A0A087Y239_POEFO Loading...

MIF4G domain containing b

Functions in replication-dependent translation of histone mRNAs which differ from other eukaryotic mRNAs in that they do not end with a poly-A tail but a stem-loop. May participate in circularizing those mRNAs specifically enhancing their translation.

AlphaFold DB , UniProt , Accession A0A087Y239, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 221 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
1M31.3Very low52.6Low247 Ų247116.1 Ų116.1100%1.21759%0.592SS**  0101.40-74.2176.3171.300106N3M1-N3 PolarHBondContact O-N 3.34Å
2E31.6Very low54.7Low193 Ų193110.8 Ų110.890%0.90257%0.573SS**  trans-70.7109.7-161-70.5164.6147.400111.3C4E2-C4 PolarHBondContact O-N 3.05Å
3N35Very low57Low169 Ų169103.4 Ų103.490%0.90453%0.534SS*.  trans-8374.2154.9-118.6-3.5000106.2M1 S5M1-N3 PolarHBondContact O-N 3.34Å; N3-S5 PolarHBondContact O-N 2.97Å; N3-S5 VanDerWaalsContact O-N 3.12Å
4C32.4Very low59.2Low97 Ų97102.3 Ų102.366%0.65553%0.53SS*.  trans-70.1105.5162.8-166.80000105E2 E6E2-C4 PolarHBondContact O-N 3.05Å; C4-E6 PolarHBondContact O-N 2.91Å
5S39.6Very low61.1Low109 Ų109101.7 Ų101.776%0.76253%0.532SS*.  trans-58.292.9167.4166.10000107N3 D7N3-S5 PolarHBondContact O-N 2.97Å; N3-S5 VanDerWaalsContact O-N 3.12Å; S5-D7 VanDerWaalsContact C-N 3.35Å; S5-D7 PolarHBondContact O-N 3.21Å
6E54.9Low62.9Low110 Ų110102.2 Ų102.251%0.51454%0.536SS..  trans-65.795.5-178.8-71.5174.7139.600108.6C4 Y8C4-E6 PolarHBondContact O-N 2.91Å; E6-Y8 HydrophobicContact CB-CD2 3.77Å; E6-Y8 HydrophobicContact CB-CE1 4.37Å; E6-Y8 HydrophobicContact CB-CE2 3.34Å; E6-Y8 HydrophobicContact CB-CG 4.46Å; E6-Y8 HydrophobicContact CG-CE2 4.2Å; E6-Y8 WeakPolarHBondContact O-CD2 3.4Å; E6-Y8 PolarHBondContact O-N 3.28Å; E6-Y8 PolarHBondContact OE1-OH 3.07Å; E6-Y8 WeakPolarHBondContact OE2-CE2 3.24Å; E6-Y8 PolarHBondContact OE2-OH 3.24Å
7D63.7Low64.5Low72 Ų7297.2 Ų97.239%0.38551%0.511SS..  trans-73.678.3175.1-168.45.4000108.8S5 R9 Q11S5-D7 VanDerWaalsContact C-N 3.35Å; S5-D7 PolarHBondContact O-N 3.21Å; D7-R9 PolarHBondContact O-N 3.19Å; D7-R9 PolarHBondContact OD1-N 3.1Å; D7-R9 IonicContact OD2-CZ 3.58Å; D7-R9 IonicContact OD2-NE 3.12Å; D7-R9 IonicContact OD2-NH1 3.43Å; D7-Q11 PolarHBondContact OD1-NE2 3.07Å
8Y66.6Low65.9Low19 Ų1994.2 Ų94.28%0.07549%0.493CS..  trans-68.713.9177.6-71.5-65.1000113.8E6 I10 L25 I57 T60E6-Y8 HydrophobicContact CB-CD2 3.77Å; E6-Y8 HydrophobicContact CB-CE1 4.37Å; E6-Y8 HydrophobicContact CB-CE2 3.34Å; E6-Y8 HydrophobicContact CB-CG 4.46Å; E6-Y8 HydrophobicContact CG-CE2 4.2Å; E6-Y8 WeakPolarHBondContact O-CD2 3.4Å; E6-Y8 PolarHBondContact O-N 3.28Å; E6-Y8 PolarHBondContact OE1-OH 3.07Å; E6-Y8 WeakPolarHBondContact OE2-CE2 3.24Å; E6-Y8 PolarHBondContact OE2-OH 3.24Å; Y8-I10 WeakPolarHBondContact O-CG2 3.36Å; Y8-I10 PolarHBondContact O-N 2.94Å; Y8-L25 HydrophobicContact CD2-CD1 3.9Å; Y8-L25 HydrophobicContact CE2-CD1 3.84Å; Y8-I57 HydrophobicContact CD1-CD1 4.5Å; Y8-I57 HydrophobicContact CD1-CG1 3.54Å; Y8-I57 HydrophobicContact CE1-CG1 4.31Å; Y8-I57 HydrophobicContact CG-CG1 4.04Å; Y8-I57 WeakPolarHBondContact O-CD1 3.35Å; Y8-T60 WeakPolarHBondContact OH-CG2 3.22Å; Y8-T60 PolarHBondContact OH-OG1 3.44Å
9R70.9Confident67.1Low137 Ų13795.5 Ų95.552%0.51750%0.495SS..  trans48.129.2-179.4-63.3-61.4-167.7173.11.1114.7D7 Q11 E53D7-R9 PolarHBondContact O-N 3.19Å; D7-R9 PolarHBondContact OD1-N 3.1Å; D7-R9 IonicContact OD2-CZ 3.58Å; D7-R9 IonicContact OD2-NE 3.12Å; D7-R9 IonicContact OD2-NH1 3.43Å; R9-Q11 VanDerWaalsContact C-OE1 3.26Å; R9-Q11 PolarHBondContact O-N 3.06Å; R9-Q11 VanDerWaalsContact O-N 3.09Å; R9-E53 HydrophobicContact CB-CG 4.46Å; R9-E53 HydrophobicContact CG-CG 4.02Å
10I75.6Confident68.4Low14 Ų1492.7 Ų92.77%0.07248%0.48CS..G310 helixtrans-75.36-179.258173.5000112.7Y8 S12 F13 Q18 L21 K22 I57Y8-I10 WeakPolarHBondContact O-CG2 3.36Å; Y8-I10 PolarHBondContact O-N 2.94Å; I10-S12 PolarHBondContact O-N 3.06Å; I10-F13 HydrophobicContact CB-CD2 4.05Å; I10-F13 HydrophobicContact CG2-CD2 4.31Å; I10-F13 HydrophobicContact CG2-CE2 4.35Å; I10-F13 PolarHBondContact O-N 2.88Å; I10-Q18 HydrophobicContact CB-CG 4.39Å; I10-Q18 HydrophobicContact CD1-CB 4.44Å; I10-Q18 HydrophobicContact CD1-CG 4.45Å; I10-Q18 HydrophobicContact CG1-CG 4.43Å; I10-Q18 VanDerWaalsContact O-CD 3.32Å; I10-Q18 WeakPolarHBondContact O-CG 3.47Å; I10-Q18 PolarHBondContact O-NE2 2.93Å; I10-L21 HydrophobicContact CG2-CD1 3.88Å; I10-K22 HydrophobicContact CD1-CD 4.3Å; I10-K22 VanDerWaalsContact CD1-CE 3.45Å; I10-K22 HydrophobicContact CD1-CG 3.93Å; I10-I57 HydrophobicContact CG2-CD1 4.08Å
11Q76.6Confident69.5Low110 Ų11088.2 Ų88.251%0.51446%0.457SS..G310 helixtrans-67.7-19.3-179.7-54.4875.900112.7D7 R9 F13D7-Q11 PolarHBondContact OD1-NE2 3.07Å; R9-Q11 VanDerWaalsContact C-OE1 3.26Å; R9-Q11 PolarHBondContact O-N 3.06Å; R9-Q11 VanDerWaalsContact O-N 3.09Å; Q11-F13 PolarHBondContact O-N 3.5Å
12S77.8Confident72.3Confident52 Ų5281.6 Ų81.636%0.36442%0.421SS..G310 helixtrans-75.9-8.3175.561.10000114I10 Q43 D47I10-S12 PolarHBondContact O-N 3.06Å; S12-Q43 PolarHBondContact OG-NE2 3.09Å; S12-D47 WeakPolarHBondContact CB-OD2 3.48Å; S12-D47 PolarHBondContact OG-OD2 3.28Å
13F84.9Confident75.2Confident15 Ų1575.2 Ų75.27%0.06640%0.395CS..SBendtrans-91.4156.4175.1-66.3-83.9000112.8I10 Q11 T17 Q18 L21 I39 L40 Q43 F50I10-F13 HydrophobicContact CB-CD2 4.05Å; I10-F13 HydrophobicContact CG2-CD2 4.31Å; I10-F13 HydrophobicContact CG2-CE2 4.35Å; I10-F13 PolarHBondContact O-N 2.88Å; Q11-F13 PolarHBondContact O-N 3.5Å; F13-T17 HydrophobicContact CB-CG2 3.91Å; F13-T17 HydrophobicContact CD1-CG2 3.32Å; F13-T17 HydrophobicContact CE1-CG2 3.96Å; F13-T17 HydrophobicContact CG-CG2 3.79Å; F13-Q18 HydrophobicContact CB-CG 3.9Å; F13-Q18 PolarHBondContact O-NE2 3.08Å; F13-L21 HydrophobicContact CD2-CD1 3.86Å; F13-L21 HydrophobicContact CE1-CD1 4.32Å; F13-L21 HydrophobicContact CE2-CD1 3.68Å; F13-L21 HydrophobicContact CG-CD1 4.25Å; F13-L21 HydrophobicContact CZ-CD1 3.9Å; F13-I39 HydrophobicContact CD1-CG2 4.1Å; F13-I39 HydrophobicContact CE1-CG2 3.54Å; F13-I39 HydrophobicContact CZ-CG2 4.41Å; F13-L40 HydrophobicContact CZ-CD2 4.44Å; F13-Q43 HydrophobicContact CD1-CB 4.44Å; F13-Q43 HydrophobicContact CD1-CG 4.24Å; F13-Q43 HydrophobicContact CE1-CB 3.4Å; F13-Q43 VanDerWaalsContact CE1-CB 3.4Å; F13-Q43 HydrophobicContact CE1-CG 3.52Å; F13-Q43 HydrophobicContact CE2-CG 4.06Å; F13-Q43 HydrophobicContact CZ-CB 3.49Å; F13-Q43 VanDerWaalsContact CZ-CB 3.49Å; F13-Q43 HydrophobicContact CZ-CG 3.43Å; F13-Q43 VanDerWaalsContact CZ-CG 3.43Å; F13-F50 AromaticContact CE2-CD2 3.95Å; F13-F50 HydrophobicContact CE2-CD2 3.95Å; F13-F50 HydrophobicContact CE2-CE1 4.1Å; F13-F50 AromaticContact CE2-CE2 3.44Å; F13-F50 HydrophobicContact CE2-CE2 3.44Å; F13-F50 VanDerWaalsContact CE2-CE2 3.44Å; F13-F50 HydrophobicContact CE2-CG 4.48Å; F13-F50 AromaticContact CE2-CZ 3.52Å; F13-F50 HydrophobicContact CE2-CZ 3.52Å; F13-F50 HydrophobicContact CZ-CD1 4.3Å; F13-F50 HydrophobicContact CZ-CD2 4.48Å; F13-F50 AromaticContact CZ-CE1 3.7Å; F13-F50 HydrophobicContact CZ-CE1 3.7Å; F13-F50 AromaticContact CZ-CE2 3.93Å; F13-F50 HydrophobicContact CZ-CE2 3.93Å; F13-F50 AromaticContact CZ-CZ 3.5Å; F13-F50 HydrophobicContact CZ-CZ 3.5Å
14D87.9Confident77.9Confident88 Ų8867.1 Ų67.147%0.47135%0.352SS..  trans-64.2160.4167.570.190.7000111.8D16 T17 Q18D14-D16 VanDerWaalsContact C-N 3.25Å; D14-D16 PolarHBondContact O-N 2.86Å; D14-D16 WeakPolarHBondContact OD1-CB 3.42Å; D14-D16 PolarHBondContact OD1-N 3.37Å; D14-T17 PolarHBondContact O-N 3.42Å; D14-T17 PolarHBondContact OD1-N 3.43Å; D14-T17 PolarHBondContact OD1-OG1 3.5Å; D14-T17 WeakPolarHBondContact OD2-CB 3.02Å; D14-T17 PolarHBondContact OD2-OG1 3.2Å; D14-Q18 WeakPolarHBondContact O-CG 3.31Å; D14-Q18 PolarHBondContact O-N 2.89Å
15V88.3Confident80.7Confident94 Ų9463.9 Ų63.957%0.5733%0.328SS*.Hα-helixtrans-59.6-35.2-173.41770000112.5K19V15-K19 WeakPolarHBondContact O-CG 3.4Å; V15-K19 PolarHBondContact O-N 3.17Å
16D89.1Confident83.1Confident109 Ų10967.5 Ų67.558%0.58333%0.33SS*.Hα-helixtrans-76.1-39-178.1-66.7-31.3000110.9D14 K19 L20D14-D16 VanDerWaalsContact C-N 3.25Å; D14-D16 PolarHBondContact O-N 2.86Å; D14-D16 WeakPolarHBondContact OD1-CB 3.42Å; D14-D16 PolarHBondContact OD1-N 3.37Å; D16-K19 PolarHBondContact O-N 3.06Å; D16-K19 IonicContact OD1-NZ 3.7Å; D16-L20 WeakPolarHBondContact O-CB 3.39Å; D16-L20 PolarHBondContact O-N 3.45Å
