG 3.52Å; K130-C159 CarbonylContact O-C 3.6Å; K130-C159 WeakPolarHBondContact O-CA 3.48Å; Y155-C159 PolarHBondContact O-N 2.97Å
160R92.4Very high91.4Very high29 Ų2954.8 Ų54.811%0.10929%0.289CS..EExtended strand (participates in β ladder)trans-104.5149.1166.8-59.8-62.9178.2130.71.4109.1D34 F35 F129 K130 V131 V132 M156D34-R160 IonicContact OD1-CZ 3.27Å; D34-R160 IonicContact OD1-NH1 2.96Å; D34-R160 PolarHBondContact OD1-NH1 2.96Å; D34-R160 IonicContact OD1-NH2 3.28Å; D34-R160 PolarHBondContact OD1-NH2 2.99Å; F35-R160 HydrophobicContact CD1-CB 3.98Å; F35-R160 HydrophobicContact CD1-CG 4.15Å; F35-R160 HydrophobicContact CE1-CB 4.36Å; F35-R160 WeakPolarHBondContact O-CD 3.29Å; F35-R160 PolarHBondContact O-NE 3.48Å; F35-R160 PolarHBondContact O-NH1 2.96Å; F129-R160 HydrophobicContact CB-CG 4.16Å; F129-R160 HydrophobicContact CD1-CG 4.1Å; F129-R160 HydrophobicContact CD2-CB 3.69Å; F129-R160 HydrophobicContact CD2-CG 3.28Å; F129-R160 HydrophobicContact CE1-CG 4.34Å; F129-R160 HydrophobicContact CE2-CB 3.88Å; F129-R160 HydrophobicContact CE2-CG 3.57Å; F129-R160 HydrophobicContact CG-CB 4.44Å; F129-R160 HydrophobicContact CG-CG 3.58Å; F129-R160 HydrophobicContact CZ-CG 4.1Å; K130-R160 PolarHBondContact O-N 3.33Å; V131-R160 CarbonylContact C-O 3.51Å; V131-R160 VanDerWaalsContact CA-O 3.31Å; V131-R160 WeakPolarHBondContact CA-O 3.45Å; V131-R160 HydrophobicContact CG2-CB 4.42Å; V132-R160 PolarHBondContact N-O 3.46Å; M156-R160 PolarHBondContact O-NE 3.36Å
161L94.6Very high91.5Very high1 Ų146.7 Ų46.71%0.00526%0.259CS..EExtended strand (participates in β ladder)trans-117.9136.3-174.9-74.286.3000109.7H37 L38 I112 V132 L134 L148 M152 L163H37-L161 CarbonylContact C-O 3.6Å; H37-L161 WeakPolarHBondContact CA-O 3.23Å; H37-L161 PolarHBondContact ND1-N 3.27Å; L38-L161 PolarHBondContact N-O 3.4Å; I112-L161 HydrophobicContact CD1-CD2 4.01Å; V132-L161 HydrophobicContact CB-CG 4.4Å; V132-L161 WeakPolarHBondContact O-CA 3.4Å; L134-L161 HydrophobicContact CD1-CD2 4.27Å; L148-L161 HydrophobicContact CD1-CD2 3.52Å; M152-L161 HydrophobicContact CG-CD1 3.9Å; M152-L161 HydrophobicContact CG-CD2 3.68Å; M152-L161 HydrophobicContact CG-CG 4.32Å; M152-L161 HydrophobicContact SD-CD2 4.39Å; L161-L163 HydrophobicContact CB-CD2 4.42Å; L161-L163 HydrophobicContact CD2-CD2 4.34Å
162I96.1Very high91.6Very high0 Ų047.2 Ų47.20%026%0.261CS..EExtended strand (participates in β ladder)trans-116.6113.7168.4-58.7-177.9000106.9F35 L38 V40 I52 L55 L56 V131 V132 L133 L134F35-I162 HydrophobicContact CE1-CD1 4.41Å; F35-I162 HydrophobicContact CE1-CG1 4.39Å; F35-I162 HydrophobicContact CZ-CD1 4.16Å; F35-I162 HydrophobicContact CZ-CG1 4.48Å; L38-I162 HydrophobicContact CB-CG1 4.31Å; L38-I162 HydrophobicContact CB-CG2 4.38Å; L38-I162 HydrophobicContact CD1-CD1 4.47Å; L38-I162 HydrophobicContact CD1-CG1 4.47Å; L38-I162 CarbonylContact O-C 3.45Å; L38-I162 WeakPolarHBondContact O-CA 3.46Å; V40-I162 HydrophobicContact CG2-CG2 4.18Å; I52-I162 HydrophobicContact CD1-CG2 3.84Å; I52-I162 HydrophobicContact CG1-CG2 3.91Å; I52-I162 HydrophobicContact CG2-CD1 4.12Å; I52-I162 HydrophobicContact CG2-CG2 4.04Å; L55-I162 HydrophobicContact CD2-CD1 4.1Å; L56-I162 HydrophobicContact CD2-CD1 4.31Å; V131-I162 HydrophobicContact CG1-CB 4.36Å; V131-I162 HydrophobicContact CG1-CD1 3.71Å; V131-I162 HydrophobicContact CG1-CG1 3.73Å; V132-I162 PolarHBondContact O-N 3.2Å; L133-I162 WeakPolarHBondContact CA-O 3.42Å; L133-I162 HydrophobicContact CD1-CB 4.13Å; L133-I162 HydrophobicContact CD1-CG2 3.91Å; L133-I162 WeakPolarHBondContact CD1-O 3.44Å; L134-I162 PolarHBondContact N-O 2.86Å
163L95.8Very high91.7Very high0 Ų049.3 Ų49.30%028%0.284CS..EExtended strand (participates in β ladder)trans-96.8125.2178.9-55.1-176.1000108.3L38 L39 V40 L134 V137 L148 L161 I175L38-L163 PolarHBondContact O-N 3.02Å; L39-L163 CarbonylContact C-O 3.55Å; L39-L163 WeakPolarHBondContact CA-O 3.22Å; L39-L163 HydrophobicContact CD1-CB 3.61Å; L39-L163 HydrophobicContact CD1-CD1 4.49Å; V40-L163 PolarHBondContact N-O 3.17Å; L134-L163 HydrophobicContact CB-CD2 3.96Å; L134-L163 HydrophobicContact CD1-CD2 3.78Å; L134-L163 HydrophobicContact CG-CD2 4.12Å; V137-L163 HydrophobicContact CG1-CD1 4.49Å; V137-L163 HydrophobicContact CG2-CB 4Å; V137-L163 HydrophobicContact CG2-CD2 4.09Å; L148-L163 HydrophobicContact CD2-CD1 4.41Å; L148-L163 HydrophobicContact CD2-CD2 4.02Å; L161-L163 HydrophobicContact CB-CD2 4.42Å; L161-L163 HydrophobicContact CD2-CD2 4.34Å; L163-I175 HydrophobicContact CD1-CG2 3.44Å; L163-I175 VanDerWaalsContact CD1-CG2 3.44Å
164C95.5Very high91.9Very high10 Ų1046.7 Ų46.77%0.06828%0.275CS..EExtended strand (participates in β ladder)trans-111.9115.7175.9179.40000109.9V40 I52 L133 L134 T135 E136 V137V40-C164 WeakPolarHBondContact O-CA 3.5Å; I52-C164 HydrophobicContact CD1-CB 4.01Å; L133-C164 HydrophobicContact CD1-CB 4.27Å; L134-C164 PolarHBondContact O-N 3.45Å; T135-C164 CarbonylContact C-O 3.56Å; E136-C164 PolarHBondContact N-O 3.35Å; V137-C164 PolarHBondContact N-O 3.15Å
165S93.7Very high92Very high2 Ų239.6 Ų39.61%0.01424%0.244CC..EExtended strand (participates in β ladder)trans-127.8162.9176.673.80000112.2V40 Y41 G42 K48 S167V40-S165 PolarHBondContact O-N 2.98Å; V40-S165 VanDerWaalsContact O-N 3.11Å; Y41-S165 WeakPolarHBondContact CA-O 3.44Å; Y41-S165 WeakPolarHBondContact CB-OG 3.28Å; G42-S165 PolarHBondContact N-O 3.46Å; K48-S165 VanDerWaalsContact CE-O 3.25Å; K48-S165 WeakPolarHBondContact CE-O 3.43Å; S165-S167 WeakPolarHBondContact CB-O 3.43Å; S165-S167 PolarHBondContact OG-O 2.86Å
166T92.4Very high92.2Very high71 Ų7140.6 Ų40.644%0.43625%0.252SS..SBendtrans-83.8-42.5171.568.70000111.7G42 D138G42-T166 CarbonylContact C-O 3.48Å; G42-T166 WeakPolarHBondContact CA-O 3.45Å; G42-T166 PolarHBondContact N-O 3.47Å; G42-T166 CarbonylContact O-C 3.5Å; G42-T166 VanDerWaalsContact O-CA 3.26Å; G42-T166 WeakPolarHBondContact O-CA 3.46Å; D138-T166 WeakPolarHBondContact OD2-CB 3.45Å; D138-T166 PolarHBondContact OD2-N 3.48Å; D138-T166 PolarHBondContact OD2-OG1 2.88Å
167S89.6Confident92.4Very high47 Ų4740.7 Ų40.733%0.32926%0.261SS..  trans-127.9154.7176.6-177.90000110.9S165 S169S165-S167 WeakPolarHBondContact CB-O 3.43Å; S165-S167 PolarHBondContact OG-O 2.86Å; S167-S169 PolarHBondContact OG-N 3.47Å; S167-S169 PolarHBondContact OG-OG 3.14Å
168T92.1Very high92.8Very high40 Ų4040.4 Ų40.425%0.24524%0.241CC..SBendtrans-90.6-14.3173.651.50000112.7L39 Y41 K170 V171 L176L39-T168 HydrophobicContact CD2-CG2 4.18Å; Y41-T168 HydrophobicContact CD1-CG2 3.69Å; Y41-T168 HydrophobicContact CD2-CG2 3.56Å; Y41-T168 HydrophobicContact CE1-CG2 4.02Å; Y41-T168 HydrophobicContact CE2-CG2 3.87Å; Y41-T168 HydrophobicContact CG-CG2 3.43Å; Y41-T168 VanDerWaalsContact CG-CG2 3.43Å; T168-K170 PolarHBondContact O-N 3.38Å; T168-V171 WeakPolarHBondContact O-CB 3.43Å; T168-V171 PolarHBondContact O-N 3.27Å; T168-L176 HydrophobicContact CG2-CD2 4.43Å
169S91.3Very high93.1Very high109 Ų10938.1 Ų38.176%0.76223%0.228SC*.THydrogen-bonded Turntrans-60.3-31.3-173.5-49.70000114S167S167-S169 PolarHBondContact OG-N 3.47Å; S167-S169 PolarHBondContact OG-OG 3.14Å
170K88.9Confident93.4Very high121 Ų12141.6 Ų41.653%0.52625%0.246SC..THydrogen-bonded Turntrans-89-3.7178.8-67-173177.8-176.10113.5D138 Q145 T168D138-K170 HydrophobicContact CB-CB 4.32Å; D138-K170 VanDerWaalsContact O-CD 3.29Å; D138-K170 WeakPolarHBondContact O-CD 3.39Å; Q145-K170 PolarHBondContact NE2-O 3.2Å; Q145-K170 PolarHBondContact OE1-O 3.43Å; T168-K170 PolarHBondContact O-N 3.38Å
171V93.2Very high93.5Very high9 Ų943 Ų436%0.05526%0.264CS..SBendtrans-90.3129.4-180-177.70000109.6T168 I175 L176T168-V171 WeakPolarHBondContact O-CB 3.43Å; T168-V171 PolarHBondContact O-N 3.27Å; V171-I175 HydrophobicContact CG1-CB 3.9Å; V171-I175 HydrophobicContact CG1-CD1 4.45Å; V171-I175 HydrophobicContact CG1-CG2 3.87Å; V171-L176 HydrophobicContact CB-CD2 4.18Å; V171-L176 HydrophobicContact CG1-CD2 3.89Å; V171-L176 HydrophobicContact CG1-CG 4.16Å
172I94.7Very high93.5Very high25 Ų2543.5 Ų43.513%0.12827%0.267CS..  trans-64.8141.2-179.863.9173.2000111.7Q145 P174 I175 L176Q145-I172 HydrophobicContact CB-CD1 3.86Å; Q145-I172 HydrophobicContact CB-CG1 4.07Å; Q145-I172 HydrophobicContact CB-CG2 4.46Å; I172-P174 VanDerWaalsContact C-N 3.29Å; I172-P174 HydrophobicContact CD1-CB 4.4Å; I172-P174 HydrophobicContact CD1-CG 4.44Å; I172-P174 VanDerWaalsContact O-N 3.15Å; I172-I175 HydrophobicContact CD1-CD1 4.16Å; I172-I175 HydrophobicContact CD1-CG1 4.12Å; I172-I175 HydrophobicContact CG1-CB 4.26Å; I172-I175 HydrophobicContact CG1-CD1 3.79Å; I172-I175 HydrophobicContact CG1-CG1 3.75Å; I172-I175 PolarHBondContact O-N 3.36Å; I172-L176 PolarHBondContact O-N 3.4Å
173G93.5Very high93.4Very high46 Ų4651.4 Ų51.447%0.47430%0.297SS..Hα-helixtrans-48.8-39.6177.700000115.3I175 L176 S177G173-I175 VanDerWaalsContact C-N 3.28Å; G173-I175 PolarHBondContact O-N 2.96Å; G173-L176 WeakPolarHBondContact O-CB 3.19Å; G173-L176 PolarHBondContact O-N 3.34Å; G173-L176 VanDerWaalsContact O-N 3.15Å; G173-S177 PolarHBondContact O-N 3.49Å
174P94.4Very high93.4Very high40 Ų4051.4 Ų51.426%0.2630%0.297SS..Hα-helixtrans-60.5-28175.9-28.737000115.8R149 I172 S177 R178R149-P174 HydrophobicContact CG-CB 4.3Å; I172-P174 VanDerWaalsContact C-N 3.29Å; I172-P174 HydrophobicContact CD1-CB 4.4Å; I172-P174 HydrophobicContact CD1-CG 4.44Å; I172-P174 VanDerWaalsContact O-N 3.15Å; P174-S177 PolarHBondContact O-OG 3.45Å; P174-R178 WeakPolarHBondContact O-CD 3.25Å; P174-R178 WeakPolarHBondContact O-CG 3.42Å; P174-R178 PolarHBondContact O-NH1 3.13Å
175I94.3Very high93.3Very high0 Ų053 Ų530%031%0.307CS..Hα-helixtrans-77.6-43.5173.9-68175.2000109.4Q145 L148 R149 L163 V171 I172 G173 S177 R178 C179Q145-I175 HydrophobicContact CB-CD1 3.78Å; Q145-I175 HydrophobicContact CG-CD1 4.18Å; L148-I175 HydrophobicContact CD2-CD1 4.08Å; R149-I175 HydrophobicContact CB-CG1 4.42Å; L163-I175 HydrophobicContact CD1-CG2 3.44Å; L163-I175 VanDerWaalsContact CD1-CG2 3.44Å; V171-I175 HydrophobicContact CG1-CB 3.9Å; V171-I175 HydrophobicContact CG1-CD1 4.45Å; V171-I175 HydrophobicContact CG1-CG2 3.87Å; I172-I175 HydrophobicContact CD1-CD1 4.16Å; I172-I175 HydrophobicContact CD1-CG1 4.12Å; I172-I175 HydrophobicContact CG1-CB 4.26Å; I172-I175 HydrophobicContact CG1-CD1 3.79Å; I172-I175 HydrophobicContact CG1-CG1 3.75Å; I172-I175 PolarHBondContact O-N 3.36Å; G173-I175 VanDerWaalsContact C-N 3.28Å; G173-I175 PolarHBondContact O-N 2.96Å; I175-S177 VanDerWaalsContact C-N 3.28Å; I175-S177 PolarHBondContact O-N 2.98Å; I175-R178 PolarHBondContact O-N 2.93Å; I175-R178 VanDerWaalsContact O-N 3.07Å; I175-C179 PolarHBondContact O-N 3.22Å; I175-C179 PolarHBondContact O-SG 2.6Å
176L93.4Very high93.2Very high64 Ų6455.7 Ų55.734%0.33532%0.321SS..Hα-helixtrans-57.2-41179.5-63.2-179.8000112.1L39 T168 V171 I172 G173 R178 C179L39-L176 HydrophobicContact CD2-CD2 3.22Å; T168-L176 HydrophobicContact CG2-CD2 4.43Å; V171-L176 HydrophobicContact CB-CD2 4.18Å; V171-L176 HydrophobicContact CG1-CD2 3.89Å; V171-L176 HydrophobicContact CG1-CG 4.16Å; I172-L176 PolarHBondContact O-N 3.4Å; G173-L176 WeakPolarHBondContact O-CB 3.19Å; G173-L176 PolarHBondContact O-N 3.34Å; G173-L176 VanDerWaalsContact O-N 3.15Å; L176-R178 PolarHBondContact O-N 3.26Å; L176-C179 PolarHBondContact O-N 3.16Å
177S93.3Very high93.3Very high92 Ų9252.3 Ų52.364%0.64330%0.3SS*.THydrogen-bonded Turntrans-70.8-13.2-179.966.30000114.7G173 P174 I175G173-S177 PolarHBondContact O-N 3.49Å; P174-S177 PolarHBondContact O-OG 3.45Å; I175-S177 VanDerWaalsContact C-N 3.28Å; I175-S177 PolarHBondContact O-N 2.98Å
178R93.3Very high93.5Very high82 Ų8252.2 Ų52.231%0.30930%0.3SS..THydrogen-bonded Turntrans-106.6-5.7-177.6-69.1170.5177.460.59.3113.4E153 P174 I175 L176E153-R178 IonicContact OE1-CZ 3.64Å; E153-R178 IonicContact OE1-NE 2.75Å; E153-R178 PolarHBondContact OE1-NE 3.32Å; E153-R178 IonicContact OE1-NH2 3.8Å; E153-R178 PolarHBondContact OE1-NH2 3.03Å; P174-R178 WeakPolarHBondContact O-CD 3.25Å; P174-R178 WeakPolarHBondContact O-CG 3.42Å; P174-R178 PolarHBondContact O-NH1 3.13Å; I175-R178 PolarHBondContact O-N 2.93Å; I175-R178 VanDerWaalsContact O-N 3.07Å; L176-R178 PolarHBondContact O-N 3.26Å
179C94.1Very high93.5Very high12 Ų1252.7 Ų52.78%0.08130%0.303CS..SBendtrans-118.1139.4-178.5-56.30000110.1H37 L39 M152 I175 L176 A181H37-C179 HydrophobicContact CB-CB 4.47Å; H37-C179 CarbonylContact O-C 3.22Å; H37-C179 VanDerWaalsContact O-CA 3.3Å; H37-C179 WeakPolarHBondContact O-CA 3.26Å; L39-C179 HydrophobicContact CB-CB 3.76Å; M152-C179 VanDerWaalsContact CE-SG 3.57Å; I175-C179 PolarHBondContact O-N 3.22Å; I175-C179 PolarHBondContact O-SG 2.6Å; L176-C179 PolarHBondContact O-N 3.16Å; C179-A181 PolarHBondContact O-N 3.26Å
180L94.7Very high93.6Very high74 Ų7455 Ų5539%0.38730%0.301SS..EExtended strand (participates in β ladder)trans-71.8117.8164.7-176.6156.1000108.3L29 P36 H37 L38 L39 V182L29-L180 HydrophobicContact CD1-CD1 4.19Å; L29-L180 HydrophobicContact CD2-CD1 4.47Å; P36-L180 HydrophobicContact CB-CB 4.46Å; P36-L180 HydrophobicContact CG-CB 4.08Å; P36-L180 HydrophobicContact CG-CD1 4.13Å; H37-L180 PolarHBondContact O-N 3.03Å; L38-L180 WeakPolarHBondContact CA-O 3.35Å; L38-L180 HydrophobicContact CD2-CB 3.88Å; L38-L180 HydrophobicContact CD2-CD2 3.67Å; L38-L180 HydrophobicContact CD2-CG 4.27Å; L39-L180 PolarHBondContact N-O 3.14Å; L180-V182 HydrophobicContact CD2-CG2 3.49Å; L180-V182 VanDerWaalsContact CD2-CG2 3.49Å
181A94.6Very high93.8Very high59 Ų5951.8 Ų51.849%0.48829%0.288SS..EExtended strand (participates in β ladder)trans-86.2112.7-173.900000110.8L39 Y41 C179L39-A181 CarbonylContact O-C 3.59Å; L39-A181 WeakPolarHBondContact O-CA 3.36Å; Y41-A181 HydrophobicContact CE1-CB 3.99Å; C179-A181 PolarHBondContact O-N 3.26Å
182V95Very high93.8Very high10 Ų1051.4 Ų51.46%0.06129%0.286CS..EExtended strand (participates in β ladder)trans-105.6106178.7-175.90000109.2L26 L38 L39 V40 Y41 L180 V184L26-V182 HydrophobicContact CD2-CG1 4.31Å; L26-V182 HydrophobicContact CD2-CG2 4.17Å; L38-V182 HydrophobicContact CD2-CG2 4.05Å; L39-V182 PolarHBondContact O-N 3.15Å; V40-V182 WeakPolarHBondContact CA-O 3.48Å; V40-V182 HydrophobicContact CG2-CB 4.27Å; Y41-V182 PolarHBondContact N-O 3.07Å; L180-V182 HydrophobicContact CD2-CG2 3.49Å; L180-V182 VanDerWaalsContact CD2-CG2 3.49Å; V182-V184 HydrophobicContact CG1-CG2 4.38Å
183R94.8Very high93.7Very high166 Ų16651.4 Ų51.463%0.62629%0.288SS*.EExtended strand (participates in β ladder)trans-83.5122.2175.9-173.9177.2172.9-176.5-1.9110.7Q22 Y41 P185Q22-R183 PolarHBondContact NE2-O 3.1Å; Y41-R183 HydrophobicContact CD2-CG 4.41Å; Y41-R183 HydrophobicContact CE1-CB 3.95Å; Y41-R183 HydrophobicContact CE2-CB 3.94Å; Y41-R183 HydrophobicContact CE2-CG 3.73Å; R183-P185 WeakPolarHBondContact O-CD 3.5Å
184V95Very high93.7Very high0 Ų052.4 Ų52.40%029%0.287CS..  trans-109.998.6175.4-176.20000109.1V40 Y41 A46 K48 V182V40-V184 HydrophobicContact CG1-CG2 3.7Å; Y41-V184 PolarHBondContact O-N 3.09Å; A46-V184 HydrophobicContact CB-CG1 4.11Å; A46-V184 VanDerWaalsContact O-CG1 3.25Å; A46-V184 WeakPolarHBondContact O-CG1 3.49Å; K48-V184 HydrophobicContact CG-CB 4Å; K48-V184 HydrophobicContact CG-CG1 4.32Å; K48-V184 HydrophobicContact CG-CG2 4.28Å; V182-V184 HydrophobicContact CG1-CG2 4.38Å
185P93.4Very high93.7Very high45 Ų4550.8 Ų50.829%0.29228%0.276SS..PPolyproline II helixtrans-73.6168.1178.328.9-29.4000112A46 R183A46-P185 WeakPolarHBondContact CB-O 3.43Å; R183-P185 WeakPolarHBondContact O-CD 3.5Å
