A0A087YSH1_POEFO Loading...

LAS1 like ribosome biogenesis factor

AlphaFold DB , UniProt , Accession A0A087YSH1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 565 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
1S35.3Very low39.5Very low177 Ų177161.4 Ų161.4100%1.23886%0.863SS**  0107.30-70.40000111.4
2A32Very low41.7Very low103 Ų103167.6 Ų167.685%0.85187%0.866SS**  trans-98.8107.6171.800000108.9K4A2-K4 PolarHBondContact O-N 3.23Å; A2-K4 VanDerWaalsContact O-N 3.12Å
3M34.9Very low43.9Very low189 Ų189164 Ų16493%0.93184%0.842SS**  trans-69.1103.2172.4-76171.2113.200109.3K5M3-K5 PolarHBondContact O-N 3.13Å
4K35.9Very low46.4Very low206 Ų206159.7 Ų159.790%0.89683%0.827SS**  trans-70.3112.5164-95.5177.1172.4176.80108.2A2 S6A2-K4 PolarHBondContact O-N 3.23Å; A2-K4 VanDerWaalsContact O-N 3.12Å; K4-S6 PolarHBondContact O-N 3.3Å
5K39Very low48.9Very low208 Ų208153.5 Ų153.590%0.90480%0.799SS**  trans-66.9109.9163.4-78.6178.2172.91790108M3 S7M3-K5 PolarHBondContact O-N 3.13Å; K5-S7 PolarHBondContact O-N 2.88Å
6S34.1Very low51.1Low114 Ų114144.4 Ų144.480%0.79775%0.753SS**  trans-78.6108.2166.263.30000108.3K4 S8K4-S6 PolarHBondContact O-N 3.3Å; S6-S8 PolarHBondContact O-N 3.32Å
7S36.4Very low53.2Low101 Ų101138.9 Ų138.971%0.70672%0.72SS**  trans-69.8115.7156.652.20000106.7K5 E9K5-S7 PolarHBondContact O-N 2.88Å; S7-E9 VanDerWaalsContact C-N 3.26Å; S7-E9 PolarHBondContact O-N 3.1Å
8S39.3Very low55.1Low110 Ų110137.1 Ų137.177%0.76972%0.716SS**  trans-64.786.5172.460.50000109.4S6 K10S6-S8 PolarHBondContact O-N 3.32Å; S8-K10 PolarHBondContact O-N 3.27Å; S8-K10 VanDerWaalsContact O-N 3.13Å
9E42.5Very low56.7Low172 Ų172134.2 Ų134.280%0.80470%0.701SS**  trans-57.7116.2164.8-87.3-179.2149.800107.5S7 R11S7-E9 VanDerWaalsContact C-N 3.26Å; S7-E9 PolarHBondContact O-N 3.1Å; E9-R11 PolarHBondContact O-N 3.09Å
10K51Low58.2Low192 Ų192131.9 Ų131.984%0.83569%0.685SS**  trans-60.1103.5172.4-70.8-178.2178.8-179.10107.6S8 R12S8-K10 PolarHBondContact O-N 3.27Å; S8-K10 VanDerWaalsContact O-N 3.13Å; K10-R12 PolarHBondContact O-N 3.21Å; K10-R12 VanDerWaalsContact O-N 3.16Å
11R53.8Low59.6Low203 Ų203128.7 Ų128.777%0.76668%0.679SS**  trans-55.7119173.7-71.5-176.6-179.6177.52108.2E9E9-R11 PolarHBondContact O-N 3.09Å
12R66.4Low62.3Low236 Ų236121 Ų12189%0.89162%0.623SS**  trans-95113.7175.5-64.2-179.2-176.2-178.70.8107.3K10K10-R12 PolarHBondContact O-N 3.21Å; K10-R12 VanDerWaalsContact O-N 3.16Å
13H70.6Confident65Low121 Ų121116.3 Ų116.356%0.5658%0.583SS**  trans-92.1130.5176.1-66.3-95.9000109.8D168H13-D168 IonicContact CE1-OD2 3.77Å
14V78.1Confident67.6Low104 Ų104109.5 Ų109.563%0.6355%0.551SS**  trans-82.3132.8173.7-179.50000108.4Y52V14-Y52 HydrophobicContact CB-CE2 4.33Å; V14-Y52 HydrophobicContact CG1-CE2 3.77Å; V14-Y52 PolarHBondContact O-OH 2.89Å
15V83.6Confident70.3Confident66 Ų66103.1 Ų103.140%0.452%0.524SS..  trans-129157.1-176.7-64.20000111.4W17V15-W17 HydrophobicContact CB-CD2 3.88Å; V15-W17 HydrophobicContact CB-CE3 4.16Å; V15-W17 HydrophobicContact CB-CG 4.49Å; V15-W17 HydrophobicContact CB-CH2 3.97Å; V15-W17 HydrophobicContact CB-CZ2 3.67Å; V15-W17 HydrophobicContact CB-CZ3 4.18Å; V15-W17 HydrophobicContact CG1-CH2 3.81Å; V15-W17 HydrophobicContact CG1-CZ2 3.46Å; V15-W17 VanDerWaalsContact CG1-CZ2 3.46Å; V15-W17 HydrophobicContact CG1-CZ3 4.48Å; V15-W17 HydrophobicContact CG2-CD2 4.21Å; V15-W17 HydrophobicContact CG2-CG 4.34Å; V15-W17 HydrophobicContact CG2-CZ2 4.34Å
16A84.6Confident72.9Confident9 Ų993.2 Ų93.27%0.07448%0.481CS..SBendtrans-83.8-21.2-175.800000114.2W48 R51 Y52A16-W48 HydrophobicContact CB-CB 3.75Å; A16-W48 HydrophobicContact CB-CG 4.1Å; A16-R51 WeakPolarHBondContact O-CD 3.45Å; A16-R51 PolarHBondContact O-NH1 2.78Å; A16-Y52 HydrophobicContact CB-CD1 4.45Å; A16-Y52 HydrophobicContact CB-CG 4.19Å
17W87.1Confident75.7Confident50 Ų5088.4 Ų88.419%0.18945%0.446CS..SBendtrans-88.8150.3176.852.991.1000111.2V15 N19 E22 W23 W48V15-W17 HydrophobicContact CB-CD2 3.88Å; V15-W17 HydrophobicContact CB-CE3 4.16Å; V15-W17 HydrophobicContact CB-CG 4.49Å; V15-W17 HydrophobicContact CB-CH2 3.97Å; V15-W17 HydrophobicContact CB-CZ2 3.67Å; V15-W17 HydrophobicContact CB-CZ3 4.18Å; V15-W17 HydrophobicContact CG1-CH2 3.81Å; V15-W17 HydrophobicContact CG1-CZ2 3.46Å; V15-W17 VanDerWaalsContact CG1-CZ2 3.46Å; V15-W17 HydrophobicContact CG1-CZ3 4.48Å; V15-W17 HydrophobicContact CG2-CD2 4.21Å; V15-W17 HydrophobicContact CG2-CG 4.34Å; V15-W17 HydrophobicContact CG2-CZ2 4.34Å; W17-N19 VanDerWaalsContact CD1-O 3.3Å; W17-E22 VanDerWaalsContact CA-OE2 3.29Å; W17-E22 WeakPolarHBondContact CA-OE2 3.38Å; W17-E22 WeakPolarHBondContact CB-OE2 3.39Å; W17-W23 HydrophobicContact CD2-CB 4.38Å; W17-W23 HydrophobicContact CD2-CD2 4.21Å; W17-W23 AromaticContact CD2-CE3 3.44Å; W17-W23 HydrophobicContact CD2-CE3 3.44Å; W17-W23 VanDerWaalsContact CD2-CE3 3.44Å; W17-W23 HydrophobicContact CD2-CZ3 4.07Å; W17-W23 AromaticContact CE2-CE3 3.65Å; W17-W23 HydrophobicContact CE3-CD2 4.44Å; W17-W23 AromaticContact CE3-CE3 3.32Å; W17-W23 HydrophobicContact CE3-CE3 3.32Å; W17-W23 AromaticContact CE3-CZ3 3.48Å; W17-W23 HydrophobicContact CE3-CZ3 3.48Å; W17-W23 VanDerWaalsContact CE3-CZ3 3.48Å; W17-W23 HydrophobicContact CG-CB 4.1Å; W17-W23 HydrophobicContact CG-CE3 4.2Å; W17-W23 HydrophobicContact CH2-CD2 4.35Å; W17-W23 AromaticContact CH2-CE3 3.65Å; W17-W23 HydrophobicContact CH2-CE3 3.65Å; W17-W23 AromaticContact CH2-CH2 3.91Å; W17-W23 HydrophobicContact CH2-CH2 3.91Å; W17-W23 AromaticContact CH2-CZ3 3.42Å; W17-W23 HydrophobicContact CH2-CZ3 3.42Å; W17-W23 VanDerWaalsContact CH2-CZ3 3.42Å; W17-W23 HydrophobicContact CZ2-CD2 4.11Å; W17-W23 AromaticContact CZ2-CE3 3.75Å; W17-W23 HydrophobicContact CZ2-CE3 3.75Å; W17-W23 AromaticContact CZ2-CZ3 4Å; W17-W23 HydrophobicContact CZ2-CZ3 4Å; W17-W23 AromaticContact CZ3-CE3 3.45Å; W17-W23 HydrophobicContact CZ3-CE3 3.45Å; W17-W23 VanDerWaalsContact CZ3-CE3 3.45Å; W17-W23 HydrophobicContact CZ3-CH2 4.01Å; W17-W23 AromaticContact CZ3-CZ3 3.13Å; W17-W23 HydrophobicContact CZ3-CZ3 3.13Å; W17-W48 HydrophobicContact CB-CZ2 3.76Å
18V86.8Confident78.4Confident106 Ų10688.9 Ų88.964%0.64244%0.441SS*.SBendtrans-69.5-41.3-175.8177.40000111.1E22V18-E22 PolarHBondContact N-OE2 3.01Å
19N86.6Confident81.1Confident83 Ų8386.7 Ų86.744%0.44442%0.416SS..SBendtrans-158.5172-179.360.732000111.2W17 A21 E22 W23W17-N19 VanDerWaalsContact CD1-O 3.3Å; N19-A21 PolarHBondContact O-N 3.21Å; N19-A21 WeakPolarHBondContact OD1-CB 3.47Å; N19-A21 PolarHBondContact OD1-N 3.22Å; N19-E22 PolarHBondContact O-N 3.29Å; N19-E22 PolarHBondContact OD1-N 3.3Å; N19-W23 PolarHBondContact O-N 3.49Å
20K86.1Confident83.6Confident87 Ų8778.6 Ų78.638%0.37838%0.378SS..Hα-helixtrans-59.1-33.7179.5-176.955.5173.81600113E22 W23 D24 Q160 L161K20-E22 PolarHBondContact O-N 2.82Å; K20-W23 VanDerWaalsContact NZ-CD1 3.32Å; K20-W23 WeakPolarHBondContact O-CB 3.43Å; K20-W23 PolarHBondContact O-N 3.47Å; K20-D24 WeakPolarHBondContact CE-OD1 3.45Å; K20-D24 WeakPolarHBondContact CE-OD2 3.49Å; K20-D24 WeakPolarHBondContact CG-OD2 3.43Å; K20-D24 IonicContact NZ-OD1 3.11Å; K20-D24 PolarHBondContact NZ-OD1 3.45Å; K20-D24 VanDerWaalsContact O-CG 3.27Å; K20-D24 PolarHBondContact O-N 3.2Å; K20-Q160 PolarHBondContact NZ-O 3.38Å; K20-L161 VanDerWaalsContact NZ-CD2 3.27Å
21A88.3Confident85.7Confident66 Ų6672.1 Ų72.155%0.54535%0.349SS..Hα-helixtrans-65.6-39177.800000112.7N19 W23 Q25N19-A21 PolarHBondContact O-N 3.21Å; N19-A21 WeakPolarHBondContact OD1-CB 3.47Å; N19-A21 PolarHBondContact OD1-N 3.22Å; A21-W23 VanDerWaalsContact C-N 3.32Å; A21-Q25 WeakPolarHBondContact O-CB 3.29Å; A21-Q25 PolarHBondContact O-N 2.95Å
22E90.3Very high87.5Confident14 Ų1463.9 Ų63.97%0.06532%0.323CS..Hα-helixtrans-63.3-41.3173.1-174.8179.1-142.800111W17 V18 N19 K20 V26 R44 W48W17-E22 VanDerWaalsContact CA-OE2 3.29Å; W17-E22 WeakPolarHBondContact CA-OE2 3.38Å; W17-E22 WeakPolarHBondContact CB-OE2 3.39Å; V18-E22 PolarHBondContact N-OE2 3.01Å; N19-E22 PolarHBondContact O-N 3.29Å; N19-E22 PolarHBondContact OD1-N 3.3Å; K20-E22 PolarHBondContact O-N 2.82Å; E22-V26 VanDerWaalsContact O-CG2 3.31Å; E22-V26 WeakPolarHBondContact O-CG2 3.27Å; E22-V26 PolarHBondContact O-N 3.47Å; E22-V26 VanDerWaalsContact O-N 3.08Å; E22-R44 VanDerWaalsContact OE1-CD 3.29Å; E22-R44 WeakPolarHBondContact OE1-CD 3.48Å; E22-R44 IonicContact OE1-CZ 3.75Å; E22-R44 IonicContact OE1-NE 2.7Å; E22-R44 IonicContact OE1-NH1 2.82Å; E22-R44 PolarHBondContact OE1-NH1 2.95Å; E22-W48 HydrophobicContact CG-CZ2 4.24Å
23W89Confident88.7Confident5 Ų561.7 Ų61.72%0.01932%0.32CS..Hα-helixtrans-61.2-50.6176.7175.5-89.7000112.3W17 N19 K20 A21 Q25 V26 L27 W48 V60 Y156 W157W17-W23 HydrophobicContact CD2-CB 4.38Å; W17-W23 HydrophobicContact CD2-CD2 4.21Å; W17-W23 AromaticContact CD2-CE3 3.44Å; W17-W23 HydrophobicContact CD2-CE3 3.44Å; W17-W23 VanDerWaalsContact CD2-CE3 3.44Å; W17-W23 HydrophobicContact CD2-CZ3 4.07Å; W17-W23 AromaticContact CE2-CE3 3.65Å; W17-W23 HydrophobicContact CE3-CD2 4.44Å; W17-W23 AromaticContact CE3-CE3 3.32Å; W17-W23 HydrophobicContact CE3-CE3 3.32Å; W17-W23 AromaticContact CE3-CZ3 3.48Å; W17-W23 HydrophobicContact CE3-CZ3 3.48Å; W17-W23 VanDerWaalsContact CE3-CZ3 3.48Å; W17-W23 HydrophobicContact CG-CB 4.1Å; W17-W23 HydrophobicContact CG-CE3 4.2Å; W17-W23 HydrophobicContact CH2-CD2 4.35Å; W17-W23 AromaticContact CH2-CE3 3.65Å; W17-W23 HydrophobicContact CH2-CE3 3.65Å; W17-W23 AromaticContact CH2-CH2 3.91Å; W17-W23 HydrophobicContact CH2-CH2 3.91Å; W17-W23 AromaticContact CH2-CZ3 3.42Å; W17-W23 HydrophobicContact CH2-CZ3 3.42Å; W17-W23 VanDerWaalsContact CH2-CZ3 3.42Å; W17-W23 HydrophobicContact CZ2-CD2 4.11Å; W17-W23 AromaticContact CZ2-CE3 3.75Å; W17-W23 HydrophobicContact CZ2-CE3 3.75Å; W17-W23 AromaticContact CZ2-CZ3 4Å; W17-W23 HydrophobicContact CZ2-CZ3 4Å; W17-W23 AromaticContact CZ3-CE3 3.45Å; W17-W23 HydrophobicContact CZ3-CE3 3.45Å; W17-W23 VanDerWaalsContact CZ3-CE3 3.45Å; W17-W23 HydrophobicContact CZ3-CH2 4.01Å; W17-W23 AromaticContact CZ3-CZ3 3.13Å; W17-W23 HydrophobicContact CZ3-CZ3 3.13Å; N19-W23 PolarHBondContact O-N 3.49Å; K20-W23 VanDerWaalsContact NZ-CD1 3.32Å; K20-W23 WeakPolarHBondContact O-CB 3.43Å; K20-W23 PolarHBondContact O-N 3.47Å; A21-W23 VanDerWaalsContact C-N 3.32Å; W23-Q25 PolarHBondContact O-N 3.28Å; W23-V26 PolarHBondContact O-N 3.31Å; W23-L27 PolarHBondContact O-N 2.9Å; W23-W48 HydrophobicContact CD2-CH2 4.48Å; W23-W48 AromaticContact CE3-CH2 3.57Å; W23-W48 HydrophobicContact CE3-CH2 3.57Å; W23-W48 HydrophobicContact CE3-CZ2 4.42Å; W23-W48 AromaticContact CE3-CZ3 3.79Å; W23-W48 HydrophobicContact CE3-CZ3 3.79Å; W23-W48 HydrophobicContact CZ3-CH2 4.03Å; W23-W48 AromaticContact CZ3-CZ3 3.73Å; W23-W48 HydrophobicContact CZ3-CZ3 3.73Å; W23-V60 HydrophobicContact CH2-CG2 3.68Å; W23-V60 HydrophobicContact CZ3-CG2 3.99Å; W23-Y156 AromaticContact CH2-CE1 3.95Å; W23-Y156 HydrophobicContact CH2-CE1 3.95Å; W23-Y156 HydrophobicContact CZ2-CE1 4.11Å; W23-W157 AromaticContact CD2-CZ3 3.99Å; W23-W157 HydrophobicContact CD2-CZ3 3.99Å; W23-W157 AromaticContact CE2-CE3 3.72Å; W23-W157 AromaticContact CE2-CZ3 3.44Å; W23-W157 VanDerWaalsContact CE2-CZ3 3.44Å; W23-W157 HydrophobicContact CE3-CZ3 4.11Å; W23-W157 AromaticContact CH2-CE3 3.88Å; W23-W157 HydrophobicContact CH2-CE3 3.88Å; W23-W157 AromaticContact CH2-CH2 3.75Å; W23-W157 HydrophobicContact CH2-CH2 3.75Å; W23-W157 AromaticContact CH2-CZ3 3.29Å; W23-W157 HydrophobicContact CH2-CZ3 3.29Å; W23-W157 HydrophobicContact CZ2-CD2 4.37Å; W23-W157 AromaticContact CZ2-CE3 3.29Å; W23-W157 HydrophobicContact CZ2-CE3 3.29Å; W23-W157 HydrophobicContact CZ2-CH2 4.04Å; W23-W157 AromaticContact CZ2-CZ3 3.11Å; W23-W157 HydrophobicContact CZ2-CZ3 3.11Å; W23-W157 HydrophobicContact CZ3-CH2 4.08Å; W23-W157 AromaticContact CZ3-CZ3 3.78Å; W23-W157 HydrophobicContact CZ3-CZ3 3.78Å
24D89.8Confident89.8Confident47 Ų4759.2 Ų59.225%0.25131%0.311SS..Hα-helixtrans-65.3-39.5-178-63.3-24.9000111.2K20 V26 L27 D28 L161K20-D24 WeakPolarHBondContact CE-OD1 3.45Å; K20-D24 WeakPolarHBondContact CE-OD2 3.49Å; K20-D24 WeakPolarHBondContact CG-OD2 3.43Å; K20-D24 IonicContact NZ-OD1 3.11Å; K20-D24 PolarHBondContact NZ-OD1 3.45Å; K20-D24 VanDerWaalsContact O-CG 3.27Å; K20-D24 PolarHBondContact O-N 3.2Å; D24-V26 PolarHBondContact O-N 3.2Å; D24-L27 WeakPolarHBondContact O-CB 3.48Å; D24-L27 PolarHBondContact O-N 3.08Å; D24-D28 PolarHBondContact O-N 3.26Å; D24-L161 WeakPolarHBondContact OD1-CD2 3.35Å
25Q93.5Very high90.4Very high72 Ų7256.2 Ų56.234%0.33629%0.293SS..Hα-helixtrans-60.9-44.5174.3179.7178.16100112.3A21 W23 L27 D28 Y29A21-Q25 WeakPolarHBondContact O-CB 3.29Å; A21-Q25 PolarHBondContact O-N 2.95Å; W23-Q25 PolarHBondContact O-N 3.28Å; Q25-L27 VanDerWaalsContact C-N 3.35Å; Q25-D28 PolarHBondContact O-N 3.38Å; Q25-Y29 HydrophobicContact CG-CD1 4.42Å; Q25-Y29 HydrophobicContact CG-CD2 4.12Å; Q25-Y29 HydrophobicContact CG-CE1 4.08Å; Q25-Y29 HydrophobicContact CG-CE2 3.75Å; Q25-Y29 HydrophobicContact CG-CG 4.43Å; Q25-Y29 PolarHBondContact NE2-OH 3.28Å; Q25-Y29 WeakPolarHBondContact O-CB 3.37Å; Q25-Y29 WeakPolarHBondContact O-CD1 3.24Å; Q25-Y29 VanDerWaalsContact O-CG 3.28Å; Q25-Y29 PolarHBondContact O-N 2.93Å
26V93.1Very high90.9Very high0 Ų055.7 Ų55.70%030%0.296CS..Hα-helixtrans-65.7-41.3179.4169.70000110.7E22 W23 D24 Y29 L30 A41 R44 V45 W48E22-V26 VanDerWaalsContact O-CG2 3.31Å; E22-V26 WeakPolarHBondContact O-CG2 3.27Å; E22-V26 PolarHBondContact O-N 3.47Å; E22-V26 VanDerWaalsContact O-N 3.08Å; W23-V26 PolarHBondContact O-N 3.31Å; D24-V26 PolarHBondContact O-N 3.2Å; V26-Y29 PolarHBondContact O-N 2.78Å; V26-L30 HydrophobicContact CG1-CD1 3.84Å; V26-L30 HydrophobicContact CG1-CG 4.18Å; V26-L30 WeakPolarHBondContact O-CB 3.31Å; V26-L30 VanDerWaalsContact O-CG 3.24Å; V26-L30 WeakPolarHBondContact O-CG 3.25Å; V26-L30 PolarHBondContact O-N 3.4Å; V26-A41 HydrophobicContact CG1-CB 4.41Å; V26-R44 HydrophobicContact CG2-CB 3.82Å; V26-R44 HydrophobicContact CG2-CG 3.51Å; V26-V45 HydrophobicContact CG1-CG2 3.83Å; V26-W48 HydrophobicContact CB-CH2 3.56Å; V26-W48 HydrophobicContact CB-CZ2 3.94Å; V26-W48 HydrophobicContact CB-CZ3 4.41Å; V26-W48 HydrophobicContact CG1-CH2 3.51Å; V26-W48 HydrophobicContact CG1-CZ2 4.17Å; V26-W48 HydrophobicContact CG1-CZ3 3.86Å; V26-W48 HydrophobicContact CG2-CH2 3.81Å; V26-W48 HydrophobicContact CG2-CZ2 3.63Å
27L92.6Very high91.4Very high13 Ų1357.9 Ų57.97%0.06831%0.306CS..Hα-helixtrans-56.6-53.6174170.658.3000111.1W23 D24 Q25 Y29 L30 Y31 W157 L161W23-L27 PolarHBondContact O-N 2.9Å; D24-L27 WeakPolarHBondContact O-CB 3.48Å; D24-L27 PolarHBondContact O-N 3.08Å; Q25-L27 VanDerWaalsContact C-N 3.35Å; L27-Y29 VanDerWaalsContact C-N 3.26Å; L27-Y29 PolarHBondContact O-N 2.96Å; L27-L30 PolarHBondContact O-N 3.46Å; L27-Y31 HydrophobicContact CD1-CD2 3.62Å; L27-Y31 HydrophobicContact CD1-CE2 3.64Å; L27-Y31 WeakPolarHBondContact O-CD2 3.5Å; L27-Y31 PolarHBondContact O-N 3.04Å; L27-W157 HydrophobicContact CB-CE3 4.03Å; L27-W157 HydrophobicContact CB-CZ3 4.11Å; L27-W157 HydrophobicContact CD1-CB 3.69Å; L27-W157 HydrophobicContact CD1-CD2 3.58Å; L27-W157 HydrophobicContact CD1-CE3 3.63Å; L27-W157 HydrophobicContact CD1-CG 3.61Å; L27-W157 HydrophobicContact CD1-CZ3 4.34Å; L27-W157 HydrophobicContact CD2-CB 4.2Å; L27-W157 HydrophobicContact CD2-CE3 4.18Å; L27-W157 HydrophobicContact CG-CE3 4.16Å; L27-L161 HydrophobicContact CD2-CD1 4.27Å
28D93.6Very high91.8Very high111 Ų11155.6 Ų55.659%0.59430%0.298SS*.Hα-helixtrans-58.6-40.1-179.6-74.2-16000111.9D24 Q25 S32D24-D28 PolarHBondContact O-N 3.26Å; Q25-D28 PolarHBondContact O-N 3.38Å; D28-S32 PolarHBondContact O-N 3.05Å; D28-S32 VanDerWaalsContact O-N 3.07Å
29Y95.9Very high92.2Very high63 Ų6355.9 Ų55.925%0.24729%0.287CS..Hα-helixtrans-76.1-32.6-178.4-71.28.3000113Q25 V26 L27 Y31 S32 L37 Q38 F40Q25-Y29 HydrophobicContact CG-CD1 4.42Å; Q25-Y29 HydrophobicContact CG-CD2 4.12Å; Q25-Y29 HydrophobicContact CG-CE1 4.08Å; Q25-Y29 HydrophobicContact CG-CE2 3.75Å; Q25-Y29 HydrophobicContact CG-CG 4.43Å; Q25-Y29 PolarHBondContact NE2-OH 3.28Å; Q25-Y29 WeakPolarHBondContact O-CB 3.37Å; Q25-Y29 WeakPolarHBondContact O-CD1 3.24Å; Q25-Y29 VanDerWaalsContact O-CG 3.28Å; Q25-Y29 PolarHBondContact O-N 2.93Å; V26-Y29 PolarHBondContact O-N 2.78Å; L27-Y29 VanDerWaalsContact C-N 3.26Å; L27-Y29 PolarHBondContact O-N 2.96Å; Y29-Y31 VanDerWaalsContact C-N 3.33Å; Y29-S32 WeakPolarHBondContact O-CB 3.49Å; Y29-S32 PolarHBondContact O-N 3.33Å; Y29-L37 HydrophobicContact CD1-CB 4.45Å; Y29-L37 HydrophobicContact CD1-CD1 4.38Å; Y29-L37 HydrophobicContact CD1-CD2 4.37Å; Y29-L37 HydrophobicContact CD2-CB 4.39Å; Y29-L37 HydrophobicContact CD2-CD2 4.13Å; Y29-L37 HydrophobicContact CE1-CD1 4.46Å; Y29-L37 HydrophobicContact CE1-CD2 4.14Å; Y29-L37 HydrophobicContact CE2-CD2 3.9Å; Y29-L37 HydrophobicContact CG-CB 4.12Å; Y29-L37 HydrophobicContact CG-CD2 4.37Å; Y29-Q38 WeakPolarHBondContact O-CG 3.44Å; Y29-F40 AromaticContact CD2-CD1 3.68Å; Y29-F40 HydrophobicContact CD2-CD1 3.68Å; Y29-F40 HydrophobicContact CD2-CE1 4.23Å; Y29-F40 AromaticContact CE2-CD1 3.83Å; Y29-F40 HydrophobicContact CE2-CD1 3.83Å; Y29-F40 HydrophobicContact CE2-CE1 4.04Å
30L94.9Very high92.7Very high2 Ų255.6 Ų55.61%0.0128%0.282CS..Hα-helixtrans-61.5-42.3173.9-77.3169.5000111.2V26 L27 Q38 A41 L42 V45 T63 V67 W157V26-L30 HydrophobicContact CG1-CD1 3.84Å; V26-L30 HydrophobicContact CG1-CG 4.18Å; V26-L30 WeakPolarHBondContact O-CB 3.31Å; V26-L30 VanDerWaalsContact O-CG 3.24Å; V26-L30 WeakPolarHBondContact O-CG 3.25Å; V26-L30 PolarHBondContact O-N 3.4Å; L27-L30 PolarHBondContact O-N 3.46Å; L30-Q38 PolarHBondContact O-NE2 3.35Å; L30-Q38 VanDerWaalsContact O-NE2 3.11Å; L30-A41 HydrophobicContact CD2-CB 3.89Å; L30-A41 HydrophobicContact CG-CB 3.85Å; L30-L42 HydrophobicContact CD2-CD2 4.17Å; L30-V45 HydrophobicContact CD1-CG2 4.35Å; L30-T63 HydrophobicContact CB-CG2 4.41Å; L30-T63 HydrophobicContact CD1-CG2 3.95Å; L30-V67 HydrophobicContact CB-CG2 4.47Å; L30-V67 HydrophobicContact CD2-CB 4.29Å; L30-V67 HydrophobicContact CD2-CG1 4.22Å; L30-V67 HydrophobicContact CD2-CG2 4.21Å; L30-W157 HydrophobicContact CD1-CH2 4Å; L30-W157 HydrophobicContact CD1-CZ2 3.89Å
31Y94.2Very high93.2Very high56 Ų5651.5 Ų51.522%0.2226%0.264CS..SBendtrans-90.42.5-179-72.5-91.3000113.9L27 Y29 T63 L149 Q153 W157L27-Y31 HydrophobicContact CD1-CD2 3.62Å; L27-Y31 HydrophobicContact CD1-CE2 3.64Å; L27-Y31 WeakPolarHBondContact O-CD2 3.5Å; L27-Y31 PolarHBondContact O-N 3.04Å; Y29-Y31 VanDerWaalsContact C-N 3.33Å; Y31-T63 HydrophobicContact CE2-CG2 4.11Å; Y31-L149 HydrophobicContact CE1-CB 4.22Å; Y31-L149 VanDerWaalsContact CE1-O 3.31Å; Y31-L149 WeakPolarHBondContact CE1-O 3.43Å; Y31-L149 PolarHBondContact OH-O 3.01Å; Y31-Q153 HydrophobicContact CD1-CB 4.45Å; Y31-Q153 HydrophobicContact CD1-CG 4.28Å; Y31-Q153 HydrophobicContact CE1-CB 3.64Å; Y31-Q153 HydrophobicContact CE1-CG 3.91Å; Y31-Q153 HydrophobicContact CE2-CB 4.48Å; Y31-Q153 HydrophobicContact CE2-CG 4.33Å; Y31-Q153 WeakPolarHBondContact OH-CA 3.38Å; Y31-Q153 PolarHBondContact OH-N 2.86Å; Y31-W157 AromaticContact CE2-CD1 3.92Å; Y31-W157 HydrophobicContact CE2-CG 4.41Å
32S93.3Very high93.5Very high30 Ų3049.1 Ų49.121%0.2124%0.242CC..  trans-66.4153.5175-176.40000112.4D28 Y29 D34 Q38D28-S32 PolarHBondContact O-N 3.05Å; D28-S32 VanDerWaalsContact O-N 3.07Å; Y29-S32 WeakPolarHBondContact O-CB 3.49Å; Y29-S32 PolarHBondContact O-N 3.33Å; S32-D34 VanDerWaalsContact C-N 3.32Å; S32-D34 PolarHBondContact OG-N 3.45Å; S32-Q38 VanDerWaalsContact O-CD 3.31Å; S32-Q38 PolarHBondContact O-NE2 3.07Å; S32-Q38 VanDerWaalsContact O-NE2 3.07Å
33K90.1Very high93.8Very high190 Ų19055 Ų5583%0.82627%0.269SS*.SBendtrans-79.6-16.7172.3-64.4-177.7-177.3174.90112.6R74K33-R74 PolarHBondContact O-NH1 3.24Å; K33-R74 VanDerWaalsContact O-NH1 3.09Å
34D93.5Very high94Very high70 Ų7058.2 Ų58.237%0.37428%0.282SS..  trans-82.4118.1-178.2-178.2-0.2000111.5S32 A36 L37 Q38S32-D34 VanDerWaalsContact C-N 3.32Å; S32-D34 PolarHBondContact OG-N 3.45Å; D34-A36 PolarHBondContact O-N 2.89Å; D34-A36 WeakPolarHBondContact OD1-CB 3.42Å; D34-A36 PolarHBondContact OD1-N 3.37Å; D34-L37 HydrophobicContact CB-CB 4.27Å; D34-L37 HydrophobicContact CB-CD1 4.04Å; D34-L37 HydrophobicContact CB-CG 4.1Å; D34-L37 PolarHBondContact O-N 3.34Å; D34-Q38 WeakPolarHBondContact O-CG 3.39Å; D34-Q38 PolarHBondContact O-N 3.25Å; D34-Q38 VanDerWaalsContact O-N 3.1Å
35P91.7Very high94.2Very high41 Ų4156.1 Ų56.127%0.26627%0.271SS..Hα-helixtrans-63.5-24.7177.928-36.3000113.7R39P35-R39 VanDerWaalsContact O-CG 3.27Å; P35-R39 WeakPolarHBondContact O-CG 3.43Å; P35-R39 PolarHBondContact O-N 3.43Å
36A93.4Very high94.1Very high55 Ų5555.8 Ų55.846%0.45528%0.276SS..Hα-helixtrans-68.7-46176.600000111.4D34 R39 F40D34-A36 PolarHBondContact O-N 2.89Å; D34-A36 WeakPolarHBondContact OD1-CB 3.42Å; D34-A36 PolarHBondContact OD1-N 3.37Å; A36-R39 PolarHBondContact O-N 3.09Å; A36-F40 PolarHBondContact O-N 2.62Å; A36-F40 VanDerWaalsContact O-N 3.13Å
37L95.6Very high94Very high55 Ų5557.8 Ų57.829%0.28829%0.293SS..Hα-helixtrans-63.3-42.8175-65.4179.3000111.6Y29 D34 R39 F40 A41Y29-L37 HydrophobicContact CD1-CB 4.45Å; Y29-L37 HydrophobicContact CD1-CD1 4.38Å; Y29-L37 HydrophobicContact CD1-CD2 4.37Å; Y29-L37 HydrophobicContact CD2-CB 4.39Å; Y29-L37 HydrophobicContact CD2-CD2 4.13Å; Y29-L37 HydrophobicContact CE1-CD1 4.46Å; Y29-L37 HydrophobicContact CE1-CD2 4.14Å; Y29-L37 HydrophobicContact CE2-CD2 3.9Å; Y29-L37 HydrophobicContact CG-CB 4.12Å; Y29-L37 HydrophobicContact CG-CD2 4.37Å; D34-L37 HydrophobicContact CB-CB 4.27Å; D34-L37 HydrophobicContact CB-CD1 4.04Å; D34-L37 HydrophobicContact CB-CG 4.1Å; D34-L37 PolarHBondContact O-N 3.34Å; L37-R39 VanDerWaalsContact C-N 3.33Å; L37-R39 PolarHBondContact O-N 3.23Å; L37-F40 WeakPolarHBondContact O-CB 3.42Å; L37-F40 PolarHBondContact O-N 3.07Å; L37-A41 PolarHBondContact O-N 2.99Å
38Q96.1Very high94Very high2 Ų257.2 Ų57.21%0.00929%0.29CS..Hα-helixtrans-59.5-42.6175.6-71.2-174.8-45.600111.9Y29 L30 S32 D34 F40 A41 L42 V67 V71Y29-Q38 WeakPolarHBondContact O-CG 3.44Å; L30-Q38 PolarHBondContact O-NE2 3.35Å; L30-Q38 VanDerWaalsContact O-NE2 3.11Å; S32-Q38 VanDerWaalsContact O-CD 3.31Å; S32-Q38 PolarHBondContact O-NE2 3.07Å; S32-Q38 VanDerWaalsContact O-NE2 3.07Å; D34-Q38 WeakPolarHBondContact O-CG 3.39Å; D34-Q38 PolarHBondContact O-N 3.25Å; D34-Q38 VanDerWaalsContact O-N 3.1Å; Q38-F40 PolarHBondContact O-N 3.12Å; Q38-A41 PolarHBondContact O-N 2.74Å; Q38-L42 VanDerWaalsContact O-CG 3.25Å; Q38-L42 WeakPolarHBondContact O-CG 3.36Å; Q38-L42 PolarHBondContact O-N 3.11Å; Q38-V67 HydrophobicContact CB-CG1 3.92Å; Q38-V67 HydrophobicContact CG-CG1 4.03Å; Q38-V71 HydrophobicContact CB-CG2 3.6Å; Q38-V71 HydrophobicContact CG-CG2 4.5Å
39R95.3Very high93.7Very high111 Ų11156.2 Ų56.242%0.41928%0.277SS..Hα-helixtrans-61.1-42.5175.7-75.2177.4-166.2114.4-2.4112.4P35 A36 L37 L42 Q43 V71P35-R39 VanDerWaalsContact O-CG 3.27Å; P35-R39 WeakPolarHBondContact O-CG 3.43Å; P35-R39 PolarHBondContact O-N 3.43Å; A36-R39 PolarHBondContact O-N 3.09Å; L37-R39 VanDerWaalsContact C-N 3.33Å; L37-R39 PolarHBondContact O-N 3.23Å; R39-L42 PolarHBondContact O-N 3.41Å; R39-Q43 WeakPolarHBondContact O-CG 3.35Å; R39-Q43 PolarHBondContact O-N 3.39Å; R39-V71 HydrophobicContact CG-CG1 3.72Å
40F96.1Very high93.2Very high78 Ų7856.4 Ų56.434%0.34230%0.299SS..Hα-helixtrans-61.4-44.9175.8-179.8-86.5000111.6Y29 A36 L37 Q38 L42 Q43 R44Y29-F40 AromaticContact CD2-CD1 3.68Å; Y29-F40 HydrophobicContact CD2-CD1 3.68Å; Y29-F40 HydrophobicContact CD2-CE1 4.23Å; Y29-F40 AromaticContact CE2-CD1 3.83Å; Y29-F40 HydrophobicContact CE2-CD1 3.83Å; Y29-F40 HydrophobicContact CE2-CE1 4.04Å; A36-F40 PolarHBondContact O-N 2.62Å; A36-F40 VanDerWaalsContact O-N 3.13Å; L37-F40 WeakPolarHBondContact O-CB 3.42Å; L37-F40 PolarHBondContact O-N 3.07Å; Q38-F40 PolarHBondContact O-N 3.12Å; F40-L42 PolarHBondContact O-N 3.45Å; F40-Q43 PolarHBondContact O-N 3.02Å; F40-R44 PolarHBondContact O-N 3.04Å
41A96.1Very high92.8Very high0 Ų062.9 Ų62.90%032%0.323CS..Hα-helixtrans-61.9-43.1177.800000111.9V26 L30 L37 Q38 Q43 R44 V45V26-A41 HydrophobicContact CG1-CB 4.41Å; L30-A41 HydrophobicContact CD2-CB 3.89Å; L30-A41 HydrophobicContact CG-CB 3.85Å; L37-A41 PolarHBondContact O-N 2.99Å; Q38-A41 PolarHBondContact O-N 2.74Å; A41-Q43 PolarHBondContact O-N 3.09Å; A41-R44 WeakPolarHBondContact O-CA 3.43Å; A41-R44 WeakPolarHBondContact O-CB 3.37Å; A41-R44 PolarHBondContact O-N 3.43Å; A41-R44 VanDerWaalsContact O-N 3.08Å; A41-V45 WeakPolarHBondContact O-CG2 3.29Å; A41-V45 PolarHBondContact O-N 2.92Å
42L95.8Very high92.1Very high16 Ų1663.1 Ų63.18%0.08432%0.324CS..Hα-helixtrans-60.8-43.1176.4-70.7173.8000112.3L30 Q38 R39 F40 R44 V45 S46 A64 V67 R68 V71L30-L42 HydrophobicContact CD2-CD2 4.17Å; Q38-L42 VanDerWaalsContact O-CG 3.25Å; Q38-L42 WeakPolarHBondContact O-CG 3.36Å; Q38-L42 PolarHBondContact O-N 3.11Å; R39-L42 PolarHBondContact O-N 3.41Å; F40-L42 PolarHBondContact O-N 3.45Å; L42-R44 PolarHBondContact O-N 3.42Å; L42-V45 PolarHBondContact O-N 3.33Å; L42-S46 PolarHBondContact O-N 2.97Å; L42-S46 PolarHBondContact O-OG 3.39Å; L42-A64 HydrophobicContact CD2-CB 3.86Å; L42-A64 WeakPolarHBondContact CD2-O 3.47Å; L42-V67 HydrophobicContact CD1-CG1 4.26Å; L42-V67 HydrophobicContact CD2-CB 4.21Å; L42-V67 HydrophobicContact CD2-CG1 4.19Å; L42-V67 HydrophobicContact CG-CG1 4.24Å; L42-R68 HydrophobicContact CD1-CB 4.03Å; L42-R68 HydrophobicContact CD1-CG 4.42Å; L42-R68 HydrophobicContact CD2-CB 4.43Å; L42-V71 HydrophobicContact CD1-CG2 4.3Å
43Q95.3Very high90.8Very high137 Ų13764.6 Ų64.664%0.6434%0.338SS*.Hα-helixtrans-61-37.3174.4-72.4173.9-10.100111.4R39 F40 A41 S46 A47R39-Q43 WeakPolarHBondContact O-CG 3.35Å; R39-Q43 PolarHBondContact O-N 3.39Å; F40-Q43 PolarHBondContact O-N 3.02Å; A41-Q43 PolarHBondContact O-N 3.09Å; Q43-S46 WeakPolarHBondContact O-CB 3.45Å; Q43-S46 PolarHBondContact O-N 3.08Å; Q43-A47 PolarHBondContact O-N 2.99Å
44R94.4Very high89.7Confident74 Ų7464.2 Ų64.228%0.27934%0.339SS..Hα-helixtrans-67.6-43.5177.3-163.960.763.9125.2-0.7112.6E22 V26 F40 A41 L42 S46 A47 W48E22-R44 VanDerWaalsContact OE1-CD 3.29Å; E22-R44 WeakPolarHBondContact OE1-CD 3.48Å; E22-R44 IonicContact OE1-CZ 3.75Å; E22-R44 IonicContact OE1-NE 2.7Å; E22-R44 IonicContact OE1-NH1 2.82Å; E22-R44 PolarHBondContact OE1-NH1 2.95Å; V26-R44 HydrophobicContact CG2-CB 3.82Å; V26-R44 HydrophobicContact CG2-CG 3.51Å; F40-R44 PolarHBondContact O-N 3.04Å; A41-R44 WeakPolarHBondContact O-CA 3.43Å; A41-R44 WeakPolarHBondContact O-CB 3.37Å; A41-R44 PolarHBondContact O-N 3.43Å; A41-R44 VanDerWaalsContact O-N 3.08Å; L42-R44 PolarHBondContact O-N 3.42Å; R44-S46 VanDerWaalsContact C-N 3.29Å; R44-S46 PolarHBondContact O-N 3.04Å; R44-A47 WeakPolarHBondContact O-CB 3.49Å; R44-A47 PolarHBondContact O-N 3.45Å; R44-A47 VanDerWaalsContact O-N 3.09Å; R44-W48 HydrophobicContact CG-CZ2 4.41Å; R44-W48 PolarHBondContact O-N 3.35Å
45V93.1Very high88.6Confident3 Ų365.3 Ų65.32%0.01835%0.345CS..Hα-helixtrans-62.2-37.5173.5176.60000111.1V26 L30 A41 L42 A47 W48 R49 V60 A64V26-V45 HydrophobicContact CG1-CG2 3.83Å; L30-V45 HydrophobicContact CD1-CG2 4.35Å; A41-V45 WeakPolarHBondContact O-CG2 3.29Å; A41-V45 PolarHBondContact O-N 2.92Å; L42-V45 PolarHBondContact O-N 3.33Å; V45-A47 VanDerWaalsContact C-N 3.31Å; V45-A47 PolarHBondContact O-N 3.32Å; V45-W48 HydrophobicContact CB-CE3 4.48Å; V45-W48 HydrophobicContact CG2-CE3 4.03Å; V45-W48 HydrophobicContact CG2-CZ3 4.12Å; V45-W48 WeakPolarHBondContact O-CB 3.48Å; V45-W48 PolarHBondContact O-N 3.15Å; V45-W48 VanDerWaalsContact O-N 3.17Å; V45-R49 PolarHBondContact O-N 2.94Å; V45-V60 HydrophobicContact CG1-CG1 3.78Å; V45-V60 HydrophobicContact CG2-CG1 4.27Å; V45-A64 HydrophobicContact CB-CB 4.34Å; V45-A64 HydrophobicContact CG1-CB 3.83Å
46S92.3Very high88Confident65 Ų6564 Ų6446%0.45534%0.336SS..Hα-helixtrans-61.6-38.3172.6-64.50000112.7L42 Q43 R44 R49 G50L42-S46 PolarHBondContact O-N 2.97Å; L42-S46 PolarHBondContact O-OG 3.39Å; Q43-S46 WeakPolarHBondContact O-CB 3.45Å; Q43-S46 PolarHBondContact O-N 3.08Å; R44-S46 VanDerWaalsContact C-N 3.29Å; R44-S46 PolarHBondContact O-N 3.04Å; S46-R49 PolarHBondContact O-N 3.37Å; S46-G50 PolarHBondContact O-N 3.11Å; S46-G50 VanDerWaalsContact O-N 3.11Å
47A91.6Very high87.6Confident41 Ų4161.9 Ų61.934%0.33932%0.318SS..Hα-helixtrans-65.5-39.317300000112Q43 R44 V45 G50 R51Q43-A47 PolarHBondContact O-N 2.99Å; R44-A47 WeakPolarHBondContact O-CB 3.49Å; R44-A47 PolarHBondContact O-N 3.45Å; R44-A47 VanDerWaalsContact O-N 3.09Å; V45-A47 VanDerWaalsContact C-N 3.31Å; V45-A47 PolarHBondContact O-N 3.32Å; A47-G50 PolarHBondContact O-N 3.07Å; A47-R51 PolarHBondContact O-N 3.38Å
48W91.8Very high87.2Confident2 Ų260.2 Ų60.21%0.00831%0.31CS..Hα-helixtrans-60.4-44.7173.4-64.4-13.4000111.9A16 W17 E22 W23 V26 R44 V45 G50 R51 Y52 V60A16-W48 HydrophobicContact CB-CB 3.75Å; A16-W48 HydrophobicContact CB-CG 4.1Å; W17-W48 HydrophobicContact CB-CZ2 3.76Å; E22-W48 HydrophobicContact CG-CZ2 4.24Å; W23-W48 HydrophobicContact CD2-CH2 4.48Å; W23-W48 AromaticContact CE3-CH2 3.57Å; W23-W48 HydrophobicContact CE3-CH2 3.57Å; W23-W48 HydrophobicContact CE3-CZ2 4.42Å; W23-W48 AromaticContact CE3-CZ3 3.79Å; W23-W48 HydrophobicContact CE3-CZ3 3.79Å; W23-W48 HydrophobicContact CZ3-CH2 4.03Å; W23-W48 AromaticContact CZ3-CZ3 3.73Å; W23-W48 HydrophobicContact CZ3-CZ3 3.73Å; V26-W48 HydrophobicContact CB-CH2 3.56Å; V26-W48 HydrophobicContact CB-CZ2 3.94Å; V26-W48 HydrophobicContact CB-CZ3 4.41Å; V26-W48 HydrophobicContact CG1-CH2 3.51Å; V26-W48 HydrophobicContact CG1-CZ2 4.17Å; V26-W48 HydrophobicContact CG1-CZ3 3.86Å; V26-W48 HydrophobicContact CG2-CH2 3.81Å; V26-W48 HydrophobicContact CG2-CZ2 3.63Å; R44-W48 HydrophobicContact CG-CZ2 4.41Å; R44-W48 PolarHBondContact O-N 3.35Å; V45-W48 HydrophobicContact CB-CE3 4.48Å; V45-W48 HydrophobicContact CG2-CE3 4.03Å; V45-W48 HydrophobicContact CG2-CZ3 4.12Å; V45-W48 WeakPolarHBondContact O-CB 3.48Å; V45-W48 PolarHBondContact O-N 3.15Å; V45-W48 VanDerWaalsContact O-N 3.17Å; W48-G50 VanDerWaalsContact C-N 3.25Å; W48-G50 PolarHBondContact O-N 3.48Å; W48-R51 PolarHBondContact O-N 3.41Å; W48-Y52 PolarHBondContact O-N 3.43Å; W48-V60 HydrophobicContact CE3-CG1 4.11Å; W48-V60 HydrophobicContact CZ3-CG1 4.18Å
49R87.4Confident86.9Confident89 Ų8960.5 Ų60.534%0.33631%0.312SS..Hα-helixtrans-58.9-37.3175.6-168.9-177.2-75.6179.7-1.5111.9V45 S46 R51 A53 D61V45-R49 PolarHBondContact O-N 2.94Å; S46-R49 PolarHBondContact O-N 3.37Å; R49-R51 VanDerWaalsContact C-N 3.34Å; R49-R51 PolarHBondContact O-N 3.43Å; R49-A53 WeakPolarHBondContact O-CA 3.15Å; R49-A53 PolarHBondContact O-N 3.49Å; R49-D61 IonicContact CZ-OD1 3.76Å; R49-D61 IonicContact NE-OD1 3.53Å; R49-D61 PolarHBondContact NE-OD1 2.96Å; R49-D61 VanDerWaalsContact NE-OD1 3.16Å; R49-D61 IonicContact NE-OD2 2.69Å; R49-D61 IonicContact NH2-OD1 3.71Å; R49-D61 PolarHBondContact NH2-OD1 3.12Å; R49-D61 IonicContact NH2-OD2 2.72Å
50G85.8Confident86.6Confident68 Ų6855.2 Ų55.270%0.70129%0.293SS*.Hα-helixtrans-66.1-32.1175.500000114.1S46 A47 W48S46-G50 PolarHBondContact O-N 3.11Å; S46-G50 VanDerWaalsContact O-N 3.11Å; A47-G50 PolarHBondContact O-N 3.07Å; W48-G50 VanDerWaalsContact C-N 3.25Å; W48-G50 PolarHBondContact O-N 3.48Å
51R86.4Confident86.3Confident138 Ų13852.3 Ų52.352%0.52128%0.281SS..Hα-helixtrans-81.3-31.6178.4-65.2174.5-172.2165.91.2112.8A16 A47 W48 R49A16-R51 WeakPolarHBondContact O-CD 3.45Å; A16-R51 PolarHBondContact O-NH1 2.78Å; A47-R51 PolarHBondContact O-N 3.38Å; W48-R51 PolarHBondContact O-N 3.41Å; R49-R51 VanDerWaalsContact C-N 3.34Å; R49-R51 PolarHBondContact O-N 3.43Å
52Y78.6Confident86.2Confident61 Ų6152.4 Ų52.424%0.23928%0.281CS..SBendtrans-135.350-164.8-145.5-123.5000111.1V14 A16 W48 H54 N55 T56V14-Y52 HydrophobicContact CB-CE2 4.33Å; V14-Y52 HydrophobicContact CG1-CE2 3.77Å; V14-Y52 PolarHBondContact O-OH 2.89Å; A16-Y52 HydrophobicContact CB-CD1 4.45Å; A16-Y52 HydrophobicContact CB-CG 4.19Å; W48-Y52 PolarHBondContact O-N 3.43Å; Y52-H54 PolarHBondContact O-N 3.17Å; Y52-N55 VanDerWaalsContact CD1-C 3.41Å; Y52-N55 HydrophobicContact CD1-CB 3.53Å; Y52-N55 WeakPolarHBondContact CD1-O 3.11Å; Y52-N55 HydrophobicContact CE1-CB 3.22Å; Y52-N55 WeakPolarHBondContact CE1-O 3.47Å; Y52-N55 HydrophobicContact CE2-CB 4.31Å; Y52-N55 HydrophobicContact CG-CB 4.2Å; Y52-N55 PolarHBondContact O-N 3.47Å; Y52-T56 PolarHBondContact O-N 2.89Å; Y52-T56 PolarHBondContact O-OG1 2.79Å
53A67.5Low86.2Confident61 Ų6151.7 Ų51.750%0.50428%0.277SS..THydrogen-bonded Turntrans-45.9-56-16500000115.3R49R49-A53 WeakPolarHBondContact O-CA 3.15Å; R49-A53 PolarHBondContact O-N 3.49Å
54H65.1Low86.1Confident181 Ų18145.2 Ų45.284%0.83825%0.247SC*.THydrogen-bonded Turntrans-92.6-8.7-173.7-52.7-56.1000113.9Y52Y52-H54 PolarHBondContact O-N 3.17Å
55N72Confident86.2Confident94 Ų9442.7 Ų42.750%0.50324%0.239SC..THydrogen-bonded Turntrans-119.112.4-172.1-69.131.9000112.3Y52 P57Y52-N55 VanDerWaalsContact CD1-C 3.41Å; Y52-N55 HydrophobicContact CD1-CB 3.53Å; Y52-N55 WeakPolarHBondContact CD1-O 3.11Å; Y52-N55 HydrophobicContact CE1-CB 3.22Å; Y52-N55 WeakPolarHBondContact CE1-O 3.47Å; Y52-N55 HydrophobicContact CE2-CB 4.31Å; Y52-N55 HydrophobicContact CG-CB 4.2Å; Y52-N55 PolarHBondContact O-N 3.47Å; N55-P57 WeakPolarHBondContact O-CD 3.29Å
56T78.6Confident86.3Confident12 Ų1242.6 Ų42.67%0.07424%0.239CC..SBendtrans-66.8128.3173.5-59.70000108.6Y52 V58 V60Y52-T56 PolarHBondContact O-N 2.89Å; Y52-T56 PolarHBondContact O-OG1 2.79Å; T56-V58 PolarHBondContact O-N 3.2Å; T56-V60 HydrophobicContact CG2-CB 4.44Å; T56-V60 HydrophobicContact CG2-CG1 4.41Å
57P85.2Confident86.5Confident12 Ų1239.5 Ų39.58%0.07822%0.217CC..  trans-56131.5-178.4-2835000111.7N55 A59 V60 D61 Y156 E170N55-P57 WeakPolarHBondContact O-CD 3.29Å; P57-A59 PolarHBondContact O-N 2.69Å; P57-A59 VanDerWaalsContact O-N 3.16Å; P57-V60 HydrophobicContact CB-CB 4.45Å; P57-V60 HydrophobicContact CB-CG2 3.97Å; P57-V60 HydrophobicContact CG-CG2 4.3Å; P57-V60 WeakPolarHBondContact O-CB 3.44Å; P57-V60 PolarHBondContact O-N 3.44Å; P57-D61 PolarHBondContact O-N 3.33Å; P57-Y156 HydrophobicContact CB-CE2 4.15Å; P57-Y156 WeakPolarHBondContact CB-OH 3.49Å; P57-Y156 WeakPolarHBondContact CG-OH 3.44Å; P57-E170 WeakPolarHBondContact CA-OE1 3.4Å; P57-E170 VanDerWaalsContact CB-OE1 3.25Å; P57-E170 WeakPolarHBondContact CB-OE1 3.21Å; P57-E170 WeakPolarHBondContact CG-OE1 3.27Å
58V86.5Confident86.7Confident20 Ų2041.4 Ų41.412%0.12122%0.215CC..Hα-helixtrans-55.5-38.1-177.4161.60000111.6T56 V60 D61 C62 L97 I98 R101T56-V58 PolarHBondContact O-N 3.2Å; V58-V60 VanDerWaalsContact C-N 3.33Å; V58-V60 PolarHBondContact O-N 2.93Å; V58-D61 PolarHBondContact O-N 3.12Å; V58-C62 WeakPolarHBondContact O-CB 3.42Å; V58-C62 PolarHBondContact O-N 3.27Å; V58-C62 PolarHBondContact O-SG 2.94Å; V58-L97 HydrophobicContact CG1-CB 3.48Å; V58-L97 VanDerWaalsContact CG1-CB 3.48Å; V58-L97 HydrophobicContact CG1-CD1 3.96Å; V58-L97 HydrophobicContact CG1-CG 4.35Å; V58-I98 HydrophobicContact CG1-CD1 4.1Å; V58-R101 VanDerWaalsContact CG2-NH2 3.31Å
59A89.3Confident86.9Confident7 Ų741.4 Ų41.46%0.05822%0.216CC..Hα-helixtrans-60.8-40.7177.400000112.3P57 C62 T63 L152 Y156P57-A59 PolarHBondContact O-N 2.69Å; P57-A59 VanDerWaalsContact O-N 3.16Å; A59-C62 PolarHBondContact O-N 3.01Å; A59-T63 WeakPolarHBondContact O-CB 3.44Å; A59-T63 PolarHBondContact O-N 3.13Å; A59-T63 PolarHBondContact O-OG1 3.23Å; A59-L152 HydrophobicContact CB-CD2 3.82Å; A59-Y156 HydrophobicContact CB-CD1 3.51Å; A59-Y156 HydrophobicContact CB-CD2 3.33Å; A59-Y156 HydrophobicContact CB-CE1 3.85Å; A59-Y156 HydrophobicContact CB-CE2 3.66Å; A59-Y156 HydrophobicContact CB-CG 3.26Å