17T89.7Confident84.9Confident18 Ų1865 Ų6511%0.1132%0.32CS..Hα-helixtrans-64.7-40.9171.4-61.70000111.9F13 D14 K19 L20 L21 I39F13-T17 HydrophobicContact CB-CG2 3.91Å; F13-T17 HydrophobicContact CD1-CG2 3.32Å; F13-T17 HydrophobicContact CE1-CG2 3.96Å; F13-T17 HydrophobicContact CG-CG2 3.79Å; D14-T17 PolarHBondContact O-N 3.42Å; D14-T17 PolarHBondContact OD1-N 3.43Å; D14-T17 PolarHBondContact OD1-OG1 3.5Å; D14-T17 WeakPolarHBondContact OD2-CB 3.02Å; D14-T17 PolarHBondContact OD2-OG1 3.2Å; T17-K19 VanDerWaalsContact C-N 3.31Å; T17-K19 PolarHBondContact O-N 2.59Å; T17-L20 WeakPolarHBondContact O-CB 3.39Å; T17-L20 PolarHBondContact O-N 2.79Å; T17-L20 VanDerWaalsContact O-N 3.16Å; T17-L21 HydrophobicContact CG2-CD1 4.24Å; T17-L21 HydrophobicContact CG2-CG 4.29Å; T17-L21 WeakPolarHBondContact O-CG 3.24Å; T17-L21 PolarHBondContact O-N 3.17Å; T17-I39 HydrophobicContact CG2-CD1 4.32Å; T17-I39 HydrophobicContact CG2-CG2 3.48Å; T17-I39 VanDerWaalsContact CG2-CG2 3.48Å
18Q89.7Confident86.2Confident42 Ų4261.7 Ų61.720%0.19630%0.303CS..Hα-helixtrans-59.3-42.3174-73.2-17537.800112.1I10 F13 D14 K22I10-Q18 HydrophobicContact CB-CG 4.39Å; I10-Q18 HydrophobicContact CD1-CB 4.44Å; I10-Q18 HydrophobicContact CD1-CG 4.45Å; I10-Q18 HydrophobicContact CG1-CG 4.43Å; I10-Q18 VanDerWaalsContact O-CD 3.32Å; I10-Q18 WeakPolarHBondContact O-CG 3.47Å; I10-Q18 PolarHBondContact O-NE2 2.93Å; F13-Q18 HydrophobicContact CB-CG 3.9Å; F13-Q18 PolarHBondContact O-NE2 3.08Å; D14-Q18 WeakPolarHBondContact O-CG 3.31Å; D14-Q18 PolarHBondContact O-N 2.89Å; Q18-K22 WeakPolarHBondContact O-CB 3.5Å; Q18-K22 VanDerWaalsContact O-CG 3.25Å; Q18-K22 WeakPolarHBondContact O-CG 3.46Å; Q18-K22 PolarHBondContact O-N 3.27Å
19K89.9Confident87.3Confident120 Ų12064.3 Ų64.352%0.52232%0.324SS..Hα-helixtrans-62.5-46174.2-73.5169.9-172.4163.90110.7V15 D16 T17 L21 K22 T23V15-K19 WeakPolarHBondContact O-CG 3.4Å; V15-K19 PolarHBondContact O-N 3.17Å; D16-K19 PolarHBondContact O-N 3.06Å; D16-K19 IonicContact OD1-NZ 3.7Å; T17-K19 VanDerWaalsContact C-N 3.31Å; T17-K19 PolarHBondContact O-N 2.59Å; K19-L21 PolarHBondContact O-N 3Å; K19-K22 PolarHBondContact O-N 3.16Å; K19-T23 PolarHBondContact O-N 3.06Å; K19-T23 PolarHBondContact O-OG1 3.04Å
20L92Very high88.3Confident38 Ų3861 Ų6120%0.19932%0.322CS..Hα-helixtrans-57.8-47.2178.3-17868.4000111.8D16 T17 T23 A24 V31 K35 V36 I39D16-L20 WeakPolarHBondContact O-CB 3.39Å; D16-L20 PolarHBondContact O-N 3.45Å; T17-L20 WeakPolarHBondContact O-CB 3.39Å; T17-L20 PolarHBondContact O-N 2.79Å; T17-L20 VanDerWaalsContact O-N 3.16Å; L20-T23 PolarHBondContact O-N 3.43Å; L20-A24 WeakPolarHBondContact O-CB 3.1Å; L20-A24 PolarHBondContact O-N 3.48Å; L20-V31 HydrophobicContact CD1-CB 4.01Å; L20-V31 HydrophobicContact CD1-CG1 3.78Å; L20-K35 HydrophobicContact CD2-CD 4.41Å; L20-K35 HydrophobicContact CD2-CG 4.5Å; L20-V36 HydrophobicContact CD1-CG2 4.33Å; L20-V36 HydrophobicContact CD2-CG2 4.06Å; L20-V36 HydrophobicContact CG-CG2 3.97Å; L20-I39 HydrophobicContact CD2-CD1 3.8Å
21L91.3Very high89.2Confident0 Ų061.5 Ų61.50%033%0.325CS..Hα-helixtrans-65.1-43.3178.3-66.8-179.6000111.9I10 F13 T17 K19 T23 A24 L25 V36 L40I10-L21 HydrophobicContact CG2-CD1 3.88Å; F13-L21 HydrophobicContact CD2-CD1 3.86Å; F13-L21 HydrophobicContact CE1-CD1 4.32Å; F13-L21 HydrophobicContact CE2-CD1 3.68Å; F13-L21 HydrophobicContact CG-CD1 4.25Å; F13-L21 HydrophobicContact CZ-CD1 3.9Å; T17-L21 HydrophobicContact CG2-CD1 4.24Å; T17-L21 HydrophobicContact CG2-CG 4.29Å; T17-L21 WeakPolarHBondContact O-CG 3.24Å; T17-L21 PolarHBondContact O-N 3.17Å; K19-L21 PolarHBondContact O-N 3Å; L21-T23 VanDerWaalsContact C-N 3.29Å; L21-T23 PolarHBondContact O-N 3.05Å; L21-A24 PolarHBondContact O-N 3.35Å; L21-L25 VanDerWaalsContact O-CG 3.31Å; L21-L25 WeakPolarHBondContact O-CG 3.15Å; L21-L25 PolarHBondContact O-N 3.49Å; L21-V36 HydrophobicContact CD2-CG1 3.87Å; L21-L40 HydrophobicContact CD1-CD2 4.18Å; L21-L40 HydrophobicContact CD2-CD1 4.38Å; L21-L40 HydrophobicContact CD2-CD2 3.79Å; L21-L40 HydrophobicContact CD2-CG 4.03Å
22K91.2Very high90Very high108 Ų10860.8 Ų60.847%0.4733%0.325SS..Hα-helixtrans-61.1-38.1174.9-74.7174.7-175.2176.50112.1I10 Q18 K19 K26I10-K22 HydrophobicContact CD1-CD 4.3Å; I10-K22 VanDerWaalsContact CD1-CE 3.45Å; I10-K22 HydrophobicContact CD1-CG 3.93Å; Q18-K22 WeakPolarHBondContact O-CB 3.5Å; Q18-K22 VanDerWaalsContact O-CG 3.25Å; Q18-K22 WeakPolarHBondContact O-CG 3.46Å; Q18-K22 PolarHBondContact O-N 3.27Å; K19-K22 PolarHBondContact O-N 3.16Å; K22-K26 PolarHBondContact O-N 3.29Å
23T91.9Very high90.9Very high58 Ų5859.1 Ų59.136%0.35631%0.312SS..Hα-helixtrans-69.2-43.8174.2-55.70000110.7K19 L20 L21 L25 K26 D27 S30 V31K19-T23 PolarHBondContact O-N 3.06Å; K19-T23 PolarHBondContact O-OG1 3.04Å; L20-T23 PolarHBondContact O-N 3.43Å; L21-T23 VanDerWaalsContact C-N 3.29Å; L21-T23 PolarHBondContact O-N 3.05Å; T23-L25 PolarHBondContact O-N 2.96Å; T23-K26 PolarHBondContact O-N 3.04Å; T23-D27 CarbonylContact O-C 3.48Å; T23-D27 PolarHBondContact O-N 3.48Å; T23-S30 VanDerWaalsContact CG2-OG 3.31Å; T23-S30 WeakPolarHBondContact CG2-OG 3.46Å; T23-V31 HydrophobicContact CG2-CG1 3.6Å
24A92.2Very high91.4Very high0 Ų062.9 Ų62.90%033%0.33CS..Hα-helixtrans-59.2-34.1177.400000113.1L20 L21 K26 P28 V31 V36 I61L20-A24 WeakPolarHBondContact O-CB 3.1Å; L20-A24 PolarHBondContact O-N 3.48Å; L21-A24 PolarHBondContact O-N 3.35Å; A24-K26 VanDerWaalsContact C-N 3.33Å; A24-P28 WeakPolarHBondContact O-CD 3.15Å; A24-P28 VanDerWaalsContact O-CG 3.26Å; A24-P28 WeakPolarHBondContact O-CG 3.44Å; A24-V31 HydrophobicContact CB-CG2 3.81Å; A24-V36 HydrophobicContact CB-CG1 4.09Å; A24-V36 HydrophobicContact CB-CG2 4.08Å; A24-I61 HydrophobicContact CB-CD1 4.18Å; A24-I61 HydrophobicContact CB-CG1 4.48Å
25L90.8Very high91.7Very high29 Ų2964.5 Ų64.515%0.15233%0.333CS..Hα-helixtrans-70.5-26.9175.9-70.9165.8000113.2Y8 L21 T23 I57 T60 I61Y8-L25 HydrophobicContact CD2-CD1 3.9Å; Y8-L25 HydrophobicContact CE2-CD1 3.84Å; L21-L25 VanDerWaalsContact O-CG 3.31Å; L21-L25 WeakPolarHBondContact O-CG 3.15Å; L21-L25 PolarHBondContact O-N 3.49Å; T23-L25 PolarHBondContact O-N 2.96Å; L25-I57 HydrophobicContact CD2-CG2 4.39Å; L25-T60 HydrophobicContact CD2-CG2 3.56Å; L25-I61 HydrophobicContact CD2-CG1 3.75Å; L25-I61 HydrophobicContact CG-CG1 4.29Å
26K90.7Very high92Very high184 Ų18460 Ų6080%0.831%0.306SS*.Hα-helixtrans-100.3-43.3-175.6-69.8-177.4178-174.60113.3K22 T23 A24K22-K26 PolarHBondContact O-N 3.29Å; T23-K26 PolarHBondContact O-N 3.04Å; A24-K26 VanDerWaalsContact C-N 3.33Å
27D91.4Very high92.3Very high58 Ų5854.9 Ų54.931%0.3128%0.278SS..  trans-140.577.1-178.4-174.52.2000110.3T23 S29 S30 Q68T23-D27 CarbonylContact O-C 3.48Å; T23-D27 PolarHBondContact O-N 3.48Å; D27-S29 PolarHBondContact O-N 2.94Å; D27-S29 VanDerWaalsContact O-N 3.14Å; D27-S29 PolarHBondContact OD1-N 3.08Å; D27-S29 PolarHBondContact OD1-OG 2.98Å; D27-S30 PolarHBondContact O-N 3.33Å; D27-S30 VanDerWaalsContact O-N 3.1Å; D27-S30 PolarHBondContact O-OG 2.87Å; D27-S30 PolarHBondContact OD1-N 3.3Å; D27-S30 WeakPolarHBondContact OD2-CB 3.18Å; D27-Q68 PolarHBondContact OD1-NE2 2.9Å; D27-Q68 PolarHBondContact OD1-OE1 3.34Å
28P91.4Very high92.6Very high2 Ų256.5 Ų56.51%0.01329%0.286CS..G310 helixtrans-52.4-31.3176.9-22.626.2000113.9A24 S30 V31 L33 A64 E65A24-P28 WeakPolarHBondContact O-CD 3.15Å; A24-P28 VanDerWaalsContact O-CG 3.26Å; A24-P28 WeakPolarHBondContact O-CG 3.44Å; P28-S30 VanDerWaalsContact C-N 3.26Å; P28-S30 PolarHBondContact O-N 2.95Å; P28-V31 VanDerWaalsContact O-CG2 3.29Å; P28-V31 WeakPolarHBondContact O-CG2 3.36Å; P28-V31 PolarHBondContact O-N 3.48Å; P28-L33 HydrophobicContact CB-CD1 4.47Å; P28-L33 HydrophobicContact CB-CD2 3.97Å; P28-L33 WeakPolarHBondContact O-CD2 3.4Å; P28-A64 HydrophobicContact CG-CB 3.58Å; P28-E65 HydrophobicContact CB-CB 4.1Å; P28-E65 HydrophobicContact CG-CB 4.25Å
29S90.3Very high92.8Very high74 Ų7456 Ų5652%0.51728%0.284SS..G310 helixtrans-70.8-20.9-17876.90000114D27 Q68D27-S29 PolarHBondContact O-N 2.94Å; D27-S29 VanDerWaalsContact O-N 3.14Å; D27-S29 PolarHBondContact OD1-N 3.08Å; D27-S29 PolarHBondContact OD1-OG 2.98Å; S29-Q68 PolarHBondContact OG-NE2 3.07Å
30S91.8Very high93Very high68 Ų6850.2 Ų50.248%0.47626%0.259SS..G310 helixtrans-86.7-5.6-178.770.30000114.3T23 D27 P28T23-S30 VanDerWaalsContact CG2-OG 3.31Å; T23-S30 WeakPolarHBondContact CG2-OG 3.46Å; D27-S30 PolarHBondContact O-N 3.33Å; D27-S30 VanDerWaalsContact O-N 3.1Å; D27-S30 PolarHBondContact O-OG 2.87Å; D27-S30 PolarHBondContact OD1-N 3.3Å; D27-S30 WeakPolarHBondContact OD2-CB 3.18Å; P28-S30 VanDerWaalsContact C-N 3.26Å; P28-S30 PolarHBondContact O-N 2.95Å