186L92.3Very high93.6Very high57 Ų5750.8 Ų50.830%0.29828%0.277SS..PPolyproline II helixtrans-66.8143.3171.2-69.3159000109.3P43 A46 R221P43-L186 HydrophobicContact CB-CD1 4.13Å; P43-L186 HydrophobicContact CB-CD2 4.03Å; P43-L186 HydrophobicContact CB-CG 4.02Å; P43-L186 HydrophobicContact CG-CD1 3.84Å; P43-L186 HydrophobicContact CG-CD2 3.78Å; P43-L186 HydrophobicContact CG-CG 3.39Å; A46-L186 HydrophobicContact CB-CD2 4.15Å; L186-R221 HydrophobicContact CB-CB 4Å; L186-R221 HydrophobicContact CD1-CB 4.21Å; L186-R221 HydrophobicContact CD2-CB 4.46Å; L186-R221 WeakPolarHBondContact CD2-O 3.45Å; L186-R221 HydrophobicContact CG-CB 4.38Å
187P93.3Very high93.7Very high1 Ų149.8 Ų49.81%0.00627%0.273CS..PPolyproline II helixtrans-60.4153.1167.827.2-33.4000110.6Y18 E191 V192 L223Y18-P187 HydrophobicContact CD2-CB 3.82Å; Y18-P187 HydrophobicContact CE2-CB 4.02Å; Y18-P187 HydrophobicContact CE2-CG 4.28Å; Y18-P187 HydrophobicContact CG-CB 4.19Å; P187-E191 VanDerWaalsContact CA-OE2 3.25Å; P187-E191 WeakPolarHBondContact CA-OE2 3.45Å; P187-E191 HydrophobicContact CB-CB 4.02Å; P187-V192 HydrophobicContact CB-CG2 3.98Å; P187-V192 HydrophobicContact CG-CG2 3.57Å; P187-L223 HydrophobicContact CG-CB 4.45Å
188S93.3Very high93.7Very high45 Ų4547 Ų4732%0.31525%0.254SS..PPolyproline II helixtrans-66.6161.1170.468.50000110.9E190 E191 V192S188-E190 PolarHBondContact O-N 2.86Å; S188-E191 PolarHBondContact N-OE2 2.96Å; S188-E191 PolarHBondContact O-N 3.27Å; S188-E191 WeakPolarHBondContact OG-CB 3.25Å; S188-E191 WeakPolarHBondContact OG-CG 3.39Å; S188-E191 PolarHBondContact OG-N 2.88Å; S188-E191 VanDerWaalsContact OG-N 3.12Å; S188-E191 PolarHBondContact OG-OE2 2.87Å; S188-V192 WeakPolarHBondContact O-CG2 3.49Å; S188-V192 PolarHBondContact O-N 3.16Å
189T92.8Very high93.7Very high50 Ų5043.4 Ų43.431%0.30724%0.241SC..Hα-helixtrans-59.8-37.4176.545.60000111.8V192 C193 S216 R221T189-V192 PolarHBondContact O-N 3.32Å; T189-C193 PolarHBondContact O-N 3.35Å; T189-C193 PolarHBondContact O-SG 2.9Å; T189-S216 WeakPolarHBondContact CA-OG 3.48Å; T189-S216 PolarHBondContact O-OG 3.31Å; T189-R221 HydrophobicContact CG2-CG 4.28Å
190E92.6Very high93.6Very high156 Ų15642.8 Ų42.873%0.72924%0.237SC*.Hα-helixtrans-65.5-44.3175.9-63.6175.3-171.600111.9S188 V192 C193 S194S188-E190 PolarHBondContact O-N 2.86Å; E190-V192 PolarHBondContact O-N 2.68Å; E190-C193 PolarHBondContact O-N 2.93Å; E190-S194 WeakPolarHBondContact O-CB 3.5Å; E190-S194 PolarHBondContact O-N 2.78Å
191E93Very high93.6Very high55 Ų5546.7 Ų46.726%0.25725%0.25SS..Hα-helixtrans-60.7-45.3175.1-75.8171.8154.800110.7P187 S188 C193 S194 I195P187-E191 VanDerWaalsContact CA-OE2 3.25Å; P187-E191 WeakPolarHBondContact CA-OE2 3.45Å; P187-E191 HydrophobicContact CB-CB 4.02Å; S188-E191 PolarHBondContact N-OE2 2.96Å; S188-E191 PolarHBondContact O-N 3.27Å; S188-E191 WeakPolarHBondContact OG-CB 3.25Å; S188-E191 WeakPolarHBondContact OG-CG 3.39Å; S188-E191 PolarHBondContact OG-N 2.88Å; S188-E191 VanDerWaalsContact OG-N 3.12Å; S188-E191 PolarHBondContact OG-OE2 2.87Å; E191-C193 PolarHBondContact O-N 3.34Å; E191-S194 PolarHBondContact O-N 3.3Å; E191-S194 PolarHBondContact O-OG 2.97Å; E191-I195 WeakPolarHBondContact O-CD1 3.24Å; E191-I195 VanDerWaalsContact O-CG1 3.24Å; E191-I195 WeakPolarHBondContact O-CG1 3.42Å; E191-I195 PolarHBondContact O-N 3.4Å
192V93.6Very high93.5Very high0 Ų049.9 Ų49.90%025%0.253CS..Hα-helixtrans-59.1-47.4176.1175.30000110.9P187 S188 T189 E190 S194 I195 L196 L223 A226P187-V192 HydrophobicContact CB-CG2 3.98Å; P187-V192 HydrophobicContact CG-CG2 3.57Å; S188-V192 WeakPolarHBondContact O-CG2 3.49Å; S188-V192 PolarHBondContact O-N 3.16Å; T189-V192 PolarHBondContact O-N 3.32Å; E190-V192 PolarHBondContact O-N 2.68Å; V192-S194 VanDerWaalsContact C-N 3.33Å; V192-S194 PolarHBondContact O-N 2.9Å; V192-I195 PolarHBondContact O-N 3.11Å; V192-L196 HydrophobicContact CG1-CD1 4.15Å; V192-L196 HydrophobicContact CG1-CG 4.35Å; V192-L196 WeakPolarHBondContact O-CG 3.25Å; V192-L196 PolarHBondContact O-N 3.24Å; V192-L223 HydrophobicContact CG1-CD1 4.28Å; V192-L223 HydrophobicContact CG2-CD1 4.38Å; V192-A226 HydrophobicContact CG1-CB 3.82Å
193C93.7Very high93.4Very high25 Ų2551.4 Ų51.417%0.16926%0.26CS..Hα-helixtrans-58.3-45.8177-67.10000111.5T189 E190 E191 I195 L196 T197 A212T189-C193 PolarHBondContact O-N 3.35Å; T189-C193 PolarHBondContact O-SG 2.9Å; E190-C193 PolarHBondContact O-N 2.93Å; E191-C193 PolarHBondContact O-N 3.34Å; C193-I195 VanDerWaalsContact C-N 3.29Å; C193-I195 PolarHBondContact O-N 2.78Å; C193-L196 PolarHBondContact O-N 3.18Å; C193-T197 PolarHBondContact O-N 3.03Å; C193-T197 PolarHBondContact O-OG1 3.02Å; C193-A212 HydrophobicContact CB-CB 4.39Å
194S93.6Very high93.1Very high67 Ų6746.6 Ų46.647%0.46926%0.262SS..Hα-helixtrans-60.8-38.7178.877.80000112.5E190 E191 V192 S198E190-S194 WeakPolarHBondContact O-CB 3.5Å; E190-S194 PolarHBondContact O-N 2.78Å; E191-S194 PolarHBondContact O-N 3.3Å; E191-S194 PolarHBondContact O-OG 2.97Å; V192-S194 VanDerWaalsContact C-N 3.33Å; V192-S194 PolarHBondContact O-N 2.9Å; S194-S198 WeakPolarHBondContact O-CB 3.45Å; S194-S198 PolarHBondContact O-N 2.85Å
195I93.5Very high93Very high6 Ų647.1 Ų47.13%0.03127%0.265CS..Hα-helixtrans-67.7-47.2177.4-65.5161.9000109.8D17 Y18 E191 V192 C193 T197 S198 V199 L223D17-I195 HydrophobicContact CB-CD1 3.91Å; D17-I195 HydrophobicContact CB-CG1 3.69Å; Y18-I195 HydrophobicContact CD1-CD1 3.69Å; Y18-I195 HydrophobicContact CE1-CD1 4.15Å; E191-I195 WeakPolarHBondContact O-CD1 3.24Å; E191-I195 VanDerWaalsContact O-CG1 3.24Å; E191-I195 WeakPolarHBondContact O-CG1 3.42Å; E191-I195 PolarHBondContact O-N 3.4Å; V192-I195 PolarHBondContact O-N 3.11Å; C193-I195 VanDerWaalsContact C-N 3.29Å; C193-I195 PolarHBondContact O-N 2.78Å; I195-T197 PolarHBondContact O-N 2.66Å; I195-S198 WeakPolarHBondContact O-CB 3.49Å; I195-S198 PolarHBondContact O-N 3.29Å; I195-S198 VanDerWaalsContact O-N 3.11Å; I195-S198 PolarHBondContact O-OG 3.26Å; I195-V199 HydrophobicContact CG2-CG2 4.4Å; I195-V199 WeakPolarHBondContact O-CG2 3.18Å; I195-V199 PolarHBondContact O-N 2.96Å; I195-L223 HydrophobicContact CB-CD1 4.28Å; I195-L223 HydrophobicContact CD1-CD1 3.98Å; I195-L223 HydrophobicContact CD1-CD2 4Å; I195-L223 HydrophobicContact CG2-CD1 4.01Å
196L93.3Very high92.8Very high1 Ų151 Ų511%0.00529%0.287CS..Hα-helixtrans-56.9-49.2176.9-69177000111.1V192 C193 S198 V199 C200 L207 I215 A226 L227 C230V192-L196 HydrophobicContact CG1-CD1 4.15Å; V192-L196 HydrophobicContact CG1-CG 4.35Å; V192-L196 WeakPolarHBondContact O-CG 3.25Å; V192-L196 PolarHBondContact O-N 3.24Å; C193-L196 PolarHBondContact O-N 3.18Å; L196-S198 VanDerWaalsContact C-N 3.29Å; L196-S198 PolarHBondContact O-N 3.47Å; L196-V199 PolarHBondContact O-N 3.46Å; L196-C200 PolarHBondContact O-N 3.36Å; L196-C200 PolarHBondContact O-SG 3.21Å; L196-L207 HydrophobicContact CB-CD2 3.87Å; L196-I215 HydrophobicContact CD1-CB 4.16Å; L196-I215 HydrophobicContact CD1-CG2 3.81Å; L196-A226 HydrophobicContact CD1-CB 4.49Å; L196-A226 HydrophobicContact CD2-CB 4.39Å; L196-L227 HydrophobicContact CD2-CD2 3.88Å; L196-L227 HydrophobicContact CD2-CG 4.36Å; L196-C230 HydrophobicContact CD2-CB 3.95Å
197T93.9Very high92.7Very high42 Ų4249 Ų4926%0.25828%0.277SS..Hα-helixtrans-60.4-39.1176.1-52.90000111.9C193 I195 K201C193-T197 PolarHBondContact O-N 3.03Å; C193-T197 PolarHBondContact O-OG1 3.02Å; I195-T197 PolarHBondContact O-N 2.66Å; T197-K201 HydrophobicContact CG2-CD 4.21Å; T197-K201 HydrophobicContact CG2-CG 4.48Å; T197-K201 WeakPolarHBondContact O-CB 3.46Å; T197-K201 VanDerWaalsContact O-CG 3.25Å; T197-K201 WeakPolarHBondContact O-CG 3.38Å; T197-K201 PolarHBondContact O-N 2.59Å
198S93.6Very high92.7Very high35 Ų3550.3 Ų50.325%0.24529%0.285CS..Hα-helixtrans-66-3817883.20000112.5S194 I195 L196 K202S194-S198 WeakPolarHBondContact O-CB 3.45Å; S194-S198 PolarHBondContact O-N 2.85Å; I195-S198 WeakPolarHBondContact O-CB 3.49Å; I195-S198 PolarHBondContact O-N 3.29Å; I195-S198 VanDerWaalsContact O-N 3.11Å; I195-S198 PolarHBondContact O-OG 3.26Å; L196-S198 VanDerWaalsContact C-N 3.29Å; L196-S198 PolarHBondContact O-N 3.47Å; S198-K202 VanDerWaalsContact O-CG 3.29Å; S198-K202 WeakPolarHBondContact O-CG 3.47Å; S198-K202 PolarHBondContact O-N 3.3Å; S198-K202 VanDerWaalsContact O-N 3.13Å
199V93.8Very high92.6Very high5 Ų553.1 Ų53.13%0.0330%0.302CS..Hα-helixtrans-69.9-47177.4170.10000110W4 Y8 I195 L196 K201 K202 E203 L227W4-V199 HydrophobicContact CB-CG1 4.46Å; W4-V199 HydrophobicContact CD2-CG1 4.4Å; W4-V199 HydrophobicContact CE3-CG1 3.92Å; Y8-V199 HydrophobicContact CD2-CG1 3.61Å; Y8-V199 HydrophobicContact CD2-CG2 4.4Å; Y8-V199 HydrophobicContact CE2-CG1 3.91Å; Y8-V199 HydrophobicContact CG-CG1 4.21Å; Y8-V199 HydrophobicContact CG-CG2 4.19Å; I195-V199 HydrophobicContact CG2-CG2 4.4Å; I195-V199 WeakPolarHBondContact O-CG2 3.18Å; I195-V199 PolarHBondContact O-N 2.96Å; L196-V199 PolarHBondContact O-N 3.46Å; V199-K201 VanDerWaalsContact C-N 3.35Å; V199-K201 PolarHBondContact O-N 3.2Å; V199-K202 PolarHBondContact O-N 3.2Å; V199-K202 VanDerWaalsContact O-N 3.13Å; V199-E203 PolarHBondContact O-N 3.18Å; V199-L227 HydrophobicContact CB-CD2 4.38Å; V199-L227 HydrophobicContact CG1-CD2 4.3Å; V199-L227 HydrophobicContact CG2-CD2 4.02Å
200C92.6Very high92.5Very high0 Ų056.3 Ų56.30%031%0.314CS..Hα-helixtrans-59.4-43.8175.7-67.70000112L196 K202 E203 G204 L205 L207L196-C200 PolarHBondContact O-N 3.36Å; L196-C200 PolarHBondContact O-SG 3.21Å; C200-K202 VanDerWaalsContact C-N 3.32Å; C200-K202 PolarHBondContact O-N 3.48Å; C200-E203 CarbonylContact O-C 3.58Å; C200-E203 WeakPolarHBondContact O-CA 3.49Å; C200-E203 PolarHBondContact O-N 2.97Å; C200-G204 PolarHBondContact O-N 3.49Å; C200-L205 CarbonylContact C-O 3.36Å; C200-L205 HydrophobicContact CB-CB 4.09Å; C200-L205 PolarHBondContact O-N 3.32Å; C200-L207 HydrophobicContact CB-CB 3.95Å
201K93.6Very high92.5Very high155 Ų15548.9 Ų48.967%0.67428%0.279SS*.Hα-helixtrans-58.8-41.4174.6-78176.7178.1179.60112.5T197 V199 E203 G204T197-K201 HydrophobicContact CG2-CD 4.21Å; T197-K201 HydrophobicContact CG2-CG 4.48Å; T197-K201 WeakPolarHBondContact O-CB 3.46Å; T197-K201 VanDerWaalsContact O-CG 3.25Å; T197-K201 WeakPolarHBondContact O-CG 3.38Å; T197-K201 PolarHBondContact O-N 2.59Å; V199-K201 VanDerWaalsContact C-N 3.35Å; V199-K201 PolarHBondContact O-N 3.2Å; K201-E203 VanDerWaalsContact C-N 3.26Å; K201-E203 PolarHBondContact O-N 3.42Å; K201-G204 PolarHBondContact O-N 3.07Å; K201-G204 VanDerWaalsContact O-N 3.1Å
202K92.8Very high92.4Very high126 Ų12646.3 Ų46.355%0.54827%0.267SS..Hα-helixtrans-68.6-24.4176.4-71.2171-173.6168.60113.1Y8 S198 V199 C200 G204Y8-K202 HydrophobicContact CD1-CB 4.36Å; Y8-K202 HydrophobicContact CD1-CD 3.66Å; Y8-K202 HydrophobicContact CE1-CB 3.49Å; Y8-K202 VanDerWaalsContact CE1-CB 3.49Å; Y8-K202 HydrophobicContact CE1-CD 3.57Å; Y8-K202 HydrophobicContact CE1-CG 4.15Å; Y8-K202 PolarHBondContact OH-O 2.97Å; S198-K202 VanDerWaalsContact O-CG 3.29Å; S198-K202 WeakPolarHBondContact O-CG 3.47Å; S198-K202 PolarHBondContact O-N 3.3Å; S198-K202 VanDerWaalsContact O-N 3.13Å; V199-K202 PolarHBondContact O-N 3.2Å; V199-K202 VanDerWaalsContact O-N 3.13Å; C200-K202 VanDerWaalsContact C-N 3.32Å; C200-K202 PolarHBondContact O-N 3.48Å; K202-G204 VanDerWaalsContact C-N 3.34Å
203E92.3Very high92.4Very high43 Ų4352.1 Ų52.120%0.20129%0.293CS..THydrogen-bonded Turntrans-87-2172.1-76.6-68.3150.400112.9W4 K7 Y8 V199 C200 K201 L205 R234W4-E203 HydrophobicContact CD2-CG 4.33Å; W4-E203 HydrophobicContact CZ2-CG 4.22Å; K7-E203 IonicContact NZ-OE1 3.14Å; K7-E203 PolarHBondContact NZ-OE1 2.92Å; Y8-E203 HydrophobicContact CE2-CG 3.78Å; Y8-E203 VanDerWaalsContact CE2-OE1 3.3Å; Y8-E203 WeakPolarHBondContact CE2-OE1 3.34Å; Y8-E203 VanDerWaalsContact OH-CD 3.28Å; Y8-E203 WeakPolarHBondContact OH-CG 2.79Å; Y8-E203 PolarHBondContact OH-OE1 2.75Å; V199-E203 PolarHBondContact O-N 3.18Å; C200-E203 CarbonylContact O-C 3.58Å; C200-E203 WeakPolarHBondContact O-CA 3.49Å; C200-E203 PolarHBondContact O-N 2.97Å; K201-E203 VanDerWaalsContact C-N 3.26Å; K201-E203 PolarHBondContact O-N 3.42Å; E203-L205 VanDerWaalsContact C-N 3.32Å; E203-L205 HydrophobicContact CB-CD1 3.76Å; E203-L205 HydrophobicContact CB-CG 4Å; E203-R234 IonicContact OE2-NH1 3.49Å; E203-R234 PolarHBondContact OE2-NH1 3.42Å
204G90Very high92.3Very high65 Ų6554.2 Ų54.267%0.6730%0.3SS*.THydrogen-bonded Turntrans74.619.5-176.500000114.2C200 K201 K202C200-G204 PolarHBondContact O-N 3.49Å; K201-G204 PolarHBondContact O-N 3.07Å; K201-G204 VanDerWaalsContact O-N 3.1Å; K202-G204 VanDerWaalsContact C-N 3.34Å
205L91.3Very high92.3Very high10 Ų1051 Ų515%0.05228%0.278CS..  trans-102.2147.5-178.7-56.3163.1000111.2W4 C200 E203 Y238 F240W4-L205 HydrophobicContact CH2-CD1 3.54Å; W4-L205 HydrophobicContact CZ2-CD1 4.03Å; W4-L205 HydrophobicContact CZ3-CD1 4.37Å; C200-L205 CarbonylContact C-O 3.36Å; C200-L205 HydrophobicContact CB-CB 4.09Å; C200-L205 PolarHBondContact O-N 3.32Å; E203-L205 VanDerWaalsContact C-N 3.32Å; E203-L205 HydrophobicContact CB-CD1 3.76Å; E203-L205 HydrophobicContact CB-CG 4Å; L205-Y238 HydrophobicContact CD2-CD2 4.1Å; L205-Y238 HydrophobicContact CD2-CE2 3.45Å; L205-Y238 VanDerWaalsContact CD2-CE2 3.45Å; L205-F240 HydrophobicContact CB-CE2 4.12Å; L205-F240 HydrophobicContact CD1-CE2 4.15Å
206V89.8Confident92.2Very high126 Ų12650.7 Ų50.776%0.76428%0.276SS*.  trans-102.3108.3172.3-176.50000108.8F240V206-F240 WeakPolarHBondContact O-CD2 3.36Å
207L90.6Very high92.1Very high15 Ų1556.2 Ų56.28%0.07930%0.302CS..  trans-93.8121.3176.3-174.870.7000109.8L196 C200 L211 A212 F240L196-L207 HydrophobicContact CB-CD2 3.87Å; C200-L207 HydrophobicContact CB-CB 3.95Å; L207-L211 HydrophobicContact CD1-CD2 3.87Å; L207-L211 HydrophobicContact CD1-CG 4.27Å; L207-A212 HydrophobicContact CD2-CB 3.67Å; L207-A212 HydrophobicContact CG-CB 4.24Å; L207-F240 HydrophobicContact CD1-CD1 4.28Å; L207-F240 HydrophobicContact CD1-CD2 4.08Å; L207-F240 HydrophobicContact CD1-CE1 4.33Å; L207-F240 HydrophobicContact CD1-CE2 4.11Å; L207-F240 HydrophobicContact CD1-CG 4.16Å; L207-F240 HydrophobicContact CD1-CZ 4.23Å
208P93.1Very high92Very high29 Ų2958 Ų5819%0.18831%0.306CS..  trans-59.7140.9172-2333.4000111.7E210 L211 A212 F240P208-E210 VanDerWaalsContact C-N 3.28Å; P208-E210 PolarHBondContact O-N 3.37Å; P208-L211 HydrophobicContact CB-CB 4.29Å; P208-L211 PolarHBondContact O-N 3.33Å; P208-A212 PolarHBondContact O-N 3.03Å; P208-A212 VanDerWaalsContact O-N 3.08Å; P208-F240 HydrophobicContact CG-CB 4.11Å
209P90.9Very high91.8Very high104 Ų10456.4 Ų56.468%0.67530%0.295SS*.Hα-helixtrans-65.9-31.6-178.726.7-34000112.7A212 K213P209-A212 PolarHBondContact O-N 3.15Å; P209-K213 PolarHBondContact O-N 3.46Å
210E91.6Very high91.5Very high118 Ų11858.6 Ų58.655%0.55132%0.318SS*.Hα-helixtrans-65.2-48.7177.7-67173.7-18000111.1P208 A212 K213 Q214 A242P208-E210 VanDerWaalsContact C-N 3.28Å; P208-E210 PolarHBondContact O-N 3.37Å; E210-A212 VanDerWaalsContact C-N 3.32Å; E210-A212 PolarHBondContact O-N 3.17Å; E210-K213 WeakPolarHBondContact O-CB 3.35Å; E210-K213 PolarHBondContact O-N 2.91Å; E210-K213 VanDerWaalsContact O-N 3.17Å; E210-Q214 WeakPolarHBondContact O-CG 3.38Å; E210-Q214 PolarHBondContact O-N 3.27Å; E210-A242 VanDerWaalsContact OE2-CB 3.29Å; E210-A242 WeakPolarHBondContact OE2-CB 3.26Å