60V90.3Very high87.2Confident1 Ų138.9 Ų38.91%0.00621%0.208CC..Hα-helixtrans-64.4-43.8177.6176.60000110.7W23 V45 W48 T56 P57 V58 T63 A64 Y156 W157W23-V60 HydrophobicContact CH2-CG2 3.68Å; W23-V60 HydrophobicContact CZ3-CG2 3.99Å; V45-V60 HydrophobicContact CG1-CG1 3.78Å; V45-V60 HydrophobicContact CG2-CG1 4.27Å; W48-V60 HydrophobicContact CE3-CG1 4.11Å; W48-V60 HydrophobicContact CZ3-CG1 4.18Å; T56-V60 HydrophobicContact CG2-CB 4.44Å; T56-V60 HydrophobicContact CG2-CG1 4.41Å; P57-V60 HydrophobicContact CB-CB 4.45Å; P57-V60 HydrophobicContact CB-CG2 3.97Å; P57-V60 HydrophobicContact CG-CG2 4.3Å; P57-V60 WeakPolarHBondContact O-CB 3.44Å; P57-V60 PolarHBondContact O-N 3.44Å; V58-V60 VanDerWaalsContact C-N 3.33Å; V58-V60 PolarHBondContact O-N 2.93Å; V60-T63 PolarHBondContact O-N 2.59Å; V60-A64 WeakPolarHBondContact O-CB 3.31Å; V60-A64 PolarHBondContact O-N 3.11Å; V60-Y156 HydrophobicContact CG2-CE1 3.79Å; V60-W157 HydrophobicContact CB-CZ2 4.41Å; V60-W157 HydrophobicContact CG1-CH2 4.39Å; V60-W157 HydrophobicContact CG1-CZ2 4.49Å; V60-W157 HydrophobicContact CG2-CH2 3.88Å; V60-W157 HydrophobicContact CG2-CZ2 3.95Å
61D90Very high87.7Confident17 Ų1736 Ų369%0.09118%0.177CC..Hα-helixtrans-62.9-46.7176.5-89.3-14.9000111.9R49 P57 V58 A64 D65R49-D61 IonicContact CZ-OD1 3.76Å; R49-D61 IonicContact NE-OD1 3.53Å; R49-D61 PolarHBondContact NE-OD1 2.96Å; R49-D61 VanDerWaalsContact NE-OD1 3.16Å; R49-D61 IonicContact NE-OD2 2.69Å; R49-D61 IonicContact NH2-OD1 3.71Å; R49-D61 PolarHBondContact NH2-OD1 3.12Å; R49-D61 IonicContact NH2-OD2 2.72Å; P57-D61 PolarHBondContact O-N 3.33Å; V58-D61 PolarHBondContact O-N 3.12Å; D61-A64 PolarHBondContact O-N 3.38Å; D61-D65 VanDerWaalsContact O-CG 3.31Å; D61-D65 PolarHBondContact O-N 3.11Å
62C93.1Very high88Confident2 Ų231.8 Ų31.81%0.01416%0.164CC..Hα-helixtrans-63.2-41.7177.2-69.80000112.1V58 A59 D65 L66 F94 L152V58-C62 WeakPolarHBondContact O-CB 3.42Å; V58-C62 PolarHBondContact O-N 3.27Å; V58-C62 PolarHBondContact O-SG 2.94Å; A59-C62 PolarHBondContact O-N 3.01Å; C62-D65 PolarHBondContact O-N 3.01Å; C62-L66 WeakPolarHBondContact O-CB 3.4Å; C62-L66 VanDerWaalsContact O-CG 3.29Å; C62-L66 WeakPolarHBondContact O-CG 3.47Å; C62-L66 PolarHBondContact O-N 3.08Å; C62-F94 HydrophobicContact CB-CB 4.36Å; C62-F94 HydrophobicContact CB-CD2 4.04Å; C62-L152 HydrophobicContact CB-CD1 4.21Å
63T94.9Very high88.7Confident0 Ų030 Ų300%016%0.159CC..Hα-helixtrans-59.6-46.9174.2-60.10000110.5L30 Y31 A59 V60 D65 L66 V67 L149 W157L30-T63 HydrophobicContact CB-CG2 4.41Å; L30-T63 HydrophobicContact CD1-CG2 3.95Å; Y31-T63 HydrophobicContact CE2-CG2 4.11Å; A59-T63 WeakPolarHBondContact O-CB 3.44Å; A59-T63 PolarHBondContact O-N 3.13Å; A59-T63 PolarHBondContact O-OG1 3.23Å; V60-T63 PolarHBondContact O-N 2.59Å; T63-D65 PolarHBondContact O-N 2.99Å; T63-L66 PolarHBondContact O-N 3.41Å; T63-V67 HydrophobicContact CG2-CG2 4.25Å; T63-V67 WeakPolarHBondContact O-CB 3.39Å; T63-V67 VanDerWaalsContact O-CG2 3.29Å; T63-V67 WeakPolarHBondContact O-CG2 2.83Å; T63-V67 PolarHBondContact O-N 2.95Å; T63-L149 HydrophobicContact CG2-CD2 3.92Å; T63-W157 HydrophobicContact CG2-CZ2 4.3Å; T63-W157 PolarHBondContact OG1-NE1 3.48Å
64A94.9Very high89.9Confident1 Ų132.8 Ų32.81%0.00816%0.156CC..Hα-helixtrans-63.3-40.8179.500000112.7L42 V45 V60 D61 R68L42-A64 HydrophobicContact CD2-CB 3.86Å; L42-A64 WeakPolarHBondContact CD2-O 3.47Å; V45-A64 HydrophobicContact CB-CB 4.34Å; V45-A64 HydrophobicContact CG1-CB 3.83Å; V60-A64 WeakPolarHBondContact O-CB 3.31Å; V60-A64 PolarHBondContact O-N 3.11Å; D61-A64 PolarHBondContact O-N 3.38Å; A64-R68 VanDerWaalsContact O-CB 3.3Å; A64-R68 WeakPolarHBondContact O-CB 3.45Å; A64-R68 PolarHBondContact O-N 3.31Å
65D95.1Very high91.1Very high22 Ų2226 Ų2612%0.11813%0.129CC..Hα-helixtrans-64.1-43.1177.7-70.1-18.6000111.6D61 C62 T63 R68 C69 A90 R93D61-D65 VanDerWaalsContact O-CG 3.31Å; D61-D65 PolarHBondContact O-N 3.11Å; C62-D65 PolarHBondContact O-N 3.01Å; T63-D65 PolarHBondContact O-N 2.99Å; D65-R68 PolarHBondContact O-N 3.22Å; D65-R68 IonicContact OD1-CZ 3.53Å; D65-R68 IonicContact OD1-NH1 3.52Å; D65-R68 PolarHBondContact OD1-NH1 3.46Å; D65-R68 IonicContact OD1-NH2 2.79Å; D65-C69 PolarHBondContact O-N 2.93Å; D65-C69 PolarHBondContact O-SG 3.05Å; D65-A90 HydrophobicContact CB-CB 4.21Å; D65-R93 IonicContact OD2-NE 3.16Å
66L96.4Very high91.8Very high0 Ų024.6 Ų24.60%014%0.137CC..Hα-helixtrans-69-41.4178.3-69.6168.3000112.8C62 T63 R68 C69 Q70 A90 L91 C145 V148 L149 L152C62-L66 WeakPolarHBondContact O-CB 3.4Å; C62-L66 VanDerWaalsContact O-CG 3.29Å; C62-L66 WeakPolarHBondContact O-CG 3.47Å; C62-L66 PolarHBondContact O-N 3.08Å; T63-L66 PolarHBondContact O-N 3.41Å; L66-R68 VanDerWaalsContact C-N 3.33Å; L66-C69 VanDerWaalsContact O-CB 3.32Å; L66-C69 WeakPolarHBondContact O-CB 3.23Å; L66-C69 PolarHBondContact O-N 3.39Å; L66-Q70 PolarHBondContact O-N 3.17Å; L66-A90 HydrophobicContact CD2-CB 3.82Å; L66-A90 HydrophobicContact CG-CB 4.37Å; L66-L91 HydrophobicContact CD2-CD2 3.99Å; L66-L91 HydrophobicContact CD2-CG 4.3Å; L66-C145 HydrophobicContact CD2-CB 4.21Å; L66-V148 HydrophobicContact CD1-CB 4.01Å; L66-V148 HydrophobicContact CD1-CG1 3.36Å; L66-L149 HydrophobicContact CB-CD1 4.23Å; L66-L149 HydrophobicContact CB-CD2 3.84Å; L66-L149 HydrophobicContact CB-CG 3.98Å; L66-L149 HydrophobicContact CD1-CD2 4.15Å; L66-L149 HydrophobicContact CD1-CG 4.16Å; L66-L152 HydrophobicContact CD1-CD1 4.08Å
67V96.7Very high92.2Very high1 Ų131.3 Ų31.31%0.00617%0.167CC..Hα-helixtrans-65.8-37.5175.91720000110.7L30 Q38 L42 T63 C69 Q70 V71 L149L30-V67 HydrophobicContact CB-CG2 4.47Å; L30-V67 HydrophobicContact CD2-CB 4.29Å; L30-V67 HydrophobicContact CD2-CG1 4.22Å; L30-V67 HydrophobicContact CD2-CG2 4.21Å; Q38-V67 HydrophobicContact CB-CG1 3.92Å; Q38-V67 HydrophobicContact CG-CG1 4.03Å; L42-V67 HydrophobicContact CD1-CG1 4.26Å; L42-V67 HydrophobicContact CD2-CB 4.21Å; L42-V67 HydrophobicContact CD2-CG1 4.19Å; L42-V67 HydrophobicContact CG-CG1 4.24Å; T63-V67 HydrophobicContact CG2-CG2 4.25Å; T63-V67 WeakPolarHBondContact O-CB 3.39Å; T63-V67 VanDerWaalsContact O-CG2 3.29Å; T63-V67 WeakPolarHBondContact O-CG2 2.83Å; T63-V67 PolarHBondContact O-N 2.95Å; V67-C69 VanDerWaalsContact C-N 3.28Å; V67-C69 PolarHBondContact O-N 3.48Å; V67-Q70 WeakPolarHBondContact O-CB 3.38Å; V67-Q70 PolarHBondContact O-N 3.22Å; V67-Q70 VanDerWaalsContact O-N 3.11Å; V67-V71 HydrophobicContact CG1-CG2 4.37Å; V67-V71 WeakPolarHBondContact O-CG2 3.33Å; V67-V71 PolarHBondContact O-N 2.98Å; V67-L149 HydrophobicContact CG2-CD1 4.38Å; V67-L149 HydrophobicContact CG2-CD2 4.07Å
68R95.4Very high92.4Very high80 Ų8033.7 Ų33.730%0.30218%0.179SC..Hα-helixtrans-59-40.5173.2-169.8-178.3-58.9107.25.1111.7L42 A64 D65 L66 V71 L72L42-R68 HydrophobicContact CD1-CB 4.03Å; L42-R68 HydrophobicContact CD1-CG 4.42Å; L42-R68 HydrophobicContact CD2-CB 4.43Å; A64-R68 VanDerWaalsContact O-CB 3.3Å; A64-R68 WeakPolarHBondContact O-CB 3.45Å; A64-R68 PolarHBondContact O-N 3.31Å; D65-R68 PolarHBondContact O-N 3.22Å; D65-R68 IonicContact OD1-CZ 3.53Å; D65-R68 IonicContact OD1-NH1 3.52Å; D65-R68 PolarHBondContact OD1-NH1 3.46Å; D65-R68 IonicContact OD1-NH2 2.79Å; L66-R68 VanDerWaalsContact C-N 3.33Å; R68-V71 PolarHBondContact O-N 3.11Å; R68-L72 HydrophobicContact CG-CD1 4.1Å; R68-L72 WeakPolarHBondContact O-CG 3.48Å; R68-L72 PolarHBondContact O-N 3.13Å; R68-L72 VanDerWaalsContact O-N 3.07Å
69C95.3Very high92.6Very high2 Ų238.2 Ų38.21%0.01420%0.203CC..Hα-helixtrans-59.3-46.5173.7-57.50000111.2D65 L66 V67 V71 L72 D73 L86 Y87D65-C69 PolarHBondContact O-N 2.93Å; D65-C69 PolarHBondContact O-SG 3.05Å; L66-C69 VanDerWaalsContact O-CB 3.32Å; L66-C69 WeakPolarHBondContact O-CB 3.23Å; L66-C69 PolarHBondContact O-N 3.39Å; V67-C69 VanDerWaalsContact C-N 3.28Å; V67-C69 PolarHBondContact O-N 3.48Å; C69-V71 PolarHBondContact O-N 3.2Å; C69-L72 PolarHBondContact O-N 2.72Å; C69-D73 VanDerWaalsContact O-CB 3.23Å; C69-D73 WeakPolarHBondContact O-CB 3.37Å; C69-D73 PolarHBondContact O-N 2.92Å; C69-L86 HydrophobicContact CB-CD2 4.44Å; C69-L86 HydrophobicContact CB-CG 4.5Å; C69-Y87 HydrophobicContact CB-CD1 3.47Å; C69-Y87 VanDerWaalsContact CB-CD1 3.47Å; C69-Y87 HydrophobicContact CB-CD2 4.46Å; C69-Y87 HydrophobicContact CB-CE1 3.29Å; C69-Y87 HydrophobicContact CB-CE2 4.32Å; C69-Y87 HydrophobicContact CB-CG 4.07Å
70Q94.8Very high92.6Very high36 Ų3639.6 Ų39.617%0.16822%0.217CC..Hα-helixtrans-62.7-41.8179.1-66.9-171.2-13.300113.2L66 V67 D73 R74 L149L66-Q70 PolarHBondContact O-N 3.17Å; V67-Q70 WeakPolarHBondContact O-CB 3.38Å; V67-Q70 PolarHBondContact O-N 3.22Å; V67-Q70 VanDerWaalsContact O-N 3.11Å; Q70-D73 PolarHBondContact O-N 3.18Å; Q70-R74 WeakPolarHBondContact O-CG 3.48Å; Q70-R74 PolarHBondContact O-N 2.71Å; Q70-L149 VanDerWaalsContact NE2-CD1 3.31Å
71V94.8Very high92.7Very high9 Ų945.8 Ų45.86%0.05525%0.251CS..Hα-helixtrans-64.2-43.1179.1171.20000110.9Q38 R39 L42 V67 R68 C69 S75Q38-V71 HydrophobicContact CB-CG2 3.6Å; Q38-V71 HydrophobicContact CG-CG2 4.5Å; R39-V71 HydrophobicContact CG-CG1 3.72Å; L42-V71 HydrophobicContact CD1-CG2 4.3Å; V67-V71 HydrophobicContact CG1-CG2 4.37Å; V67-V71 WeakPolarHBondContact O-CG2 3.33Å; V67-V71 PolarHBondContact O-N 2.98Å; R68-V71 PolarHBondContact O-N 3.11Å; C69-V71 PolarHBondContact O-N 3.2Å; V71-S75 PolarHBondContact O-N 2.98Å; V71-S75 VanDerWaalsContact O-N 3.09Å
72L93.3Very high92.9Very high48 Ų4848.5 Ų48.525%0.25127%0.265SS..Hα-helixtrans-70-40.4178.5-72.7169.5000112R68 C69 R74 S75 L78 L86R68-L72 HydrophobicContact CG-CD1 4.1Å; R68-L72 WeakPolarHBondContact O-CG 3.48Å; R68-L72 PolarHBondContact O-N 3.13Å; R68-L72 VanDerWaalsContact O-N 3.07Å; C69-L72 PolarHBondContact O-N 2.72Å; L72-R74 PolarHBondContact O-N 2.71Å; L72-S75 WeakPolarHBondContact O-CB 3.4Å; L72-S75 PolarHBondContact O-N 3.3Å; L72-S75 VanDerWaalsContact O-N 3.12Å; L72-S75 PolarHBondContact O-OG 2.95Å; L72-L78 HydrophobicContact CB-CD1 4.08Å; L72-L78 HydrophobicContact CD1-CD1 4.29Å; L72-L86 HydrophobicContact CB-CD2 4.27Å; L72-L86 HydrophobicContact CD1-CD2 3.63Å
73D93.9Very high92.9Very high23 Ų2348.8 Ų48.812%0.12327%0.266CS..Hα-helixtrans-58.4-45.7174.7-169.72.1000111.4C69 Q70 S75 G76 L83 Y87 R142C69-D73 VanDerWaalsContact O-CB 3.23Å; C69-D73 WeakPolarHBondContact O-CB 3.37Å; C69-D73 PolarHBondContact O-N 2.92Å; Q70-D73 PolarHBondContact O-N 3.18Å; D73-S75 VanDerWaalsContact C-N 3.29Å; D73-S75 PolarHBondContact O-N 3.06Å; D73-G76 PolarHBondContact O-N 3.27Å; D73-L83 HydrophobicContact CB-CD1 4.45Å; D73-L83 HydrophobicContact CB-CD2 3.96Å; D73-Y87 HydrophobicContact CB-CE2 4.13Å; D73-Y87 WeakPolarHBondContact CB-OH 3.36Å; D73-Y87 WeakPolarHBondContact OD2-CE2 3.43Å; D73-Y87 PolarHBondContact OD2-OH 3.01Å; D73-R142 IonicContact OD1-CZ 3.92Å; D73-R142 IonicContact OD1-NE 3.58Å; D73-R142 IonicContact OD1-NH2 2.78Å; D73-R142 PolarHBondContact OD1-NH2 2.88Å; D73-R142 IonicContact OD2-CZ 2.62Å; D73-R142 IonicContact OD2-NE 3.65Å; D73-R142 PolarHBondContact OD2-NE 3.3Å; D73-R142 IonicContact OD2-NH2 2.87Å
74R91.8Very high92.9Very high121 Ų12149.3 Ų49.346%0.45727%0.27SS..Hα-helixtrans-70.3-23.2176.4-68.5179.9-161.7150.914113.8K33 Q70 L72 G76K33-R74 PolarHBondContact O-NH1 3.24Å; K33-R74 VanDerWaalsContact O-NH1 3.09Å; Q70-R74 WeakPolarHBondContact O-CG 3.48Å; Q70-R74 PolarHBondContact O-N 2.71Å; L72-R74 PolarHBondContact O-N 2.71Å; R74-G76 PolarHBondContact O-N 2.97Å
75S89.8Confident92.9Very high37 Ų3754 Ų5426%0.25929%0.294SS..Hα-helixtrans-71.4-20.2179.577.40000113.1V71 L72 D73 Q77V71-S75 PolarHBondContact O-N 2.98Å; V71-S75 VanDerWaalsContact O-N 3.09Å; L72-S75 WeakPolarHBondContact O-CB 3.4Å; L72-S75 PolarHBondContact O-N 3.3Å; L72-S75 VanDerWaalsContact O-N 3.12Å; L72-S75 PolarHBondContact O-OG 2.95Å; D73-S75 VanDerWaalsContact C-N 3.29Å; D73-S75 PolarHBondContact O-N 3.06Å; S75-Q77 PolarHBondContact O-N 3.41Å; S75-Q77 WeakPolarHBondContact OG-CB 3.4Å; S75-Q77 WeakPolarHBondContact OG-CG 3.45Å; S75-Q77 PolarHBondContact OG-N 2.87Å
76G87.3Confident92.9Very high65 Ų6555.5 Ų55.567%0.6730%0.302SS*.THydrogen-bonded Turntrans67.210.9-176.800000114.5D73 R74D73-G76 PolarHBondContact O-N 3.27Å; R74-G76 PolarHBondContact O-N 2.97Å
77Q86.4Confident92.9Very high153 Ų15355.7 Ų55.772%0.71530%0.303SS*.  trans-79.5-19.2-176.6-68.2-179.9-24.800114S75S75-Q77 PolarHBondContact O-N 3.41Å; S75-Q77 WeakPolarHBondContact OG-CB 3.4Å; S75-Q77 WeakPolarHBondContact OG-CG 3.45Å; S75-Q77 PolarHBondContact OG-N 2.87Å
78L89.4Confident92.8Very high62 Ų6255.8 Ų55.833%0.32530%0.304SS..SBendtrans-113.3146.5-175.2-66.1177.2000111.2L72 D82 L83 L86L72-L78 HydrophobicContact CB-CD1 4.08Å; L72-L78 HydrophobicContact CD1-CD1 4.29Å; L78-D82 HydrophobicContact CB-CB 4.31Å; L78-D82 HydrophobicContact CD2-CB 4.47Å; L78-L83 HydrophobicContact CB-CD2 3.96Å; L78-L83 HydrophobicContact CB-CG 3.93Å; L78-L83 HydrophobicContact CD1-CD2 4.03Å; L78-L86 HydrophobicContact CD1-CD2 4.11Å
79N91.4Very high92.8Very high115 Ų11555 Ų5562%0.61531%0.314SS*.  trans-71.1161.6174.7-63.4-40.4000111.1D81 D82 L83N79-D81 VanDerWaalsContact C-N 3.26Å; N79-D81 PolarHBondContact O-N 2.92Å; N79-D82 PolarHBondContact O-N 3.36Å; N79-L83 WeakPolarHBondContact O-CG 3.48Å; N79-L83 PolarHBondContact O-N 3.04Å
80G90.2Very high92.8Very high36 Ų3655.3 Ų55.337%0.37132%0.317SS..Hα-helixtrans-56.2-39.4179.700000113.4L83 V84G80-L83 PolarHBondContact O-N 3.39Å; G80-V84 WeakPolarHBondContact O-CG2 3.45Å; G80-V84 PolarHBondContact O-N 3.3Å
81D91.1Very high92.8Very high131 Ų13153.7 Ų53.770%0.70131%0.309SS*.Hα-helixtrans-70-41.8-179.6-62.6-27000112N79 L83 V84 L85N79-D81 VanDerWaalsContact C-N 3.26Å; N79-D81 PolarHBondContact O-N 2.92Å; D81-L83 VanDerWaalsContact C-N 3.3Å; D81-L83 PolarHBondContact O-N 2.93Å; D81-V84 WeakPolarHBondContact O-CB 3.29Å; D81-V84 PolarHBondContact O-N 2.91Å; D81-L85 PolarHBondContact O-N 3.46Å; D81-L85 VanDerWaalsContact O-N 3.08Å
82D93.9Very high92.8Very high74 Ų7454.4 Ų54.440%0.39631%0.314SS..Hα-helixtrans-63.1-38.9175.7-60.8-35.8000111.1L78 N79 L85 L86L78-D82 HydrophobicContact CB-CB 4.31Å; L78-D82 HydrophobicContact CD2-CB 4.47Å; N79-D82 PolarHBondContact O-N 3.36Å; D82-L85 PolarHBondContact O-N 3.46Å; D82-L86 WeakPolarHBondContact O-CB 3.35Å; D82-L86 PolarHBondContact O-N 3.43Å
83L94.4Very high92.8Very high8 Ų857.3 Ų57.34%0.04232%0.321CS..Hα-helixtrans-64.7-41.1174.7-71.2171.2000111.7D73 L78 N79 G80 D81 L85 L86 Y87 L138D73-L83 HydrophobicContact CB-CD1 4.45Å; D73-L83 HydrophobicContact CB-CD2 3.96Å; L78-L83 HydrophobicContact CB-CD2 3.96Å; L78-L83 HydrophobicContact CB-CG 3.93Å; L78-L83 HydrophobicContact CD1-CD2 4.03Å; N79-L83 WeakPolarHBondContact O-CG 3.48Å; N79-L83 PolarHBondContact O-N 3.04Å; G80-L83 PolarHBondContact O-N 3.39Å; D81-L83 VanDerWaalsContact C-N 3.3Å; D81-L83 PolarHBondContact O-N 2.93Å; L83-L85 VanDerWaalsContact C-N 3.32Å; L83-L85 PolarHBondContact O-N 3.13Å; L83-L86 PolarHBondContact O-N 3.17Å; L83-Y87 WeakPolarHBondContact O-CB 3.49Å; L83-Y87 WeakPolarHBondContact O-CD2 3.39Å; L83-Y87 PolarHBondContact O-N 3.22Å; L83-L138 HydrophobicContact CB-CD1 3.71Å; L83-L138 HydrophobicContact CB-CD2 4.5Å; L83-L138 HydrophobicContact CD1-CD2 4.17Å
84V95.4Very high92.8Very high12 Ų1256.3 Ų56.37%0.07332%0.316CS..Hα-helixtrans-59.7-44.6176.3168.30000110.6G80 D81 G88 F130 L135 P136 L138G80-V84 WeakPolarHBondContact O-CG2 3.45Å; G80-V84 PolarHBondContact O-N 3.3Å; D81-V84 WeakPolarHBondContact O-CB 3.29Å; D81-V84 PolarHBondContact O-N 2.91Å; V84-G88 PolarHBondContact O-N 3.05Å; V84-F130 HydrophobicContact CG1-CE1 3.9Å; V84-F130 HydrophobicContact CG1-CZ 4.49Å; V84-F130 WeakPolarHBondContact O-CE1 3.3Å; V84-L135 HydrophobicContact CG1-CB 4.24Å; V84-P136 WeakPolarHBondContact CG1-O 3.31Å; V84-L138 HydrophobicContact CG2-CB 3.93Å; V84-L138 HydrophobicContact CG2-CD1 4.26Å
85L94.6Very high92.8Very high100 Ų10050.7 Ų50.752%0.52430%0.295SS..Hα-helixtrans-65-42.8176.9-66.6176.2000112.2D81 D82 L83 G88 A89 L135D81-L85 PolarHBondContact O-N 3.46Å; D81-L85 VanDerWaalsContact O-N 3.08Å; D82-L85 PolarHBondContact O-N 3.46Å; L83-L85 VanDerWaalsContact C-N 3.32Å; L83-L85 PolarHBondContact O-N 3.13Å; L85-G88 PolarHBondContact O-N 3.22Å; L85-A89 PolarHBondContact O-N 3.23Å; L85-L135 HydrophobicContact CD2-CD1 4.15Å; L85-L135 HydrophobicContact CD2-CD2 4.42Å
86L95.4Very high92.8Very high53 Ų5351.6 Ų51.628%0.27730%0.297SS..Hα-helixtrans-62.9-49.6179.7-177.865.7000111.9C69 L72 L78 D82 L83 G88 A89 A90C69-L86 HydrophobicContact CB-CD2 4.44Å; C69-L86 HydrophobicContact CB-CG 4.5Å; L72-L86 HydrophobicContact CB-CD2 4.27Å; L72-L86 HydrophobicContact CD1-CD2 3.63Å; L78-L86 HydrophobicContact CD1-CD2 4.11Å; D82-L86 WeakPolarHBondContact O-CB 3.35Å; D82-L86 PolarHBondContact O-N 3.43Å; L83-L86 PolarHBondContact O-N 3.17Å; L86-G88 VanDerWaalsContact C-N 3.3Å; L86-G88 PolarHBondContact O-N 3.3Å; L86-A89 PolarHBondContact O-N 2.95Å; L86-A90 PolarHBondContact O-N 3.17Å
87Y96.3Very high92.8Very high4 Ų450.2 Ų50.22%0.01627%0.274CS..Hα-helixtrans-62.9-39174.2-82.4-69.9000111.6C69 D73 L83 A90 L91 L138 C141 R142 C145C69-Y87 HydrophobicContact CB-CD1 3.47Å; C69-Y87 VanDerWaalsContact CB-CD1 3.47Å; C69-Y87 HydrophobicContact CB-CD2 4.46Å; C69-Y87 HydrophobicContact CB-CE1 3.29Å; C69-Y87 HydrophobicContact CB-CE2 4.32Å; C69-Y87 HydrophobicContact CB-CG 4.07Å; D73-Y87 HydrophobicContact CB-CE2 4.13Å; D73-Y87 WeakPolarHBondContact CB-OH 3.36Å; D73-Y87 WeakPolarHBondContact OD2-CE2 3.43Å; D73-Y87 PolarHBondContact OD2-OH 3.01Å; L83-Y87 WeakPolarHBondContact O-CB 3.49Å; L83-Y87 WeakPolarHBondContact O-CD2 3.39Å; L83-Y87 PolarHBondContact O-N 3.22Å; Y87-A90 PolarHBondContact O-N 3.03Å; Y87-L91 WeakPolarHBondContact O-CB 3.4Å; Y87-L91 VanDerWaalsContact O-CG 3.3Å; Y87-L91 WeakPolarHBondContact O-CG 3.5Å; Y87-L91 PolarHBondContact O-N 3.42Å; Y87-L138 HydrophobicContact CD2-CD1 3.95Å; Y87-L138 HydrophobicContact CE2-CD1 4.04Å; Y87-C141 HydrophobicContact CD2-CB 4.08Å; Y87-C141 HydrophobicContact CG-CB 3.95Å; Y87-R142 HydrophobicContact CE2-CG 4.29Å; Y87-C145 HydrophobicContact CD1-CB 3.76Å; Y87-C145 HydrophobicContact CE1-CB 3.6Å
88G94.4Very high92.7Very high3 Ų343.8 Ų43.83%0.03124%0.244CC..Hα-helixtrans-58.2-49.217700000112.4V84 L85 L86 A90 L91 V92V84-G88 PolarHBondContact O-N 3.05Å; L85-G88 PolarHBondContact O-N 3.22Å; L86-G88 VanDerWaalsContact C-N 3.3Å; L86-G88 PolarHBondContact O-N 3.3Å; G88-A90 PolarHBondContact O-N 3.3Å; G88-L91 PolarHBondContact O-N 3.44Å; G88-V92 WeakPolarHBondContact O-CB 3.4Å; G88-V92 WeakPolarHBondContact O-CG2 3.49Å; G88-V92 PolarHBondContact O-N 3.01Å
89A95.2Very high92.4Very high63 Ų6341.3 Ų41.352%0.52123%0.232SC..Hα-helixtrans-58.9-45.2177.400000112.1L85 L86 R93L85-A89 PolarHBondContact O-N 3.23Å; L86-A89 PolarHBondContact O-N 2.95Å; A89-R93 WeakPolarHBondContact O-CB 3.39Å; A89-R93 PolarHBondContact O-N 2.88Å
90A95.7Very high91.9Very high8 Ų842.2 Ų42.27%0.06623%0.233CC..Hα-helixtrans-64.9-44.2179.200000112.4D65 L66 L86 Y87 G88 R93 F94D65-A90 HydrophobicContact CB-CB 4.21Å; L66-A90 HydrophobicContact CD2-CB 3.82Å; L66-A90 HydrophobicContact CG-CB 4.37Å; L86-A90 PolarHBondContact O-N 3.17Å; Y87-A90 PolarHBondContact O-N 3.03Å; G88-A90 PolarHBondContact O-N 3.3Å; A90-R93 PolarHBondContact O-N 3.46Å; A90-F94 WeakPolarHBondContact O-CB 3.44Å; A90-F94 PolarHBondContact O-N 2.9Å
91L94.9Very high91.1Very high2 Ų245.1 Ų45.11%0.0123%0.232CC..Hα-helixtrans-68.2-43.1179.3-72.1170.2000112.3L66 Y87 G88 R93 F94 V95 L126 F130 V148L66-L91 HydrophobicContact CD2-CD2 3.99Å; L66-L91 HydrophobicContact CD2-CG 4.3Å; Y87-L91 WeakPolarHBondContact O-CB 3.4Å; Y87-L91 VanDerWaalsContact O-CG 3.3Å; Y87-L91 WeakPolarHBondContact O-CG 3.5Å; Y87-L91 PolarHBondContact O-N 3.42Å; G88-L91 PolarHBondContact O-N 3.44Å; L91-R93 VanDerWaalsContact C-N 3.34Å; L91-F94 PolarHBondContact O-N 3.26Å; L91-V95 WeakPolarHBondContact O-CG2 3.32Å; L91-V95 PolarHBondContact O-N 2.82Å; L91-L126 HydrophobicContact CD1-CD1 4.48Å; L91-F130 HydrophobicContact CD1-CE2 4.27Å; L91-V148 HydrophobicContact CD2-CB 4.39Å; L91-V148 HydrophobicContact CD2-CG2 3.84Å
92V93.9Very high90.2Very high24 Ų2443.2 Ų43.215%0.14522%0.219CC..Hα-helixtrans-61.9-44.4175.7171.30000110.3G88 V95 N96 R127 F130 T131G88-V92 WeakPolarHBondContact O-CB 3.4Å; G88-V92 WeakPolarHBondContact O-CG2 3.49Å; G88-V92 PolarHBondContact O-N 3.01Å; V92-V95 PolarHBondContact O-N 3.2Å; V92-N96 WeakPolarHBondContact O-CB 3.21Å; V92-N96 VanDerWaalsContact O-CG 3.23Å; V92-N96 PolarHBondContact O-N 2.94Å; V92-N96 PolarHBondContact O-ND2 3.38Å; V92-R127 HydrophobicContact CB-CG 4.44Å; V92-R127 HydrophobicContact CG1-CG 4.32Å; V92-R127 HydrophobicContact CG2-CG 4.16Å; V92-F130 HydrophobicContact CG2-CB 3.75Å; V92-F130 HydrophobicContact CG2-CD2 4.44Å; V92-F130 HydrophobicContact CG2-CG 4.35Å; V92-T131 HydrophobicContact CG1-CG2 4.19Å; V92-T131 HydrophobicContact CG2-CG2 4.23Å
93R92.7Very high89.2Confident110 Ų11043.5 Ų43.542%0.41522%0.218SC..Hα-helixtrans-60.8-45.9176.8-176.8174.1175.578.33.7111.5D65 A89 A90 L91 N96 L97D65-R93 IonicContact OD2-NE 3.16Å; A89-R93 WeakPolarHBondContact O-CB 3.39Å; A89-R93 PolarHBondContact O-N 2.88Å; A90-R93 PolarHBondContact O-N 3.46Å; L91-R93 VanDerWaalsContact C-N 3.34Å; R93-N96 PolarHBondContact O-N 3.25Å; R93-L97 HydrophobicContact CG-CD1 3.6Å; R93-L97 HydrophobicContact CG-CG 4.2Å; R93-L97 WeakPolarHBondContact O-CB 3.41Å; R93-L97 VanDerWaalsContact O-CG 3.26Å; R93-L97 WeakPolarHBondContact O-CG 3.38Å; R93-L97 PolarHBondContact O-N 3.08Å
94F93.8Very high88Confident1 Ų144.5 Ų44.50%0.00423%0.23CC..Hα-helixtrans-56.6-55.1175.2165.3-99.1000112C62 A90 L91 N96 L97 I98 I119 V148 W151 L152C62-F94 HydrophobicContact CB-CB 4.36Å; C62-F94 HydrophobicContact CB-CD2 4.04Å; A90-F94 WeakPolarHBondContact O-CB 3.44Å; A90-F94 PolarHBondContact O-N 2.9Å; L91-F94 PolarHBondContact O-N 3.26Å; F94-N96 VanDerWaalsContact C-N 3.32Å; F94-N96 PolarHBondContact O-N 2.59Å; F94-L97 PolarHBondContact O-N 3.41Å; F94-I98 HydrophobicContact CD2-CG1 3.76Å; F94-I98 HydrophobicContact CE2-CD1 4.36Å; F94-I98 HydrophobicContact CE2-CG1 3.57Å; F94-I98 HydrophobicContact CZ-CG1 4.18Å; F94-I98 WeakPolarHBondContact O-CB 3.45Å; F94-I98 WeakPolarHBondContact O-CG1 3.33Å; F94-I98 PolarHBondContact O-N 2.87Å; F94-I119 HydrophobicContact CE1-CD1 4.3Å; F94-I119 HydrophobicContact CZ-CD1 4.07Å; F94-V148 HydrophobicContact CB-CG1 4.39Å; F94-V148 HydrophobicContact CD1-CB 4.34Å; F94-V148 HydrophobicContact CD1-CG1 3.49Å; F94-V148 VanDerWaalsContact CD1-CG1 3.49Å; F94-V148 HydrophobicContact CD1-CG2 3.81Å; F94-V148 HydrophobicContact CD2-CG1 3.56Å; F94-V148 HydrophobicContact CE1-CB 4.25Å; F94-V148 HydrophobicContact CE1-CG1 3.53Å; F94-V148 HydrophobicContact CE1-CG2 3.69Å; F94-V148 HydrophobicContact CE2-CG1 3.56Å; F94-V148 HydrophobicContact CG-CG1 3.52Å; F94-V148 HydrophobicContact CZ-CG1 3.57Å; F94-V148 HydrophobicContact CZ-CG2 4.38Å; F94-W151 AromaticContact CE2-CE3 3.82Å; F94-W151 HydrophobicContact CE2-CE3 3.82Å; F94-W151 AromaticContact CE2-CZ3 3.75Å; F94-W151 HydrophobicContact CE2-CZ3 3.75Å; F94-W151 HydrophobicContact CZ-CD2 4.37Å; F94-W151 AromaticContact CZ-CE3 3.64Å; F94-W151 HydrophobicContact CZ-CE3 3.64Å; F94-W151 AromaticContact CZ-CZ3 3.81Å; F94-W151 HydrophobicContact CZ-CZ3 3.81Å; F94-L152 HydrophobicContact CD2-CD1 4.2Å; F94-L152 HydrophobicContact CD2-CD2 4.43Å; F94-L152 HydrophobicContact CD2-CG 4.47Å; F94-L152 HydrophobicContact CE2-CD1 4.16Å; F94-L152 HydrophobicContact CE2-CD2 3.92Å; F94-L152 HydrophobicContact CE2-CG 3.95Å
95V91.5Very high86.5Confident4 Ų454.4 Ų54.42%0.02427%0.266CS..Hα-helixtrans-61-44.7-176.9173.50000110.5L91 V92 T99 L110 V123 R127L91-V95 WeakPolarHBondContact O-CG2 3.32Å; L91-V95 PolarHBondContact O-N 2.82Å; V92-V95 PolarHBondContact O-N 3.2Å; V95-T99 WeakPolarHBondContact O-CB 3.49Å; V95-T99 VanDerWaalsContact O-CG2 3.29Å; V95-T99 WeakPolarHBondContact O-CG2 3.4Å; V95-T99 PolarHBondContact O-N 2.93Å; V95-T99 VanDerWaalsContact O-N 3.15Å; V95-T99 PolarHBondContact O-OG1 3.3Å; V95-L110 HydrophobicContact CG1-CD1 4.03Å; V95-L110 HydrophobicContact CG1-CD2 3.76Å; V95-L110 HydrophobicContact CG1-CG 4.15Å; V95-V123 HydrophobicContact CG2-CG1 4.17Å; V95-R127 HydrophobicContact CB-CB 4.09Å; V95-R127 HydrophobicContact CB-CG 4.1Å; V95-R127 HydrophobicContact CG1-CB 4.08Å; V95-R127 HydrophobicContact CG1-CG 4.02Å; V95-R127 HydrophobicContact CG2-CB 4.1Å
96N90.2Very high85.2Confident56 Ų5658.2 Ų58.230%0.29928%0.279SS..Hα-helixtrans-64-51.3-179.7-70.5-12.7000111.6V92 R93 F94 I98 T99 E100 R127V92-N96 WeakPolarHBondContact O-CB 3.21Å; V92-N96 VanDerWaalsContact O-CG 3.23Å; V92-N96 PolarHBondContact O-N 2.94Å; V92-N96 PolarHBondContact O-ND2 3.38Å; R93-N96 PolarHBondContact O-N 3.25Å; F94-N96 VanDerWaalsContact C-N 3.32Å; F94-N96 PolarHBondContact O-N 2.59Å; N96-I98 PolarHBondContact O-N 3.4Å; N96-T99 PolarHBondContact O-N 3.44Å; N96-T99 PolarHBondContact O-OG1 2.95Å; N96-E100 WeakPolarHBondContact O-CB 3.48Å; N96-E100 PolarHBondContact O-N 3.49Å; N96-R127 PolarHBondContact OD1-NE 3.16Å; N96-R127 VanDerWaalsContact OD1-NE 3.16Å
97L87Confident84.1Confident35 Ų3560 Ų6018%0.18330%0.302CS..Hα-helixtrans-68.2-35.9-174.2-66175.5000113.2V58 R93 F94V58-L97 HydrophobicContact CG1-CB 3.48Å; V58-L97 VanDerWaalsContact CG1-CB 3.48Å; V58-L97 HydrophobicContact CG1-CD1 3.96Å; V58-L97 HydrophobicContact CG1-CG 4.35Å; R93-L97 HydrophobicContact CG-CD1 3.6Å; R93-L97 HydrophobicContact CG-CG 4.2Å; R93-L97 WeakPolarHBondContact O-CB 3.41Å; R93-L97 VanDerWaalsContact O-CG 3.26Å; R93-L97 WeakPolarHBondContact O-CG 3.38Å; R93-L97 PolarHBondContact O-N 3.08Å; F94-L97 PolarHBondContact O-N 3.41Å
98I84.7Confident83.4Confident18 Ų1863.9 Ų63.99%0.09232%0.316CS..Hα-helixtrans-72-36.9178.4-67.3-62.5000111.5V58 F94 N96 L117 I119 W151V58-I98 HydrophobicContact CG1-CD1 4.1Å; F94-I98 HydrophobicContact CD2-CG1 3.76Å; F94-I98 HydrophobicContact CE2-CD1 4.36Å; F94-I98 HydrophobicContact CE2-CG1 3.57Å; F94-I98 HydrophobicContact CZ-CG1 4.18Å; F94-I98 WeakPolarHBondContact O-CB 3.45Å; F94-I98 WeakPolarHBondContact O-CG1 3.33Å; F94-I98 PolarHBondContact O-N 2.87Å; N96-I98 PolarHBondContact O-N 3.4Å; I98-L117 HydrophobicContact CG2-CD1 3.43Å; I98-L117 VanDerWaalsContact CG2-CD1 3.43Å; I98-I119 HydrophobicContact CG2-CD1 4.03Å; I98-W151 HydrophobicContact CD1-CZ3 4.49Å; I98-W151 HydrophobicContact CG2-CH2 4.07Å
99T82.9Confident82.8Confident10 Ų1067.9 Ų67.96%0.06134%0.342CS..Hα-helixtrans-83.8-29.1-179.359.10000113.7V95 N96 R101 Q102 Q103 L110 L113V95-T99 WeakPolarHBondContact O-CB 3.49Å; V95-T99 VanDerWaalsContact O-CG2 3.29Å; V95-T99 WeakPolarHBondContact O-CG2 3.4Å; V95-T99 PolarHBondContact O-N 2.93Å; V95-T99 VanDerWaalsContact O-N 3.15Å; V95-T99 PolarHBondContact O-OG1 3.3Å; N96-T99 PolarHBondContact O-N 3.44Å; N96-T99 PolarHBondContact O-OG1 2.95Å; T99-R101 VanDerWaalsContact C-N 3.29Å; T99-R101 PolarHBondContact O-N 3.09Å; T99-Q102 CarbonylContact O-C 3.57Å; T99-Q102 PolarHBondContact O-N 3.27Å; T99-Q103 PolarHBondContact O-N 2.97Å; T99-L110 HydrophobicContact CG2-CD1 3.33Å; T99-L110 HydrophobicContact CG2-CG 4.4Å; T99-L110 WeakPolarHBondContact OG1-CD1 3.33Å; T99-L113 HydrophobicContact CG2-CB 4.18Å
100E82.6Confident82.1Confident135 Ų13567 Ų6763%0.63133%0.328SS*.Hα-helixtrans-59.1-41.3172.7-176.1170.4-162.300111.1N96 Q102 Q103N96-E100 WeakPolarHBondContact O-CB 3.48Å; N96-E100 PolarHBondContact O-N 3.49Å; E100-Q102 PolarHBondContact O-N 3.47Å; E100-Q103 WeakPolarHBondContact O-CB 3.4Å; E100-Q103 PolarHBondContact O-N 2.94Å
101R72.9Confident81.6Confident97 Ų9771.9 Ų71.937%0.36634%0.344SS..THydrogen-bonded Turntrans-63.1-20.7173.8-73.5-174.9178-119.52.6114.6V58 T99V58-R101 VanDerWaalsContact CG2-NH2 3.31Å; T99-R101 VanDerWaalsContact C-N 3.29Å; T99-R101 PolarHBondContact O-N 3.09Å
102Q71.3Confident81Confident91 Ų9179.3 Ų79.343%0.42537%0.372SS..THydrogen-bonded Turntrans-99.71.7178.6-62.8-62.1-37.600112.3T99 E100 G104 L113 L117T99-Q102 CarbonylContact O-C 3.57Å; T99-Q102 PolarHBondContact O-N 3.27Å; E100-Q102 PolarHBondContact O-N 3.47Å; Q102-G104 PolarHBondContact O-N 3.37Å; Q102-L113 HydrophobicContact CB-CD2 4.07Å; Q102-L113 WeakPolarHBondContact O-CD2 3.31Å; Q102-L117 HydrophobicContact CG-CD1 3.98Å; Q102-L117 HydrophobicContact CG-CD2 4.17Å; Q102-L117 HydrophobicContact CG-CG 4.35Å
103Q74.2Confident80.5Confident79 Ų7978.4 Ų78.437%0.36937%0.367SS..  trans-81.5117.1-179.9-163.675.9-52.600109.1T99 E100 R108T99-Q103 PolarHBondContact O-N 2.97Å; E100-Q103 WeakPolarHBondContact O-CB 3.4Å; E100-Q103 PolarHBondContact O-N 2.94Å; Q103-R108 PolarHBondContact NE2-O 3.38Å; Q103-R108 PolarHBondContact OE1-O 3.03Å
104G67.4Low80Confident29 Ų2973.2 Ų73.230%0.29935%0.347SS..  trans-81.9-173.1173.100000112.5Q102 K106Q102-G104 PolarHBondContact O-N 3.37Å; G104-K106 CarbonylContact O-C 3.53Å; G104-K106 PolarHBondContact O-N 2.9Å
105R64.2Low79.4Confident221 Ų22175.4 Ų75.483%0.83437%0.371SS*.SBendtrans-53.5-22.5177.6-65.7-175.2-172.6-170.71.6115E176R105-E176 IonicContact CZ-OE1 3.43Å; R105-E176 VanDerWaalsContact CZ-OE1 3.27Å; R105-E176 IonicContact NE-OE1 2.73Å; R105-E176 PolarHBondContact NE-OE1 2.87Å; R105-E176 IonicContact NH2-OE1 3.1Å; R105-E176 PolarHBondContact NH2-OE1 2.94Å; R105-E176 IonicContact NH2-OE2 2.79Å
106K67.5Low79Confident179 Ų17981.2 Ų81.278%0.77840%0.395SS*.SBendtrans-109.4132173.2-67-179-179.7176.50109.2G104 R108G104-K106 CarbonylContact O-C 3.53Å; G104-K106 PolarHBondContact O-N 2.9Å; K106-R108 PolarHBondContact O-N 2.96Å; K106-R108 VanDerWaalsContact O-N 3.17Å
107A73.2Confident78.7Confident92 Ų9279.6 Ų79.676%0.7639%0.387SS*.PPolyproline II helixtrans-59.8118.2176.400000110.8
108R80.5Confident78.6Confident84 Ų8483.8 Ų83.832%0.31741%0.409SS..PPolyproline II helixtrans-102146.4174.4-66.1175.5177175.5-1.6109.5Q103 K106 L113Q103-R108 PolarHBondContact NE2-O 3.38Å; Q103-R108 PolarHBondContact OE1-O 3.03Å; K106-R108 PolarHBondContact O-N 2.96Å; K106-R108 VanDerWaalsContact O-N 3.17Å; R108-L113 HydrophobicContact CB-CD2 4.03Å; R108-L113 HydrophobicContact CB-CG 4.28Å
109P83.3Confident78.8Confident88 Ų8883.4 Ų83.457%0.57141%0.407SS*.PPolyproline II helixtrans-63139.2176.8-22.432.9000112.4R111 R112 L113P109-R111 VanDerWaalsContact C-N 3.3Å; P109-R111 PolarHBondContact O-N 3.45Å; P109-R112 WeakPolarHBondContact O-CB 3.18Å; P109-R112 PolarHBondContact O-N 3.3Å; P109-L113 PolarHBondContact O-N 3.47Å
110L80.3Confident79.1Confident44 Ų4485.1 Ų85.123%0.2342%0.418CS..Hα-helixtrans-55.1-40.8-176.2-169.464.6000113.7V95 T99 R112 L113 A114 V124V95-L110 HydrophobicContact CG1-CD1 4.03Å; V95-L110 HydrophobicContact CG1-CD2 3.76Å; V95-L110 HydrophobicContact CG1-CG 4.15Å; T99-L110 HydrophobicContact CG2-CD1 3.33Å; T99-L110 HydrophobicContact CG2-CG 4.4Å; T99-L110 WeakPolarHBondContact OG1-CD1 3.33Å; L110-R112 VanDerWaalsContact C-N 3.3Å; L110-R112 PolarHBondContact O-N 3.28Å; L110-L113 PolarHBondContact O-N 2.83Å; L110-A114 PolarHBondContact O-N 2.94Å; L110-V124 HydrophobicContact CB-CG1 4.19Å; L110-V124 HydrophobicContact CD2-CG1 3.56Å; L110-V124 HydrophobicContact CG-CG1 3.65Å
111R83.4Confident79.4Confident110 Ų11083.9 Ų83.942%0.41541%0.413SS..Hα-helixtrans-58.6-40176.3-66.3176.2-175.2-84.4-8.8112.4P109 G115 E121 V124 D125P109-R111 VanDerWaalsContact C-N 3.3Å; P109-R111 PolarHBondContact O-N 3.45Å; R111-G115 PolarHBondContact O-N 3.2Å; R111-E121 WeakPolarHBondContact CD-OE1 3.23Å; R111-E121 HydrophobicContact CG-CG 4.46Å; R111-E121 IonicContact CZ-OE1 3.36Å; R111-E121 IonicContact NE-OE1 3.6Å; R111-E121 IonicContact NH1-OE1 3.79Å; R111-E121 PolarHBondContact NH1-OE1 3.28Å; R111-V124 HydrophobicContact CG-CG1 4.27Å; R111-D125 IonicContact CZ-OD1 2.83Å; R111-D125 IonicContact NH1-OD1 4Å; R111-D125 PolarHBondContact NH1-OD1 2.7Å; R111-D125 IonicContact NH1-OD2 2.76Å; R111-D125 IonicContact NH2-OD1 3.27Å; R111-D125 PolarHBondContact NH2-OD1 3.01Å
112R82.9Confident80.3Confident158 Ų15882.4 Ų82.460%0.59641%0.407SS*.Hα-helixtrans-69.2-37.6179.7-173.2177.7176.3173.6-1.4111.4P109 L110 K116P109-R112 WeakPolarHBondContact O-CB 3.18Å; P109-R112 PolarHBondContact O-N 3.3Å; L110-R112 VanDerWaalsContact C-N 3.3Å; L110-R112 PolarHBondContact O-N 3.28Å; R112-K116 PolarHBondContact O-N 3.11Å
113L83.1Confident81.3Confident5 Ų578.1 Ų78.13%0.02639%0.387CS..Hα-helixtrans-67.9-46.9176.2-62.1174.8000111.1T99 Q102 R108 P109 L110 G115 K116 L117T99-L113 HydrophobicContact CG2-CB 4.18Å; Q102-L113 HydrophobicContact CB-CD2 4.07Å; Q102-L113 WeakPolarHBondContact O-CD2 3.31Å; R108-L113 HydrophobicContact CB-CD2 4.03Å; R108-L113 HydrophobicContact CB-CG 4.28Å; P109-L113 PolarHBondContact O-N 3.47Å; L110-L113 PolarHBondContact O-N 2.83Å; L113-G115 VanDerWaalsContact C-N 3.3Å; L113-G115 PolarHBondContact O-N 3.1Å; L113-K116 WeakPolarHBondContact O-CB 3.4Å; L113-K116 PolarHBondContact O-N 3.28Å; L113-K116 VanDerWaalsContact O-N 3.16Å; L113-L117 PolarHBondContact O-N 3.1Å
114A83.1Confident82.1Confident1 Ų174.7 Ų74.71%0.00837%0.372CS..Hα-helixtrans-59.5-40.4176.100000112.5L110 K116 L117 N118 I119 V124L110-A114 PolarHBondContact O-N 2.94Å; A114-K116 VanDerWaalsContact C-N 3.31Å; A114-K116 PolarHBondContact O-N 3.09Å; A114-L117 CarbonylContact O-C 3.57Å; A114-L117 PolarHBondContact O-N 3.5Å; A114-L117 VanDerWaalsContact O-N 3.13Å; A114-N118 PolarHBondContact O-N 3.31Å; A114-I119 HydrophobicContact CB-CB 4.06Å; A114-I119 HydrophobicContact CB-CG2 4.42Å; A114-I119 PolarHBondContact O-N 2.98Å; A114-V124 HydrophobicContact CB-CG2 3.32Å
115G82.1Confident83.2Confident48 Ų4875.4 Ų75.450%0.49537%0.369SS..Hα-helixtrans-60.6-36.6175.900000113.5R111 L113 L117 N118R111-G115 PolarHBondContact O-N 3.2Å; L113-G115 VanDerWaalsContact C-N 3.3Å; L113-G115 PolarHBondContact O-N 3.1Å; G115-L117 VanDerWaalsContact C-N 3.34Å; G115-N118 PolarHBondContact O-N 3.5Å
116K83.2Confident84.5Confident125 Ų12565.2 Ų65.254%0.54333%0.331SS..Hα-helixtrans-67.6-34.8174.3-72.7-173.5170.6-157.70112.9R112 L113 A114 N118R112-K116 PolarHBondContact O-N 3.11Å; L113-K116 WeakPolarHBondContact O-CB 3.4Å; L113-K116 PolarHBondContact O-N 3.28Å; L113-K116 VanDerWaalsContact O-N 3.16Å; A114-K116 VanDerWaalsContact C-N 3.31Å; A114-K116 PolarHBondContact O-N 3.09Å; K116-N118 PolarHBondContact O-N 3.02Å
117L82.3Confident85.7Confident23 Ų2359.1 Ų59.112%0.1230%0.303CS..THydrogen-bonded Turntrans-85.27.1-179.8-64.9178.5000113.2I98 Q102 L113 A114 G115 I119 W151I98-L117 HydrophobicContact CG2-CD1 3.43Å; I98-L117 VanDerWaalsContact CG2-CD1 3.43Å; Q102-L117 HydrophobicContact CG-CD1 3.98Å; Q102-L117 HydrophobicContact CG-CD2 4.17Å; Q102-L117 HydrophobicContact CG-CG 4.35Å; L113-L117 PolarHBondContact O-N 3.1Å; A114-L117 CarbonylContact O-C 3.57Å; A114-L117 PolarHBondContact O-N 3.5Å; A114-L117 VanDerWaalsContact O-N 3.13Å; G115-L117 VanDerWaalsContact C-N 3.34Å; L117-I119 HydrophobicContact CB-CD1 3.94Å; L117-I119 HydrophobicContact CB-CG1 3.93Å; L117-I119 HydrophobicContact CD1-CD1 3.91Å; L117-I119 PolarHBondContact O-N 3.34Å; L117-I119 VanDerWaalsContact O-N 3.12Å; L117-W151 HydrophobicContact CB-CZ2 4.11Å; L117-W151 PolarHBondContact O-NE1 2.89Å
118N85.6Confident86.5Confident122 Ų12257.8 Ų57.865%0.65228%0.281SS*.THydrogen-bonded Turntrans54.426.6-172.6-60.1-45.5000113.9A114 G115 K116A114-N118 PolarHBondContact O-N 3.31Å; G115-N118 PolarHBondContact O-N 3.5Å; K116-N118 PolarHBondContact O-N 3.02Å
119I88.3Confident87Confident11 Ų1155.8 Ų55.86%0.05628%0.276CS..  trans-81.5125.6173.8-62.1172000107.9F94 I98 A114 L117 E121 V123 W151F94-I119 HydrophobicContact CE1-CD1 4.3Å; F94-I119 HydrophobicContact CZ-CD1 4.07Å; I98-I119 HydrophobicContact CG2-CD1 4.03Å; A114-I119 HydrophobicContact CB-CB 4.06Å; A114-I119 HydrophobicContact CB-CG2 4.42Å; A114-I119 PolarHBondContact O-N 2.98Å; L117-I119 HydrophobicContact CB-CD1 3.94Å; L117-I119 HydrophobicContact CB-CG1 3.93Å; L117-I119 HydrophobicContact CD1-CD1 3.91Å; L117-I119 PolarHBondContact O-N 3.34Å; L117-I119 VanDerWaalsContact O-N 3.12Å; I119-E121 PolarHBondContact O-N 3.28Å; I119-V123 HydrophobicContact CG2-CB 4.17Å; I119-V123 HydrophobicContact CG2-CG1 4.31Å; I119-W151 HydrophobicContact CD1-CH2 4.29Å; I119-W151 HydrophobicContact CD1-CZ2 3.95Å; I119-W151 HydrophobicContact CG1-CD2 4.09Å; I119-W151 HydrophobicContact CG1-CG 4.41Å; I119-W151 HydrophobicContact CG1-CZ2 3.9Å
120P88.9Confident87.4Confident45 Ų4553 Ų5329%0.29226%0.256SS..  trans-58.6134.3-178.8-2634.9000112.7W122 V123 V147P120-W122 HydrophobicContact CB-CG 4.47Å; P120-W122 VanDerWaalsContact CB-NE1 3.27Å; P120-W122 PolarHBondContact O-N 3.12Å; P120-W122 VanDerWaalsContact O-N 3.14Å; P120-V123 HydrophobicContact CB-CG2 4.25Å; P120-V123 WeakPolarHBondContact O-CB 3.19Å; P120-V123 PolarHBondContact O-N 3.26Å; P120-V147 HydrophobicContact CG-CG1 4.04Å