31V94.1Very high93.1Very high24 Ų2448.4 Ų48.415%0.14525%0.25CC..SBendtrans-121.6157.4-174.8-64.70000111.9L20 T23 A24 P28 L33 V36L20-V31 HydrophobicContact CD1-CB 4.01Å; L20-V31 HydrophobicContact CD1-CG1 3.78Å; T23-V31 HydrophobicContact CG2-CG1 3.6Å; A24-V31 HydrophobicContact CB-CG2 3.81Å; P28-V31 VanDerWaalsContact O-CG2 3.29Å; P28-V31 WeakPolarHBondContact O-CG2 3.36Å; P28-V31 PolarHBondContact O-N 3.48Å; V31-L33 HydrophobicContact CG2-CD2 3.85Å; V31-L33 PolarHBondContact O-N 3.3Å; V31-L33 VanDerWaalsContact O-N 3.08Å; V31-V36 HydrophobicContact CG2-CG2 4.24Å
32N94.7Very high93.3Very high95 Ų9551.3 Ų51.351%0.50827%0.265SS..  trans-75.798.6170.1-176.1-33.2000109.6E34 K35 V36N32-E34 VanDerWaalsContact C-N 3.27Å; N32-E34 PolarHBondContact O-N 3.34Å; N32-E34 WeakPolarHBondContact OD1-CB 3.45Å; N32-E34 PolarHBondContact OD1-N 2.7Å; N32-E34 VanDerWaalsContact OD1-N 3.07Å; N32-K35 HydrophobicContact CB-CB 4.04Å; N32-K35 WeakPolarHBondContact O-CB 3.48Å; N32-K35 PolarHBondContact O-N 3.03Å; N32-K35 PolarHBondContact OD1-N 2.69Å; N32-V36 WeakPolarHBondContact O-CG2 3.25Å; N32-V36 PolarHBondContact O-N 2.68Å
33L94.7Very high93.4Very high17 Ų1747.9 Ų47.99%0.08925%0.251CS..Hα-helixtrans-63.7-28.2-177.8-66173.6000113.8P28 V31 V36 S37 I61 E65 V73 F74P28-L33 HydrophobicContact CB-CD1 4.47Å; P28-L33 HydrophobicContact CB-CD2 3.97Å; P28-L33 WeakPolarHBondContact O-CD2 3.4Å; V31-L33 HydrophobicContact CG2-CD2 3.85Å; V31-L33 PolarHBondContact O-N 3.3Å; V31-L33 VanDerWaalsContact O-N 3.08Å; L33-V36 PolarHBondContact O-N 2.86Å; L33-S37 PolarHBondContact O-N 3.29Å; L33-S37 PolarHBondContact O-OG 2.92Å; L33-I61 HydrophobicContact CD2-CG2 4.28Å; L33-E65 HydrophobicContact CD1-CG 4.43Å; L33-V73 HydrophobicContact CD1-CB 4.19Å; L33-V73 HydrophobicContact CD1-CG1 4.44Å; L33-F74 HydrophobicContact CB-CB 4.1Å; L33-F74 HydrophobicContact CB-CD2 4.26Å; L33-F74 HydrophobicContact CD1-CB 4.09Å; L33-F74 HydrophobicContact CD2-CB 4.12Å; L33-F74 HydrophobicContact CD2-CD2 4.23Å; L33-F74 HydrophobicContact CD2-CG 4.48Å; L33-F74 HydrophobicContact CG-CB 4.32Å
34E95.6Very high93.4Very high95 Ų9545.1 Ų45.144%0.44423%0.234SC..Hα-helixtrans-66.8-45.6173.2177.8175.6-151.300111N32 V36 S37 N38 H77N32-E34 VanDerWaalsContact C-N 3.27Å; N32-E34 PolarHBondContact O-N 3.34Å; N32-E34 WeakPolarHBondContact OD1-CB 3.45Å; N32-E34 PolarHBondContact OD1-N 2.7Å; N32-E34 VanDerWaalsContact OD1-N 3.07Å; E34-V36 VanDerWaalsContact C-N 3.31Å; E34-V36 PolarHBondContact O-N 3.33Å; E34-S37 WeakPolarHBondContact CA-OG 3.37Å; E34-S37 PolarHBondContact O-N 3.12Å; E34-S37 PolarHBondContact O-OG 3.47Å; E34-N38 VanDerWaalsContact O-CG 3.28Å; E34-N38 PolarHBondContact O-N 2.94Å; E34-N38 PolarHBondContact O-ND2 3.12Å; E34-H77 IonicContact OE1-ND1 3.64Å
35K94.9Very high93.5Very high122 Ų12246.4 Ų46.453%0.5324%0.241SC..Hα-helixtrans-60.3-43.1174.8-175.1177.3178.8-179.70111L20 N32 N38 I39L20-K35 HydrophobicContact CD2-CD 4.41Å; L20-K35 HydrophobicContact CD2-CG 4.5Å; N32-K35 HydrophobicContact CB-CB 4.04Å; N32-K35 WeakPolarHBondContact O-CB 3.48Å; N32-K35 PolarHBondContact O-N 3.03Å; N32-K35 PolarHBondContact OD1-N 2.69Å; K35-N38 PolarHBondContact O-N 3.21Å; K35-I39 HydrophobicContact CG-CD1 3.92Å; K35-I39 VanDerWaalsContact O-CG1 3.32Å; K35-I39 WeakPolarHBondContact O-CG1 3.41Å; K35-I39 PolarHBondContact O-N 3.44Å
36V95.1Very high93.5Very high0 Ų052 Ų520%026%0.264CS..Hα-helixtrans-60.4-46.6176.8176.20000110.8L20 L21 A24 V31 N32 L33 E34 N38 I39 L40 I61 F74L20-V36 HydrophobicContact CD1-CG2 4.33Å; L20-V36 HydrophobicContact CD2-CG2 4.06Å; L20-V36 HydrophobicContact CG-CG2 3.97Å; L21-V36 HydrophobicContact CD2-CG1 3.87Å; A24-V36 HydrophobicContact CB-CG1 4.09Å; A24-V36 HydrophobicContact CB-CG2 4.08Å; V31-V36 HydrophobicContact CG2-CG2 4.24Å; N32-V36 WeakPolarHBondContact O-CG2 3.25Å; N32-V36 PolarHBondContact O-N 2.68Å; L33-V36 PolarHBondContact O-N 2.86Å; E34-V36 VanDerWaalsContact C-N 3.31Å; E34-V36 PolarHBondContact O-N 3.33Å; V36-N38 VanDerWaalsContact C-N 3.34Å; V36-N38 PolarHBondContact O-N 2.68Å; V36-I39 PolarHBondContact O-N 3.49Å; V36-L40 HydrophobicContact CG1-CD1 3.92Å; V36-L40 HydrophobicContact CG1-CG 4.49Å; V36-L40 VanDerWaalsContact O-CG 3.3Å; V36-L40 WeakPolarHBondContact O-CG 3.46Å; V36-L40 PolarHBondContact O-N 3.07Å; V36-I61 HydrophobicContact CG1-CD1 3.9Å; V36-F74 HydrophobicContact CB-CE2 4.24Å; V36-F74 HydrophobicContact CG1-CD2 4.37Å; V36-F74 HydrophobicContact CG1-CE2 3.75Å
37S95.3Very high93.6Very high0 Ų044.8 Ų44.80%023%0.234CC..Hα-helixtrans-63.7-38.6179.156.20000112.8L33 E34 L40 V41 H77L33-S37 PolarHBondContact O-N 3.29Å; L33-S37 PolarHBondContact O-OG 2.92Å; E34-S37 WeakPolarHBondContact CA-OG 3.37Å; E34-S37 PolarHBondContact O-N 3.12Å; E34-S37 PolarHBondContact O-OG 3.47Å; S37-L40 PolarHBondContact O-N 3.39Å; S37-V41 WeakPolarHBondContact O-CG2 3.43Å; S37-V41 PolarHBondContact O-N 3.43Å; S37-H77 VanDerWaalsContact OG-CB 3.26Å; S37-H77 WeakPolarHBondContact OG-CB 3.35Å
38N95.3Very high93.4Very high53 Ų5344.4 Ų44.428%0.28324%0.235SC..Hα-helixtrans-65.7-46.6178.9-68.6-16.6000111.1E34 K35 V36 L40 V41 D42 R81E34-N38 VanDerWaalsContact O-CG 3.28Å; E34-N38 PolarHBondContact O-N 2.94Å; E34-N38 PolarHBondContact O-ND2 3.12Å; K35-N38 PolarHBondContact O-N 3.21Å; V36-N38 VanDerWaalsContact C-N 3.34Å; V36-N38 PolarHBondContact O-N 2.68Å; N38-L40 VanDerWaalsContact C-N 3.32Å; N38-L40 PolarHBondContact O-N 3.24Å; N38-V41 PolarHBondContact O-N 2.91Å; N38-D42 WeakPolarHBondContact O-CB 3.49Å; N38-D42 PolarHBondContact O-N 3.15Å; N38-R81 WeakPolarHBondContact OD1-CD 3.31Å
39I94.4Very high93.3Very high30 Ų3050.5 Ų50.515%0.15427%0.266CS..Hα-helixtrans-58-45177-73.5170.1000111.5F13 T17 L20 K35 V36 D42 Q43F13-I39 HydrophobicContact CD1-CG2 4.1Å; F13-I39 HydrophobicContact CE1-CG2 3.54Å; F13-I39 HydrophobicContact CZ-CG2 4.41Å; T17-I39 HydrophobicContact CG2-CD1 4.32Å; T17-I39 HydrophobicContact CG2-CG2 3.48Å; T17-I39 VanDerWaalsContact CG2-CG2 3.48Å; L20-I39 HydrophobicContact CD2-CD1 3.8Å; K35-I39 HydrophobicContact CG-CD1 3.92Å; K35-I39 VanDerWaalsContact O-CG1 3.32Å; K35-I39 WeakPolarHBondContact O-CG1 3.41Å; K35-I39 PolarHBondContact O-N 3.44Å; V36-I39 PolarHBondContact O-N 3.49Å; I39-D42 PolarHBondContact O-N 2.89Å; I39-Q43 WeakPolarHBondContact O-CB 3.42Å; I39-Q43 PolarHBondContact O-N 3.23Å
40L94.2Very high93.2Very high0 Ų047 Ų470%024%0.242CC..Hα-helixtrans-64.4-43-179.6-71.4170.8000111.6F13 L21 V36 S37 N38 S44 F50 I57 I61 F74F13-L40 HydrophobicContact CZ-CD2 4.44Å; L21-L40 HydrophobicContact CD1-CD2 4.18Å; L21-L40 HydrophobicContact CD2-CD1 4.38Å; L21-L40 HydrophobicContact CD2-CD2 3.79Å; L21-L40 HydrophobicContact CD2-CG 4.03Å; V36-L40 HydrophobicContact CG1-CD1 3.92Å; V36-L40 HydrophobicContact CG1-CG 4.49Å; V36-L40 VanDerWaalsContact O-CG 3.3Å; V36-L40 WeakPolarHBondContact O-CG 3.46Å; V36-L40 PolarHBondContact O-N 3.07Å; S37-L40 PolarHBondContact O-N 3.39Å; N38-L40 VanDerWaalsContact C-N 3.32Å; N38-L40 PolarHBondContact O-N 3.24Å; L40-S44 VanDerWaalsContact O-CB 3.3Å; L40-S44 WeakPolarHBondContact O-CB 3.3Å; L40-S44 PolarHBondContact O-N 3.49Å; L40-S44 PolarHBondContact O-OG 2.97Å; L40-F50 HydrophobicContact CD2-CE1 4.17Å; L40-F50 HydrophobicContact CD2-CZ 3.64Å; L40-I57 HydrophobicContact CD1-CG2 4.3Å; L40-I57 HydrophobicContact CD2-CG2 4.04Å; L40-I61 HydrophobicContact CD1-CD1 3.97Å; L40-F74 HydrophobicContact CD1-CE2 4.02Å; L40-F74 HydrophobicContact CD1-CZ 3.64Å
41V95.1Very high93.2Very high0 Ų043.8 Ų43.80%022%0.219CC..Hα-helixtrans-65.7-49177.1175.80000110.3S37 N38 Q43 S44 L45 L78 R81 E85 F106S37-V41 WeakPolarHBondContact O-CG2 3.43Å; S37-V41 PolarHBondContact O-N 3.43Å; N38-V41 PolarHBondContact O-N 2.91Å; V41-Q43 VanDerWaalsContact C-N 3.3Å; V41-Q43 PolarHBondContact O-N 2.79Å; V41-S44 WeakPolarHBondContact O-CB 3.44Å; V41-S44 PolarHBondContact O-N 3.36Å; V41-S44 VanDerWaalsContact O-N 3.09Å; V41-L45 HydrophobicContact CG1-CD1 4.3Å; V41-L45 WeakPolarHBondContact O-CG 3.35Å; V41-L45 PolarHBondContact O-N 3.49Å; V41-L45 VanDerWaalsContact O-N 3.07Å; V41-L78 HydrophobicContact CG2-CD1 3.88Å; V41-R81 HydrophobicContact CB-CG 3.84Å; V41-R81 HydrophobicContact CG1-CG 3.88Å; V41-R81 HydrophobicContact CG2-CB 4.16Å; V41-R81 HydrophobicContact CG2-CG 3.66Å; V41-E85 HydrophobicContact CG1-CG 4.03Å; V41-F106 HydrophobicContact CB-CE1 4.33Å; V41-F106 HydrophobicContact CG1-CE1 4.45Å; V41-F106 HydrophobicContact CG2-CE1 3.79Å; V41-F106 HydrophobicContact CG2-CZ 4.29Å