211L91.4Very high91.3Very high0 Ų064.9 Ų64.90%034%0.342CS..Hα-helixtrans-61.4-40.5174.9-177.261.4000111.6L207 P208 K213 Q214 I215 F240 Q244 V246L207-L211 HydrophobicContact CD1-CD2 3.87Å; L207-L211 HydrophobicContact CD1-CG 4.27Å; P208-L211 HydrophobicContact CB-CB 4.29Å; P208-L211 PolarHBondContact O-N 3.33Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 3.09Å; L211-Q214 PolarHBondContact O-N 2.97Å; L211-I215 HydrophobicContact CD1-CD1 4.3Å; L211-I215 HydrophobicContact CD1-CG1 4.39Å; L211-I215 HydrophobicContact CG-CD1 3.99Å; L211-I215 VanDerWaalsContact O-CG1 3.29Å; L211-I215 WeakPolarHBondContact O-CG1 3.49Å; L211-I215 PolarHBondContact O-N 2.98Å; L211-F240 HydrophobicContact CD2-CB 4.06Å; L211-F240 HydrophobicContact CD2-CD1 3.69Å; L211-F240 HydrophobicContact CD2-CE1 4.46Å; L211-F240 HydrophobicContact CD2-CG 4.14Å; L211-Q244 HydrophobicContact CD1-CB 4.12Å; L211-Q244 HydrophobicContact CD2-CB 4.4Å; L211-V246 HydrophobicContact CD1-CG2 3.88Å
212A92.4Very high91.3Very high1 Ų159.1 Ų59.11%0.00832%0.319CS..Hα-helixtrans-60.2-41.2176.100000112.1C193 L207 P208 P209 E210 S216C193-A212 HydrophobicContact CB-CB 4.39Å; L207-A212 HydrophobicContact CD2-CB 3.67Å; L207-A212 HydrophobicContact CG-CB 4.24Å; P208-A212 PolarHBondContact O-N 3.03Å; P208-A212 VanDerWaalsContact O-N 3.08Å; P209-A212 PolarHBondContact O-N 3.15Å; E210-A212 VanDerWaalsContact C-N 3.32Å; E210-A212 PolarHBondContact O-N 3.17Å; A212-S216 WeakPolarHBondContact O-CB 3.4Å; A212-S216 PolarHBondContact O-N 2.97Å
213K92.5Very high91.3Very high122 Ų12254 Ų5453%0.5330%0.298SS..Hα-helixtrans-66.5-45.2176.8-170.4-179.8176-172.50111.5P209 E210 L211 I215 S216 E217P209-K213 PolarHBondContact O-N 3.46Å; E210-K213 WeakPolarHBondContact O-CB 3.35Å; E210-K213 PolarHBondContact O-N 2.91Å; E210-K213 VanDerWaalsContact O-N 3.17Å; L211-K213 VanDerWaalsContact C-N 3.3Å; L211-K213 PolarHBondContact O-N 3.09Å; K213-I215 PolarHBondContact O-N 2.88Å; K213-S216 WeakPolarHBondContact O-CB 3.38Å; K213-S216 PolarHBondContact O-N 2.9Å; K213-S216 VanDerWaalsContact O-N 3.14Å; K213-E217 WeakPolarHBondContact CE-OE1 3.46Å; K213-E217 WeakPolarHBondContact O-CG 3.49Å; K213-E217 PolarHBondContact O-N 3.17Å
214Q92.1Very high91.3Very high68 Ų6857.3 Ų57.332%0.31831%0.308SS..Hα-helixtrans-58.7-45.4175.7-71.7178.3-5.200112.1E210 L211 S216 E217 K218E210-Q214 WeakPolarHBondContact O-CG 3.38Å; E210-Q214 PolarHBondContact O-N 3.27Å; L211-Q214 PolarHBondContact O-N 2.97Å; Q214-S216 VanDerWaalsContact C-N 3.32Å; Q214-S216 PolarHBondContact O-N 3.35Å; Q214-E217 PolarHBondContact O-N 3.42Å; Q214-K218 WeakPolarHBondContact O-CB 3.47Å; Q214-K218 PolarHBondContact O-N 3.33Å
215I92.6Very high91.5Very high0 Ų057.2 Ų57.20%029%0.287CS..Hα-helixtrans-61.6-42.6175.5-67166.7000110.4L196 L211 K213 E217 S219 A226 M229 C230 V246L196-I215 HydrophobicContact CD1-CB 4.16Å; L196-I215 HydrophobicContact CD1-CG2 3.81Å; L211-I215 HydrophobicContact CD1-CD1 4.3Å; L211-I215 HydrophobicContact CD1-CG1 4.39Å; L211-I215 HydrophobicContact CG-CD1 3.99Å; L211-I215 VanDerWaalsContact O-CG1 3.29Å; L211-I215 WeakPolarHBondContact O-CG1 3.49Å; L211-I215 PolarHBondContact O-N 2.98Å; K213-I215 PolarHBondContact O-N 2.88Å; I215-E217 VanDerWaalsContact C-N 3.34Å; I215-E217 PolarHBondContact O-N 3.41Å; I215-S219 WeakPolarHBondContact O-CB 3.34Å; I215-S219 PolarHBondContact O-N 3.27Å; I215-S219 PolarHBondContact O-OG 3.46Å; I215-A226 HydrophobicContact CG2-CB 4.11Å; I215-A226 WeakPolarHBondContact CG2-O 3.39Å; I215-M229 HydrophobicContact CG2-CB 4.08Å; I215-C230 HydrophobicContact CD1-CB 4.16Å; I215-V246 HydrophobicContact CG1-CG1 4.14Å; I215-V246 HydrophobicContact CG1-CG2 3.71Å
216S92.3Very high91.6Very high0 Ų056.8 Ų56.80%029%0.285CS..Hα-helixtrans-61.9-41178-178.20000112.3T189 A212 K213 Q214 S219T189-S216 WeakPolarHBondContact CA-OG 3.48Å; T189-S216 PolarHBondContact O-OG 3.31Å; A212-S216 WeakPolarHBondContact O-CB 3.4Å; A212-S216 PolarHBondContact O-N 2.97Å; K213-S216 WeakPolarHBondContact O-CB 3.38Å; K213-S216 PolarHBondContact O-N 2.9Å; K213-S216 VanDerWaalsContact O-N 3.14Å; Q214-S216 VanDerWaalsContact C-N 3.32Å; Q214-S216 PolarHBondContact O-N 3.35Å; S216-S219 PolarHBondContact O-OG 3.16Å
217E91.4Very high91.8Very high116 Ų11651.4 Ų51.454%0.54225%0.252SS..Hα-helixtrans-69.4-50.7178.3-72.2173.2-177.600111.1K213 Q214 I215 S219 G220K213-E217 WeakPolarHBondContact CE-OE1 3.46Å; K213-E217 WeakPolarHBondContact O-CG 3.49Å; K213-E217 PolarHBondContact O-N 3.17Å; Q214-E217 PolarHBondContact O-N 3.42Å; I215-E217 VanDerWaalsContact C-N 3.34Å; I215-E217 PolarHBondContact O-N 3.41Å; E217-S219 VanDerWaalsContact C-N 3.27Å; E217-S219 PolarHBondContact O-N 3.04Å; E217-G220 PolarHBondContact O-N 3.2Å; E217-G220 VanDerWaalsContact O-N 3.07Å
218K90.6Very high91.9Very high80 Ų8054 Ų5435%0.34827%0.266SS..Hα-helixtrans-61-33.1177.9-76.3-169.9176.1-166.50113.4Q214 G220 R225 M229 V246Q214-K218 WeakPolarHBondContact O-CB 3.47Å; Q214-K218 PolarHBondContact O-N 3.33Å; K218-G220 PolarHBondContact O-N 3.16Å; K218-R225 PolarHBondContact O-NH2 3.43Å; K218-M229 HydrophobicContact CB-CE 4.5Å; K218-V246 HydrophobicContact CD-CB 3.85Å; K218-V246 HydrophobicContact CD-CG1 4.19Å; K218-V246 HydrophobicContact CD-CG2 4.37Å; K218-V246 PolarHBondContact NZ-O 2.92Å
219S89.6Confident91.9Very high2 Ų253 Ų531%0.01426%0.258CS..THydrogen-bonded Turntrans-71.3-10.8178.272.10000114I215 S216 E217 R221 N222I215-S219 WeakPolarHBondContact O-CB 3.34Å; I215-S219 PolarHBondContact O-N 3.27Å; I215-S219 PolarHBondContact O-OG 3.46Å; S216-S219 PolarHBondContact O-OG 3.16Å; E217-S219 VanDerWaalsContact C-N 3.27Å; E217-S219 PolarHBondContact O-N 3.04Å; S219-R221 VanDerWaalsContact C-N 3.28Å; S219-R221 PolarHBondContact O-N 3.22Å; S219-N222 WeakPolarHBondContact O-CB 3.29Å; S219-N222 PolarHBondContact O-N 3.29Å; S219-N222 VanDerWaalsContact O-N 3.11Å
220G88.4Confident91.9Very high51 Ų5148.1 Ų48.153%0.52623%0.227SC..THydrogen-bonded Turntrans62.234.9-175.900000112.8E217 K218 N222E217-G220 PolarHBondContact O-N 3.2Å; E217-G220 VanDerWaalsContact O-N 3.07Å; K218-G220 PolarHBondContact O-N 3.16Å; G220-N222 PolarHBondContact O-N 3.31Å
221R88.2Confident92Very high131 Ų13144.1 Ų44.149%0.49421%0.208SC..THydrogen-bonded Turntrans6312.3-173.7-49.2178.7-175.81780.5114.6L186 T189 S219 L223L186-R221 HydrophobicContact CB-CB 4Å; L186-R221 HydrophobicContact CD1-CB 4.21Å; L186-R221 HydrophobicContact CD2-CB 4.46Å; L186-R221 WeakPolarHBondContact CD2-O 3.45Å; L186-R221 HydrophobicContact CG-CB 4.38Å; T189-R221 HydrophobicContact CG2-CG 4.28Å; S219-R221 VanDerWaalsContact C-N 3.28Å; S219-R221 PolarHBondContact O-N 3.22Å; R221-L223 PolarHBondContact O-N 3.43Å
222N93.4Very high92Very high35 Ų3546 Ų4619%0.18722%0.223CC..  trans-81.7104.4174.9-178.2-29000109.9G45 S219 G220 R224 R225 A226G45-N222 VanDerWaalsContact CA-OD1 3.24Å; G45-N222 WeakPolarHBondContact CA-OD1 3.43Å; S219-N222 WeakPolarHBondContact O-CB 3.29Å; S219-N222 PolarHBondContact O-N 3.29Å; S219-N222 VanDerWaalsContact O-N 3.11Å; G220-N222 PolarHBondContact O-N 3.31Å; N222-R224 VanDerWaalsContact C-N 3.28Å; N222-R224 PolarHBondContact O-N 3.4Å; N222-R224 WeakPolarHBondContact OD1-CB 3.48Å; N222-R224 PolarHBondContact OD1-N 3.38Å; N222-R224 VanDerWaalsContact OD1-N 3.14Å; N222-R225 HydrophobicContact CB-CB 3.95Å; N222-R225 PolarHBondContact O-N 3.24Å; N222-R225 PolarHBondContact OD1-N 2.99Å; N222-R225 VanDerWaalsContact OD1-N 3.15Å; N222-A226 PolarHBondContact O-N 3.2Å
223L92.6Very high91.9Very high19 Ų1945.9 Ų45.910%0.09922%0.223CC..Hα-helixtrans-60.9-35.2-175.3-173.363.3000113.4Y18 P187 V192 I195 R221 A226 L227Y18-L223 HydrophobicContact CE1-CD2 3.81Å; P187-L223 HydrophobicContact CG-CB 4.45Å; V192-L223 HydrophobicContact CG1-CD1 4.28Å; V192-L223 HydrophobicContact CG2-CD1 4.38Å; I195-L223 HydrophobicContact CB-CD1 4.28Å; I195-L223 HydrophobicContact CD1-CD1 3.98Å; I195-L223 HydrophobicContact CD1-CD2 4Å; I195-L223 HydrophobicContact CG2-CD1 4.01Å; R221-L223 PolarHBondContact O-N 3.43Å; L223-A226 PolarHBondContact O-N 3.13Å; L223-L227 HydrophobicContact CG-CD1 4.22Å; L223-L227 WeakPolarHBondContact O-CG 3.33Å; L223-L227 PolarHBondContact O-N 2.89Å
224R93.4Very high91.8Very high112 Ų11244.2 Ų44.242%0.42321%0.213SC..Hα-helixtrans-61.6-48.1175.3-178-170.5-63.4141.8-4.4110.3L5 N222 L227 L228L5-R224 HydrophobicContact CD1-CB 4.25Å; L5-R224 HydrophobicContact CD1-CG 3.96Å; L5-R224 HydrophobicContact CD2-CG 3.7Å; L5-R224 HydrophobicContact CG-CG 4.5Å; N222-R224 VanDerWaalsContact C-N 3.28Å; N222-R224 PolarHBondContact O-N 3.4Å; N222-R224 WeakPolarHBondContact OD1-CB 3.48Å; N222-R224 PolarHBondContact OD1-N 3.38Å; N222-R224 VanDerWaalsContact OD1-N 3.14Å; R224-L227 PolarHBondContact O-N 3.16Å; R224-L228 HydrophobicContact CG-CD1 4.14Å; R224-L228 WeakPolarHBondContact O-CG 3.39Å; R224-L228 PolarHBondContact O-N 2.96Å; R224-L228 VanDerWaalsContact O-N 3.15Å
225R92.6Very high91.7Very high63 Ų6346.9 Ų46.924%0.23823%0.234CC..Hα-helixtrans-64.9-42.7179.6-174.3173166.6-171.9-12110.9K218 N222 L227 L228 M229 E252K218-R225 PolarHBondContact O-NH2 3.43Å; N222-R225 HydrophobicContact CB-CB 3.95Å; N222-R225 PolarHBondContact O-N 3.24Å; N222-R225 PolarHBondContact OD1-N 2.99Å; N222-R225 VanDerWaalsContact OD1-N 3.15Å; R225-L227 PolarHBondContact O-N 3.4Å; R225-L228 PolarHBondContact O-N 3.19Å; R225-M229 HydrophobicContact CG-CE 4Å; R225-M229 HydrophobicContact CG-CG 4.35Å; R225-M229 HydrophobicContact CG-SD 3.81Å; R225-M229 WeakPolarHBondContact O-CB 3.42Å; R225-M229 VanDerWaalsContact O-CG 3.25Å; R225-M229 WeakPolarHBondContact O-CG 3.38Å; R225-M229 PolarHBondContact O-N 3.47Å; R225-E252 IonicContact CZ-OE1 3.79Å; R225-E252 IonicContact CZ-OE2 3.05Å; R225-E252 VanDerWaalsContact CZ-OE2 3.24Å; R225-E252 IonicContact NE-OE1 3.17Å; R225-E252 IonicContact NH1-OE1 2.65Å; R225-E252 PolarHBondContact NH1-OE1 3.16Å; R225-E252 IonicContact NH1-OE2 2.69Å; R225-E252 IonicContact NH2-OE1 3.24Å; R225-E252 PolarHBondContact NH2-OE1 2.77Å; R225-E252 IonicContact NH2-OE2 3.3Å; R225-E252 PolarHBondContact NH2-OE2 2.67Å
226A93.6Very high91.6Very high0 Ų052.8 Ų52.80%026%0.261CS..Hα-helixtrans-58.8-45.517700000112.8V192 L196 I215 N222 L223 M229 C230V192-A226 HydrophobicContact CG1-CB 3.82Å; L196-A226 HydrophobicContact CD1-CB 4.49Å; L196-A226 HydrophobicContact CD2-CB 4.39Å; I215-A226 HydrophobicContact CG2-CB 4.11Å; I215-A226 WeakPolarHBondContact CG2-O 3.39Å; N222-A226 PolarHBondContact O-N 3.2Å; L223-A226 PolarHBondContact O-N 3.13Å; A226-M229 PolarHBondContact O-N 3.16Å; A226-C230 WeakPolarHBondContact O-CB 3.13Å; A226-C230 PolarHBondContact O-N 2.88Å
227L93.7Very high91.4Very high13 Ų1357.5 Ų57.57%0.06828%0.283CS..Hα-helixtrans-65.6-43.4178.3-74.7167.2000112.1L5 L196 V199 L223 R224 R225 C230 E231L5-L227 HydrophobicContact CD1-CD1 3.9Å; L196-L227 HydrophobicContact CD2-CD2 3.88Å; L196-L227 HydrophobicContact CD2-CG 4.36Å; V199-L227 HydrophobicContact CB-CD2 4.38Å; V199-L227 HydrophobicContact CG1-CD2 4.3Å; V199-L227 HydrophobicContact CG2-CD2 4.02Å; L223-L227 HydrophobicContact CG-CD1 4.22Å; L223-L227 WeakPolarHBondContact O-CG 3.33Å; L223-L227 PolarHBondContact O-N 2.89Å; R224-L227 PolarHBondContact O-N 3.16Å; R225-L227 PolarHBondContact O-N 3.4Å; L227-C230 PolarHBondContact O-N 3.43Å; L227-E231 PolarHBondContact O-N 3.48Å
228L94Very high91.1Very high70 Ų7058.4 Ų58.437%0.36628%0.283SS..Hα-helixtrans-65.4-40.4177.2-69.9172.2000112L3 R224 R225 E231 A232L3-L228 HydrophobicContact CD1-CD2 4.49Å; R224-L228 HydrophobicContact CG-CD1 4.14Å; R224-L228 WeakPolarHBondContact O-CG 3.39Å; R224-L228 PolarHBondContact O-N 2.96Å; R224-L228 VanDerWaalsContact O-N 3.15Å; R225-L228 PolarHBondContact O-N 3.19Å; L228-E231 PolarHBondContact O-N 3Å; L228-A232 WeakPolarHBondContact O-CB 3.33Å; L228-A232 PolarHBondContact O-N 3.01Å
229M92.4Very high90.9Very high8 Ų859 Ų594%0.03930%0.295CS..Hα-helixtrans-61.4-44.6173.9-77.5171.9154.300111.3I215 K218 R225 A226 E231 A232 C233 V246 E248I215-M229 HydrophobicContact CG2-CB 4.08Å; K218-M229 HydrophobicContact CB-CE 4.5Å; R225-M229 HydrophobicContact CG-CE 4Å; R225-M229 HydrophobicContact CG-CG 4.35Å; R225-M229 HydrophobicContact CG-SD 3.81Å; R225-M229 WeakPolarHBondContact O-CB 3.42Å; R225-M229 VanDerWaalsContact O-CG 3.25Å; R225-M229 WeakPolarHBondContact O-CG 3.38Å; R225-M229 PolarHBondContact O-N 3.47Å; A226-M229 PolarHBondContact O-N 3.16Å; M229-E231 VanDerWaalsContact C-N 3.35Å; M229-E231 PolarHBondContact O-N 3.36Å; M229-A232 PolarHBondContact O-N 3.37Å; M229-C233 PolarHBondContact O-N 3.32Å; M229-C233 PolarHBondContact O-SG 3.09Å; M229-V246 HydrophobicContact CB-CG1 3.97Å; M229-V246 HydrophobicContact CG-CG1 4.16Å; M229-V246 HydrophobicContact SD-CG1 4.26Å; M229-E248 HydrophobicContact CE-CG 4.49Å
230C91.9Very high90.9Very high1 Ų160 Ų601%0.00730%0.299CS..Hα-helixtrans-63.1-40.3177.3-172.40000112.5L196 I215 A226 L227 R234L196-C230 HydrophobicContact CD2-CB 3.95Å; I215-C230 HydrophobicContact CD1-CB 4.16Å; A226-C230 WeakPolarHBondContact O-CB 3.13Å; A226-C230 PolarHBondContact O-N 2.88Å; L227-C230 PolarHBondContact O-N 3.43Å; C230-R234 PolarHBondContact O-N 3.05Å
231E92.1Very high90.9Very high34 Ų3459.6 Ų59.616%0.15929%0.289CS..Hα-helixtrans-65.8-41.9175.5-170.7170.1-177.400110.8W4 L227 L228 M229 R234 V235W4-E231 HydrophobicContact CD2-CB 4.22Å; W4-E231 HydrophobicContact CD2-CG 4.1Å; W4-E231 HydrophobicContact CE3-CB 4.09Å; W4-E231 HydrophobicContact CE3-CG 4.45Å; W4-E231 HydrophobicContact CG-CG 4.35Å; W4-E231 HydrophobicContact CZ2-CG 4.37Å; W4-E231 HydrophobicContact CZ3-CB 4.33Å; W4-E231 PolarHBondContact N-OE2 3.33Å; W4-E231 VanDerWaalsContact N-OE2 3.09Å; L227-E231 PolarHBondContact O-N 3.48Å; L228-E231 PolarHBondContact O-N 3Å; M229-E231 VanDerWaalsContact C-N 3.35Å; M229-E231 PolarHBondContact O-N 3.36Å; E231-R234 WeakPolarHBondContact O-CB 3.38Å; E231-R234 PolarHBondContact O-N 2.93Å; E231-V235 WeakPolarHBondContact O-CG2 3.3Å; E231-V235 PolarHBondContact O-N 2.96Å; E231-V235 VanDerWaalsContact O-N 3.16Å
232A91.9Very high90.7Very high39 Ų3954.8 Ų54.832%0.32228%0.276SS..Hα-helixtrans-64.3-42.517600000112.7L228 M229 R234 V235 Q236 P247L228-A232 WeakPolarHBondContact O-CB 3.33Å; L228-A232 PolarHBondContact O-N 3.01Å; M229-A232 PolarHBondContact O-N 3.37Å; A232-R234 VanDerWaalsContact C-N 3.27Å; A232-R234 PolarHBondContact O-N 3.47Å; A232-V235 PolarHBondContact O-N 3.48Å; A232-V235 VanDerWaalsContact O-N 3.16Å; A232-Q236 PolarHBondContact O-N 3.24Å; A232-P247 HydrophobicContact CB-CG 3.56Å
233C91.1Very high90.3Very high0 Ų059.6 Ų59.60%030%0.302CS..Hα-helixtrans-54.7-44.6173.4-690000111.2M229 V235 Q236 Q237 F240 Q244 P247M229-C233 PolarHBondContact O-N 3.32Å; M229-C233 PolarHBondContact O-SG 3.09Å; C233-V235 PolarHBondContact O-N 3.35Å; C233-Q236 PolarHBondContact O-N 3.17Å; C233-Q237 PolarHBondContact O-N 2.92Å; C233-F240 HydrophobicContact CB-CE1 3.96Å; C233-Q244 PolarHBondContact O-NE2 2.94Å; C233-P247 VanDerWaalsContact SG-CD 3.51Å
234R90.5Very high90Very high86 Ų8659 Ų5933%0.32530%0.299SS..Hα-helixtrans-62.5-43179179.2-171.8169.6166.8-2.7111.9W4 E203 C230 E231 A232 Q236 F240W4-R234 HydrophobicContact CH2-CB 4.13Å; W4-R234 VanDerWaalsContact CH2-CD 3.42Å; W4-R234 HydrophobicContact CH2-CG 4.39Å; E203-R234 IonicContact OE2-NH1 3.49Å; E203-R234 PolarHBondContact OE2-NH1 3.42Å; C230-R234 PolarHBondContact O-N 3.05Å; E231-R234 WeakPolarHBondContact O-CB 3.38Å; E231-R234 PolarHBondContact O-N 2.93Å; A232-R234 VanDerWaalsContact C-N 3.27Å; A232-R234 PolarHBondContact O-N 3.47Å; R234-Q236 VanDerWaalsContact C-N 3.33Å; R234-F240 HydrophobicContact CB-CE1 4.09Å; R234-F240 HydrophobicContact CB-CZ 3.84Å; R234-F240 HydrophobicContact CG-CZ 4.47Å