121E88.8Confident87.8Confident109 Ų10953.7 Ų53.751%0.50926%0.262SS..Hα-helixtrans-57.3-35.4-174-170.3173.7-171.100113.2R111 I119 V123 V124 D125R111-E121 WeakPolarHBondContact CD-OE1 3.23Å; R111-E121 HydrophobicContact CG-CG 4.46Å; R111-E121 IonicContact CZ-OE1 3.36Å; R111-E121 IonicContact NE-OE1 3.6Å; R111-E121 IonicContact NH1-OE1 3.79Å; R111-E121 PolarHBondContact NH1-OE1 3.28Å; I119-E121 PolarHBondContact O-N 3.28Å; E121-V123 PolarHBondContact O-N 3.41Å; E121-V124 WeakPolarHBondContact O-CA 3.48Å; E121-V124 VanDerWaalsContact O-CB 3.27Å; E121-V124 WeakPolarHBondContact O-CB 3.37Å; E121-V124 PolarHBondContact O-N 3.33Å; E121-D125 PolarHBondContact O-N 3.08Å
122W92.2Very high87.9Confident66 Ų6654.7 Ų54.725%0.2527%0.271CS..Hα-helixtrans-65.2-20.4177.868.7-92.7000113.6P120 D125 L126 W140 K143 V147P120-W122 HydrophobicContact CB-CG 4.47Å; P120-W122 VanDerWaalsContact CB-NE1 3.27Å; P120-W122 PolarHBondContact O-N 3.12Å; P120-W122 VanDerWaalsContact O-N 3.14Å; W122-D125 WeakPolarHBondContact O-CB 3.23Å; W122-D125 PolarHBondContact O-N 3.23Å; W122-L126 HydrophobicContact CE3-CD1 3.85Å; W122-L126 HydrophobicContact CE3-CG 4.23Å; W122-L126 HydrophobicContact CZ3-CD1 3.53Å; W122-L126 HydrophobicContact CZ3-CG 4.4Å; W122-L126 WeakPolarHBondContact O-CG 3.47Å; W122-L126 PolarHBondContact O-N 2.98Å; W122-W140 HydrophobicContact CD2-CZ3 4.39Å; W122-W140 HydrophobicContact CE3-CE3 4.14Å; W122-W140 AromaticContact CE3-CZ3 3.88Å; W122-W140 HydrophobicContact CE3-CZ3 3.88Å; W122-W140 HydrophobicContact CZ3-CE3 4.15Å; W122-W140 HydrophobicContact CZ3-CZ3 4.19Å; W122-K143 HydrophobicContact CH2-CD 4.35Å; W122-K143 HydrophobicContact CH2-CG 3.95Å; W122-V147 HydrophobicContact CH2-CB 4.13Å; W122-V147 HydrophobicContact CH2-CG2 4.05Å; W122-V147 HydrophobicContact CZ2-CB 4.04Å; W122-V147 HydrophobicContact CZ2-CG1 4.02Å; W122-V147 HydrophobicContact CZ2-CG2 3.82Å
123V92.5Very high88Confident2 Ų253.3 Ų53.31%0.01227%0.269CS..Hα-helixtrans-71.7-35.6171.7178.30000110.3V95 I119 P120 E121 D125 L126 R127 V147 V148V95-V123 HydrophobicContact CG2-CG1 4.17Å; I119-V123 HydrophobicContact CG2-CB 4.17Å; I119-V123 HydrophobicContact CG2-CG1 4.31Å; P120-V123 HydrophobicContact CB-CG2 4.25Å; P120-V123 WeakPolarHBondContact O-CB 3.19Å; P120-V123 PolarHBondContact O-N 3.26Å; E121-V123 PolarHBondContact O-N 3.41Å; V123-D125 VanDerWaalsContact C-N 3.34Å; V123-L126 WeakPolarHBondContact O-CB 3.17Å; V123-L126 PolarHBondContact O-N 3.19Å; V123-R127 PolarHBondContact O-N 3.08Å; V123-V147 HydrophobicContact CG2-CG1 4.3Å; V123-V148 HydrophobicContact CG1-CG2 3.73Å
124V90.9Very high88.2Confident7 Ų762 Ų624%0.04231%0.306CS..Hα-helixtrans-68.2-38.6171.7-175.40000110.5L110 R111 A114 E121 L126 R127 H128L110-V124 HydrophobicContact CB-CG1 4.19Å; L110-V124 HydrophobicContact CD2-CG1 3.56Å; L110-V124 HydrophobicContact CG-CG1 3.65Å; R111-V124 HydrophobicContact CG-CG1 4.27Å; A114-V124 HydrophobicContact CB-CG2 3.32Å; E121-V124 WeakPolarHBondContact O-CA 3.48Å; E121-V124 VanDerWaalsContact O-CB 3.27Å; E121-V124 WeakPolarHBondContact O-CB 3.37Å; E121-V124 PolarHBondContact O-N 3.33Å; V124-L126 VanDerWaalsContact C-N 3.32Å; V124-L126 PolarHBondContact O-N 3.21Å; V124-R127 WeakPolarHBondContact O-CB 3.47Å; V124-R127 PolarHBondContact O-N 3.13Å; V124-H128 PolarHBondContact O-N 3.36Å
125D91.1Very high88.5Confident44 Ų4466.2 Ų66.224%0.23533%0.328CS..Hα-helixtrans-60.3-41.9172.9-66.1-37.8000111.6R111 E121 W122 V123 R127 H128 D129R111-D125 IonicContact CZ-OD1 2.83Å; R111-D125 IonicContact NH1-OD1 4Å; R111-D125 PolarHBondContact NH1-OD1 2.7Å; R111-D125 IonicContact NH1-OD2 2.76Å; R111-D125 IonicContact NH2-OD1 3.27Å; R111-D125 PolarHBondContact NH2-OD1 3.01Å; E121-D125 PolarHBondContact O-N 3.08Å; W122-D125 WeakPolarHBondContact O-CB 3.23Å; W122-D125 PolarHBondContact O-N 3.23Å; V123-D125 VanDerWaalsContact C-N 3.34Å; D125-R127 VanDerWaalsContact C-N 3.34Å; D125-R127 PolarHBondContact O-N 2.89Å; D125-H128 CarbonylContact O-C 3.3Å; D125-H128 WeakPolarHBondContact O-CA 3.48Å; D125-H128 WeakPolarHBondContact O-CB 3.49Å; D125-H128 PolarHBondContact O-N 2.8Å; D125-D129 VanDerWaalsContact O-CG 3.25Å; D125-D129 PolarHBondContact O-N 3.2Å
126L91.8Very high89Confident7 Ų764.7 Ų64.74%0.03731%0.31CS..Hα-helixtrans-57.1-45.6174.1-77.3178.4000112.1L91 W122 V123 V124 H128 D129 F130 P136 W140L91-L126 HydrophobicContact CD1-CD1 4.48Å; W122-L126 HydrophobicContact CE3-CD1 3.85Å; W122-L126 HydrophobicContact CE3-CG 4.23Å; W122-L126 HydrophobicContact CZ3-CD1 3.53Å; W122-L126 HydrophobicContact CZ3-CG 4.4Å; W122-L126 WeakPolarHBondContact O-CG 3.47Å; W122-L126 PolarHBondContact O-N 2.98Å; V123-L126 WeakPolarHBondContact O-CB 3.17Å; V123-L126 PolarHBondContact O-N 3.19Å; V124-L126 VanDerWaalsContact C-N 3.32Å; V124-L126 PolarHBondContact O-N 3.21Å; L126-H128 VanDerWaalsContact C-N 3.29Å; L126-H128 PolarHBondContact O-N 2.66Å; L126-D129 PolarHBondContact O-N 3.05Å; L126-F130 WeakPolarHBondContact O-CD2 3.25Å; L126-F130 PolarHBondContact O-N 3.16Å; L126-P136 HydrophobicContact CD2-CB 3.83Å; L126-P136 HydrophobicContact CD2-CG 3.67Å; L126-W140 HydrophobicContact CD2-CB 4.16Å
127R92.4Very high89.5Confident50 Ų5063 Ų6319%0.18931%0.31CS..Hα-helixtrans-57.7-44.7174.3173.8-86.6-177.6-136.89.3110.9V92 V95 N96 V123 V124 D125 D129 F130 T131 H132V92-R127 HydrophobicContact CB-CG 4.44Å; V92-R127 HydrophobicContact CG1-CG 4.32Å; V92-R127 HydrophobicContact CG2-CG 4.16Å; V95-R127 HydrophobicContact CB-CB 4.09Å; V95-R127 HydrophobicContact CB-CG 4.1Å; V95-R127 HydrophobicContact CG1-CB 4.08Å; V95-R127 HydrophobicContact CG1-CG 4.02Å; V95-R127 HydrophobicContact CG2-CB 4.1Å; N96-R127 PolarHBondContact OD1-NE 3.16Å; N96-R127 VanDerWaalsContact OD1-NE 3.16Å; V123-R127 PolarHBondContact O-N 3.08Å; V124-R127 WeakPolarHBondContact O-CB 3.47Å; V124-R127 PolarHBondContact O-N 3.13Å; D125-R127 VanDerWaalsContact C-N 3.34Å; D125-R127 PolarHBondContact O-N 2.89Å; R127-D129 VanDerWaalsContact C-N 3.33Å; R127-F130 PolarHBondContact O-N 3.38Å; R127-T131 PolarHBondContact NH1-OG1 3.13Å; R127-T131 WeakPolarHBondContact O-CG2 3.39Å; R127-T131 PolarHBondContact O-N 3Å; R127-T131 PolarHBondContact O-OG1 3.05Å; R127-H132 PolarHBondContact NH1-NE2 3.02Å
128H90.6Very high90.1Very high65 Ų6563.4 Ų63.430%0.30131%0.312SS..Hα-helixtrans-62.7-42.1178.7-175.877.5000111.2V124 D125 L126 F130 T131 H132 K133V124-H128 PolarHBondContact O-N 3.36Å; D125-H128 CarbonylContact O-C 3.3Å; D125-H128 WeakPolarHBondContact O-CA 3.48Å; D125-H128 WeakPolarHBondContact O-CB 3.49Å; D125-H128 PolarHBondContact O-N 2.8Å; L126-H128 VanDerWaalsContact C-N 3.29Å; L126-H128 PolarHBondContact O-N 2.66Å; H128-F130 PolarHBondContact O-N 3.36Å; H128-T131 PolarHBondContact O-N 3.26Å; H128-T131 PolarHBondContact O-OG1 3.16Å; H128-T131 VanDerWaalsContact O-OG1 3.08Å; H128-H132 AromaticContact CE1-CD2 3.89Å; H128-H132 AromaticContact ND1-CD2 3.64Å; H128-H132 PolarHBondContact O-N 3.05Å; H128-K133 VanDerWaalsContact CD2-CE 3.4Å; H128-K133 WeakPolarHBondContact CD2-CE 3.36Å; H128-K133 WeakPolarHBondContact NE2-CE 3.11Å
129D91Very high90.5Very high41 Ų4165.7 Ų65.722%0.21932%0.316CS..Hα-helixtrans-61.3-43.7178.6-68.1-16.1000112.5D125 L126 R127 T131 K133 P136D125-D129 VanDerWaalsContact O-CG 3.25Å; D125-D129 PolarHBondContact O-N 3.2Å; L126-D129 PolarHBondContact O-N 3.05Å; R127-D129 VanDerWaalsContact C-N 3.33Å; D129-T131 VanDerWaalsContact C-N 3.28Å; D129-T131 PolarHBondContact O-N 3.01Å; D129-K133 CarbonylContact O-C 3.57Å; D129-K133 VanDerWaalsContact O-C 3.23Å; D129-K133 PolarHBondContact O-N 3.3Å; D129-K133 WeakPolarHBondContact OD1-CD 3.43Å; D129-K133 IonicContact OD1-NZ 3.98Å; D129-P136 HydrophobicContact CB-CG 3.85Å
130F91.4Very high90.8Very high31 Ų3170.9 Ų70.914%0.13634%0.335CS..Hα-helixtrans-64.6-28.9177-81.9-67000114.3V84 L91 V92 L126 R127 H128 L135 P136V84-F130 HydrophobicContact CG1-CE1 3.9Å; V84-F130 HydrophobicContact CG1-CZ 4.49Å; V84-F130 WeakPolarHBondContact O-CE1 3.3Å; L91-F130 HydrophobicContact CD1-CE2 4.27Å; V92-F130 HydrophobicContact CG2-CB 3.75Å; V92-F130 HydrophobicContact CG2-CD2 4.44Å; V92-F130 HydrophobicContact CG2-CG 4.35Å; L126-F130 WeakPolarHBondContact O-CD2 3.25Å; L126-F130 PolarHBondContact O-N 3.16Å; R127-F130 PolarHBondContact O-N 3.38Å; H128-F130 PolarHBondContact O-N 3.36Å; F130-L135 HydrophobicContact CD1-CD2 3.6Å; F130-L135 HydrophobicContact CE1-CD2 4.06Å; F130-P136 HydrophobicContact CD2-CG 4.2Å; F130-P136 HydrophobicContact CE1-CG 4.32Å; F130-P136 HydrophobicContact CE2-CG 3.85Å; F130-P136 HydrophobicContact CZ-CB 4.39Å; F130-P136 HydrophobicContact CZ-CG 3.93Å
131T88.4Confident91.1Very high58 Ų5868.7 Ų68.736%0.35632%0.321SS..Hα-helixtrans-99.6-33-173.552.30000114.3V92 R127 H128 D129V92-T131 HydrophobicContact CG1-CG2 4.19Å; V92-T131 HydrophobicContact CG2-CG2 4.23Å; R127-T131 PolarHBondContact NH1-OG1 3.13Å; R127-T131 WeakPolarHBondContact O-CG2 3.39Å; R127-T131 PolarHBondContact O-N 3Å; R127-T131 PolarHBondContact O-OG1 3.05Å; H128-T131 PolarHBondContact O-N 3.26Å; H128-T131 PolarHBondContact O-OG1 3.16Å; H128-T131 VanDerWaalsContact O-OG1 3.08Å; D129-T131 VanDerWaalsContact C-N 3.28Å; D129-T131 PolarHBondContact O-N 3.01Å
132H85.8Confident91.4Very high131 Ų13169 Ų6961%0.60632%0.318SS*.Hα-helixtrans-132.1-13.7-168.1-61.7-61.8000114.1R127 H128R127-H132 PolarHBondContact NH1-NE2 3.02Å; H128-H132 AromaticContact CE1-CD2 3.89Å; H128-H132 AromaticContact ND1-CD2 3.64Å; H128-H132 PolarHBondContact O-N 3.05Å
133K85.5Confident91.6Very high129 Ų12971 Ų7156%0.56133%0.328SS*.SBendtrans-124-152.4179.5-54.8179.8176.9162.30110.9H128 D129H128-K133 VanDerWaalsContact CD2-CE 3.4Å; H128-K133 WeakPolarHBondContact CD2-CE 3.36Å; H128-K133 WeakPolarHBondContact NE2-CE 3.11Å; D129-K133 CarbonylContact O-C 3.57Å; D129-K133 VanDerWaalsContact O-C 3.23Å; D129-K133 PolarHBondContact O-N 3.3Å; D129-K133 WeakPolarHBondContact OD1-CD 3.43Å; D129-K133 IonicContact OD1-NZ 3.98Å
134K85.7Confident91.7Very high187 Ų18770.9 Ų70.981%0.81333%0.327SS*.PPolyproline II helixtrans-83.5137.7-179.1-172.1174.7-179.4177.70109.8
135L90.3Very high91.9Very high90 Ų9070.6 Ų70.647%0.47133%0.325SS..PPolyproline II helixtrans-53.1128.2177.3-68.6174.5000111.4V84 L85 F130V84-L135 HydrophobicContact CG1-CB 4.24Å; L85-L135 HydrophobicContact CD2-CD1 4.15Å; L85-L135 HydrophobicContact CD2-CD2 4.42Å; F130-L135 HydrophobicContact CD1-CD2 3.6Å; F130-L135 HydrophobicContact CE1-CD2 4.06Å
136P92Very high92.1Very high16 Ų1674.3 Ų74.310%0.10434%0.34CS..PPolyproline II helixtrans-62.2160.4174.8-2434.1000112.8V84 L126 D129 F130 W140V84-P136 WeakPolarHBondContact CG1-O 3.31Å; L126-P136 HydrophobicContact CD2-CB 3.83Å; L126-P136 HydrophobicContact CD2-CG 3.67Å; D129-P136 HydrophobicContact CB-CG 3.85Å; F130-P136 HydrophobicContact CD2-CG 4.2Å; F130-P136 HydrophobicContact CE1-CG 4.32Å; F130-P136 HydrophobicContact CE2-CG 3.85Å; F130-P136 HydrophobicContact CZ-CB 4.39Å; F130-P136 HydrophobicContact CZ-CG 3.93Å; P136-W140 HydrophobicContact CB-CB 4.24Å
137T93.9Very high92.3Very high88 Ų8875.5 Ų75.554%0.5435%0.347SS..PPolyproline II helixtrans-72.8153.8173.267.70000111.2K139 W140 C141T137-K139 PolarHBondContact O-N 3.22Å; T137-K139 VanDerWaalsContact O-N 3.09Å; T137-W140 WeakPolarHBondContact O-CB 3.41Å; T137-W140 PolarHBondContact O-N 2.72Å; T137-C141 PolarHBondContact O-N 3.29Å; T137-C141 VanDerWaalsContact O-N 3.11Å; T137-C141 PolarHBondContact O-SG 3.03Å
138L94Very high92.4Very high32 Ų3273.3 Ų73.317%0.16834%0.339CS..Hα-helixtrans-54.6-32.3177.8-176.159.1000113L83 V84 Y87 W140 C141 R142L83-L138 HydrophobicContact CB-CD1 3.71Å; L83-L138 HydrophobicContact CB-CD2 4.5Å; L83-L138 HydrophobicContact CD1-CD2 4.17Å; V84-L138 HydrophobicContact CG2-CB 3.93Å; V84-L138 HydrophobicContact CG2-CD1 4.26Å; Y87-L138 HydrophobicContact CD2-CD1 3.95Å; Y87-L138 HydrophobicContact CE2-CD1 4.04Å; L138-W140 PolarHBondContact O-N 2.95Å; L138-C141 HydrophobicContact CD1-CB 4.42Å; L138-C141 WeakPolarHBondContact O-CB 3.46Å; L138-C141 PolarHBondContact O-N 3.16Å; L138-R142 WeakPolarHBondContact O-CG 3.18Å; L138-R142 PolarHBondContact O-N 3Å
139K94.9Very high92.6Very high170 Ų17070.7 Ų70.774%0.73933%0.327SS*.Hα-helixtrans-60.8-42.9175.2-174.5178.3179.3179.50112.1T137 K143T137-K139 PolarHBondContact O-N 3.22Å; T137-K139 VanDerWaalsContact O-N 3.09Å; K139-K143 PolarHBondContact O-N 3.25Å; K139-K143 VanDerWaalsContact O-N 3.1Å
140W94.1Very high92.8Very high120 Ų12072.5 Ų72.546%0.45533%0.334SS..Hα-helixtrans-70.2-37.2176.5-82.1108.9000112W122 L126 P136 T137 L138 K143 G144W122-W140 HydrophobicContact CD2-CZ3 4.39Å; W122-W140 HydrophobicContact CE3-CE3 4.14Å; W122-W140 AromaticContact CE3-CZ3 3.88Å; W122-W140 HydrophobicContact CE3-CZ3 3.88Å; W122-W140 HydrophobicContact CZ3-CE3 4.15Å; W122-W140 HydrophobicContact CZ3-CZ3 4.19Å; L126-W140 HydrophobicContact CD2-CB 4.16Å; P136-W140 HydrophobicContact CB-CB 4.24Å; T137-W140 WeakPolarHBondContact O-CB 3.41Å; T137-W140 PolarHBondContact O-N 2.72Å; L138-W140 PolarHBondContact O-N 2.95Å; W140-K143 HydrophobicContact CE3-CD 4.25Å; W140-K143 HydrophobicContact CZ3-CD 4.14Å; W140-K143 PolarHBondContact O-N 3.43Å; W140-G144 PolarHBondContact O-N 3.3Å
141C95.3Very high92.9Very high0 Ų072 Ų720%033%0.331CS..Hα-helixtrans-58.2-49.3174-56.60000111.7Y87 T137 L138 K143 G144 C145Y87-C141 HydrophobicContact CD2-CB 4.08Å; Y87-C141 HydrophobicContact CG-CB 3.95Å; T137-C141 PolarHBondContact O-N 3.29Å; T137-C141 VanDerWaalsContact O-N 3.11Å; T137-C141 PolarHBondContact O-SG 3.03Å; L138-C141 HydrophobicContact CD1-CB 4.42Å; L138-C141 WeakPolarHBondContact O-CB 3.46Å; L138-C141 PolarHBondContact O-N 3.16Å; C141-K143 VanDerWaalsContact C-N 3.35Å; C141-K143 PolarHBondContact O-N 3.43Å; C141-G144 PolarHBondContact O-N 3.09Å; C141-C145 WeakPolarHBondContact O-CB 3.48Å; C141-C145 PolarHBondContact O-N 2.89Å
142R95.9Very high93.1Very high116 Ų11669.2 Ų69.244%0.43832%0.315SS..Hα-helixtrans-60.9-42.2176.6-72.1171.8175.7159.8-0.3112.1D73 Y87 L138 K146D73-R142 IonicContact OD1-CZ 3.92Å; D73-R142 IonicContact OD1-NE 3.58Å; D73-R142 IonicContact OD1-NH2 2.78Å; D73-R142 PolarHBondContact OD1-NH2 2.88Å; D73-R142 IonicContact OD2-CZ 2.62Å; D73-R142 IonicContact OD2-NE 3.65Å; D73-R142 PolarHBondContact OD2-NE 3.3Å; D73-R142 IonicContact OD2-NH2 2.87Å; Y87-R142 HydrophobicContact CE2-CG 4.29Å; L138-R142 WeakPolarHBondContact O-CG 3.18Å; L138-R142 PolarHBondContact O-N 3Å; R142-K146 PolarHBondContact O-N 3.43Å
143K95.8Very high93.3Very high107 Ų10767 Ų6747%0.46531%0.305SS..Hα-helixtrans-64.4-45176.6-171.5179.9176.6-175.60111.5W122 K139 W140 C141 K146 V147W122-K143 HydrophobicContact CH2-CD 4.35Å; W122-K143 HydrophobicContact CH2-CG 3.95Å; K139-K143 PolarHBondContact O-N 3.25Å; K139-K143 VanDerWaalsContact O-N 3.1Å; W140-K143 HydrophobicContact CE3-CD 4.25Å; W140-K143 HydrophobicContact CZ3-CD 4.14Å; W140-K143 PolarHBondContact O-N 3.43Å; C141-K143 VanDerWaalsContact C-N 3.35Å; C141-K143 PolarHBondContact O-N 3.43Å; K143-K146 PolarHBondContact O-N 3.45Å; K143-V147 WeakPolarHBondContact O-CG2 3.3Å; K143-V147 PolarHBondContact O-N 3.36Å; K143-V147 VanDerWaalsContact O-N 3.09Å
144G95.1Very high93.4Very high0 Ų066.9 Ų66.90%031%0.306CS..Hα-helixtrans-58.1-50.2175.100000111.8W140 C141 K146 V147 V148W140-G144 PolarHBondContact O-N 3.3Å; C141-G144 PolarHBondContact O-N 3.09Å; G144-K146 VanDerWaalsContact C-N 3.34Å; G144-K146 PolarHBondContact O-N 3.47Å; G144-V147 PolarHBondContact O-N 2.93Å; G144-V148 WeakPolarHBondContact O-CB 3.04Å; G144-V148 WeakPolarHBondContact O-CG2 3.36Å; G144-V148 PolarHBondContact O-N 2.95Å
145C95.9Very high93.3Very high0 Ų059.7 Ų59.70%028%0.275CS..Hα-helixtrans-56.6-46.4177.2174.10000112.2L66 Y87 C141 V148 L149L66-C145 HydrophobicContact CD2-CB 4.21Å; Y87-C145 HydrophobicContact CD1-CB 3.76Å; Y87-C145 HydrophobicContact CE1-CB 3.6Å; C141-C145 WeakPolarHBondContact O-CB 3.48Å; C141-C145 PolarHBondContact O-N 2.89Å; C145-V148 PolarHBondContact O-N 3.47Å; C145-L149 WeakPolarHBondContact O-CB 3.39Å; C145-L149 WeakPolarHBondContact O-CG 3.48Å; C145-L149 PolarHBondContact O-N 3.23Å
146K95.3Very high93.1Very high123 Ų12356.1 Ų56.154%0.53526%0.256SS..Hα-helixtrans-58.8-50.2177.8-178.3179.2170.6-177.90112R142 K143 G144 V148 L149 E150R142-K146 PolarHBondContact O-N 3.43Å; K143-K146 PolarHBondContact O-N 3.45Å; G144-K146 VanDerWaalsContact C-N 3.34Å; G144-K146 PolarHBondContact O-N 3.47Å; K146-V148 PolarHBondContact O-N 3.35Å; K146-L149 PolarHBondContact O-N 3.42Å; K146-E150 WeakPolarHBondContact CE-OE1 3.5Å; K146-E150 IonicContact NZ-OE1 3.9Å; K146-E150 WeakPolarHBondContact O-CG 3.47Å; K146-E150 PolarHBondContact O-N 3.44Å
147V95.5Very high92.9Very high32 Ų3255.4 Ų55.419%0.19425%0.251CS..Hα-helixtrans-66.3-39.4-177.2169.20000111.8P120 W122 V123 K143 G144 E150 W151P120-V147 HydrophobicContact CG-CG1 4.04Å; W122-V147 HydrophobicContact CH2-CB 4.13Å; W122-V147 HydrophobicContact CH2-CG2 4.05Å; W122-V147 HydrophobicContact CZ2-CB 4.04Å; W122-V147 HydrophobicContact CZ2-CG1 4.02Å; W122-V147 HydrophobicContact CZ2-CG2 3.82Å; V123-V147 HydrophobicContact CG2-CG1 4.3Å; K143-V147 WeakPolarHBondContact O-CG2 3.3Å; K143-V147 PolarHBondContact O-N 3.36Å; K143-V147 VanDerWaalsContact O-N 3.09Å; G144-V147 PolarHBondContact O-N 2.93Å; V147-E150 PolarHBondContact O-N 2.91Å; V147-W151 WeakPolarHBondContact O-CB 3.4Å; V147-W151 PolarHBondContact O-N 3.46Å
148V95Very high92.3Very high3 Ų354.2 Ų54.22%0.01825%0.246CC..Hα-helixtrans-66.2-40.3175.8172.90000111.6L66 L91 F94 V123 G144 C145 K146 W151 L152L66-V148 HydrophobicContact CD1-CB 4.01Å; L66-V148 HydrophobicContact CD1-CG1 3.36Å; L91-V148 HydrophobicContact CD2-CB 4.39Å; L91-V148 HydrophobicContact CD2-CG2 3.84Å; F94-V148 HydrophobicContact CB-CG1 4.39Å; F94-V148 HydrophobicContact CD1-CB 4.34Å; F94-V148 HydrophobicContact CD1-CG1 3.49Å; F94-V148 VanDerWaalsContact CD1-CG1 3.49Å; F94-V148 HydrophobicContact CD1-CG2 3.81Å; F94-V148 HydrophobicContact CD2-CG1 3.56Å; F94-V148 HydrophobicContact CE1-CB 4.25Å; F94-V148 HydrophobicContact CE1-CG1 3.53Å; F94-V148 HydrophobicContact CE1-CG2 3.69Å; F94-V148 HydrophobicContact CE2-CG1 3.56Å; F94-V148 HydrophobicContact CG-CG1 3.52Å; F94-V148 HydrophobicContact CZ-CG1 3.57Å; F94-V148 HydrophobicContact CZ-CG2 4.38Å; V123-V148 HydrophobicContact CG1-CG2 3.73Å; G144-V148 WeakPolarHBondContact O-CB 3.04Å; G144-V148 WeakPolarHBondContact O-CG2 3.36Å; G144-V148 PolarHBondContact O-N 2.95Å; C145-V148 PolarHBondContact O-N 3.47Å; K146-V148 PolarHBondContact O-N 3.35Å; V148-W151 PolarHBondContact O-N 3.27Å; V148-L152 HydrophobicContact CG1-CD1 3.94Å; V148-L152 HydrophobicContact CG1-CG 4.42Å; V148-L152 WeakPolarHBondContact O-CB 3.37Å; V148-L152 WeakPolarHBondContact O-CG 3.38Å; V148-L152 PolarHBondContact O-N 3.08Å
149L94.9Very high91.3Very high10 Ų1057.7 Ų57.75%0.05226%0.257CS..Hα-helixtrans-64.8-41.8176-78.1172.3000112.2Y31 T63 L66 V67 Q70 C145 K146 L152 Q153Y31-L149 HydrophobicContact CE1-CB 4.22Å; Y31-L149 VanDerWaalsContact CE1-O 3.31Å; Y31-L149 WeakPolarHBondContact CE1-O 3.43Å; Y31-L149 PolarHBondContact OH-O 3.01Å; T63-L149 HydrophobicContact CG2-CD2 3.92Å; L66-L149 HydrophobicContact CB-CD1 4.23Å; L66-L149 HydrophobicContact CB-CD2 3.84Å; L66-L149 HydrophobicContact CB-CG 3.98Å; L66-L149 HydrophobicContact CD1-CD2 4.15Å; L66-L149 HydrophobicContact CD1-CG 4.16Å; V67-L149 HydrophobicContact CG2-CD1 4.38Å; V67-L149 HydrophobicContact CG2-CD2 4.07Å; Q70-L149 VanDerWaalsContact NE2-CD1 3.31Å; C145-L149 WeakPolarHBondContact O-CB 3.39Å; C145-L149 WeakPolarHBondContact O-CG 3.48Å; C145-L149 PolarHBondContact O-N 3.23Å; K146-L149 PolarHBondContact O-N 3.42Å; L149-L152 PolarHBondContact O-N 2.67Å; L149-Q153 WeakPolarHBondContact O-CB 3.34Å; L149-Q153 PolarHBondContact O-N 3.25Å
150E93.6Very high90.2Very high80 Ų8052.5 Ų52.537%0.37424%0.235SC..Hα-helixtrans-61.7-45174.5-74.5170.7173.400111.1K146 V147 Q153 Q154K146-E150 WeakPolarHBondContact CE-OE1 3.5Å; K146-E150 IonicContact NZ-OE1 3.9Å; K146-E150 WeakPolarHBondContact O-CG 3.47Å; K146-E150 PolarHBondContact O-N 3.44Å; V147-E150 PolarHBondContact O-N 2.91Å; E150-Q153 WeakPolarHBondContact O-CB 3.43Å; E150-Q153 PolarHBondContact O-N 3.11Å; E150-Q154 WeakPolarHBondContact O-CG 3.3Å; E150-Q154 PolarHBondContact O-N 3.5Å; E150-Q154 VanDerWaalsContact O-N 3.08Å
151W93.4Very high88.5Confident19 Ų1951.4 Ų51.47%0.07224%0.238CC..Hα-helixtrans-60.9-47.2175.1-177.890.8000111.7F94 I98 L117 I119 V147 V148 Q153 Q154 E155 W169F94-W151 AromaticContact CE2-CE3 3.82Å; F94-W151 HydrophobicContact CE2-CE3 3.82Å; F94-W151 AromaticContact CE2-CZ3 3.75Å; F94-W151 HydrophobicContact CE2-CZ3 3.75Å; F94-W151 HydrophobicContact CZ-CD2 4.37Å; F94-W151 AromaticContact CZ-CE3 3.64Å; F94-W151 HydrophobicContact CZ-CE3 3.64Å; F94-W151 AromaticContact CZ-CZ3 3.81Å; F94-W151 HydrophobicContact CZ-CZ3 3.81Å; I98-W151 HydrophobicContact CD1-CZ3 4.49Å; I98-W151 HydrophobicContact CG2-CH2 4.07Å; L117-W151 HydrophobicContact CB-CZ2 4.11Å; L117-W151 PolarHBondContact O-NE1 2.89Å; I119-W151 HydrophobicContact CD1-CH2 4.29Å; I119-W151 HydrophobicContact CD1-CZ2 3.95Å; I119-W151 HydrophobicContact CG1-CD2 4.09Å; I119-W151 HydrophobicContact CG1-CG 4.41Å; I119-W151 HydrophobicContact CG1-CZ2 3.9Å; V147-W151 WeakPolarHBondContact O-CB 3.4Å; V147-W151 PolarHBondContact O-N 3.46Å; V148-W151 PolarHBondContact O-N 3.27Å; W151-Q153 PolarHBondContact O-N 3.19Å; W151-Q154 PolarHBondContact O-N 3.44Å; W151-E155 HydrophobicContact CD2-CB 4.27Å; W151-E155 HydrophobicContact CD2-CG 4.08Å; W151-E155 HydrophobicContact CG-CG 4.31Å; W151-E155 HydrophobicContact CH2-CB 4.22Å; W151-E155 HydrophobicContact CZ2-CB 3.94Å; W151-E155 HydrophobicContact CZ2-CG 3.88Å; W151-E155 WeakPolarHBondContact O-CB 3.38Å; W151-E155 PolarHBondContact O-N 2.97Å; W151-W169 HydrophobicContact CH2-CZ3 4.48Å
152L92.2Very high86.4Confident0 Ų053.7 Ų53.70%026%0.262CS..Hα-helixtrans-59.9-36.6176.4-78.4165.8000111.7A59 C62 L66 F94 V148 L149 Y156 W157A59-L152 HydrophobicContact CB-CD2 3.82Å; C62-L152 HydrophobicContact CB-CD1 4.21Å; L66-L152 HydrophobicContact CD1-CD1 4.08Å; F94-L152 HydrophobicContact CD2-CD1 4.2Å; F94-L152 HydrophobicContact CD2-CD2 4.43Å; F94-L152 HydrophobicContact CD2-CG 4.47Å; F94-L152 HydrophobicContact CE2-CD1 4.16Å; F94-L152 HydrophobicContact CE2-CD2 3.92Å; F94-L152 HydrophobicContact CE2-CG 3.95Å; V148-L152 HydrophobicContact CG1-CD1 3.94Å; V148-L152 HydrophobicContact CG1-CG 4.42Å; V148-L152 WeakPolarHBondContact O-CB 3.37Å; V148-L152 WeakPolarHBondContact O-CG 3.38Å; V148-L152 PolarHBondContact O-N 3.08Å; L149-L152 PolarHBondContact O-N 2.67Å; L152-Y156 WeakPolarHBondContact O-CA 3.19Å; L152-Y156 WeakPolarHBondContact O-CB 3.47Å; L152-Y156 PolarHBondContact O-N 3.33Å; L152-W157 VanDerWaalsContact O-CD1 3.26Å; L152-W157 PolarHBondContact O-N 3.48Å
153Q90.6Very high83.9Confident85 Ų8552.5 Ų52.540%0.39729%0.285SS..Iπ-helixtrans-64.7-44.8178.3-162.717713.500111.3Y31 L149 E150 W151 W157 S158Y31-Q153 HydrophobicContact CD1-CB 4.45Å; Y31-Q153 HydrophobicContact CD1-CG 4.28Å; Y31-Q153 HydrophobicContact CE1-CB 3.64Å; Y31-Q153 HydrophobicContact CE1-CG 3.91Å; Y31-Q153 HydrophobicContact CE2-CB 4.48Å; Y31-Q153 HydrophobicContact CE2-CG 4.33Å; Y31-Q153 WeakPolarHBondContact OH-CA 3.38Å; Y31-Q153 PolarHBondContact OH-N 2.86Å; L149-Q153 WeakPolarHBondContact O-CB 3.34Å; L149-Q153 PolarHBondContact O-N 3.25Å; E150-Q153 WeakPolarHBondContact O-CB 3.43Å; E150-Q153 PolarHBondContact O-N 3.11Å; W151-Q153 PolarHBondContact O-N 3.19Å; Q153-W157 PolarHBondContact O-N 3.25Å; Q153-S158 WeakPolarHBondContact O-CB 3.27Å; Q153-S158 PolarHBondContact O-N 3.5Å
154Q88Confident81.3Confident126 Ų12650.5 Ų50.559%0.58930%0.295SS*.Iπ-helixtrans-74.6-51.6-177.8-69.2175.9-3.800111.5E150 W151 S158E150-Q154 WeakPolarHBondContact O-CG 3.3Å; E150-Q154 PolarHBondContact O-N 3.5Å; E150-Q154 VanDerWaalsContact O-N 3.08Å; W151-Q154 PolarHBondContact O-N 3.44Å; Q154-S158 PolarHBondContact O-OG 3.17Å
155E84.4Confident78.7Confident36 Ų3655.4 Ų55.417%0.16834%0.336CS..Iπ-helixtrans-82-34.5-170.4-67.5-60.2159.400113.1W151 R159 W169W151-E155 HydrophobicContact CD2-CB 4.27Å; W151-E155 HydrophobicContact CD2-CG 4.08Å; W151-E155 HydrophobicContact CG-CG 4.31Å; W151-E155 HydrophobicContact CH2-CB 4.22Å; W151-E155 HydrophobicContact CZ2-CB 3.94Å; W151-E155 HydrophobicContact CZ2-CG 3.88Å; W151-E155 WeakPolarHBondContact O-CB 3.38Å; W151-E155 PolarHBondContact O-N 2.97Å; E155-R159 WeakPolarHBondContact O-CD 3.22Å; E155-R159 PolarHBondContact O-NE 3.42Å; E155-R159 IonicContact OE2-CZ 2.72Å; E155-R159 IonicContact OE2-NE 3.94Å; E155-R159 PolarHBondContact OE2-NE 3.11Å; E155-R159 IonicContact OE2-NH2 3.97Å; E155-R159 PolarHBondContact OE2-NH2 3.05Å; E155-W169 HydrophobicContact CB-CH2 3.79Å; E155-W169 HydrophobicContact CB-CZ2 4.03Å; E155-W169 VanDerWaalsContact O-CE2 3.28Å; E155-W169 WeakPolarHBondContact O-CZ2 3.26Å
156Y86.3Confident76.3Confident16 Ų1662.9 Ų62.96%0.06338%0.376CS..Iπ-helixtrans-104.5-60.8179.6178.5-93000112.1W23 P57 A59 V60 L152 S158 Q160W23-Y156 AromaticContact CH2-CE1 3.95Å; W23-Y156 HydrophobicContact CH2-CE1 3.95Å; W23-Y156 HydrophobicContact CZ2-CE1 4.11Å; P57-Y156 HydrophobicContact CB-CE2 4.15Å; P57-Y156 WeakPolarHBondContact CB-OH 3.49Å; P57-Y156 WeakPolarHBondContact CG-OH 3.44Å; A59-Y156 HydrophobicContact CB-CD1 3.51Å; A59-Y156 HydrophobicContact CB-CD2 3.33Å; A59-Y156 HydrophobicContact CB-CE1 3.85Å; A59-Y156 HydrophobicContact CB-CE2 3.66Å; A59-Y156 HydrophobicContact CB-CG 3.26Å; V60-Y156 HydrophobicContact CG2-CE1 3.79Å; L152-Y156 WeakPolarHBondContact O-CA 3.19Å; L152-Y156 WeakPolarHBondContact O-CB 3.47Å; L152-Y156 PolarHBondContact O-N 3.33Å; Y156-S158 PolarHBondContact O-N 3.07Å; Y156-Q160 PolarHBondContact O-NE2 3.14Å; Y156-Q160 PolarHBondContact O-OE1 3.35Å
157W85.8Confident74Confident1 Ų164 Ų640%0.00438%0.383CS..Iπ-helixtrans-67.9-33.3-169.1-66.299.2000113.9W23 L27 L30 Y31 V60 T63 L152 Q153W23-W157 AromaticContact CD2-CZ3 3.99Å; W23-W157 HydrophobicContact CD2-CZ3 3.99Å; W23-W157 AromaticContact CE2-CE3 3.72Å; W23-W157 AromaticContact CE2-CZ3 3.44Å; W23-W157 VanDerWaalsContact CE2-CZ3 3.44Å; W23-W157 HydrophobicContact CE3-CZ3 4.11Å; W23-W157 AromaticContact CH2-CE3 3.88Å; W23-W157 HydrophobicContact CH2-CE3 3.88Å; W23-W157 AromaticContact CH2-CH2 3.75Å; W23-W157 HydrophobicContact CH2-CH2 3.75Å; W23-W157 AromaticContact CH2-CZ3 3.29Å; W23-W157 HydrophobicContact CH2-CZ3 3.29Å; W23-W157 HydrophobicContact CZ2-CD2 4.37Å; W23-W157 AromaticContact CZ2-CE3 3.29Å; W23-W157 HydrophobicContact CZ2-CE3 3.29Å; W23-W157 HydrophobicContact CZ2-CH2 4.04Å; W23-W157 AromaticContact CZ2-CZ3 3.11Å; W23-W157 HydrophobicContact CZ2-CZ3 3.11Å; W23-W157 HydrophobicContact CZ3-CH2 4.08Å; W23-W157 AromaticContact CZ3-CZ3 3.78Å; W23-W157 HydrophobicContact CZ3-CZ3 3.78Å; L27-W157 HydrophobicContact CB-CE3 4.03Å; L27-W157 HydrophobicContact CB-CZ3 4.11Å; L27-W157 HydrophobicContact CD1-CB 3.69Å; L27-W157 HydrophobicContact CD1-CD2 3.58Å; L27-W157 HydrophobicContact CD1-CE3 3.63Å; L27-W157 HydrophobicContact CD1-CG 3.61Å; L27-W157 HydrophobicContact CD1-CZ3 4.34Å; L27-W157 HydrophobicContact CD2-CB 4.2Å; L27-W157 HydrophobicContact CD2-CE3 4.18Å; L27-W157 HydrophobicContact CG-CE3 4.16Å; L30-W157 HydrophobicContact CD1-CH2 4Å; L30-W157 HydrophobicContact CD1-CZ2 3.89Å; Y31-W157 AromaticContact CE2-CD1 3.92Å; Y31-W157 HydrophobicContact CE2-CG 4.41Å; V60-W157 HydrophobicContact CB-CZ2 4.41Å; V60-W157 HydrophobicContact CG1-CH2 4.39Å; V60-W157 HydrophobicContact CG1-CZ2 4.49Å; V60-W157 HydrophobicContact CG2-CH2 3.88Å; V60-W157 HydrophobicContact CG2-CZ2 3.95Å; T63-W157 HydrophobicContact CG2-CZ2 4.3Å; T63-W157 PolarHBondContact OG1-NE1 3.48Å; L152-W157 VanDerWaalsContact O-CD1 3.26Å; L152-W157 PolarHBondContact O-N 3.48Å; Q153-W157 PolarHBondContact O-N 3.25Å
158S82.3Confident71.8Confident62 Ų6266 Ų6643%0.43439%0.392SS..THydrogen-bonded Turntrans-74.8-36.1-178.189.60000113.7Q153 Q154 Y156 Q160 L161Q153-S158 WeakPolarHBondContact O-CB 3.27Å; Q153-S158 PolarHBondContact O-N 3.5Å; Q154-S158 PolarHBondContact O-OG 3.17Å; Y156-S158 PolarHBondContact O-N 3.07Å; S158-Q160 PolarHBondContact O-N 2.85Å; S158-L161 WeakPolarHBondContact O-CB 3.34Å; S158-L161 PolarHBondContact O-N 3.28Å; S158-L161 VanDerWaalsContact O-N 3.15Å
159R73.8Confident69.8Low105 Ų10569.5 Ų69.540%0.39641%0.405SS..G310 helixtrans-67.3-25.3179.1-67.2-174.5-173.5-155.912.9111.9E155 L161 G162 E167 W169E155-R159 WeakPolarHBondContact O-CD 3.22Å; E155-R159 PolarHBondContact O-NE 3.42Å; E155-R159 IonicContact OE2-CZ 2.72Å; E155-R159 IonicContact OE2-NE 3.94Å; E155-R159 PolarHBondContact OE2-NE 3.11Å; E155-R159 IonicContact OE2-NH2 3.97Å; E155-R159 PolarHBondContact OE2-NH2 3.05Å; R159-L161 PolarHBondContact O-N 2.6Å; R159-G162 PolarHBondContact O-N 2.95Å; R159-E167 IonicContact NH1-OE2 3.87Å; R159-E167 PolarHBondContact NH1-OE2 3.25Å; R159-W169 VanDerWaalsContact CZ-CZ2 3.4Å
160Q70.3Confident67.7Low61 Ų6172.9 Ų72.929%0.28542%0.421SS..G310 helixtrans-80.6-4.7180-83.664.5-35.600112K20 Y156 S158K20-Q160 PolarHBondContact NZ-O 3.38Å; Y156-Q160 PolarHBondContact O-NE2 3.14Å; Y156-Q160 PolarHBondContact O-OE1 3.35Å; S158-Q160 PolarHBondContact O-N 2.85Å
161L58.8Low65.5Low97 Ų9772.9 Ų72.951%0.50843%0.43SS..G310 helixtrans-95.2-24.1175.1-68.3164.7000112.5K20 D24 L27 S158 R159K20-L161 VanDerWaalsContact NZ-CD2 3.27Å; D24-L161 WeakPolarHBondContact OD1-CD2 3.35Å; L27-L161 HydrophobicContact CD2-CD1 4.27Å; S158-L161 WeakPolarHBondContact O-CB 3.34Å; S158-L161 PolarHBondContact O-N 3.28Å; S158-L161 VanDerWaalsContact O-N 3.15Å; R159-L161 PolarHBondContact O-N 2.6Å
162G50.5Low63Low49 Ų4978.7 Ų78.751%0.50546%0.462SS..SBendtrans-88.2118.7171.600000109.6R159 G164R159-G162 PolarHBondContact O-N 2.95Å; G162-G164 PolarHBondContact O-N 3.28Å
163G44.3Very low60.7Low90 Ų9080.7 Ų80.793%0.92848%0.476SS*.  trans-66.442.2-18000000115.7A165G163-A165 PolarHBondContact O-N 3.42Å
164G40.9Very low58.7Low65 Ų6582.6 Ų82.667%0.6749%0.489SS*.  trans-78.897.816900000109.4G162 D166G162-G164 PolarHBondContact O-N 3.28Å; G164-D166 PolarHBondContact O-N 2.84Å
165A41.5Very low56.9Low104 Ų10478.2 Ų78.286%0.8648%0.477SS*.THydrogen-bonded Turntrans-75.234.8176.900000113.6G163G163-A165 PolarHBondContact O-N 3.42Å
166D44.6Very low55.3Low157 Ų15781 Ų8184%0.8449%0.49SS*.THydrogen-bonded Turntrans-139.4-0.1-169.1-130.413.4000117.1G164G164-D166 PolarHBondContact O-N 2.84Å
167E47.3Very low53.6Low147 Ų14787.2 Ų87.269%0.68752%0.52SS*.  trans-126.984.6166.7-75.8-177.3-173.100108.4R159 W169R159-E167 IonicContact NH1-OE2 3.87Å; R159-E167 PolarHBondContact NH1-OE2 3.25Å; E167-W169 VanDerWaalsContact C-N 3.31Å; E167-W169 PolarHBondContact O-N 3.4Å
168D48.9Very low52.1Low73 Ų7394 Ų9439%0.3955%0.552SS.*  trans-63.896.4170.5-168.18.1000107.5H13 E170 S171H13-D168 IonicContact CE1-OD2 3.77Å; D168-E170 PolarHBondContact O-N 3.38Å; D168-E170 PolarHBondContact OD1-N 3.18Å; D168-S171 WeakPolarHBondContact O-CB 3.38Å; D168-S171 PolarHBondContact O-N 2.82Å
169W52.9Low50.9Low77 Ų7795.5 Ų95.529%0.29256%0.555SS.*THydrogen-bonded Turntrans-53.1-14.4172.6-100.279000113W151 E155 R159 E167W151-W169 HydrophobicContact CH2-CZ3 4.48Å; E155-W169 HydrophobicContact CB-CH2 3.79Å; E155-W169 HydrophobicContact CB-CZ2 4.03Å; E155-W169 VanDerWaalsContact O-CE2 3.28Å; E155-W169 WeakPolarHBondContact O-CZ2 3.26Å; R159-W169 VanDerWaalsContact CZ-CZ2 3.4Å; E167-W169 VanDerWaalsContact C-N 3.31Å; E167-W169 PolarHBondContact O-N 3.4Å
170E51.4Low50.5Low81 Ų8192.4 Ų92.438%0.37955%0.552SS.*THydrogen-bonded Turntrans-99.8-0.1176.3-53.8-149.914100114.4P57 D168 D172P57-E170 WeakPolarHBondContact CA-OE1 3.4Å; P57-E170 VanDerWaalsContact CB-OE1 3.25Å; P57-E170 WeakPolarHBondContact CB-OE1 3.21Å; P57-E170 WeakPolarHBondContact CG-OE1 3.27Å; D168-E170 PolarHBondContact O-N 3.38Å; D168-E170 PolarHBondContact OD1-N 3.18Å; E170-D172 PolarHBondContact O-N 3.36Å
171S46.4Very low50.2Low80 Ų8093.6 Ų93.656%0.55956%0.557SS**  trans-71.3116.2174.8-138.40000109.9D168 S173D168-S171 WeakPolarHBondContact O-CB 3.38Å; D168-S171 PolarHBondContact O-N 2.82Å; S171-S173 PolarHBondContact O-N 3.18Å
172D41.1Very low50.9Low140 Ų14093.9 Ų93.975%0.74956%0.559SS**  trans-64116.4177.3-144.44000109.4E170E170-D172 PolarHBondContact O-N 3.36Å
173S44.5Very low52.1Low43 Ų4398.5 Ų98.530%0.30157%0.565SS.*  trans63.383.5161.4-1770000120.1S171 G175 E176S171-S173 PolarHBondContact O-N 3.18Å; S173-G175 PolarHBondContact O-N 3.36Å; S173-E176 PolarHBondContact O-N 3.25Å
174D48.3Very low53.4Low125 Ų125101.9 Ų101.967%0.66855%0.55SS*.THydrogen-bonded Turntrans-62.6-10.8155.4-90.5-13.7000114E176D174-E176 PolarHBondContact O-N 3.42Å
175G51.1Low54.9Low33 Ų33103.2 Ų103.234%0.3454%0.539SS..Hα-helixtrans-70.9-14.3177.700000114.6S173S173-G175 PolarHBondContact O-N 3.36Å
176E50.8Low56.7Low94 Ų94104.1 Ų104.144%0.43953%0.525SS..Hα-helixtrans-86.9-30178.2-68.5-161.315400112.8R105 S173 D174 A180R105-E176 IonicContact CZ-OE1 3.43Å; R105-E176 VanDerWaalsContact CZ-OE1 3.27Å; R105-E176 IonicContact NE-OE1 2.73Å; R105-E176 PolarHBondContact NE-OE1 2.87Å; R105-E176 IonicContact NH2-OE1 3.1Å; R105-E176 PolarHBondContact NH2-OE1 2.94Å; R105-E176 IonicContact NH2-OE2 2.79Å; S173-E176 PolarHBondContact O-N 3.25Å; D174-E176 PolarHBondContact O-N 3.42Å; E176-A180 WeakPolarHBondContact O-CB 3.38Å; E176-A180 PolarHBondContact O-N 3.3Å
177E50.9Low58.3Low147 Ų14799.7 Ų99.769%0.68751%0.507SS*.Hα-helixtrans-75-41.9179.7-69-164.9163.900111.8A180 E181E177-A180 PolarHBondContact O-N 2.99Å; E177-E181 WeakPolarHBondContact O-CB 3.36Å; E177-E181 PolarHBondContact O-N 2.85Å
178E52.7Low60Low144 Ų14497.1 Ų97.167%0.67350%0.498SS*.Hα-helixtrans-64.1-46.7179.3-70.2-173.8156.700112.8A180 E181 L182E178-A180 PolarHBondContact O-N 3.23Å; E178-E181 PolarHBondContact O-N 2.93Å; E178-L182 WeakPolarHBondContact O-CG 3.32Å; E178-L182 PolarHBondContact O-N 2.8Å
179D58.2Low61.8Low93 Ų9399 Ų9950%0.49751%0.507SS..Hα-helixtrans-70.3-31.4179.9-89.7-4.8000112.1K183D179-K183 WeakPolarHBondContact O-CG 3.47Å; D179-K183 PolarHBondContact O-N 2.61Å
180A64.2Low63.4Low41 Ų4199.3 Ų99.334%0.33951%0.514SS..Hα-helixtrans-73.5-38174.600000111.7E176 E177 E178 K183 R184E176-A180 WeakPolarHBondContact O-CB 3.38Å; E176-A180 PolarHBondContact O-N 3.3Å; E177-A180 PolarHBondContact O-N 2.99Å; E178-A180 PolarHBondContact O-N 3.23Å; A180-K183 PolarHBondContact O-N 3.28Å; A180-R184 VanDerWaalsContact O-CG 3.29Å; A180-R184 WeakPolarHBondContact O-CG 3.09Å; A180-R184 PolarHBondContact O-N 3.32Å
181E65.9Low64.9Low85 Ų8597.9 Ų97.940%0.39751%0.513SS..Hα-helixtrans-67.3-44177.4-175.455-150.100111.4E177 E178 K183 R184 Q185E177-E181 WeakPolarHBondContact O-CB 3.36Å; E177-E181 PolarHBondContact O-N 2.85Å; E178-E181 PolarHBondContact O-N 2.93Å; E181-K183 VanDerWaalsContact C-N 3.33Å; E181-K183 PolarHBondContact O-N 2.96Å; E181-R184 WeakPolarHBondContact O-CB 3.42Å; E181-R184 PolarHBondContact O-N 3.42Å; E181-Q185 WeakPolarHBondContact O-CG 3.17Å; E181-Q185 PolarHBondContact O-N 3.49Å; E181-Q185 PolarHBondContact OE1-NE2 2.96Å; E181-Q185 VanDerWaalsContact OE1-NE2 3.08Å
182L71.8Confident66.5Low104 Ų104102.6 Ų102.655%0.54552%0.518SS..Hα-helixtrans-59.8-41.8175.1-73.5171000112.3E178 Q185 E186E178-L182 WeakPolarHBondContact O-CG 3.32Å; E178-L182 PolarHBondContact O-N 2.8Å; L182-Q185 PolarHBondContact O-N 3.43Å; L182-E186 WeakPolarHBondContact O-CB 3.33Å; L182-E186 PolarHBondContact O-N 3.36Å
183K75.6Confident68.8Low145 Ų145101 Ų10163%0.6351%0.506SS*.Hα-helixtrans-67.7-36.7175.9-75.5176.5-178.4175.60112.9D179 A180 E181 Q185 S187D179-K183 WeakPolarHBondContact O-CG 3.47Å; D179-K183 PolarHBondContact O-N 2.61Å; A180-K183 PolarHBondContact O-N 3.28Å; E181-K183 VanDerWaalsContact C-N 3.33Å; E181-K183 PolarHBondContact O-N 2.96Å; K183-Q185 VanDerWaalsContact C-N 3.34Å; K183-S187 WeakPolarHBondContact O-CB 3.49Å; K183-S187 PolarHBondContact O-N 2.85Å