42D94Very high92.8Very high60 Ų6046.9 Ų46.932%0.32123%0.231SC..Hα-helixtrans-62.1-37.5-176.7-66.8-16.2000112.2N38 I39 K46 R81N38-D42 WeakPolarHBondContact O-CB 3.49Å; N38-D42 PolarHBondContact O-N 3.15Å; I39-D42 PolarHBondContact O-N 2.89Å; D42-K46 WeakPolarHBondContact O-CG 3.48Å; D42-R81 IonicContact OD1-CZ 2.9Å; D42-R81 IonicContact OD1-NE 3.87Å; D42-R81 IonicContact OD1-NH2 3.86Å; D42-R81 PolarHBondContact OD1-NH2 3.25Å
43Q93.1Very high92.5Very high37 Ų3744.9 Ų44.917%0.17322%0.219CC..Hα-helixtrans-72.9-38.3174.7-170.669.74.500111.8S12 F13 I39 V41 L45 K46 D47 F50S12-Q43 PolarHBondContact OG-NE2 3.09Å; F13-Q43 HydrophobicContact CD1-CB 4.44Å; F13-Q43 HydrophobicContact CD1-CG 4.24Å; F13-Q43 HydrophobicContact CE1-CB 3.4Å; F13-Q43 VanDerWaalsContact CE1-CB 3.4Å; F13-Q43 HydrophobicContact CE1-CG 3.52Å; F13-Q43 HydrophobicContact CE2-CG 4.06Å; F13-Q43 HydrophobicContact CZ-CB 3.49Å; F13-Q43 VanDerWaalsContact CZ-CB 3.49Å; F13-Q43 HydrophobicContact CZ-CG 3.43Å; F13-Q43 VanDerWaalsContact CZ-CG 3.43Å; I39-Q43 WeakPolarHBondContact O-CB 3.42Å; I39-Q43 PolarHBondContact O-N 3.23Å; V41-Q43 VanDerWaalsContact C-N 3.3Å; V41-Q43 PolarHBondContact O-N 2.79Å; Q43-L45 PolarHBondContact O-N 3.45Å; Q43-K46 PolarHBondContact O-N 2.89Å; Q43-D47 HydrophobicContact CG-CB 4.42Å; Q43-D47 PolarHBondContact O-N 3.21Å; Q43-F50 HydrophobicContact CB-CD1 3.89Å; Q43-F50 HydrophobicContact CB-CE1 3.99Å; Q43-F50 HydrophobicContact CG-CB 4.45Å; Q43-F50 HydrophobicContact CG-CD1 3.63Å; Q43-F50 HydrophobicContact CG-CE1 4.1Å; Q43-F50 HydrophobicContact CG-CG 4.04Å
44S93.4Very high92.2Very high0 Ų044 Ų440%021%0.214CC..Hα-helixtrans-61.8-27.4177.8-59.50000112.3L40 V41 F50 S51 A54 C102 F106L40-S44 VanDerWaalsContact O-CB 3.3Å; L40-S44 WeakPolarHBondContact O-CB 3.3Å; L40-S44 PolarHBondContact O-N 3.49Å; L40-S44 PolarHBondContact O-OG 2.97Å; V41-S44 WeakPolarHBondContact O-CB 3.44Å; V41-S44 PolarHBondContact O-N 3.36Å; V41-S44 VanDerWaalsContact O-N 3.09Å; S44-F50 WeakPolarHBondContact OG-CE1 3.4Å; S44-S51 VanDerWaalsContact O-CB 3.25Å; S44-S51 WeakPolarHBondContact O-CB 3.33Å; S44-A54 WeakPolarHBondContact OG-CB 3.26Å; S44-C102 WeakPolarHBondContact O-CB 3.48Å; S44-F106 WeakPolarHBondContact OG-CD2 3.47Å; S44-F106 WeakPolarHBondContact OG-CE2 3.39Å
45L92.9Very high92Very high27 Ų2739.5 Ų39.514%0.14119%0.193CC..THydrogen-bonded Turntrans-78-17.9174.6-67.6175.6000114.1V41 Q43 E85 G99 Y103V41-L45 HydrophobicContact CG1-CD1 4.3Å; V41-L45 WeakPolarHBondContact O-CG 3.35Å; V41-L45 PolarHBondContact O-N 3.49Å; V41-L45 VanDerWaalsContact O-N 3.07Å; Q43-L45 PolarHBondContact O-N 3.45Å; L45-E85 HydrophobicContact CD1-CG 4.05Å; L45-E85 WeakPolarHBondContact CD1-OE2 3.49Å; L45-G99 WeakPolarHBondContact O-CA 3.21Å; L45-Y103 VanDerWaalsContact CD2-CB 3.49Å; L45-Y103 HydrophobicContact CD2-CD2 3.88Å; L45-Y103 HydrophobicContact CD2-CG 4.16Å
46K91.6Very high91.8Very high147 Ų14738 Ų3864%0.63918%0.184SC*.THydrogen-bonded Turntrans-105.3-33.4-174-68.3173.4-174.11730113D42 Q43D42-K46 WeakPolarHBondContact O-CG 3.48Å; Q43-K46 PolarHBondContact O-N 2.89Å
47D91.4Very high91.6Very high31 Ų3138 Ų3817%0.16618%0.184CC..  trans-114.3106.6-172.4179.9-11.8000110.2S12 Q43 L49 F50 S51S12-D47 WeakPolarHBondContact CB-OD2 3.48Å; S12-D47 PolarHBondContact OG-OD2 3.28Å; Q43-D47 HydrophobicContact CG-CB 4.42Å; Q43-D47 PolarHBondContact O-N 3.21Å; D47-L49 PolarHBondContact O-N 2.88Å; D47-L49 WeakPolarHBondContact OD1-CB 3.46Å; D47-L49 PolarHBondContact OD1-N 3.49Å; D47-F50 HydrophobicContact CB-CB 3.7Å; D47-F50 VanDerWaalsContact CG-CB 3.47Å; D47-F50 PolarHBondContact O-N 3.06Å; D47-F50 PolarHBondContact OD1-N 3.4Å; D47-F50 VanDerWaalsContact OD1-N 3.08Å; D47-F50 WeakPolarHBondContact OD2-CB 3.27Å; D47-S51 PolarHBondContact O-N 2.82Å
48P88.7Confident91.5Very high51 Ų5138 Ų3833%0.33118%0.184SC..Hα-helixtrans-62.3-27.1179.9-22.732.6000114.2S51 Q98P48-S51 PolarHBondContact O-OG 3.42Å; P48-Q98 HydrophobicContact CG-CG 4.18Å
49L88.1Confident91.4Very high129 Ų12939.9 Ų39.968%0.67519%0.188SC*.Hα-helixtrans-76.4-42.5176.7-62.7175.9000109.6D47 K52D47-L49 PolarHBondContact O-N 2.88Å; D47-L49 WeakPolarHBondContact OD1-CB 3.46Å; D47-L49 PolarHBondContact OD1-N 3.49Å; L49-K52 PolarHBondContact O-N 3.4Å
50F89.8Confident91.3Very high0 Ų040.1 Ų40.10%019%0.191CC..Hα-helixtrans-65.9-38.9177.3-172.4-107000112.5F13 L40 Q43 S44 D47 K52 E53 A54 I57F13-F50 AromaticContact CE2-CD2 3.95Å; F13-F50 HydrophobicContact CE2-CD2 3.95Å; F13-F50 HydrophobicContact CE2-CE1 4.1Å; F13-F50 AromaticContact CE2-CE2 3.44Å; F13-F50 HydrophobicContact CE2-CE2 3.44Å; F13-F50 VanDerWaalsContact CE2-CE2 3.44Å; F13-F50 HydrophobicContact CE2-CG 4.48Å; F13-F50 AromaticContact CE2-CZ 3.52Å; F13-F50 HydrophobicContact CE2-CZ 3.52Å; F13-F50 HydrophobicContact CZ-CD1 4.3Å; F13-F50 HydrophobicContact CZ-CD2 4.48Å; F13-F50 AromaticContact CZ-CE1 3.7Å; F13-F50 HydrophobicContact CZ-CE1 3.7Å; F13-F50 AromaticContact CZ-CE2 3.93Å; F13-F50 HydrophobicContact CZ-CE2 3.93Å; F13-F50 AromaticContact CZ-CZ 3.5Å; F13-F50 HydrophobicContact CZ-CZ 3.5Å; L40-F50 HydrophobicContact CD2-CE1 4.17Å; L40-F50 HydrophobicContact CD2-CZ 3.64Å; Q43-F50 HydrophobicContact CB-CD1 3.89Å; Q43-F50 HydrophobicContact CB-CE1 3.99Å; Q43-F50 HydrophobicContact CG-CB 4.45Å; Q43-F50 HydrophobicContact CG-CD1 3.63Å; Q43-F50 HydrophobicContact CG-CE1 4.1Å; Q43-F50 HydrophobicContact CG-CG 4.04Å; S44-F50 WeakPolarHBondContact OG-CE1 3.4Å; D47-F50 HydrophobicContact CB-CB 3.7Å; D47-F50 VanDerWaalsContact CG-CB 3.47Å; D47-F50 PolarHBondContact O-N 3.06Å; D47-F50 PolarHBondContact OD1-N 3.4Å; D47-F50 VanDerWaalsContact OD1-N 3.08Å; D47-F50 WeakPolarHBondContact OD2-CB 3.27Å; F50-K52 PolarHBondContact O-N 3.12Å; F50-K52 VanDerWaalsContact O-N 3.1Å; F50-E53 PolarHBondContact O-N 2.86Å; F50-A54 HydrophobicContact CD1-CB 4.05Å; F50-A54 HydrophobicContact CE1-CB 3.66Å; F50-A54 HydrophobicContact CZ-CB 3.95Å; F50-A54 WeakPolarHBondContact O-CB 3.43Å; F50-A54 PolarHBondContact O-N 3.4Å; F50-I57 HydrophobicContact CE2-CD1 3.43Å; F50-I57 VanDerWaalsContact CE2-CD1 3.43Å; F50-I57 HydrophobicContact CZ-CD1 3.72Å
51S90.6Very high91.3Very high1 Ų140.1 Ų40.11%0.00719%0.191CC..Hα-helixtrans-56.8-29.1179.277.40000113.1S44 D47 P48 T105 N109S44-S51 VanDerWaalsContact O-CB 3.25Å; S44-S51 WeakPolarHBondContact O-CB 3.33Å; D47-S51 PolarHBondContact O-N 2.82Å; P48-S51 PolarHBondContact O-OG 3.42Å; S51-T105 WeakPolarHBondContact OG-CG2 3.41Å; S51-N109 PolarHBondContact O-ND2 3.38Å; S51-N109 VanDerWaalsContact O-ND2 3.09Å
52K86.6Confident91.2Very high90 Ų9040.8 Ų40.839%0.39120%0.195SC..Hα-helixtrans-73.9-34.6175.6-65.6178.4-176.6-175.80113.3L49 F50 T105 N109L49-K52 PolarHBondContact O-N 3.4Å; F50-K52 PolarHBondContact O-N 3.12Å; F50-K52 VanDerWaalsContact O-N 3.1Å; K52-T105 HydrophobicContact CG-CG2 3.85Å; K52-N109 PolarHBondContact O-OD1 3.3Å
53E87.2Confident91Very high52 Ų5241.1 Ų41.124%0.24320%0.195CC..Hα-helixtrans-97.3-19.6-176.9-65.9-58.2129.100113.8R9 F50 G55 R56R9-E53 HydrophobicContact CB-CG 4.46Å; R9-E53 HydrophobicContact CG-CG 4.02Å; F50-E53 PolarHBondContact O-N 2.86Å; E53-G55 PolarHBondContact O-N 2.88Å; E53-R56 WeakPolarHBondContact O-CB 3.43Å; E53-R56 PolarHBondContact O-N 3.32Å; E53-R56 VanDerWaalsContact OE2-CD 3.31Å; E53-R56 WeakPolarHBondContact OE2-CD 3.21Å; E53-R56 IonicContact OE2-CZ 2.7Å; E53-R56 IonicContact OE2-NH1 3.12Å; E53-R56 PolarHBondContact OE2-NH1 3.48Å
54A89.9Confident91Very high0 Ų040.4 Ų40.40%020%0.195CC..Hα-helixtrans-58.4-27.8-173.300000113.3S44 F50 R56 I57 C58 F106S44-A54 WeakPolarHBondContact OG-CB 3.26Å; F50-A54 HydrophobicContact CD1-CB 4.05Å; F50-A54 HydrophobicContact CE1-CB 3.66Å; F50-A54 HydrophobicContact CZ-CB 3.95Å; F50-A54 WeakPolarHBondContact O-CB 3.43Å; F50-A54 PolarHBondContact O-N 3.4Å; A54-R56 VanDerWaalsContact C-N 3.33Å; A54-R56 PolarHBondContact O-N 3.39Å; A54-I57 PolarHBondContact O-N 3.27Å; A54-C58 WeakPolarHBondContact O-CB 3.29Å; A54-C58 PolarHBondContact O-N 3.5Å; A54-C58 PolarHBondContact O-SG 3.36Å; A54-F106 HydrophobicContact CB-CD2 3.71Å; A54-F106 HydrophobicContact CB-CE2 3.45Å; A54-F106 VanDerWaalsContact CB-CE2 3.45Å
55G89.9Confident91Very high0 Ų040.5 Ų40.50%020%0.195CC..Hα-helixtrans-58.8-40.1173.700000113.5E53 C58 Y59E53-G55 PolarHBondContact O-N 2.88Å; G55-C58 PolarHBondContact O-N 3.26Å; G55-Y59 WeakPolarHBondContact O-CB 2.95Å; G55-Y59 PolarHBondContact O-N 3.46Å