235V90.4Very high89.6Confident124 Ų12459.9 Ų59.975%0.75231%0.312SS*.Hα-helixtrans-67.5-37.8-177.9173.90000110.9E231 A232 C233E231-V235 WeakPolarHBondContact O-CG2 3.3Å; E231-V235 PolarHBondContact O-N 2.96Å; E231-V235 VanDerWaalsContact O-N 3.16Å; A232-V235 PolarHBondContact O-N 3.48Å; A232-V235 VanDerWaalsContact O-N 3.16Å; C233-V235 PolarHBondContact O-N 3.35Å
236Q88.8Confident89.4Confident124 Ų12457.1 Ų57.158%0.57930%0.302SS*.Hα-helixtrans-72.6-46.2-180-173.4176.92.200112.4A232 C233 R234A232-Q236 PolarHBondContact O-N 3.24Å; C233-Q236 PolarHBondContact O-N 3.17Å; R234-Q236 VanDerWaalsContact C-N 3.33Å
237Q87.9Confident89.1Confident99 Ų9959 Ų5946%0.46331%0.314SS..  trans-150.5127-177.9-176.7-179.1-5.800111.1C233C233-Q237 PolarHBondContact O-N 2.92Å
238Y86.1Confident88.9Confident135 Ų13560.6 Ų60.653%0.52932%0.321SS..SBendtrans-137.4136.4170.4-178.7-99.2000109.1L205L205-Y238 HydrophobicContact CD2-CD2 4.1Å; L205-Y238 HydrophobicContact CD2-CE2 3.45Å; L205-Y238 VanDerWaalsContact CD2-CE2 3.45Å
239P86.1Confident88.7Confident94 Ų9459.3 Ų59.361%0.6132%0.318SS*.SBendcis-66.9157.15-21.334.8000115.6
240F89.8Confident88.7Confident21 Ų2165.7 Ų65.79%0.09235%0.352CS..  trans-64.5136.6173.6-68-62.9000110.8L205 V206 L207 P208 L211 C233 R234L205-F240 HydrophobicContact CB-CE2 4.12Å; L205-F240 HydrophobicContact CD1-CE2 4.15Å; V206-F240 WeakPolarHBondContact O-CD2 3.36Å; L207-F240 HydrophobicContact CD1-CD1 4.28Å; L207-F240 HydrophobicContact CD1-CD2 4.08Å; L207-F240 HydrophobicContact CD1-CE1 4.33Å; L207-F240 HydrophobicContact CD1-CE2 4.11Å; L207-F240 HydrophobicContact CD1-CG 4.16Å; L207-F240 HydrophobicContact CD1-CZ 4.23Å; P208-F240 HydrophobicContact CG-CB 4.11Å; L211-F240 HydrophobicContact CD2-CB 4.06Å; L211-F240 HydrophobicContact CD2-CD1 3.69Å; L211-F240 HydrophobicContact CD2-CE1 4.46Å; L211-F240 HydrophobicContact CD2-CG 4.14Å; C233-F240 HydrophobicContact CB-CE1 3.96Å; R234-F240 HydrophobicContact CB-CE1 4.09Å; R234-F240 HydrophobicContact CB-CZ 3.84Å; R234-F240 HydrophobicContact CG-CZ 4.47Å
241S87.6Confident88.8Confident44 Ų4469.7 Ų69.731%0.30837%0.367SS..  trans-114.1158.4171.556.30000110.4D243 Q244S241-D243 VanDerWaalsContact C-N 3.34Å; S241-Q244 WeakPolarHBondContact OG-CB 3.34Å
242A84.7Confident88.8Confident29 Ų2969.2 Ų69.224%0.2437%0.365CS..THydrogen-bonded Turntrans-65.4-38.4179.600000112.5E210 Q244E210-A242 VanDerWaalsContact OE2-CB 3.29Å; E210-A242 WeakPolarHBondContact OE2-CB 3.26Å; A242-Q244 VanDerWaalsContact C-N 3.34Å; A242-Q244 PolarHBondContact O-N 3.48Å
243D84.1Confident88.9Confident137 Ų13770 Ų7073%0.73337%0.365SS*.THydrogen-bonded Turntrans-96.322.4-176.4-56.4-46000113S241 D245S241-D243 VanDerWaalsContact C-N 3.34Å; D243-D245 PolarHBondContact O-N 3.48Å
244Q86.7Confident89.1Confident7 Ų772.2 Ų72.23%0.03337%0.374CS..  trans-68.5131.5-177.2-171.4175.4-14.100111.3L211 C233 S241 A242 V246L211-Q244 HydrophobicContact CD1-CB 4.12Å; L211-Q244 HydrophobicContact CD2-CB 4.4Å; C233-Q244 PolarHBondContact O-NE2 2.94Å; S241-Q244 WeakPolarHBondContact OG-CB 3.34Å; A242-Q244 VanDerWaalsContact C-N 3.34Å; A242-Q244 PolarHBondContact O-N 3.48Å; Q244-V246 PolarHBondContact O-N 3.37Å; Q244-V246 VanDerWaalsContact O-N 3.12Å
245D85.9Confident89.3Confident129 Ų12968.4 Ų68.469%0.6936%0.36SS*.  trans-64.9115171-79.6-40.6000110.9D243 P247D243-D245 PolarHBondContact O-N 3.48Å; D245-P247 WeakPolarHBondContact O-CD 3.44Å
246V87.4Confident89.5Confident6 Ų666.2 Ų66.24%0.03634%0.338CS..  trans-75118.4173.4-179.40000108.8L211 I215 K218 M229 Q244L211-V246 HydrophobicContact CD1-CG2 3.88Å; I215-V246 HydrophobicContact CG1-CG1 4.14Å; I215-V246 HydrophobicContact CG1-CG2 3.71Å; K218-V246 HydrophobicContact CD-CB 3.85Å; K218-V246 HydrophobicContact CD-CG1 4.19Å; K218-V246 HydrophobicContact CD-CG2 4.37Å; K218-V246 PolarHBondContact NZ-O 2.92Å; M229-V246 HydrophobicContact CB-CG1 3.97Å; M229-V246 HydrophobicContact CG-CG1 4.16Å; M229-V246 HydrophobicContact SD-CG1 4.26Å; Q244-V246 PolarHBondContact O-N 3.37Å; Q244-V246 VanDerWaalsContact O-N 3.12Å
247P88.4Confident89.8Confident38 Ų3864.9 Ų64.925%0.24733%0.332CS..  trans-67.7140.9179.528.6-33.4000110.5A232 C233 D245A232-P247 HydrophobicContact CB-CG 3.56Å; C233-P247 VanDerWaalsContact SG-CD 3.51Å; D245-P247 WeakPolarHBondContact O-CD 3.44Å
248E88.7Confident90.1Very high47 Ų4760.2 Ų60.222%0.2231%0.31CS..  trans-107.4155.4176.7-65.8-179.6166.200110.1M229 V253 R256M229-E248 HydrophobicContact CE-CG 4.49Å; E248-V253 HydrophobicContact CB-CG2 4.19Å; E248-R256 IonicContact OE1-NH2 3.34Å; E248-R256 PolarHBondContact OE1-NH2 3.32Å; E248-R256 IonicContact OE2-CZ 2.67Å; E248-R256 IonicContact OE2-NH1 3.2Å; E248-R256 PolarHBondContact OE2-NH1 2.96Å; E248-R256 IonicContact OE2-NH2 3.33Å; E248-R256 PolarHBondContact OE2-NH2 3.48Å
249P90.4Very high90.5Very high44 Ų4453.8 Ų53.829%0.28629%0.285SS..  trans-58.9140.2174.1-21.132.5000112W251 E252 V253P249-W251 HydrophobicContact CB-CG 4.42Å; P249-W251 PolarHBondContact O-N 3.42Å; P249-W251 VanDerWaalsContact O-N 3.09Å; P249-E252 HydrophobicContact CB-CG 4.35Å; P249-E252 WeakPolarHBondContact CD-OE2 3.48Å; P249-E252 HydrophobicContact CG-CG 4.33Å; P249-E252 WeakPolarHBondContact O-CB 3.34Å; P249-E252 PolarHBondContact O-N 3.02Å; P249-V253 PolarHBondContact O-N 3.21Å
250D92.3Very high90.9Very high141 Ų14152.7 Ų52.775%0.75427%0.274SS*.Hα-helixtrans-51.2-40.2-178.2-55.3-26.1000113E252 V253 Y254D250-E252 VanDerWaalsContact C-N 3.32Å; D250-E252 PolarHBondContact O-N 3Å; D250-V253 PolarHBondContact O-N 3.05Å; D250-Y254 VanDerWaalsContact O-CB 3.3Å; D250-Y254 WeakPolarHBondContact O-CB 2.96Å; D250-Y254 PolarHBondContact O-N 2.9Å
251W93.7Very high91.1Very high85 Ų8552.5 Ų52.532%0.32228%0.276SS..Hα-helixtrans-67.4-29.3179.770.3-91.8000113.6P249 L255 L281 I286 I290P249-W251 HydrophobicContact CB-CG 4.42Å; P249-W251 PolarHBondContact O-N 3.42Å; P249-W251 VanDerWaalsContact O-N 3.09Å; W251-L255 HydrophobicContact CZ3-CD2 4.3Å; W251-L255 WeakPolarHBondContact O-CB 3.43Å; W251-L255 PolarHBondContact O-N 3.33Å; W251-L281 HydrophobicContact CB-CD2 4.38Å; W251-I286 HydrophobicContact CB-CD1 3.39Å; W251-I286 HydrophobicContact CD2-CD1 4.43Å; W251-I286 HydrophobicContact CG-CD1 3.94Å; W251-I290 HydrophobicContact CH2-CG2 3.62Å; W251-I290 HydrophobicContact CZ3-CG2 3.63Å
252E92Very high91.4Very high25 Ų2550.4 Ų50.412%0.11726%0.262CS..Hα-helixtrans-72.1-42.6175.9-69.8-172.3168.200110.5R225 P249 D250 L255 R256R225-E252 IonicContact CZ-OE1 3.79Å; R225-E252 IonicContact CZ-OE2 3.05Å; R225-E252 VanDerWaalsContact CZ-OE2 3.24Å; R225-E252 IonicContact NE-OE1 3.17Å; R225-E252 IonicContact NH1-OE1 2.65Å; R225-E252 PolarHBondContact NH1-OE1 3.16Å; R225-E252 IonicContact NH1-OE2 2.69Å; R225-E252 IonicContact NH2-OE1 3.24Å; R225-E252 PolarHBondContact NH2-OE1 2.77Å; R225-E252 IonicContact NH2-OE2 3.3Å; R225-E252 PolarHBondContact NH2-OE2 2.67Å; P249-E252 HydrophobicContact CB-CG 4.35Å; P249-E252 WeakPolarHBondContact CD-OE2 3.48Å; P249-E252 HydrophobicContact CG-CG 4.33Å; P249-E252 WeakPolarHBondContact O-CB 3.34Å; P249-E252 PolarHBondContact O-N 3.02Å; D250-E252 VanDerWaalsContact C-N 3.32Å; D250-E252 PolarHBondContact O-N 3Å; E252-L255 PolarHBondContact O-N 2.92Å; E252-R256 WeakPolarHBondContact O-CB 3.36Å; E252-R256 PolarHBondContact O-N 2.79Å
253V93.7Very high91.8Very high54 Ų5450.3 Ų50.333%0.32726%0.258SS..Hα-helixtrans-61.5-48.8174.4-178.50000110.1E248 P249 D250 L255 R256 E257E248-V253 HydrophobicContact CB-CG2 4.19Å; P249-V253 PolarHBondContact O-N 3.21Å; D250-V253 PolarHBondContact O-N 3.05Å; V253-L255 VanDerWaalsContact C-N 3.29Å; V253-L255 PolarHBondContact O-N 2.67Å; V253-R256 WeakPolarHBondContact O-CB 3.33Å; V253-R256 PolarHBondContact O-N 3.39Å; V253-R256 VanDerWaalsContact O-N 3.16Å; V253-E257 WeakPolarHBondContact O-CG 3.23Å; V253-E257 PolarHBondContact O-N 3.28Å
254Y95.7Very high92.2Very high47 Ų4747.6 Ų47.618%0.18425%0.25CC..Hα-helixtrans-60.6-38.2178.7-168.1-87.7000112.4D250 T258 R277 E280 L281D250-Y254 VanDerWaalsContact O-CB 3.3Å; D250-Y254 WeakPolarHBondContact O-CB 2.96Å; D250-Y254 PolarHBondContact O-N 2.9Å; Y254-T258 WeakPolarHBondContact O-CB 3.34Å; Y254-T258 PolarHBondContact O-N 2.79Å; Y254-T258 PolarHBondContact O-OG1 2.78Å; Y254-R277 HydrophobicContact CE1-CB 3.72Å; Y254-R277 HydrophobicContact CE1-CG 4.22Å; Y254-R277 PolarHBondContact O-NH2 2.86Å; Y254-R277 VanDerWaalsContact OH-CA 3.3Å; Y254-R277 WeakPolarHBondContact OH-CA 3.43Å; Y254-R277 WeakPolarHBondContact OH-CB 3.37Å; Y254-R277 WeakPolarHBondContact OH-CG 3.37Å; Y254-E280 VanDerWaalsContact CZ-OE2 3.26Å; Y254-E280 PolarHBondContact OH-OE2 2.95Å; Y254-L281 HydrophobicContact CD1-CD1 4.2Å; Y254-L281 HydrophobicContact CD1-CD2 3.73Å; Y254-L281 HydrophobicContact CD1-CG 3.81Å; Y254-L281 HydrophobicContact CE1-CD1 4.43Å; Y254-L281 HydrophobicContact CE1-CD2 4.39Å; Y254-L281 HydrophobicContact CE1-CG 4Å
255L94.6Very high92.4Very high7 Ų750.9 Ų50.94%0.03727%0.265CS..Hα-helixtrans-67.7-41.9176.1-166.969.4000111.8W251 E252 V253 T258 A259 L281 I291 L295W251-L255 HydrophobicContact CZ3-CD2 4.3Å; W251-L255 WeakPolarHBondContact O-CB 3.43Å; W251-L255 PolarHBondContact O-N 3.33Å; E252-L255 PolarHBondContact O-N 2.92Å; V253-L255 VanDerWaalsContact C-N 3.29Å; V253-L255 PolarHBondContact O-N 2.67Å; L255-T258 WeakPolarHBondContact O-CB 3.34Å; L255-T258 PolarHBondContact O-N 3.33Å; L255-A259 PolarHBondContact O-N 3.36Å; L255-L281 HydrophobicContact CD1-CD1 3.6Å; L255-I291 HydrophobicContact CD1-CG2 3.92Å; L255-L295 HydrophobicContact CD1-CD1 4.44Å; L255-L295 HydrophobicContact CD1-CD2 3.81Å; L255-L295 HydrophobicContact CD1-CG 3.69Å; L255-L295 HydrophobicContact CG-CD2 4.17Å; L255-L295 HydrophobicContact CG-CG 4.22Å
256R94.2Very high92.7Very high78 Ų7846.6 Ų46.629%0.29424%0.241SC..Hα-helixtrans-61.9-48.2176.5-174.5-179.3-59.6118-0.1111.6E248 E252 V253 T258 A259 N260 E298E248-R256 IonicContact OE1-NH2 3.34Å; E248-R256 PolarHBondContact OE1-NH2 3.32Å; E248-R256 IonicContact OE2-CZ 2.67Å; E248-R256 IonicContact OE2-NH1 3.2Å; E248-R256 PolarHBondContact OE2-NH1 2.96Å; E248-R256 IonicContact OE2-NH2 3.33Å; E248-R256 PolarHBondContact OE2-NH2 3.48Å; E252-R256 WeakPolarHBondContact O-CB 3.36Å; E252-R256 PolarHBondContact O-N 2.79Å; V253-R256 WeakPolarHBondContact O-CB 3.33Å; V253-R256 PolarHBondContact O-N 3.39Å; V253-R256 VanDerWaalsContact O-N 3.16Å; R256-T258 VanDerWaalsContact C-N 3.25Å; R256-T258 PolarHBondContact O-N 2.53Å; R256-A259 WeakPolarHBondContact O-CB 3.35Å; R256-A259 PolarHBondContact O-N 3.08Å; R256-A259 VanDerWaalsContact O-N 3.15Å; R256-N260 PolarHBondContact O-N 3.2Å; R256-N260 PolarHBondContact O-ND2 3.43Å; R256-E298 HydrophobicContact CG-CG 4.01Å; R256-E298 WeakPolarHBondContact CG-OE1 3.37Å
257E95Very high93.1Very high96 Ų9647.5 Ų47.545%0.44925%0.247SC..Hα-helixtrans-58.7-39.1173.4-72.6177.1-178.100112.1V253 N260 A261 R277V253-E257 WeakPolarHBondContact O-CG 3.23Å; V253-E257 PolarHBondContact O-N 3.28Å; E257-N260 PolarHBondContact O-N 3.49Å; E257-A261 WeakPolarHBondContact O-CB 3.39Å; E257-A261 PolarHBondContact O-N 3.3Å; E257-R277 VanDerWaalsContact CB-NH2 3.29Å; E257-R277 IonicContact OE2-CZ 2.79Å; E257-R277 IonicContact OE2-NH1 2.69Å; E257-R277 IonicContact OE2-NH2 3.05Å; E257-R277 PolarHBondContact OE2-NH2 2.91Å
258T95.1Very high93.4Very high0 Ų051 Ų510%027%0.271CS..Hα-helixtrans-62.5-45175.5-53.50000110.8Y254 L255 R256 A261 I262 V274 R277 L295Y254-T258 WeakPolarHBondContact O-CB 3.34Å; Y254-T258 PolarHBondContact O-N 2.79Å; Y254-T258 PolarHBondContact O-OG1 2.78Å; L255-T258 WeakPolarHBondContact O-CB 3.34Å; L255-T258 PolarHBondContact O-N 3.33Å; R256-T258 VanDerWaalsContact C-N 3.25Å; R256-T258 PolarHBondContact O-N 2.53Å; T258-A261 PolarHBondContact O-N 2.9Å; T258-I262 HydrophobicContact CG2-CD1 4.34Å; T258-I262 VanDerWaalsContact O-CG1 3.25Å; T258-I262 WeakPolarHBondContact O-CG1 3.3Å; T258-I262 PolarHBondContact O-N 3.18Å; T258-V274 HydrophobicContact CG2-CG1 3.95Å; T258-R277 HydrophobicContact CG2-CB 4.11Å; T258-R277 PolarHBondContact OG1-NE 3.25Å; T258-L295 HydrophobicContact CG2-CD2 4.36Å
259A94.9Very high93.7Very high0 Ų056.1 Ų56.10%029%0.294CS..Hα-helixtrans-61.8-43175.600000112.1L255 R256 A261 I262 V263 L295 E298 L299L255-A259 PolarHBondContact O-N 3.36Å; R256-A259 WeakPolarHBondContact O-CB 3.35Å; R256-A259 PolarHBondContact O-N 3.08Å; R256-A259 VanDerWaalsContact O-N 3.15Å; A259-A261 VanDerWaalsContact C-N 3.34Å; A259-A261 PolarHBondContact O-N 3.31Å; A259-I262 WeakPolarHBondContact O-CB 3.21Å; A259-I262 PolarHBondContact O-N 3.09Å; A259-I262 VanDerWaalsContact O-N 3.17Å; A259-V263 WeakPolarHBondContact O-CG2 3.35Å; A259-V263 PolarHBondContact O-N 3.07Å; A259-V263 VanDerWaalsContact O-N 3.08Å; A259-L295 HydrophobicContact CB-CD2 4.04Å; A259-E298 HydrophobicContact CB-CB 3.62Å; A259-E298 HydrophobicContact CB-CG 3.64Å; A259-L299 HydrophobicContact CB-CD2 4.18Å; A259-L299 HydrophobicContact CB-CG 4.41Å
260N94.1Very high93.9Very high71 Ų7156.9 Ų56.938%0.3829%0.291SS..Hα-helixtrans-63-39.9176.2-69.5-21.1000112.1R256 E257 I262 V263 S264R256-N260 PolarHBondContact O-N 3.2Å; R256-N260 PolarHBondContact O-ND2 3.43Å; E257-N260 PolarHBondContact O-N 3.49Å; N260-I262 VanDerWaalsContact C-N 3.32Å; N260-I262 PolarHBondContact O-N 3.15Å; N260-V263 PolarHBondContact O-N 3.03Å; N260-S264 WeakPolarHBondContact O-CB 3.3Å; N260-S264 PolarHBondContact O-N 2.99Å
261A94.1Very high94.1Very high18 Ų1851.8 Ų51.815%0.14926%0.264CS..Hα-helixtrans-62.5-38.9174.400000111.9E257 T258 A259 V263 S264E257-A261 WeakPolarHBondContact O-CB 3.39Å; E257-A261 PolarHBondContact O-N 3.3Å; T258-A261 PolarHBondContact O-N 2.9Å; A259-A261 VanDerWaalsContact C-N 3.34Å; A259-A261 PolarHBondContact O-N 3.31Å; A261-V263 VanDerWaalsContact C-N 3.34Å; A261-V263 PolarHBondContact O-N 3.14Å; A261-S264 PolarHBondContact O-N 2.75Å; A261-S264 PolarHBondContact O-OG 3.14Å
262I94.2Very high94.2Very high0 Ų053.6 Ų53.60%028%0.279CS..Hα-helixtrans-63-40.2175.6-65.6163.1000111.4T258 A259 N260 Q266 V274 L295 L299 I336 F339 M340T258-I262 HydrophobicContact CG2-CD1 4.34Å; T258-I262 VanDerWaalsContact O-CG1 3.25Å; T258-I262 WeakPolarHBondContact O-CG1 3.3Å; T258-I262 PolarHBondContact O-N 3.18Å; A259-I262 WeakPolarHBondContact O-CB 3.21Å; A259-I262 PolarHBondContact O-N 3.09Å; A259-I262 VanDerWaalsContact O-N 3.17Å; N260-I262 VanDerWaalsContact C-N 3.32Å; N260-I262 PolarHBondContact O-N 3.15Å; I262-Q266 PolarHBondContact O-NE2 3.45Å; I262-V274 HydrophobicContact CD1-CG1 3.96Å; I262-V274 HydrophobicContact CG1-CB 4.47Å; I262-V274 HydrophobicContact CG1-CG1 3.88Å; I262-V274 HydrophobicContact CG1-CG2 3.75Å; I262-L295 HydrophobicContact CD1-CD2 4.18Å; I262-L299 HydrophobicContact CB-CD2 4.33Å; I262-L299 HydrophobicContact CG2-CD2 4.14Å; I262-I336 HydrophobicContact CD1-CD1 3.83Å; I262-I336 HydrophobicContact CD1-CG1 4.07Å; I262-I336 HydrophobicContact CD1-CG2 3.91Å; I262-I336 HydrophobicContact CG1-CG2 3.95Å; I262-I336 HydrophobicContact CG2-CG2 4.15Å; I262-F339 HydrophobicContact CG2-CD1 3.54Å; I262-F339 HydrophobicContact CG2-CE1 3.66Å; I262-M340 HydrophobicContact CB-CE 4.16Å; I262-M340 HydrophobicContact CG1-CE 4.06Å; I262-M340 HydrophobicContact CG2-CE 3.92Å; I262-M340 HydrophobicContact CG2-CG 4.05Å