184R72.3Confident70.8Confident161 Ų161107.2 Ų107.261%0.60852%0.523SS*.Hα-helixtrans-63.8-43.3173.3-76.9172.7-180178.33.1110.5A180 E181 S187 N188A180-R184 VanDerWaalsContact O-CG 3.29Å; A180-R184 WeakPolarHBondContact O-CG 3.09Å; A180-R184 PolarHBondContact O-N 3.32Å; E181-R184 WeakPolarHBondContact O-CB 3.42Å; E181-R184 PolarHBondContact O-N 3.42Å; R184-S187 PolarHBondContact O-N 3.05Å; R184-N188 WeakPolarHBondContact O-CB 3.49Å; R184-N188 PolarHBondContact O-N 3.43Å; R184-N188 PolarHBondContact O-ND2 3.13Å
185Q72.6Confident72.5Confident94 Ų94107.4 Ų107.444%0.43952%0.52SS..Hα-helixtrans-63.2-46.5176.6-72.41786.400111.8E181 L182 K183 S187 N188 L189E181-Q185 WeakPolarHBondContact O-CG 3.17Å; E181-Q185 PolarHBondContact O-N 3.49Å; E181-Q185 PolarHBondContact OE1-NE2 2.96Å; E181-Q185 VanDerWaalsContact OE1-NE2 3.08Å; L182-Q185 PolarHBondContact O-N 3.43Å; K183-Q185 VanDerWaalsContact C-N 3.34Å; Q185-S187 PolarHBondContact O-N 2.98Å; Q185-N188 PolarHBondContact O-N 2.88Å; Q185-L189 WeakPolarHBondContact O-CG 3.49Å; Q185-L189 PolarHBondContact O-N 3.38Å
186E78.9Confident74.2Confident123 Ų123111.1 Ų111.158%0.57553%0.53SS*.Hα-helixtrans-60.5-44.6176.1-172.5176.7-16100111.7L182 N188 L189 L190L182-E186 WeakPolarHBondContact O-CB 3.33Å; L182-E186 PolarHBondContact O-N 3.36Å; E186-N188 VanDerWaalsContact C-N 3.33Å; E186-N188 PolarHBondContact O-N 3.12Å; E186-L189 PolarHBondContact O-N 3.25Å; E186-L190 HydrophobicContact CG-CD1 4.31Å; E186-L190 WeakPolarHBondContact O-CG 3.32Å; E186-L190 PolarHBondContact O-N 3.39Å
187S79.6Confident76Confident64 Ų64111.4 Ų111.445%0.44853%0.531SS..Hα-helixtrans-61.5-40.2174.9-173.30000112.2K183 R184 Q185 L190 S191K183-S187 WeakPolarHBondContact O-CB 3.49Å; K183-S187 PolarHBondContact O-N 2.85Å; R184-S187 PolarHBondContact O-N 3.05Å; Q185-S187 PolarHBondContact O-N 2.98Å; S187-L190 PolarHBondContact O-N 3.47Å; S187-S191 PolarHBondContact O-N 2.95Å; S187-S191 PolarHBondContact O-OG 3.37Å; S187-S191 VanDerWaalsContact O-OG 3.13Å
188N82Confident77.8Confident93 Ų93106.3 Ų106.350%0.49752%0.515SS..Hα-helixtrans-67.6-38.6178.2-71.7-22.8000111.8R184 Q185 E186 S191 R192R184-N188 WeakPolarHBondContact O-CB 3.49Å; R184-N188 PolarHBondContact O-N 3.43Å; R184-N188 PolarHBondContact O-ND2 3.13Å; Q185-N188 PolarHBondContact O-N 2.88Å; E186-N188 VanDerWaalsContact C-N 3.33Å; E186-N188 PolarHBondContact O-N 3.12Å; N188-S191 PolarHBondContact O-N 3.24Å; N188-R192 WeakPolarHBondContact O-CG 3.37Å; N188-R192 PolarHBondContact O-N 3.01Å
189L85.7Confident79.5Confident113 Ų113102.2 Ų102.259%0.59250%0.495SS*.Hα-helixtrans-64.3-44.2175.4-70.6175.3000111.3Q185 E186 R192 Q193Q185-L189 WeakPolarHBondContact O-CG 3.49Å; Q185-L189 PolarHBondContact O-N 3.38Å; E186-L189 PolarHBondContact O-N 3.25Å; L189-R192 PolarHBondContact O-N 3.47Å; L189-Q193 WeakPolarHBondContact O-CB 3.42Å; L189-Q193 PolarHBondContact O-N 3.23Å
190L88.2Confident81Confident82 Ų82103.4 Ų103.443%0.42950%0.495SS..Hα-helixtrans-63.4-41.3176.3-72.8167.2000112.2E186 S187 Q193 R194E186-L190 HydrophobicContact CG-CD1 4.31Å; E186-L190 WeakPolarHBondContact O-CG 3.32Å; E186-L190 PolarHBondContact O-N 3.39Å; S187-L190 PolarHBondContact O-N 3.47Å; L190-Q193 PolarHBondContact O-N 3.47Å; L190-R194 WeakPolarHBondContact O-CG 3.35Å; L190-R194 PolarHBondContact O-N 3.41Å
191S81.4Confident82.3Confident51 Ų51103.6 Ų103.636%0.35750%0.497SS..Hα-helixtrans-62.5-46.9175.4-66.30000111.8S187 N188 Q193 R194 E195S187-S191 PolarHBondContact O-N 2.95Å; S187-S191 PolarHBondContact O-OG 3.37Å; S187-S191 VanDerWaalsContact O-OG 3.13Å; N188-S191 PolarHBondContact O-N 3.24Å; S191-Q193 VanDerWaalsContact C-N 3.29Å; S191-Q193 PolarHBondContact O-N 3.22Å; S191-R194 PolarHBondContact O-N 3.21Å; S191-E195 WeakPolarHBondContact O-CG 3.39Å; S191-E195 PolarHBondContact O-N 2.92Å
192R81.8Confident83.4Confident179 Ų17999.7 Ų99.768%0.67548%0.479SS*.Hα-helixtrans-60.9-38176.3-76.3-179.9176.2173-0.3112.6N188 L189 E195 M196N188-R192 WeakPolarHBondContact O-CG 3.37Å; N188-R192 PolarHBondContact O-N 3.01Å; L189-R192 PolarHBondContact O-N 3.47Å; R192-E195 PolarHBondContact O-N 3.39Å; R192-M196 WeakPolarHBondContact O-CB 3.27Å; R192-M196 PolarHBondContact O-N 2.96Å
193Q87.7Confident84.4Confident106 Ų10698.6 Ų98.650%0.49547%0.468SS..Hα-helixtrans-64.2-43.7176.6-176.7176.3-7.700111.4L189 L190 S191 M196 E197L189-Q193 WeakPolarHBondContact O-CB 3.42Å; L189-Q193 PolarHBondContact O-N 3.23Å; L190-Q193 PolarHBondContact O-N 3.47Å; S191-Q193 VanDerWaalsContact C-N 3.29Å; S191-Q193 PolarHBondContact O-N 3.22Å; Q193-M196 WeakPolarHBondContact O-CB 3.45Å; Q193-M196 PolarHBondContact O-N 3.42Å; Q193-E197 WeakPolarHBondContact CG-OE1 3.2Å; Q193-E197 PolarHBondContact NE2-OE1 3.44Å; Q193-E197 WeakPolarHBondContact O-CG 3.26Å; Q193-E197 PolarHBondContact O-N 3.4Å
194R86.8Confident85.1Confident174 Ų17496.5 Ų96.566%0.65746%0.463SS*.Hα-helixtrans-63.4-41.4176.7-71.3174.9-177.11761.5112.5L190 S191 M196 E197 A198L190-R194 WeakPolarHBondContact O-CG 3.35Å; L190-R194 PolarHBondContact O-N 3.41Å; S191-R194 PolarHBondContact O-N 3.21Å; R194-M196 VanDerWaalsContact C-N 3.35Å; R194-E197 PolarHBondContact O-N 3.39Å; R194-A198 WeakPolarHBondContact O-CB 3.1Å; R194-A198 PolarHBondContact O-N 2.95Å
195E84.9Confident85.9Confident130 Ų13089.8 Ų89.861%0.60744%0.439SS*.Hα-helixtrans-60.4-44.7174.9-72.6169.7-172.100111.3S191 R192 A198 F199S191-E195 WeakPolarHBondContact O-CG 3.39Å; S191-E195 PolarHBondContact O-N 2.92Å; R192-E195 PolarHBondContact O-N 3.39Å; E195-A198 PolarHBondContact O-N 3.14Å; E195-F199 WeakPolarHBondContact O-CB 3.19Å; E195-F199 PolarHBondContact O-N 2.91Å
196M86.7Confident86.7Confident110 Ų11085.3 Ų85.354%0.54242%0.418SS..Hα-helixtrans-62.6-42.3175.7-177.586.271.400112.5R192 Q193 R194 F199 K200R192-M196 WeakPolarHBondContact O-CB 3.27Å; R192-M196 PolarHBondContact O-N 2.96Å; Q193-M196 WeakPolarHBondContact O-CB 3.45Å; Q193-M196 PolarHBondContact O-N 3.42Å; R194-M196 VanDerWaalsContact C-N 3.35Å; M196-F199 PolarHBondContact O-N 3.45Å; M196-K200 HydrophobicContact CG-CD 4.48Å; M196-K200 WeakPolarHBondContact O-CG 3.5Å; M196-K200 PolarHBondContact O-N 3.1Å
197E88.6Confident87.1Confident100 Ų10082.9 Ų82.947%0.46741%0.409SS..Hα-helixtrans-65.9-42.5177.6-74.3169.8-172.200111.3Q193 R194 K200 A201Q193-E197 WeakPolarHBondContact CG-OE1 3.2Å; Q193-E197 PolarHBondContact NE2-OE1 3.44Å; Q193-E197 WeakPolarHBondContact O-CG 3.26Å; Q193-E197 PolarHBondContact O-N 3.4Å; R194-E197 PolarHBondContact O-N 3.39Å; E197-K200 PolarHBondContact O-N 3.42Å; E197-A201 WeakPolarHBondContact O-CB 3.49Å; E197-A201 PolarHBondContact O-N 2.98Å
198A87.8Confident87.5Confident41 Ų4181.6 Ų81.634%0.33940%0.399SS..Hα-helixtrans-63.6-41.3174.900000111.9R194 E195 A201 T202 L249R194-A198 WeakPolarHBondContact O-CB 3.1Å; R194-A198 PolarHBondContact O-N 2.95Å; E195-A198 PolarHBondContact O-N 3.14Å; A198-A201 PolarHBondContact O-N 3.19Å; A198-T202 WeakPolarHBondContact O-CB 3.36Å; A198-T202 PolarHBondContact O-N 2.82Å; A198-T202 PolarHBondContact O-OG1 3.19Å; A198-L249 HydrophobicContact CB-CD2 3.79Å
199F89.5Confident87.8Confident57 Ų5777.2 Ų77.225%0.2538%0.376CS..Hα-helixtrans-59.8-49.3176.4-175.9-84.2000111.3E195 M196 T202 R203 L249 V253 E256E195-F199 WeakPolarHBondContact O-CB 3.19Å; E195-F199 PolarHBondContact O-N 2.91Å; M196-F199 PolarHBondContact O-N 3.45Å; F199-T202 PolarHBondContact O-N 3.33Å; F199-R203 WeakPolarHBondContact O-CB 2.95Å; F199-R203 PolarHBondContact O-N 3.31Å; F199-L249 HydrophobicContact CB-CD1 3.96Å; F199-L249 HydrophobicContact CD2-CD1 3.55Å; F199-L249 HydrophobicContact CG-CD1 4.22Å; F199-V253 HydrophobicContact CD2-CG2 3.89Å; F199-V253 HydrophobicContact CE1-CG2 4.47Å; F199-V253 HydrophobicContact CE2-CG2 3.56Å; F199-V253 HydrophobicContact CG-CG2 4.45Å; F199-V253 HydrophobicContact CZ-CG2 3.89Å; F199-E256 WeakPolarHBondContact CZ-OE1 3.29Å; F199-E256 WeakPolarHBondContact CZ-OE2 3.36Å
200K89.8Confident87.8Confident118 Ų11873.2 Ų73.251%0.51335%0.354SS..Hα-helixtrans-60.2-47.6177.1-73.3174.5-179.5-179.10111.8M196 E197 T202 R203 D204M196-K200 HydrophobicContact CG-CD 4.48Å; M196-K200 WeakPolarHBondContact O-CG 3.5Å; M196-K200 PolarHBondContact O-N 3.1Å; E197-K200 PolarHBondContact O-N 3.42Å; K200-T202 VanDerWaalsContact C-N 3.31Å; K200-T202 PolarHBondContact O-N 3.43Å; K200-R203 PolarHBondContact O-N 3.25Å; K200-D204 VanDerWaalsContact O-CG 3.23Å; K200-D204 PolarHBondContact O-N 3.02Å
201A89.9Confident87.6Confident46 Ų4672 Ų7238%0.3835%0.352SS..Hα-helixtrans-59.1-43178.100000112E197 A198 D204 I205E197-A201 WeakPolarHBondContact O-CB 3.49Å; E197-A201 PolarHBondContact O-N 2.98Å; A198-A201 PolarHBondContact O-N 3.19Å; A201-D204 PolarHBondContact O-N 2.7Å; A201-I205 WeakPolarHBondContact O-CD1 3.4Å; A201-I205 VanDerWaalsContact O-CG1 3.32Å; A201-I205 WeakPolarHBondContact O-CG1 3.47Å; A201-I205 PolarHBondContact O-N 3.27Å; A201-I205 VanDerWaalsContact O-N 3.13Å
202T90.5Very high87.7Confident2 Ų272.1 Ų72.11%0.01235%0.347CS..Hα-helixtrans-62.6-44.1176.8-56.30000111.3A198 F199 K200 I205 L206 L249 L250 V253A198-T202 WeakPolarHBondContact O-CB 3.36Å; A198-T202 PolarHBondContact O-N 2.82Å; A198-T202 PolarHBondContact O-OG1 3.19Å; F199-T202 PolarHBondContact O-N 3.33Å; K200-T202 VanDerWaalsContact C-N 3.31Å; K200-T202 PolarHBondContact O-N 3.43Å; T202-I205 PolarHBondContact O-N 3.05Å; T202-L206 PolarHBondContact O-N 3.19Å; T202-L206 VanDerWaalsContact O-N 3.14Å; T202-L249 WeakPolarHBondContact OG1-CD2 3.38Å; T202-L250 HydrophobicContact CG2-CB 4.47Å; T202-L250 HydrophobicContact CG2-CD1 3.85Å; T202-V253 HydrophobicContact CG2-CB 4.33Å; T202-V253 HydrophobicContact CG2-CG2 4.09Å
203R91.9Very high87.7Confident82 Ų8265.3 Ų65.331%0.30932%0.322SS..Hα-helixtrans-63.4-44.3177.2-170.5177.3176114.35.8112.3F199 K200 I205 L206 I207 V253 E256 F259F199-R203 WeakPolarHBondContact O-CB 2.95Å; F199-R203 PolarHBondContact O-N 3.31Å; K200-R203 PolarHBondContact O-N 3.25Å; R203-I205 VanDerWaalsContact C-N 3.29Å; R203-I205 PolarHBondContact O-N 3.35Å; R203-L206 PolarHBondContact O-N 3.39Å; R203-L206 VanDerWaalsContact O-N 3.16Å; R203-I207 HydrophobicContact CG-CD1 3.99Å; R203-I207 VanDerWaalsContact O-CG1 3.31Å; R203-I207 WeakPolarHBondContact O-CG1 3.34Å; R203-I207 PolarHBondContact O-N 3Å; R203-V253 HydrophobicContact CB-CG1 3.92Å; R203-V253 HydrophobicContact CG-CG1 4.08Å; R203-E256 IonicContact CZ-OE2 3.67Å; R203-E256 IonicContact NH1-OE1 3.34Å; R203-E256 PolarHBondContact NH1-OE1 2.87Å; R203-E256 IonicContact NH1-OE2 2.63Å; R203-E256 PolarHBondContact NH1-OE2 3.49Å; R203-F259 HydrophobicContact CG-CE2 4.19Å; R203-F259 HydrophobicContact CG-CZ 3.96Å
204D90.3Very high87.4Confident100 Ų10062.7 Ų62.754%0.53531%0.308SS..Hα-helixtrans-62-37.3179.1-68.9-20.7000111.8K200 A201 I207 S208K200-D204 VanDerWaalsContact O-CG 3.23Å; K200-D204 PolarHBondContact O-N 3.02Å; A201-D204 PolarHBondContact O-N 2.7Å; D204-I207 PolarHBondContact O-N 2.83Å; D204-S208 PolarHBondContact O-N 2.8Å; D204-S208 PolarHBondContact O-OG 2.86Å
205I88.9Confident86.9Confident21 Ų2160.6 Ų60.611%0.10831%0.305CS..Hα-helixtrans-69.5-35.2176.2-69163.3000111.9A201 T202 R203 S208 Y209 L235 E238 I239 L242A201-I205 WeakPolarHBondContact O-CD1 3.4Å; A201-I205 VanDerWaalsContact O-CG1 3.32Å; A201-I205 WeakPolarHBondContact O-CG1 3.47Å; A201-I205 PolarHBondContact O-N 3.27Å; A201-I205 VanDerWaalsContact O-N 3.13Å; T202-I205 PolarHBondContact O-N 3.05Å; R203-I205 VanDerWaalsContact C-N 3.29Å; R203-I205 PolarHBondContact O-N 3.35Å; I205-S208 WeakPolarHBondContact CA-OG 3.14Å; I205-S208 PolarHBondContact O-OG 3.44Å; I205-Y209 PolarHBondContact O-N 3.2Å; I205-Y209 VanDerWaalsContact O-N 3.09Å; I205-L235 HydrophobicContact CG2-CD2 4.4Å; I205-E238 HydrophobicContact CD1-CG 4.04Å; I205-I239 HydrophobicContact CG2-CD1 4.16Å; I205-I239 HydrophobicContact CG2-CG1 3.49Å; I205-I239 VanDerWaalsContact CG2-CG1 3.49Å; I205-L242 HydrophobicContact CB-CD1 4.47Å; I205-L242 HydrophobicContact CD1-CD1 3.58Å; I205-L242 HydrophobicContact CG2-CD1 4.33Å
206L89.3Confident86.2Confident0 Ų056.3 Ų56.30%029%0.29CS..Hα-helixtrans-73-34.5174.1-70.6177.1000112.1T202 R203 Y209 E210 I239 L250 V253 L254 F259 L296T202-L206 PolarHBondContact O-N 3.19Å; T202-L206 VanDerWaalsContact O-N 3.14Å; R203-L206 PolarHBondContact O-N 3.39Å; R203-L206 VanDerWaalsContact O-N 3.16Å; L206-Y209 WeakPolarHBondContact O-CB 3.22Å; L206-Y209 PolarHBondContact O-N 3.36Å; L206-E210 WeakPolarHBondContact O-CB 3.06Å; L206-E210 PolarHBondContact O-N 3.16Å; L206-I239 HydrophobicContact CD2-CD1 4.23Å; L206-L250 HydrophobicContact CD1-CD1 4.14Å; L206-L250 HydrophobicContact CD2-CD1 4.31Å; L206-L250 HydrophobicContact CG-CD1 4.43Å; L206-V253 HydrophobicContact CD1-CB 4.1Å; L206-V253 HydrophobicContact CD1-CG1 3.64Å; L206-L254 HydrophobicContact CD1-CD2 3.84Å; L206-L254 HydrophobicContact CD1-CG 3.95Å; L206-L254 HydrophobicContact CD2-CD2 3.96Å; L206-F259 HydrophobicContact CB-CD1 4.06Å; L206-F259 HydrophobicContact CB-CE1 3.46Å; L206-F259 VanDerWaalsContact CB-CE1 3.46Å; L206-F259 HydrophobicContact CB-CZ 3.88Å; L206-L296 HydrophobicContact CD2-CD1 3.91Å
207I88.9Confident85.2Confident72 Ų7253.8 Ų53.837%0.36928%0.278SS..Hα-helixtrans-65.4-41.5173.4-68.8166.7000110.8R203 D204 Y209 E210 S211 F259R203-I207 HydrophobicContact CG-CD1 3.99Å; R203-I207 VanDerWaalsContact O-CG1 3.31Å; R203-I207 WeakPolarHBondContact O-CG1 3.34Å; R203-I207 PolarHBondContact O-N 3Å; D204-I207 PolarHBondContact O-N 2.83Å; I207-Y209 VanDerWaalsContact C-N 3.33Å; I207-E210 PolarHBondContact O-N 3.22Å; I207-S211 WeakPolarHBondContact O-CB 3.37Å; I207-S211 PolarHBondContact O-N 3.48Å; I207-F259 HydrophobicContact CG1-CE1 4.23Å; I207-F259 HydrophobicContact CG1-CZ 4.05Å
208S87.3Confident83.8Confident36 Ų3656.2 Ų56.225%0.25229%0.294SS..Hα-helixtrans-64.3-40.7175.765.10000111.3D204 I205 S211 E212 L235D204-S208 PolarHBondContact O-N 2.8Å; D204-S208 PolarHBondContact O-OG 2.86Å; I205-S208 WeakPolarHBondContact CA-OG 3.14Å; I205-S208 PolarHBondContact O-OG 3.44Å; S208-S211 PolarHBondContact O-N 2.86Å; S208-E212 WeakPolarHBondContact O-CG 3.41Å; S208-E212 PolarHBondContact O-N 3.03Å; S208-L235 VanDerWaalsContact OG-CD2 3.22Å; S208-L235 WeakPolarHBondContact OG-CD2 3.08Å
209Y87.8Confident82.3Confident1 Ų155.5 Ų55.50%0.00429%0.291CS..Hα-helixtrans-57.5-50.2171.3177.1-95.9000111.8I205 L206 I207 S211 E212 R213 M232 L236 I239 W293 L296I205-Y209 PolarHBondContact O-N 3.2Å; I205-Y209 VanDerWaalsContact O-N 3.09Å; L206-Y209 WeakPolarHBondContact O-CB 3.22Å; L206-Y209 PolarHBondContact O-N 3.36Å; I207-Y209 VanDerWaalsContact C-N 3.33Å; Y209-S211 PolarHBondContact O-N 3.15Å; Y209-E212 PolarHBondContact O-N 3.24Å; Y209-R213 HydrophobicContact CD1-CG 4.17Å; Y209-R213 HydrophobicContact CD2-CG 4.46Å; Y209-R213 HydrophobicContact CE1-CG 3.76Å; Y209-R213 HydrophobicContact CE2-CG 4.06Å; Y209-R213 WeakPolarHBondContact O-CG 3.14Å; Y209-R213 PolarHBondContact O-N 2.64Å; Y209-M232 HydrophobicContact CD2-CE 3.48Å; Y209-M232 VanDerWaalsContact CD2-CE 3.48Å; Y209-M232 HydrophobicContact CE2-CE 3.97Å; Y209-M232 HydrophobicContact CG-CE 4.21Å; Y209-L236 HydrophobicContact CD2-CD2 4.37Å; Y209-L236 HydrophobicContact CE2-CD2 3.88Å; Y209-I239 HydrophobicContact CD2-CD1 4.26Å; Y209-I239 HydrophobicContact CG-CD1 4.3Å; Y209-W293 HydrophobicContact CD1-CE3 4.4Å; Y209-W293 HydrophobicContact CD1-CH2 4.37Å; Y209-W293 AromaticContact CD1-CZ3 3.74Å; Y209-W293 HydrophobicContact CD1-CZ3 3.74Å; Y209-W293 AromaticContact CE1-CE3 3.93Å; Y209-W293 HydrophobicContact CE1-CE3 3.93Å; Y209-W293 AromaticContact CE1-CZ3 3.74Å; Y209-W293 HydrophobicContact CE1-CZ3 3.74Å; Y209-L296 HydrophobicContact CD1-CD1 3.93Å; Y209-L296 HydrophobicContact CE1-CB 4.15Å; Y209-L296 HydrophobicContact CE1-CD1 3.89Å; Y209-L296 HydrophobicContact CE2-CB 4.42Å; Y209-L296 HydrophobicContact CG-CD1 4.27Å
210E86.3Confident80.2Confident29 Ų2958 Ų5814%0.13631%0.313CS..Hα-helixtrans-58.6-48.9179.3-173-168.3169.900111.8L206 I207 E212 R213 Y214 Q266 F292L206-E210 WeakPolarHBondContact O-CB 3.06Å; L206-E210 PolarHBondContact O-N 3.16Å; I207-E210 PolarHBondContact O-N 3.22Å; E210-E212 PolarHBondContact O-N 2.96Å; E210-R213 WeakPolarHBondContact O-CB 3.23Å; E210-R213 PolarHBondContact O-N 3.38Å; E210-R213 VanDerWaalsContact O-N 3.14Å; E210-Y214 HydrophobicContact CG-CD2 3.79Å; E210-Y214 HydrophobicContact CG-CE2 3.5Å; E210-Y214 VanDerWaalsContact CG-CE2 3.5Å; E210-Y214 VanDerWaalsContact O-CD2 3.23Å; E210-Y214 WeakPolarHBondContact O-CD2 3.39Å; E210-Y214 PolarHBondContact O-N 3.16Å; E210-Y214 WeakPolarHBondContact OE1-CE2 3.47Å; E210-Q266 PolarHBondContact OE1-NE2 2.94Å; E210-F292 HydrophobicContact CG-CE1 4.25Å; E210-F292 HydrophobicContact CG-CZ 3.91Å
211S84.5Confident78.1Confident56 Ų5659.8 Ų59.839%0.39232%0.323SS..Hα-helixtrans-59-46.5179.6-178.60000112.3I207 S208 Y209 R213 Y214 Q215I207-S211 WeakPolarHBondContact O-CB 3.37Å; I207-S211 PolarHBondContact O-N 3.48Å; S208-S211 PolarHBondContact O-N 2.86Å; Y209-S211 PolarHBondContact O-N 3.15Å; S211-R213 VanDerWaalsContact C-N 3.31Å; S211-R213 PolarHBondContact O-N 3.48Å; S211-Y214 PolarHBondContact O-N 2.8Å; S211-Q215 VanDerWaalsContact O-CG 3.3Å; S211-Q215 WeakPolarHBondContact O-CG 3.24Å; S211-Q215 PolarHBondContact O-N 3.22Å; S211-Q215 PolarHBondContact OG-NE2 3.29Å
212E82.3Confident75.9Confident54 Ų5467 Ų6725%0.25235%0.349SS..Hα-helixtrans-65.7-34.3177.1-73.9-170.2-170.600111.6S208 Y209 E210 Q215 S216 M232 L235S208-E212 WeakPolarHBondContact O-CG 3.41Å; S208-E212 PolarHBondContact O-N 3.03Å; Y209-E212 PolarHBondContact O-N 3.24Å; E210-E212 PolarHBondContact O-N 2.96Å; E212-Q215 PolarHBondContact O-N 3.23Å; E212-S216 PolarHBondContact O-N 3.37Å; E212-M232 HydrophobicContact CB-CE 3.38Å; E212-M232 HydrophobicContact CB-SD 3.56Å; E212-M232 VanDerWaalsContact CB-SD 3.56Å; E212-M232 HydrophobicContact CG-CE 4.19Å; E212-M232 WeakPolarHBondContact OE2-CE 3.26Å; E212-M232 VanDerWaalsContact OE2-CG 3.23Å; E212-M232 WeakPolarHBondContact OE2-CG 3.4Å; E212-L235 HydrophobicContact CG-CD1 4.31Å; E212-L235 WeakPolarHBondContact OE1-CD1 3.29Å; E212-L235 VanDerWaalsContact OE2-CD1 3.28Å; E212-L235 WeakPolarHBondContact OE2-CD1 3.28Å
213R81.7Confident73.7Confident37 Ų3772.2 Ų72.214%0.1438%0.377CS..Hα-helixtrans-67.3-42174.8-68.2-65.5-69.6150-0.3112Y209 E210 S211 S216 L217 M232 F292Y209-R213 HydrophobicContact CD1-CG 4.17Å; Y209-R213 HydrophobicContact CD2-CG 4.46Å; Y209-R213 HydrophobicContact CE1-CG 3.76Å; Y209-R213 HydrophobicContact CE2-CG 4.06Å; Y209-R213 WeakPolarHBondContact O-CG 3.14Å; Y209-R213 PolarHBondContact O-N 2.64Å; E210-R213 WeakPolarHBondContact O-CB 3.23Å; E210-R213 PolarHBondContact O-N 3.38Å; E210-R213 VanDerWaalsContact O-N 3.14Å; S211-R213 VanDerWaalsContact C-N 3.31Å; S211-R213 PolarHBondContact O-N 3.48Å; R213-S216 PolarHBondContact O-N 3.02Å; R213-S216 PolarHBondContact O-OG 3.31Å; R213-L217 WeakPolarHBondContact O-CG 3.43Å; R213-L217 PolarHBondContact O-N 3.08Å; R213-M232 HydrophobicContact CG-CE 4.49Å; R213-M232 HydrophobicContact CG-SD 4.38Å; R213-F292 HydrophobicContact CB-CD2 4.35Å; R213-F292 HydrophobicContact CB-CE1 4.35Å; R213-F292 HydrophobicContact CB-CE2 3.57Å; R213-F292 HydrophobicContact CB-CZ 3.57Å; R213-F292 HydrophobicContact CG-CZ 4.4Å
214Y80.8Confident71.7Confident51 Ų5175 Ų7520%0.239%0.388CS..Hα-helixtrans-63.6-42.4173.6-80-70000112.4E210 S211 S216 L217 D218 L270 F292E210-Y214 HydrophobicContact CG-CD2 3.79Å; E210-Y214 HydrophobicContact CG-CE2 3.5Å; E210-Y214 VanDerWaalsContact CG-CE2 3.5Å; E210-Y214 VanDerWaalsContact O-CD2 3.23Å; E210-Y214 WeakPolarHBondContact O-CD2 3.39Å; E210-Y214 PolarHBondContact O-N 3.16Å; E210-Y214 WeakPolarHBondContact OE1-CE2 3.47Å; S211-Y214 PolarHBondContact O-N 2.8Å; Y214-S216 PolarHBondContact O-N 2.92Å; Y214-L217 HydrophobicContact CD1-CD1 4.23Å; Y214-L217 WeakPolarHBondContact O-CB 3.34Å; Y214-L217 PolarHBondContact O-N 3.36Å; Y214-D218 PolarHBondContact O-N 3.04Å; Y214-L270 HydrophobicContact CE1-CD2 4.11Å; Y214-L270 HydrophobicContact CE1-CG 4.34Å; Y214-F292 HydrophobicContact CD1-CE2 4.38Å; Y214-F292 HydrophobicContact CD2-CE2 4.14Å; Y214-F292 HydrophobicContact CD2-CZ 4.03Å; Y214-F292 HydrophobicContact CE1-CE2 4.23Å; Y214-F292 AromaticContact CE2-CE2 3.96Å; Y214-F292 HydrophobicContact CE2-CE2 3.96Å; Y214-F292 AromaticContact CE2-CZ 3.74Å; Y214-F292 HydrophobicContact CE2-CZ 3.74Å; Y214-F292 HydrophobicContact CG-CE2 4.34Å
215Q78.1Confident69.5Low130 Ų13073.7 Ų73.761%0.60739%0.39SS*.Hα-helixtrans-59.3-36.1174.8-70.4171.730.100112.3S211 E212 L217S211-Q215 VanDerWaalsContact O-CG 3.3Å; S211-Q215 WeakPolarHBondContact O-CG 3.24Å; S211-Q215 PolarHBondContact O-N 3.22Å; S211-Q215 PolarHBondContact OG-NE2 3.29Å; E212-Q215 PolarHBondContact O-N 3.23Å; Q215-L217 VanDerWaalsContact C-N 3.29Å; Q215-L217 PolarHBondContact O-N 2.8Å
216S69.2Low67.5Low40 Ų4079.3 Ų79.328%0.2842%0.42SS..Hα-helixtrans-71.1-21.1175.977.70000114.2E212 R213 Y214E212-S216 PolarHBondContact O-N 3.37Å; R213-S216 PolarHBondContact O-N 3.02Å; R213-S216 PolarHBondContact O-OG 3.31Å; Y214-S216 PolarHBondContact O-N 2.92Å
217L65.3Low65.4Low57 Ų5780.6 Ų80.630%0.29843%0.431SS..Hα-helixtrans-81.4-26.8178.5-72.7166.3000112.7R213 Y214 Q215 G219 L270 F292R213-L217 WeakPolarHBondContact O-CG 3.43Å; R213-L217 PolarHBondContact O-N 3.08Å; Y214-L217 HydrophobicContact CD1-CD1 4.23Å; Y214-L217 WeakPolarHBondContact O-CB 3.34Å; Y214-L217 PolarHBondContact O-N 3.36Å; Q215-L217 VanDerWaalsContact C-N 3.29Å; Q215-L217 PolarHBondContact O-N 2.8Å; L217-G219 PolarHBondContact O-N 2.87Å; L217-L270 HydrophobicContact CD1-CD2 4.03Å; L217-F292 HydrophobicContact CD1-CD2 3.93Å; L217-F292 HydrophobicContact CD1-CE2 4.01Å
218D58.9Low63.5Low150 Ų15081.1 Ų81.180%0.80244%0.439SS*.SBendtrans-72.8-2.9175.9-78.1-24.3000113.8Y214Y214-D218 PolarHBondContact O-N 3.04Å
219G56.5Low61.8Low27 Ų2784.6 Ų84.628%0.27845%0.454SS..SBendtrans-77.3164.617700000115.6L217L217-G219 PolarHBondContact O-N 2.87Å
220P45.3Very low60.2Low110 Ų11087.6 Ų87.671%0.71448%0.479SS*.  trans-60147.7-179.921.8-29.9000113.4E222 D223P220-E222 VanDerWaalsContact C-N 3.26Å; P220-E222 PolarHBondContact O-N 3.46Å; P220-D223 PolarHBondContact O-N 3.17Å
221Q46.5Very low58.9Low154 Ų15492.1 Ų92.172%0.7250%0.504SS*.THydrogen-bonded Turntrans-61.2-17.4-157.8-167.7174.2-1700116.8
222E44.1Very low58.1Low197 Ų19790.3 Ų90.392%0.92149%0.49SS*.THydrogen-bonded Turntrans-80.4-19.1-174.7-65.1-171.9158.300114.1P220P220-E222 VanDerWaalsContact C-N 3.26Å; P220-E222 PolarHBondContact O-N 3.46Å
223D43.6Very low57.8Low113 Ų11391.2 Ų91.260%0.60450%0.502SS*.SBendtrans-99.8-3.5-177.3-80.7-34.9000115.1P220 A225 L226 A227P220-D223 PolarHBondContact O-N 3.17Å; D223-A225 PolarHBondContact O-N 3.31Å; D223-L226 PolarHBondContact O-N 2.96Å; D223-A227 PolarHBondContact O-N 2.62Å; D223-A227 VanDerWaalsContact O-N 3.14Å
224R49.6Very low57.9Low141 Ų14196.2 Ų96.253%0.53252%0.521SS..THydrogen-bonded Turntrans-61.4-21.4-168.5-70.2-178.4178.1178-0.5116
225A44.8Very low58Low71 Ų7193.9 Ų93.959%0.58751%0.512SS*.THydrogen-bonded Turntrans-94.5-13.6-174.500000114.3D223D223-A225 PolarHBondContact O-N 3.31Å
226L46.7Very low58.2Low139 Ų13988.2 Ų88.273%0.72849%0.485SS*.  trans-156.540.1-172.4-73.7171.9000111.6D223D223-L226 PolarHBondContact O-N 2.96Å
227A44.6Very low58.9Low28 Ų2887.8 Ų87.823%0.23149%0.488CS..  trans-49.2134.417100000109.5D223 L229D223-A227 PolarHBondContact O-N 2.62Å; D223-A227 VanDerWaalsContact O-N 3.14Å; A227-L229 PolarHBondContact O-N 2.87Å
228P50.3Low59.8Low82 Ų8289 Ų8953%0.53249%0.492SS..  trans-61.9116.9-162.5-19.530.6000110.7A230 D231P228-A230 HydrophobicContact CB-CB 4.16Å; P228-A230 PolarHBondContact O-N 2.72Å; P228-D231 PolarHBondContact O-N 2.99Å
229L51.7Low61.2Low109 Ų10981.9 Ų81.957%0.57145%0.454SS*.THydrogen-bonded Turntrans-51.9-12.8167.9-140.896.8000113.1A227 S233 L236 P295A227-L229 PolarHBondContact O-N 2.87Å; L229-S233 PolarHBondContact O-N 2.78Å; L229-L236 HydrophobicContact CD1-CD1 4.31Å; L229-L236 HydrophobicContact CD2-CD1 3.92Å; L229-L236 HydrophobicContact CG-CD1 3.74Å; L229-P295 HydrophobicContact CD1-CB 3.88Å
230A53.1Low62.6Low64 Ų6485.7 Ų85.753%0.52946%0.463SS..THydrogen-bonded Turntrans-66.8-40.3-178.500000113P228 M232 S233P228-A230 HydrophobicContact CB-CB 4.16Å; P228-A230 PolarHBondContact O-N 2.72Å; A230-M232 VanDerWaalsContact C-N 3.29Å; A230-M232 PolarHBondContact O-N 2.9Å; A230-S233 WeakPolarHBondContact O-CB 3.42Å; A230-S233 PolarHBondContact O-N 3.46Å; A230-S233 PolarHBondContact O-OG 3.17Å
231D60Low64.6Low124 Ų12485.7 Ų85.766%0.66345%0.453SS*.THydrogen-bonded Turntrans-73-25.3-176.9-67.1-18.9000112P228P228-D231 PolarHBondContact O-N 2.99Å
232M66.6Low66.5Low19 Ų1979.9 Ų79.99%0.09443%0.427CS..THydrogen-bonded Turntrans-103.213178.5-58.7-158.957.800114Y209 E212 R213 A230 W234 L235 L236Y209-M232 HydrophobicContact CD2-CE 3.48Å; Y209-M232 VanDerWaalsContact CD2-CE 3.48Å; Y209-M232 HydrophobicContact CE2-CE 3.97Å; Y209-M232 HydrophobicContact CG-CE 4.21Å; E212-M232 HydrophobicContact CB-CE 3.38Å; E212-M232 HydrophobicContact CB-SD 3.56Å; E212-M232 VanDerWaalsContact CB-SD 3.56Å; E212-M232 HydrophobicContact CG-CE 4.19Å; E212-M232 WeakPolarHBondContact OE2-CE 3.26Å; E212-M232 VanDerWaalsContact OE2-CG 3.23Å; E212-M232 WeakPolarHBondContact OE2-CG 3.4Å; R213-M232 HydrophobicContact CG-CE 4.49Å; R213-M232 HydrophobicContact CG-SD 4.38Å; A230-M232 VanDerWaalsContact C-N 3.29Å; A230-M232 PolarHBondContact O-N 2.9Å; M232-W234 PolarHBondContact O-N 3.15Å; M232-L235 HydrophobicContact CE-CD1 3.6Å; M232-L235 PolarHBondContact O-N 3.12Å; M232-L236 WeakPolarHBondContact O-CB 3.28Å; M232-L236 WeakPolarHBondContact O-CG 3.16Å; M232-L236 PolarHBondContact O-N 3.06Å
233S75.8Confident68.5Low73 Ų7371.3 Ų71.351%0.5139%0.388SS..Hα-helixtrans-61.9-30.9-176.657.20000113.1L229 A230 G237L229-S233 PolarHBondContact O-N 2.78Å; A230-S233 WeakPolarHBondContact O-CB 3.42Å; A230-S233 PolarHBondContact O-N 3.46Å; A230-S233 PolarHBondContact O-OG 3.17Å; S233-G237 PolarHBondContact O-N 3.19Å
234W83.6Confident70.5Confident142 Ų14271.9 Ų71.954%0.53839%0.391SS..Hα-helixtrans-71.1-47.7176.974.6-86.4000111.8M232 G237 E238M232-W234 PolarHBondContact O-N 3.15Å; W234-G237 WeakPolarHBondContact O-CA 3.48Å; W234-G237 PolarHBondContact O-N 3.36Å; W234-G237 VanDerWaalsContact O-N 3.14Å; W234-E238 WeakPolarHBondContact CZ3-OE2 3.36Å; W234-E238 PolarHBondContact O-N 3.06Å
235L83.3Confident72.1Confident1 Ų171.4 Ų71.41%0.00540%0.399CS..Hα-helixtrans-62.6-45.3175.2-80.3171.3000112.1I205 S208 E212 M232 G237 E238 I239I205-L235 HydrophobicContact CG2-CD2 4.4Å; S208-L235 VanDerWaalsContact OG-CD2 3.22Å; S208-L235 WeakPolarHBondContact OG-CD2 3.08Å; E212-L235 HydrophobicContact CG-CD1 4.31Å; E212-L235 WeakPolarHBondContact OE1-CD1 3.29Å; E212-L235 VanDerWaalsContact OE2-CD1 3.28Å; E212-L235 WeakPolarHBondContact OE2-CD1 3.28Å; M232-L235 HydrophobicContact CE-CD1 3.6Å; M232-L235 PolarHBondContact O-N 3.12Å; L235-G237 PolarHBondContact O-N 3.06Å; L235-E238 PolarHBondContact O-N 3.05Å; L235-E238 VanDerWaalsContact O-N 3.16Å; L235-I239 VanDerWaalsContact O-CG1 3.28Å; L235-I239 WeakPolarHBondContact O-CG1 3.2Å; L235-I239 PolarHBondContact O-N 3Å
236L82.7Confident74.1Confident11 Ų1169.7 Ų69.76%0.05838%0.383CS..Hα-helixtrans-62.9-33.6175.5-70.7174.2000111.4Y209 L229 M232 K240 M299Y209-L236 HydrophobicContact CD2-CD2 4.37Å; Y209-L236 HydrophobicContact CE2-CD2 3.88Å; L229-L236 HydrophobicContact CD1-CD1 4.31Å; L229-L236 HydrophobicContact CD2-CD1 3.92Å; L229-L236 HydrophobicContact CG-CD1 3.74Å; M232-L236 WeakPolarHBondContact O-CB 3.28Å; M232-L236 WeakPolarHBondContact O-CG 3.16Å; M232-L236 PolarHBondContact O-N 3.06Å; L236-K240 VanDerWaalsContact O-CB 3.27Å; L236-K240 WeakPolarHBondContact O-CB 3.33Å; L236-K240 PolarHBondContact O-N 3.06Å; L236-M299 HydrophobicContact CD2-CE 4.43Å; L236-M299 WeakPolarHBondContact O-CE 3.47Å
237G83.8Confident76Confident32 Ų3265.2 Ų65.233%0.3336%0.363SS..Hα-helixtrans-64.4-44.4172.100000112.5S233 W234 L235 K240 Q241S233-G237 PolarHBondContact O-N 3.19Å; W234-G237 WeakPolarHBondContact O-CA 3.48Å; W234-G237 PolarHBondContact O-N 3.36Å; W234-G237 VanDerWaalsContact O-N 3.14Å; L235-G237 PolarHBondContact O-N 3.06Å; G237-K240 WeakPolarHBondContact O-CB 3.35Å; G237-K240 PolarHBondContact O-N 3.44Å; G237-Q241 WeakPolarHBondContact O-CG 3.42Å; G237-Q241 PolarHBondContact O-N 3.48Å
238E85.1Confident78Confident82 Ų8267.6 Ų67.638%0.38337%0.372SS..Hα-helixtrans-67.7-46.1179.6-164.5169.3-172.300112.1I205 W234 L235 K240 Q241 L242I205-E238 HydrophobicContact CD1-CG 4.04Å; W234-E238 WeakPolarHBondContact CZ3-OE2 3.36Å; W234-E238 PolarHBondContact O-N 3.06Å; L235-E238 PolarHBondContact O-N 3.05Å; L235-E238 VanDerWaalsContact O-N 3.16Å; E238-K240 PolarHBondContact O-N 3.3Å; E238-Q241 PolarHBondContact O-N 3.35Å; E238-Q241 VanDerWaalsContact O-N 3.1Å; E238-L242 PolarHBondContact O-N 3.4Å
239I87.7Confident79.9Confident0 Ų065.3 Ų65.30%036%0.355CS..Hα-helixtrans-59.6-36.1172.8-64.3166.9000110.8I205 L206 Y209 L235 L242 S243 L250 L296 M299 L300I205-I239 HydrophobicContact CG2-CD1 4.16Å; I205-I239 HydrophobicContact CG2-CG1 3.49Å; I205-I239 VanDerWaalsContact CG2-CG1 3.49Å; L206-I239 HydrophobicContact CD2-CD1 4.23Å; Y209-I239 HydrophobicContact CD2-CD1 4.26Å; Y209-I239 HydrophobicContact CG-CD1 4.3Å; L235-I239 VanDerWaalsContact O-CG1 3.28Å; L235-I239 WeakPolarHBondContact O-CG1 3.2Å; L235-I239 PolarHBondContact O-N 3Å; I239-L242 PolarHBondContact O-N 2.89Å; I239-S243 PolarHBondContact O-N 3.23Å; I239-L250 HydrophobicContact CG2-CD1 4.36Å; I239-L250 HydrophobicContact CG2-CD2 4.22Å; I239-L296 HydrophobicContact CD1-CD1 4.04Å; I239-L296 HydrophobicContact CG2-CD1 4.5Å; I239-M299 HydrophobicContact CB-CE 4.06Å; I239-M299 HydrophobicContact CG2-CE 3.81Å; I239-L300 HydrophobicContact CG2-CD2 4.3Å
240K86.4Confident81.8Confident108 Ų10860.2 Ų60.247%0.4733%0.328SS..Hα-helixtrans-66-41175.9-167172.3-178.2176.70112.4L236 G237 E238 S243 L244 M299L236-K240 VanDerWaalsContact O-CB 3.27Å; L236-K240 WeakPolarHBondContact O-CB 3.33Å; L236-K240 PolarHBondContact O-N 3.06Å; G237-K240 WeakPolarHBondContact O-CB 3.35Å; G237-K240 PolarHBondContact O-N 3.44Å; E238-K240 PolarHBondContact O-N 3.3Å; K240-S243 PolarHBondContact O-N 2.98Å; K240-L244 WeakPolarHBondContact O-CG 3.4Å; K240-L244 PolarHBondContact O-N 2.91Å; K240-M299 HydrophobicContact CB-CE 4.04Å; K240-M299 HydrophobicContact CB-SD 3.49Å; K240-M299 WeakPolarHBondContact CB-SD 3.38Å; K240-M299 HydrophobicContact CD-SD 3.82Å; K240-M299 HydrophobicContact CG-SD 3.61Å
241Q86.1Confident83.6Confident110 Ų11057.1 Ų57.151%0.51430%0.303SS..Hα-helixtrans-64.9-44.7175.1-65-56-37.200110.6G237 E238 S243 L244 D245G237-Q241 WeakPolarHBondContact O-CG 3.42Å; G237-Q241 PolarHBondContact O-N 3.48Å; E238-Q241 PolarHBondContact O-N 3.35Å; E238-Q241 VanDerWaalsContact O-N 3.1Å; Q241-S243 VanDerWaalsContact C-N 3.26Å; Q241-S243 PolarHBondContact O-N 3.23Å; Q241-L244 WeakPolarHBondContact O-CA 3.18Å; Q241-L244 WeakPolarHBondContact O-CB 3.39Å; Q241-L244 PolarHBondContact O-N 3.44Å; Q241-D245 PolarHBondContact O-N 2.93Å
242L86.9Confident85Confident32 Ų3253.7 Ų53.717%0.16829%0.285CS..Hα-helixtrans-57.8-37.7174.1-73.3173.1000112.9I205 E238 I239 L244 D245 S246I205-L242 HydrophobicContact CB-CD1 4.47Å; I205-L242 HydrophobicContact CD1-CD1 3.58Å; I205-L242 HydrophobicContact CG2-CD1 4.33Å; E238-L242 PolarHBondContact O-N 3.4Å; I239-L242 PolarHBondContact O-N 2.89Å; L242-L244 PolarHBondContact O-N 2.89Å; L242-D245 PolarHBondContact O-N 3.39Å; L242-S246 CarbonylContact O-C 3.58Å; L242-S246 VanDerWaalsContact O-C 3.3Å; L242-S246 WeakPolarHBondContact O-CA 3.35Å; L242-S246 PolarHBondContact O-N 3.25Å; L242-S246 PolarHBondContact O-OG 3.4Å
243S86.8Confident86.1Confident16 Ų1652.8 Ų52.811%0.11228%0.28CS..Hα-helixtrans-65.4-26.3174.5-179.40000113.3I239 K240 Q241 S247I239-S243 PolarHBondContact O-N 3.23Å; K240-S243 PolarHBondContact O-N 2.98Å; Q241-S243 VanDerWaalsContact C-N 3.26Å; Q241-S243 PolarHBondContact O-N 3.23Å; S243-S247 WeakPolarHBondContact O-CB 3.39Å
244L85.5Confident86.8Confident125 Ų12549.3 Ų49.365%0.65426%0.256SS*.Hα-helixtrans-82.7-39176.5-66.5172.4000111.3K240 Q241 L242K240-L244 WeakPolarHBondContact O-CG 3.4Å; K240-L244 PolarHBondContact O-N 2.91Å; Q241-L244 WeakPolarHBondContact O-CA 3.18Å; Q241-L244 WeakPolarHBondContact O-CB 3.39Å; Q241-L244 PolarHBondContact O-N 3.44Å; L242-L244 PolarHBondContact O-N 2.89Å
245D83.8Confident87.2Confident131 Ų13142.6 Ų42.670%0.70123%0.231SC*.Hα-helixtrans-80.9-39.9-176.2-66.6-20.8000112.6Q241 L242Q241-D245 PolarHBondContact O-N 2.93Å; L242-D245 PolarHBondContact O-N 3.39Å
246S85Confident87.4Confident35 Ų3545 Ų4525%0.24524%0.242CC..  trans-15063.8-172.859.40000112.5L242 D248 L249 L250L242-S246 CarbonylContact O-C 3.58Å; L242-S246 VanDerWaalsContact O-C 3.3Å; L242-S246 WeakPolarHBondContact O-CA 3.35Å; L242-S246 PolarHBondContact O-N 3.25Å; L242-S246 PolarHBondContact O-OG 3.4Å; S246-D248 VanDerWaalsContact C-N 3.28Å; S246-D248 PolarHBondContact O-N 3.23Å; S246-L249 PolarHBondContact O-N 3.12Å; S246-L250 PolarHBondContact O-N 3.38Å
247S86.3Confident87.5Confident46 Ų4648.8 Ų48.832%0.32226%0.262SS..Hα-helixtrans-57.6-35.2178.155.10000114.4S243 L250 V251S243-S247 WeakPolarHBondContact O-CB 3.39Å; S247-L250 PolarHBondContact O-N 3.45Å; S247-V251 WeakPolarHBondContact O-CG2 3.46Å; S247-V251 PolarHBondContact O-N 2.72Å; S247-V251 VanDerWaalsContact O-N 3.11Å
248D88.7Confident87.5Confident78 Ų7847.8 Ų47.842%0.41725%0.251SS..Hα-helixtrans-61.9-51.5178.9-164.157.7000111.6S246 L250 V251 D252 K312S246-D248 VanDerWaalsContact C-N 3.28Å; S246-D248 PolarHBondContact O-N 3.23Å; D248-L250 VanDerWaalsContact C-N 3.34Å; D248-L250 PolarHBondContact O-N 2.98Å; D248-V251 PolarHBondContact O-N 3.12Å; D248-D252 VanDerWaalsContact O-CG 3.32Å; D248-D252 PolarHBondContact O-N 3.45Å; D248-K312 WeakPolarHBondContact OD1-CE 3.29Å; D248-K312 IonicContact OD1-NZ 2.67Å; D248-K312 PolarHBondContact OD1-NZ 2.85Å; D248-K312 IonicContact OD2-NZ 3.41Å; D248-K312 PolarHBondContact OD2-NZ 3.5Å
249L89.6Confident87.6Confident34 Ų3444 Ų4418%0.17823%0.234CC..Hα-helixtrans-60.7-42.4178.2-173.467.8000112.2A198 F199 T202 S246 D252 V253A198-L249 HydrophobicContact CB-CD2 3.79Å; F199-L249 HydrophobicContact CB-CD1 3.96Å; F199-L249 HydrophobicContact CD2-CD1 3.55Å; F199-L249 HydrophobicContact CG-CD1 4.22Å; T202-L249 WeakPolarHBondContact OG1-CD2 3.38Å; S246-L249 PolarHBondContact O-N 3.12Å; L249-D252 PolarHBondContact O-N 3.08Å; L249-V253 WeakPolarHBondContact O-CG2 3.26Å; L249-V253 PolarHBondContact O-N 3.46Å
250L90.6Very high87.5Confident1 Ų144.1 Ų44.11%0.00523%0.234CC..Hα-helixtrans-63.1-42.6179179.964.5000111.8T202 L206 I239 S246 S247 D248 L254 L300T202-L250 HydrophobicContact CG2-CB 4.47Å; T202-L250 HydrophobicContact CG2-CD1 3.85Å; L206-L250 HydrophobicContact CD1-CD1 4.14Å; L206-L250 HydrophobicContact CD2-CD1 4.31Å; L206-L250 HydrophobicContact CG-CD1 4.43Å; I239-L250 HydrophobicContact CG2-CD1 4.36Å; I239-L250 HydrophobicContact CG2-CD2 4.22Å; S246-L250 PolarHBondContact O-N 3.38Å; S247-L250 PolarHBondContact O-N 3.45Å; D248-L250 VanDerWaalsContact C-N 3.34Å; D248-L250 PolarHBondContact O-N 2.98Å; L250-L254 HydrophobicContact CD1-CD1 4.46Å; L250-L254 HydrophobicContact CG-CD1 4.12Å; L250-L254 WeakPolarHBondContact O-CB 3.4Å; L250-L254 VanDerWaalsContact O-CG 3.26Å; L250-L254 WeakPolarHBondContact O-CG 3.28Å; L250-L254 PolarHBondContact O-N 2.88Å; L250-L300 HydrophobicContact CD2-CD1 4.02Å; L250-L300 HydrophobicContact CD2-CD2 4.14Å
251V91.1Very high87.6Confident0 Ų039.1 Ų39.10%021%0.213CC..Hα-helixtrans-67.5-40.8177.6173.80000110.9S247 D248 V253 L254 L255 F305 L308 L309 K312S247-V251 WeakPolarHBondContact O-CG2 3.46Å; S247-V251 PolarHBondContact O-N 2.72Å; S247-V251 VanDerWaalsContact O-N 3.11Å; D248-V251 PolarHBondContact O-N 3.12Å; V251-V253 PolarHBondContact O-N 3.33Å; V251-L254 PolarHBondContact O-N 2.86Å; V251-L255 HydrophobicContact CG1-CD1 3.95Å; V251-L255 HydrophobicContact CG1-CG 4.42Å; V251-L255 WeakPolarHBondContact O-CG 3.47Å; V251-L255 PolarHBondContact O-N 2.83Å; V251-L255 VanDerWaalsContact O-N 3.11Å; V251-F305 HydrophobicContact CG2-CD2 3.94Å; V251-F305 HydrophobicContact CG2-CE2 3.45Å; V251-F305 VanDerWaalsContact CG2-CE2 3.45Å; V251-F305 HydrophobicContact CG2-CZ 4.14Å; V251-L308 HydrophobicContact CB-CG 4.49Å; V251-L308 HydrophobicContact CG2-CD2 3.97Å; V251-L308 HydrophobicContact CG2-CG 4.12Å; V251-L309 HydrophobicContact CG1-CD1 3.99Å; V251-K312 HydrophobicContact CG1-CB 3.66Å; V251-K312 HydrophobicContact CG1-CG 3.75Å