56R90.6Very high90.9Very high90 Ų9040.8 Ų40.834%0.3420%0.201SC..Hα-helixtrans-68.3-40.8179.4-65.1174.473.1-158.73.1112E53 A54 Y59 T60 Y113E53-R56 WeakPolarHBondContact O-CB 3.43Å; E53-R56 PolarHBondContact O-N 3.32Å; E53-R56 VanDerWaalsContact OE2-CD 3.31Å; E53-R56 WeakPolarHBondContact OE2-CD 3.21Å; E53-R56 IonicContact OE2-CZ 2.7Å; E53-R56 IonicContact OE2-NH1 3.12Å; E53-R56 PolarHBondContact OE2-NH1 3.48Å; A54-R56 VanDerWaalsContact C-N 3.33Å; A54-R56 PolarHBondContact O-N 3.39Å; R56-Y59 PolarHBondContact O-N 2.8Å; R56-T60 WeakPolarHBondContact O-CB 3.46Å; R56-T60 PolarHBondContact O-N 3.34Å; R56-T60 PolarHBondContact O-OG1 3.44Å; R56-Y113 HydrophobicContact CG-CD1 3.89Å; R56-Y113 HydrophobicContact CG-CD2 4.27Å; R56-Y113 HydrophobicContact CG-CE1 3.38Å; R56-Y113 HydrophobicContact CG-CE2 3.8Å; R56-Y113 HydrophobicContact CG-CG 4.32Å
57I91.6Very high90.8Very high1 Ų142.2 Ų42.21%0.00521%0.208CC..Hα-helixtrans-64.1-49.4176.4-59.6171.6000109.5Y8 I10 L25 L40 F50 A54 Y59 T60 I61Y8-I57 HydrophobicContact CD1-CD1 4.5Å; Y8-I57 HydrophobicContact CD1-CG1 3.54Å; Y8-I57 HydrophobicContact CE1-CG1 4.31Å; Y8-I57 HydrophobicContact CG-CG1 4.04Å; Y8-I57 WeakPolarHBondContact O-CD1 3.35Å; I10-I57 HydrophobicContact CG2-CD1 4.08Å; L25-I57 HydrophobicContact CD2-CG2 4.39Å; L40-I57 HydrophobicContact CD1-CG2 4.3Å; L40-I57 HydrophobicContact CD2-CG2 4.04Å; F50-I57 HydrophobicContact CE2-CD1 3.43Å; F50-I57 VanDerWaalsContact CE2-CD1 3.43Å; F50-I57 HydrophobicContact CZ-CD1 3.72Å; A54-I57 PolarHBondContact O-N 3.27Å; I57-Y59 VanDerWaalsContact C-N 3.31Å; I57-Y59 PolarHBondContact O-N 2.96Å; I57-T60 PolarHBondContact O-N 2.99Å; I57-T60 VanDerWaalsContact O-N 3.14Å; I57-I61 HydrophobicContact CG2-CD1 3.86Å; I57-I61 HydrophobicContact CG2-CG1 4.45Å; I57-I61 WeakPolarHBondContact O-CG1 3.47Å; I57-I61 PolarHBondContact O-N 3.38Å
58C93.9Very high90.7Very high0 Ų044.9 Ų44.90%022%0.219CC..Hα-helixtrans-58.3-44.6178.9-68.20000111.6A54 G55 I61 V62 F74 L78 I110A54-C58 WeakPolarHBondContact O-CB 3.29Å; A54-C58 PolarHBondContact O-N 3.5Å; A54-C58 PolarHBondContact O-SG 3.36Å; G55-C58 PolarHBondContact O-N 3.26Å; C58-I61 PolarHBondContact O-N 3.42Å; C58-V62 WeakPolarHBondContact O-CG2 3.22Å; C58-V62 PolarHBondContact O-N 3.1Å; C58-F74 HydrophobicContact CB-CE1 4.2Å; C58-L78 HydrophobicContact CB-CD2 3.74Å; C58-I110 HydrophobicContact CB-CD1 3.64Å
59Y92.4Very high90.6Very high91 Ų9146.8 Ų46.836%0.35723%0.226SC..Hα-helixtrans-58.4-48.5174.2174.1-102000112G55 R56 I57 I61 V62 Q63 Y113 L114G55-Y59 WeakPolarHBondContact O-CB 2.95Å; G55-Y59 PolarHBondContact O-N 3.46Å; R56-Y59 PolarHBondContact O-N 2.8Å; I57-Y59 VanDerWaalsContact C-N 3.31Å; I57-Y59 PolarHBondContact O-N 2.96Å; Y59-I61 VanDerWaalsContact C-N 3.33Å; Y59-I61 PolarHBondContact O-N 3.11Å; Y59-V62 PolarHBondContact O-N 2.9Å; Y59-Q63 HydrophobicContact CD1-CG 4.16Å; Y59-Q63 HydrophobicContact CD2-CG 4.04Å; Y59-Q63 HydrophobicContact CE1-CG 3.76Å; Y59-Q63 HydrophobicContact CE2-CG 3.64Å; Y59-Q63 HydrophobicContact CG-CG 4.3Å; Y59-Q63 VanDerWaalsContact CZ-CG 3.48Å; Y59-Q63 VanDerWaalsContact O-CG 3.26Å; Y59-Q63 WeakPolarHBondContact O-CG 3.34Å; Y59-Q63 PolarHBondContact O-N 2.87Å; Y59-Q63 PolarHBondContact OH-NE2 3.48Å; Y59-Y113 WeakPolarHBondContact CD2-O 3.44Å; Y59-L114 HydrophobicContact CD2-CD1 4.4Å
60T92.4Very high90.5Very high35 Ų3547.7 Ų47.722%0.21523%0.232CC..Hα-helixtrans-61.4-41.9-178.3-52.20000111.7Y8 L25 R56 I57 Q63 A64Y8-T60 WeakPolarHBondContact OH-CG2 3.22Å; Y8-T60 PolarHBondContact OH-OG1 3.44Å; L25-T60 HydrophobicContact CD2-CG2 3.56Å; R56-T60 WeakPolarHBondContact O-CB 3.46Å; R56-T60 PolarHBondContact O-N 3.34Å; R56-T60 PolarHBondContact O-OG1 3.44Å; I57-T60 PolarHBondContact O-N 2.99Å; I57-T60 VanDerWaalsContact O-N 3.14Å; T60-Q63 PolarHBondContact O-N 3.21Å; T60-A64 WeakPolarHBondContact O-CB 3.5Å; T60-A64 PolarHBondContact O-N 2.86Å
61I93.3Very high90.4Very high0 Ų048.4 Ų48.40%024%0.239CC..Hα-helixtrans-65-44.2176.9-63.1170.6000111A24 L25 L33 V36 L40 I57 C58 Y59 Q63 A64 E65 F74A24-I61 HydrophobicContact CB-CD1 4.18Å; A24-I61 HydrophobicContact CB-CG1 4.48Å; L25-I61 HydrophobicContact CD2-CG1 3.75Å; L25-I61 HydrophobicContact CG-CG1 4.29Å; L33-I61 HydrophobicContact CD2-CG2 4.28Å; V36-I61 HydrophobicContact CG1-CD1 3.9Å; L40-I61 HydrophobicContact CD1-CD1 3.97Å; I57-I61 HydrophobicContact CG2-CD1 3.86Å; I57-I61 HydrophobicContact CG2-CG1 4.45Å; I57-I61 WeakPolarHBondContact O-CG1 3.47Å; I57-I61 PolarHBondContact O-N 3.38Å; C58-I61 PolarHBondContact O-N 3.42Å; Y59-I61 VanDerWaalsContact C-N 3.33Å; Y59-I61 PolarHBondContact O-N 3.11Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 3.36Å; I61-A64 PolarHBondContact O-N 2.89Å; I61-E65 WeakPolarHBondContact O-CB 3.26Å; I61-E65 PolarHBondContact O-N 3Å; I61-F74 HydrophobicContact CB-CD1 3.98Å; I61-F74 HydrophobicContact CB-CE1 3.9Å; I61-F74 HydrophobicContact CB-CG 4.47Å; I61-F74 HydrophobicContact CB-CZ 4.31Å; I61-F74 HydrophobicContact CD1-CE1 4.45Å; I61-F74 HydrophobicContact CD1-CE2 4.31Å; I61-F74 HydrophobicContact CD1-CZ 4.03Å; I61-F74 HydrophobicContact CG2-CB 4.15Å; I61-F74 HydrophobicContact CG2-CD1 3.56Å; I61-F74 HydrophobicContact CG2-CD2 3.9Å; I61-F74 HydrophobicContact CG2-CE1 3.89Å; I61-F74 HydrophobicContact CG2-CE2 4.2Å; I61-F74 HydrophobicContact CG2-CG 3.57Å; I61-F74 HydrophobicContact CG2-CZ 4.2Å
62V92.9Very high90.5Very high14 Ų1451.6 Ų51.69%0.08526%0.259CS..Hα-helixtrans-60.1-42.3176.1169.50000111.4C58 Y59 E65 A66 F74 R75 L114C58-V62 WeakPolarHBondContact O-CG2 3.22Å; C58-V62 PolarHBondContact O-N 3.1Å; Y59-V62 PolarHBondContact O-N 2.9Å; V62-E65 PolarHBondContact O-N 3.22Å; V62-A66 WeakPolarHBondContact O-CB 3.45Å; V62-A66 PolarHBondContact O-N 3.4Å; V62-F74 HydrophobicContact CG2-CD1 3.64Å; V62-F74 HydrophobicContact CG2-CE1 4.14Å; V62-R75 HydrophobicContact CG2-CB 3.87Å; V62-R75 HydrophobicContact CG2-CG 4.47Å; V62-L114 HydrophobicContact CB-CD1 4.05Å; V62-L114 HydrophobicContact CG1-CD1 4.4Å; V62-L114 HydrophobicContact CG2-CD1 3.81Å; V62-L114 HydrophobicContact CG2-CD2 4.38Å
63Q91.1Very high90.8Very high68 Ų6850 Ų5032%0.31826%0.257SS..Hα-helixtrans-68.3-39.2178.4-65.8-64.58800112.1Y59 T60 I61 K67Y59-Q63 HydrophobicContact CD1-CG 4.16Å; Y59-Q63 HydrophobicContact CD2-CG 4.04Å; Y59-Q63 HydrophobicContact CE1-CG 3.76Å; Y59-Q63 HydrophobicContact CE2-CG 3.64Å; Y59-Q63 HydrophobicContact CG-CG 4.3Å; Y59-Q63 VanDerWaalsContact CZ-CG 3.48Å; Y59-Q63 VanDerWaalsContact O-CG 3.26Å; Y59-Q63 WeakPolarHBondContact O-CG 3.34Å; Y59-Q63 PolarHBondContact O-N 2.87Å; Y59-Q63 PolarHBondContact OH-NE2 3.48Å; T60-Q63 PolarHBondContact O-N 3.21Å; I61-Q63 VanDerWaalsContact C-N 3.31Å; I61-Q63 PolarHBondContact O-N 3.36Å; Q63-K67 WeakPolarHBondContact O-CB 3.35Å; Q63-K67 VanDerWaalsContact O-CG 3.22Å; Q63-K67 WeakPolarHBondContact O-CG 3.37Å; Q63-K67 PolarHBondContact O-N 3.05Å
64A91.8Very high91.2Very high21 Ų2147.5 Ų47.517%0.17425%0.245CC..Hα-helixtrans-64-44.1175.400000111.2P28 T60 I61 K67 Q68P28-A64 HydrophobicContact CG-CB 3.58Å; T60-A64 WeakPolarHBondContact O-CB 3.5Å; T60-A64 PolarHBondContact O-N 2.86Å; I61-A64 PolarHBondContact O-N 2.89Å; A64-K67 PolarHBondContact O-N 3.47Å; A64-Q68 WeakPolarHBondContact O-CB 3.37Å; A64-Q68 PolarHBondContact O-N 3.16Å
65E93.7Very high91.4Very high2 Ų250.8 Ų50.81%0.00926%0.257CS..Hα-helixtrans-62.3-50.6178.1-174.3-173.3-168.400110.7P28 L33 I61 V62 K67 Q68 N69 T72 V73 F74P28-E65 HydrophobicContact CB-CB 4.1Å; P28-E65 HydrophobicContact CG-CB 4.25Å; L33-E65 HydrophobicContact CD1-CG 4.43Å; I61-E65 WeakPolarHBondContact O-CB 3.26Å; I61-E65 PolarHBondContact O-N 3Å; V62-E65 PolarHBondContact O-N 3.22Å; E65-K67 VanDerWaalsContact C-N 3.31Å; E65-K67 PolarHBondContact O-N 3.21Å; E65-Q68 PolarHBondContact O-N 3Å; E65-Q68 VanDerWaalsContact O-N 3.14Å; E65-N69 PolarHBondContact O-N 3.14Å; E65-N69 VanDerWaalsContact O-N 3.11Å; E65-N69 PolarHBondContact O-OD1 3.26Å; E65-T72 PolarHBondContact OE1-N 2.68Å; E65-V73 WeakPolarHBondContact OE1-CA 2.88Å; E65-V73 WeakPolarHBondContact OE1-CB 3.41Å; E65-V73 PolarHBondContact OE1-N 2.98Å; E65-V73 PolarHBondContact OE2-N 2.84Å; E65-F74 PolarHBondContact OE1-N 3Å; E65-F74 VanDerWaalsContact OE2-CB 3.28Å; E65-F74 WeakPolarHBondContact OE2-CB 3.47Å; E65-F74 PolarHBondContact OE2-N 3.4Å