263V92.3Very high94.3Very high26 Ų2657 Ų5716%0.15830%0.295CS..Hα-helixtrans-73.7-34179.41750000111.8A259 N260 A261 Q265 Q266 L299 N302 Y343A259-V263 WeakPolarHBondContact O-CG2 3.35Å; A259-V263 PolarHBondContact O-N 3.07Å; A259-V263 VanDerWaalsContact O-N 3.08Å; N260-V263 PolarHBondContact O-N 3.03Å; A261-V263 VanDerWaalsContact C-N 3.34Å; A261-V263 PolarHBondContact O-N 3.14Å; V263-Q265 PolarHBondContact O-N 3.34Å; V263-Q266 PolarHBondContact O-NE2 2.69Å; V263-L299 HydrophobicContact CG2-CD2 3.66Å; V263-N302 HydrophobicContact CG1-CB 4.18Å; V263-N302 HydrophobicContact CG2-CB 4.08Å; V263-Y343 HydrophobicContact CG1-CE1 4.28Å
264S92.1Very high94.4Very high80 Ų8054.4 Ų54.456%0.55928%0.28SS*.Hα-helixtrans-66.1-34.1-17770.20000114.6N260 A261N260-S264 WeakPolarHBondContact O-CB 3.3Å; N260-S264 PolarHBondContact O-N 2.99Å; A261-S264 PolarHBondContact O-N 2.75Å; A261-S264 PolarHBondContact O-OG 3.14Å
265Q92.3Very high94.5Very high76 Ų7656.2 Ų56.236%0.35529%0.286SS..  trans-154.6125.9-172.4-168.7-178.21100112.5V263 S267 R270V263-Q265 PolarHBondContact O-N 3.34Å; Q265-S267 PolarHBondContact NE2-OG 3.28Å; Q265-R270 HydrophobicContact CB-CB 4.39Å; Q265-R270 HydrophobicContact CB-CG 4.24Å; Q265-R270 HydrophobicContact CG-CB 4.47Å; Q265-R270 WeakPolarHBondContact O-CG 3.46Å; Q265-R270 VanDerWaalsContact OE1-NE 3.12Å
266Q92.3Very high94.6Very high39 Ų3958.6 Ų58.618%0.18231%0.307CS..  trans-105.667.5-179.8-58.974.725.100110.8I262 V263 M340 Y343 K344I262-Q266 PolarHBondContact O-NE2 3.45Å; V263-Q266 PolarHBondContact O-NE2 2.69Å; Q266-M340 HydrophobicContact CB-CB 4.29Å; Q266-M340 HydrophobicContact CG-CB 4.23Å; Q266-M340 HydrophobicContact CG-CG 4.42Å; Q266-Y343 HydrophobicContact CG-CD1 4.27Å; Q266-Y343 VanDerWaalsContact NE2-CD1 3.34Å; Q266-K344 HydrophobicContact CB-CB 3.86Å; Q266-K344 HydrophobicContact CB-CD 4.08Å; Q266-K344 HydrophobicContact CB-CG 4.32Å; Q266-K344 HydrophobicContact CG-CB 4.04Å
267S94.4Very high94.6Very high25 Ų2557.6 Ų57.618%0.17530%0.303CS..SBendtrans-123.1154.6177.475.80000112.3Q265 Q269 R270 L271Q265-S267 PolarHBondContact NE2-OG 3.28Å; S267-Q269 PolarHBondContact O-N 3.22Å; S267-R270 PolarHBondContact O-N 3.29Å; S267-R270 VanDerWaalsContact O-N 3.16Å; S267-R270 PolarHBondContact OG-N 3.06Å; S267-L271 PolarHBondContact O-N 3.37Å
268P94.9Very high94.7Very high113 Ų11353.1 Ų53.173%0.73428%0.282SS*.Hα-helixtrans-60.9-31.1176-24.434.6000113.6L271 L272P268-L271 PolarHBondContact O-N 3.12Å; P268-L272 PolarHBondContact O-N 3.4Å
269Q95.1Very high94.7Very high154 Ų15457.8 Ų57.872%0.7230%0.301SS*.Hα-helixtrans-65.2-45.1175-68.3173-4.500110.9S267 L271 L272 E273S267-Q269 PolarHBondContact O-N 3.22Å; Q269-L271 VanDerWaalsContact C-N 3.32Å; Q269-L271 PolarHBondContact O-N 3.34Å; Q269-L272 WeakPolarHBondContact O-CB 3.44Å; Q269-L272 PolarHBondContact O-N 3.35Å; Q269-L272 VanDerWaalsContact O-N 3.16Å; Q269-E273 PolarHBondContact O-N 3.21Å
270R94.9Very high94.8Very high59 Ų5962.2 Ų62.222%0.22332%0.321CS..Hα-helixtrans-62.6-39.2175.2-174.562.365.116714.1112Q265 S267 L272 E273 V274 M340Q265-R270 HydrophobicContact CB-CB 4.39Å; Q265-R270 HydrophobicContact CB-CG 4.24Å; Q265-R270 HydrophobicContact CG-CB 4.47Å; Q265-R270 WeakPolarHBondContact O-CG 3.46Å; Q265-R270 VanDerWaalsContact OE1-NE 3.12Å; S267-R270 PolarHBondContact O-N 3.29Å; S267-R270 VanDerWaalsContact O-N 3.16Å; S267-R270 PolarHBondContact OG-N 3.06Å; R270-L272 VanDerWaalsContact C-N 3.26Å; R270-L272 PolarHBondContact O-N 3.35Å; R270-E273 WeakPolarHBondContact CD-OE2 3.45Å; R270-E273 IonicContact CZ-OE2 3.85Å; R270-E273 IonicContact NE-OE2 2.66Å; R270-E273 PolarHBondContact NE-OE2 3.3Å; R270-E273 IonicContact NH1-OE2 3.07Å; R270-E273 PolarHBondContact NH1-OE2 3.14Å; R270-E273 WeakPolarHBondContact O-CB 3.45Å; R270-E273 PolarHBondContact O-N 2.66Å; R270-V274 HydrophobicContact CG-CG2 4.38Å; R270-V274 WeakPolarHBondContact O-CG2 3.47Å; R270-V274 PolarHBondContact O-N 3.28Å; R270-M340 HydrophobicContact CG-CE 4.21Å
271L95.4Very high94.8Very high34 Ų3459 Ų5918%0.17830%0.304CS..Hα-helixtrans-59.9-37.2176-177.863.7000112.1S267 P268 Q269 V274 R275 I336 A337 M340S267-L271 PolarHBondContact O-N 3.37Å; P268-L271 PolarHBondContact O-N 3.12Å; Q269-L271 VanDerWaalsContact C-N 3.32Å; Q269-L271 PolarHBondContact O-N 3.34Å; L271-V274 PolarHBondContact O-N 2.96Å; L271-R275 WeakPolarHBondContact O-CB 3.34Å; L271-R275 PolarHBondContact O-N 3.06Å; L271-I336 HydrophobicContact CD1-CB 4.29Å; L271-I336 HydrophobicContact CD1-CG2 3.81Å; L271-A337 HydrophobicContact CD1-CB 4.35Å; L271-A337 HydrophobicContact CD2-CB 3.86Å; L271-M340 HydrophobicContact CB-SD 4.11Å; L271-M340 HydrophobicContact CD1-CE 4.49Å; L271-M340 HydrophobicContact CD1-SD 4.05Å
272L95.9Very high94.8Very high124 Ų12460.2 Ų60.265%0.64931%0.308SS*.Hα-helixtrans-64.5-43.8175.3-169.6158.9000111.5P268 Q269 R270 R275 A276P268-L272 PolarHBondContact O-N 3.4Å; Q269-L272 WeakPolarHBondContact O-CB 3.44Å; Q269-L272 PolarHBondContact O-N 3.35Å; Q269-L272 VanDerWaalsContact O-N 3.16Å; R270-L272 VanDerWaalsContact C-N 3.26Å; R270-L272 PolarHBondContact O-N 3.35Å; L272-R275 WeakPolarHBondContact O-CB 3.14Å; L272-R275 PolarHBondContact O-N 3.44Å; L272-A276 PolarHBondContact O-N 2.62Å; L272-A276 VanDerWaalsContact O-N 3.14Å
273E95.7Very high94.9Very high95 Ų9565.2 Ų65.244%0.44434%0.339SS..Hα-helixtrans-61-47174.5-64.8172.8-170.700111.4Q269 R270 R275 A276 R277Q269-E273 PolarHBondContact O-N 3.21Å; R270-E273 WeakPolarHBondContact CD-OE2 3.45Å; R270-E273 IonicContact CZ-OE2 3.85Å; R270-E273 IonicContact NE-OE2 2.66Å; R270-E273 PolarHBondContact NE-OE2 3.3Å; R270-E273 IonicContact NH1-OE2 3.07Å; R270-E273 PolarHBondContact NH1-OE2 3.14Å; R270-E273 WeakPolarHBondContact O-CB 3.45Å; R270-E273 PolarHBondContact O-N 2.66Å; E273-R275 VanDerWaalsContact C-N 3.26Å; E273-R275 PolarHBondContact O-N 3.34Å; E273-A276 WeakPolarHBondContact O-CB 3.3Å; E273-A276 PolarHBondContact O-N 3.06Å; E273-R277 PolarHBondContact O-N 3.45Å; E273-R277 VanDerWaalsContact O-N 3.09Å
274V95.9Very high95Very high1 Ų170.1 Ų70.11%0.00636%0.36CS..Hα-helixtrans-61.4-37.4178172.70000111.1T258 I262 R270 L271 A276 R277 L278 I336 M340T258-V274 HydrophobicContact CG2-CG1 3.95Å; I262-V274 HydrophobicContact CD1-CG1 3.96Å; I262-V274 HydrophobicContact CG1-CB 4.47Å; I262-V274 HydrophobicContact CG1-CG1 3.88Å; I262-V274 HydrophobicContact CG1-CG2 3.75Å; R270-V274 HydrophobicContact CG-CG2 4.38Å; R270-V274 WeakPolarHBondContact O-CG2 3.47Å; R270-V274 PolarHBondContact O-N 3.28Å; L271-V274 PolarHBondContact O-N 2.96Å; V274-A276 VanDerWaalsContact C-N 3.33Å; V274-A276 PolarHBondContact O-N 3.1Å; V274-R277 WeakPolarHBondContact O-CB 3.46Å; V274-R277 PolarHBondContact O-N 3.23Å; V274-L278 WeakPolarHBondContact O-CG 3.49Å; V274-L278 PolarHBondContact O-N 2.93Å; V274-I336 HydrophobicContact CG1-CD1 3.53Å; V274-I336 HydrophobicContact CG1-CG2 4.14Å; V274-M340 HydrophobicContact CG2-CE 4.25Å
275R96.3Very high95Very high84 Ų8471.7 Ų71.732%0.31737%0.369SS..Hα-helixtrans-60.5-41.5173.7-177.5-174.2179.9159.1-12.3112.1L271 L272 E273 R277 L278 Y279 I329 E333L271-R275 WeakPolarHBondContact O-CB 3.34Å; L271-R275 PolarHBondContact O-N 3.06Å; L272-R275 WeakPolarHBondContact O-CB 3.14Å; L272-R275 PolarHBondContact O-N 3.44Å; E273-R275 VanDerWaalsContact C-N 3.26Å; E273-R275 PolarHBondContact O-N 3.34Å; R275-R277 VanDerWaalsContact C-N 3.32Å; R275-L278 PolarHBondContact O-N 3.21Å; R275-Y279 HydrophobicContact CG-CD2 4.07Å; R275-Y279 HydrophobicContact CG-CE2 3.88Å; R275-Y279 VanDerWaalsContact O-CD2 3.3Å; R275-Y279 WeakPolarHBondContact O-CD2 3.43Å; R275-Y279 PolarHBondContact O-N 2.72Å; R275-I329 HydrophobicContact CG-CD1 4.38Å; R275-E333 WeakPolarHBondContact CD-OE1 3.3Å; R275-E333 WeakPolarHBondContact CD-OE2 3.5Å; R275-E333 IonicContact CZ-OE1 2.72Å; R275-E333 IonicContact CZ-OE2 3.61Å; R275-E333 VanDerWaalsContact CZ-OE2 3.27Å; R275-E333 IonicContact NE-OE1 3.82Å; R275-E333 IonicContact NE-OE2 3.44Å; R275-E333 PolarHBondContact NE-OE2 2.89Å; R275-E333 IonicContact NH1-OE1 2.62Å; R275-E333 PolarHBondContact NH1-OE1 2.82Å; R275-E333 IonicContact NH1-OE2 3.88Å; R275-E333 PolarHBondContact NH1-OE2 2.85Å; R275-E333 VanDerWaalsContact NH1-OE2 3.14Å
276A96.4Very high95.1Very high58 Ų5869 Ų6948%0.47936%0.357SS..Hα-helixtrans-61.1-43174.800000111.1L272 E273 V274 L278 Y279 E280L272-A276 PolarHBondContact O-N 2.62Å; L272-A276 VanDerWaalsContact O-N 3.14Å; E273-A276 WeakPolarHBondContact O-CB 3.3Å; E273-A276 PolarHBondContact O-N 3.06Å; V274-A276 VanDerWaalsContact C-N 3.33Å; V274-A276 PolarHBondContact O-N 3.1Å; A276-L278 PolarHBondContact O-N 2.93Å; A276-Y279 WeakPolarHBondContact O-CB 3.41Å; A276-Y279 PolarHBondContact O-N 3.44Å; A276-Y279 VanDerWaalsContact O-N 3.15Å; A276-E280 PolarHBondContact O-N 2.87Å
277R95.8Very high95.1Very high57 Ų5769.1 Ų69.122%0.21536%0.361CS..Hα-helixtrans-61.1-40.7175.2-61.5-170.868.1108.6-4.9112.8Y254 E257 T258 E273 V274 R275 Y279 E280 L281Y254-R277 HydrophobicContact CE1-CB 3.72Å; Y254-R277 HydrophobicContact CE1-CG 4.22Å; Y254-R277 PolarHBondContact O-NH2 2.86Å; Y254-R277 VanDerWaalsContact OH-CA 3.3Å; Y254-R277 WeakPolarHBondContact OH-CA 3.43Å; Y254-R277 WeakPolarHBondContact OH-CB 3.37Å; Y254-R277 WeakPolarHBondContact OH-CG 3.37Å; E257-R277 VanDerWaalsContact CB-NH2 3.29Å; E257-R277 IonicContact OE2-CZ 2.79Å; E257-R277 IonicContact OE2-NH1 2.69Å; E257-R277 IonicContact OE2-NH2 3.05Å; E257-R277 PolarHBondContact OE2-NH2 2.91Å; T258-R277 HydrophobicContact CG2-CB 4.11Å; T258-R277 PolarHBondContact OG1-NE 3.25Å; E273-R277 PolarHBondContact O-N 3.45Å; E273-R277 VanDerWaalsContact O-N 3.09Å; V274-R277 WeakPolarHBondContact O-CB 3.46Å; V274-R277 PolarHBondContact O-N 3.23Å; R275-R277 VanDerWaalsContact C-N 3.32Å; R277-Y279 VanDerWaalsContact C-N 3.35Å; R277-Y279 PolarHBondContact O-N 3.06Å; R277-E280 PolarHBondContact O-N 2.91Å; R277-L281 PolarHBondContact O-N 2.96Å; R277-L281 VanDerWaalsContact O-N 3.12Å
278L95.5Very high95.1Very high1 Ų169.4 Ų69.41%0.00536%0.362CS..Hα-helixtrans-63.5-38.7174.2-69.3-179.5000112.6V274 R275 A276 E280 L281 L282 I291 L295 I329 L332 I336V274-L278 WeakPolarHBondContact O-CG 3.49Å; V274-L278 PolarHBondContact O-N 2.93Å; R275-L278 PolarHBondContact O-N 3.21Å; A276-L278 PolarHBondContact O-N 2.93Å; L278-E280 VanDerWaalsContact C-N 3.33Å; L278-L281 PolarHBondContact O-N 3.07Å; L278-L282 WeakPolarHBondContact O-CB 3.47Å; L278-L282 VanDerWaalsContact O-CG 3.3Å; L278-L282 WeakPolarHBondContact O-CG 3.33Å; L278-L282 PolarHBondContact O-N 3.36Å; L278-I291 HydrophobicContact CD2-CG2 4.01Å; L278-L295 HydrophobicContact CD2-CD1 4.21Å; L278-I329 HydrophobicContact CB-CD1 3.7Å; L278-I329 HydrophobicContact CD1-CD1 3.98Å; L278-L332 HydrophobicContact CD1-CB 3.71Å; L278-L332 HydrophobicContact CD2-CD1 4.48Å; L278-I336 HydrophobicContact CD1-CD1 3.63Å; L278-I336 HydrophobicContact CD2-CD1 4.16Å; L278-I336 HydrophobicContact CG-CD1 4.16Å
279Y96Very high95Very high99 Ų9965.6 Ų65.639%0.38834%0.336SS..Hα-helixtrans-63.2-40.9175.1-87.4-65.4000111.9R275 A276 R277 L282 T283 I329R275-Y279 HydrophobicContact CG-CD2 4.07Å; R275-Y279 HydrophobicContact CG-CE2 3.88Å; R275-Y279 VanDerWaalsContact O-CD2 3.3Å; R275-Y279 WeakPolarHBondContact O-CD2 3.43Å; R275-Y279 PolarHBondContact O-N 2.72Å; A276-Y279 WeakPolarHBondContact O-CB 3.41Å; A276-Y279 PolarHBondContact O-N 3.44Å; A276-Y279 VanDerWaalsContact O-N 3.15Å; R277-Y279 VanDerWaalsContact C-N 3.35Å; R277-Y279 PolarHBondContact O-N 3.06Å; Y279-L282 PolarHBondContact O-N 3.48Å; Y279-T283 VanDerWaalsContact O-CB 3.3Å; Y279-T283 WeakPolarHBondContact O-CB 3.39Å; Y279-T283 PolarHBondContact O-N 3.12Å; Y279-T283 PolarHBondContact O-OG1 2.88Å; Y279-I329 HydrophobicContact CD2-CD1 4.45Å; Y279-I329 HydrophobicContact CE1-CB 4.41Å; Y279-I329 HydrophobicContact CE1-CG1 4.07Å; Y279-I329 HydrophobicContact CE1-CG2 4.37Å; Y279-I329 HydrophobicContact CE2-CD1 4.42Å; Y279-I329 HydrophobicContact CE2-CG1 4.09Å
280E95.9Very high94.9Very high93 Ų9361.2 Ų61.244%0.43532%0.317SS..Hα-helixtrans-60.4-47.9176.9-167.4162.8-166.900110.9Y254 A276 R277 L278 L282 T283 H284Y254-E280 VanDerWaalsContact CZ-OE2 3.26Å; Y254-E280 PolarHBondContact OH-OE2 2.95Å; A276-E280 PolarHBondContact O-N 2.87Å; R277-E280 PolarHBondContact O-N 2.91Å; L278-E280 VanDerWaalsContact C-N 3.33Å; E280-L282 PolarHBondContact O-N 2.9Å; E280-T283 WeakPolarHBondContact O-CB 3.45Å; E280-T283 PolarHBondContact O-N 2.78Å; E280-T283 VanDerWaalsContact O-N 3.15Å; E280-H284 PolarHBondContact O-CD2 2.79Å; E280-H284 PolarHBondContact O-N 3.14Å
281L94.7Very high94.9Very high4 Ų458.4 Ų58.42%0.02131%0.306CS..Hα-helixtrans-58.5-43.9175-70.9169.8000113.2W251 Y254 L255 R277 L278 T283 H284 I286 I291W251-L281 HydrophobicContact CB-CD2 4.38Å; Y254-L281 HydrophobicContact CD1-CD1 4.2Å; Y254-L281 HydrophobicContact CD1-CD2 3.73Å; Y254-L281 HydrophobicContact CD1-CG 3.81Å; Y254-L281 HydrophobicContact CE1-CD1 4.43Å; Y254-L281 HydrophobicContact CE1-CD2 4.39Å; Y254-L281 HydrophobicContact CE1-CG 4Å; L255-L281 HydrophobicContact CD1-CD1 3.6Å; R277-L281 PolarHBondContact O-N 2.96Å; R277-L281 VanDerWaalsContact O-N 3.12Å; L278-L281 PolarHBondContact O-N 3.07Å; L281-T283 VanDerWaalsContact C-N 3.34Å; L281-H284 PolarHBondContact O-N 3.04Å; L281-I286 HydrophobicContact CB-CD1 4.37Å; L281-I286 HydrophobicContact CD2-CD1 3.61Å; L281-I286 PolarHBondContact O-N 3.22Å; L281-I291 HydrophobicContact CB-CD1 3.8Å; L281-I291 HydrophobicContact CD1-CG2 4.32Å
282L94.7Very high94.9Very high42 Ų4257 Ų5722%0.2230%0.299CS..Hα-helixtrans-68.6-34177.6-70.9174.2000112.3L278 Y279 E280 H284 C285 P288 I291 A328 I329 L332L278-L282 WeakPolarHBondContact O-CB 3.47Å; L278-L282 VanDerWaalsContact O-CG 3.3Å; L278-L282 WeakPolarHBondContact O-CG 3.33Å; L278-L282 PolarHBondContact O-N 3.36Å; Y279-L282 PolarHBondContact O-N 3.48Å; E280-L282 PolarHBondContact O-N 2.9Å; L282-H284 VanDerWaalsContact C-N 3.3Å; L282-C285 PolarHBondContact O-N 2.84Å; L282-P288 HydrophobicContact CD2-CB 4.38Å; L282-P288 HydrophobicContact CD2-CG 3.88Å; L282-I291 HydrophobicContact CD2-CD1 3.85Å; L282-I291 HydrophobicContact CG-CD1 4.25Å; L282-A328 HydrophobicContact CD2-CB 4.32Å; L282-I329 HydrophobicContact CD1-CB 3.95Å; L282-I329 HydrophobicContact CD1-CD1 4.19Å; L282-L332 HydrophobicContact CD1-CD1 4.14Å; L282-L332 HydrophobicContact CD2-CD1 4.21Å; L282-L332 HydrophobicContact CG-CD1 4.38Å
283T95.8Very high94.8Very high106 Ų10657.2 Ų57.265%0.6529%0.294SS*.Hα-helixtrans-67-35.3177.9-58.10000110.8Y279 E280 L281 C285Y279-T283 VanDerWaalsContact O-CB 3.3Å; Y279-T283 WeakPolarHBondContact O-CB 3.39Å; Y279-T283 PolarHBondContact O-N 3.12Å; Y279-T283 PolarHBondContact O-OG1 2.88Å; E280-T283 WeakPolarHBondContact O-CB 3.45Å; E280-T283 PolarHBondContact O-N 2.78Å; E280-T283 VanDerWaalsContact O-N 3.15Å; L281-T283 VanDerWaalsContact C-N 3.34Å; T283-C285 PolarHBondContact O-N 3.09Å; T283-C285 VanDerWaalsContact O-N 3.1Å
284H94.7Very high94.6Very high129 Ų12954.1 Ų54.160%0.59729%0.288SS*.THydrogen-bonded Turntrans-73.512.1170.5-70.2-63.2000114.4E280 L281 L282 I286E280-H284 PolarHBondContact O-CD2 2.79Å; E280-H284 PolarHBondContact O-N 3.14Å; L281-H284 PolarHBondContact O-N 3.04Å; L282-H284 VanDerWaalsContact C-N 3.3Å; H284-I286 HydrophobicContact CB-CD1 4.34Å; H284-I286 HydrophobicContact CB-CG1 4.4Å; H284-I286 PolarHBondContact O-N 3.37Å
285C92.4Very high94.6Very high112 Ų11254.1 Ų54.176%0.75729%0.288SS*.THydrogen-bonded Turntrans58.529.8176.8-58.70000114.2L282 T283 P287L282-C285 PolarHBondContact O-N 2.84Å; T283-C285 PolarHBondContact O-N 3.09Å; T283-C285 VanDerWaalsContact O-N 3.1Å; C285-P287 WeakPolarHBondContact O-CD 3.45Å