252D89.8Confident87.5Confident51 Ų5134.1 Ų34.127%0.27319%0.19SC..Hα-helixtrans-59.3-46.9177.3-71.2-17.2000111.2D248 L249 L255 E256 K312D248-D252 VanDerWaalsContact O-CG 3.32Å; D248-D252 PolarHBondContact O-N 3.45Å; L249-D252 PolarHBondContact O-N 3.08Å; D252-L255 PolarHBondContact O-N 2.86Å; D252-E256 PolarHBondContact O-N 3.38Å; D252-K312 VanDerWaalsContact CG-NZ 3.31Å; D252-K312 VanDerWaalsContact OD1-CD 3.31Å; D252-K312 WeakPolarHBondContact OD1-CD 3.17Å; D252-K312 WeakPolarHBondContact OD1-CE 3.35Å; D252-K312 IonicContact OD1-NZ 3.45Å; D252-K312 PolarHBondContact OD1-NZ 2.87Å; D252-K312 IonicContact OD2-NZ 3.43Å; D252-K312 PolarHBondContact OD2-NZ 3.42Å; D252-K312 VanDerWaalsContact OD2-NZ 3.1Å
253V90.6Very high87.4Confident0 Ų035 Ų350%020%0.197CC..Hα-helixtrans-65.9-41.4176.5-177.30000111.5F199 T202 R203 L206 L249 V251 L255 E256 F259F199-V253 HydrophobicContact CD2-CG2 3.89Å; F199-V253 HydrophobicContact CE1-CG2 4.47Å; F199-V253 HydrophobicContact CE2-CG2 3.56Å; F199-V253 HydrophobicContact CG-CG2 4.45Å; F199-V253 HydrophobicContact CZ-CG2 3.89Å; T202-V253 HydrophobicContact CG2-CB 4.33Å; T202-V253 HydrophobicContact CG2-CG2 4.09Å; R203-V253 HydrophobicContact CB-CG1 3.92Å; R203-V253 HydrophobicContact CG-CG1 4.08Å; L206-V253 HydrophobicContact CD1-CB 4.1Å; L206-V253 HydrophobicContact CD1-CG1 3.64Å; L249-V253 WeakPolarHBondContact O-CG2 3.26Å; L249-V253 PolarHBondContact O-N 3.46Å; V251-V253 PolarHBondContact O-N 3.33Å; V253-L255 PolarHBondContact O-N 3.17Å; V253-E256 WeakPolarHBondContact O-CB 3.49Å; V253-E256 PolarHBondContact O-N 3.39Å; V253-F259 HydrophobicContact CG1-CD2 4.29Å; V253-F259 HydrophobicContact CG1-CE2 3.69Å; V253-F259 HydrophobicContact CG1-CZ 4.19Å; V253-F259 WeakPolarHBondContact O-CD2 3.28Å
254L90.6Very high87.1Confident0 Ų037.5 Ų37.50%021%0.211CC..Hα-helixtrans-60.2-27.7178.1-80.4170.2000113.4L206 L250 V251 F259 L260 W293 L296 L300 F305L206-L254 HydrophobicContact CD1-CD2 3.84Å; L206-L254 HydrophobicContact CD1-CG 3.95Å; L206-L254 HydrophobicContact CD2-CD2 3.96Å; L250-L254 HydrophobicContact CD1-CD1 4.46Å; L250-L254 HydrophobicContact CG-CD1 4.12Å; L250-L254 WeakPolarHBondContact O-CB 3.4Å; L250-L254 VanDerWaalsContact O-CG 3.26Å; L250-L254 WeakPolarHBondContact O-CG 3.28Å; L250-L254 PolarHBondContact O-N 2.88Å; V251-L254 PolarHBondContact O-N 2.86Å; L254-F259 WeakPolarHBondContact O-CB 3.22Å; L254-L260 HydrophobicContact CB-CD1 4.03Å; L254-L260 HydrophobicContact CB-CG 4.35Å; L254-L260 WeakPolarHBondContact O-CB 3.45Å; L254-L260 VanDerWaalsContact O-CG 3.28Å; L254-L260 WeakPolarHBondContact O-CG 3.36Å; L254-L260 PolarHBondContact O-N 2.94Å; L254-W293 HydrophobicContact CD2-CZ3 4.41Å; L254-L296 HydrophobicContact CD1-CD2 4.42Å; L254-L296 HydrophobicContact CD2-CD2 4.29Å; L254-L300 HydrophobicContact CD1-CD1 4.25Å; L254-F305 HydrophobicContact CD1-CE2 4.43Å; L254-F305 HydrophobicContact CD1-CZ 4.06Å
255L90.8Very high86.9Confident2 Ų238.7 Ų38.71%0.0121%0.214CC..THydrogen-bonded Turntrans-89.8-0.8178.8-65.3176.3000113.6V251 D252 V253 L260 L309 K312 L313 E316 R328 L332V251-L255 HydrophobicContact CG1-CD1 3.95Å; V251-L255 HydrophobicContact CG1-CG 4.42Å; V251-L255 WeakPolarHBondContact O-CG 3.47Å; V251-L255 PolarHBondContact O-N 2.83Å; V251-L255 VanDerWaalsContact O-N 3.11Å; D252-L255 PolarHBondContact O-N 2.86Å; V253-L255 PolarHBondContact O-N 3.17Å; L255-L260 HydrophobicContact CD2-CD1 4.09Å; L255-L309 HydrophobicContact CD2-CD1 4.28Å; L255-K312 HydrophobicContact CD1-CB 3.55Å; L255-L313 HydrophobicContact CD2-CD2 3.43Å; L255-L313 VanDerWaalsContact CD2-CD2 3.43Å; L255-L313 HydrophobicContact CD2-CG 4.01Å; L255-E316 HydrophobicContact CB-CG 4.43Å; L255-E316 HydrophobicContact CD1-CG 4.13Å; L255-R328 PolarHBondContact O-NH1 3.46Å; L255-R328 VanDerWaalsContact O-NH1 3.09Å; L255-R328 PolarHBondContact O-NH2 2.94Å; L255-L332 HydrophobicContact CD2-CD2 4.06Å
256E87.6Confident86.8Confident51 Ų5133.6 Ų33.624%0.23819%0.186CC..SBendtrans-70.1157.2171.5-63.9-17111400112F199 R203 D252 V253 G258 F259F199-E256 WeakPolarHBondContact CZ-OE1 3.29Å; F199-E256 WeakPolarHBondContact CZ-OE2 3.36Å; R203-E256 IonicContact CZ-OE2 3.67Å; R203-E256 IonicContact NH1-OE1 3.34Å; R203-E256 PolarHBondContact NH1-OE1 2.87Å; R203-E256 IonicContact NH1-OE2 2.63Å; R203-E256 PolarHBondContact NH1-OE2 3.49Å; D252-E256 PolarHBondContact O-N 3.38Å; V253-E256 WeakPolarHBondContact O-CB 3.49Å; V253-E256 PolarHBondContact O-N 3.39Å; E256-G258 PolarHBondContact O-N 3.43Å; E256-F259 HydrophobicContact CB-CD2 4.11Å; E256-F259 HydrophobicContact CB-CE2 4.45Å; E256-F259 PolarHBondContact O-N 3Å
257D85.6Confident86.6Confident91 Ų9132 Ų3249%0.48717%0.174SC..BIsolated β-bridgetrans-61.9132.3173.1-59.3-36.6000110.1V261 R328D257-V261 WeakPolarHBondContact OD1-CG1 3.44Å; D257-R328 IonicContact OD1-CZ 3.85Å; D257-R328 IonicContact OD1-NH1 3.57Å; D257-R328 PolarHBondContact OD1-NH1 2.99Å
258G82.1Confident86.3Confident10 Ų1036 Ų3610%0.10319%0.187CC..THydrogen-bonded Turntrans104.2-13-173.800000114.4E256 V261 Q266E256-G258 PolarHBondContact O-N 3.43Å; G258-V261 PolarHBondContact N-O 2.81Å; G258-Q266 PolarHBondContact O-NE2 3.24Å; G258-Q266 PolarHBondContact O-OE1 3.45Å
259F88.1Confident85.8Confident3 Ų337 Ų371%0.01320%0.197CC..THydrogen-bonded Turntrans-110.9-106179-59.1-67.5000112.1R203 L206 I207 V253 L254 E256 V261 W293R203-F259 HydrophobicContact CG-CE2 4.19Å; R203-F259 HydrophobicContact CG-CZ 3.96Å; L206-F259 HydrophobicContact CB-CD1 4.06Å; L206-F259 HydrophobicContact CB-CE1 3.46Å; L206-F259 VanDerWaalsContact CB-CE1 3.46Å; L206-F259 HydrophobicContact CB-CZ 3.88Å; I207-F259 HydrophobicContact CG1-CE1 4.23Å; I207-F259 HydrophobicContact CG1-CZ 4.05Å; V253-F259 HydrophobicContact CG1-CD2 4.29Å; V253-F259 HydrophobicContact CG1-CE2 3.69Å; V253-F259 HydrophobicContact CG1-CZ 4.19Å; V253-F259 WeakPolarHBondContact O-CD2 3.28Å; L254-F259 WeakPolarHBondContact O-CB 3.22Å; E256-F259 HydrophobicContact CB-CD2 4.11Å; E256-F259 HydrophobicContact CB-CE2 4.45Å; E256-F259 PolarHBondContact O-N 3Å; F259-V261 PolarHBondContact O-N 3.17Å; F259-W293 HydrophobicContact CB-CH2 4.25Å; F259-W293 HydrophobicContact CB-CZ2 4.14Å; F259-W293 AromaticContact CD1-CH2 3.85Å; F259-W293 HydrophobicContact CD1-CH2 3.85Å; F259-W293 HydrophobicContact CD1-CZ2 4.31Å; F259-W293 WeakPolarHBondContact O-CZ2 3.49Å; F259-W293 PolarHBondContact O-NE1 3.33Å; F259-W293 VanDerWaalsContact O-NE1 3.09Å
260L86.1Confident85.1Confident2 Ų236.7 Ų36.71%0.0120%0.195CC..THydrogen-bonded Turntrans-70-24.2175.5-65.9178000112L254 L255 P262 W293 L309 W335L254-L260 HydrophobicContact CB-CD1 4.03Å; L254-L260 HydrophobicContact CB-CG 4.35Å; L254-L260 WeakPolarHBondContact O-CB 3.45Å; L254-L260 VanDerWaalsContact O-CG 3.28Å; L254-L260 WeakPolarHBondContact O-CG 3.36Å; L254-L260 PolarHBondContact O-N 2.94Å; L255-L260 HydrophobicContact CD2-CD1 4.09Å; L260-P262 WeakPolarHBondContact O-CD 3.21Å; L260-W293 HydrophobicContact CD2-CB 4.22Å; L260-W293 HydrophobicContact CD2-CD2 4.14Å; L260-W293 HydrophobicContact CD2-CG 3.88Å; L260-L309 HydrophobicContact CD1-CD1 4.29Å; L260-W335 HydrophobicContact CD2-CD2 4.47Å; L260-W335 HydrophobicContact CD2-CH2 4.11Å; L260-W335 HydrophobicContact CD2-CZ2 3.68Å; L260-W335 PolarHBondContact O-NE1 3.33Å
261V87.3Confident84Confident3 Ų340 Ų402%0.01823%0.229CC..BIsolated β-bridgetrans-97.996168.5-175.90000107.8D257 G258 F259 R328 L332D257-V261 WeakPolarHBondContact OD1-CG1 3.44Å; G258-V261 PolarHBondContact N-O 2.81Å; F259-V261 PolarHBondContact O-N 3.17Å; V261-R328 HydrophobicContact CG1-CB 4.22Å; V261-R328 HydrophobicContact CG1-CG 4.09Å; V261-R328 HydrophobicContact CG2-CG 4.45Å; V261-L332 HydrophobicContact CG2-CD2 3.86Å; V261-L332 HydrophobicContact CG2-CG 4.19Å
262P84.3Confident83.1Confident6 Ų640.7 Ų40.74%0.03923%0.234CC..  trans-71.7146-174.729.6-35.5000111.8L260 Q266 L267 Y331L260-P262 WeakPolarHBondContact O-CD 3.21Å; P262-Q266 HydrophobicContact CB-CB 4.42Å; P262-L267 HydrophobicContact CB-CD2 3.88Å; P262-L267 HydrophobicContact CB-CG 4.04Å; P262-L267 HydrophobicContact CG-CD1 4.35Å; P262-L267 HydrophobicContact CG-CD2 3.62Å; P262-L267 HydrophobicContact CG-CG 4.05Å; P262-Y331 HydrophobicContact CG-CD1 3.92Å; P262-Y331 HydrophobicContact CG-CD2 4.1Å; P262-Y331 HydrophobicContact CG-CE1 3.63Å; P262-Y331 HydrophobicContact CG-CE2 3.84Å; P262-Y331 HydrophobicContact CG-CG 4.16Å
263T85.3Confident82Confident51 Ų5143.5 Ų43.531%0.31325%0.249SC..  trans-77.1162.1169.866.30000111E265 Q266 L267T263-E265 VanDerWaalsContact C-N 3.25Å; T263-E265 PolarHBondContact O-N 2.96Å; T263-Q266 PolarHBondContact O-N 3.25Å; T263-Q266 VanDerWaalsContact O-N 3.16Å; T263-Q266 VanDerWaalsContact OG1-CG 3.31Å; T263-Q266 WeakPolarHBondContact OG1-CG 3.34Å; T263-Q266 PolarHBondContact OG1-N 3.38Å; T263-Q266 PolarHBondContact OG1-OE1 3.32Å; T263-L267 WeakPolarHBondContact O-CG 3.33Å; T263-L267 PolarHBondContact O-N 2.97Å
264V80.5Confident80.5Confident67 Ų6744.5 Ų44.541%0.40626%0.255SS..Hα-helixtrans-57.5-41178.3-177.80000111.3Q266 L267 E268 P274 L327V264-Q266 PolarHBondContact O-N 2.88Å; V264-L267 PolarHBondContact O-N 3.03Å; V264-E268 WeakPolarHBondContact O-CG 3.37Å; V264-E268 PolarHBondContact O-N 3.21Å; V264-P274 HydrophobicContact CG1-CB 4.19Å; V264-P274 HydrophobicContact CG1-CG 3.89Å; V264-L327 HydrophobicContact CG2-CD2 4.34Å
265E80.4Confident78.7Confident151 Ų15153.1 Ų53.171%0.70629%0.293SS*.Hα-helixtrans-63.6-40.4177.8-61.4-179.8179.500112.2T263 L267 E268 T269T263-E265 VanDerWaalsContact C-N 3.25Å; T263-E265 PolarHBondContact O-N 2.96Å; E265-L267 VanDerWaalsContact C-N 3.32Å; E265-L267 PolarHBondContact O-N 2.89Å; E265-E268 PolarHBondContact O-N 3.25Å; E265-T269 WeakPolarHBondContact O-CG2 3.29Å; E265-T269 PolarHBondContact O-N 2.88Å; E265-T269 PolarHBondContact O-OG1 3.43Å
266Q82.6Confident76.9Confident24 Ų2460.1 Ų60.111%0.11233%0.326CS..Hα-helixtrans-67.8-32.4175.8-70.6169.5-2800112.4E210 G258 P262 T263 V264 T269 L270E210-Q266 PolarHBondContact OE1-NE2 2.94Å; G258-Q266 PolarHBondContact O-NE2 3.24Å; G258-Q266 PolarHBondContact O-OE1 3.45Å; P262-Q266 HydrophobicContact CB-CB 4.42Å; T263-Q266 PolarHBondContact O-N 3.25Å; T263-Q266 VanDerWaalsContact O-N 3.16Å; T263-Q266 VanDerWaalsContact OG1-CG 3.31Å; T263-Q266 WeakPolarHBondContact OG1-CG 3.34Å; T263-Q266 PolarHBondContact OG1-N 3.38Å; T263-Q266 PolarHBondContact OG1-OE1 3.32Å; V264-Q266 PolarHBondContact O-N 2.88Å; Q266-T269 WeakPolarHBondContact CA-OG1 3.34Å; Q266-T269 PolarHBondContact O-OG1 3.45Å; Q266-L270 WeakPolarHBondContact O-CB 3.35Å; Q266-L270 WeakPolarHBondContact O-CG 3.47Å; Q266-L270 PolarHBondContact O-N 3.42Å; Q266-L270 VanDerWaalsContact O-N 3.09Å
267L80.3Confident75.1Confident0 Ų061.1 Ų61.10%034%0.336CS..Hα-helixtrans-68.3-42174.9-68.5174.2000111.3P262 T263 V264 E265 L270 G271 C272 P274 V289 L327 Y331P262-L267 HydrophobicContact CB-CD2 3.88Å; P262-L267 HydrophobicContact CB-CG 4.04Å; P262-L267 HydrophobicContact CG-CD1 4.35Å; P262-L267 HydrophobicContact CG-CD2 3.62Å; P262-L267 HydrophobicContact CG-CG 4.05Å; T263-L267 WeakPolarHBondContact O-CG 3.33Å; T263-L267 PolarHBondContact O-N 2.97Å; V264-L267 PolarHBondContact O-N 3.03Å; E265-L267 VanDerWaalsContact C-N 3.32Å; E265-L267 PolarHBondContact O-N 2.89Å; L267-L270 CarbonylContact O-C 3.56Å; L267-L270 PolarHBondContact O-N 3.42Å; L267-G271 PolarHBondContact O-N 2.92Å; L267-G271 VanDerWaalsContact O-N 3.1Å; L267-C272 CarbonylContact C-O 3.53Å; L267-C272 HydrophobicContact CB-CB 4.31Å; L267-C272 HydrophobicContact CD2-CB 4.03Å; L267-C272 PolarHBondContact O-N 3.34Å; L267-P274 HydrophobicContact CB-CG 4.33Å; L267-P274 HydrophobicContact CD1-CB 4.39Å; L267-V289 HydrophobicContact CD2-CG2 4Å; L267-L327 HydrophobicContact CD1-CD1 4.48Å; L267-Y331 HydrophobicContact CD1-CE2 4.08Å; L267-Y331 WeakPolarHBondContact CD1-OH 3.48Å; L267-Y331 WeakPolarHBondContact CD2-OH 3.46Å
268E79.6Confident73.2Confident130 Ų13060 Ų6061%0.60733%0.333SS*.Hα-helixtrans-61.9-42.8175.5-70.8177.2177.900111.8V264 E265 L270 G271 P274V264-E268 WeakPolarHBondContact O-CG 3.37Å; V264-E268 PolarHBondContact O-N 3.21Å; E265-E268 PolarHBondContact O-N 3.25Å; E268-L270 VanDerWaalsContact C-N 3.34Å; E268-L270 PolarHBondContact O-N 2.89Å; E268-G271 PolarHBondContact O-N 3.42Å; E268-G271 VanDerWaalsContact O-N 3.13Å; E268-P274 HydrophobicContact CG-CG 4.4Å
269T79.3Confident71.6Confident99 Ų9963.8 Ų63.861%0.60737%0.372SS*.Hα-helixtrans-67.6-32.9177.3580000112.9E265 Q266 G271E265-T269 WeakPolarHBondContact O-CG2 3.29Å; E265-T269 PolarHBondContact O-N 2.88Å; E265-T269 PolarHBondContact O-OG1 3.43Å; Q266-T269 WeakPolarHBondContact CA-OG1 3.34Å; Q266-T269 PolarHBondContact O-OG1 3.45Å; T269-G271 PolarHBondContact O-N 2.91Å
270L74.3Confident69.9Low29 Ų2966.5 Ų66.515%0.15239%0.392CS..THydrogen-bonded Turntrans-81.1-0.8174.6-66.6173.1000113.4Y214 L217 Q266 L267 E268 C272 P288 V289 F292Y214-L270 HydrophobicContact CE1-CD2 4.11Å; Y214-L270 HydrophobicContact CE1-CG 4.34Å; L217-L270 HydrophobicContact CD1-CD2 4.03Å; Q266-L270 WeakPolarHBondContact O-CB 3.35Å; Q266-L270 WeakPolarHBondContact O-CG 3.47Å; Q266-L270 PolarHBondContact O-N 3.42Å; Q266-L270 VanDerWaalsContact O-N 3.09Å; L267-L270 CarbonylContact O-C 3.56Å; L267-L270 PolarHBondContact O-N 3.42Å; E268-L270 VanDerWaalsContact C-N 3.34Å; E268-L270 PolarHBondContact O-N 2.89Å; L270-C272 VanDerWaalsContact C-N 3.34Å; L270-P288 HydrophobicContact CB-CB 4.38Å; L270-V289 HydrophobicContact CD1-CG2 4.09Å; L270-F292 HydrophobicContact CD2-CD2 4.08Å
271G67.9Low68.5Low69 Ų6968.6 Ų68.671%0.71141%0.406SS*.THydrogen-bonded Turntrans68.230.1-179.700000113.8L267 E268 T269L267-G271 PolarHBondContact O-N 2.92Å; L267-G271 VanDerWaalsContact O-N 3.1Å; E268-G271 PolarHBondContact O-N 3.42Å; E268-G271 VanDerWaalsContact O-N 3.13Å; T269-G271 PolarHBondContact O-N 2.91Å
272C73.3Confident67.7Low15 Ų1572.5 Ų72.510%0.10142%0.424CS..  trans-100.7129.1174.9-63.30000109.7L267 L270 P274L267-C272 CarbonylContact C-O 3.53Å; L267-C272 HydrophobicContact CB-CB 4.31Å; L267-C272 HydrophobicContact CD2-CB 4.03Å; L267-C272 PolarHBondContact O-N 3.34Å; L270-C272 VanDerWaalsContact C-N 3.34Å; C272-P274 VanDerWaalsContact O-CD 3.27Å; C272-P274 WeakPolarHBondContact O-CD 3.25Å
273D66.4Low67.2Low111 Ų11172.2 Ų72.259%0.59442%0.423SS*.  trans-71.6117.6175.7-81.6-37.3000110.6F275 E276D273-F275 PolarHBondContact O-N 3.13Å; D273-F275 VanDerWaalsContact O-N 3.13Å; D273-E276 HydrophobicContact CB-CB 4.11Å; D273-E276 HydrophobicContact CB-CG 3.91Å; D273-E276 PolarHBondContact O-N 3.2Å
274P58.6Low66.9Low20 Ų2076.4 Ų76.413%0.1343%0.433CS..THydrogen-bonded Turntrans-63.9-20.9-177.7-20.331.7000113.7V264 L267 E268 C272V264-P274 HydrophobicContact CG1-CB 4.19Å; V264-P274 HydrophobicContact CG1-CG 3.89Å; L267-P274 HydrophobicContact CB-CG 4.33Å; L267-P274 HydrophobicContact CD1-CB 4.39Å; E268-P274 HydrophobicContact CG-CG 4.4Å; C272-P274 VanDerWaalsContact O-CD 3.27Å; C272-P274 WeakPolarHBondContact O-CD 3.25Å
275F52.5Low66.9Low182 Ų18273.4 Ų73.480%0.79841%0.414SS*.THydrogen-bonded Turntrans-105.6-3.8-174.7-58.4-77.6000113.8D273 T277D273-F275 PolarHBondContact O-N 3.13Å; D273-F275 VanDerWaalsContact O-N 3.13Å; F275-T277 PolarHBondContact O-N 2.9Å
276E52.8Low66.9Low149 Ų14968 Ų6870%0.69639%0.392SS*.  trans-77.958.2159-73.5-161.8156.300108.7D273 P278D273-E276 HydrophobicContact CB-CB 4.11Å; D273-E276 HydrophobicContact CB-CG 3.91Å; D273-E276 PolarHBondContact O-N 3.2Å; E276-P278 WeakPolarHBondContact O-CD 3.46Å
277T50Low66.7Low72 Ų7270.9 Ų70.944%0.44241%0.406SS..  trans-75.7102.6156.216.50000104.4F275 G279 F330F275-T277 PolarHBondContact O-N 2.9Å; T277-G279 PolarHBondContact O-N 3.46Å; T277-F330 HydrophobicContact CG2-CB 4.41Å; T277-F330 HydrophobicContact CG2-CD1 4.33Å; T277-F330 HydrophobicContact CG2-CD2 4.03Å; T277-F330 HydrophobicContact CG2-CE2 4.38Å; T277-F330 HydrophobicContact CG2-CG 3.99Å
278P46.2Very low66.7Low67 Ų6773.6 Ų73.644%0.43542%0.423SS..  trans-62.6124.6177.129.2-33.2000105.6E276 S280E276-P278 WeakPolarHBondContact O-CD 3.46Å; P278-S280 WeakPolarHBondContact CB-OG 3.28Å; P278-S280 WeakPolarHBondContact CG-OG 3.31Å; P278-S280 PolarHBondContact O-N 3.38Å
279G47.5Very low66.8Low89 Ų8967.4 Ų67.492%0.91840%0.395SS*.  trans-62.326.7163.600000112.7T277T277-G279 PolarHBondContact O-N 3.46Å
280S52.4Low66.9Low61 Ų6162.9 Ų62.943%0.42737%0.366SS..  trans-81.9130.5170.258.70000108.3P278 E282P278-S280 WeakPolarHBondContact CB-OG 3.28Å; P278-S280 WeakPolarHBondContact CG-OG 3.31Å; P278-S280 PolarHBondContact O-N 3.38Å; S280-E282 PolarHBondContact O-N 2.89Å; S280-E282 PolarHBondContact OG-O 3.08Å
281S56.8Low67.2Low45 Ų4567.8 Ų67.832%0.31538%0.383SS..SBendtrans-54.8-5.6173-480000114.7P283 H391S281-P283 WeakPolarHBondContact O-CD 3.49Å; S281-H391 WeakPolarHBondContact O-CB 3.27Å
282E70.3Confident68Low85 Ų8564.9 Ų64.940%0.39735%0.351SS..SBendtrans-104.7101.7177.2-54-170.2-175.700111.7S280 R284S280-E282 PolarHBondContact O-N 2.89Å; S280-E282 PolarHBondContact OG-O 3.08Å; E282-R284 PolarHBondContact O-N 2.7Å; E282-R284 IonicContact OE2-CZ 3.58Å; E282-R284 IonicContact OE2-NE 3.46Å; E282-R284 PolarHBondContact OE2-NE 3.33Å; E282-R284 IonicContact OE2-NH2 2.81Å; E282-R284 PolarHBondContact OE2-NH2 3.11Å
283P74.5Confident68.6Low1 Ų164.5 Ų64.51%0.00635%0.347CS..  trans-71.4129.5171.133.4-40.2000110.7S281 F330 S333 A334 S337S281-P283 WeakPolarHBondContact O-CD 3.49Å; P283-F330 HydrophobicContact CB-CD2 4.49Å; P283-F330 HydrophobicContact CB-CE2 4.34Å; P283-S333 VanDerWaalsContact CB-OG 3.25Å; P283-S333 WeakPolarHBondContact CB-OG 3.36Å; P283-A334 HydrophobicContact CB-CB 4.05Å; P283-S337 VanDerWaalsContact O-CB 3.32Å; P283-S337 WeakPolarHBondContact O-CB 3.13Å; P283-S337 PolarHBondContact O-OG 3.14Å
284R78.4Confident69.5Low139 Ų13959.9 Ų59.953%0.52532%0.322SS..  trans-135.9141.5175.5-64.1-169.9-172.8-150.83.2110.5E282E282-R284 PolarHBondContact O-N 2.7Å; E282-R284 IonicContact OE2-CZ 3.58Å; E282-R284 IonicContact OE2-NE 3.46Å; E282-R284 PolarHBondContact OE2-NE 3.33Å; E282-R284 IonicContact OE2-NH2 2.81Å; E282-R284 PolarHBondContact OE2-NH2 3.11Å
285V80.8Confident70.7Confident4 Ų460.3 Ų60.32%0.02433%0.325CS..  trans-75.9129179.6-178.40000108.5Q287 V289 L290 A334 W335 E338V285-Q287 PolarHBondContact O-N 3.34Å; V285-V289 HydrophobicContact CG1-CB 3.94Å; V285-V289 HydrophobicContact CG1-CG1 3.87Å; V285-L290 HydrophobicContact CG1-CB 4.18Å; V285-A334 HydrophobicContact CG2-CB 3.64Å; V285-W335 HydrophobicContact CG1-CH2 4.21Å; V285-W335 HydrophobicContact CG1-CZ2 3.89Å; V285-W335 HydrophobicContact CG2-CD2 3.74Å; V285-W335 HydrophobicContact CG2-CE3 4.04Å; V285-W335 HydrophobicContact CG2-CG 4Å; V285-W335 HydrophobicContact CG2-CZ2 4.49Å; V285-E338 HydrophobicContact CB-CG 4.04Å; V285-E338 HydrophobicContact CG2-CG 3.7Å
286P81.5Confident72.2Confident36 Ų3651.7 Ų51.723%0.23429%0.287CS..  trans-52.5135.4173.3-26.634.9000111.3P288 V289 L290 Y331P286-P288 VanDerWaalsContact C-N 3.31Å; P286-V289 HydrophobicContact CB-CG2 4.21Å; P286-V289 PolarHBondContact O-N 3.15Å; P286-L290 PolarHBondContact O-N 3.41Å; P286-Y331 HydrophobicContact CG-CE1 4.26Å
287Q78.5Confident73.8Confident85 Ų8544.9 Ų44.940%0.39726%0.256SS..Hα-helixtrans-54.7-36.8-177-71.5-65.3-5100114.5V285 R291V285-Q287 PolarHBondContact O-N 3.34Å; Q287-R291 WeakPolarHBondContact O-CB 3.45Å; Q287-R291 VanDerWaalsContact O-CG 3.32Å; Q287-R291 WeakPolarHBondContact O-CG 3.16Å; Q287-R291 PolarHBondContact O-N 3Å
288P78.4Confident75.4Confident57 Ų5745.2 Ų45.237%0.3725%0.251SS..Hα-helixtrans-60.7-45.3174.1-24.936.7000112.6L270 P286 R291 F292L270-P288 HydrophobicContact CB-CB 4.38Å; P286-P288 VanDerWaalsContact C-N 3.31Å; P288-R291 PolarHBondContact O-N 2.73Å; P288-F292 WeakPolarHBondContact O-CB 3.21Å; P288-F292 PolarHBondContact O-N 3.2Å
289V82.4Confident77.2Confident1 Ų144.3 Ų44.31%0.00624%0.242CC..Hα-helixtrans-65.8-43.6178.7179.60000111.1L267 L270 V285 P286 R291 F292 W293 W335L267-V289 HydrophobicContact CD2-CG2 4Å; L270-V289 HydrophobicContact CD1-CG2 4.09Å; V285-V289 HydrophobicContact CG1-CB 3.94Å; V285-V289 HydrophobicContact CG1-CG1 3.87Å; P286-V289 HydrophobicContact CB-CG2 4.21Å; P286-V289 PolarHBondContact O-N 3.15Å; V289-R291 PolarHBondContact O-N 3.16Å; V289-F292 WeakPolarHBondContact O-CB 3.21Å; V289-F292 PolarHBondContact O-N 3.19Å; V289-W293 PolarHBondContact O-N 3.35Å; V289-W335 HydrophobicContact CG1-CZ2 4.11Å
290L82.4Confident78.9Confident3 Ų340.4 Ų40.42%0.01620%0.199CC..Hα-helixtrans-59.1-49.5176.1-177.872.5000110.9V285 P286 F292 W293 L294 W335 I365V285-L290 HydrophobicContact CG1-CB 4.18Å; P286-L290 PolarHBondContact O-N 3.41Å; L290-F292 VanDerWaalsContact C-N 3.29Å; L290-F292 PolarHBondContact O-N 3.49Å; L290-W293 PolarHBondContact O-N 3.08Å; L290-L294 VanDerWaalsContact O-CB 3.28Å; L290-L294 WeakPolarHBondContact O-CB 3.32Å; L290-L294 PolarHBondContact O-N 3.05Å; L290-W335 HydrophobicContact CD1-CH2 4.07Å; L290-W335 HydrophobicContact CD1-CZ3 3.78Å; L290-I365 HydrophobicContact CD1-CD1 4.07Å; L290-I365 HydrophobicContact CD1-CG1 4.18Å
291R80.5Confident80.3Confident133 Ų13340 Ų4050%0.50219%0.193SC..Hα-helixtrans-67.2-29.3-179-73.9179.6-179.9162.37.4113.3Q287 P288 V289 D363Q287-R291 WeakPolarHBondContact O-CB 3.45Å; Q287-R291 VanDerWaalsContact O-CG 3.32Å; Q287-R291 WeakPolarHBondContact O-CG 3.16Å; Q287-R291 PolarHBondContact O-N 3Å; P288-R291 PolarHBondContact O-N 2.73Å; V289-R291 PolarHBondContact O-N 3.16Å; R291-D363 IonicContact NE-OD1 3.81Å; R291-D363 IonicContact NH2-OD2 3.55Å
292F83.4Confident81.7Confident8 Ų839.5 Ų39.54%0.03519%0.189CC..Hα-helixtrans-59.7-51.2175.2-173.1-88.9000110.8E210 R213 Y214 L217 L270 P288 V289 L290 P295E210-F292 HydrophobicContact CG-CE1 4.25Å; E210-F292 HydrophobicContact CG-CZ 3.91Å; R213-F292 HydrophobicContact CB-CD2 4.35Å; R213-F292 HydrophobicContact CB-CE1 4.35Å; R213-F292 HydrophobicContact CB-CE2 3.57Å; R213-F292 HydrophobicContact CB-CZ 3.57Å; R213-F292 HydrophobicContact CG-CZ 4.4Å; Y214-F292 HydrophobicContact CD1-CE2 4.38Å; Y214-F292 HydrophobicContact CD2-CE2 4.14Å; Y214-F292 HydrophobicContact CD2-CZ 4.03Å; Y214-F292 HydrophobicContact CE1-CE2 4.23Å; Y214-F292 AromaticContact CE2-CE2 3.96Å; Y214-F292 HydrophobicContact CE2-CE2 3.96Å; Y214-F292 AromaticContact CE2-CZ 3.74Å; Y214-F292 HydrophobicContact CE2-CZ 3.74Å; Y214-F292 HydrophobicContact CG-CE2 4.34Å; L217-F292 HydrophobicContact CD1-CD2 3.93Å; L217-F292 HydrophobicContact CD1-CE2 4.01Å; L270-F292 HydrophobicContact CD2-CD2 4.08Å; P288-F292 WeakPolarHBondContact O-CB 3.21Å; P288-F292 PolarHBondContact O-N 3.2Å; V289-F292 WeakPolarHBondContact O-CB 3.21Å; V289-F292 PolarHBondContact O-N 3.19Å; L290-F292 VanDerWaalsContact C-N 3.29Å; L290-F292 PolarHBondContact O-N 3.49Å; F292-P295 WeakPolarHBondContact O-CD 3.35Å
293W87Confident82.3Confident7 Ų739 Ų393%0.02719%0.194CC..Hα-helixtrans-88.1-14.8-176.5-68.2110000115Y209 L254 F259 L260 V289 L290 P295 L296 L297 W335Y209-W293 HydrophobicContact CD1-CE3 4.4Å; Y209-W293 HydrophobicContact CD1-CH2 4.37Å; Y209-W293 AromaticContact CD1-CZ3 3.74Å; Y209-W293 HydrophobicContact CD1-CZ3 3.74Å; Y209-W293 AromaticContact CE1-CE3 3.93Å; Y209-W293 HydrophobicContact CE1-CE3 3.93Å; Y209-W293 AromaticContact CE1-CZ3 3.74Å; Y209-W293 HydrophobicContact CE1-CZ3 3.74Å; L254-W293 HydrophobicContact CD2-CZ3 4.41Å; F259-W293 HydrophobicContact CB-CH2 4.25Å; F259-W293 HydrophobicContact CB-CZ2 4.14Å; F259-W293 AromaticContact CD1-CH2 3.85Å; F259-W293 HydrophobicContact CD1-CH2 3.85Å; F259-W293 HydrophobicContact CD1-CZ2 4.31Å; F259-W293 WeakPolarHBondContact O-CZ2 3.49Å; F259-W293 PolarHBondContact O-NE1 3.33Å; F259-W293 VanDerWaalsContact O-NE1 3.09Å; L260-W293 HydrophobicContact CD2-CB 4.22Å; L260-W293 HydrophobicContact CD2-CD2 4.14Å; L260-W293 HydrophobicContact CD2-CG 3.88Å; V289-W293 PolarHBondContact O-N 3.35Å; L290-W293 PolarHBondContact O-N 3.08Å; W293-P295 VanDerWaalsContact C-CD 3.4Å; W293-L296 HydrophobicContact CE3-CD1 4.25Å; W293-L296 HydrophobicContact CZ3-CD1 4.1Å; W293-L296 PolarHBondContact O-N 2.89Å; W293-L296 VanDerWaalsContact O-N 3.13Å; W293-L297 HydrophobicContact CB-CD1 4.2Å; W293-L297 HydrophobicContact CB-CG 4.47Å; W293-L297 PolarHBondContact O-N 3.42Å; W293-W335 HydrophobicContact CB-CH2 4.15Å
294L84.1Confident82.9Confident14 Ų1443 Ų437%0.07322%0.221CC..Hα-helixtrans-52.3-42.2-176.3-169.865.6000114.9L290 L296 L297 K298 I365L290-L294 VanDerWaalsContact O-CB 3.28Å; L290-L294 WeakPolarHBondContact O-CB 3.32Å; L290-L294 PolarHBondContact O-N 3.05Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 2.97Å; L294-L297 PolarHBondContact O-N 2.94Å; L294-K298 HydrophobicContact CD1-CD 4.36Å; L294-K298 HydrophobicContact CD1-CG 4.21Å; L294-K298 HydrophobicContact CG-CD 4.1Å; L294-K298 HydrophobicContact CG-CG 4.33Å; L294-K298 WeakPolarHBondContact O-CB 3.24Å; L294-K298 WeakPolarHBondContact O-CG 3.32Å; L294-K298 PolarHBondContact O-N 3.33Å; L294-I365 HydrophobicContact CD1-CG1 4.32Å
295P83.8Confident83.4Confident29 Ų2936.6 Ų36.619%0.18820%0.197CC..Hα-helixtrans-60.9-41.1179.2-23.535.4000113L229 F292 W293 M299L229-P295 HydrophobicContact CD1-CB 3.88Å; F292-P295 WeakPolarHBondContact O-CD 3.35Å; W293-P295 VanDerWaalsContact C-CD 3.4Å; P295-M299 PolarHBondContact O-N 3.18Å
296L85.3Confident83.7Confident0 Ų036.6 Ų36.60%020%0.197CC..Hα-helixtrans-69.3-48.5178.1-178.8153.4000110.7L206 Y209 I239 L254 W293 L294 K298 M299 L300L206-L296 HydrophobicContact CD2-CD1 3.91Å; Y209-L296 HydrophobicContact CD1-CD1 3.93Å; Y209-L296 HydrophobicContact CE1-CB 4.15Å; Y209-L296 HydrophobicContact CE1-CD1 3.89Å; Y209-L296 HydrophobicContact CE2-CB 4.42Å; Y209-L296 HydrophobicContact CG-CD1 4.27Å; I239-L296 HydrophobicContact CD1-CD1 4.04Å; I239-L296 HydrophobicContact CG2-CD1 4.5Å; L254-L296 HydrophobicContact CD1-CD2 4.42Å; L254-L296 HydrophobicContact CD2-CD2 4.29Å; W293-L296 HydrophobicContact CE3-CD1 4.25Å; W293-L296 HydrophobicContact CZ3-CD1 4.1Å; W293-L296 PolarHBondContact O-N 2.89Å; W293-L296 VanDerWaalsContact O-N 3.13Å; L294-L296 VanDerWaalsContact C-N 3.33Å; L294-L296 PolarHBondContact O-N 2.97Å; L296-K298 VanDerWaalsContact C-N 3.33Å; L296-K298 PolarHBondContact O-N 3.25Å; L296-M299 WeakPolarHBondContact O-CB 3.4Å; L296-M299 PolarHBondContact O-N 3.46Å; L296-M299 VanDerWaalsContact O-N 3.07Å; L296-L300 HydrophobicContact CD2-CD1 3.43Å; L296-L300 VanDerWaalsContact CD2-CD1 3.43Å; L296-L300 HydrophobicContact CD2-CG 4.22Å; L296-L300 HydrophobicContact CG-CD1 4.25Å; L296-L300 WeakPolarHBondContact O-CG 3.39Å; L296-L300 PolarHBondContact O-N 3.01Å
297L84.9Confident84Confident6 Ų636.7 Ų36.73%0.03119%0.194CC..Hα-helixtrans-64.2-35.8-179.1-65174.7000112.7W293 L294 M299 L300 N301 W335 I365W293-L297 HydrophobicContact CB-CD1 4.2Å; W293-L297 HydrophobicContact CB-CG 4.47Å; W293-L297 PolarHBondContact O-N 3.42Å; L294-L297 PolarHBondContact O-N 2.94Å; L297-M299 VanDerWaalsContact C-N 3.3Å; L297-M299 PolarHBondContact O-N 3.47Å; L297-L300 PolarHBondContact O-N 3.29Å; L297-N301 PolarHBondContact O-N 3.49Å; L297-W335 HydrophobicContact CD1-CE3 4.43Å; L297-W335 HydrophobicContact CD1-CH2 3.85Å; L297-W335 HydrophobicContact CD1-CZ3 3.53Å; L297-I365 HydrophobicContact CB-CG2 3.75Å; L297-I365 HydrophobicContact CD1-CG2 4.25Å
298K83.8Confident84.5Confident80 Ų8034 Ų3435%0.34818%0.182SC..Hα-helixtrans-65.2-34.5173.4-80.4-177.3176.5176.20112.7L294 L296 N301 K362 R364L294-K298 HydrophobicContact CD1-CD 4.36Å; L294-K298 HydrophobicContact CD1-CG 4.21Å; L294-K298 HydrophobicContact CG-CD 4.1Å; L294-K298 HydrophobicContact CG-CG 4.33Å; L294-K298 WeakPolarHBondContact O-CB 3.24Å; L294-K298 WeakPolarHBondContact O-CG 3.32Å; L294-K298 PolarHBondContact O-N 3.33Å; L296-K298 VanDerWaalsContact C-N 3.33Å; L296-K298 PolarHBondContact O-N 3.25Å; K298-N301 VanDerWaalsContact O-CB 3.28Å; K298-N301 WeakPolarHBondContact O-CB 3.46Å; K298-K362 PolarHBondContact NZ-O 3.37Å; K298-R364 WeakPolarHBondContact CE-O 3.34Å
299M83.9Confident85.1Confident48 Ų4831.7 Ų31.724%0.23617%0.167CC..Hα-helixtrans-71.5-41.2177.5-178.3-76.6-71.400111L236 I239 K240 P295 L296 L297 N301L236-M299 HydrophobicContact CD2-CE 4.43Å; L236-M299 WeakPolarHBondContact O-CE 3.47Å; I239-M299 HydrophobicContact CB-CE 4.06Å; I239-M299 HydrophobicContact CG2-CE 3.81Å; K240-M299 HydrophobicContact CB-CE 4.04Å; K240-M299 HydrophobicContact CB-SD 3.49Å; K240-M299 WeakPolarHBondContact CB-SD 3.38Å; K240-M299 HydrophobicContact CD-SD 3.82Å; K240-M299 HydrophobicContact CG-SD 3.61Å; P295-M299 PolarHBondContact O-N 3.18Å; L296-M299 WeakPolarHBondContact O-CB 3.4Å; L296-M299 PolarHBondContact O-N 3.46Å; L296-M299 VanDerWaalsContact O-N 3.07Å; L297-M299 VanDerWaalsContact C-N 3.3Å; L297-M299 PolarHBondContact O-N 3.47Å; M299-N301 PolarHBondContact O-N 3.48Å
300L83.9Confident85.4Confident6 Ų631.7 Ų31.73%0.03117%0.167CC..SBendtrans-77.50.3178.8-64.9-178.3000114.6I239 L250 L254 L296 L297 S302 F305I239-L300 HydrophobicContact CG2-CD2 4.3Å; L250-L300 HydrophobicContact CD2-CD1 4.02Å; L250-L300 HydrophobicContact CD2-CD2 4.14Å; L254-L300 HydrophobicContact CD1-CD1 4.25Å; L296-L300 HydrophobicContact CD2-CD1 3.43Å; L296-L300 VanDerWaalsContact CD2-CD1 3.43Å; L296-L300 HydrophobicContact CD2-CG 4.22Å; L296-L300 HydrophobicContact CG-CD1 4.25Å; L296-L300 WeakPolarHBondContact O-CG 3.39Å; L296-L300 PolarHBondContact O-N 3.01Å; L297-L300 PolarHBondContact O-N 3.29Å; L300-S302 VanDerWaalsContact C-N 3.28Å; L300-S302 PolarHBondContact O-N 3.07Å; L300-F305 HydrophobicContact CB-CD1 3.91Å; L300-F305 HydrophobicContact CB-CD2 4.42Å; L300-F305 HydrophobicContact CB-CE1 3.78Å; L300-F305 HydrophobicContact CB-CE2 4.31Å; L300-F305 HydrophobicContact CB-CG 4.24Å; L300-F305 HydrophobicContact CB-CZ 4Å; L300-F305 HydrophobicContact CD1-CE1 4.11Å; L300-F305 HydrophobicContact CD1-CE2 3.74Å; L300-F305 HydrophobicContact CD1-CZ 3.5Å; L300-F305 VanDerWaalsContact CD1-CZ 3.5Å; L300-F305 HydrophobicContact CG-CZ 4.37Å; L300-F305 WeakPolarHBondContact O-CB 3.11Å; L300-F305 WeakPolarHBondContact O-CD1 3.45Å
301N81.8Confident85.8Confident54 Ų5436.5 Ų36.529%0.28919%0.189SC..  trans-62.382.2-175.5179.624.5000112.5L297 K298 M299 I306 F366L297-N301 PolarHBondContact O-N 3.49Å; K298-N301 VanDerWaalsContact O-CB 3.28Å; K298-N301 WeakPolarHBondContact O-CB 3.46Å; M299-N301 PolarHBondContact O-N 3.48Å; N301-I306 WeakPolarHBondContact OD1-CD1 3.47Å; N301-F366 WeakPolarHBondContact OD1-CD1 3.28Å
302S85Confident86.3Confident34 Ų3432 Ų3224%0.23817%0.173CC..  trans-125.4145.7170.168.70000109L300 S304 F305 I306L300-S302 VanDerWaalsContact C-N 3.28Å; L300-S302 PolarHBondContact O-N 3.07Å; S302-S304 PolarHBondContact O-N 2.91Å; S302-S304 PolarHBondContact OG-OG 3.35Å; S302-F305 PolarHBondContact O-N 3.46Å; S302-F305 VanDerWaalsContact O-N 3.16Å; S302-F305 WeakPolarHBondContact OG-CB 3.39Å; S302-F305 PolarHBondContact OG-N 3.45Å; S302-I306 WeakPolarHBondContact O-CD1 3.45Å; S302-I306 WeakPolarHBondContact O-CG1 3.32Å; S302-I306 PolarHBondContact O-N 3.22Å
303P84.8Confident86.6Confident75 Ų7531.7 Ų31.749%0.48717%0.172SC..Hα-helixtrans-59.9-36.4-179.122.9-32000112.2I306 H307 I370P303-I306 PolarHBondContact O-N 2.79Å; P303-H307 PolarHBondContact O-CD2 3.08Å; P303-H307 PolarHBondContact O-N 3.05Å; P303-I370 HydrophobicContact CB-CD1 4.49Å; P303-I370 HydrophobicContact CB-CG2 3.79Å
304S86.1Confident86.8Confident84 Ų8431.5 Ų31.559%0.58717%0.171SC*.Hα-helixtrans-61.4-47174.343.60000112.7S302 I306 H307 L308S302-S304 PolarHBondContact O-N 2.91Å; S302-S304 PolarHBondContact OG-OG 3.35Å; S304-I306 VanDerWaalsContact C-N 3.32Å; S304-I306 PolarHBondContact O-N 2.9Å; S304-H307 PolarHBondContact O-N 3.47Å; S304-L308 WeakPolarHBondContact O-CB 3.18Å; S304-L308 PolarHBondContact O-N 3Å; S304-L308 VanDerWaalsContact O-N 3.09Å
305F88Confident87Confident5 Ų534.5 Ų34.52%0.02219%0.19CC..Hα-helixtrans-62.5-40177.9178.2-98.1000111.7V251 L254 L300 S302 L308 L309V251-F305 HydrophobicContact CG2-CD2 3.94Å; V251-F305 HydrophobicContact CG2-CE2 3.45Å; V251-F305 VanDerWaalsContact CG2-CE2 3.45Å; V251-F305 HydrophobicContact CG2-CZ 4.14Å; L254-F305 HydrophobicContact CD1-CE2 4.43Å; L254-F305 HydrophobicContact CD1-CZ 4.06Å; L300-F305 HydrophobicContact CB-CD1 3.91Å; L300-F305 HydrophobicContact CB-CD2 4.42Å; L300-F305 HydrophobicContact CB-CE1 3.78Å; L300-F305 HydrophobicContact CB-CE2 4.31Å; L300-F305 HydrophobicContact CB-CG 4.24Å; L300-F305 HydrophobicContact CB-CZ 4Å; L300-F305 HydrophobicContact CD1-CE1 4.11Å; L300-F305 HydrophobicContact CD1-CE2 3.74Å; L300-F305 HydrophobicContact CD1-CZ 3.5Å; L300-F305 VanDerWaalsContact CD1-CZ 3.5Å; L300-F305 HydrophobicContact CG-CZ 4.37Å; L300-F305 WeakPolarHBondContact O-CB 3.11Å; L300-F305 WeakPolarHBondContact O-CD1 3.45Å; S302-F305 PolarHBondContact O-N 3.46Å; S302-F305 VanDerWaalsContact O-N 3.16Å; S302-F305 WeakPolarHBondContact OG-CB 3.39Å; S302-F305 PolarHBondContact OG-N 3.45Å; F305-L308 PolarHBondContact O-N 3.13Å; F305-L309 HydrophobicContact CE1-CB 4.48Å; F305-L309 HydrophobicContact CE1-CD2 4.05Å; F305-L309 VanDerWaalsContact O-CB 3.27Å; F305-L309 WeakPolarHBondContact O-CB 3.11Å; F305-L309 PolarHBondContact O-N 3.07Å
306I87.5Confident87.1Confident3 Ų335.6 Ų35.62%0.01519%0.193CC..Hα-helixtrans-70.5-38.9-177.5-68.1161.2000111.7N301 S302 P303 S304 L308 L310 V339 F366 I370N301-I306 WeakPolarHBondContact OD1-CD1 3.47Å; S302-I306 WeakPolarHBondContact O-CD1 3.45Å; S302-I306 WeakPolarHBondContact O-CG1 3.32Å; S302-I306 PolarHBondContact O-N 3.22Å; P303-I306 PolarHBondContact O-N 2.79Å; S304-I306 VanDerWaalsContact C-N 3.32Å; S304-I306 PolarHBondContact O-N 2.9Å; I306-L308 VanDerWaalsContact C-N 3.35Å; I306-L310 HydrophobicContact CG2-CD1 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.17Å; I306-L310 WeakPolarHBondContact O-CG 3.28Å; I306-L310 PolarHBondContact O-N 2.96Å; I306-V339 HydrophobicContact CG2-CG1 4.01Å; I306-F366 HydrophobicContact CD1-CD1 3.31Å; I306-F366 HydrophobicContact CD1-CE1 3.26Å; I306-F366 HydrophobicContact CD1-CG 4Å; I306-F366 HydrophobicContact CD1-CZ 3.92Å; I306-F366 HydrophobicContact CG1-CD1 4.12Å; I306-F366 HydrophobicContact CG1-CE1 3.52Å; I306-F366 HydrophobicContact CG1-CZ 3.95Å; I306-F366 HydrophobicContact CG2-CZ 4.21Å; I306-I370 HydrophobicContact CB-CD1 4.38Å; I306-I370 HydrophobicContact CD1-CD1 3.15Å; I306-I370 HydrophobicContact CG1-CD1 4.33Å; I306-I370 HydrophobicContact CG2-CD1 4.46Å
307H88.8Confident87.2Confident39 Ų3935.7 Ų35.718%0.18119%0.193CC..Hα-helixtrans-60.9-46.4171.7-72.3-55.2000111.8P303 S304 L310 E311 Q371P303-H307 PolarHBondContact O-CD2 3.08Å; P303-H307 PolarHBondContact O-N 3.05Å; S304-H307 PolarHBondContact O-N 3.47Å; H307-L310 PolarHBondContact O-N 2.87Å; H307-E311 WeakPolarHBondContact O-CB 3.42Å; H307-E311 PolarHBondContact O-N 3.44Å; H307-Q371 PolarHBondContact CE1-O 2.98Å; H307-Q371 PolarHBondContact NE2-O 3.34Å
308L89.5Confident87.2Confident27 Ų2740.7 Ų40.714%0.14122%0.215CC..Hα-helixtrans-64.3-44.3179.9-178.963.3000111.8V251 S304 F305 I306 E311 K312V251-L308 HydrophobicContact CB-CG 4.49Å; V251-L308 HydrophobicContact CG2-CD2 3.97Å; V251-L308 HydrophobicContact CG2-CG 4.12Å; S304-L308 WeakPolarHBondContact O-CB 3.18Å; S304-L308 PolarHBondContact O-N 3Å; S304-L308 VanDerWaalsContact O-N 3.09Å; F305-L308 PolarHBondContact O-N 3.13Å; I306-L308 VanDerWaalsContact C-N 3.35Å; L308-E311 PolarHBondContact O-N 3.03Å; L308-K312 HydrophobicContact CD1-CG 4.18Å; L308-K312 WeakPolarHBondContact O-CB 3.48Å; L308-K312 VanDerWaalsContact O-CG 3.29Å; L308-K312 WeakPolarHBondContact O-CG 3.38Å; L308-K312 PolarHBondContact O-N 3.31Å