66A90.8Very high91.6Very high33 Ų3357.1 Ų57.127%0.27328%0.281SS..Hα-helixtrans-59.2-41.3179.100000112.1V62 N70V62-A66 WeakPolarHBondContact O-CB 3.45Å; V62-A66 PolarHBondContact O-N 3.4Å; A66-N70 VanDerWaalsContact O-CA 3.23Å; A66-N70 WeakPolarHBondContact O-CA 3.49Å; A66-N70 PolarHBondContact O-N 3.41Å; A66-N70 PolarHBondContact O-OD1 2.83Å
67K89.9Confident91.9Very high178 Ų17854.7 Ų54.777%0.77427%0.274SS*.Hα-helixtrans-66.6-34.6177.2-76.3175.3-177.9179.80113.3Q63 A64 E65Q63-K67 WeakPolarHBondContact O-CB 3.35Å; Q63-K67 VanDerWaalsContact O-CG 3.22Å; Q63-K67 WeakPolarHBondContact O-CG 3.37Å; Q63-K67 PolarHBondContact O-N 3.05Å; A64-K67 PolarHBondContact O-N 3.47Å; E65-K67 VanDerWaalsContact C-N 3.31Å; E65-K67 PolarHBondContact O-N 3.21Å
68Q89.7Confident92.1Very high87 Ų8754.7 Ų54.741%0.40727%0.273SS..Hα-helixtrans-78.7-43-174.4-172.9174.421.800112.5D27 S29 A64 E65D27-Q68 PolarHBondContact OD1-NE2 2.9Å; D27-Q68 PolarHBondContact OD1-OE1 3.34Å; S29-Q68 PolarHBondContact OG-NE2 3.07Å; A64-Q68 WeakPolarHBondContact O-CB 3.37Å; A64-Q68 PolarHBondContact O-N 3.16Å; E65-Q68 PolarHBondContact O-N 3Å; E65-Q68 VanDerWaalsContact O-N 3.14Å
69N87Confident92.2Very high90 Ų9056.6 Ų56.648%0.48128%0.283SS..Hα-helixtrans-146.315.1-17265.27.1000114.6E65 G71E65-N69 PolarHBondContact O-N 3.14Å; E65-N69 VanDerWaalsContact O-N 3.11Å; E65-N69 PolarHBondContact O-OD1 3.26Å; N69-G71 PolarHBondContact O-N 2.83Å; N69-G71 VanDerWaalsContact O-N 3.13Å; N69-G71 WeakPolarHBondContact OD1-CA 3.43Å; N69-G71 PolarHBondContact OD1-N 3.27Å
70N85.8Confident92.3Very high149 Ų14956 Ų5680%0.79729%0.286SS*.SBendtrans53.126.5-170.5-63.8-42.3000113.2A66A66-N70 VanDerWaalsContact O-CA 3.23Å; A66-N70 WeakPolarHBondContact O-CA 3.49Å; A66-N70 PolarHBondContact O-N 3.41Å; A66-N70 PolarHBondContact O-OD1 2.83Å
71G87.2Confident92.5Very high15 Ų1556.2 Ų56.216%0.15528%0.283CS..  trans-77.6156.7-178.300000112.8N69N69-G71 PolarHBondContact O-N 2.83Å; N69-G71 VanDerWaalsContact O-N 3.13Å; N69-G71 WeakPolarHBondContact OD1-CA 3.43Å; N69-G71 PolarHBondContact OD1-N 3.27Å
72T92.1Very high92.6Very high68 Ų6856.4 Ų56.442%0.41728%0.284SS..  trans-137.225.1174.871.20000111.4E65 R76E65-T72 PolarHBondContact OE1-N 2.68Å; T72-R76 WeakPolarHBondContact O-CB 3.47Å; T72-R76 PolarHBondContact O-N 2.9Å; T72-R76 VanDerWaalsContact O-N 3.13Å
73V94.5Very high92.7Very high56 Ų5660.9 Ų60.934%0.33930%0.304SS..Hα-helixtrans-67.4-50.3-174.8-179.50000109.3L33 E65 R75 R76 H77L33-V73 HydrophobicContact CD1-CB 4.19Å; L33-V73 HydrophobicContact CD1-CG1 4.44Å; E65-V73 WeakPolarHBondContact OE1-CA 2.88Å; E65-V73 WeakPolarHBondContact OE1-CB 3.41Å; E65-V73 PolarHBondContact OE1-N 2.98Å; E65-V73 PolarHBondContact OE2-N 2.84Å; V73-R75 PolarHBondContact O-N 2.88Å; V73-R76 PolarHBondContact O-N 2.96Å; V73-H77 PolarHBondContact O-CD2 3.03Å; V73-H77 PolarHBondContact O-N 3.19Å
74F95Very high93Very high0 Ų062.4 Ų62.40%031%0.311CS..Hα-helixtrans-60.2-48.6179.6177.3-103000111.3L33 V36 L40 C58 I61 V62 E65 R76 H77 L78L33-F74 HydrophobicContact CB-CB 4.1Å; L33-F74 HydrophobicContact CB-CD2 4.26Å; L33-F74 HydrophobicContact CD1-CB 4.09Å; L33-F74 HydrophobicContact CD2-CB 4.12Å; L33-F74 HydrophobicContact CD2-CD2 4.23Å; L33-F74 HydrophobicContact CD2-CG 4.48Å; L33-F74 HydrophobicContact CG-CB 4.32Å; V36-F74 HydrophobicContact CB-CE2 4.24Å; V36-F74 HydrophobicContact CG1-CD2 4.37Å; V36-F74 HydrophobicContact CG1-CE2 3.75Å; L40-F74 HydrophobicContact CD1-CE2 4.02Å; L40-F74 HydrophobicContact CD1-CZ 3.64Å; C58-F74 HydrophobicContact CB-CE1 4.2Å; I61-F74 HydrophobicContact CB-CD1 3.98Å; I61-F74 HydrophobicContact CB-CE1 3.9Å; I61-F74 HydrophobicContact CB-CG 4.47Å; I61-F74 HydrophobicContact CB-CZ 4.31Å; I61-F74 HydrophobicContact CD1-CE1 4.45Å; I61-F74 HydrophobicContact CD1-CE2 4.31Å; I61-F74 HydrophobicContact CD1-CZ 4.03Å; I61-F74 HydrophobicContact CG2-CB 4.15Å; I61-F74 HydrophobicContact CG2-CD1 3.56Å; I61-F74 HydrophobicContact CG2-CD2 3.9Å; I61-F74 HydrophobicContact CG2-CE1 3.89Å; I61-F74 HydrophobicContact CG2-CE2 4.2Å; I61-F74 HydrophobicContact CG2-CG 3.57Å; I61-F74 HydrophobicContact CG2-CZ 4.2Å; V62-F74 HydrophobicContact CG2-CD1 3.64Å; V62-F74 HydrophobicContact CG2-CE1 4.14Å; E65-F74 PolarHBondContact OE1-N 3Å; E65-F74 VanDerWaalsContact OE2-CB 3.28Å; E65-F74 WeakPolarHBondContact OE2-CB 3.47Å; E65-F74 PolarHBondContact OE2-N 3.4Å; F74-R76 VanDerWaalsContact C-N 3.27Å; F74-R76 PolarHBondContact O-N 2.97Å; F74-H77 PolarHBondContact O-N 3.26Å; F74-L78 HydrophobicContact CE1-CD2 4.01Å; F74-L78 HydrophobicContact CZ-CD2 4.39Å; F74-L78 WeakPolarHBondContact O-CB 3.2Å; F74-L78 PolarHBondContact O-N 2.99Å
75R94.2Very high93.2Very high69 Ų6962.1 Ų62.126%0.2631%0.306SS..Hα-helixtrans-53.9-44.4177.4-176179.168.1-176.60.1111.9V62 V73 L79 L114V62-R75 HydrophobicContact CG2-CB 3.87Å; V62-R75 HydrophobicContact CG2-CG 4.47Å; V73-R75 PolarHBondContact O-N 2.88Å; R75-L79 HydrophobicContact CG-CD1 3.96Å; R75-L79 HydrophobicContact CG-CG 4.48Å; R75-L79 WeakPolarHBondContact O-CB 3.47Å; R75-L79 VanDerWaalsContact O-CG 3.28Å; R75-L79 WeakPolarHBondContact O-CG 3.33Å; R75-L79 PolarHBondContact O-N 2.77Å; R75-L114 HydrophobicContact CG-CD2 3.98Å
76R94.6Very high93.3Very high133 Ų13363.3 Ų63.350%0.50231%0.312SS..Hα-helixtrans-65.7-45.8-180178179.353.9149.61111.8T72 V73 F74 L78 L79 N80T72-R76 WeakPolarHBondContact O-CB 3.47Å; T72-R76 PolarHBondContact O-N 2.9Å; T72-R76 VanDerWaalsContact O-N 3.13Å; V73-R76 PolarHBondContact O-N 2.96Å; F74-R76 VanDerWaalsContact C-N 3.27Å; F74-R76 PolarHBondContact O-N 2.97Å; R76-L78 VanDerWaalsContact C-N 3.35Å; R76-L79 PolarHBondContact O-N 3.36Å; R76-N80 WeakPolarHBondContact O-CB 3.16Å; R76-N80 PolarHBondContact O-N 3.26Å; R76-N80 PolarHBondContact O-ND2 2.88Å
77H96.6Very high93.6Very high39 Ų3968.8 Ų68.818%0.18133%0.329CS..Hα-helixtrans-64-41.6177.2-71.9-74.1000111.8E34 S37 V73 F74 N80 R81E34-H77 IonicContact OE1-ND1 3.64Å; S37-H77 VanDerWaalsContact OG-CB 3.26Å; S37-H77 WeakPolarHBondContact OG-CB 3.35Å; V73-H77 PolarHBondContact O-CD2 3.03Å; V73-H77 PolarHBondContact O-N 3.19Å; F74-H77 PolarHBondContact O-N 3.26Å; H77-N80 PolarHBondContact O-N 2.94Å; H77-R81 WeakPolarHBondContact O-CB 3.39Å; H77-R81 PolarHBondContact O-N 3.28Å
78L95.8Very high93.9Very high0 Ų065.2 Ų65.20%032%0.316CS..Hα-helixtrans-58.2-49.6175.3179.164.1000112.2V41 C58 F74 R76 R81 L82 F106 I110 L114V41-L78 HydrophobicContact CG2-CD1 3.88Å; C58-L78 HydrophobicContact CB-CD2 3.74Å; F74-L78 HydrophobicContact CE1-CD2 4.01Å; F74-L78 HydrophobicContact CZ-CD2 4.39Å; F74-L78 WeakPolarHBondContact O-CB 3.2Å; F74-L78 PolarHBondContact O-N 2.99Å; R76-L78 VanDerWaalsContact C-N 3.35Å; L78-R81 PolarHBondContact O-N 3.12Å; L78-L82 HydrophobicContact CD1-CD1 4.39Å; L78-L82 HydrophobicContact CG-CD1 4.18Å; L78-L82 WeakPolarHBondContact O-CB 3.41Å; L78-L82 WeakPolarHBondContact O-CG 3.39Å; L78-L82 PolarHBondContact O-N 3.43Å; L78-F106 HydrophobicContact CD1-CE1 4.46Å; L78-F106 HydrophobicContact CD1-CZ 4.07Å; L78-I110 HydrophobicContact CD2-CD1 4.08Å; L78-L114 HydrophobicContact CD2-CD2 4.35Å
79L94.8Very high94.2Very high40 Ų4064.1 Ų64.121%0.20931%0.308CS..Hα-helixtrans-66.7-38.7179.6-68.5172.3000112.3R75 R76 L82 Q83 M121 L124R75-L79 HydrophobicContact CG-CD1 3.96Å; R75-L79 HydrophobicContact CG-CG 4.48Å; R75-L79 WeakPolarHBondContact O-CB 3.47Å; R75-L79 VanDerWaalsContact O-CG 3.28Å; R75-L79 WeakPolarHBondContact O-CG 3.33Å; R75-L79 PolarHBondContact O-N 2.77Å; R76-L79 PolarHBondContact O-N 3.36Å; L79-L82 HydrophobicContact CD2-CD1 4.38Å; L79-L82 PolarHBondContact O-N 3.12Å; L79-Q83 WeakPolarHBondContact O-CB 3.36Å; L79-Q83 PolarHBondContact O-N 3.2Å; L79-M121 HydrophobicContact CD1-CE 4.43Å; L79-M121 HydrophobicContact CD1-SD 4.26Å; L79-M121 HydrophobicContact CD2-CE 3.92Å; L79-L124 HydrophobicContact CD2-CD1 4.33Å; L79-L124 HydrophobicContact CD2-CD2 3.89Å; L79-L124 HydrophobicContact CD2-CG 4.25Å
80N95.9Very high94.7Very high78 Ų7862.9 Ų62.942%0.41730%0.299SS..Hα-helixtrans-62.3-44.2175.4-73.7-14.6000111.4R76 H77 Q83 Q84R76-N80 WeakPolarHBondContact O-CB 3.16Å; R76-N80 PolarHBondContact O-N 3.26Å; R76-N80 PolarHBondContact O-ND2 2.88Å; H77-N80 PolarHBondContact O-N 2.94Å; N80-Q83 PolarHBondContact O-N 3.49Å; N80-Q84 WeakPolarHBondContact O-CG 3.49Å; N80-Q84 PolarHBondContact O-N 3.5Å; N80-Q84 VanDerWaalsContact O-N 3.09Å