286I94.7Very high94.5Very high21 Ų2150.9 Ų50.911%0.10828%0.278CS..  trans-76.2126.8173.8-58.8164000108.4W251 L281 H284 I290 I291W251-I286 HydrophobicContact CB-CD1 3.39Å; W251-I286 HydrophobicContact CD2-CD1 4.43Å; W251-I286 HydrophobicContact CG-CD1 3.94Å; L281-I286 HydrophobicContact CB-CD1 4.37Å; L281-I286 HydrophobicContact CD2-CD1 3.61Å; L281-I286 PolarHBondContact O-N 3.22Å; H284-I286 HydrophobicContact CB-CD1 4.34Å; H284-I286 HydrophobicContact CB-CG1 4.4Å; H284-I286 PolarHBondContact O-N 3.37Å; I286-I290 HydrophobicContact CG2-CB 4.41Å; I286-I290 HydrophobicContact CG2-CG2 4.4Å; I286-I291 HydrophobicContact CB-CD1 4.39Å; I286-I291 HydrophobicContact CB-CG1 4.4Å; I286-I291 HydrophobicContact CG2-CD1 4.39Å; I286-I291 HydrophobicContact CG2-CG1 3.86Å
287P92.8Very high94.3Very high40 Ų4049.9 Ų49.926%0.2627%0.272SS..  trans-55.6131.8178.9-2733.7000112.1C285 D289 I290 I291C285-P287 WeakPolarHBondContact O-CD 3.45Å; P287-D289 WeakPolarHBondContact CB-OD1 3.46Å; P287-D289 PolarHBondContact O-N 3.04Å; P287-I290 HydrophobicContact CB-CB 4.49Å; P287-I290 HydrophobicContact CB-CD1 4.04Å; P287-I290 HydrophobicContact CB-CG1 4.05Å; P287-I290 HydrophobicContact CG-CD1 3.82Å; P287-I290 HydrophobicContact CG-CG1 4.39Å; P287-I290 WeakPolarHBondContact O-CB 3.3Å; P287-I290 PolarHBondContact O-N 3.43Å; P287-I291 PolarHBondContact O-N 3.44Å
288P94.1Very high94.1Very high31 Ų3149.2 Ų49.220%0.20127%0.272CS..Hα-helixtrans-62.5-27.1-177.2-19.928.3000114L282 I290 I291 I292 L322 A328 L332L282-P288 HydrophobicContact CD2-CB 4.38Å; L282-P288 HydrophobicContact CD2-CG 3.88Å; P288-I290 VanDerWaalsContact C-N 3.28Å; P288-I290 PolarHBondContact O-N 3.05Å; P288-I291 PolarHBondContact O-N 3.12Å; P288-I292 PolarHBondContact O-N 3.1Å; P288-L322 HydrophobicContact CB-CD1 3.53Å; P288-L322 HydrophobicContact CB-CD2 3.74Å; P288-L322 HydrophobicContact CB-CG 4.23Å; P288-L322 HydrophobicContact CG-CD2 4.26Å; P288-A328 HydrophobicContact CB-CB 3.84Å; P288-A328 HydrophobicContact CG-CB 3.46Å; P288-A328 VanDerWaalsContact CG-CB 3.46Å; P288-L332 HydrophobicContact CB-CD1 4.45Å
289D91.9Very high94Very high33 Ų3349.2 Ų49.218%0.17627%0.272CS..Hα-helixtrans-68-30.1175.470.1-68000112P287 K293P287-D289 WeakPolarHBondContact CB-OD1 3.46Å; P287-D289 PolarHBondContact O-N 3.04Å; D289-K293 WeakPolarHBondContact O-CB 3.3Å; D289-K293 VanDerWaalsContact O-CD 3.31Å; D289-K293 WeakPolarHBondContact O-CD 3.48Å; D289-K293 WeakPolarHBondContact O-CG 3.09Å; D289-K293 PolarHBondContact O-N 3.15Å; D289-K293 IonicContact OD2-NZ 2.74Å; D289-K293 PolarHBondContact OD2-NZ 3.38Å
290I93.2Very high93.8Very high62 Ų6246.4 Ų46.432%0.31826%0.264SS..Hα-helixtrans-72.6-41.6172.9-61.4-179.7000109.8W251 I286 P287 P288 K293 G294W251-I290 HydrophobicContact CH2-CG2 3.62Å; W251-I290 HydrophobicContact CZ3-CG2 3.63Å; I286-I290 HydrophobicContact CG2-CB 4.41Å; I286-I290 HydrophobicContact CG2-CG2 4.4Å; P287-I290 HydrophobicContact CB-CB 4.49Å; P287-I290 HydrophobicContact CB-CD1 4.04Å; P287-I290 HydrophobicContact CB-CG1 4.05Å; P287-I290 HydrophobicContact CG-CD1 3.82Å; P287-I290 HydrophobicContact CG-CG1 4.39Å; P287-I290 WeakPolarHBondContact O-CB 3.3Å; P287-I290 PolarHBondContact O-N 3.43Å; P288-I290 VanDerWaalsContact C-N 3.28Å; P288-I290 PolarHBondContact O-N 3.05Å; I290-K293 PolarHBondContact O-N 3.11Å; I290-G294 PolarHBondContact O-N 2.82Å
291I95.5Very high93.5Very high1 Ų147.2 Ų47.21%0.00527%0.271CS..Hα-helixtrans-58.8-50.1176.8-60.9175.6000110.5L255 L278 L281 L282 I286 P287 P288 G294 L295 L332L255-I291 HydrophobicContact CD1-CG2 3.92Å; L278-I291 HydrophobicContact CD2-CG2 4.01Å; L281-I291 HydrophobicContact CB-CD1 3.8Å; L281-I291 HydrophobicContact CD1-CG2 4.32Å; L282-I291 HydrophobicContact CD2-CD1 3.85Å; L282-I291 HydrophobicContact CG-CD1 4.25Å; I286-I291 HydrophobicContact CB-CD1 4.39Å; I286-I291 HydrophobicContact CB-CG1 4.4Å; I286-I291 HydrophobicContact CG2-CD1 4.39Å; I286-I291 HydrophobicContact CG2-CG1 3.86Å; P287-I291 PolarHBondContact O-N 3.44Å; P288-I291 PolarHBondContact O-N 3.12Å; I291-G294 PolarHBondContact O-N 3.32Å; I291-L295 HydrophobicContact CG2-CD1 3.95Å; I291-L295 HydrophobicContact CG2-CG 4.46Å; I291-L295 WeakPolarHBondContact O-CB 3.32Å; I291-L295 WeakPolarHBondContact O-CG 3.4Å; I291-L295 PolarHBondContact O-N 3.29Å; I291-L332 HydrophobicContact CD1-CD1 4.49Å; I291-L332 HydrophobicContact CG2-CD1 4.39Å; I291-L332 HydrophobicContact CG2-CD2 4.35Å
292I95Very high93.1Very high4 Ų450.2 Ų50.22%0.02129%0.287CS..Hα-helixtrans-60.5-49.3178.1-67.7179.2000110.8P288 G294 L295 V296 A315 E319 L322 L332P288-I292 PolarHBondContact O-N 3.1Å; I292-G294 VanDerWaalsContact C-N 3.33Å; I292-G294 PolarHBondContact O-N 3.07Å; I292-L295 PolarHBondContact O-N 2.86Å; I292-V296 HydrophobicContact CG2-CG2 4.04Å; I292-V296 WeakPolarHBondContact O-CB 3.29Å; I292-V296 WeakPolarHBondContact O-CG2 3.45Å; I292-V296 PolarHBondContact O-N 3.46Å; I292-A315 HydrophobicContact CG2-CB 4.47Å; I292-E319 HydrophobicContact CD1-CB 4Å; I292-E319 HydrophobicContact CD1-CG 4.32Å; I292-E319 HydrophobicContact CG2-CB 4.36Å; I292-L322 HydrophobicContact CD1-CD1 3.84Å; I292-L332 HydrophobicContact CD1-CD2 3.7Å; I292-L332 HydrophobicContact CG1-CD2 3.23Å
293K93.3Very high92.6Very high128 Ų12848.6 Ų48.656%0.55728%0.279SS*.Hα-helixtrans-61.2-42-178-73.6167.8-1691580112.1D289 I290 G297D289-K293 WeakPolarHBondContact O-CB 3.3Å; D289-K293 VanDerWaalsContact O-CD 3.31Å; D289-K293 WeakPolarHBondContact O-CD 3.48Å; D289-K293 WeakPolarHBondContact O-CG 3.09Å; D289-K293 PolarHBondContact O-N 3.15Å; D289-K293 IonicContact OD2-NZ 2.74Å; D289-K293 PolarHBondContact OD2-NZ 3.38Å; I290-K293 PolarHBondContact O-N 3.11Å; K293-G297 PolarHBondContact O-N 3.31Å
294G92.8Very high92.2Very high30 Ų3048.5 Ų48.531%0.30927%0.274SS..Hα-helixtrans-70.2-42.4178.800000112.8I290 I291 I292 V296 G297 E298I290-G294 PolarHBondContact O-N 2.82Å; I291-G294 PolarHBondContact O-N 3.32Å; I292-G294 VanDerWaalsContact C-N 3.33Å; I292-G294 PolarHBondContact O-N 3.07Å; G294-V296 PolarHBondContact O-N 2.67Å; G294-G297 PolarHBondContact O-N 3.41Å; G294-E298 PolarHBondContact O-N 3.37Å
295L94.4Very high91.6Very high1 Ų145.1 Ų45.11%0.00527%0.274CS..Hα-helixtrans-58.6-48.3172.8-77.5172.5000111L255 T258 A259 I262 L278 I291 I292 G297 E298 L299 I336L255-L295 HydrophobicContact CD1-CD1 4.44Å; L255-L295 HydrophobicContact CD1-CD2 3.81Å; L255-L295 HydrophobicContact CD1-CG 3.69Å; L255-L295 HydrophobicContact CG-CD2 4.17Å; L255-L295 HydrophobicContact CG-CG 4.22Å; T258-L295 HydrophobicContact CG2-CD2 4.36Å; A259-L295 HydrophobicContact CB-CD2 4.04Å; I262-L295 HydrophobicContact CD1-CD2 4.18Å; L278-L295 HydrophobicContact CD2-CD1 4.21Å; I291-L295 HydrophobicContact CG2-CD1 3.95Å; I291-L295 HydrophobicContact CG2-CG 4.46Å; I291-L295 WeakPolarHBondContact O-CB 3.32Å; I291-L295 WeakPolarHBondContact O-CG 3.4Å; I291-L295 PolarHBondContact O-N 3.29Å; I292-L295 PolarHBondContact O-N 2.86Å; L295-G297 VanDerWaalsContact C-N 3.33Å; L295-G297 PolarHBondContact O-N 3.23Å; L295-E298 PolarHBondContact O-N 2.81Å; L295-L299 WeakPolarHBondContact O-CB 3.39Å; L295-L299 WeakPolarHBondContact O-CG 3.35Å; L295-L299 PolarHBondContact O-N 2.87Å; L295-I336 HydrophobicContact CD1-CD1 4.23Å
296V94.4Very high91.2Very high17 Ų1747.5 Ų47.510%0.10328%0.275CS..Hα-helixtrans-63.5-41-178.6172.70000111.2I292 G294 E298 L299 L300 A315 F335I292-V296 HydrophobicContact CG2-CG2 4.04Å; I292-V296 WeakPolarHBondContact O-CB 3.29Å; I292-V296 WeakPolarHBondContact O-CG2 3.45Å; I292-V296 PolarHBondContact O-N 3.46Å; G294-V296 PolarHBondContact O-N 2.67Å; V296-E298 VanDerWaalsContact C-N 3.27Å; V296-E298 PolarHBondContact O-N 3.24Å; V296-L299 PolarHBondContact O-N 2.96Å; V296-L300 HydrophobicContact CG1-CD1 3.59Å; V296-L300 HydrophobicContact CG1-CG 3.93Å; V296-L300 VanDerWaalsContact O-CB 3.29Å; V296-L300 WeakPolarHBondContact O-CB 3.41Å; V296-L300 WeakPolarHBondContact O-CG 3.41Å; V296-L300 PolarHBondContact O-N 2.94Å; V296-A315 HydrophobicContact CB-CB 4.4Å; V296-A315 HydrophobicContact CG1-CB 4.16Å; V296-A315 HydrophobicContact CG2-CB 3.37Å; V296-F335 HydrophobicContact CG2-CE1 4.12Å; V296-F335 HydrophobicContact CG2-CE2 4.49Å; V296-F335 HydrophobicContact CG2-CZ 3.66Å
297G92.1Very high91Very high36 Ų3646.8 Ų46.837%0.37127%0.271SS..Hα-helixtrans-54.7-44.217500000112.4K293 G294 L295 N301K293-G297 PolarHBondContact O-N 3.31Å; G294-G297 PolarHBondContact O-N 3.41Å; L295-G297 VanDerWaalsContact C-N 3.33Å; L295-G297 PolarHBondContact O-N 3.23Å; G297-N301 PolarHBondContact O-ND2 2.91Å
298E92.9Very high90.9Very high44 Ų4448.8 Ų48.821%0.20628%0.275CS..Hα-helixtrans-77.1-41.4179.8-161.964.9-168.700112.8R256 A259 G294 L295 V296 L300 N301R256-E298 HydrophobicContact CG-CG 4.01Å; R256-E298 WeakPolarHBondContact CG-OE1 3.37Å; A259-E298 HydrophobicContact CB-CB 3.62Å; A259-E298 HydrophobicContact CB-CG 3.64Å; G294-E298 PolarHBondContact O-N 3.37Å; L295-E298 PolarHBondContact O-N 2.81Å; V296-E298 VanDerWaalsContact C-N 3.27Å; V296-E298 PolarHBondContact O-N 3.24Å; E298-L300 VanDerWaalsContact C-N 3.32Å; E298-L300 PolarHBondContact O-N 2.87Å; E298-N301 WeakPolarHBondContact O-CB 3.49Å; E298-N301 PolarHBondContact O-N 3.31Å
299L92.3Very high90.8Very high0 Ų050.6 Ų50.60%029%0.293CS..Hα-helixtrans-62.7-39.3178.2-68.7176.3000111.6A259 I262 V263 L295 V296 N301 N302 C303 F335 F339A259-L299 HydrophobicContact CB-CD2 4.18Å; A259-L299 HydrophobicContact CB-CG 4.41Å; I262-L299 HydrophobicContact CB-CD2 4.33Å; I262-L299 HydrophobicContact CG2-CD2 4.14Å; V263-L299 HydrophobicContact CG2-CD2 3.66Å; L295-L299 WeakPolarHBondContact O-CB 3.39Å; L295-L299 WeakPolarHBondContact O-CG 3.35Å; L295-L299 PolarHBondContact O-N 2.87Å; V296-L299 PolarHBondContact O-N 2.96Å; L299-N301 PolarHBondContact O-N 3.17Å; L299-N302 PolarHBondContact O-N 3.34Å; L299-N302 VanDerWaalsContact O-N 3.1Å; L299-C303 PolarHBondContact O-N 2.91Å; L299-C303 PolarHBondContact O-SG 3.32Å; L299-F335 HydrophobicContact CD1-CE1 4.22Å; L299-F335 HydrophobicContact CD1-CZ 4.3Å; L299-F339 HydrophobicContact CB-CE2 4.2Å; L299-F339 HydrophobicContact CB-CZ 4.19Å; L299-F339 HydrophobicContact CD1-CD1 4.23Å; L299-F339 HydrophobicContact CD1-CD2 4.19Å; L299-F339 HydrophobicContact CD1-CE1 4.24Å; L299-F339 HydrophobicContact CD1-CE2 4.19Å; L299-F339 HydrophobicContact CD1-CG 4.22Å; L299-F339 HydrophobicContact CD1-CZ 4.23Å; L299-F339 HydrophobicContact CD2-CD1 4.42Å; L299-F339 HydrophobicContact CD2-CE1 3.74Å; L299-F339 HydrophobicContact CD2-CE2 4.5Å; L299-F339 HydrophobicContact CD2-CZ 3.79Å; L299-F339 HydrophobicContact CG-CE1 4.49Å; L299-F339 HydrophobicContact CG-CZ 4.28Å
300L92.1Very high90.8Very high41 Ų4154.1 Ų54.122%0.21531%0.308CS..Hα-helixtrans-67.1-22.2178-71.2175.6000113.3V296 E298 N302 K308 V311V296-L300 HydrophobicContact CG1-CD1 3.59Å; V296-L300 HydrophobicContact CG1-CG 3.93Å; V296-L300 VanDerWaalsContact O-CB 3.29Å; V296-L300 WeakPolarHBondContact O-CB 3.41Å; V296-L300 WeakPolarHBondContact O-CG 3.41Å; V296-L300 PolarHBondContact O-N 2.94Å; E298-L300 VanDerWaalsContact C-N 3.32Å; E298-L300 PolarHBondContact O-N 2.87Å; L300-N302 VanDerWaalsContact C-N 3.27Å; L300-K308 HydrophobicContact CD2-CB 3.79Å; L300-K308 HydrophobicContact CD2-CG 3.83Å; L300-K308 WeakPolarHBondContact CD2-O 3.43Å; L300-K308 WeakPolarHBondContact O-CE 3.49Å; L300-K308 PolarHBondContact O-NZ 3.05Å; L300-V311 HydrophobicContact CD2-CB 4.08Å; L300-V311 HydrophobicContact CD2-CG1 4.01Å
301N89.4Confident90.8Very high110 Ų11051.2 Ų51.259%0.58829%0.293SS*.Hα-helixtrans-70.4-29.3173.4-67.4-24.3000111.5G297 E298 L299G297-N301 PolarHBondContact O-ND2 2.91Å; E298-N301 WeakPolarHBondContact O-CB 3.49Å; E298-N301 PolarHBondContact O-N 3.31Å; L299-N301 PolarHBondContact O-N 3.17Å
302N85.9Confident90.8Very high67 Ų6753.2 Ų53.236%0.35831%0.31SS..SBendtrans-97.52.2-177.5-64.2-35.4000114V263 L299 L300V263-N302 HydrophobicContact CG1-CB 4.18Å; V263-N302 HydrophobicContact CG2-CB 4.08Å; L299-N302 PolarHBondContact O-N 3.34Å; L299-N302 VanDerWaalsContact O-N 3.1Å; L300-N302 VanDerWaalsContact C-N 3.27Å
303C85.6Confident90.7Very high8 Ų859.5 Ų59.55%0.05434%0.339CS..SBendtrans-105.5152.9-178.6-66.90000112.5L299 L307 K308L299-C303 PolarHBondContact O-N 2.91Å; L299-C303 PolarHBondContact O-SG 3.32Å; C303-L307 HydrophobicContact CB-CB 4.31Å; C303-L307 HydrophobicContact CB-CD2 4.06Å; C303-L307 HydrophobicContact CB-CG 4.28Å; C303-K308 HydrophobicContact CB-CG 4.03Å; C303-K308 WeakPolarHBondContact O-CE 3.17Å
304D85.9Confident90.8Very high103 Ų10354.4 Ų54.455%0.55132%0.318SS*.  trans-73.9157.8169.7-84.1-34.7000113.1Q306 L307 K308 F346D304-Q306 VanDerWaalsContact C-N 3.33Å; D304-Q306 PolarHBondContact O-N 2.93Å; D304-L307 CarbonylContact O-C 3.6Å; D304-L307 WeakPolarHBondContact O-CA 3.3Å; D304-L307 WeakPolarHBondContact O-CB 3.44Å; D304-L307 PolarHBondContact O-N 3.21Å; D304-K308 WeakPolarHBondContact O-CG 3.4Å; D304-K308 PolarHBondContact O-N 3.15Å; D304-F346 HydrophobicContact CB-CE1 4.06Å; D304-F346 HydrophobicContact CB-CZ 3.9Å; D304-F346 WeakPolarHBondContact OD2-CE1 3.14Å; D304-F346 WeakPolarHBondContact OD2-CZ 3.46Å
305G83.3Confident90.9Very high58 Ų5853.4 Ų53.460%0.59831%0.307SS*.Hα-helixtrans-55.2-38.3-171.800000115.5
306Q84.3Confident90.9Very high163 Ų16356.2 Ų56.276%0.76233%0.33SS*.Hα-helixtrans-68.4-44.3175.9-67.2179.5-1.500111.2D304 K308 A309D304-Q306 VanDerWaalsContact C-N 3.33Å; D304-Q306 PolarHBondContact O-N 2.93Å; Q306-K308 VanDerWaalsContact C-N 3.3Å; Q306-K308 PolarHBondContact O-N 3.11Å; Q306-A309 PolarHBondContact O-N 3.27Å
307L88.9Confident91Very high5 Ų560.9 Ų60.93%0.02635%0.347CS..Hα-helixtrans-65.6-33.2178.6-169.163.5000111.9C303 D304 A309 E310 V311 M342 Y343 F346C303-L307 HydrophobicContact CB-CB 4.31Å; C303-L307 HydrophobicContact CB-CD2 4.06Å; C303-L307 HydrophobicContact CB-CG 4.28Å; D304-L307 CarbonylContact O-C 3.6Å; D304-L307 WeakPolarHBondContact O-CA 3.3Å; D304-L307 WeakPolarHBondContact O-CB 3.44Å; D304-L307 PolarHBondContact O-N 3.21Å; L307-A309 VanDerWaalsContact C-N 3.27Å; L307-A309 PolarHBondContact O-N 3.48Å; L307-E310 PolarHBondContact O-N 3.26Å; L307-V311 HydrophobicContact CD1-CG2 4.31Å; L307-V311 HydrophobicContact CG-CG2 4Å; L307-V311 WeakPolarHBondContact O-CB 3.36Å; L307-V311 VanDerWaalsContact O-CG2 3.22Å; L307-V311 WeakPolarHBondContact O-CG2 3.42Å; L307-V311 PolarHBondContact O-N 3.31Å; L307-M342 HydrophobicContact CD1-CG 3.68Å; L307-M342 HydrophobicContact CD1-SD 3.53Å; L307-M342 VanDerWaalsContact CD1-SD 3.53Å; L307-Y343 HydrophobicContact CD2-CD2 3.66Å; L307-Y343 HydrophobicContact CD2-CE2 4.19Å; L307-F346 HydrophobicContact CD2-CD1 4.09Å; L307-F346 HydrophobicContact CD2-CG 4.29Å
308K92.3Very high91.2Very high83 Ų8360.6 Ų60.636%0.36134%0.335SS..Hα-helixtrans-56-40.4176.6-72.1-176.3-163.2-153.40112.7L300 C303 D304 Q306 A312L300-K308 HydrophobicContact CD2-CB 3.79Å; L300-K308 HydrophobicContact CD2-CG 3.83Å; L300-K308 WeakPolarHBondContact CD2-O 3.43Å; L300-K308 WeakPolarHBondContact O-CE 3.49Å; L300-K308 PolarHBondContact O-NZ 3.05Å; C303-K308 HydrophobicContact CB-CG 4.03Å; C303-K308 WeakPolarHBondContact O-CE 3.17Å; D304-K308 WeakPolarHBondContact O-CG 3.4Å; D304-K308 PolarHBondContact O-N 3.15Å; Q306-K308 VanDerWaalsContact C-N 3.3Å; Q306-K308 PolarHBondContact O-N 3.11Å; K308-A312 VanDerWaalsContact O-CB 3.26Å; K308-A312 WeakPolarHBondContact O-CB 3.22Å; K308-A312 PolarHBondContact O-N 2.95Å