309L90.3Very high87.3Confident9 Ų939.9 Ų39.95%0.04722%0.216CC..Hα-helixtrans-60.3-46.4176.3-179.564000111.5V251 L255 L260 F305 K312 L313 V339V251-L309 HydrophobicContact CG1-CD1 3.99Å; L255-L309 HydrophobicContact CD2-CD1 4.28Å; L260-L309 HydrophobicContact CD1-CD1 4.29Å; F305-L309 HydrophobicContact CE1-CB 4.48Å; F305-L309 HydrophobicContact CE1-CD2 4.05Å; F305-L309 VanDerWaalsContact O-CB 3.27Å; F305-L309 WeakPolarHBondContact O-CB 3.11Å; F305-L309 PolarHBondContact O-N 3.07Å; L309-K312 PolarHBondContact O-N 3.39Å; L309-L313 HydrophobicContact CD1-CD1 4.28Å; L309-L313 HydrophobicContact CD1-CG 4.31Å; L309-L313 HydrophobicContact CG-CD1 3.95Å; L309-L313 HydrophobicContact CG-CG 4.44Å; L309-L313 VanDerWaalsContact O-CB 3.28Å; L309-L313 WeakPolarHBondContact O-CB 2.88Å; L309-L313 WeakPolarHBondContact O-CD1 3.46Å; L309-L313 WeakPolarHBondContact O-CG 3.46Å; L309-L313 PolarHBondContact O-N 2.92Å; L309-V339 HydrophobicContact CD2-CG2 4.47Å
310L89.6Confident87.2Confident1 Ų137.6 Ų37.61%0.00521%0.205CC..Hα-helixtrans-62.9-44.6176.4-78.9172.8000112.1I306 H307 L313 F314 V339 L372 L377I306-L310 HydrophobicContact CG2-CD1 4.36Å; I306-L310 WeakPolarHBondContact O-CB 3.17Å; I306-L310 WeakPolarHBondContact O-CG 3.28Å; I306-L310 PolarHBondContact O-N 2.96Å; H307-L310 PolarHBondContact O-N 2.87Å; L310-L313 PolarHBondContact O-N 2.69Å; L310-F314 WeakPolarHBondContact O-CD2 3.31Å; L310-F314 PolarHBondContact O-N 3.03Å; L310-F314 VanDerWaalsContact O-N 3.14Å; L310-V339 HydrophobicContact CD1-CG1 3.87Å; L310-V339 HydrophobicContact CD2-CB 4Å; L310-V339 HydrophobicContact CD2-CG1 3.61Å; L310-V339 HydrophobicContact CG-CG1 3.72Å; L310-L372 HydrophobicContact CD1-CD1 4.48Å; L310-L372 HydrophobicContact CD1-CD2 3.9Å; L310-L377 HydrophobicContact CB-CD2 3.91Å; L310-L377 HydrophobicContact CD1-CD1 4.28Å; L310-L377 HydrophobicContact CD1-CD2 4.13Å
311E90.6Very high86.8Confident105 Ų10539.3 Ų39.349%0.49122%0.216SC..Hα-helixtrans-58.6-50.5177.5-176.6174.8172.900111H307 L308 F314 V315H307-E311 WeakPolarHBondContact O-CB 3.42Å; H307-E311 PolarHBondContact O-N 3.44Å; L308-E311 PolarHBondContact O-N 3.03Å; E311-F314 PolarHBondContact O-N 3.09Å; E311-V315 WeakPolarHBondContact O-CG2 3.41Å; E311-V315 PolarHBondContact O-N 3.39Å
312K90.2Very high86.4Confident37 Ų3740.4 Ų40.416%0.16123%0.232CC..Hα-helixtrans-66.2-37.4179.3-66.9-74.5-172.5143.30112.7D248 V251 D252 L255 L308 L309 F314 V315 E316D248-K312 WeakPolarHBondContact OD1-CE 3.29Å; D248-K312 IonicContact OD1-NZ 2.67Å; D248-K312 PolarHBondContact OD1-NZ 2.85Å; D248-K312 IonicContact OD2-NZ 3.41Å; D248-K312 PolarHBondContact OD2-NZ 3.5Å; V251-K312 HydrophobicContact CG1-CB 3.66Å; V251-K312 HydrophobicContact CG1-CG 3.75Å; D252-K312 VanDerWaalsContact CG-NZ 3.31Å; D252-K312 VanDerWaalsContact OD1-CD 3.31Å; D252-K312 WeakPolarHBondContact OD1-CD 3.17Å; D252-K312 WeakPolarHBondContact OD1-CE 3.35Å; D252-K312 IonicContact OD1-NZ 3.45Å; D252-K312 PolarHBondContact OD1-NZ 2.87Å; D252-K312 IonicContact OD2-NZ 3.43Å; D252-K312 PolarHBondContact OD2-NZ 3.42Å; D252-K312 VanDerWaalsContact OD2-NZ 3.1Å; L255-K312 HydrophobicContact CD1-CB 3.55Å; L308-K312 HydrophobicContact CD1-CG 4.18Å; L308-K312 WeakPolarHBondContact O-CB 3.48Å; L308-K312 VanDerWaalsContact O-CG 3.29Å; L308-K312 WeakPolarHBondContact O-CG 3.38Å; L308-K312 PolarHBondContact O-N 3.31Å; L309-K312 PolarHBondContact O-N 3.39Å; K312-F314 PolarHBondContact O-N 3.3Å; K312-V315 PolarHBondContact O-N 2.8Å; K312-E316 WeakPolarHBondContact O-CB 3.35Å; K312-E316 WeakPolarHBondContact O-CG 3.25Å; K312-E316 PolarHBondContact O-N 3.35Å
313L90.7Very high85.8Confident2 Ų244.9 Ų44.91%0.0125%0.249CC..Hα-helixtrans-57.8-44.8173.6-81.3167.4000112.1L255 L309 L310 L317 L332 W335 A336L255-L313 HydrophobicContact CD2-CD2 3.43Å; L255-L313 VanDerWaalsContact CD2-CD2 3.43Å; L255-L313 HydrophobicContact CD2-CG 4.01Å; L309-L313 HydrophobicContact CD1-CD1 4.28Å; L309-L313 HydrophobicContact CD1-CG 4.31Å; L309-L313 HydrophobicContact CG-CD1 3.95Å; L309-L313 HydrophobicContact CG-CG 4.44Å; L309-L313 VanDerWaalsContact O-CB 3.28Å; L309-L313 WeakPolarHBondContact O-CB 2.88Å; L309-L313 WeakPolarHBondContact O-CD1 3.46Å; L309-L313 WeakPolarHBondContact O-CG 3.46Å; L309-L313 PolarHBondContact O-N 2.92Å; L310-L313 PolarHBondContact O-N 2.69Å; L313-L317 VanDerWaalsContact O-CB 3.24Å; L313-L317 WeakPolarHBondContact O-CB 3.37Å; L313-L317 PolarHBondContact O-N 3.05Å; L313-L332 HydrophobicContact CD2-CB 4.46Å; L313-L332 HydrophobicContact CD2-CD2 3.71Å; L313-W335 HydrophobicContact CD1-CB 4.27Å; L313-W335 HydrophobicContact CD2-CB 4.12Å; L313-A336 HydrophobicContact CD1-CB 4.49Å
314F89.6Confident84.9Confident4 Ų447.9 Ų47.92%0.01826%0.257CS..Hα-helixtrans-72.2-34.5177.8-76.9-68.5000112.8L310 E311 K312 L317 K318 A336 L377 A380 C381 L392 I396L310-F314 WeakPolarHBondContact O-CD2 3.31Å; L310-F314 PolarHBondContact O-N 3.03Å; L310-F314 VanDerWaalsContact O-N 3.14Å; E311-F314 PolarHBondContact O-N 3.09Å; K312-F314 PolarHBondContact O-N 3.3Å; F314-L317 HydrophobicContact CD1-CD2 4.2Å; F314-L317 PolarHBondContact O-N 3.1Å; F314-K318 PolarHBondContact O-N 3.14Å; F314-A336 HydrophobicContact CZ-CB 4.49Å; F314-L377 HydrophobicContact CD2-CD2 4.32Å; F314-L377 HydrophobicContact CE2-CD2 4.05Å; F314-A380 HydrophobicContact CB-CB 3.84Å; F314-A380 HydrophobicContact CD2-CB 4.24Å; F314-A380 HydrophobicContact CG-CB 4.04Å; F314-C381 HydrophobicContact CD1-CB 4.3Å; F314-C381 HydrophobicContact CE1-CB 3.69Å; F314-C381 HydrophobicContact CZ-CB 4.07Å; F314-L392 HydrophobicContact CE1-CD1 4.08Å; F314-I396 HydrophobicContact CZ-CD1 4.4Å
315V89.6Confident84.2Confident76 Ų7646.4 Ų46.446%0.46124%0.244SC..Hα-helixtrans-63-48.6173.2171.60000110.6E311 K312 L317 K318 V319E311-V315 WeakPolarHBondContact O-CG2 3.41Å; E311-V315 PolarHBondContact O-N 3.39Å; K312-V315 PolarHBondContact O-N 2.8Å; V315-L317 VanDerWaalsContact C-N 3.33Å; V315-L317 PolarHBondContact O-N 3.44Å; V315-K318 WeakPolarHBondContact O-CB 3.44Å; V315-K318 PolarHBondContact O-N 3.27Å; V315-V319 PolarHBondContact O-N 3.18Å
316E86.1Confident83.7Confident53 Ų5352.6 Ų52.625%0.24828%0.278CS..Hα-helixtrans-64.4-37176.5-75.6-60.9130.200112L255 K312 K318 V319 A320 R328 L332L255-E316 HydrophobicContact CB-CG 4.43Å; L255-E316 HydrophobicContact CD1-CG 4.13Å; K312-E316 WeakPolarHBondContact O-CB 3.35Å; K312-E316 WeakPolarHBondContact O-CG 3.25Å; K312-E316 PolarHBondContact O-N 3.35Å; E316-K318 VanDerWaalsContact C-N 3.28Å; E316-K318 PolarHBondContact O-N 3.38Å; E316-V319 PolarHBondContact O-N 3Å; E316-V319 VanDerWaalsContact O-N 3.16Å; E316-A320 WeakPolarHBondContact O-CB 3.25Å; E316-A320 PolarHBondContact O-N 2.96Å; E316-R328 IonicContact OE2-CZ 2.83Å; E316-R328 IonicContact OE2-NE 2.72Å; E316-R328 IonicContact OE2-NH2 3.8Å; E316-R328 PolarHBondContact OE2-NH2 3.04Å; E316-L332 HydrophobicContact CB-CD1 3.93Å; E316-L332 HydrophobicContact CB-CD2 4.3Å
317L86.3Confident83.4Confident2 Ų255 Ų551%0.0129%0.29CS..Hα-helixtrans-61.5-37.8174.5-172.369.4000111.7L313 F314 V315 V319 T321 V329 L332 A384 C386 L392L313-L317 VanDerWaalsContact O-CB 3.24Å; L313-L317 WeakPolarHBondContact O-CB 3.37Å; L313-L317 PolarHBondContact O-N 3.05Å; F314-L317 HydrophobicContact CD1-CD2 4.2Å; F314-L317 PolarHBondContact O-N 3.1Å; V315-L317 VanDerWaalsContact C-N 3.33Å; V315-L317 PolarHBondContact O-N 3.44Å; L317-V319 VanDerWaalsContact C-N 3.35Å; L317-T321 WeakPolarHBondContact O-CB 3.34Å; L317-T321 WeakPolarHBondContact O-CG2 3.48Å; L317-T321 PolarHBondContact O-N 3.04Å; L317-T321 PolarHBondContact O-OG1 3.13Å; L317-V329 HydrophobicContact CD1-CB 4.45Å; L317-V329 HydrophobicContact CD1-CG1 3.96Å; L317-L332 HydrophobicContact CD1-CB 4.16Å; L317-A384 HydrophobicContact CB-CB 4.31Å; L317-A384 HydrophobicContact CD2-CB 4.12Å; L317-A384 HydrophobicContact CG-CB 4.24Å; L317-C386 HydrophobicContact CD1-CB 4.45Å; L317-L392 HydrophobicContact CD2-CD1 4.48Å
318K86Confident83.3Confident111 Ų11154.5 Ų54.548%0.48329%0.287SS..Hα-helixtrans-65.5-36.8175.2-173.9176.9-178.8170.80112.3F314 V315 E316 T321 A384F314-K318 PolarHBondContact O-N 3.14Å; V315-K318 WeakPolarHBondContact O-CB 3.44Å; V315-K318 PolarHBondContact O-N 3.27Å; E316-K318 VanDerWaalsContact C-N 3.28Å; E316-K318 PolarHBondContact O-N 3.38Å; K318-T321 WeakPolarHBondContact CA-OG1 3.49Å; K318-T321 PolarHBondContact O-OG1 3.42Å; K318-A384 HydrophobicContact CB-CB 3.93Å
319V86.1Confident83.1Confident63 Ų6354.2 Ų54.238%0.38229%0.286SS..Hα-helixtrans-72.3-49.8176.2178.10000110.3V315 E316 L317 T321 A322 E323V315-V319 PolarHBondContact O-N 3.18Å; E316-V319 PolarHBondContact O-N 3Å; E316-V319 VanDerWaalsContact O-N 3.16Å; L317-V319 VanDerWaalsContact C-N 3.35Å; V319-T321 VanDerWaalsContact C-N 3.3Å; V319-T321 PolarHBondContact O-N 2.86Å; V319-A322 WeakPolarHBondContact O-CB 3.2Å; V319-A322 PolarHBondContact O-N 3.18Å; V319-E323 PolarHBondContact O-N 3.46Å
320A80.7Confident82.9Confident0 Ų055.2 Ų55.20%029%0.29CS..Hα-helixtrans-61.9-34.6-178.300000113.3E316 A322 E323 Q324 T325 R328 V329 L332E316-A320 WeakPolarHBondContact O-CB 3.25Å; E316-A320 PolarHBondContact O-N 2.96Å; A320-A322 VanDerWaalsContact C-N 3.3Å; A320-A322 PolarHBondContact O-N 2.97Å; A320-E323 PolarHBondContact O-N 2.94Å; A320-Q324 PolarHBondContact O-N 2.9Å; A320-Q324 VanDerWaalsContact O-N 3.07Å; A320-T325 PolarHBondContact O-N 3.46Å; A320-T325 PolarHBondContact O-OG1 2.82Å; A320-R328 HydrophobicContact CB-CG 4.07Å; A320-V329 HydrophobicContact CB-CG2 3.82Å; A320-L332 HydrophobicContact CB-CD1 4.14Å
321T75Confident82.7Confident41 Ų4155.6 Ų55.625%0.25229%0.292SS..Hα-helixtrans-67.4-28.9174.844.60000113L317 K318 V319 V329 C386L317-T321 WeakPolarHBondContact O-CB 3.34Å; L317-T321 WeakPolarHBondContact O-CG2 3.48Å; L317-T321 PolarHBondContact O-N 3.04Å; L317-T321 PolarHBondContact O-OG1 3.13Å; K318-T321 WeakPolarHBondContact CA-OG1 3.49Å; K318-T321 PolarHBondContact O-OG1 3.42Å; V319-T321 VanDerWaalsContact C-N 3.3Å; V319-T321 PolarHBondContact O-N 2.86Å; T321-V329 HydrophobicContact CG2-CG1 4.34Å; T321-V329 HydrophobicContact CG2-CG2 4.1Å; T321-C386 HydrophobicContact CG2-CB 3.61Å
322A73.6Confident82.6Confident77 Ų7750.7 Ų50.764%0.63627%0.269SS*.Hα-helixtrans-74.2-34.8172.600000112V319 A320V319-A322 WeakPolarHBondContact O-CB 3.2Å; V319-A322 PolarHBondContact O-N 3.18Å; A320-A322 VanDerWaalsContact C-N 3.3Å; A320-A322 PolarHBondContact O-N 2.97Å
323E73.1Confident82.4Confident129 Ų12949 Ų4960%0.60326%0.261SS*.Hα-helixtrans-86.4-7-176.5-65.4-179.5173.300114.6V319 A320V319-E323 PolarHBondContact O-N 3.46Å; A320-E323 PolarHBondContact O-N 2.94Å
324Q64.9Low82.2Confident138 Ų13848.9 Ų48.965%0.64526%0.261SS*.THydrogen-bonded Turntrans61.638.2178.3-58.7173.831.700114.3A320 D326A320-Q324 PolarHBondContact O-N 2.9Å; A320-Q324 VanDerWaalsContact O-N 3.07Å; Q324-D326 PolarHBondContact O-N 3.01Å
325T72.6Confident82.2Confident52 Ų5249 Ų4932%0.31926%0.261SS..  trans-90.784.6175.9450000111.2A320 L327 R328 V329A320-T325 PolarHBondContact O-N 3.46Å; A320-T325 PolarHBondContact O-OG1 2.82Å; T325-L327 VanDerWaalsContact C-N 3.3Å; T325-L327 PolarHBondContact O-N 3.38Å; T325-R328 PolarHBondContact O-N 2.76Å; T325-R328 VanDerWaalsContact O-N 3.09Å; T325-V329 WeakPolarHBondContact O-CG2 3.36Å; T325-V329 PolarHBondContact O-N 3.29Å
326D76.6Confident82.1Confident136 Ų13645.5 Ų45.573%0.72724%0.24SC*.Hα-helixtrans-54.6-40.1-173-69.6-23.4000113.9Q324 F330Q324-D326 PolarHBondContact O-N 3.01Å; D326-F330 WeakPolarHBondContact O-CB 3.34Å; D326-F330 PolarHBondContact O-N 3.01Å
327L82.5Confident82.1Confident53 Ų5343 Ų4328%0.27723%0.228SC..Hα-helixtrans-65.7-46177.8-169.871.1000111.9V264 L267 T325 F330 Y331V264-L327 HydrophobicContact CG2-CD2 4.34Å; L267-L327 HydrophobicContact CD1-CD1 4.48Å; T325-L327 VanDerWaalsContact C-N 3.3Å; T325-L327 PolarHBondContact O-N 3.38Å; L327-F330 WeakPolarHBondContact O-CB 3.36Å; L327-F330 PolarHBondContact O-N 3.2Å; L327-Y331 HydrophobicContact CD1-CD2 4.1Å; L327-Y331 HydrophobicContact CD1-CE2 3.66Å; L327-Y331 HydrophobicContact CG-CD2 4.09Å; L327-Y331 HydrophobicContact CG-CE2 4.07Å; L327-Y331 WeakPolarHBondContact O-CD2 3.46Å; L327-Y331 PolarHBondContact O-N 3.32Å
328R85.3Confident82Confident29 Ų2944 Ų4411%0.10923%0.233CC..Hα-helixtrans-64.9-45179.8-176.2170.118079.86.1110.4L255 D257 V261 E316 A320 T325 F330 Y331 L332L255-R328 PolarHBondContact O-NH1 3.46Å; L255-R328 VanDerWaalsContact O-NH1 3.09Å; L255-R328 PolarHBondContact O-NH2 2.94Å; D257-R328 IonicContact OD1-CZ 3.85Å; D257-R328 IonicContact OD1-NH1 3.57Å; D257-R328 PolarHBondContact OD1-NH1 2.99Å; V261-R328 HydrophobicContact CG1-CB 4.22Å; V261-R328 HydrophobicContact CG1-CG 4.09Å; V261-R328 HydrophobicContact CG2-CG 4.45Å; E316-R328 IonicContact OE2-CZ 2.83Å; E316-R328 IonicContact OE2-NE 2.72Å; E316-R328 IonicContact OE2-NH2 3.8Å; E316-R328 PolarHBondContact OE2-NH2 3.04Å; A320-R328 HydrophobicContact CB-CG 4.07Å; T325-R328 PolarHBondContact O-N 2.76Å; T325-R328 VanDerWaalsContact O-N 3.09Å; R328-F330 VanDerWaalsContact C-N 3.31Å; R328-F330 PolarHBondContact O-N 3.09Å; R328-Y331 PolarHBondContact O-N 3.08Å; R328-L332 HydrophobicContact CG-CD1 3.77Å; R328-L332 HydrophobicContact CG-CG 4.28Å; R328-L332 WeakPolarHBondContact O-CB 3.4Å; R328-L332 WeakPolarHBondContact O-CG 3.33Å; R328-L332 PolarHBondContact O-N 3.44Å
329V85Confident82Confident21 Ų2139 Ų3913%0.12721%0.211CC..Hα-helixtrans-58.1-42.8174.7173.20000111.2L317 A320 T321 T325 S333 C386L317-V329 HydrophobicContact CD1-CB 4.45Å; L317-V329 HydrophobicContact CD1-CG1 3.96Å; A320-V329 HydrophobicContact CB-CG2 3.82Å; T321-V329 HydrophobicContact CG2-CG1 4.34Å; T321-V329 HydrophobicContact CG2-CG2 4.1Å; T325-V329 WeakPolarHBondContact O-CG2 3.36Å; T325-V329 PolarHBondContact O-N 3.29Å; V329-S333 VanDerWaalsContact O-CB 3.25Å; V329-S333 WeakPolarHBondContact O-CB 3.44Å; V329-S333 PolarHBondContact O-N 3.27Å; V329-S333 PolarHBondContact O-OG 2.93Å; V329-S333 VanDerWaalsContact O-OG 3.08Å; V329-C386 HydrophobicContact CG1-CB 3.76Å
330F86.4Confident81.8Confident29 Ų2936.1 Ų36.113%0.12719%0.194CC..Hα-helixtrans-60.3-55.7176.5177.6-96.8000111.8T277 P283 D326 L327 R328 L332 S333 A334T277-F330 HydrophobicContact CG2-CB 4.41Å; T277-F330 HydrophobicContact CG2-CD1 4.33Å; T277-F330 HydrophobicContact CG2-CD2 4.03Å; T277-F330 HydrophobicContact CG2-CE2 4.38Å; T277-F330 HydrophobicContact CG2-CG 3.99Å; P283-F330 HydrophobicContact CB-CD2 4.49Å; P283-F330 HydrophobicContact CB-CE2 4.34Å; D326-F330 WeakPolarHBondContact O-CB 3.34Å; D326-F330 PolarHBondContact O-N 3.01Å; L327-F330 WeakPolarHBondContact O-CB 3.36Å; L327-F330 PolarHBondContact O-N 3.2Å; R328-F330 VanDerWaalsContact C-N 3.31Å; R328-F330 PolarHBondContact O-N 3.09Å; F330-L332 PolarHBondContact O-N 2.79Å; F330-S333 PolarHBondContact O-N 2.96Å; F330-S333 PolarHBondContact O-OG 3.36Å; F330-A334 VanDerWaalsContact O-CB 3.32Å; F330-A334 WeakPolarHBondContact O-CB 3.42Å; F330-A334 PolarHBondContact O-N 3.46Å
331Y86.3Confident81.8Confident10 Ų1037.8 Ų37.84%0.03920%0.203CC..Hα-helixtrans-66.2-39.5-176.3-81.1-78.6000113.3P262 L267 P286 L327 R328 S333 A334 W335P262-Y331 HydrophobicContact CG-CD1 3.92Å; P262-Y331 HydrophobicContact CG-CD2 4.1Å; P262-Y331 HydrophobicContact CG-CE1 3.63Å; P262-Y331 HydrophobicContact CG-CE2 3.84Å; P262-Y331 HydrophobicContact CG-CG 4.16Å; L267-Y331 HydrophobicContact CD1-CE2 4.08Å; L267-Y331 WeakPolarHBondContact CD1-OH 3.48Å; L267-Y331 WeakPolarHBondContact CD2-OH 3.46Å; P286-Y331 HydrophobicContact CG-CE1 4.26Å; L327-Y331 HydrophobicContact CD1-CD2 4.1Å; L327-Y331 HydrophobicContact CD1-CE2 3.66Å; L327-Y331 HydrophobicContact CG-CD2 4.09Å; L327-Y331 HydrophobicContact CG-CE2 4.07Å; L327-Y331 WeakPolarHBondContact O-CD2 3.46Å; L327-Y331 PolarHBondContact O-N 3.32Å; R328-Y331 PolarHBondContact O-N 3.08Å; Y331-S333 VanDerWaalsContact C-N 3.33Å; Y331-S333 PolarHBondContact O-N 3.38Å; Y331-A334 PolarHBondContact O-N 3.4Å; Y331-W335 PolarHBondContact O-N 3.04Å
332L88.1Confident81.9Confident2 Ų236.7 Ų36.71%0.0120%0.197CC..Hα-helixtrans-61.1-43.7174-67173.4000111L255 V261 L313 E316 L317 A320 R328 F330 A336L255-L332 HydrophobicContact CD2-CD2 4.06Å; V261-L332 HydrophobicContact CG2-CD2 3.86Å; V261-L332 HydrophobicContact CG2-CG 4.19Å; L313-L332 HydrophobicContact CD2-CB 4.46Å; L313-L332 HydrophobicContact CD2-CD2 3.71Å; E316-L332 HydrophobicContact CB-CD1 3.93Å; E316-L332 HydrophobicContact CB-CD2 4.3Å; L317-L332 HydrophobicContact CD1-CB 4.16Å; A320-L332 HydrophobicContact CB-CD1 4.14Å; R328-L332 HydrophobicContact CG-CD1 3.77Å; R328-L332 HydrophobicContact CG-CG 4.28Å; R328-L332 WeakPolarHBondContact O-CB 3.4Å; R328-L332 WeakPolarHBondContact O-CG 3.33Å; R328-L332 PolarHBondContact O-N 3.44Å; F330-L332 PolarHBondContact O-N 2.79Å; L332-A336 WeakPolarHBondContact O-CB 2.91Å; L332-A336 PolarHBondContact O-N 3Å
333S86.2Confident82.1Confident0 Ų033.4 Ų33.40%017%0.168CC..Hα-helixtrans-68.3-33.6176.475.20000113P283 V329 F330 Y331 S337 S388P283-S333 VanDerWaalsContact CB-OG 3.25Å; P283-S333 WeakPolarHBondContact CB-OG 3.36Å; V329-S333 VanDerWaalsContact O-CB 3.25Å; V329-S333 WeakPolarHBondContact O-CB 3.44Å; V329-S333 PolarHBondContact O-N 3.27Å; V329-S333 PolarHBondContact O-OG 2.93Å; V329-S333 VanDerWaalsContact O-OG 3.08Å; F330-S333 PolarHBondContact O-N 2.96Å; F330-S333 PolarHBondContact O-OG 3.36Å; Y331-S333 VanDerWaalsContact C-N 3.33Å; Y331-S333 PolarHBondContact O-N 3.38Å; S333-S337 VanDerWaalsContact O-CB 3.28Å; S333-S337 WeakPolarHBondContact O-CB 3.25Å; S333-S337 PolarHBondContact O-N 3.15Å; S333-S388 PolarHBondContact OG-OG 2.98Å; S333-S388 VanDerWaalsContact OG-OG 3.08Å
334A86.1Confident82Confident0 Ų028 Ų280%015%0.145CC..Hα-helixtrans-68.5-44.717700000111.4P283 V285 F330 Y331 S337 E338P283-A334 HydrophobicContact CB-CB 4.05Å; V285-A334 HydrophobicContact CG2-CB 3.64Å; F330-A334 VanDerWaalsContact O-CB 3.32Å; F330-A334 WeakPolarHBondContact O-CB 3.42Å; F330-A334 PolarHBondContact O-N 3.46Å; Y331-A334 PolarHBondContact O-N 3.4Å; A334-S337 WeakPolarHBondContact O-CB 3.33Å; A334-S337 PolarHBondContact O-N 3.43Å; A334-E338 WeakPolarHBondContact O-CG 3.25Å; A334-E338 PolarHBondContact O-N 3.43Å
335W88.8Confident81.8Confident7 Ų726.1 Ų26.13%0.02714%0.139CC..Hα-helixtrans-64.2-41.9174.5-77.6115.3000112.1L260 V285 V289 L290 W293 L297 L313 Y331 S337 E338 V339 I365L260-W335 HydrophobicContact CD2-CD2 4.47Å; L260-W335 HydrophobicContact CD2-CH2 4.11Å; L260-W335 HydrophobicContact CD2-CZ2 3.68Å; L260-W335 PolarHBondContact O-NE1 3.33Å; V285-W335 HydrophobicContact CG1-CH2 4.21Å; V285-W335 HydrophobicContact CG1-CZ2 3.89Å; V285-W335 HydrophobicContact CG2-CD2 3.74Å; V285-W335 HydrophobicContact CG2-CE3 4.04Å; V285-W335 HydrophobicContact CG2-CG 4Å; V285-W335 HydrophobicContact CG2-CZ2 4.49Å; V289-W335 HydrophobicContact CG1-CZ2 4.11Å; L290-W335 HydrophobicContact CD1-CH2 4.07Å; L290-W335 HydrophobicContact CD1-CZ3 3.78Å; W293-W335 HydrophobicContact CB-CH2 4.15Å; L297-W335 HydrophobicContact CD1-CE3 4.43Å; L297-W335 HydrophobicContact CD1-CH2 3.85Å; L297-W335 HydrophobicContact CD1-CZ3 3.53Å; L313-W335 HydrophobicContact CD1-CB 4.27Å; L313-W335 HydrophobicContact CD2-CB 4.12Å; Y331-W335 PolarHBondContact O-N 3.04Å; W335-S337 VanDerWaalsContact C-N 3.33Å; W335-S337 PolarHBondContact O-N 2.95Å; W335-E338 PolarHBondContact O-N 3.31Å; W335-V339 VanDerWaalsContact O-CG2 3.25Å; W335-V339 WeakPolarHBondContact O-CG2 3.37Å; W335-V339 PolarHBondContact O-N 3.42Å; W335-I365 HydrophobicContact CZ3-CD1 4.21Å
336A87.4Confident81Confident2 Ų229.4 Ų29.42%0.01715%0.149CC..Hα-helixtrans-59.9-43.6173.900000111.8L313 F314 L332 V339 L340 L392L313-A336 HydrophobicContact CD1-CB 4.49Å; F314-A336 HydrophobicContact CZ-CB 4.49Å; L332-A336 WeakPolarHBondContact O-CB 2.91Å; L332-A336 PolarHBondContact O-N 3Å; A336-V339 PolarHBondContact O-N 2.87Å; A336-L340 WeakPolarHBondContact O-CB 3.25Å; A336-L340 VanDerWaalsContact O-CG 3.25Å; A336-L340 WeakPolarHBondContact O-CG 3.48Å; A336-L340 PolarHBondContact O-N 2.9Å; A336-L392 HydrophobicContact CB-CD1 4.41Å; A336-L392 HydrophobicContact CB-CD2 4.1Å
337S86.3Confident79.8Confident0 Ų027.4 Ų27.40%013%0.134CC..Hα-helixtrans-60.5-48.3175.1-179.60000111.8P283 S333 A334 W335 V339 L340 L341 H391P283-S337 VanDerWaalsContact O-CB 3.32Å; P283-S337 WeakPolarHBondContact O-CB 3.13Å; P283-S337 PolarHBondContact O-OG 3.14Å; S333-S337 VanDerWaalsContact O-CB 3.28Å; S333-S337 WeakPolarHBondContact O-CB 3.25Å; S333-S337 PolarHBondContact O-N 3.15Å; A334-S337 WeakPolarHBondContact O-CB 3.33Å; A334-S337 PolarHBondContact O-N 3.43Å; W335-S337 VanDerWaalsContact C-N 3.33Å; W335-S337 PolarHBondContact O-N 2.95Å; S337-V339 PolarHBondContact O-N 3.49Å; S337-L340 PolarHBondContact O-N 3.33Å; S337-L341 VanDerWaalsContact O-CB 3.3Å; S337-L341 WeakPolarHBondContact O-CB 3.44Å; S337-L341 VanDerWaalsContact O-CG 3.25Å; S337-L341 WeakPolarHBondContact O-CG 3.42Å; S337-L341 PolarHBondContact O-N 3.43Å; S337-H391 PolarHBondContact OG-NE2 3.49Å
338E85.3Confident77.9Confident25 Ų2532 Ų3212%0.11715%0.154CC..Hα-helixtrans-62.3-40.8178.8-74-59.8151.800112.7V285 A334 W335 C342 I365V285-E338 HydrophobicContact CB-CG 4.04Å; V285-E338 HydrophobicContact CG2-CG 3.7Å; A334-E338 WeakPolarHBondContact O-CG 3.25Å; A334-E338 PolarHBondContact O-N 3.43Å; W335-E338 PolarHBondContact O-N 3.31Å; E338-C342 WeakPolarHBondContact O-CB 3.25Å; E338-C342 PolarHBondContact O-N 2.82Å; E338-C342 PolarHBondContact O-SG 3.08Å; E338-I365 HydrophobicContact CB-CD1 4.21Å
339V85.3Confident76.3Confident4 Ų435.6 Ų35.62%0.02417%0.171CC..Hα-helixtrans-65.3-44.6177.4171.60000110.9I306 L309 L310 W335 A336 S337 C342 N343 F366I306-V339 HydrophobicContact CG2-CG1 4.01Å; L309-V339 HydrophobicContact CD2-CG2 4.47Å; L310-V339 HydrophobicContact CD1-CG1 3.87Å; L310-V339 HydrophobicContact CD2-CB 4Å; L310-V339 HydrophobicContact CD2-CG1 3.61Å; L310-V339 HydrophobicContact CG-CG1 3.72Å; W335-V339 VanDerWaalsContact O-CG2 3.25Å; W335-V339 WeakPolarHBondContact O-CG2 3.37Å; W335-V339 PolarHBondContact O-N 3.42Å; A336-V339 PolarHBondContact O-N 2.87Å; S337-V339 PolarHBondContact O-N 3.49Å; V339-C342 PolarHBondContact O-N 3.43Å; V339-N343 PolarHBondContact O-N 2.8Å; V339-F366 HydrophobicContact CB-CE2 4.23Å; V339-F366 HydrophobicContact CB-CZ 4.23Å; V339-F366 HydrophobicContact CG1-CE2 3.78Å; V339-F366 HydrophobicContact CG1-CZ 3.77Å; V339-F366 HydrophobicContact CG2-CE2 4.43Å; V339-F366 HydrophobicContact CG2-CZ 3.99Å
340L83.2Confident74.4Confident3 Ų344.8 Ų44.82%0.01620%0.203CC..Hα-helixtrans-65-45.4176.9-69.7170.9000111.6A336 S337 C342 N343 S344 L372 L392 L395 I396A336-L340 WeakPolarHBondContact O-CB 3.25Å; A336-L340 VanDerWaalsContact O-CG 3.25Å; A336-L340 WeakPolarHBondContact O-CG 3.48Å; A336-L340 PolarHBondContact O-N 2.9Å; S337-L340 PolarHBondContact O-N 3.33Å; L340-C342 VanDerWaalsContact C-N 3.34Å; L340-C342 PolarHBondContact O-N 3.1Å; L340-N343 WeakPolarHBondContact O-CB 3.32Å; L340-N343 PolarHBondContact O-N 2.73Å; L340-S344 PolarHBondContact O-N 3.47Å; L340-L372 HydrophobicContact CD2-CD1 3.95Å; L340-L392 HydrophobicContact CD1-CD2 4.29Å; L340-L395 HydrophobicContact CB-CB 4.34Å; L340-L395 HydrophobicContact CB-CD1 4.25Å; L340-L395 HydrophobicContact CD1-CB 4.25Å; L340-I396 HydrophobicContact CD1-CD1 4.44Å; L340-I396 HydrophobicContact CD1-CG1 3.96Å; L340-I396 HydrophobicContact CD2-CG1 4.25Å
341L80.4Confident72.5Confident35 Ų3552.8 Ų52.818%0.18324%0.238CC..Hα-helixtrans-62.3-38.4177.9-76.6170.4000112.5S337 N343 S344 F347 L395S337-L341 VanDerWaalsContact O-CB 3.3Å; S337-L341 WeakPolarHBondContact O-CB 3.44Å; S337-L341 VanDerWaalsContact O-CG 3.25Å; S337-L341 WeakPolarHBondContact O-CG 3.42Å; S337-L341 PolarHBondContact O-N 3.43Å; L341-N343 PolarHBondContact O-N 2.83Å; L341-S344 WeakPolarHBondContact O-CB 3.28Å; L341-S344 PolarHBondContact O-N 3.22Å; L341-S344 VanDerWaalsContact O-N 3.16Å; L341-S344 PolarHBondContact O-OG 3.04Å; L341-F347 HydrophobicContact CD2-CE2 4.4Å; L341-L395 HydrophobicContact CD2-CD1 4.39Å; L341-L395 HydrophobicContact CD2-CD2 3.58Å; L341-L395 HydrophobicContact CG-CD1 4.06Å; L341-L395 HydrophobicContact CG-CD2 4.17Å
342C77.1Confident70.9Confident19 Ų1955 Ų5513%0.12825%0.249CC..Hα-helixtrans-62.2-24.9174.7-76.10000112.8E338 V339 L340 F366E338-C342 WeakPolarHBondContact O-CB 3.25Å; E338-C342 PolarHBondContact O-N 2.82Å; E338-C342 PolarHBondContact O-SG 3.08Å; V339-C342 PolarHBondContact O-N 3.43Å; L340-C342 VanDerWaalsContact C-N 3.34Å; L340-C342 PolarHBondContact O-N 3.1Å; C342-F366 HydrophobicContact CB-CD2 3.44Å; C342-F366 VanDerWaalsContact CB-CD2 3.44Å; C342-F366 HydrophobicContact CB-CE2 3.68Å; C342-F366 HydrophobicContact CB-CG 4.48Å
343N76.3Confident69.6Low7 Ų763.6 Ų63.64%0.03728%0.281CS..Hα-helixtrans-93.4-8.4178-159.145000114.2V339 L340 L341 R369 I370 L372V339-N343 PolarHBondContact O-N 2.8Å; L340-N343 WeakPolarHBondContact O-CB 3.32Å; L340-N343 PolarHBondContact O-N 2.73Å; L341-N343 PolarHBondContact O-N 2.83Å; N343-R369 WeakPolarHBondContact OD1-CA 3.42Å; N343-R369 VanDerWaalsContact OD1-CG 3.23Å; N343-R369 WeakPolarHBondContact OD1-CG 3.21Å; N343-I370 PolarHBondContact ND2-O 3.08Å; N343-I370 PolarHBondContact OD1-N 3.24Å; N343-I370 PolarHBondContact OD1-O 2.81Å; N343-L372 HydrophobicContact CB-CD1 4.37Å; N343-L372 VanDerWaalsContact ND2-CD1 3.25Å; N343-L372 WeakPolarHBondContact ND2-CD1 3.34Å; N343-L372 VanDerWaalsContact ND2-CG 3.33Å; N343-L372 WeakPolarHBondContact ND2-CG 3.22Å
344S71.8Confident68.2Low16 Ų1672.6 Ų72.611%0.11232%0.32CS..  trans-70143.8-175.7710000113.8L340 L341 D399L340-S344 PolarHBondContact O-N 3.47Å; L341-S344 WeakPolarHBondContact O-CB 3.28Å; L341-S344 PolarHBondContact O-N 3.22Å; L341-S344 VanDerWaalsContact O-N 3.16Å; L341-S344 PolarHBondContact O-OG 3.04Å; S344-D399 WeakPolarHBondContact CA-OD2 3.34Å; S344-D399 WeakPolarHBondContact CB-OD2 3.4Å
345N61.6Low66.9Low99 Ų9977.5 Ų77.553%0.52935%0.351SS..  trans-95.9-10.4179.8-164.233.6000113.4F347 D399N345-F347 VanDerWaalsContact C-N 3.25Å; N345-F347 PolarHBondContact O-N 3.04Å; N345-F347 VanDerWaalsContact O-N 3.14Å; N345-D399 PolarHBondContact N-OD1 3.02Å
346K55.2Low65.4Low121 Ų12182 Ų8253%0.52637%0.372SS..  trans-72.6-7.8-166.3-69-170.3176.4-1720116.1E348 D398K346-E348 PolarHBondContact O-N 2.74Å; K346-D398 HydrophobicContact CD-CB 4.44Å; K346-D398 WeakPolarHBondContact CE-O 3.34Å; K346-D398 IonicContact NZ-OD1 2.72Å; K346-D398 PolarHBondContact NZ-OD1 2.79Å; K346-D398 IonicContact NZ-OD2 2.81Å; K346-D398 PolarHBondContact NZ-OD2 3.44Å
347F51.6Low64.2Low94 Ų9487.6 Ų87.641%0.41240%0.396SS..  trans-96.557.8179.4-68.8-70.6000112.2L341 N345 F349 R360L341-F347 HydrophobicContact CD2-CE2 4.4Å; N345-F347 VanDerWaalsContact C-N 3.25Å; N345-F347 PolarHBondContact O-N 3.04Å; N345-F347 VanDerWaalsContact O-N 3.14Å; F347-F349 VanDerWaalsContact C-N 3.28Å; F347-F349 HydrophobicContact CB-CD2 4.12Å; F347-F349 HydrophobicContact CB-CE2 3.67Å; F347-F349 HydrophobicContact CB-CZ 4.12Å; F347-F349 AromaticContact CD1-CE1 3.88Å; F347-F349 HydrophobicContact CD1-CE1 3.88Å; F347-F349 AromaticContact CD1-CE2 3.65Å; F347-F349 HydrophobicContact CD1-CE2 3.65Å; F347-F349 AromaticContact CD1-CZ 3.19Å; F347-F349 HydrophobicContact CD1-CZ 3.19Å; F347-F349 AromaticContact CE1-CZ 3.85Å; F347-F349 HydrophobicContact CE1-CZ 3.85Å; F347-F349 AromaticContact CG-CE2 3.96Å; F347-F349 HydrophobicContact CG-CE2 3.96Å; F347-F349 AromaticContact CG-CZ 3.99Å; F347-F349 HydrophobicContact CG-CZ 3.99Å; F347-F349 PolarHBondContact O-N 3.37Å; F347-F349 VanDerWaalsContact O-N 3.17Å; F347-R360 VanDerWaalsContact CB-CZ 3.45Å; F347-R360 PolarHBondContact O-NH1 3.48Å
348E43.1Very low62.9Low148 Ų14895.3 Ų95.369%0.69243%0.429SS*.  trans-76.882.6157.5-79.3-169.3160.800108.7K346 R350K346-E348 PolarHBondContact O-N 2.74Å; E348-R350 PolarHBondContact O-N 2.96Å
349F50.5Low61.7Low106 Ų10696.8 Ų96.847%0.46545%0.446SS..  trans-71.196.6173.7-65.7-71.1000109.3F347 F351 E352F347-F349 VanDerWaalsContact C-N 3.28Å; F347-F349 HydrophobicContact CB-CD2 4.12Å; F347-F349 HydrophobicContact CB-CE2 3.67Å; F347-F349 HydrophobicContact CB-CZ 4.12Å; F347-F349 AromaticContact CD1-CE1 3.88Å; F347-F349 HydrophobicContact CD1-CE1 3.88Å; F347-F349 AromaticContact CD1-CE2 3.65Å; F347-F349 HydrophobicContact CD1-CE2 3.65Å; F347-F349 AromaticContact CD1-CZ 3.19Å; F347-F349 HydrophobicContact CD1-CZ 3.19Å; F347-F349 AromaticContact CE1-CZ 3.85Å; F347-F349 HydrophobicContact CE1-CZ 3.85Å; F347-F349 AromaticContact CG-CE2 3.96Å; F347-F349 HydrophobicContact CG-CE2 3.96Å; F347-F349 AromaticContact CG-CZ 3.99Å; F347-F349 HydrophobicContact CG-CZ 3.99Å; F347-F349 PolarHBondContact O-N 3.37Å; F347-F349 VanDerWaalsContact O-N 3.17Å; F349-F351 PolarHBondContact O-N 3.06Å; F349-E352 HydrophobicContact CB-CB 3.78Å; F349-E352 PolarHBondContact O-N 3.39Å
350R45.6Very low60.7Low214 Ų21499.5 Ų99.581%0.80846%0.456SS*.THydrogen-bonded Turntrans-57.8-7.5-179-70.3-176.4-176.7175.71.6114.9E348E348-R350 PolarHBondContact O-N 2.96Å
351F46.8Very low59.7Low196 Ų196102.4 Ų102.486%0.8647%0.47SS*.THydrogen-bonded Turntrans-14031.3-178.8-60.7-76.2000114.5F349F349-F351 PolarHBondContact O-N 3.06Å
352E52.2Low59Low56 Ų56105 Ų10526%0.26248%0.479SS..  trans-74.5126.4179.4-165.7176.3-142.600112.3F349 Q356 K357 R360F349-E352 HydrophobicContact CB-CB 3.78Å; F349-E352 PolarHBondContact O-N 3.39Å; E352-Q356 HydrophobicContact CG-CB 3.78Å; E352-K357 VanDerWaalsContact CD-CA 3.5Å; E352-K357 HydrophobicContact CG-CB 4.07Å; E352-K357 WeakPolarHBondContact OE2-CB 3.27Å; E352-K357 WeakPolarHBondContact OE2-CG 3.34Å; E352-R360 WeakPolarHBondContact OE1-CD 3.25Å
353R61.2Low58.4Low183 Ų183106 Ų10669%0.69148%0.484SS*.  trans-70.6149.5173.4-64.7-177.8-177.5176.31.9110.2T355 Q356 K357R353-T355 PolarHBondContact O-N 3.28Å; R353-Q356 HydrophobicContact CB-CG 4.34Å; R353-Q356 VanDerWaalsContact N-OE1 3.08Å; R353-Q356 WeakPolarHBondContact O-CB 3.39Å; R353-Q356 PolarHBondContact O-N 2.98Å; R353-K357 PolarHBondContact O-N 3.33Å
354K57.1Low58.1Low189 Ų189108.4 Ų108.482%0.82249%0.492SS*.Hα-helixtrans-53.1-32.4179.1-70.1-175.4178.8179.10113.7K358K354-K358 WeakPolarHBondContact O-CB 3.38Å; K354-K358 WeakPolarHBondContact O-CG 3.47Å; K354-K358 PolarHBondContact O-N 3.09Å; K354-K358 VanDerWaalsContact O-N 3.11Å
355T57.9Low58Low104 Ų104107.9 Ų107.964%0.63849%0.488SS*.Hα-helixtrans-72.1-39.5176.147.10000112.8R353 K358 A359R353-T355 PolarHBondContact O-N 3.28Å; T355-K358 PolarHBondContact O-N 2.9Å; T355-A359 PolarHBondContact O-N 2.72Å
356Q58.6Low58.5Low100 Ų100103.5 Ų103.547%0.46746%0.464SS..Hα-helixtrans-68.2-41.8175.7-68.7169.6-31.600111E352 R353 K358 A359 R360E352-Q356 HydrophobicContact CG-CB 3.78Å; R353-Q356 HydrophobicContact CB-CG 4.34Å; R353-Q356 VanDerWaalsContact N-OE1 3.08Å; R353-Q356 WeakPolarHBondContact O-CB 3.39Å; R353-Q356 PolarHBondContact O-N 2.98Å; Q356-K358 VanDerWaalsContact C-N 3.33Å; Q356-K358 PolarHBondContact O-N 3.4Å; Q356-A359 PolarHBondContact O-N 3.06Å; Q356-R360 WeakPolarHBondContact O-CB 3.26Å; Q356-R360 PolarHBondContact O-N 3.47Å
357K60.5Low58.9Low120 Ų120102.8 Ų102.852%0.52246%0.464SS..Hα-helixtrans-60.1-42173-170.2171.4-178.3174.40112.1E352 R353 R360 M361E352-K357 VanDerWaalsContact CD-CA 3.5Å; E352-K357 HydrophobicContact CG-CB 4.07Å; E352-K357 WeakPolarHBondContact OE2-CB 3.27Å; E352-K357 WeakPolarHBondContact OE2-CG 3.34Å; R353-K357 PolarHBondContact O-N 3.33Å; K357-R360 PolarHBondContact O-N 3.3Å; K357-M361 VanDerWaalsContact O-CG 3.32Å; K357-M361 WeakPolarHBondContact O-CG 3.48Å; K357-M361 PolarHBondContact O-N 3.03Å
358K60Low59.7Low163 Ų163104.4 Ų104.471%0.70948%0.477SS*.Hα-helixtrans-64.8-42.2175.3-80.9-176.2176.4-170.80112.6K354 T355 Q356 M361 K362K354-K358 WeakPolarHBondContact O-CB 3.38Å; K354-K358 WeakPolarHBondContact O-CG 3.47Å; K354-K358 PolarHBondContact O-N 3.09Å; K354-K358 VanDerWaalsContact O-N 3.11Å; T355-K358 PolarHBondContact O-N 2.9Å; Q356-K358 VanDerWaalsContact C-N 3.33Å; Q356-K358 PolarHBondContact O-N 3.4Å; K358-M361 PolarHBondContact O-N 3.06Å; K358-K362 WeakPolarHBondContact O-CB 3.32Å; K358-K362 PolarHBondContact O-N 3.36Å
359A59.6Low61.1Low55 Ų55103.8 Ų103.846%0.45547%0.468SS..Hα-helixtrans-63.8-44.7175.500000111.3T355 Q356 M361 K362 D363T355-A359 PolarHBondContact O-N 2.72Å; Q356-A359 PolarHBondContact O-N 3.06Å; A359-M361 PolarHBondContact O-N 2.92Å; A359-K362 VanDerWaalsContact O-CB 3.31Å; A359-K362 WeakPolarHBondContact O-CB 3.4Å; A359-K362 PolarHBondContact O-N 3.47Å; A359-K362 VanDerWaalsContact O-N 3.11Å; A359-D363 PolarHBondContact O-N 3.01Å
360R64.9Low62.5Low62 Ų6299.7 Ų99.723%0.23445%0.451CS..Hα-helixtrans-61.2-42.5176.2-175.4-178.9174.5-154.5-3112.5F347 E352 Q356 K357 K362 R364F347-R360 VanDerWaalsContact CB-CZ 3.45Å; F347-R360 PolarHBondContact O-NH1 3.48Å; E352-R360 WeakPolarHBondContact OE1-CD 3.25Å; Q356-R360 WeakPolarHBondContact O-CB 3.26Å; Q356-R360 PolarHBondContact O-N 3.47Å; K357-R360 PolarHBondContact O-N 3.3Å; R360-K362 VanDerWaalsContact C-N 3.27Å; R360-K362 PolarHBondContact O-N 3.19Å; R360-R364 WeakPolarHBondContact O-CG 3.07Å
361M62.6Low64.2Low63 Ų6395.9 Ų95.931%0.3144%0.443SS..Hα-helixtrans-74-18.7177.3-66.3-155.69600113.1K357 K358 A359K357-M361 VanDerWaalsContact O-CG 3.32Å; K357-M361 WeakPolarHBondContact O-CG 3.48Å; K357-M361 PolarHBondContact O-N 3.03Å; K358-M361 PolarHBondContact O-N 3.06Å; A359-M361 PolarHBondContact O-N 2.92Å
362K64.3Low65.9Low90 Ų9087 Ų8739%0.39140%0.404SS..Hα-helixtrans-68-40.2177-168.6-179177.3-175.60111.5K298 K358 A359 R360K298-K362 PolarHBondContact NZ-O 3.37Å; K358-K362 WeakPolarHBondContact O-CB 3.32Å; K358-K362 PolarHBondContact O-N 3.36Å; A359-K362 VanDerWaalsContact O-CB 3.31Å; A359-K362 WeakPolarHBondContact O-CB 3.4Å; A359-K362 PolarHBondContact O-N 3.47Å; A359-K362 VanDerWaalsContact O-N 3.11Å; R360-K362 VanDerWaalsContact C-N 3.27Å; R360-K362 PolarHBondContact O-N 3.19Å
363D64.3Low67.5Low41 Ų4190.7 Ų90.722%0.21942%0.415CS..SBendtrans-96.72.5-173.4-62.9-23.9000113.6R291 A359R291-D363 IonicContact NE-OD1 3.81Å; R291-D363 IonicContact NH2-OD2 3.55Å; A359-D363 PolarHBondContact O-N 3.01Å
364R70.9Confident68.6Low57 Ų5783 Ų8322%0.21539%0.386CS..  trans-73.2135.4174.2-79.4-173.9-163.9-1609.8112.2K298 R360K298-R364 WeakPolarHBondContact CE-O 3.34Å; R360-R364 WeakPolarHBondContact O-CG 3.07Å
365I70.2Confident70Confident4 Ų481.8 Ų81.82%0.02138%0.384CS..SBendtrans-69.1-42.1173.1-49.7176.5000110.2L290 L294 L297 W335 E338L290-I365 HydrophobicContact CD1-CD1 4.07Å; L290-I365 HydrophobicContact CD1-CG1 4.18Å; L294-I365 HydrophobicContact CD1-CG1 4.32Å; L297-I365 HydrophobicContact CB-CG2 3.75Å; L297-I365 HydrophobicContact CD1-CG2 4.25Å; W335-I365 HydrophobicContact CZ3-CD1 4.21Å; E338-I365 HydrophobicContact CB-CD1 4.21Å
366F72.3Confident71.3Confident7 Ų781.9 Ų81.93%0.03138%0.377CS..  trans-119.1139.2-179.2-31.5-61.9000112.5N301 I306 V339 C342N301-F366 WeakPolarHBondContact OD1-CD1 3.28Å; I306-F366 HydrophobicContact CD1-CD1 3.31Å; I306-F366 HydrophobicContact CD1-CE1 3.26Å; I306-F366 HydrophobicContact CD1-CG 4Å; I306-F366 HydrophobicContact CD1-CZ 3.92Å; I306-F366 HydrophobicContact CG1-CD1 4.12Å; I306-F366 HydrophobicContact CG1-CE1 3.52Å; I306-F366 HydrophobicContact CG1-CZ 3.95Å; I306-F366 HydrophobicContact CG2-CZ 4.21Å; V339-F366 HydrophobicContact CB-CE2 4.23Å; V339-F366 HydrophobicContact CB-CZ 4.23Å; V339-F366 HydrophobicContact CG1-CE2 3.78Å; V339-F366 HydrophobicContact CG1-CZ 3.77Å; V339-F366 HydrophobicContact CG2-CE2 4.43Å; V339-F366 HydrophobicContact CG2-CZ 3.99Å; C342-F366 HydrophobicContact CB-CD2 3.44Å; C342-F366 VanDerWaalsContact CB-CD2 3.44Å; C342-F366 HydrophobicContact CB-CE2 3.68Å; C342-F366 HydrophobicContact CB-CG 4.48Å
367M63.4Low72.6Confident106 Ų10677.7 Ų77.752%0.52236%0.358SS..SBendtrans-85.9-28.4179.2-64.9-67.7-76.300112.9
368N67Low73.8Confident128 Ų12873.2 Ų73.268%0.68434%0.339SS*.SBendtrans-122.9146.3-175.8-65.7-28.8000110.6
369R73.7Confident75Confident135 Ų13568.2 Ų68.251%0.50933%0.325SS..  trans-68.7141.7173.2-166.9-178.4-175.8-159.7-3.1110.1N343N343-R369 WeakPolarHBondContact OD1-CA 3.42Å; N343-R369 VanDerWaalsContact OD1-CG 3.23Å; N343-R369 WeakPolarHBondContact OD1-CG 3.21Å