81R96Very high95.3Very high40 Ų4061 Ų6115%0.15129%0.285CS..Hα-helixtrans-66.4-43.3177.9-174.768.3-175.1104.812111.6N38 V41 D42 H77 L78 Q83 Q84 E85N38-R81 WeakPolarHBondContact OD1-CD 3.31Å; V41-R81 HydrophobicContact CB-CG 3.84Å; V41-R81 HydrophobicContact CG1-CG 3.88Å; V41-R81 HydrophobicContact CG2-CB 4.16Å; V41-R81 HydrophobicContact CG2-CG 3.66Å; D42-R81 IonicContact OD1-CZ 2.9Å; D42-R81 IonicContact OD1-NE 3.87Å; D42-R81 IonicContact OD1-NH2 3.86Å; D42-R81 PolarHBondContact OD1-NH2 3.25Å; H77-R81 WeakPolarHBondContact O-CB 3.39Å; H77-R81 PolarHBondContact O-N 3.28Å; L78-R81 PolarHBondContact O-N 3.12Å; R81-Q83 VanDerWaalsContact C-N 3.29Å; R81-Q83 PolarHBondContact O-N 3.12Å; R81-Q84 WeakPolarHBondContact O-CB 3.38Å; R81-Q84 PolarHBondContact O-N 2.77Å; R81-E85 IonicContact CZ-OE1 3.71Å; R81-E85 IonicContact NH1-OE1 3.79Å; R81-E85 PolarHBondContact NH1-OE1 3.06Å; R81-E85 IonicContact NH2-OE1 3.76Å; R81-E85 PolarHBondContact NH2-OE1 3.27Å; R81-E85 PolarHBondContact O-N 3.28Å; R81-E85 VanDerWaalsContact O-N 3.15Å
82L95.6Very high95.7Very high4 Ų460.6 Ų60.62%0.02128%0.28CS..Hα-helixtrans-58-39.9173.1-82.4169.6000112.7L78 L79 E85 F86 Y103 F106 I110L78-L82 HydrophobicContact CD1-CD1 4.39Å; L78-L82 HydrophobicContact CG-CD1 4.18Å; L78-L82 WeakPolarHBondContact O-CB 3.41Å; L78-L82 WeakPolarHBondContact O-CG 3.39Å; L78-L82 PolarHBondContact O-N 3.43Å; L79-L82 HydrophobicContact CD2-CD1 4.38Å; L79-L82 PolarHBondContact O-N 3.12Å; L82-E85 PolarHBondContact O-N 2.97Å; L82-F86 WeakPolarHBondContact O-CB 3.23Å; L82-F86 PolarHBondContact O-N 3.5Å; L82-Y103 HydrophobicContact CD2-CE2 4.12Å; L82-Y103 PolarHBondContact O-OH 2.89Å; L82-F106 HydrophobicContact CD2-CD1 3.5Å; L82-F106 HydrophobicContact CD2-CE1 3.44Å; L82-F106 VanDerWaalsContact CD2-CE1 3.44Å; L82-F106 HydrophobicContact CG-CE1 4.14Å; L82-I110 HydrophobicContact CD1-CB 4.32Å; L82-I110 HydrophobicContact CD1-CG1 4.13Å; L82-I110 HydrophobicContact CD1-CG2 4.01Å
83Q95.6Very high96Very high108 Ų10859.2 Ų59.251%0.50527%0.267SS..Hα-helixtrans-68.8-33.7177.9-168.5-17533.900112.2L79 N80 R81 F86 K87L79-Q83 WeakPolarHBondContact O-CB 3.36Å; L79-Q83 PolarHBondContact O-N 3.2Å; N80-Q83 PolarHBondContact O-N 3.49Å; R81-Q83 VanDerWaalsContact C-N 3.29Å; R81-Q83 PolarHBondContact O-N 3.12Å; Q83-F86 WeakPolarHBondContact O-CB 3.33Å; Q83-F86 PolarHBondContact O-N 3.09Å; Q83-K87 WeakPolarHBondContact O-CG 3.42Å; Q83-K87 PolarHBondContact O-N 3.08Å
84Q96Very high96.1Very high100 Ų10063.6 Ų63.647%0.46728%0.282SS..Hα-helixtrans-63.5-50.1173.5-70.6168.2-4.800110.6N80 R81 F86 K87 E88N80-Q84 WeakPolarHBondContact O-CG 3.49Å; N80-Q84 PolarHBondContact O-N 3.5Å; N80-Q84 VanDerWaalsContact O-N 3.09Å; R81-Q84 WeakPolarHBondContact O-CB 3.38Å; R81-Q84 PolarHBondContact O-N 2.77Å; Q84-F86 VanDerWaalsContact C-N 3.26Å; Q84-F86 PolarHBondContact O-N 2.98Å; Q84-K87 WeakPolarHBondContact O-CB 3.47Å; Q84-K87 PolarHBondContact O-N 3.38Å; Q84-K87 VanDerWaalsContact O-N 3.09Å; Q84-E88 PolarHBondContact O-N 2.86Å
85E96.3Very high96.1Very high15 Ų1572.2 Ų72.27%0.0731%0.314CS..Hα-helixtrans-60.8-35.8176.2-68.5-59.2139.800112.3V41 L45 R81 L82 K87 E88 R89 Y103V41-E85 HydrophobicContact CG1-CG 4.03Å; L45-E85 HydrophobicContact CD1-CG 4.05Å; L45-E85 WeakPolarHBondContact CD1-OE2 3.49Å; R81-E85 IonicContact CZ-OE1 3.71Å; R81-E85 IonicContact NH1-OE1 3.79Å; R81-E85 PolarHBondContact NH1-OE1 3.06Å; R81-E85 IonicContact NH2-OE1 3.76Å; R81-E85 PolarHBondContact NH2-OE1 3.27Å; R81-E85 PolarHBondContact O-N 3.28Å; R81-E85 VanDerWaalsContact O-N 3.15Å; L82-E85 PolarHBondContact O-N 2.97Å; E85-K87 VanDerWaalsContact C-N 3.3Å; E85-K87 PolarHBondContact O-N 3.28Å; E85-E88 PolarHBondContact O-N 2.94Å; E85-R89 PolarHBondContact O-N 3Å; E85-R89 VanDerWaalsContact O-N 3.13Å; E85-Y103 HydrophobicContact CB-CD2 3.79Å; E85-Y103 HydrophobicContact CB-CE2 3.4Å; E85-Y103 HydrophobicContact CG-CE2 4.49Å
86F96.7Very high96.2Very high27 Ų2771.4 Ų71.412%0.11832%0.319CS..Hα-helixtrans-59.8-40.7174.8-173.8-108.3000112.6L82 Q83 Q84 E88 R89 Y103 P127 D130L82-F86 WeakPolarHBondContact O-CB 3.23Å; L82-F86 PolarHBondContact O-N 3.5Å; Q83-F86 WeakPolarHBondContact O-CB 3.33Å; Q83-F86 PolarHBondContact O-N 3.09Å; Q84-F86 VanDerWaalsContact C-N 3.26Å; Q84-F86 PolarHBondContact O-N 2.98Å; F86-E88 VanDerWaalsContact C-N 3.29Å; F86-E88 PolarHBondContact O-N 3.33Å; F86-R89 WeakPolarHBondContact O-CB 3.41Å; F86-R89 VanDerWaalsContact O-CD 3.3Å; F86-R89 WeakPolarHBondContact O-CD 3.31Å; F86-R89 WeakPolarHBondContact O-CG 3.39Å; F86-R89 PolarHBondContact O-N 2.89Å; F86-R89 PolarHBondContact O-NH1 3.24Å; F86-Y103 WeakPolarHBondContact CA-OH 3.29Å; F86-Y103 WeakPolarHBondContact CB-OH 3.28Å; F86-Y103 HydrophobicContact CD2-CE1 4.25Å; F86-Y103 PolarHBondContact N-OH 2.94Å; F86-P127 HydrophobicContact CD2-CB 4.12Å; F86-P127 HydrophobicContact CE2-CB 4Å; F86-P127 WeakPolarHBondContact CE2-O 3.49Å; F86-P127 HydrophobicContact CZ-CB 4.33Å; F86-D130 HydrophobicContact CE2-CB 4.03Å; F86-D130 HydrophobicContact CZ-CB 3.66Å
87K96.5Very high96.3Very high148 Ų14867 Ų6764%0.64331%0.305SS*.Hα-helixtrans-68-33-178.9-72.7172-178.7178.10111.5Q83 Q84 E85Q83-K87 WeakPolarHBondContact O-CG 3.42Å; Q83-K87 PolarHBondContact O-N 3.08Å; Q84-K87 WeakPolarHBondContact O-CB 3.47Å; Q84-K87 PolarHBondContact O-N 3.38Å; Q84-K87 VanDerWaalsContact O-N 3.09Å; E85-K87 VanDerWaalsContact C-N 3.3Å; E85-K87 PolarHBondContact O-N 3.28Å
88E95.8Very high96.3Very high104 Ų10469.4 Ų69.449%0.48632%0.317SS..THydrogen-bonded Turntrans-92.35.3-179-62.9-176.8-170.400113.2Q84 E85 F86 E90 E91 T92Q84-E88 PolarHBondContact O-N 2.86Å; E85-E88 PolarHBondContact O-N 2.94Å; F86-E88 VanDerWaalsContact C-N 3.29Å; F86-E88 PolarHBondContact O-N 3.33Å; E88-E90 VanDerWaalsContact C-N 3.32Å; E88-E90 PolarHBondContact O-N 3.07Å; E88-E90 VanDerWaalsContact O-N 3.14Å; E88-E91 PolarHBondContact O-N 3.41Å; E88-T92 PolarHBondContact O-N 3.04Å
89R96.8Very high96.3Very high63 Ų6369.7 Ų69.724%0.23832%0.32CS..Hα-helixtrans-52.9-39.9-170.770-173.3179.6-77.3-0.5115.6E85 F86 T92 R93 W100E85-R89 PolarHBondContact O-N 3Å; E85-R89 VanDerWaalsContact O-N 3.13Å; F86-R89 WeakPolarHBondContact O-CB 3.41Å; F86-R89 VanDerWaalsContact O-CD 3.3Å; F86-R89 WeakPolarHBondContact O-CD 3.31Å; F86-R89 WeakPolarHBondContact O-CG 3.39Å; F86-R89 PolarHBondContact O-N 2.89Å; F86-R89 PolarHBondContact O-NH1 3.24Å; R89-T92 PolarHBondContact O-N 3.19Å; R89-R93 WeakPolarHBondContact O-CB 3.48Å; R89-R93 PolarHBondContact O-N 3.41Å; R89-W100 HydrophobicContact CB-CE3 4.03Å; R89-W100 HydrophobicContact CB-CH2 4.3Å; R89-W100 HydrophobicContact CB-CZ3 3.53Å; R89-W100 HydrophobicContact CG-CZ3 4.23Å
90E97.1Very high96.5Very high64 Ų6467.8 Ų67.830%0.29931%0.31SS..Hα-helixtrans-69.2-37179.2-66.6-58.2140.600111.5E88 R93 K94 R134E88-E90 VanDerWaalsContact C-N 3.32Å; E88-E90 PolarHBondContact O-N 3.07Å; E88-E90 VanDerWaalsContact O-N 3.14Å; E90-R93 PolarHBondContact O-N 3.5Å; E90-K94 VanDerWaalsContact O-CG 3.29Å; E90-K94 WeakPolarHBondContact O-CG 3.49Å; E90-K94 PolarHBondContact O-N 2.97Å; E90-R134 WeakPolarHBondContact OE1-CD 3.48Å; E90-R134 IonicContact OE1-NE 3.75Å; E90-R134 PolarHBondContact OE1-NE 2.83Å; E90-R134 IonicContact OE2-CZ 3.46Å; E90-R134 IonicContact OE2-NE 3.82Å; E90-R134 PolarHBondContact OE2-NE 3.42Å; E90-R134 VanDerWaalsContact OE2-NE 3.09Å; E90-R134 IonicContact OE2-NH2 2.68Å
91E97.3Very high96.5Very high110 Ų11064.7 Ų64.751%0.51429%0.294SS..Hα-helixtrans-70.7-38.2174.5-63.6-53.5125.400111.1E88 K94 R95E88-E91 PolarHBondContact O-N 3.41Å; E91-K94 PolarHBondContact O-N 3.48Å; E91-K94 IonicContact OE1-NZ 3.73Å; E91-K94 PolarHBondContact OE1-NZ 3.34Å; E91-R95 VanDerWaalsContact O-CB 3.27Å; E91-R95 WeakPolarHBondContact O-CB 3.41Å; E91-R95 PolarHBondContact O-N 2.87Å
92T96.3Very high96.6Very high7 Ų762.9 Ų62.94%0.04329%0.287CS..Hα-helixtrans-60-46.5171.4-67.70000111.2E88 R89 K94 R95 S96 W100E88-T92 PolarHBondContact O-N 3.04Å; R89-T92 PolarHBondContact O-N 3.19Å; T92-K94 PolarHBondContact O-N 2.95Å; T92-R95 PolarHBondContact O-N 2.87Å; T92-R95 PolarHBondContact OG1-NH2 3.21Å; T92-S96 CarbonylContact O-C 3.54Å; T92-S96 PolarHBondContact O-N 2.93Å; T92-S96 VanDerWaalsContact O-O 3.06Å; T92-W100 HydrophobicContact CG2-CB 4.39Å