309A91.5Very high91.3Very high69 Ų6960.9 Ų60.957%0.5734%0.336SS*.Hα-helixtrans-65.7-44.4179.600000111.6Q306 L307 A312 H313Q306-A309 PolarHBondContact O-N 3.27Å; L307-A309 VanDerWaalsContact C-N 3.27Å; L307-A309 PolarHBondContact O-N 3.48Å; A309-A312 PolarHBondContact O-N 3.2Å; A309-H313 PolarHBondContact O-N 3.28Å
310E91.6Very high91.4Very high107 Ų10766.2 Ų66.250%0.536%0.361SS..Hα-helixtrans-67.5-43.4179.1-61.3-167.3168.200112L307 A312 H313 L314 M342L307-E310 PolarHBondContact O-N 3.26Å; E310-A312 VanDerWaalsContact C-N 3.35Å; E310-A312 PolarHBondContact O-N 3.04Å; E310-H313 PolarHBondContact O-N 2.65Å; E310-L314 WeakPolarHBondContact O-CG 3.41Å; E310-L314 PolarHBondContact O-N 3.2Å; E310-M342 HydrophobicContact CB-CE 3.83Å; E310-M342 HydrophobicContact CB-SD 3.96Å; E310-M342 VanDerWaalsContact OE2-CE 3.28Å; E310-M342 WeakPolarHBondContact OE2-CE 3.29Å
311V93.9Very high91.5Very high0 Ų069 Ų690%037%0.368CS..Hα-helixtrans-63.1-41.8177.6174.10000110.9L300 L307 L314 A315 F339 M342L300-V311 HydrophobicContact CD2-CB 4.08Å; L300-V311 HydrophobicContact CD2-CG1 4.01Å; L307-V311 HydrophobicContact CD1-CG2 4.31Å; L307-V311 HydrophobicContact CG-CG2 4Å; L307-V311 WeakPolarHBondContact O-CB 3.36Å; L307-V311 VanDerWaalsContact O-CG2 3.22Å; L307-V311 WeakPolarHBondContact O-CG2 3.42Å; L307-V311 PolarHBondContact O-N 3.31Å; V311-L314 PolarHBondContact O-N 3.15Å; V311-A315 VanDerWaalsContact O-CB 3.3Å; V311-A315 WeakPolarHBondContact O-CB 3.48Å; V311-A315 PolarHBondContact O-N 3.29Å; V311-F339 HydrophobicContact CG1-CD2 4Å; V311-F339 HydrophobicContact CG1-CE2 4.08Å; V311-F339 HydrophobicContact CG2-CD2 3.78Å; V311-F339 HydrophobicContact CG2-CE2 3.71Å; V311-M342 HydrophobicContact CG2-SD 4.24Å
312A93.9Very high91.7Very high44 Ų4464.3 Ų64.336%0.36434%0.343SS..Hα-helixtrans-62.8-41.9175.500000112K308 A309 E310 A315 A316K308-A312 VanDerWaalsContact O-CB 3.26Å; K308-A312 WeakPolarHBondContact O-CB 3.22Å; K308-A312 PolarHBondContact O-N 2.95Å; A309-A312 PolarHBondContact O-N 3.2Å; E310-A312 VanDerWaalsContact C-N 3.35Å; E310-A312 PolarHBondContact O-N 3.04Å; A312-A315 PolarHBondContact O-N 3.31Å; A312-A316 WeakPolarHBondContact O-CB 3.49Å; A312-A316 PolarHBondContact O-N 3.23Å
313H94.6Very high91.8Very high135 Ų13565.3 Ų65.363%0.62535%0.346SS*.Hα-helixtrans-64.7-44.8175.8-179.3-87.2000112A309 E310 A315 A316 Y317A309-H313 PolarHBondContact O-N 3.28Å; E310-H313 PolarHBondContact O-N 2.65Å; H313-A315 PolarHBondContact O-N 3.17Å; H313-A316 PolarHBondContact O-N 2.9Å; H313-Y317 WeakPolarHBondContact O-CB 3.36Å; H313-Y317 PolarHBondContact O-N 3.01Å
314L94.4Very high92Very high22 Ų2271.4 Ų71.412%0.11538%0.377CS..Hα-helixtrans-59.9-46.4175.4-75.9-179.6000111.6E310 V311 A316 Y317 Y318 F335 K338 M342E310-L314 WeakPolarHBondContact O-CG 3.41Å; E310-L314 PolarHBondContact O-N 3.2Å; V311-L314 PolarHBondContact O-N 3.15Å; L314-A316 VanDerWaalsContact C-N 3.34Å; L314-A316 PolarHBondContact O-N 2.99Å; L314-Y317 PolarHBondContact O-N 3.18Å; L314-Y318 HydrophobicContact CD2-CE2 4.28Å; L314-Y318 VanDerWaalsContact O-CD2 3.25Å; L314-Y318 WeakPolarHBondContact O-CD2 3.45Å; L314-Y318 PolarHBondContact O-N 3.21Å; L314-F335 HydrophobicContact CB-CD2 4.47Å; L314-F335 HydrophobicContact CB-CE2 4.32Å; L314-K338 HydrophobicContact CD1-CG 3.87Å; L314-K338 HydrophobicContact CD2-CG 4.02Å; L314-M342 HydrophobicContact CD1-CE 3.33Å; L314-M342 HydrophobicContact CD1-SD 3.95Å; L314-M342 HydrophobicContact CG-CE 4.15Å
315A95Very high92.2Very high8 Ų868.1 Ų68.17%0.06637%0.368CS..Hα-helixtrans-56.8-48.2177.400000111.8I292 V296 V311 A312 H313 Y317 Y318 E319 F335I292-A315 HydrophobicContact CG2-CB 4.47Å; V296-A315 HydrophobicContact CB-CB 4.4Å; V296-A315 HydrophobicContact CG1-CB 4.16Å; V296-A315 HydrophobicContact CG2-CB 3.37Å; V311-A315 VanDerWaalsContact O-CB 3.3Å; V311-A315 WeakPolarHBondContact O-CB 3.48Å; V311-A315 PolarHBondContact O-N 3.29Å; A312-A315 PolarHBondContact O-N 3.31Å; H313-A315 PolarHBondContact O-N 3.17Å; A315-Y317 VanDerWaalsContact C-N 3.33Å; A315-Y317 PolarHBondContact O-N 3.05Å; A315-Y318 PolarHBondContact O-N 2.95Å; A315-E319 VanDerWaalsContact O-CB 3.24Å; A315-E319 WeakPolarHBondContact O-CB 3.44Å; A315-E319 PolarHBondContact O-N 2.8Å; A315-F335 HydrophobicContact CB-CE2 3.91Å; A315-F335 HydrophobicContact CB-CZ 4.22Å
316A95.1Very high92.4Very high61 Ų6171.2 Ų71.250%0.50438%0.38SS..Hα-helixtrans-61.4-41.7177.400000112A312 H313 L314 H320A312-A316 WeakPolarHBondContact O-CB 3.49Å; A312-A316 PolarHBondContact O-N 3.23Å; H313-A316 PolarHBondContact O-N 2.9Å; L314-A316 VanDerWaalsContact C-N 3.34Å; L314-A316 PolarHBondContact O-N 2.99Å; A316-H320 WeakPolarHBondContact O-CB 3.36Å; A316-H320 PolarHBondContact O-N 3.19Å
317Y96Very high92.8Very high114 Ų11468.7 Ų68.745%0.44737%0.366SS..Hα-helixtrans-62.9-48.9177.5173.7-105.3000112.4H313 L314 A315 H320 R321H313-Y317 WeakPolarHBondContact O-CB 3.36Å; H313-Y317 PolarHBondContact O-N 3.01Å; L314-Y317 PolarHBondContact O-N 3.18Å; A315-Y317 VanDerWaalsContact C-N 3.33Å; A315-Y317 PolarHBondContact O-N 3.05Å; Y317-H320 PolarHBondContact O-N 3.22Å; Y317-R321 HydrophobicContact CE2-CG 4.37Å; Y317-R321 WeakPolarHBondContact O-CG 3.48Å; Y317-R321 PolarHBondContact O-N 3.45Å; Y317-R321 VanDerWaalsContact O-N 3.12Å
318Y95.8Very high93.1Very high31 Ų3169.4 Ų69.412%0.12237%0.373CS..Hα-helixtrans-71.3-34.6-179.6-78.6-77000112.7L314 A315 R321 L322 A334 F335 K338L314-Y318 HydrophobicContact CD2-CE2 4.28Å; L314-Y318 VanDerWaalsContact O-CD2 3.25Å; L314-Y318 WeakPolarHBondContact O-CD2 3.45Å; L314-Y318 PolarHBondContact O-N 3.21Å; A315-Y318 PolarHBondContact O-N 2.95Å; Y318-R321 PolarHBondContact O-N 3.17Å; Y318-L322 WeakPolarHBondContact O-CB 3.32Å; Y318-L322 PolarHBondContact O-N 3.07Å; Y318-A334 HydrophobicContact CD1-CB 4.21Å; Y318-A334 HydrophobicContact CE1-CB 3.57Å; Y318-F335 HydrophobicContact CD1-CB 4.31Å; Y318-F335 HydrophobicContact CD2-CB 3.84Å; Y318-F335 AromaticContact CD2-CD2 3.89Å; Y318-F335 HydrophobicContact CD2-CD2 3.89Å; Y318-F335 HydrophobicContact CD2-CG 4.36Å; Y318-F335 HydrophobicContact CE2-CB 4.46Å; Y318-F335 HydrophobicContact CG-CB 3.76Å; Y318-F335 HydrophobicContact CG-CD2 4.45Å; Y318-K338 HydrophobicContact CE2-CB 4.13Å; Y318-K338 HydrophobicContact CE2-CG 4.35Å
319E94.9Very high93.2Very high50 Ų5066 Ų6623%0.23436%0.359CS..Hα-helixtrans-61.4-45.5172-168.4-79.8154.800111I292 A315 R321 L322 Q323I292-E319 HydrophobicContact CD1-CB 4Å; I292-E319 HydrophobicContact CD1-CG 4.32Å; I292-E319 HydrophobicContact CG2-CB 4.36Å; A315-E319 VanDerWaalsContact O-CB 3.24Å; A315-E319 WeakPolarHBondContact O-CB 3.44Å; A315-E319 PolarHBondContact O-N 2.8Å; E319-R321 PolarHBondContact O-N 3.45Å; E319-L322 WeakPolarHBondContact O-CB 3.41Å; E319-L322 PolarHBondContact O-N 3.36Å; E319-L322 VanDerWaalsContact O-N 3.13Å; E319-Q323 WeakPolarHBondContact O-CG 3.31Å; E319-Q323 PolarHBondContact O-N 3.4Å; E319-Q323 PolarHBondContact OE1-NE2 3.02Å
320H94Very high93.4Very high112 Ų11268.6 Ų68.652%0.51936%0.355SS..Hα-helixtrans-59.4-45.7176.5179.762.1000112A316 Y317 L322 Q323A316-H320 WeakPolarHBondContact O-CB 3.36Å; A316-H320 PolarHBondContact O-N 3.19Å; Y317-H320 PolarHBondContact O-N 3.22Å; H320-L322 VanDerWaalsContact C-N 3.3Å; H320-L322 PolarHBondContact O-N 3.34Å; H320-Q323 PolarHBondContact O-N 3.36Å
321R94.3Very high93.6Very high98 Ų9864.6 Ų64.637%0.3734%0.336SS..Hα-helixtrans-66.4-32.5176.8-60.8-150.3-35162.716112.8Y317 Y318 E319 Q323 L324 G325 H331Y317-R321 HydrophobicContact CE2-CG 4.37Å; Y317-R321 WeakPolarHBondContact O-CG 3.48Å; Y317-R321 PolarHBondContact O-N 3.45Å; Y317-R321 VanDerWaalsContact O-N 3.12Å; Y318-R321 PolarHBondContact O-N 3.17Å; E319-R321 PolarHBondContact O-N 3.45Å; R321-Q323 PolarHBondContact O-N 3.09Å; R321-L324 PolarHBondContact O-N 3.22Å; R321-L324 VanDerWaalsContact O-N 3.12Å; R321-G325 PolarHBondContact O-N 3.38Å; R321-H331 PolarHBondContact O-CE1 3.02Å
322L94.1Very high93.6Very high13 Ų1364.6 Ų64.67%0.06834%0.336CS..Hα-helixtrans-60-38.8177.5-177.5147.5000111P288 I292 Y318 E319 H320 L324 G325 A328 H331 L332P288-L322 HydrophobicContact CB-CD1 3.53Å; P288-L322 HydrophobicContact CB-CD2 3.74Å; P288-L322 HydrophobicContact CB-CG 4.23Å; P288-L322 HydrophobicContact CG-CD2 4.26Å; I292-L322 HydrophobicContact CD1-CD1 3.84Å; Y318-L322 WeakPolarHBondContact O-CB 3.32Å; Y318-L322 PolarHBondContact O-N 3.07Å; E319-L322 WeakPolarHBondContact O-CB 3.41Å; E319-L322 PolarHBondContact O-N 3.36Å; E319-L322 VanDerWaalsContact O-N 3.13Å; H320-L322 VanDerWaalsContact C-N 3.3Å; H320-L322 PolarHBondContact O-N 3.34Å; L322-L324 VanDerWaalsContact C-N 3.25Å; L322-L324 PolarHBondContact O-N 3.05Å; L322-G325 PolarHBondContact O-N 3.31Å; L322-A328 HydrophobicContact CD1-CB 4.07Å; L322-A328 HydrophobicContact CG-CB 4.34Å; L322-H331 HydrophobicContact CB-CB 3.9Å; L322-H331 HydrophobicContact CD1-CB 4.16Å; L322-H331 HydrophobicContact CG-CB 4.3Å; L322-L332 HydrophobicContact CD1-CD2 3.92Å; L322-L332 HydrophobicContact CD1-CG 4.03Å
323Q88.9Confident93.8Very high88 Ų8864.4 Ų64.441%0.41133%0.328SS..Hα-helixtrans-68.3-23.1177.7-59.2-67.6-24.100113.3E319 H320 R321E319-Q323 WeakPolarHBondContact O-CG 3.31Å; E319-Q323 PolarHBondContact O-N 3.4Å; E319-Q323 PolarHBondContact OE1-NE2 3.02Å; H320-Q323 PolarHBondContact O-N 3.36Å; R321-Q323 PolarHBondContact O-N 3.09Å
324L89.9Confident93.8Very high136 Ų13659.4 Ų59.471%0.71231%0.31SS*.Hα-helixtrans-89.9-23.2177.9-60.8175.3000112.5R321 L322R321-L324 PolarHBondContact O-N 3.22Å; R321-L324 VanDerWaalsContact O-N 3.12Å; L322-L324 VanDerWaalsContact C-N 3.25Å; L322-L324 PolarHBondContact O-N 3.05Å
325G89.6Confident93.9Very high34 Ų3458.4 Ų58.435%0.35131%0.305SS..  trans-87.4161.3-178.800000113.4R321 L322R321-G325 PolarHBondContact O-N 3.38Å; L322-G325 PolarHBondContact O-N 3.31Å
326S87.8Confident93.9Very high122 Ų12258 Ų5885%0.85330%0.302SS*.SBendtrans-90.8-32.7174.156.50000113.1
327K93.2Very high94Very high110 Ų11057 Ų5748%0.47829%0.293SS..  trans-106.596.5-176.8-68-177.5-179.1-176.60110.6I329 Y330 H331K327-I329 VanDerWaalsContact C-N 3.25Å; K327-I329 PolarHBondContact O-N 3.19Å; K327-Y330 HydrophobicContact CB-CD2 3.91Å; K327-Y330 HydrophobicContact CB-CE2 4.06Å; K327-Y330 HydrophobicContact CB-CG 4.26Å; K327-Y330 HydrophobicContact CD-CD2 4.12Å; K327-Y330 HydrophobicContact CD-CE1 4.3Å; K327-Y330 HydrophobicContact CD-CE2 3.38Å; K327-Y330 VanDerWaalsContact CD-CZ 3.47Å; K327-Y330 WeakPolarHBondContact CD-OH 3.31Å; K327-Y330 HydrophobicContact CG-CE2 4.33Å; K327-Y330 PolarHBondContact NZ-OH 3.32Å; K327-Y330 PolarHBondContact O-N 3.36Å; K327-H331 PolarHBondContact O-CD2 3.07Å
328A93.6Very high93.9Very high21 Ų2156.4 Ų56.417%0.17429%0.293CS..Hα-helixtrans-53.1-39.918000000113.6L282 P288 L322 Y330 H331 L332L282-A328 HydrophobicContact CD2-CB 4.32Å; P288-A328 HydrophobicContact CB-CB 3.84Å; P288-A328 HydrophobicContact CG-CB 3.46Å; P288-A328 VanDerWaalsContact CG-CB 3.46Å; L322-A328 HydrophobicContact CD1-CB 4.07Å; L322-A328 HydrophobicContact CG-CB 4.34Å; A328-Y330 VanDerWaalsContact C-N 3.28Å; A328-Y330 PolarHBondContact O-N 3.32Å; A328-H331 PolarHBondContact O-N 3.1Å; A328-L332 WeakPolarHBondContact O-CG 3.27Å; A328-L332 PolarHBondContact O-N 3.22Å; A328-L332 VanDerWaalsContact O-N 3.09Å
329I94.8Very high93.9Very high12 Ų1255 Ų556%0.06229%0.287CS..Hα-helixtrans-55.9-38.2-176.6-173.860.4000113.5R275 L278 Y279 L282 K327 H331 L332 E333R275-I329 HydrophobicContact CG-CD1 4.38Å; L278-I329 HydrophobicContact CB-CD1 3.7Å; L278-I329 HydrophobicContact CD1-CD1 3.98Å; Y279-I329 HydrophobicContact CD2-CD1 4.45Å; Y279-I329 HydrophobicContact CE1-CB 4.41Å; Y279-I329 HydrophobicContact CE1-CG1 4.07Å; Y279-I329 HydrophobicContact CE1-CG2 4.37Å; Y279-I329 HydrophobicContact CE2-CD1 4.42Å; Y279-I329 HydrophobicContact CE2-CG1 4.09Å; L282-I329 HydrophobicContact CD1-CB 3.95Å; L282-I329 HydrophobicContact CD1-CD1 4.19Å; K327-I329 VanDerWaalsContact C-N 3.25Å; K327-I329 PolarHBondContact O-N 3.19Å; I329-H331 VanDerWaalsContact C-N 3.27Å; I329-H331 PolarHBondContact O-N 3.27Å; I329-L332 PolarHBondContact O-N 2.77Å; I329-E333 VanDerWaalsContact O-CB 3.3Å; I329-E333 WeakPolarHBondContact O-CB 3.06Å; I329-E333 PolarHBondContact O-N 2.79Å
330Y95.3Very high93.9Very high122 Ų12253 Ų5348%0.47828%0.278SS..Hα-helixtrans-65.1-34.5-179.3-63.4-14.5000112.1K327 A328 A334K327-Y330 HydrophobicContact CB-CD2 3.91Å; K327-Y330 HydrophobicContact CB-CE2 4.06Å; K327-Y330 HydrophobicContact CB-CG 4.26Å; K327-Y330 HydrophobicContact CD-CD2 4.12Å; K327-Y330 HydrophobicContact CD-CE1 4.3Å; K327-Y330 HydrophobicContact CD-CE2 3.38Å; K327-Y330 VanDerWaalsContact CD-CZ 3.47Å; K327-Y330 WeakPolarHBondContact CD-OH 3.31Å; K327-Y330 HydrophobicContact CG-CE2 4.33Å; K327-Y330 PolarHBondContact NZ-OH 3.32Å; K327-Y330 PolarHBondContact O-N 3.36Å; A328-Y330 VanDerWaalsContact C-N 3.28Å; A328-Y330 PolarHBondContact O-N 3.32Å; Y330-A334 WeakPolarHBondContact O-CB 3.35Å; Y330-A334 PolarHBondContact O-N 2.68Å; Y330-A334 VanDerWaalsContact O-N 3.16Å
331H95.9Very high93.9Very high23 Ų2350.7 Ų50.711%0.10628%0.278CS..Hα-helixtrans-78.3-38.3179.1-59.8-86.2000111.4R321 L322 K327 A328 I329 F335R321-H331 PolarHBondContact O-CE1 3.02Å; L322-H331 HydrophobicContact CB-CB 3.9Å; L322-H331 HydrophobicContact CD1-CB 4.16Å; L322-H331 HydrophobicContact CG-CB 4.3Å; K327-H331 PolarHBondContact O-CD2 3.07Å; A328-H331 PolarHBondContact O-N 3.1Å; I329-H331 VanDerWaalsContact C-N 3.27Å; I329-H331 PolarHBondContact O-N 3.27Å; H331-F335 WeakPolarHBondContact O-CB 3.22Å; H331-F335 PolarHBondContact O-N 3.32Å
332L95.6Very high93.7Very high1 Ų147.8 Ų47.81%0.00527%0.269CS..Hα-helixtrans-64.6-50.1175.7-64175.7000111.7L278 L282 P288 I291 I292 L322 A328 I329 A334 F335 I336L278-L332 HydrophobicContact CD1-CB 3.71Å; L278-L332 HydrophobicContact CD2-CD1 4.48Å; L282-L332 HydrophobicContact CD1-CD1 4.14Å; L282-L332 HydrophobicContact CD2-CD1 4.21Å; L282-L332 HydrophobicContact CG-CD1 4.38Å; P288-L332 HydrophobicContact CB-CD1 4.45Å; I291-L332 HydrophobicContact CD1-CD1 4.49Å; I291-L332 HydrophobicContact CG2-CD1 4.39Å; I291-L332 HydrophobicContact CG2-CD2 4.35Å; I292-L332 HydrophobicContact CD1-CD2 3.7Å; I292-L332 HydrophobicContact CG1-CD2 3.23Å; L322-L332 HydrophobicContact CD1-CD2 3.92Å; L322-L332 HydrophobicContact CD1-CG 4.03Å; A328-L332 WeakPolarHBondContact O-CG 3.27Å; A328-L332 PolarHBondContact O-N 3.22Å; A328-L332 VanDerWaalsContact O-N 3.09Å; I329-L332 PolarHBondContact O-N 2.77Å; L332-A334 VanDerWaalsContact C-N 3.34Å; L332-A334 PolarHBondContact O-N 2.74Å; L332-F335 WeakPolarHBondContact O-CB 3.35Å; L332-F335 PolarHBondContact O-N 3.08Å; L332-I336 WeakPolarHBondContact O-CG1 3.49Å; L332-I336 PolarHBondContact O-N 3.39Å; L332-I336 VanDerWaalsContact O-N 3.08Å
333E96.3Very high93.6Very high39 Ų3948.6 Ų48.618%0.18227%0.272CS..Hα-helixtrans-62.3-42.2178.3-175.5178.5178.300111.1R275 I329 F335 I336 A337R275-E333 WeakPolarHBondContact CD-OE1 3.3Å; R275-E333 WeakPolarHBondContact CD-OE2 3.5Å; R275-E333 IonicContact CZ-OE1 2.72Å; R275-E333 IonicContact CZ-OE2 3.61Å; R275-E333 VanDerWaalsContact CZ-OE2 3.27Å; R275-E333 IonicContact NE-OE1 3.82Å; R275-E333 IonicContact NE-OE2 3.44Å; R275-E333 PolarHBondContact NE-OE2 2.89Å; R275-E333 IonicContact NH1-OE1 2.62Å; R275-E333 PolarHBondContact NH1-OE1 2.82Å; R275-E333 IonicContact NH1-OE2 3.88Å; R275-E333 PolarHBondContact NH1-OE2 2.85Å; R275-E333 VanDerWaalsContact NH1-OE2 3.14Å; I329-E333 VanDerWaalsContact O-CB 3.3Å; I329-E333 WeakPolarHBondContact O-CB 3.06Å; I329-E333 PolarHBondContact O-N 2.79Å; E333-F335 PolarHBondContact O-N 3.22Å; E333-I336 PolarHBondContact O-N 2.96Å; E333-A337 WeakPolarHBondContact O-CB 3.4Å; E333-A337 PolarHBondContact O-N 2.89Å