370I79.1Confident76.2Confident21 Ų2166.9 Ų66.911%0.10831%0.314CS..  trans-119.3140.3-178.9-57.8172.6000108.7P303 I306 N343 L372P303-I370 HydrophobicContact CB-CD1 4.49Å; P303-I370 HydrophobicContact CB-CG2 3.79Å; I306-I370 HydrophobicContact CB-CD1 4.38Å; I306-I370 HydrophobicContact CD1-CD1 3.15Å; I306-I370 HydrophobicContact CG1-CD1 4.33Å; I306-I370 HydrophobicContact CG2-CD1 4.46Å; N343-I370 PolarHBondContact ND2-O 3.08Å; N343-I370 PolarHBondContact OD1-N 3.24Å; N343-I370 PolarHBondContact OD1-O 2.81Å; I370-L372 PolarHBondContact O-N 3.12Å
371Q81.8Confident77.2Confident134 Ų13464 Ų6463%0.62630%0.303SS*.  trans-73.3112.2173.4-179.3165.130.800109.4H307 E401H307-Q371 PolarHBondContact CE1-O 2.98Å; H307-Q371 PolarHBondContact NE2-O 3.34Å; Q371-E401 WeakPolarHBondContact CG-OE1 3.43Å; Q371-E401 PolarHBondContact NE2-OE1 2.9Å; Q371-E401 PolarHBondContact NE2-OE2 2.94Å; Q371-E401 VanDerWaalsContact NE2-OE2 3.12Å
372L82.7Confident78.3Confident8 Ų863.2 Ų63.24%0.04230%0.3CS..  trans-86.8150.2-179.2-66.5178.8000112.1L310 L340 N343 I370 W374 L377L310-L372 HydrophobicContact CD1-CD1 4.48Å; L310-L372 HydrophobicContact CD1-CD2 3.9Å; L340-L372 HydrophobicContact CD2-CD1 3.95Å; N343-L372 HydrophobicContact CB-CD1 4.37Å; N343-L372 VanDerWaalsContact ND2-CD1 3.25Å; N343-L372 WeakPolarHBondContact ND2-CD1 3.34Å; N343-L372 VanDerWaalsContact ND2-CG 3.33Å; N343-L372 WeakPolarHBondContact ND2-CG 3.22Å; I370-L372 PolarHBondContact O-N 3.12Å; L372-W374 HydrophobicContact CB-CD2 3.91Å; L372-W374 HydrophobicContact CB-CE3 4.08Å; L372-W374 HydrophobicContact CB-CH2 4.03Å; L372-W374 HydrophobicContact CB-CZ2 3.82Å; L372-W374 HydrophobicContact CB-CZ3 4.15Å; L372-W374 HydrophobicContact CD1-CE3 4.45Å; L372-W374 HydrophobicContact CD1-CH2 3.66Å; L372-W374 HydrophobicContact CD1-CZ2 4.22Å; L372-W374 HydrophobicContact CD1-CZ3 3.78Å; L372-W374 HydrophobicContact CG-CH2 4.22Å; L372-W374 HydrophobicContact CG-CZ2 4.29Å; L372-W374 PolarHBondContact O-N 3.24Å; L372-W374 PolarHBondContact O-NE1 3.32Å; L372-L377 HydrophobicContact CB-CD1 3.81Å; L372-L377 HydrophobicContact CD1-CD1 4.04Å; L372-L377 HydrophobicContact CD2-CD1 4.47Å; L372-L377 HydrophobicContact CG-CD1 4.32Å
373R85.6Confident79.2Confident135 Ų13563.5 Ų63.551%0.50931%0.306SS..  trans-80.969.2173.2-63.4-174.9-173.6167.60.7110Q375 Q376 L377R373-Q375 VanDerWaalsContact C-N 3.29Å; R373-Q375 PolarHBondContact O-N 2.97Å; R373-Q375 VanDerWaalsContact O-N 3.13Å; R373-Q376 HydrophobicContact CB-CB 4.25Å; R373-Q376 HydrophobicContact CB-CG 4.47Å; R373-Q376 PolarHBondContact O-N 2.81Å; R373-L377 PolarHBondContact O-N 3.25Å; R373-L377 VanDerWaalsContact O-N 3.08Å
374W84.5Confident80Confident20 Ų2061.6 Ų61.68%0.07630%0.295CS..Hα-helixtrans-52.8-38.6-167.6-56.9107.3000115.1L372 L377 L378 I396 D399 M400L372-W374 HydrophobicContact CB-CD2 3.91Å; L372-W374 HydrophobicContact CB-CE3 4.08Å; L372-W374 HydrophobicContact CB-CH2 4.03Å; L372-W374 HydrophobicContact CB-CZ2 3.82Å; L372-W374 HydrophobicContact CB-CZ3 4.15Å; L372-W374 HydrophobicContact CD1-CE3 4.45Å; L372-W374 HydrophobicContact CD1-CH2 3.66Å; L372-W374 HydrophobicContact CD1-CZ2 4.22Å; L372-W374 HydrophobicContact CD1-CZ3 3.78Å; L372-W374 HydrophobicContact CG-CH2 4.22Å; L372-W374 HydrophobicContact CG-CZ2 4.29Å; L372-W374 PolarHBondContact O-N 3.24Å; L372-W374 PolarHBondContact O-NE1 3.32Å; W374-L377 PolarHBondContact O-N 3.28Å; W374-L378 VanDerWaalsContact O-CB 3.28Å; W374-L378 WeakPolarHBondContact O-CB 3.04Å; W374-L378 PolarHBondContact O-N 3.42Å; W374-I396 HydrophobicContact CE3-CG2 4.27Å; W374-D399 HydrophobicContact CH2-CB 3.62Å; W374-D399 HydrophobicContact CZ2-CB 4.39Å; W374-D399 VanDerWaalsContact CZ2-O 3.25Å; W374-D399 WeakPolarHBondContact CZ2-O 3.49Å; W374-D399 HydrophobicContact CZ3-CB 4.12Å; W374-M400 HydrophobicContact CB-CE 4.35Å; W374-M400 HydrophobicContact CB-CG 3.73Å; W374-M400 HydrophobicContact CD2-CG 3.99Å; W374-M400 HydrophobicContact CE3-CG 3.99Å; W374-M400 HydrophobicContact CG-CG 3.9Å
375Q85.6Confident80.4Confident165 Ų16560.9 Ų60.977%0.77130%0.298SS*.Hα-helixtrans-65.4-41178.1-69.8-178.9-13.500112.6R373 L378 S379R373-Q375 VanDerWaalsContact C-N 3.29Å; R373-Q375 PolarHBondContact O-N 2.97Å; R373-Q375 VanDerWaalsContact O-N 3.13Å; Q375-L378 PolarHBondContact O-N 3.16Å; Q375-S379 PolarHBondContact O-N 2.84Å; Q375-S379 PolarHBondContact O-OG 3.41Å
376Q86.1Confident80.9Confident106 Ų10661.1 Ų61.150%0.49530%0.3SS..Hα-helixtrans-70.2-37.3178-67.2179.6-13.300111.2R373 S379 A380R373-Q376 HydrophobicContact CB-CB 4.25Å; R373-Q376 HydrophobicContact CB-CG 4.47Å; R373-Q376 PolarHBondContact O-N 2.81Å; Q376-S379 WeakPolarHBondContact CA-OG 3.37Å; Q376-S379 PolarHBondContact O-OG 3.31Å; Q376-A380 WeakPolarHBondContact O-CB 3.46Å; Q376-A380 PolarHBondContact O-N 3.05Å
377L85.1Confident81.1Confident12 Ų1262.9 Ų62.96%0.06332%0.321CS..Hα-helixtrans-67.7-40.3174.8-66.4174.5000111.8L310 F314 L372 R373 W374 A380 C381 I396L310-L377 HydrophobicContact CB-CD2 3.91Å; L310-L377 HydrophobicContact CD1-CD1 4.28Å; L310-L377 HydrophobicContact CD1-CD2 4.13Å; F314-L377 HydrophobicContact CD2-CD2 4.32Å; F314-L377 HydrophobicContact CE2-CD2 4.05Å; L372-L377 HydrophobicContact CB-CD1 3.81Å; L372-L377 HydrophobicContact CD1-CD1 4.04Å; L372-L377 HydrophobicContact CD2-CD1 4.47Å; L372-L377 HydrophobicContact CG-CD1 4.32Å; R373-L377 PolarHBondContact O-N 3.25Å; R373-L377 VanDerWaalsContact O-N 3.08Å; W374-L377 PolarHBondContact O-N 3.28Å; L377-A380 PolarHBondContact O-N 3.32Å; L377-C381 WeakPolarHBondContact O-CB 3.42Å; L377-C381 PolarHBondContact O-N 3.09Å; L377-I396 HydrophobicContact CB-CD1 4.25Å
378L85.9Confident81.9Confident26 Ų2658.7 Ų58.714%0.13630%0.301CS..Hα-helixtrans-61.7-47.4175.9-178.167.3000110.9W374 Q375 C381 L382 L393 I396 L397 L404 L412W374-L378 VanDerWaalsContact O-CB 3.28Å; W374-L378 WeakPolarHBondContact O-CB 3.04Å; W374-L378 PolarHBondContact O-N 3.42Å; Q375-L378 PolarHBondContact O-N 3.16Å; L378-C381 PolarHBondContact O-N 2.94Å; L378-L382 HydrophobicContact CD1-CD1 4.36Å; L378-L382 HydrophobicContact CG-CD1 4.25Å; L378-L382 VanDerWaalsContact O-CG 3.28Å; L378-L382 WeakPolarHBondContact O-CG 3.38Å; L378-L382 PolarHBondContact O-N 3.06Å; L378-L382 VanDerWaalsContact O-N 3.13Å; L378-L393 HydrophobicContact CD1-CD1 3.28Å; L378-I396 HydrophobicContact CB-CG2 4.47Å; L378-L397 HydrophobicContact CD1-CD2 4.33Å; L378-L404 HydrophobicContact CD2-CD1 4.15Å; L378-L412 HydrophobicContact CD1-CD2 4.25Å
379S86.1Confident82.7Confident57 Ų5752.7 Ų52.740%0.39927%0.27SS..Hα-helixtrans-63.5-45.9176.156.80000111.8Q375 Q376 C381 L382 D383Q375-S379 PolarHBondContact O-N 2.84Å; Q375-S379 PolarHBondContact O-OG 3.41Å; Q376-S379 WeakPolarHBondContact CA-OG 3.37Å; Q376-S379 PolarHBondContact O-OG 3.31Å; S379-C381 VanDerWaalsContact C-N 3.32Å; S379-C381 PolarHBondContact O-N 3.02Å; S379-L382 PolarHBondContact O-N 3.46Å; S379-D383 WeakPolarHBondContact O-CB 3.49Å; S379-D383 VanDerWaalsContact O-CG 3.3Å; S379-D383 PolarHBondContact O-N 3.44Å
380A84.9Confident83.1Confident27 Ų2747.4 Ų47.422%0.22325%0.253CS..Hα-helixtrans-62.8-37.9-179.800000112.5F314 Q376 L377 D383 A384F314-A380 HydrophobicContact CB-CB 3.84Å; F314-A380 HydrophobicContact CD2-CB 4.24Å; F314-A380 HydrophobicContact CG-CB 4.04Å; Q376-A380 WeakPolarHBondContact O-CB 3.46Å; Q376-A380 PolarHBondContact O-N 3.05Å; L377-A380 PolarHBondContact O-N 3.32Å; A380-D383 PolarHBondContact O-N 2.81Å; A380-A384 PolarHBondContact O-N 3.46Å
381C86.2Confident83.2Confident1 Ų147.3 Ų47.31%0.00725%0.252CS..Hα-helixtrans-67.9-36.6176.3-174.50000112.5F314 L377 L378 S379 I396F314-C381 HydrophobicContact CD1-CB 4.3Å; F314-C381 HydrophobicContact CE1-CB 3.69Å; F314-C381 HydrophobicContact CZ-CB 4.07Å; L377-C381 WeakPolarHBondContact O-CB 3.42Å; L377-C381 PolarHBondContact O-N 3.09Å; L378-C381 PolarHBondContact O-N 2.94Å; S379-C381 VanDerWaalsContact C-N 3.32Å; S379-C381 PolarHBondContact O-N 3.02Å; C381-I396 HydrophobicContact CB-CD1 3.87Å
382L84.9Confident83.4Confident48 Ų4841 Ų4125%0.25122%0.222SC..Hα-helixtrans-75.4-30.5176.5-68172.6000112.5L378 S379 A384 L393 L412L378-L382 HydrophobicContact CD1-CD1 4.36Å; L378-L382 HydrophobicContact CG-CD1 4.25Å; L378-L382 VanDerWaalsContact O-CG 3.28Å; L378-L382 WeakPolarHBondContact O-CG 3.38Å; L378-L382 PolarHBondContact O-N 3.06Å; L378-L382 VanDerWaalsContact O-N 3.13Å; S379-L382 PolarHBondContact O-N 3.46Å; L382-A384 PolarHBondContact O-N 3Å; L382-L393 HydrophobicContact CD2-CD2 4.34Å; L382-L412 HydrophobicContact CD1-CD1 4.21Å; L382-L412 HydrophobicContact CD1-CD2 4.5Å; L382-L412 HydrophobicContact CD2-CD1 4.2Å; L382-L412 HydrophobicContact CD2-CD2 4.48Å; L382-L412 HydrophobicContact CD2-CG 4.4Å
383D83.7Confident83.5Confident96 Ų9640.6 Ų40.651%0.51322%0.22SC..SBendtrans-74.3-11.3176.6-76.3-21.1000113.7S379 A380S379-D383 WeakPolarHBondContact O-CB 3.49Å; S379-D383 VanDerWaalsContact O-CG 3.3Å; S379-D383 PolarHBondContact O-N 3.44Å; A380-D383 PolarHBondContact O-N 2.81Å
384A81.6Confident83.5Confident0 Ų037.2 Ų37.20%021%0.21CC..SBendtrans-125.172.5-179.500000111.8L317 K318 A380 L382 C386 T389L317-A384 HydrophobicContact CB-CB 4.31Å; L317-A384 HydrophobicContact CD2-CB 4.12Å; L317-A384 HydrophobicContact CG-CB 4.24Å; K318-A384 HydrophobicContact CB-CB 3.93Å; A380-A384 PolarHBondContact O-N 3.46Å; L382-A384 PolarHBondContact O-N 3Å; A384-C386 PolarHBondContact O-N 3.2Å; A384-T389 PolarHBondContact O-OG1 3.03Å
385P79.3Confident83.4Confident42 Ų4237.2 Ų37.227%0.27321%0.211SC..  trans-73.5117.3-176.728.6-33.5000112.3Y419 T420P385-Y419 HydrophobicContact CB-CD1 3.63Å; P385-Y419 HydrophobicContact CB-CE1 3.49Å; P385-Y419 VanDerWaalsContact CB-CE1 3.49Å; P385-Y419 HydrophobicContact CG-CD1 4.18Å; P385-Y419 HydrophobicContact CG-CE1 3.5Å; P385-Y419 VanDerWaalsContact CG-CE1 3.5Å; P385-T420 HydrophobicContact CB-CG2 4.31Å
386C79.1Confident83.4Confident9 Ų929.3 Ų29.36%0.06118%0.175CC..  trans-136.2170175.272.80000111L317 T321 V329 A384 S388 T389 T420L317-C386 HydrophobicContact CD1-CB 4.45Å; T321-C386 HydrophobicContact CG2-CB 3.61Å; V329-C386 HydrophobicContact CG1-CB 3.76Å; A384-C386 PolarHBondContact O-N 3.2Å; C386-S388 PolarHBondContact O-N 3.44Å; C386-T389 PolarHBondContact N-OG1 3.44Å; C386-T389 WeakPolarHBondContact O-CB 3.43Å; C386-T389 PolarHBondContact O-N 3.33Å; C386-T389 PolarHBondContact O-OG1 3.3Å; C386-T389 PolarHBondContact SG-OG1 2.93Å; C386-T389 VanDerWaalsContact SG-OG1 3.39Å; C386-T420 VanDerWaalsContact O-CG2 3.22Å; C386-T420 WeakPolarHBondContact O-CG2 3.28Å
387G76.1Confident83.2Confident45 Ų4524.6 Ų24.646%0.46415%0.153SC..THydrogen-bonded Turntrans-55.1-27.3179.200000114.2T422G387-T422 PolarHBondContact O-OG1 3.3Å
388S80.1Confident83Confident17 Ų1726.9 Ų26.912%0.11917%0.165CC..THydrogen-bonded Turntrans-90-7.9178.7-52.80000114.8S333 C386 P390 H391 L392S333-S388 PolarHBondContact OG-OG 2.98Å; S333-S388 VanDerWaalsContact OG-OG 3.08Å; C386-S388 PolarHBondContact O-N 3.44Å; S388-P390 VanDerWaalsContact C-CD 3.45Å; S388-H391 WeakPolarHBondContact O-CB 3.14Å; S388-H391 PolarHBondContact O-N 2.8Å; S388-H391 VanDerWaalsContact O-N 3.1Å; S388-L392 PolarHBondContact O-N 3.47Å
389T84.6Confident82.6Confident3 Ų326.2 Ų26.22%0.01816%0.162CC..Hα-helixtrans-55.7-41.5-178.5-61.80000113.2A384 C386 H391 L392 L393A384-T389 PolarHBondContact O-OG1 3.03Å; C386-T389 PolarHBondContact N-OG1 3.44Å; C386-T389 WeakPolarHBondContact O-CB 3.43Å; C386-T389 PolarHBondContact O-N 3.33Å; C386-T389 PolarHBondContact O-OG1 3.3Å; C386-T389 PolarHBondContact SG-OG1 2.93Å; C386-T389 VanDerWaalsContact SG-OG1 3.39Å; T389-H391 VanDerWaalsContact C-N 3.27Å; T389-H391 PolarHBondContact O-N 3.11Å; T389-L392 PolarHBondContact O-N 2.88Å; T389-L393 WeakPolarHBondContact O-CB 3.43Å; T389-L393 PolarHBondContact O-N 3.31Å
390P82Confident82.3Confident24 Ų2424.7 Ų24.716%0.15615%0.148CC..Hα-helixtrans-58.7-37.5177-24.935.3000113.3S388 Q394 L413 C416S388-P390 VanDerWaalsContact C-CD 3.45Å; P390-Q394 WeakPolarHBondContact O-CB 3.33Å; P390-Q394 PolarHBondContact O-N 3.04Å; P390-L413 WeakPolarHBondContact O-CD2 3.49Å; P390-C416 HydrophobicContact CG-CB 4.48Å
391H82.3Confident81.8Confident19 Ų1927.6 Ų27.69%0.08816%0.157CC..Hα-helixtrans-72.4-46.6177.8175.277.9000112.2S281 S337 S388 T389 L393 Q394 L395S281-H391 WeakPolarHBondContact O-CB 3.27Å; S337-H391 PolarHBondContact OG-NE2 3.49Å; S388-H391 WeakPolarHBondContact O-CB 3.14Å; S388-H391 PolarHBondContact O-N 2.8Å; S388-H391 VanDerWaalsContact O-N 3.1Å; T389-H391 VanDerWaalsContact C-N 3.27Å; T389-H391 PolarHBondContact O-N 3.11Å; H391-L393 VanDerWaalsContact C-N 3.28Å; H391-L393 PolarHBondContact O-N 3.48Å; H391-Q394 WeakPolarHBondContact O-CB 3.23Å; H391-Q394 PolarHBondContact O-N 2.99Å; H391-Q394 VanDerWaalsContact O-N 3.15Å; H391-L395 WeakPolarHBondContact O-CG 3.44Å; H391-L395 PolarHBondContact O-N 3.26Å
392L84.3Confident81.3Confident0 Ų035 Ų350%019%0.192CC..Hα-helixtrans-60.7-40.6176.2-65.6177.5000111.5F314 L317 A336 L340 S388 T389 L395 I396F314-L392 HydrophobicContact CE1-CD1 4.08Å; L317-L392 HydrophobicContact CD2-CD1 4.48Å; A336-L392 HydrophobicContact CB-CD1 4.41Å; A336-L392 HydrophobicContact CB-CD2 4.1Å; L340-L392 HydrophobicContact CD1-CD2 4.29Å; S388-L392 PolarHBondContact O-N 3.47Å; T389-L392 PolarHBondContact O-N 2.88Å; L392-L395 PolarHBondContact O-N 3.47Å; L392-I396 WeakPolarHBondContact O-CG1 3.31Å; L392-I396 PolarHBondContact O-N 3.27Å
393L85.8Confident80.9Confident0 Ų036.8 Ų36.80%021%0.206CC..Hα-helixtrans-63.3-42175.5-179.960.8000111.5L378 L382 T389 H391 I396 L397 L412 L413 C416L378-L393 HydrophobicContact CD1-CD1 3.28Å; L382-L393 HydrophobicContact CD2-CD2 4.34Å; T389-L393 WeakPolarHBondContact O-CB 3.43Å; T389-L393 PolarHBondContact O-N 3.31Å; H391-L393 VanDerWaalsContact C-N 3.28Å; H391-L393 PolarHBondContact O-N 3.48Å; L393-I396 PolarHBondContact O-N 2.89Å; L393-L397 HydrophobicContact CD1-CD1 4.05Å; L393-L397 HydrophobicContact CD1-CG 4.04Å; L393-L397 HydrophobicContact CG-CD1 3.89Å; L393-L397 HydrophobicContact CG-CG 4.31Å; L393-L397 WeakPolarHBondContact O-CB 3.45Å; L393-L397 VanDerWaalsContact O-CG 3.25Å; L393-L397 WeakPolarHBondContact O-CG 3.49Å; L393-L397 PolarHBondContact O-N 3.41Å; L393-L412 HydrophobicContact CD1-CD2 3.76Å; L393-L412 HydrophobicContact CD2-CD2 3.67Å; L393-L412 HydrophobicContact CD2-CG 3.82Å; L393-L412 HydrophobicContact CG-CD2 4.22Å; L393-L413 HydrophobicContact CB-CD2 4.22Å; L393-L413 HydrophobicContact CD2-CD2 3.82Å; L393-L413 HydrophobicContact CD2-CG 4.36Å; L393-L413 HydrophobicContact CG-CD2 3.95Å; L393-C416 HydrophobicContact CD2-CB 4.37Å; L393-C416 VanDerWaalsContact CD2-SG 3.58Å
394Q84.7Confident80.7Confident65 Ų6535.1 Ų35.130%0.30420%0.197SC..Hα-helixtrans-60.4-45.7175.3-175.5177.4-12.100111.5P390 H391 I396 L397 D398 L413P390-Q394 WeakPolarHBondContact O-CB 3.33Å; P390-Q394 PolarHBondContact O-N 3.04Å; H391-Q394 WeakPolarHBondContact O-CB 3.23Å; H391-Q394 PolarHBondContact O-N 2.99Å; H391-Q394 VanDerWaalsContact O-N 3.15Å; Q394-I396 VanDerWaalsContact C-N 3.32Å; Q394-I396 PolarHBondContact O-N 3.37Å; Q394-L397 PolarHBondContact O-N 3.18Å; Q394-D398 WeakPolarHBondContact O-CB 3.3Å; Q394-D398 PolarHBondContact O-N 3.04Å; Q394-L413 HydrophobicContact CB-CD2 4.39Å
395L82.9Confident80.9Confident19 Ų1939.2 Ų39.210%0.09922%0.223CC..Hα-helixtrans-60.3-39.9176.9-67.3177.5000112.5L340 L341 H391 L392 D399L340-L395 HydrophobicContact CB-CB 4.34Å; L340-L395 HydrophobicContact CB-CD1 4.25Å; L340-L395 HydrophobicContact CD1-CB 4.25Å; L341-L395 HydrophobicContact CD2-CD1 4.39Å; L341-L395 HydrophobicContact CD2-CD2 3.58Å; L341-L395 HydrophobicContact CG-CD1 4.06Å; L341-L395 HydrophobicContact CG-CD2 4.17Å; H391-L395 WeakPolarHBondContact O-CG 3.44Å; H391-L395 PolarHBondContact O-N 3.26Å; L392-L395 PolarHBondContact O-N 3.47Å; L395-D399 PolarHBondContact O-N 3.11Å
396I84.8Confident80.8Confident0 Ų044.4 Ų44.40%024%0.244CC..Hα-helixtrans-66.2-52.9177.2-68.4166.5000110.3F314 L340 W374 L377 L378 C381 L392 L393 Q394 D398 D399 M400F314-I396 HydrophobicContact CZ-CD1 4.4Å; L340-I396 HydrophobicContact CD1-CD1 4.44Å; L340-I396 HydrophobicContact CD1-CG1 3.96Å; L340-I396 HydrophobicContact CD2-CG1 4.25Å; W374-I396 HydrophobicContact CE3-CG2 4.27Å; L377-I396 HydrophobicContact CB-CD1 4.25Å; L378-I396 HydrophobicContact CB-CG2 4.47Å; C381-I396 HydrophobicContact CB-CD1 3.87Å; L392-I396 WeakPolarHBondContact O-CG1 3.31Å; L392-I396 PolarHBondContact O-N 3.27Å; L393-I396 PolarHBondContact O-N 2.89Å; Q394-I396 VanDerWaalsContact C-N 3.32Å; Q394-I396 PolarHBondContact O-N 3.37Å; I396-D398 PolarHBondContact O-N 3.38Å; I396-D399 PolarHBondContact O-N 2.97Å; I396-M400 HydrophobicContact CG2-CG 4.22Å; I396-M400 HydrophobicContact CG2-SD 4.05Å; I396-M400 WeakPolarHBondContact O-CG 3.12Å; I396-M400 PolarHBondContact O-N 3.19Å; I396-M400 VanDerWaalsContact O-N 3.08Å
397L83.7Confident80.7Confident6 Ų648.2 Ų48.23%0.03126%0.264CS..Hα-helixtrans-61.8-32.4-177.5-68.2174.8000112.6L378 L393 Q394 M400 L404 Q409 L413L378-L397 HydrophobicContact CD1-CD2 4.33Å; L393-L397 HydrophobicContact CD1-CD1 4.05Å; L393-L397 HydrophobicContact CD1-CG 4.04Å; L393-L397 HydrophobicContact CG-CD1 3.89Å; L393-L397 HydrophobicContact CG-CG 4.31Å; L393-L397 WeakPolarHBondContact O-CB 3.45Å; L393-L397 VanDerWaalsContact O-CG 3.25Å; L393-L397 WeakPolarHBondContact O-CG 3.49Å; L393-L397 PolarHBondContact O-N 3.41Å; Q394-L397 PolarHBondContact O-N 3.18Å; L397-M400 HydrophobicContact CD2-SD 3.89Å; L397-L404 HydrophobicContact CD2-CD1 4.02Å; L397-Q409 HydrophobicContact CD1-CB 4.07Å; L397-Q409 HydrophobicContact CD1-CG 4.15Å; L397-Q409 HydrophobicContact CD2-CG 4.22Å; L397-L413 HydrophobicContact CD1-CG 4.36Å
398D79.6Confident81Confident61 Ų6149.1 Ų49.133%0.32626%0.26SS..Hα-helixtrans-71-33.5-177.9-89.1-16.1000114.4K346 Q394 I396K346-D398 HydrophobicContact CD-CB 4.44Å; K346-D398 WeakPolarHBondContact CE-O 3.34Å; K346-D398 IonicContact NZ-OD1 2.72Å; K346-D398 PolarHBondContact NZ-OD1 2.79Å; K346-D398 IonicContact NZ-OD2 2.81Å; K346-D398 PolarHBondContact NZ-OD2 3.44Å; Q394-D398 WeakPolarHBondContact O-CB 3.3Å; Q394-D398 PolarHBondContact O-N 3.04Å; I396-D398 PolarHBondContact O-N 3.38Å
399D78.3Confident81.1Confident12 Ų1249.9 Ų49.96%0.06426%0.262CS..Hα-helixtrans-108.60.3-177.2-74.8-50.8000113.6S344 N345 W374 L395 I396 E401S344-D399 WeakPolarHBondContact CA-OD2 3.34Å; S344-D399 WeakPolarHBondContact CB-OD2 3.4Å; N345-D399 PolarHBondContact N-OD1 3.02Å; W374-D399 HydrophobicContact CH2-CB 3.62Å; W374-D399 HydrophobicContact CZ2-CB 4.39Å; W374-D399 VanDerWaalsContact CZ2-O 3.25Å; W374-D399 WeakPolarHBondContact CZ2-O 3.49Å; W374-D399 HydrophobicContact CZ3-CB 4.12Å; L395-D399 PolarHBondContact O-N 3.11Å; I396-D399 PolarHBondContact O-N 2.97Å; D399-E401 PolarHBondContact O-N 3.31Å
400M80.1Confident80.9Confident24 Ų2454.5 Ų54.512%0.11828%0.283CS..  trans-56.1129.5175.6-96.817785.500112.4W374 I396 L397 H402W374-M400 HydrophobicContact CB-CE 4.35Å; W374-M400 HydrophobicContact CB-CG 3.73Å; W374-M400 HydrophobicContact CD2-CG 3.99Å; W374-M400 HydrophobicContact CE3-CG 3.99Å; W374-M400 HydrophobicContact CG-CG 3.9Å; I396-M400 HydrophobicContact CG2-CG 4.22Å; I396-M400 HydrophobicContact CG2-SD 4.05Å; I396-M400 WeakPolarHBondContact O-CG 3.12Å; I396-M400 PolarHBondContact O-N 3.19Å; I396-M400 VanDerWaalsContact O-N 3.08Å; L397-M400 HydrophobicContact CD2-SD 3.89Å; M400-H402 VanDerWaalsContact C-N 3.27Å; M400-H402 PolarHBondContact O-N 3.45Å
401E73.5Confident80.8Confident88 Ų8859.4 Ų59.441%0.41130%0.302SS..SBendtrans-60.8-35.7178.2-73.1174.7-173.500112.9Q371 D399Q371-E401 WeakPolarHBondContact CG-OE1 3.43Å; Q371-E401 PolarHBondContact NE2-OE1 2.9Å; Q371-E401 PolarHBondContact NE2-OE2 2.94Å; Q371-E401 VanDerWaalsContact NE2-OE2 3.12Å; D399-E401 PolarHBondContact O-N 3.31Å
402H76.5Confident80.9Confident158 Ų15859.9 Ų59.973%0.73131%0.305SS*.SBendtrans-124.988.2178-6190.9000109M400M400-H402 VanDerWaalsContact C-N 3.27Å; M400-H402 PolarHBondContact O-N 3.45Å
403P75.9Confident80.8Confident85 Ų8561.6 Ų61.655%0.55231%0.314SS*.PPolyproline II helixtrans-68.5144.2-174.526.6-33.6000111.7
404L78.8Confident80.4Confident60 Ų6067.1 Ų67.131%0.31434%0.34SS..PPolyproline II helixtrans-63.8159.1170.4-66.4171.1000110.6L378 L397 Q406 Q409L378-L404 HydrophobicContact CD2-CD1 4.15Å; L397-L404 HydrophobicContact CD2-CD1 4.02Å; L404-Q406 PolarHBondContact O-N 3.42Å; L404-Q409 HydrophobicContact CB-CG 3.86Å; L404-Q409 PolarHBondContact O-NE2 3.39Å
405P85.5Confident80.2Confident86 Ų8668.5 Ų68.556%0.55835%0.349SS*.PPolyproline II helixtrans-52.6139.2172.5-24.533.5000111.5D407 T408 Q409P405-D407 VanDerWaalsContact C-N 3.25Å; P405-D407 PolarHBondContact O-N 2.93Å; P405-T408 WeakPolarHBondContact O-CA 3.31Å; P405-T408 WeakPolarHBondContact O-CB 3.47Å; P405-T408 PolarHBondContact O-N 3.34Å; P405-Q409 PolarHBondContact O-N 3.13Å
406Q78.8Confident80.1Confident151 Ų15167.7 Ų67.771%0.70635%0.345SS*.Hα-helixtrans-55.5-40.2-175.6-72.1-178-4.700112.5L404 T408 Q409 Q410L404-Q406 PolarHBondContact O-N 3.42Å; Q406-T408 VanDerWaalsContact C-N 3.3Å; Q406-T408 PolarHBondContact O-N 3.3Å; Q406-Q409 PolarHBondContact O-N 3.36Å; Q406-Q410 WeakPolarHBondContact O-CG 3.47Å; Q406-Q410 PolarHBondContact O-N 2.8Å
407D77.4Confident79.8Confident89 Ų8968.9 Ų68.948%0.47635%0.353SS..Hα-helixtrans-59.8-39174.6-70.910.4000112.5P405 K411P405-D407 VanDerWaalsContact C-N 3.25Å; P405-D407 PolarHBondContact O-N 2.93Å; D407-K411 WeakPolarHBondContact O-CB 3.5Å; D407-K411 WeakPolarHBondContact O-CD 2.97Å; D407-K411 WeakPolarHBondContact O-CG 3.41Å; D407-K411 PolarHBondContact O-N 2.9Å
408T81.5Confident79.5Confident64 Ų6474.2 Ų74.239%0.39338%0.381SS..Hα-helixtrans-71-40.6178.1-55.70000110.8P405 Q406 K411 L412P405-T408 WeakPolarHBondContact O-CA 3.31Å; P405-T408 WeakPolarHBondContact O-CB 3.47Å; P405-T408 PolarHBondContact O-N 3.34Å; Q406-T408 VanDerWaalsContact C-N 3.3Å; Q406-T408 PolarHBondContact O-N 3.3Å; T408-K411 PolarHBondContact O-N 3.27Å; T408-L412 VanDerWaalsContact O-CB 3.28Å; T408-L412 WeakPolarHBondContact O-CB 3.4Å; T408-L412 PolarHBondContact O-N 3.42Å
409Q81.9Confident79.2Confident33 Ų3372.9 Ų72.915%0.15437%0.371CS..Hα-helixtrans-60.9-46.3175.8-64.2-174.69.200111.4L397 L404 P405 Q406 L412 L413L397-Q409 HydrophobicContact CD1-CB 4.07Å; L397-Q409 HydrophobicContact CD1-CG 4.15Å; L397-Q409 HydrophobicContact CD2-CG 4.22Å; L404-Q409 HydrophobicContact CB-CG 3.86Å; L404-Q409 PolarHBondContact O-NE2 3.39Å; P405-Q409 PolarHBondContact O-N 3.13Å; Q406-Q409 PolarHBondContact O-N 3.36Å; Q409-L412 PolarHBondContact O-N 3.03Å; Q409-L413 WeakPolarHBondContact O-CG 3.39Å; Q409-L413 PolarHBondContact O-N 3.05Å
410Q81.1Confident78.9Confident100 Ų10073.7 Ų73.747%0.46738%0.377SS..Hα-helixtrans-63.5-45.1177.7-71.9179000112Q406 L412 L413 Q414Q406-Q410 WeakPolarHBondContact O-CG 3.47Å; Q406-Q410 PolarHBondContact O-N 2.8Å; Q410-L412 VanDerWaalsContact C-N 3.32Å; Q410-L412 PolarHBondContact O-N 2.95Å; Q410-L413 PolarHBondContact O-N 3.21Å; Q410-Q414 WeakPolarHBondContact O-CB 3.32Å; Q410-Q414 VanDerWaalsContact O-CG 3.26Å; Q410-Q414 WeakPolarHBondContact O-CG 3.45Å; Q410-Q414 PolarHBondContact O-N 2.82Å
411K80.1Confident78.3Confident127 Ų12779.2 Ų79.255%0.55240%0.402SS*.Hα-helixtrans-61.8-40.3176-73.6169.3-173.1172.70111.9D407 T408 Q414 L415D407-K411 WeakPolarHBondContact O-CB 3.5Å; D407-K411 WeakPolarHBondContact O-CD 2.97Å; D407-K411 WeakPolarHBondContact O-CG 3.41Å; D407-K411 PolarHBondContact O-N 2.9Å; T408-K411 PolarHBondContact O-N 3.27Å; K411-Q414 PolarHBondContact O-N 3.43Å; K411-L415 WeakPolarHBondContact O-CB 3.37Å; K411-L415 VanDerWaalsContact O-CG 3.26Å; K411-L415 WeakPolarHBondContact O-CG 3.28Å; K411-L415 PolarHBondContact O-N 2.63Å
412L83.7Confident77.6Confident30 Ų3076.3 Ų76.316%0.15739%0.391CS..Hα-helixtrans-65.5-47.5178.2-168.977.8000111.2L378 L382 L393 T408 Q409 Q410 Q414 L415 C416L378-L412 HydrophobicContact CD1-CD2 4.25Å; L382-L412 HydrophobicContact CD1-CD1 4.21Å; L382-L412 HydrophobicContact CD1-CD2 4.5Å; L382-L412 HydrophobicContact CD2-CD1 4.2Å; L382-L412 HydrophobicContact CD2-CD2 4.48Å; L382-L412 HydrophobicContact CD2-CG 4.4Å; L393-L412 HydrophobicContact CD1-CD2 3.76Å; L393-L412 HydrophobicContact CD2-CD2 3.67Å; L393-L412 HydrophobicContact CD2-CG 3.82Å; L393-L412 HydrophobicContact CG-CD2 4.22Å; T408-L412 VanDerWaalsContact O-CB 3.28Å; T408-L412 WeakPolarHBondContact O-CB 3.4Å; T408-L412 PolarHBondContact O-N 3.42Å; Q409-L412 PolarHBondContact O-N 3.03Å; Q410-L412 VanDerWaalsContact C-N 3.32Å; Q410-L412 PolarHBondContact O-N 2.95Å; L412-Q414 VanDerWaalsContact C-N 3.32Å; L412-Q414 PolarHBondContact O-N 3.16Å; L412-L415 PolarHBondContact O-N 3.16Å; L412-C416 PolarHBondContact O-N 2.9Å; L412-C416 PolarHBondContact O-SG 3.32Å; L412-C416 VanDerWaalsContact O-SG 3.34Å
413L82.3Confident76.3Confident36 Ų3674 Ų7419%0.18839%0.39CS..Hα-helixtrans-60.9-41175.8-72.6167.6000111.7P390 L393 Q394 L397 Q409 Q410 C416 S417P390-L413 WeakPolarHBondContact O-CD2 3.49Å; L393-L413 HydrophobicContact CB-CD2 4.22Å; L393-L413 HydrophobicContact CD2-CD2 3.82Å; L393-L413 HydrophobicContact CD2-CG 4.36Å; L393-L413 HydrophobicContact CG-CD2 3.95Å; Q394-L413 HydrophobicContact CB-CD2 4.39Å; L397-L413 HydrophobicContact CD1-CG 4.36Å; Q409-L413 WeakPolarHBondContact O-CG 3.39Å; Q409-L413 PolarHBondContact O-N 3.05Å; Q410-L413 PolarHBondContact O-N 3.21Å; L413-C416 PolarHBondContact O-N 2.7Å; L413-S417 WeakPolarHBondContact O-CB 3.48Å; L413-S417 PolarHBondContact O-N 3.48Å; L413-S417 PolarHBondContact O-OG 3.03Å
414Q77.8Confident74.7Confident116 Ų11673.3 Ų73.354%0.54239%0.391SS..Hα-helixtrans-62.1-47.7174.4-76.3176.3-2.200111.6Q410 K411 L412 C416 S417 I418Q410-Q414 WeakPolarHBondContact O-CB 3.32Å; Q410-Q414 VanDerWaalsContact O-CG 3.26Å; Q410-Q414 WeakPolarHBondContact O-CG 3.45Å; Q410-Q414 PolarHBondContact O-N 2.82Å; K411-Q414 PolarHBondContact O-N 3.43Å; L412-Q414 VanDerWaalsContact C-N 3.32Å; L412-Q414 PolarHBondContact O-N 3.16Å; Q414-C416 VanDerWaalsContact C-N 3.34Å; Q414-C416 PolarHBondContact O-N 3.38Å; Q414-S417 PolarHBondContact O-N 3.14Å; Q414-S417 PolarHBondContact O-OG 3.3Å; Q414-I418 VanDerWaalsContact O-CG1 3.28Å; Q414-I418 WeakPolarHBondContact O-CG1 3.49Å; Q414-I418 PolarHBondContact O-N 3.17Å
415L79.8Confident72.9Confident93 Ų9374.4 Ų74.449%0.48740%0.4SS..Hα-helixtrans-60.2-43.4176.8-75.5170.3000111.8K411 L412 I418 Y419 L497K411-L415 WeakPolarHBondContact O-CB 3.37Å; K411-L415 VanDerWaalsContact O-CG 3.26Å; K411-L415 WeakPolarHBondContact O-CG 3.28Å; K411-L415 PolarHBondContact O-N 2.63Å; L412-L415 PolarHBondContact O-N 3.16Å; L415-I418 PolarHBondContact O-N 3.24Å; L415-Y419 VanDerWaalsContact O-CB 3.29Å; L415-Y419 WeakPolarHBondContact O-CB 3.42Å; L415-Y419 PolarHBondContact O-N 2.81Å; L415-L497 HydrophobicContact CB-CD2 4.3Å
416C80.7Confident70.5Confident3 Ų379.3 Ų79.32%0.0242%0.416CS..Hα-helixtrans-61.1-46.3175-70.30000111.4P390 L393 L412 L413 Q414 I418 Y419 T420P390-C416 HydrophobicContact CG-CB 4.48Å; L393-C416 HydrophobicContact CD2-CB 4.37Å; L393-C416 VanDerWaalsContact CD2-SG 3.58Å; L412-C416 PolarHBondContact O-N 2.9Å; L412-C416 PolarHBondContact O-SG 3.32Å; L412-C416 VanDerWaalsContact O-SG 3.34Å; L413-C416 PolarHBondContact O-N 2.7Å; Q414-C416 VanDerWaalsContact C-N 3.34Å; Q414-C416 PolarHBondContact O-N 3.38Å; C416-I418 VanDerWaalsContact C-N 3.32Å; C416-I418 PolarHBondContact O-N 3.48Å; C416-Y419 PolarHBondContact O-N 3.4Å; C416-Y419 VanDerWaalsContact O-N 3.12Å; C416-T420 WeakPolarHBondContact O-CG2 3.38Å; C416-T420 PolarHBondContact O-N 3.28Å; C416-T420 PolarHBondContact O-OG1 3.22Å
417S78.8Confident68.3Low24 Ų2478.6 Ų78.617%0.16841%0.41CS..Hα-helixtrans-62.1-37.717970.60000113.3L413 Q414 Q421 T422L413-S417 WeakPolarHBondContact O-CB 3.48Å; L413-S417 PolarHBondContact O-N 3.48Å; L413-S417 PolarHBondContact O-OG 3.03Å; Q414-S417 PolarHBondContact O-N 3.14Å; Q414-S417 PolarHBondContact O-OG 3.3Å; S417-Q421 PolarHBondContact O-N 3.25Å; S417-Q421 VanDerWaalsContact O-N 3.11Å; S417-T422 PolarHBondContact O-N 3.42Å
418I77Confident66.1Low119 Ų11979.8 Ų79.861%0.6143%0.425SS*.Hα-helixtrans-65.4-44.4174.1-68165000110.1Q414 L415 C416 Q421Q414-I418 VanDerWaalsContact O-CG1 3.28Å; Q414-I418 WeakPolarHBondContact O-CG1 3.49Å; Q414-I418 PolarHBondContact O-N 3.17Å; L415-I418 PolarHBondContact O-N 3.24Å; C416-I418 VanDerWaalsContact C-N 3.32Å; C416-I418 PolarHBondContact O-N 3.48Å; I418-Q421 PolarHBondContact O-N 2.92Å
419Y73.4Confident63.6Low32 Ų3284 Ų8413%0.12545%0.445CS..Hα-helixtrans-68.6-40.5-176.1-168.3-91.4000112.6P385 L415 C416 Q421 W492 K493 F495 L497P385-Y419 HydrophobicContact CB-CD1 3.63Å; P385-Y419 HydrophobicContact CB-CE1 3.49Å; P385-Y419 VanDerWaalsContact CB-CE1 3.49Å; P385-Y419 HydrophobicContact CG-CD1 4.18Å; P385-Y419 HydrophobicContact CG-CE1 3.5Å; P385-Y419 VanDerWaalsContact CG-CE1 3.5Å; L415-Y419 VanDerWaalsContact O-CB 3.29Å; L415-Y419 WeakPolarHBondContact O-CB 3.42Å; L415-Y419 PolarHBondContact O-N 2.81Å; C416-Y419 PolarHBondContact O-N 3.4Å; C416-Y419 VanDerWaalsContact O-N 3.12Å; Y419-Q421 VanDerWaalsContact C-N 3.33Å; Y419-W492 VanDerWaalsContact CE2-O 3.28Å; Y419-W492 WeakPolarHBondContact CE2-O 3.27Å; Y419-W492 PolarHBondContact OH-O 3.05Å; Y419-K493 PolarHBondContact OH-O 3.16Å; Y419-K493 VanDerWaalsContact OH-O 3.12Å; Y419-F495 WeakPolarHBondContact CE2-O 3.47Å; Y419-F495 PolarHBondContact OH-O 2.93Å; Y419-L497 HydrophobicContact CD1-CD1 3.96Å; Y419-L497 HydrophobicContact CD2-CD1 3.82Å; Y419-L497 HydrophobicContact CD2-CG 4.25Å; Y419-L497 HydrophobicContact CE2-CD1 4.38Å; Y419-L497 HydrophobicContact CG-CD1 3.57Å; Y419-L497 HydrophobicContact CG-CG 4.46Å
420T72.4Confident61.1Low29 Ų2987.7 Ų87.718%0.17847%0.472CS..Hα-helixtrans-87.5-2.7-179.259.50000113P385 C386 C416 T422P385-T420 HydrophobicContact CB-CG2 4.31Å; C386-T420 VanDerWaalsContact O-CG2 3.22Å; C386-T420 WeakPolarHBondContact O-CG2 3.28Å; C416-T420 WeakPolarHBondContact O-CG2 3.38Å; C416-T420 PolarHBondContact O-N 3.28Å; C416-T420 PolarHBondContact O-OG1 3.22Å; T420-T422 WeakPolarHBondContact CB-OG1 3.37Å; T420-T422 PolarHBondContact O-N 3.17Å; T420-T422 VanDerWaalsContact O-N 3.08Å; T420-T422 PolarHBondContact OG1-OG1 3.24Å
421Q66.7Low59Low140 Ų14094.1 Ų94.165%0.65449%0.492SS*.THydrogen-bonded Turntrans54.123.1-177.1-56.3-178.15.300113.7S417 I418 Y419S417-Q421 PolarHBondContact O-N 3.25Å; S417-Q421 VanDerWaalsContact O-N 3.11Å; I418-Q421 PolarHBondContact O-N 2.92Å; Y419-Q421 VanDerWaalsContact C-N 3.33Å
422T58.6Low56.9Low28 Ų2895.3 Ų95.317%0.17250%0.504CS..PPolyproline II helixtrans-74.3133.1176.7-31.60000108G387 S417 T420 A424G387-T422 PolarHBondContact O-OG1 3.3Å; S417-T422 PolarHBondContact O-N 3.42Å; T420-T422 WeakPolarHBondContact CB-OG1 3.37Å; T420-T422 PolarHBondContact O-N 3.17Å; T420-T422 VanDerWaalsContact O-N 3.08Å; T420-T422 PolarHBondContact OG1-OG1 3.24Å; T422-A424 PolarHBondContact O-N 3.36Å; T422-A424 VanDerWaalsContact O-N 3.08Å
423P50.9Low54.6Low109 Ų109101.7 Ų101.771%0.70853%0.533SS*.PPolyproline II helixtrans-55.6123.1173.821.9-31.2000108.2V425P423-V425 PolarHBondContact O-N 2.91Å; P423-V425 VanDerWaalsContact O-N 3.09Å
424A41.3Very low52.3Low70 Ų70109.5 Ų109.558%0.57957%0.565SS**PPolyproline II helixtrans-51.8122179.100000108.4T422 E426T422-A424 PolarHBondContact O-N 3.36Å; T422-A424 VanDerWaalsContact O-N 3.08Å; A424-E426 PolarHBondContact O-N 3.36Å
425V41.4Very low50.3Low84 Ų84112.3 Ų112.351%0.50958%0.578SS.*PPolyproline II helixtrans-51.9118.7160.4176.90000104.8P423 F427P423-V425 PolarHBondContact O-N 2.91Å; P423-V425 VanDerWaalsContact O-N 3.09Å; V425-F427 HydrophobicContact CB-CD2 4.16Å; V425-F427 HydrophobicContact CB-CE2 3.88Å; V425-F427 HydrophobicContact CG1-CD2 4.24Å; V425-F427 HydrophobicContact CG1-CE2 3.94Å; V425-F427 HydrophobicContact CG1-CZ 4.3Å; V425-F427 VanDerWaalsContact O-CD2 3.31Å; V425-F427 WeakPolarHBondContact O-CD2 3.45Å; V425-F427 PolarHBondContact O-N 2.91Å
426E34.2Very low48.1Very low189 Ų189116.5 Ų116.588%0.88360%0.596SS**  trans-60.985.4178.9-74.1-174.8157.300109A424 S428A424-E426 PolarHBondContact O-N 3.36Å; E426-S428 PolarHBondContact O-N 3.27Å
427F32.8Very low46.3Very low136 Ų136120.3 Ų120.360%0.59662%0.62SS**  trans-74.2100.2166.9-78.4-79.7000106.6V425 L429V425-F427 HydrophobicContact CB-CD2 4.16Å; V425-F427 HydrophobicContact CB-CE2 3.88Å; V425-F427 HydrophobicContact CG1-CD2 4.24Å; V425-F427 HydrophobicContact CG1-CE2 3.94Å; V425-F427 HydrophobicContact CG1-CZ 4.3Å; V425-F427 VanDerWaalsContact O-CD2 3.31Å; V425-F427 WeakPolarHBondContact O-CD2 3.45Å; V425-F427 PolarHBondContact O-N 2.91Å; F427-L429 PolarHBondContact O-N 2.81Å
428S30.7Very low44.4Very low113 Ų113126.9 Ų126.979%0.7965%0.652SS**  trans-50.9106.4164.249.70000109.1E426E426-S428 PolarHBondContact O-N 3.27Å
429L29.1Very low42.7Very low153 Ų153127.3 Ų127.380%0.80165%0.646SS**  trans-47.1131.1170.3-74.5151.6000110F427 R431F427-L429 PolarHBondContact O-N 2.81Å; L429-R431 PolarHBondContact O-N 2.97Å
430P30.2Very low42Very low111 Ų111129.4 Ų129.472%0.72166%0.663SS**  trans-59123.2154.7-14.228.1000107.2D432P430-D432 PolarHBondContact O-N 3.41Å
431R37.9Very low40.5Very low235 Ų235134.9 Ų134.989%0.88769%0.69SS**SBendtrans-66.516.1-163.9-155178.4-179.1-176.41116.3L429L429-R431 PolarHBondContact O-N 2.97Å
432D35.4Very low39.8Very low151 Ų151135.3 Ų135.381%0.80769%0.692SS**  trans-128.944-165.9-84.6-28.2000115.2P430P430-D432 PolarHBondContact O-N 3.41Å
433Q34.4Very low39.2Very low164 Ų164135.7 Ų135.777%0.76670%0.696SS**  trans-138.681.6147.1-67.3-171.613.200109H435Q433-H435 VanDerWaalsContact C-N 3.33Å; Q433-H435 PolarHBondContact O-N 3.38Å
434K34.9Very low39.2Very low200 Ų200134.9 Ų134.987%0.8769%0.685SS**  trans-54.1106155.9-76.5177.3179.7171.80106.5Q436K434-Q436 PolarHBondContact O-N 2.96Å
435H35.9Very low39.7Very low176 Ų176137 Ų13782%0.81568%0.683SS**  trans-43.8115.2157.6-77.7-81.1000107Q433 P437Q433-H435 VanDerWaalsContact C-N 3.33Å; Q433-H435 PolarHBondContact O-N 3.38Å; H435-P437 WeakPolarHBondContact O-CD 3.44Å; H435-P437 VanDerWaalsContact O-N 3.17Å
436Q34.1Very low40.2Very low181 Ų181138 Ų13885%0.84668%0.682SS**  trans-63.4112.6160.4-73.9-172.4-600105.4K434 I438K434-Q436 PolarHBondContact O-N 2.96Å; Q436-I438 PolarHBondContact O-N 3.03Å
437P41.7Very low41Very low83 Ų83133.7 Ų133.754%0.53966%0.661SS.*  trans-72.4132.9172.529-24.3000107H435 Y439H435-P437 WeakPolarHBondContact O-CD 3.44Å; H435-P437 VanDerWaalsContact O-N 3.17Å; P437-Y439 WeakPolarHBondContact O-CD2 3.32Å; P437-Y439 PolarHBondContact O-N 3.38Å
438I39.9Very low41.7Very low162 Ų162136.2 Ų136.283%0.83167%0.666SS**  trans-58.1118.7171.8-62.7166.6000107.2Q436 T440Q436-I438 PolarHBondContact O-N 3.03Å; I438-T440 PolarHBondContact O-N 3.41Å
439Y40.9Very low42.6Very low127 Ų127138.3 Ų138.350%0.49866%0.657SS.*  trans-82.7111.5179.5-75.2-87.2000110.1P437 S443 L444 K447P437-Y439 WeakPolarHBondContact O-CD2 3.32Å; P437-Y439 PolarHBondContact O-N 3.38Å; Y439-S443 WeakPolarHBondContact CA-OG 3.44Å; Y439-L444 HydrophobicContact CD1-CD1 4.47Å; Y439-L444 HydrophobicContact CD1-CG 4.06Å; Y439-K447 HydrophobicContact CE1-CD 4.23Å; Y439-K447 PolarHBondContact OH-NZ 3.09Å
440T57.6Low43.4Very low77 Ų77136 Ų13647%0.47264%0.642SS.*  trans-83.9155157.659.90000109.6I438 E442 S443 L444I438-T440 PolarHBondContact O-N 3.41Å; T440-E442 PolarHBondContact O-N 2.92Å; T440-E442 VanDerWaalsContact O-N 3.12Å; T440-S443 PolarHBondContact N-OG 3.14Å; T440-S443 WeakPolarHBondContact O-CB 3.28Å; T440-S443 PolarHBondContact O-N 3.4Å; T440-S443 PolarHBondContact O-OG 3.37Å; T440-S443 PolarHBondContact OG1-N 3.16Å; T440-L444 PolarHBondContact O-N 3.13Å
441L42.5Very low44.1Very low143 Ų143138.1 Ų138.175%0.74964%0.642SS**Hα-helixtrans-54.6-32.7178.2-81.7163.4000112.6L444 H445L441-L444 PolarHBondContact O-N 3.38Å; L441-H445 PolarHBondContact O-CD2 2.86Å; L441-H445 VanDerWaalsContact O-CD2 3.28Å; L441-H445 PolarHBondContact O-N 2.79Å
442E51.4Low44.5Very low149 Ų149134.1 Ų134.170%0.69664%0.638SS**Hα-helixtrans-66.8-40.5175-71.9167.7157.200112.4T440 L444 H445 E446T440-E442 PolarHBondContact O-N 2.92Å; T440-E442 VanDerWaalsContact O-N 3.12Å; E442-L444 VanDerWaalsContact C-N 3.28Å; E442-L444 PolarHBondContact O-N 3.41Å; E442-H445 PolarHBondContact O-N 2.86Å; E442-H445 VanDerWaalsContact O-N 3.14Å; E442-E446 WeakPolarHBondContact O-CB 3.4Å; E442-E446 PolarHBondContact O-N 2.92Å
443S46.4Very low44.8Very low36 Ų36136.9 Ų136.925%0.25264%0.637SS.*Hα-helixtrans-64.9-29.8176.8710000113Y439 T440 K447Y439-S443 WeakPolarHBondContact CA-OG 3.44Å; T440-S443 PolarHBondContact N-OG 3.14Å; T440-S443 WeakPolarHBondContact O-CB 3.28Å; T440-S443 PolarHBondContact O-N 3.4Å; T440-S443 PolarHBondContact O-OG 3.37Å; T440-S443 PolarHBondContact OG1-N 3.16Å; S443-K447 WeakPolarHBondContact O-CB 3.44Å; S443-K447 PolarHBondContact O-N 3.42Å
444L50.7Low45Very low93 Ų93137.2 Ų137.249%0.48764%0.638SS.*Hα-helixtrans-72.3-39172.1-105157.7000112.2Y439 T440 L441 E442 E446 R448Y439-L444 HydrophobicContact CD1-CD1 4.47Å; Y439-L444 HydrophobicContact CD1-CG 4.06Å; T440-L444 PolarHBondContact O-N 3.13Å; L441-L444 PolarHBondContact O-N 3.38Å; E442-L444 VanDerWaalsContact C-N 3.28Å; E442-L444 PolarHBondContact O-N 3.41Å; L444-E446 VanDerWaalsContact C-N 3.35Å; L444-R448 PolarHBondContact O-N 3.13Å; L444-R448 VanDerWaalsContact O-N 3.11Å
445H51.1Low44.9Very low113 Ų113133 Ų13352%0.52363%0.634SS.*Hα-helixtrans-69.9-33.2175.9-79.3-145.2000112.2L441 E442 R449L441-H445 PolarHBondContact O-CD2 2.86Å; L441-H445 VanDerWaalsContact O-CD2 3.28Å; L441-H445 PolarHBondContact O-N 2.79Å; E442-H445 PolarHBondContact O-N 2.86Å; E442-H445 VanDerWaalsContact O-N 3.14Å; H445-R449 PolarHBondContact O-N 3.3Å; H445-R449 PolarHBondContact O-NE 3.18Å
446E53.3Low44.6Very low107 Ų107128.1 Ų128.150%0.563%0.631SS.*Hα-helixtrans-73-39.1175.8-163.8152.3-137.300111.8E442 L444 R448 R449 Q450E442-E446 WeakPolarHBondContact O-CB 3.4Å; E442-E446 PolarHBondContact O-N 2.92Å; L444-E446 VanDerWaalsContact C-N 3.35Å; E446-R448 VanDerWaalsContact C-N 3.32Å; E446-R448 PolarHBondContact O-N 3.37Å; E446-R449 CarbonylContact O-C 3.23Å; E446-R449 PolarHBondContact O-N 3.1Å; E446-R449 VanDerWaalsContact O-N 3.07Å; E446-Q450 WeakPolarHBondContact O-CG 3.42Å; E446-Q450 PolarHBondContact O-N 2.65Å
447K49.2Very low44.4Very low98 Ų98128.8 Ų128.843%0.42663%0.634SS.*Hα-helixtrans-63-37.4172.6-148.6174-169-177.50112.6Y439 S443 R449 Q450 Q451Y439-K447 HydrophobicContact CE1-CD 4.23Å; Y439-K447 PolarHBondContact OH-NZ 3.09Å; S443-K447 WeakPolarHBondContact O-CB 3.44Å; S443-K447 PolarHBondContact O-N 3.42Å; K447-R449 VanDerWaalsContact C-N 3.32Å; K447-R449 PolarHBondContact O-N 3.49Å; K447-Q450 PolarHBondContact O-N 3.06Å; K447-Q451 WeakPolarHBondContact O-CG 3.32Å; K447-Q451 PolarHBondContact O-N 3.46Å; K447-Q451 VanDerWaalsContact O-N 3.1Å
448R48.1Very low43.9Very low189 Ų189136.7 Ų136.771%0.71365%0.653SS**Hα-helixtrans-65.4-34172.5-164.7-178-130.9-175.33.5112.3L444 E446L444-R448 PolarHBondContact O-N 3.13Å; L444-R448 VanDerWaalsContact O-N 3.11Å; E446-R448 VanDerWaalsContact C-N 3.32Å; E446-R448 PolarHBondContact O-N 3.37Å
449R49.3Very low43.4Very low156 Ų156134.9 Ų134.959%0.58966%0.655SS**Hα-helixtrans-76.6-33.8175.7-79.2-177.8-78.8-160.82.4113.1H445 E446 K447 L452H445-R449 PolarHBondContact O-N 3.3Å; H445-R449 PolarHBondContact O-NE 3.18Å; E446-R449 CarbonylContact O-C 3.23Å; E446-R449 PolarHBondContact O-N 3.1Å; E446-R449 VanDerWaalsContact O-N 3.07Å; K447-R449 VanDerWaalsContact C-N 3.32Å; K447-R449 PolarHBondContact O-N 3.49Å; R449-L452 PolarHBondContact O-N 3.09Å
450Q45.9Very low43Very low105 Ų105137.3 Ų137.349%0.49167%0.671SS.*Hα-helixtrans-73.6-31.6177.8-73.7176-300112.7E446 K447 L452 R453E446-Q450 WeakPolarHBondContact O-CG 3.42Å; E446-Q450 PolarHBondContact O-N 2.65Å; K447-Q450 PolarHBondContact O-N 3.06Å; Q450-L452 PolarHBondContact O-N 2.97Å; Q450-R453 PolarHBondContact O-N 3.17Å
451Q45.8Very low41.7Very low155 Ų155138.5 Ų138.572%0.72468%0.682SS**THydrogen-bonded Turntrans-62.2-20.9172.2-79.1-179.5-21.200113.8K447K447-Q451 WeakPolarHBondContact O-CG 3.32Å; K447-Q451 PolarHBondContact O-N 3.46Å; K447-Q451 VanDerWaalsContact O-N 3.1Å
452L45.8Very low41.3Very low152 Ų152134.2 Ų134.280%0.79666%0.664SS**THydrogen-bonded Turntrans-89.2-5175.3-90.4131.1000114R449 Q450R449-L452 PolarHBondContact O-N 3.09Å; Q450-L452 PolarHBondContact O-N 2.97Å
453R42.8Very low40.9Very low208 Ų208129.6 Ų129.679%0.78566%0.657SS**  trans-118.77.6-171.8-71.7-170.3174.2-168.2-1.7115.2Q450 S455Q450-R453 PolarHBondContact O-N 3.17Å; R453-S455 VanDerWaalsContact C-N 3.35Å; R453-S455 PolarHBondContact O-N 3.01Å
454H37.1Very low40.7Very low171 Ų171134.2 Ų134.279%0.79268%0.678SS**  trans-81.678.7176.4-77.5-21.6000112.3
455S33.1Very low40.2Very low112 Ų112135 Ų13578%0.78368%0.682SS**  trans-156118.6152.959.70000110.6R453R453-S455 VanDerWaalsContact C-N 3.35Å; R453-S455 PolarHBondContact O-N 3.01Å
456G29.4Very low40.1Very low73 Ų73134.4 Ų134.475%0.75368%0.68SS**  trans87.9139.4177.500000113.9
457E30.5Very low39.8Very low196 Ų196138 Ų13892%0.91669%0.689SS**  cis-168.9156.8-19.1-123.9174-172.400104.9
458R32.1Very low39.9Very low248 Ų248139.2 Ų139.294%0.93670%0.698SS**  trans-77.5147.3178.5-68.6169.2169.1175.6-6.1111.2
459S28.4Very low40.2Very low124 Ų124134.8 Ų134.887%0.86769%0.688SS**  trans-166.6146130.2-153.20000113.3
460E33.3Very low40.9Very low178 Ų178130.4 Ų130.483%0.83268%0.679SS**  trans-78.4146.3-179.4-63169.6151.800112.9
461S30.1Very low41.6Very low102 Ų102128.6 Ų128.671%0.71367%0.672SS**  trans167.3152.2130.351.20000111.7
462S34.7Very low42.3Very low53 Ų53124.2 Ų124.237%0.37166%0.656SS.*  trans94.285.9164.6-160.50000117.7D464 L465 Q466S462-D464 PolarHBondContact O-N 2.7Å; S462-L465 PolarHBondContact O-N 3.2Å; S462-L465 WeakPolarHBondContact OG-CB 3.21Å; S462-L465 VanDerWaalsContact OG-CD1 3.24Å; S462-L465 WeakPolarHBondContact OG-CD1 3.38Å; S462-Q466 VanDerWaalsContact O-CB 3.23Å; S462-Q466 WeakPolarHBondContact O-CB 3.48Å; S462-Q466 WeakPolarHBondContact O-CG 3.23Å; S462-Q466 PolarHBondContact O-N 3.3Å; S462-Q466 PolarHBondContact O-OE1 3.43Å
463G41.6Very low43.4Very low53 Ų53123.1 Ų123.155%0.54665%0.647SS.*Hα-helixtrans-62.9-19.7177.800000115.8
464D41.7Very low44.7Very low132 Ų132119 Ų11971%0.70663%0.634SS**Hα-helixtrans-96.4-30.2177.6-78.4-33.7000113.5S462S462-D464 PolarHBondContact O-N 2.7Å
465L41.8Very low46.1Very low109 Ų109113 Ų11357%0.57162%0.615SS**Hα-helixtrans-71.8-38.2167.1-84.5137.2000110.8S462 R467 M468 D469S462-L465 PolarHBondContact O-N 3.2Å; S462-L465 WeakPolarHBondContact OG-CB 3.21Å; S462-L465 VanDerWaalsContact OG-CD1 3.24Å; S462-L465 WeakPolarHBondContact OG-CD1 3.38Å; L465-R467 VanDerWaalsContact C-N 3.33Å; L465-R467 PolarHBondContact O-N 2.99Å; L465-M468 PolarHBondContact O-N 3.37Å; L465-D469 WeakPolarHBondContact O-CB 3.35Å; L465-D469 PolarHBondContact O-N 2.95Å
466Q48.3Very low48Very low102 Ų102113.8 Ų113.848%0.47760%0.604SS.*Hα-helixtrans-60.8-37.8176.7-79.7167.5-12.800112.8S462 D469 V470S462-Q466 VanDerWaalsContact O-CB 3.23Å; S462-Q466 WeakPolarHBondContact O-CB 3.48Å; S462-Q466 WeakPolarHBondContact O-CG 3.23Å; S462-Q466 PolarHBondContact O-N 3.3Å; S462-Q466 PolarHBondContact O-OE1 3.43Å; Q466-D469 PolarHBondContact O-N 3.48Å; Q466-V470 WeakPolarHBondContact O-CB 3.46Å; Q466-V470 WeakPolarHBondContact O-CG2 3.22Å; Q466-V470 PolarHBondContact O-N 3.41Å
467R46.9Very low49.9Very low182 Ų182116 Ų11669%0.68760%0.603SS**Hα-helixtrans-67-41.7178.4-147.1-179.3-1391532111L465 L471L465-R467 VanDerWaalsContact C-N 3.33Å; L465-R467 PolarHBondContact O-N 2.99Å; R467-L471 WeakPolarHBondContact O-CB 3.4Å; R467-L471 WeakPolarHBondContact O-CD1 3.49Å; R467-L471 WeakPolarHBondContact O-CG 3.2Å; R467-L471 PolarHBondContact O-N 3.38Å
468M50.8Low51.5Low123 Ų123109.4 Ų109.461%0.60657%0.574SS**Hα-helixtrans-68.9-42.1176.5-159.167.969.400111.4L465 L471 T472L465-M468 PolarHBondContact O-N 3.37Å; M468-L471 PolarHBondContact O-N 2.89Å; M468-T472 VanDerWaalsContact O-CB 3.27Å; M468-T472 WeakPolarHBondContact O-CB 3.41Å; M468-T472 PolarHBondContact O-N 3.45Å; M468-T472 PolarHBondContact O-OG1 3.03Å
469D55.7Low52.6Low97 Ų97106.9 Ų106.952%0.51956%0.564SS.*Hα-helixtrans-65.4-42.2177.8-75.8-26.3000111.6L465 Q466 T472 E473L465-D469 WeakPolarHBondContact O-CB 3.35Å; L465-D469 PolarHBondContact O-N 2.95Å; Q466-D469 PolarHBondContact O-N 3.48Å; D469-T472 PolarHBondContact O-N 3.44Å; D469-E473 VanDerWaalsContact O-CB 3.27Å; D469-E473 WeakPolarHBondContact O-CB 3.49Å; D469-E473 PolarHBondContact O-N 3.13Å
470V62.6Low54.1Low63 Ų63105.1 Ų105.138%0.38257%0.565SS.*Hα-helixtrans-66.7-40176170.90000111.5Q466 T472 K474Q466-V470 WeakPolarHBondContact O-CB 3.46Å; Q466-V470 WeakPolarHBondContact O-CG2 3.22Å; Q466-V470 PolarHBondContact O-N 3.41Å; V470-T472 VanDerWaalsContact C-N 3.34Å; V470-K474 HydrophobicContact CG1-CD 4.11Å; V470-K474 WeakPolarHBondContact O-CB 3.49Å; V470-K474 VanDerWaalsContact O-CG 3.26Å; V470-K474 WeakPolarHBondContact O-CG 3.32Å; V470-K474 PolarHBondContact O-N 3.43Å
471L61.9Low55.6Low67 Ų6798.9 Ų98.935%0.35154%0.541SS..Hα-helixtrans-66.9-38.1174.5-69.5168.3000111.1R467 M468 A475 V485R467-L471 WeakPolarHBondContact O-CB 3.4Å; R467-L471 WeakPolarHBondContact O-CD1 3.49Å; R467-L471 WeakPolarHBondContact O-CG 3.2Å; R467-L471 PolarHBondContact O-N 3.38Å; M468-L471 PolarHBondContact O-N 2.89Å; L471-A475 VanDerWaalsContact O-CB 3.22Å; L471-A475 WeakPolarHBondContact O-CB 3.39Å; L471-A475 PolarHBondContact O-N 2.94Å; L471-V485 HydrophobicContact CD2-CG1 3.39Å
472T60.8Low56.6Low63 Ų6399.2 Ų99.239%0.38754%0.541SS..Hα-helixtrans-70.5-36.8178.6-52.80000111.7M468 D469 V470 K476M468-T472 VanDerWaalsContact O-CB 3.27Å; M468-T472 WeakPolarHBondContact O-CB 3.41Å; M468-T472 PolarHBondContact O-N 3.45Å; M468-T472 PolarHBondContact O-OG1 3.03Å; D469-T472 PolarHBondContact O-N 3.44Å; V470-T472 VanDerWaalsContact C-N 3.34Å; T472-K476 VanDerWaalsContact O-CG 3.31Å; T472-K476 WeakPolarHBondContact O-CG 3.35Å; T472-K476 PolarHBondContact O-N 3.05Å
473E68.7Low57.5Low130 Ų130105.5 Ų105.561%0.60756%0.557SS**Hα-helixtrans-69.9-45.3174.9-166.9170.9-159.900111.2D469 A475 K476 V477D469-E473 VanDerWaalsContact O-CB 3.27Å; D469-E473 WeakPolarHBondContact O-CB 3.49Å; D469-E473 PolarHBondContact O-N 3.13Å; E473-A475 VanDerWaalsContact C-N 3.33Å; E473-A475 PolarHBondContact O-N 3.1Å; E473-K476 WeakPolarHBondContact O-CB 3.31Å; E473-K476 PolarHBondContact O-N 3.29Å; E473-K476 VanDerWaalsContact O-N 3.09Å; E473-V477 WeakPolarHBondContact O-CG2 3.42Å; E473-V477 PolarHBondContact O-N 3.05Å
474K68.8Low58.7Low120 Ų120111.6 Ų111.652%0.52257%0.571SS.*Hα-helixtrans-61.1-39.6172.4-74177.7177.8-178.90112.2V470 K476 V477 L478 V485V470-K474 HydrophobicContact CG1-CD 4.11Å; V470-K474 WeakPolarHBondContact O-CB 3.49Å; V470-K474 VanDerWaalsContact O-CG 3.26Å; V470-K474 WeakPolarHBondContact O-CG 3.32Å; V470-K474 PolarHBondContact O-N 3.43Å; K474-K476 VanDerWaalsContact C-N 3.3Å; K474-K476 PolarHBondContact O-N 3.3Å; K474-V477 PolarHBondContact O-N 2.87Å; K474-L478 WeakPolarHBondContact O-CB 3.47Å; K474-L478 VanDerWaalsContact O-CG 3.3Å; K474-L478 WeakPolarHBondContact O-CG 3.45Å; K474-L478 PolarHBondContact O-N 3.33Å; K474-V485 HydrophobicContact CB-CG2 3.84Å
475A67.9Low60Low47 Ų47106.9 Ų106.939%0.38855%0.547SS..Hα-helixtrans-67.1-28.4174.900000113L471 E473 V485L471-A475 VanDerWaalsContact O-CB 3.22Å; L471-A475 WeakPolarHBondContact O-CB 3.39Å; L471-A475 PolarHBondContact O-N 2.94Å; E473-A475 VanDerWaalsContact C-N 3.33Å; E473-A475 PolarHBondContact O-N 3.1Å; A475-V485 HydrophobicContact CB-CG2 4.18Å
476K71.8Confident60.8Low127 Ų127105.7 Ų105.755%0.55255%0.547SS*.Hα-helixtrans-71.8-39.7171.2-75.8169.5-176.91730112T472 E473 K474 L478 R479T472-K476 VanDerWaalsContact O-CG 3.31Å; T472-K476 WeakPolarHBondContact O-CG 3.35Å; T472-K476 PolarHBondContact O-N 3.05Å; E473-K476 WeakPolarHBondContact O-CB 3.31Å; E473-K476 PolarHBondContact O-N 3.29Å; E473-K476 VanDerWaalsContact O-N 3.09Å; K474-K476 VanDerWaalsContact C-N 3.3Å; K474-K476 PolarHBondContact O-N 3.3Å; K476-L478 VanDerWaalsContact C-N 3.34Å; K476-R479 VanDerWaalsContact O-CB 3.23Å; K476-R479 WeakPolarHBondContact O-CB 3.36Å; K476-R479 PolarHBondContact O-N 2.97Å
477V70.7Confident61.4Low120 Ų120105.8 Ų105.873%0.72756%0.559SS**Hα-helixtrans-67.2-36.2177.8173.70000111.8E473 K474 R479E473-V477 WeakPolarHBondContact O-CG2 3.42Å; E473-V477 PolarHBondContact O-N 3.05Å; K474-V477 PolarHBondContact O-N 2.87Å; V477-R479 PolarHBondContact O-N 3.48Å
478L62.4Low62.2Low57 Ų57102.7 Ų102.730%0.29856%0.556SS.*THydrogen-bonded Turntrans-81.90.8-180-67.1173.1000113.8K474 K476 G480 S481 W483 V485K474-L478 WeakPolarHBondContact O-CB 3.47Å; K474-L478 VanDerWaalsContact O-CG 3.3Å; K474-L478 WeakPolarHBondContact O-CG 3.45Å; K474-L478 PolarHBondContact O-N 3.33Å; K476-L478 VanDerWaalsContact C-N 3.34Å; L478-G480 PolarHBondContact O-N 3.4Å; L478-G480 VanDerWaalsContact O-N 3.13Å; L478-S481 WeakPolarHBondContact O-CB 3.45Å; L478-S481 PolarHBondContact O-N 3Å; L478-S481 PolarHBondContact O-OG 3.14Å; L478-S481 VanDerWaalsContact O-OG 3.05Å; L478-W483 WeakPolarHBondContact CB-O 3.38Å; L478-W483 HydrophobicContact CD2-CB 4.29Å; L478-V485 HydrophobicContact CD1-CG2 3.67Å
479R55.8Low62.6Low196 Ų196106.7 Ų106.774%0.7457%0.57SS**THydrogen-bonded Turntrans-69.4109.7-176.6-153.1-173.1-69.4-139.10.1109.8K476 V477K476-R479 VanDerWaalsContact O-CB 3.23Å; K476-R479 WeakPolarHBondContact O-CB 3.36Å; K476-R479 PolarHBondContact O-N 2.97Å; V477-R479 PolarHBondContact O-N 3.48Å
480G60.5Low63Low86 Ų86103.7 Ų103.789%0.88756%0.555SS**THydrogen-bonded Turntrans101.9-5.8-174.100000114.5L478L478-G480 PolarHBondContact O-N 3.4Å; L478-G480 VanDerWaalsContact O-N 3.13Å
481S65.2Low63.1Low47 Ų47105.4 Ų105.433%0.32956%0.561SS.*SBendtrans-89.2157.4168.190.80000110.6L478 W483L478-S481 WeakPolarHBondContact O-CB 3.45Å; L478-S481 PolarHBondContact O-N 3Å; L478-S481 PolarHBondContact O-OG 3.14Å; L478-S481 VanDerWaalsContact O-OG 3.05Å; S481-W483 PolarHBondContact O-N 3.35Å; S481-W483 PolarHBondContact OG-N 2.94Å; S481-W483 VanDerWaalsContact OG-N 3.16Å; S481-W483 PolarHBondContact OG-O 3.46Å; S481-W483 VanDerWaalsContact OG-O 3.13Å
482P49.9Very low63.3Low109 Ų109106.9 Ų106.971%0.70856%0.562SS**SBendtrans-70.3-5.2173.729.5-34.2000113.3
483W54.1Low63Low186 Ų186109.4 Ų109.471%0.70557%0.568SS**  trans-99.8140.2-177.3-60.497.8000111.2L478 S481L478-W483 WeakPolarHBondContact CB-O 3.38Å; L478-W483 HydrophobicContact CD2-CB 4.29Å; S481-W483 PolarHBondContact O-N 3.35Å; S481-W483 PolarHBondContact OG-N 2.94Å; S481-W483 VanDerWaalsContact OG-N 3.16Å; S481-W483 PolarHBondContact OG-O 3.46Å; S481-W483 VanDerWaalsContact OG-O 3.13Å
484Q66.6Low62.6Low180 Ų180108.4 Ų108.484%0.84157%0.567SS**  trans-125.3149.8175.5-172.8174.34.800110.5C486Q484-C486 PolarHBondContact O-N 3.29Å
485V68.4Low62.3Low33 Ų33105.9 Ų105.920%0.256%0.556CS.*  trans-68.2118.3172.3-174.50000109.2L471 K474 A475 L478 S487L471-V485 HydrophobicContact CD2-CG1 3.39Å; K474-V485 HydrophobicContact CB-CG2 3.84Å; A475-V485 HydrophobicContact CB-CG2 4.18Å; L478-V485 HydrophobicContact CD1-CG2 3.67Å; V485-S487 PolarHBondContact O-N 2.88Å
486C59.5Low62Low84 Ų84107.6 Ų107.657%0.56856%0.563SS**  trans-72.4115174.2-175.70000109.8Q484Q484-C486 PolarHBondContact O-N 3.29Å
487S60.8Low60.9Low104 Ų104105 Ų10573%0.72756%0.555SS**  trans-91.2-1.6175.448.50000113.2V485V485-S487 PolarHBondContact O-N 2.88Å
488D62.5Low60.2Low118 Ų118102.8 Ų102.863%0.63156%0.557SS**SBendtrans-74.8136.3-172.1-59.4-19.1000110.5V490D488-V490 HydrophobicContact CB-CG2 4.15Å; D488-V490 PolarHBondContact O-N 3.02Å
489K60.5Low60.1Low207 Ų207104.3 Ų104.390%0.956%0.561SS**  trans-75.776.1172.8-69-174.1-179.9-1780109.4L491K489-L491 PolarHBondContact O-N 3.49Å
490V64.1Low60.5Low34 Ų3498.6 Ų98.621%0.20655%0.548CS..  trans-73.8122.1177.51780000109.9D488 W492 F495 P501D488-V490 HydrophobicContact CB-CG2 4.15Å; D488-V490 PolarHBondContact O-N 3.02Å; V490-W492 VanDerWaalsContact C-N 3.32Å; V490-W492 HydrophobicContact CB-CZ2 4.42Å; V490-W492 HydrophobicContact CG1-CD2 3.86Å; V490-W492 HydrophobicContact CG1-CE3 4.41Å; V490-W492 HydrophobicContact CG1-CG 4.09Å; V490-W492 HydrophobicContact CG1-CZ2 4.16Å; V490-W492 VanDerWaalsContact O-CD1 3.24Å; V490-W492 PolarHBondContact O-N 3.45Å; V490-F495 HydrophobicContact CG1-CE2 4.35Å; V490-P501 HydrophobicContact CB-CG 4.46Å; V490-P501 HydrophobicContact CG1-CB 4.42Å; V490-P501 HydrophobicContact CG1-CG 3.32Å; V490-P501 HydrophobicContact CG2-CG 4.32Å
491L63.8Low60.4Low99 Ų9996.9 Ų96.952%0.51852%0.521SS..  trans-79.879.8170.7-67.4172.6000109.9K489 K493 N494K489-L491 PolarHBondContact O-N 3.49Å; L491-K493 HydrophobicContact CB-CG 4.33Å; L491-K493 PolarHBondContact O-N 3.45Å; L491-N494 PolarHBondContact O-N 3.37Å
492W65.8Low60.3Low98 Ų9898.6 Ų98.637%0.37155%0.546SS..G310 helixtrans-54.6-26.5-176.6-70.698.8000114.5Y419 V490 N494 F495 V500 P501Y419-W492 VanDerWaalsContact CE2-O 3.28Å; Y419-W492 WeakPolarHBondContact CE2-O 3.27Å; Y419-W492 PolarHBondContact OH-O 3.05Å; V490-W492 VanDerWaalsContact C-N 3.32Å; V490-W492 HydrophobicContact CB-CZ2 4.42Å; V490-W492 HydrophobicContact CG1-CD2 3.86Å; V490-W492 HydrophobicContact CG1-CE3 4.41Å; V490-W492 HydrophobicContact CG1-CG 4.09Å; V490-W492 HydrophobicContact CG1-CZ2 4.16Å; V490-W492 VanDerWaalsContact O-CD1 3.24Å; V490-W492 PolarHBondContact O-N 3.45Å; W492-N494 PolarHBondContact O-N 3.09Å; W492-F495 PolarHBondContact O-N 3.03Å; W492-V500 HydrophobicContact CH2-CB 4.42Å; W492-V500 HydrophobicContact CH2-CG1 4Å; W492-V500 HydrophobicContact CZ3-CB 4.43Å; W492-V500 HydrophobicContact CZ3-CG1 4.05Å; W492-P501 HydrophobicContact CH2-CG 4.23Å; W492-P501 HydrophobicContact CZ3-CG 4.2Å
493K54.5Low60.9Low116 Ų11697.1 Ų97.150%0.50453%0.529SS..G310 helixtrans-52.5-23.3173.663.4172.7-172.7176.70114.8Y419 L491Y419-K493 PolarHBondContact OH-O 3.16Å; Y419-K493 VanDerWaalsContact OH-O 3.12Å; L491-K493 HydrophobicContact CB-CG 4.33Å; L491-K493 PolarHBondContact O-N 3.45Å
494N61.3Low61.1Low109 Ų10991.3 Ų91.358%0.58352%0.517SS*.G310 helixtrans-90.9-0.1-177.3-64.3-13.1000113.7L491 W492L491-N494 PolarHBondContact O-N 3.37Å; W492-N494 PolarHBondContact O-N 3.09Å
495F63.2Low60.9Low66 Ų6689 Ų8929%0.28951%0.511SS..SBendtrans-121.9131-174.5-67.6-83.7000110.5Y419 V490 W492 P501Y419-F495 WeakPolarHBondContact CE2-O 3.47Å; Y419-F495 PolarHBondContact OH-O 2.93Å; V490-F495 HydrophobicContact CG1-CE2 4.35Å; W492-F495 PolarHBondContact O-N 3.03Å; F495-P501 HydrophobicContact CD1-CB 4.45Å; F495-P501 HydrophobicContact CD1-CG 4.46Å; F495-P501 HydrophobicContact CD2-CG 3.97Å; F495-P501 HydrophobicContact CE1-CB 3.89Å; F495-P501 HydrophobicContact CE1-CG 4.29Å; F495-P501 HydrophobicContact CE2-CB 3.97Å; F495-P501 HydrophobicContact CE2-CG 3.77Å; F495-P501 HydrophobicContact CG-CG 4.31Å; F495-P501 HydrophobicContact CZ-CB 3.61Å; F495-P501 HydrophobicContact CZ-CG 3.94Å
496P60.3Low60.4Low83 Ų8391.1 Ų91.154%0.53952%0.521SS..  trans-55.3145.7179.2-22.931.8000112.5G498 K499P496-G498 PolarHBondContact O-N 2.87Å; P496-G498 VanDerWaalsContact O-N 3.15Å; P496-K499 PolarHBondContact O-N 2.82Å
497L49.8Very low60.3Low73 Ų7391.3 Ų91.338%0.38252%0.521SS..THydrogen-bonded Turntrans-56.8121.4178.3-137.5119.7000109.8L415 Y419L415-L497 HydrophobicContact CB-CD2 4.3Å; Y419-L497 HydrophobicContact CD1-CD1 3.96Å; Y419-L497 HydrophobicContact CD2-CD1 3.82Å; Y419-L497 HydrophobicContact CD2-CG 4.25Å; Y419-L497 HydrophobicContact CE2-CD1 4.38Å; Y419-L497 HydrophobicContact CG-CD1 3.57Å; Y419-L497 HydrophobicContact CG-CG 4.46Å
498G55.3Low60.1Low74 Ų7489.7 Ų89.776%0.76351%0.51SS*.THydrogen-bonded Turntrans95.3-2.5-175.300000115.7P496P496-G498 PolarHBondContact O-N 2.87Å; P496-G498 VanDerWaalsContact O-N 3.15Å
499K60.4Low59.6Low88 Ų8887.2 Ų87.238%0.38350%0.502SS..  trans-107.1134.4168.6-68.5-158.4178.8-162.90111.6P496 D505P496-K499 PolarHBondContact O-N 2.82Å; K499-D505 IonicContact NZ-OD1 2.86Å; K499-D505 PolarHBondContact NZ-OD1 3.31Å; K499-D505 IonicContact NZ-OD2 3.63Å
500V63.9Low59.2Low77 Ų7783.8 Ų83.847%0.46749%0.492SS..  trans-93.6150.4171.3-68.50000111.6W492 G502 Q503W492-V500 HydrophobicContact CH2-CB 4.42Å; W492-V500 HydrophobicContact CH2-CG1 4Å; W492-V500 HydrophobicContact CZ3-CB 4.43Å; W492-V500 HydrophobicContact CZ3-CG1 4.05Å; V500-G502 PolarHBondContact O-N 3.46Å; V500-Q503 HydrophobicContact CG2-CB 3.76Å; V500-Q503 HydrophobicContact CG2-CG 4.22Å; V500-Q503 WeakPolarHBondContact O-CB 3.42Å; V500-Q503 PolarHBondContact O-N 3.44Å
501P59.5Low58.5Low49 Ų4987.6 Ų87.632%0.31851%0.509SS..THydrogen-bonded Turntrans-53.7125.7174.4-20.325.2000111.4V490 W492 F495 Q503V490-P501 HydrophobicContact CB-CG 4.46Å; V490-P501 HydrophobicContact CG1-CB 4.42Å; V490-P501 HydrophobicContact CG1-CG 3.32Å; V490-P501 HydrophobicContact CG2-CG 4.32Å; W492-P501 HydrophobicContact CH2-CG 4.23Å; W492-P501 HydrophobicContact CZ3-CG 4.2Å; F495-P501 HydrophobicContact CD1-CB 4.45Å; F495-P501 HydrophobicContact CD1-CG 4.46Å; F495-P501 HydrophobicContact CD2-CG 3.97Å; F495-P501 HydrophobicContact CE1-CB 3.89Å; F495-P501 HydrophobicContact CE1-CG 4.29Å; F495-P501 HydrophobicContact CE2-CB 3.97Å; F495-P501 HydrophobicContact CE2-CG 3.77Å; F495-P501 HydrophobicContact CG-CG 4.31Å; F495-P501 HydrophobicContact CZ-CB 3.61Å; F495-P501 HydrophobicContact CZ-CG 3.94Å; P501-Q503 VanDerWaalsContact C-N 3.33Å
502G62.8Low57.8Low83 Ų8386.3 Ų86.386%0.85651%0.506SS*.THydrogen-bonded Turntrans80.85.3-178.500000115.3V500 S504V500-G502 PolarHBondContact O-N 3.46Å; G502-S504 PolarHBondContact O-N 3.3Å
503Q62Low57Low78 Ų7891.1 Ų91.136%0.36453%0.532SS..  trans-65.6114.7174.3-168.1172.4-6.400110.8V500 P501V500-Q503 HydrophobicContact CG2-CB 3.76Å; V500-Q503 HydrophobicContact CG2-CG 4.22Å; V500-Q503 WeakPolarHBondContact O-CB 3.42Å; V500-Q503 PolarHBondContact O-N 3.44Å; P501-Q503 VanDerWaalsContact C-N 3.33Å
504S57.6Low56.4Low64 Ų6491.5 Ų91.545%0.44855%0.545SS..  trans-70.3140.9169-179.10000109.8G502 D506G502-S504 PolarHBondContact O-N 3.3Å; S504-D506 PolarHBondContact O-N 2.88Å; S504-D506 WeakPolarHBondContact OG-CB 3.28Å; S504-D506 PolarHBondContact OG-N 3.24Å
505D61.9Low55.7Low132 Ų13294.2 Ų94.271%0.70655%0.548SS*.SBendtrans-69.6-5.1172.6-67.6-36.3000112.2K499 P507K499-D505 IonicContact NZ-OD1 2.86Å; K499-D505 PolarHBondContact NZ-OD1 3.31Å; K499-D505 IonicContact NZ-OD2 3.63Å; D505-P507 WeakPolarHBondContact O-CD 3.18Å
506D59.8Low54.5Low77 Ų7796.9 Ų96.941%0.41257%0.574SS.*  trans-79.6114.4172-178.113.2000111.1S504 S508 S509S504-D506 PolarHBondContact O-N 2.88Å; S504-D506 WeakPolarHBondContact OG-CB 3.28Å; S504-D506 PolarHBondContact OG-N 3.24Å; D506-S508 PolarHBondContact O-N 3.43Å; D506-S508 WeakPolarHBondContact OD1-CB 3.23Å; D506-S508 PolarHBondContact OD1-N 3.46Å; D506-S508 VanDerWaalsContact OD1-N 3.08Å; D506-S508 PolarHBondContact OD1-OG 3.48Å; D506-S508 VanDerWaalsContact OD2-CB 3.23Å; D506-S508 WeakPolarHBondContact OD2-CB 3.43Å; D506-S508 PolarHBondContact OD2-OG 3.49Å; D506-S509 WeakPolarHBondContact O-CB 3.47Å; D506-S509 PolarHBondContact O-N 3.11Å; D506-S509 PolarHBondContact O-OG 2.73Å
507P56.3Low53.5Low89 Ų8996.9 Ų96.958%0.57858%0.581SS**G310 helixtrans-62.6-13.617824.6-33.1000113.6D505 S509D505-P507 WeakPolarHBondContact O-CD 3.18Å; P507-S509 PolarHBondContact O-N 2.85Å
508S57Low52.8Low70 Ų70101.9 Ų101.949%0.4961%0.605SS.*G310 helixtrans-61.6-26.5170.7-39.80000112.9D506 L510 M511D506-S508 PolarHBondContact O-N 3.43Å; D506-S508 WeakPolarHBondContact OD1-CB 3.23Å; D506-S508 PolarHBondContact OD1-N 3.46Å; D506-S508 VanDerWaalsContact OD1-N 3.08Å; D506-S508 PolarHBondContact OD1-OG 3.48Å; D506-S508 VanDerWaalsContact OD2-CB 3.23Å; D506-S508 WeakPolarHBondContact OD2-CB 3.43Å; D506-S508 PolarHBondContact OD2-OG 3.49Å; S508-L510 PolarHBondContact O-N 3.02Å; S508-M511 VanDerWaalsContact O-CB 3.31Å; S508-M511 WeakPolarHBondContact O-CB 3.3Å; S508-M511 PolarHBondContact O-N 3.29Å; S508-M511 VanDerWaalsContact O-N 3.08Å
509S51.9Low52.1Low66 Ų66104.5 Ų104.546%0.46261%0.607SS.*G310 helixtrans-69.7-14.3-175.162.90000114.4D506 P507D506-S509 WeakPolarHBondContact O-CB 3.47Å; D506-S509 PolarHBondContact O-N 3.11Å; D506-S509 PolarHBondContact O-OG 2.73Å; P507-S509 PolarHBondContact O-N 2.85Å
510L51.4Low50.8Low134 Ų134106.8 Ų106.870%0.70263%0.628SS**G310 helixtrans-91.4-5.4174.5-62.6174.7000112.9S508 V512S508-L510 PolarHBondContact O-N 3.02Å; L510-V512 PolarHBondContact O-N 3.07Å
511M50Low49.3Very low114 Ų114108.4 Ų108.456%0.56264%0.641SS**  trans-81.8108.3178.2-62.4-88.9-68.600108.8S508 E513 Y515S508-M511 VanDerWaalsContact O-CB 3.31Å; S508-M511 WeakPolarHBondContact O-CB 3.3Å; S508-M511 PolarHBondContact O-N 3.29Å; S508-M511 VanDerWaalsContact O-N 3.08Å; M511-E513 PolarHBondContact O-N 3.16Å; M511-Y515 HydrophobicContact CE-CD1 4.15Å; M511-Y515 HydrophobicContact CE-CE1 3.66Å
512V50.1Low48.2Very low73 Ų73115.3 Ų115.344%0.44267%0.669SS.*  trans-63.9133.1169.2-173.50000108.1L510 T514L510-V512 PolarHBondContact O-N 3.07Å; V512-T514 CarbonylContact O-C 3.56Å; V512-T514 PolarHBondContact O-N 2.91Å
513E47.4Very low46.6Very low198 Ų198119.7 Ų119.793%0.92567%0.667SS**SBendtrans-56.1-19.6-175.4-66.9-167.9162.200113.9M511M511-E513 PolarHBondContact O-N 3.16Å
514T42.2Very low45.2Very low125 Ų125121.9 Ų121.977%0.76769%0.688SS**  trans-116.996.3170.740.60000110.8V512V512-T514 CarbonylContact O-C 3.56Å; V512-T514 PolarHBondContact O-N 2.91Å
515Y46.2Very low44Very low166 Ų166125.1 Ų125.165%0.65171%0.705SS**  trans-106.2130.7159.461.1-86000109M511M511-Y515 HydrophobicContact CE-CD1 4.15Å; M511-Y515 HydrophobicContact CE-CE1 3.66Å
516S37.7Very low42.5Very low121 Ų121128 Ų12885%0.84671%0.714SS**  trans-79.9119.8165.1-85.70000108.2M518S516-M518 PolarHBondContact O-N 2.97Å; S516-M518 VanDerWaalsContact O-N 3.12Å
517A41Very low41.1Very low83 Ų83133 Ų13369%0.68674%0.737SS**  trans-64.4111.9169.300000108.6T519A517-T519 PolarHBondContact O-N 3.35Å; A517-T519 VanDerWaalsContact O-N 3.11Å
518M34.1Very low39.8Very low178 Ų178138 Ų13888%0.87775%0.753SS**  trans-65.4109164.5-94.3-169.1-65.700107.7S516 V520S516-M518 PolarHBondContact O-N 2.97Å; S516-M518 VanDerWaalsContact O-N 3.12Å; M518-V520 PolarHBondContact O-N 2.96Å; M518-V520 VanDerWaalsContact O-N 3.13Å
519T40.8Very low38.4Very low130 Ų130139.9 Ų139.980%0.79877%0.766SS**  trans-62.9111.3160.836.70000107.6A517 C521A517-T519 PolarHBondContact O-N 3.35Å; A517-T519 VanDerWaalsContact O-N 3.11Å; T519-C521 PolarHBondContact O-N 3.14Å
520V33.3Very low37.3Very low136 Ų136142.6 Ų142.682%0.82479%0.785SS**  trans-56.1109.4173177.90000107.3M518 E522M518-V520 PolarHBondContact O-N 2.96Å; M518-V520 VanDerWaalsContact O-N 3.13Å; V520-E522 PolarHBondContact O-N 3.27Å
521C31.4Very low36.2Very low111 Ų111148.3 Ų148.375%0.7580%0.797SS**  trans-60.6132.5169.5-790000108.4T519 Q523T519-C521 PolarHBondContact O-N 3.14Å; C521-Q523 PolarHBondContact O-N 3.31Å; C521-Q523 VanDerWaalsContact O-N 3.11Å
522E36.8Very low35.2Very low194 Ų194146.4 Ų146.491%0.90781%0.806SS**  trans-48.6116178.6-63-162.9154.700111.1V520V520-E522 PolarHBondContact O-N 3.27Å
523Q30.4Very low34.3Very low174 Ų174151.3 Ų151.381%0.81383%0.825SS**  trans-84.5127.4157.7-87.7-178.2-3100107.5C521 V525C521-Q523 PolarHBondContact O-N 3.31Å; C521-Q523 VanDerWaalsContact O-N 3.11Å; Q523-V525 PolarHBondContact O-N 2.68Å
524P32.3Very low33.4Very low125 Ų125149.5 Ų149.581%0.81282%0.821SS**  trans-71.1116.5176.328.6-30.1000108.5E526P524-E526 PolarHBondContact O-N 3.23Å
525V32.7Very low32.8Very low131 Ų131148 Ų14879%0.79482%0.821SS**  trans-79.5115.1169.3178.60000107.4Q523 M527Q523-V525 PolarHBondContact O-N 2.68Å; V525-M527 PolarHBondContact O-N 3.26Å
526E29.7Very low32.2Very low193 Ų193146.3 Ų146.390%0.90283%0.831SS**  trans-63.7112.3168-76-177.415500109.1P524P524-E526 PolarHBondContact O-N 3.23Å
527M31.1Very low31.7Very low183 Ų183144.4 Ų144.490%0.90183%0.83SS**PPolyproline II helixtrans-90.9120.7173.2-124.6-171.9-17800109.4V525V525-M527 PolarHBondContact O-N 3.26Å
528E28.6Very low31.1Very low192 Ų192147.1 Ų147.190%0.89784%0.838SS**PPolyproline II helixtrans-57.8134.8174.3-77.7-177.4148.900112
529S27.8Very low31.4Very low110 Ų110144.7 Ų144.777%0.76984%0.836SS**PPolyproline II helixtrans-68.2128.7-179.755.60000112.9
530S27.4Very low30.6Very low123 Ų123141.7 Ų141.786%0.8683%0.831SS**  trans-135.6101.6145.329.40000109.5
531R28.6Very low31Very low255 Ų255141.8 Ų141.896%0.96283%0.834SS**  trans-75.8133174.9-78.2179168.7-178.9-2.3110.2
532G30Very low30.8Very low73 Ų73140.8 Ų140.875%0.75383%0.834SS**  trans-16359.3170.700000113.6
533Q31.6Very low30.4Very low177 Ų177143 Ų14383%0.82783%0.834SS**  trans52.2115.2147.2-64.3-180-15.600122.5
534N27.4Very low30.7Very low159 Ų159139.8 Ų139.885%0.8584%0.837SS**  47.1137.3128.8-57.2-11.2000120.4
535A30.3Very low30.9Very low93 Ų93138.2 Ų138.277%0.76984%0.835SS**  cis-171.4-158.94.500000108.5
536P33.5Very low31Very low131 Ų131141.1 Ų141.185%0.85184%0.839SS**  -105.7153.3-11434.5-16.1000115.9
537G27.1Very low31.6Very low81 Ų81135.1 Ų135.184%0.83583%0.829SS**  trans178.9105.4168.300000113.4
538V28.8Very low32.5Very low141 Ų141134.2 Ų134.286%0.85583%0.827SS**  trans-109153.4166.91660000105.9
539P39.4Very low33.8Very low126 Ų126132.7 Ų132.782%0.81882%0.824SS**  cis-132162.21317.67.7000115.9
540G25.4Very low34.7Very low68 Ų68134.8 Ų134.870%0.70182%0.815SS**  trans-160.9127.5157.600000110.2
541P40.6Very low36.4Very low137 Ų137132.9 Ų132.989%0.8980%0.795SS**  trans-84.3127-168.433-30.8000110.6
542A26.9Very low37.4Very low90 Ų90127.1 Ų127.174%0.74478%0.779SS**  trans-155.6117.516700000113.1
543R29.7Very low38.6Very low242 Ų242126.7 Ų126.791%0.91377%0.765SS**  trans78100.8146.4-64.3-179.3177164.7-0.1118.3
544A35Very low40.1Very low106 Ų106120.8 Ų120.888%0.87674%0.739SS**  trans-65.9133.8144.800000110.7
545A38Very low41.7Very low92 Ų92115.4 Ų115.476%0.7671%0.711SS**  trans144.8123162.800000104.9
546E34.8Very low43Very low191 Ų191114.6 Ų114.689%0.89369%0.694SS**  -154.312964.4-74.1159.6172.800106.9
547G42.5Very low44.3Very low67 Ų67117.5 Ų117.569%0.69169%0.688SS**  cis87.2105.139.500000108.4I549G547-I549 PolarHBondContact O-N 3.04Å
548L48.7Very low45.7Very low164 Ų164118.2 Ų118.286%0.85967%0.672SS**  trans-34.7126.1-179.1-89.780.1000112.2W550L548-W550 PolarHBondContact O-N 3.43Å
549I56.2Low46.8Very low160 Ų160117.3 Ų117.382%0.82166%0.657SS**SBendtrans-61.6-34-173.3-57.9178000110.3G547G547-I549 PolarHBondContact O-N 3.04Å
550W46Very low47.4Very low154 Ų154116.9 Ų116.958%0.58366%0.655SS**SBendtrans-122131.9179.3-60.8-2.2000111.5L548 D554 V555 L558L548-W550 PolarHBondContact O-N 3.43Å; W550-D554 HydrophobicContact CB-CB 4.45Å; W550-V555 HydrophobicContact CE3-CG2 4.39Å; W550-L558 HydrophobicContact CE3-CD1 3.89Å; W550-L558 HydrophobicContact CH2-CD1 3.68Å; W550-L558 HydrophobicContact CZ3-CD1 3.24Å
551N64.2Low48.2Very low83 Ų83116.7 Ų116.744%0.44465%0.654SS.*  trans-88.8165.5172.366.650.4000110.7S553 D554 V555N551-S553 PolarHBondContact O-N 3.35Å; N551-S553 VanDerWaalsContact O-N 3.08Å; N551-S553 WeakPolarHBondContact OD1-CA 3.37Å; N551-S553 WeakPolarHBondContact OD1-CB 3.46Å; N551-S553 PolarHBondContact OD1-N 3.33Å; N551-S553 PolarHBondContact OD1-OG 3.05Å; N551-D554 PolarHBondContact N-OD2 3.45Å; N551-D554 PolarHBondContact ND2-OD2 2.94Å; N551-D554 WeakPolarHBondContact O-CB 3.45Å; N551-D554 PolarHBondContact O-N 2.99Å; N551-D554 VanDerWaalsContact OD1-CG 3.25Å; N551-D554 PolarHBondContact OD1-N 2.94Å; N551-D554 PolarHBondContact OD1-OD2 3.47Å; N551-D554 VanDerWaalsContact OD1-OD2 3.12Å; N551-V555 PolarHBondContact O-N 3.45Å
552Q49Very low48.1Very low135 Ų135116.4 Ų116.463%0.63164%0.644SS**Hα-helixtrans-56.7-28.1-179.3-16866.11900113.1N556Q552-N556 WeakPolarHBondContact O-CB 3.49Å; Q552-N556 PolarHBondContact O-N 3.27Å; Q552-N556 VanDerWaalsContact O-N 3.11Å; Q552-N556 PolarHBondContact O-ND2 2.99Å
553S56.3Low48.5Very low64 Ų64121.6 Ų121.645%0.44865%0.65SS.*Hα-helixtrans-74.6-32.2178.681.20000112.7N551 N556 R557N551-S553 PolarHBondContact O-N 3.35Å; N551-S553 VanDerWaalsContact O-N 3.08Å; N551-S553 WeakPolarHBondContact OD1-CA 3.37Å; N551-S553 WeakPolarHBondContact OD1-CB 3.46Å; N551-S553 PolarHBondContact OD1-N 3.33Å; N551-S553 PolarHBondContact OD1-OG 3.05Å; S553-N556 PolarHBondContact O-N 2.96Å; S553-R557 PolarHBondContact O-N 3.11Å
554D62.7Low48.9Very low53 Ų53117.8 Ų117.828%0.28365%0.647SS.*Hα-helixtrans-70.6-40.3176.4-59.6-36.9000110.9W550 N551 N556 R557 L558W550-D554 HydrophobicContact CB-CB 4.45Å; N551-D554 PolarHBondContact N-OD2 3.45Å; N551-D554 PolarHBondContact ND2-OD2 2.94Å; N551-D554 WeakPolarHBondContact O-CB 3.45Å; N551-D554 PolarHBondContact O-N 2.99Å; N551-D554 VanDerWaalsContact OD1-CG 3.25Å; N551-D554 PolarHBondContact OD1-N 2.94Å; N551-D554 PolarHBondContact OD1-OD2 3.47Å; N551-D554 VanDerWaalsContact OD1-OD2 3.12Å; D554-N556 VanDerWaalsContact C-N 3.34Å; D554-N556 PolarHBondContact O-N 3.37Å; D554-R557 PolarHBondContact O-N 3.41Å; D554-L558 PolarHBondContact O-N 3.14Å; D554-L558 VanDerWaalsContact O-N 3.1Å
555V60.9Low49.1Very low46 Ų46126.1 Ų126.128%0.27966%0.664SS.*Hα-helixtrans-63.9-40.6173.61770000111.1W550 N551 L558 K559W550-V555 HydrophobicContact CE3-CG2 4.39Å; N551-V555 PolarHBondContact O-N 3.45Å; V555-L558 PolarHBondContact O-N 2.83Å; V555-K559 HydrophobicContact CG1-CD 4.39Å; V555-K559 WeakPolarHBondContact O-CG 3.34Å; V555-K559 PolarHBondContact O-N 2.96Å
556N58Low49.6Very low75 Ų75127.9 Ų127.940%0.40166%0.659SS.*Hα-helixtrans-67.2-36.5177-73.8-14000112.2Q552 S553 D554 L558 K559 C560Q552-N556 WeakPolarHBondContact O-CB 3.49Å; Q552-N556 PolarHBondContact O-N 3.27Å; Q552-N556 VanDerWaalsContact O-N 3.11Å; Q552-N556 PolarHBondContact O-ND2 2.99Å; S553-N556 PolarHBondContact O-N 2.96Å; D554-N556 VanDerWaalsContact C-N 3.34Å; D554-N556 PolarHBondContact O-N 3.37Å; N556-L558 PolarHBondContact O-N 3.28Å; N556-K559 PolarHBondContact O-N 3.28Å; N556-C560 PolarHBondContact O-N 3.03Å; N556-C560 PolarHBondContact O-SG 3.04Å
557R60.4Low50.4Low193 Ų193124.5 Ų124.573%0.72865%0.647SS**Hα-helixtrans-62.7-40.5173.2-80.7179.8179179.81.4112.6S553 D554 C560 G561S553-R557 PolarHBondContact O-N 3.11Å; D554-R557 PolarHBondContact O-N 3.41Å; R557-C560 PolarHBondContact O-N 2.79Å; R557-G561 PolarHBondContact O-N 3.31Å
558L55.3Low50.8Low96 Ų96127.7 Ų127.750%0.50364%0.644SS.*Hα-helixtrans-64.2-40.6174.4-88.3155.2000112.1W550 D554 V555 N556 G561W550-L558 HydrophobicContact CE3-CD1 3.89Å; W550-L558 HydrophobicContact CH2-CD1 3.68Å; W550-L558 HydrophobicContact CZ3-CD1 3.24Å; D554-L558 PolarHBondContact O-N 3.14Å; D554-L558 VanDerWaalsContact O-N 3.1Å; V555-L558 PolarHBondContact O-N 2.83Å; N556-L558 PolarHBondContact O-N 3.28Å; L558-G561 PolarHBondContact O-N 3.37Å
559K51.8Low51Low121 Ų121125.6 Ų125.653%0.52663%0.632SS.*Hα-helixtrans-65.5-39.6176.8-73.9178.2177-176.20112.9V555 N556 G561 L562V555-K559 HydrophobicContact CG1-CD 4.39Å; V555-K559 WeakPolarHBondContact O-CG 3.34Å; V555-K559 PolarHBondContact O-N 2.96Å; N556-K559 PolarHBondContact O-N 3.28Å; K559-G561 PolarHBondContact O-N 3.41Å; K559-L562 PolarHBondContact O-N 3.43Å
560C52.3Low50.6Low117 Ų117123.4 Ų123.479%0.79162%0.62SS**Hα-helixtrans-67.5-17178.1-67.20000114.1N556 R557N556-C560 PolarHBondContact O-N 3.03Å; N556-C560 PolarHBondContact O-SG 3.04Å; R557-C560 PolarHBondContact O-N 2.79Å
561G42.1Very low50.9Low65 Ų65121.4 Ų121.467%0.6762%0.622SS**THydrogen-bonded Turntrans-85.8-11.2178.400000114.8R557 L558 K559 K563R557-G561 PolarHBondContact O-N 3.31Å; L558-G561 PolarHBondContact O-N 3.37Å; K559-G561 PolarHBondContact O-N 3.41Å; G561-K563 PolarHBondContact O-N 3.25Å
562L40.2Very low50Low130 Ų130124.1 Ų124.168%0.68164%0.635SS**  trans-85.5100.7-178.4-75.6160.9000110.2K559 L564K559-L562 PolarHBondContact O-N 3.43Å; L562-L564 PolarHBondContact O-N 3.01Å
563K35Very low50.1Low199 Ų199123.3 Ų123.387%0.86564%0.635SS**  trans-79.3108.2160.1-76.2-177.1175.8-178.80107.8G561G561-K563 PolarHBondContact O-N 3.25Å
564L38.5Very low49.6Very low163 Ų163128.3 Ų128.385%0.85365%0.651SS**  trans-75.3138.3166.6-71.9162.9000108.5L562L562-L564 PolarHBondContact O-N 3.01Å
565F37.6Very low48.4Very low281 Ų281135.1 Ų135.1100%1.23268%0.684SS**  trans-60.30-175.2-76.6-90.7000113.2

Retrieved 565 of 565 residues in 1298.8 ms (Link to these results)

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