334A95.7Very high93.7Very high31 Ų3148.8 Ų48.826%0.25627%0.271SS..Hα-helixtrans-64.6-3817700000112.9Y318 Y330 L332 K338Y318-A334 HydrophobicContact CD1-CB 4.21Å; Y318-A334 HydrophobicContact CE1-CB 3.57Å; Y330-A334 WeakPolarHBondContact O-CB 3.35Å; Y330-A334 PolarHBondContact O-N 2.68Å; Y330-A334 VanDerWaalsContact O-N 3.16Å; L332-A334 VanDerWaalsContact C-N 3.34Å; L332-A334 PolarHBondContact O-N 2.74Å; A334-K338 WeakPolarHBondContact O-CB 3.27Å; A334-K338 PolarHBondContact O-N 2.96Å
335F96.4Very high93.8Very high0 Ų048.3 Ų48.30%026%0.263CS..Hα-helixtrans-60.3-48.7173.3166.2-110.9000111V296 L299 L314 A315 Y318 H331 L332 E333 K338 F339V296-F335 HydrophobicContact CG2-CE1 4.12Å; V296-F335 HydrophobicContact CG2-CE2 4.49Å; V296-F335 HydrophobicContact CG2-CZ 3.66Å; L299-F335 HydrophobicContact CD1-CE1 4.22Å; L299-F335 HydrophobicContact CD1-CZ 4.3Å; L314-F335 HydrophobicContact CB-CD2 4.47Å; L314-F335 HydrophobicContact CB-CE2 4.32Å; A315-F335 HydrophobicContact CB-CE2 3.91Å; A315-F335 HydrophobicContact CB-CZ 4.22Å; Y318-F335 HydrophobicContact CD1-CB 4.31Å; Y318-F335 HydrophobicContact CD2-CB 3.84Å; Y318-F335 AromaticContact CD2-CD2 3.89Å; Y318-F335 HydrophobicContact CD2-CD2 3.89Å; Y318-F335 HydrophobicContact CD2-CG 4.36Å; Y318-F335 HydrophobicContact CE2-CB 4.46Å; Y318-F335 HydrophobicContact CG-CB 3.76Å; Y318-F335 HydrophobicContact CG-CD2 4.45Å; H331-F335 WeakPolarHBondContact O-CB 3.22Å; H331-F335 PolarHBondContact O-N 3.32Å; L332-F335 WeakPolarHBondContact O-CB 3.35Å; L332-F335 PolarHBondContact O-N 3.08Å; E333-F335 PolarHBondContact O-N 3.22Å; F335-K338 PolarHBondContact O-N 3.05Å; F335-F339 WeakPolarHBondContact O-CB 3.41Å; F335-F339 PolarHBondContact O-N 2.84Å
336I95.6Very high93.7Very high1 Ų150 Ų501%0.00526%0.261CS..Hα-helixtrans-66.1-43.7-178.7-63.8174.4000111.3I262 L271 V274 L278 L295 L332 E333 K338 F339 M340I262-I336 HydrophobicContact CD1-CD1 3.83Å; I262-I336 HydrophobicContact CD1-CG1 4.07Å; I262-I336 HydrophobicContact CD1-CG2 3.91Å; I262-I336 HydrophobicContact CG1-CG2 3.95Å; I262-I336 HydrophobicContact CG2-CG2 4.15Å; L271-I336 HydrophobicContact CD1-CB 4.29Å; L271-I336 HydrophobicContact CD1-CG2 3.81Å; V274-I336 HydrophobicContact CG1-CD1 3.53Å; V274-I336 HydrophobicContact CG1-CG2 4.14Å; L278-I336 HydrophobicContact CD1-CD1 3.63Å; L278-I336 HydrophobicContact CD2-CD1 4.16Å; L278-I336 HydrophobicContact CG-CD1 4.16Å; L295-I336 HydrophobicContact CD1-CD1 4.23Å; L332-I336 WeakPolarHBondContact O-CG1 3.49Å; L332-I336 PolarHBondContact O-N 3.39Å; L332-I336 VanDerWaalsContact O-N 3.08Å; E333-I336 PolarHBondContact O-N 2.96Å; I336-K338 VanDerWaalsContact C-N 3.28Å; I336-K338 PolarHBondContact O-N 2.89Å; I336-F339 WeakPolarHBondContact O-CB 3.4Å; I336-F339 PolarHBondContact O-N 3.34Å; I336-M340 HydrophobicContact CG2-CE 3.84Å; I336-M340 HydrophobicContact CG2-CG 4.27Å; I336-M340 HydrophobicContact CG2-SD 4.15Å; I336-M340 WeakPolarHBondContact O-CB 3.42Å; I336-M340 WeakPolarHBondContact O-CG 3.37Å; I336-M340 PolarHBondContact O-N 3.19Å
337A95.9Very high93.6Very high38 Ų3848.1 Ų48.131%0.31424%0.24SC..Hα-helixtrans-59.6-41.1176.700000111.6L271 E333 A341L271-A337 HydrophobicContact CD1-CB 4.35Å; L271-A337 HydrophobicContact CD2-CB 3.86Å; E333-A337 WeakPolarHBondContact O-CB 3.4Å; E333-A337 PolarHBondContact O-N 2.89Å; A337-A341 WeakPolarHBondContact O-CB 3.46Å; A337-A341 PolarHBondContact O-N 3.49Å; A337-A341 VanDerWaalsContact O-N 3.1Å
338K95.3Very high93.4Very high103 Ų10347.5 Ų47.545%0.44824%0.239SC..Hα-helixtrans-68.5-40.9177.1-17162176.1177.30111.9L314 Y318 A334 F335 I336 M342L314-K338 HydrophobicContact CD1-CG 3.87Å; L314-K338 HydrophobicContact CD2-CG 4.02Å; Y318-K338 HydrophobicContact CE2-CB 4.13Å; Y318-K338 HydrophobicContact CE2-CG 4.35Å; A334-K338 WeakPolarHBondContact O-CB 3.27Å; A334-K338 PolarHBondContact O-N 2.96Å; F335-K338 PolarHBondContact O-N 3.05Å; I336-K338 VanDerWaalsContact C-N 3.28Å; I336-K338 PolarHBondContact O-N 2.89Å; K338-M342 WeakPolarHBondContact O-CB 3.39Å; K338-M342 PolarHBondContact O-N 3.42Å; K338-M342 VanDerWaalsContact O-N 3.1Å
339F94.9Very high92.9Very high1 Ų150.7 Ų50.70%0.00425%0.253CS..Hα-helixtrans-59.7-50.6173.4174.4-92.5000111.3I262 L299 V311 F335 I336 A341 M342 Y343I262-F339 HydrophobicContact CG2-CD1 3.54Å; I262-F339 HydrophobicContact CG2-CE1 3.66Å; L299-F339 HydrophobicContact CB-CE2 4.2Å; L299-F339 HydrophobicContact CB-CZ 4.19Å; L299-F339 HydrophobicContact CD1-CD1 4.23Å; L299-F339 HydrophobicContact CD1-CD2 4.19Å; L299-F339 HydrophobicContact CD1-CE1 4.24Å; L299-F339 HydrophobicContact CD1-CE2 4.19Å; L299-F339 HydrophobicContact CD1-CG 4.22Å; L299-F339 HydrophobicContact CD1-CZ 4.23Å; L299-F339 HydrophobicContact CD2-CD1 4.42Å; L299-F339 HydrophobicContact CD2-CE1 3.74Å; L299-F339 HydrophobicContact CD2-CE2 4.5Å; L299-F339 HydrophobicContact CD2-CZ 3.79Å; L299-F339 HydrophobicContact CG-CE1 4.49Å; L299-F339 HydrophobicContact CG-CZ 4.28Å; V311-F339 HydrophobicContact CG1-CD2 4Å; V311-F339 HydrophobicContact CG1-CE2 4.08Å; V311-F339 HydrophobicContact CG2-CD2 3.78Å; V311-F339 HydrophobicContact CG2-CE2 3.71Å; F335-F339 WeakPolarHBondContact O-CB 3.41Å; F335-F339 PolarHBondContact O-N 2.84Å; I336-F339 WeakPolarHBondContact O-CB 3.4Å; I336-F339 PolarHBondContact O-N 3.34Å; F339-A341 VanDerWaalsContact C-N 3.33Å; F339-A341 PolarHBondContact O-N 3.43Å; F339-M342 PolarHBondContact O-N 3.22Å; F339-Y343 HydrophobicContact CE1-CD2 4.34Å; F339-Y343 HydrophobicContact CE1-CG 4.2Å; F339-Y343 HydrophobicContact CE2-CD2 4.4Å; F339-Y343 AromaticContact CZ-CD2 3.77Å; F339-Y343 HydrophobicContact CZ-CD2 3.77Å; F339-Y343 HydrophobicContact CZ-CE2 4.5Å; F339-Y343 HydrophobicContact CZ-CG 4.08Å; F339-Y343 VanDerWaalsContact O-CB 3.27Å; F339-Y343 WeakPolarHBondContact O-CB 3.19Å; F339-Y343 PolarHBondContact O-N 2.89Å
340M94.5Very high92.1Very high9 Ų951.7 Ų51.74%0.04427%0.266CS..Hα-helixtrans-58.2-43.3179.8-75.1-179.9169.900112.2I262 Q266 R270 L271 V274 I336 K344I262-M340 HydrophobicContact CB-CE 4.16Å; I262-M340 HydrophobicContact CG1-CE 4.06Å; I262-M340 HydrophobicContact CG2-CE 3.92Å; I262-M340 HydrophobicContact CG2-CG 4.05Å; Q266-M340 HydrophobicContact CB-CB 4.29Å; Q266-M340 HydrophobicContact CG-CB 4.23Å; Q266-M340 HydrophobicContact CG-CG 4.42Å; R270-M340 HydrophobicContact CG-CE 4.21Å; L271-M340 HydrophobicContact CB-SD 4.11Å; L271-M340 HydrophobicContact CD1-CE 4.49Å; L271-M340 HydrophobicContact CD1-SD 4.05Å; V274-M340 HydrophobicContact CG2-CE 4.25Å; I336-M340 HydrophobicContact CG2-CE 3.84Å; I336-M340 HydrophobicContact CG2-CG 4.27Å; I336-M340 HydrophobicContact CG2-SD 4.15Å; I336-M340 WeakPolarHBondContact O-CB 3.42Å; I336-M340 WeakPolarHBondContact O-CG 3.37Å; I336-M340 PolarHBondContact O-N 3.19Å; M340-K344 WeakPolarHBondContact O-CB 3.42Å; M340-K344 PolarHBondContact O-N 3.39Å
341A93.9Very high90.9Very high62 Ų6250.7 Ų50.751%0.51227%0.268SS..Hα-helixtrans-64.7-40.8178.100000112.5A337 F339 K345A337-A341 WeakPolarHBondContact O-CB 3.46Å; A337-A341 PolarHBondContact O-N 3.49Å; A337-A341 VanDerWaalsContact O-N 3.1Å; F339-A341 VanDerWaalsContact C-N 3.33Å; F339-A341 PolarHBondContact O-N 3.43Å; A341-K345 WeakPolarHBondContact O-CB 3.46Å; A341-K345 PolarHBondContact O-N 3.33Å
342M91.5Very high89.5Confident38 Ų3853.9 Ų53.919%0.18729%0.286CS..Hα-helixtrans-69.7-48.1177.9178.3-167.7-84.300111.6L307 E310 V311 L314 K338 F339 K344 K345 F346L307-M342 HydrophobicContact CD1-CG 3.68Å; L307-M342 HydrophobicContact CD1-SD 3.53Å; L307-M342 VanDerWaalsContact CD1-SD 3.53Å; E310-M342 HydrophobicContact CB-CE 3.83Å; E310-M342 HydrophobicContact CB-SD 3.96Å; E310-M342 VanDerWaalsContact OE2-CE 3.28Å; E310-M342 WeakPolarHBondContact OE2-CE 3.29Å; V311-M342 HydrophobicContact CG2-SD 4.24Å; L314-M342 HydrophobicContact CD1-CE 3.33Å; L314-M342 HydrophobicContact CD1-SD 3.95Å; L314-M342 HydrophobicContact CG-CE 4.15Å; K338-M342 WeakPolarHBondContact O-CB 3.39Å; K338-M342 PolarHBondContact O-N 3.42Å; K338-M342 VanDerWaalsContact O-N 3.1Å; F339-M342 PolarHBondContact O-N 3.22Å; M342-K344 PolarHBondContact O-N 2.98Å; M342-K345 PolarHBondContact O-N 3.17Å; M342-F346 WeakPolarHBondContact O-CB 3.17Å; M342-F346 PolarHBondContact O-N 3.25Å
343Y91.5Very high87.9Confident30 Ų3057.3 Ų57.312%0.11831%0.314CS..Hα-helixtrans-62.5-42.7-179.3-171.8-94.5000111.4V263 Q266 L307 F339 F346 M347V263-Y343 HydrophobicContact CG1-CE1 4.28Å; Q266-Y343 HydrophobicContact CG-CD1 4.27Å; Q266-Y343 VanDerWaalsContact NE2-CD1 3.34Å; L307-Y343 HydrophobicContact CD2-CD2 3.66Å; L307-Y343 HydrophobicContact CD2-CE2 4.19Å; F339-Y343 HydrophobicContact CE1-CD2 4.34Å; F339-Y343 HydrophobicContact CE1-CG 4.2Å; F339-Y343 HydrophobicContact CE2-CD2 4.4Å; F339-Y343 AromaticContact CZ-CD2 3.77Å; F339-Y343 HydrophobicContact CZ-CD2 3.77Å; F339-Y343 HydrophobicContact CZ-CE2 4.5Å; F339-Y343 HydrophobicContact CZ-CG 4.08Å; F339-Y343 VanDerWaalsContact O-CB 3.27Å; F339-Y343 WeakPolarHBondContact O-CB 3.19Å; F339-Y343 PolarHBondContact O-N 2.89Å; Y343-F346 PolarHBondContact O-N 3.28Å; Y343-M347 HydrophobicContact CD1-CG 4.3Å; Y343-M347 HydrophobicContact CD1-SD 3.78Å; Y343-M347 HydrophobicContact CE1-CG 4.01Å; Y343-M347 HydrophobicContact CE1-SD 3.23Å; Y343-M347 WeakPolarHBondContact CE1-SD 3.43Å; Y343-M347 WeakPolarHBondContact O-CG 3.26Å; Y343-M347 PolarHBondContact O-N 2.94Å
344K91.6Very high86Confident91 Ų9163.4 Ų63.440%0.39635%0.345SS..Hα-helixtrans-60.6-48.1175-176.8174.1173.9174.20112Q266 M340 M342 F346 M347 E348Q266-K344 HydrophobicContact CB-CB 3.86Å; Q266-K344 HydrophobicContact CB-CD 4.08Å; Q266-K344 HydrophobicContact CB-CG 4.32Å; Q266-K344 HydrophobicContact CG-CB 4.04Å; M340-K344 WeakPolarHBondContact O-CB 3.42Å; M340-K344 PolarHBondContact O-N 3.39Å; M342-K344 PolarHBondContact O-N 2.98Å; K344-F346 VanDerWaalsContact C-N 3.31Å; K344-F346 PolarHBondContact O-N 3.12Å; K344-M347 PolarHBondContact O-N 3.1Å; K344-E348 WeakPolarHBondContact CE-OE1 3.48Å; K344-E348 IonicContact NZ-OE1 3.49Å; K344-E348 WeakPolarHBondContact O-CG 3.36Å; K344-E348 PolarHBondContact O-N 3.03Å
345K90.8Very high83.9Confident127 Ų12768.8 Ų68.855%0.55237%0.366SS*.Hα-helixtrans-59.8-43.8178.5-175.7179.7177.5-174.40111.4A341 M342 M347 E348 D349A341-K345 WeakPolarHBondContact O-CB 3.46Å; A341-K345 PolarHBondContact O-N 3.33Å; M342-K345 PolarHBondContact O-N 3.17Å; K345-M347 VanDerWaalsContact C-N 3.34Å; K345-M347 PolarHBondContact O-N 3.32Å; K345-E348 PolarHBondContact O-N 3.04Å; K345-D349 WeakPolarHBondContact CE-OD2 3.42Å; K345-D349 WeakPolarHBondContact O-CB 3.45Å; K345-D349 VanDerWaalsContact O-CG 3.23Å; K345-D349 PolarHBondContact O-N 3.34Å
346F88.4Confident81.4Confident70 Ų7080.1 Ų80.131%0.30742%0.416SS..Hα-helixtrans-62.1-41177.6-179-97.8000112.5D304 L307 M342 Y343 K344 G350D304-F346 HydrophobicContact CB-CE1 4.06Å; D304-F346 HydrophobicContact CB-CZ 3.9Å; D304-F346 WeakPolarHBondContact OD2-CE1 3.14Å; D304-F346 WeakPolarHBondContact OD2-CZ 3.46Å; L307-F346 HydrophobicContact CD2-CD1 4.09Å; L307-F346 HydrophobicContact CD2-CG 4.29Å; M342-F346 WeakPolarHBondContact O-CB 3.17Å; M342-F346 PolarHBondContact O-N 3.25Å; Y343-F346 PolarHBondContact O-N 3.28Å; K344-F346 VanDerWaalsContact C-N 3.31Å; K344-F346 PolarHBondContact O-N 3.12Å; F346-G350 PolarHBondContact O-N 3.09Å
347M86.2Confident80.7Confident82 Ų8284.1 Ų84.140%0.40444%0.437SS..Hα-helixtrans-65.6-41.2175.2-73.7-174.87000112.7Y343 K344 K345 G350 L351Y343-M347 HydrophobicContact CD1-CG 4.3Å; Y343-M347 HydrophobicContact CD1-SD 3.78Å; Y343-M347 HydrophobicContact CE1-CG 4.01Å; Y343-M347 HydrophobicContact CE1-SD 3.23Å; Y343-M347 WeakPolarHBondContact CE1-SD 3.43Å; Y343-M347 WeakPolarHBondContact O-CG 3.26Å; Y343-M347 PolarHBondContact O-N 2.94Å; K344-M347 PolarHBondContact O-N 3.1Å; K345-M347 VanDerWaalsContact C-N 3.34Å; K345-M347 PolarHBondContact O-N 3.32Å; M347-G350 PolarHBondContact O-N 3.31Å; M347-L351 WeakPolarHBondContact O-CB 3.31Å; M347-L351 WeakPolarHBondContact O-CD1 3.19Å; M347-L351 WeakPolarHBondContact O-CG 3.49Å; M347-L351 PolarHBondContact O-N 2.94Å
348E87.9Confident79.9Confident97 Ų9786.5 Ų86.545%0.45344%0.443SS..Hα-helixtrans-65-49.3177.2-72.4173.616900111K344 K345 G350 L351 D352K344-E348 WeakPolarHBondContact CE-OE1 3.48Å; K344-E348 IonicContact NZ-OE1 3.49Å; K344-E348 WeakPolarHBondContact O-CG 3.36Å; K344-E348 PolarHBondContact O-N 3.03Å; K345-E348 PolarHBondContact O-N 3.04Å; E348-G350 VanDerWaalsContact C-N 3.26Å; E348-G350 PolarHBondContact O-N 2.99Å; E348-L351 PolarHBondContact O-N 3.16Å; E348-D352 PolarHBondContact O-N 3.44Å
349D83.7Confident79Confident88 Ų8885.6 Ų85.647%0.47144%0.443SS..Hα-helixtrans-61.1-35.5177.6-67.8-16.5000111.6K345 A353K345-D349 WeakPolarHBondContact CE-OD2 3.42Å; K345-D349 WeakPolarHBondContact O-CB 3.45Å; K345-D349 VanDerWaalsContact O-CG 3.23Å; K345-D349 PolarHBondContact O-N 3.34Å; D349-A353 WeakPolarHBondContact O-CB 3.47Å; D349-A353 PolarHBondContact O-N 3.02Å; D349-A353 VanDerWaalsContact O-N 3.11Å
350G76.8Confident78.1Confident33 Ų3390.6 Ų90.634%0.3447%0.469SS..Hα-helixtrans-72.6-35.7176.300000114.1F346 M347 E348 A353 M354F346-G350 PolarHBondContact O-N 3.09Å; M347-G350 PolarHBondContact O-N 3.31Å; E348-G350 VanDerWaalsContact C-N 3.26Å; E348-G350 PolarHBondContact O-N 2.99Å; G350-A353 PolarHBondContact O-N 2.78Å; G350-M354 PolarHBondContact O-N 2.85Å
351L70.4Confident77.1Confident100 Ų10095.7 Ų95.752%0.52450%0.496SS..Hα-helixtrans-66.9-42.6173.5-82.2158000111.2M347 E348 A353 M354 M355M347-L351 WeakPolarHBondContact O-CB 3.31Å; M347-L351 WeakPolarHBondContact O-CD1 3.19Å; M347-L351 WeakPolarHBondContact O-CG 3.49Å; M347-L351 PolarHBondContact O-N 2.94Å; E348-L351 PolarHBondContact O-N 3.16Å; L351-A353 VanDerWaalsContact C-N 3.3Å; L351-A353 PolarHBondContact O-N 2.9Å; L351-M354 PolarHBondContact O-N 2.86Å; L351-M355 PolarHBondContact O-N 3.03Å
352D67Low76Confident90 Ų9097.9 Ų97.948%0.48149%0.494SS..Hα-helixtrans-63.3-38.5176.2-75.1-14.7000111.2E348 M354 M355 F356E348-D352 PolarHBondContact O-N 3.44Å; D352-M354 VanDerWaalsContact C-N 3.3Å; D352-M354 PolarHBondContact O-N 2.94Å; D352-M355 PolarHBondContact O-N 3.36Å; D352-F356 VanDerWaalsContact O-CD2 3.29Å; D352-F356 WeakPolarHBondContact O-CD2 3.41Å
353A61Low74.9Confident73 Ų73102.2 Ų102.260%0.60352%0.516SS*.Hα-helixtrans-70.3-18.4175.900000114.9D349 G350 L351D349-A353 WeakPolarHBondContact O-CB 3.47Å; D349-A353 PolarHBondContact O-N 3.02Å; D349-A353 VanDerWaalsContact O-N 3.11Å; G350-A353 PolarHBondContact O-N 2.78Å; L351-A353 VanDerWaalsContact C-N 3.3Å; L351-A353 PolarHBondContact O-N 2.9Å
354M56.6Low73.6Confident167 Ų167107.8 Ų107.882%0.82355%0.547SS*.Hα-helixtrans-93.4-15.5174.9-75.3-171.5-176.500113.5G350 L351 D352G350-M354 PolarHBondContact O-N 2.85Å; L351-M354 PolarHBondContact O-N 2.86Å; D352-M354 VanDerWaalsContact C-N 3.3Å; D352-M354 PolarHBondContact O-N 2.94Å
355M52.8Low72.1Confident144 Ų144109.2 Ų109.271%0.70956%0.56SS**  trans-89.4-4.6177.9-76-157.4-76.200113.9L351 D352L351-M355 PolarHBondContact O-N 3.03Å; D352-M355 PolarHBondContact O-N 3.36Å
356F43.3Very low70.4Confident239 Ų239107.5 Ų107.5100%1.04856%0.56SS**  trans-113.10167.5-67.7-74.7000110D352D352-F356 VanDerWaalsContact O-CD2 3.29Å; D352-F356 WeakPolarHBondContact O-CD2 3.41Å

Retrieved 356 of 356 residues in 483.4 ms (Link to these results)

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