93R97.8Very high96.7Very high39 Ų3962.8 Ų62.815%0.14729%0.287CS..Hα-helixtrans-58.8-44.2176.1-176.3178.3-179.9-952.2112.3R89 E90 R95 L97 W100 D139 E146R89-R93 WeakPolarHBondContact O-CB 3.48Å; R89-R93 PolarHBondContact O-N 3.41Å; E90-R93 PolarHBondContact O-N 3.5Å; R93-R95 VanDerWaalsContact C-N 3.34Å; R93-R95 PolarHBondContact O-N 3.24Å; R93-L97 HydrophobicContact CG-CD1 4.36Å; R93-W100 HydrophobicContact CB-CB 3.94Å; R93-W100 HydrophobicContact CB-CD2 4.23Å; R93-W100 HydrophobicContact CB-CG 3.78Å; R93-W100 HydrophobicContact CG-CB 4.33Å; R93-W100 HydrophobicContact CG-CG 3.95Å; R93-D139 IonicContact CZ-OD2 3.09Å; R93-D139 VanDerWaalsContact CZ-OD2 3.29Å; R93-D139 IonicContact NH1-OD2 3.59Å; R93-D139 PolarHBondContact NH1-OD2 2.75Å; R93-D139 IonicContact NH2-OD2 3.07Å; R93-D139 PolarHBondContact NH2-OD2 3.29Å; R93-D139 VanDerWaalsContact NH2-OD2 3.12Å; R93-E146 IonicContact CZ-OE1 2.69Å; R93-E146 IonicContact CZ-OE2 2.7Å; R93-E146 IonicContact NE-OE1 3.91Å; R93-E146 PolarHBondContact NE-OE1 3.46Å; R93-E146 IonicContact NE-OE2 2.73Å; R93-E146 PolarHBondContact NE-OE2 3.4Å; R93-E146 IonicContact NH2-OE1 3.28Å; R93-E146 IonicContact NH2-OE2 2.87Å; R93-E146 PolarHBondContact NH2-OE2 2.86Å
94K96.8Very high96.8Very high148 Ų14857.7 Ų57.764%0.64326%0.263SS*.Hα-helixtrans-64.1-38176.3-71.2170.6-169.1168.90112.6E90 E91 T92E90-K94 VanDerWaalsContact O-CG 3.29Å; E90-K94 WeakPolarHBondContact O-CG 3.49Å; E90-K94 PolarHBondContact O-N 2.97Å; E91-K94 PolarHBondContact O-N 3.48Å; E91-K94 IonicContact OE1-NZ 3.73Å; E91-K94 PolarHBondContact OE1-NZ 3.34Å; T92-K94 PolarHBondContact O-N 2.95Å
95R96.7Very high96.9Very high180 Ų18053.4 Ų53.468%0.67924%0.243SC*.Hα-helixtrans-78.6-40.8-177-179.7176.460.9-158.5-4.9112.7E91 T92 R93E91-R95 VanDerWaalsContact O-CB 3.27Å; E91-R95 WeakPolarHBondContact O-CB 3.41Å; E91-R95 PolarHBondContact O-N 2.87Å; T92-R95 PolarHBondContact O-N 2.87Å; T92-R95 PolarHBondContact OG1-NH2 3.21Å; R93-R95 VanDerWaalsContact C-N 3.34Å; R93-R95 PolarHBondContact O-N 3.24Å
96S96.4Very high96.9Very high53 Ų5352.7 Ų52.737%0.37124%0.24SC..  trans-156.7109.5-176.4179.90000110.5T92 Q98 G99 W100T92-S96 CarbonylContact O-C 3.54Å; T92-S96 PolarHBondContact O-N 2.93Å; T92-S96 VanDerWaalsContact O-O 3.06Å; S96-Q98 VanDerWaalsContact C-N 3.33Å; S96-Q98 PolarHBondContact O-N 3.4Å; S96-G99 PolarHBondContact O-N 3.35Å; S96-G99 PolarHBondContact OG-N 3.15Å; S96-G99 VanDerWaalsContact OG-N 3.14Å; S96-W100 PolarHBondContact O-N 3.22Å
97L96.1Very high96.9Very high40 Ų4051.5 Ų51.521%0.20924%0.235CC..Hα-helixtrans-59.2-45.9175.8-167.768.4000111.3R93 G99 W100 V101 N143 E145 E146R93-L97 HydrophobicContact CG-CD1 4.36Å; L97-G99 VanDerWaalsContact C-N 3.32Å; L97-G99 PolarHBondContact O-N 3.2Å; L97-W100 WeakPolarHBondContact O-CA 3.38Å; L97-W100 WeakPolarHBondContact O-CB 3.24Å; L97-W100 PolarHBondContact O-N 3Å; L97-W100 VanDerWaalsContact O-N 3.08Å; L97-V101 PolarHBondContact O-N 3.14Å; L97-N143 VanDerWaalsContact CD2-OD1 3.24Å; L97-N143 WeakPolarHBondContact CD2-OD1 3.26Å; L97-E145 HydrophobicContact CD2-CB 4.24Å; L97-E146 HydrophobicContact CD1-CG 3.73Å; L97-E146 HydrophobicContact CG-CG 4.4Å
98Q96.1Very high96.9Very high89 Ų8944.5 Ų44.542%0.41620%0.204SC..Hα-helixtrans-55.8-46.2174.9-174.8177.8-16.900111.8P48 S96 W100 V101 C102P48-Q98 HydrophobicContact CG-CG 4.18Å; S96-Q98 VanDerWaalsContact C-N 3.33Å; S96-Q98 PolarHBondContact O-N 3.4Å; Q98-W100 VanDerWaalsContact C-N 3.28Å; Q98-W100 PolarHBondContact O-N 2.79Å; Q98-V101 VanDerWaalsContact O-CG2 3.25Å; Q98-V101 WeakPolarHBondContact O-CG2 3.4Å; Q98-V101 PolarHBondContact O-N 3.49Å; Q98-C102 WeakPolarHBondContact O-CB 3.47Å; Q98-C102 PolarHBondContact O-N 3.38Å; Q98-C102 PolarHBondContact O-SG 3.43Å
99G96.3Very high96.8Very high7 Ų739.5 Ų39.57%0.07218%0.181CC..Hα-helixtrans-61.2-37.7177.300000112.8L45 S96 L97 Y103L45-G99 WeakPolarHBondContact O-CA 3.21Å; S96-G99 PolarHBondContact O-N 3.35Å; S96-G99 PolarHBondContact OG-N 3.15Å; S96-G99 VanDerWaalsContact OG-N 3.14Å; L97-G99 VanDerWaalsContact C-N 3.32Å; L97-G99 PolarHBondContact O-N 3.2Å; G99-Y103 WeakPolarHBondContact O-CB 3.42Å; G99-Y103 PolarHBondContact O-N 2.95Å
100W97.9Very high96.7Very high0 Ų036.5 Ų36.50%017%0.17CC..Hα-helixtrans-66.4-50174.7163.6-118.6000112.9R89 T92 R93 S96 L97 Q98 C102 Y103 V104 C131 R134 L135 E146R89-W100 HydrophobicContact CB-CE3 4.03Å; R89-W100 HydrophobicContact CB-CH2 4.3Å; R89-W100 HydrophobicContact CB-CZ3 3.53Å; R89-W100 HydrophobicContact CG-CZ3 4.23Å; T92-W100 HydrophobicContact CG2-CB 4.39Å; R93-W100 HydrophobicContact CB-CB 3.94Å; R93-W100 HydrophobicContact CB-CD2 4.23Å; R93-W100 HydrophobicContact CB-CG 3.78Å; R93-W100 HydrophobicContact CG-CB 4.33Å; R93-W100 HydrophobicContact CG-CG 3.95Å; S96-W100 PolarHBondContact O-N 3.22Å; L97-W100 WeakPolarHBondContact O-CA 3.38Å; L97-W100 WeakPolarHBondContact O-CB 3.24Å; L97-W100 PolarHBondContact O-N 3Å; L97-W100 VanDerWaalsContact O-N 3.08Å; Q98-W100 VanDerWaalsContact C-N 3.28Å; Q98-W100 PolarHBondContact O-N 2.79Å; W100-C102 VanDerWaalsContact C-N 3.27Å; W100-C102 PolarHBondContact O-N 2.77Å; W100-Y103 HydrophobicContact CE3-CD1 4.06Å; W100-Y103 AromaticContact CZ3-CD1 3.75Å; W100-Y103 HydrophobicContact CZ3-CD1 3.75Å; W100-Y103 HydrophobicContact CZ3-CE1 4.28Å; W100-Y103 WeakPolarHBondContact O-CB 3.47Å; W100-Y103 PolarHBondContact O-N 2.95Å; W100-Y103 VanDerWaalsContact O-N 3.12Å; W100-V104 HydrophobicContact CD2-CG2 4Å; W100-V104 HydrophobicContact CE3-CG2 3.94Å; W100-V104 HydrophobicContact CH2-CG2 3.55Å; W100-V104 HydrophobicContact CZ2-CG2 3.59Å; W100-V104 HydrophobicContact CZ3-CG2 3.69Å; W100-V104 WeakPolarHBondContact O-CG2 3.4Å; W100-V104 PolarHBondContact O-N 3.46Å; W100-C131 HydrophobicContact CH2-CB 4.16Å; W100-R134 HydrophobicContact CH2-CB 4.4Å; W100-R134 HydrophobicContact CH2-CG 4.27Å; W100-R134 HydrophobicContact CZ2-CB 4.03Å; W100-R134 HydrophobicContact CZ2-CG 3.7Å; W100-L135 HydrophobicContact CZ2-CD2 4.24Å; W100-L135 HydrophobicContact CZ2-CG 4.38Å; W100-E146 VanDerWaalsContact CD1-OE1 3.3Å; W100-E146 PolarHBondContact NE1-OE1 3.04Å
101V97.5Very high96.5Very high12 Ų1233.5 Ų33.57%0.07316%0.156CC..Hα-helixtrans-66.9-31.8178.6-60.20000112.1L97 Q98 V104 T105 E145 E146 C149L97-V101 PolarHBondContact O-N 3.14Å; Q98-V101 VanDerWaalsContact O-CG2 3.25Å; Q98-V101 WeakPolarHBondContact O-CG2 3.4Å; Q98-V101 PolarHBondContact O-N 3.49Å; V101-V104 PolarHBondContact O-N 3.05Å; V101-T105 WeakPolarHBondContact O-CB 3.1Å; V101-T105 PolarHBondContact O-N 2.79Å; V101-T105 PolarHBondContact O-OG1 3.4Å; V101-E145 HydrophobicContact CG1-CG 4.34Å; V101-E145 HydrophobicContact CG2-CG 4.2Å; V101-E145 WeakPolarHBondContact CG2-OE1 3.42Å; V101-E146 HydrophobicContact CG1-CG 4.09Å; V101-C149 HydrophobicContact CB-CB 4.01Å; V101-C149 HydrophobicContact CG1-CB 4.01Å
102C97.3Very high96.3Very high2 Ų229.7 Ų29.71%0.01414%0.139CC..Hα-helixtrans-64-42.3171.2-74.60000111.5S44 Q98 W100 T105 F106S44-C102 WeakPolarHBondContact O-CB 3.48Å; Q98-C102 WeakPolarHBondContact O-CB 3.47Å; Q98-C102 PolarHBondContact O-N 3.38Å; Q98-C102 PolarHBondContact O-SG 3.43Å; W100-C102 VanDerWaalsContact C-N 3.27Å; W100-C102 PolarHBondContact O-N 2.77Å; C102-T105 PolarHBondContact O-N 3.18Å; C102-F106 WeakPolarHBondContact O-CB 3.46Å; C102-F106 PolarHBondContact O-N 3.06Å
103Y97.5Very high96Very high3 Ų332.9 Ų32.91%0.01215%0.151CC..Hα-helixtrans-60.1-49173.1177.3-102000112.1L45 L82 E85 F86 G99 W100 T105 F106 I107L45-Y103 VanDerWaalsContact CD2-CB 3.49Å; L45-Y103 HydrophobicContact CD2-CD2 3.88Å; L45-Y103 HydrophobicContact CD2-CG 4.16Å; L82-Y103 HydrophobicContact CD2-CE2 4.12Å; L82-Y103 PolarHBondContact O-OH 2.89Å; E85-Y103 HydrophobicContact CB-CD2 3.79Å; E85-Y103 HydrophobicContact CB-CE2 3.4Å; E85-Y103 HydrophobicContact CG-CE2 4.49Å; F86-Y103 WeakPolarHBondContact CA-OH 3.29Å; F86-Y103 WeakPolarHBondContact CB-OH 3.28Å; F86-Y103 HydrophobicContact CD2-CE1 4.25Å; F86-Y103 PolarHBondContact N-OH 2.94Å; G99-Y103 WeakPolarHBondContact O-CB 3.42Å; G99-Y103 PolarHBondContact O-N 2.95Å; W100-Y103 HydrophobicContact CE3-CD1 4.06Å; W100-Y103 AromaticContact CZ3-CD1 3.75Å; W100-Y103 HydrophobicContact CZ3-CD1 3.75Å; W100-Y103 HydrophobicContact CZ3-CE1 4.28Å; W100-Y103 WeakPolarHBondContact O-CB 3.47Å; W100-Y103 PolarHBondContact O-N 2.95Å; W100-Y103 VanDerWaalsContact O-N 3.12Å; Y103-T105 VanDerWaalsContact C-N 3.31Å; Y103-T105 PolarHBondContact O-N 2.95Å; Y103-F106 PolarHBondContact O-N 3.48Å; Y103-F106 VanDerWaalsContact O-N 3.12Å; Y103-I107 HydrophobicContact CE1-CG2 4.41Å; Y103-I107 PolarHBondContact O-N 3.4Å
104V98.1Very high95.6Very high0 Ų031.2 Ų31.20%015%0.145CC..Hα-helixtrans-59.8-44.9178.5177.70000110.7W100 V101 F106 I107 C108 C131 L135 Q153W100-V104 HydrophobicContact CD2-CG2 4Å; W100-V104 HydrophobicContact CE3-CG2 3.94Å; W100-V104 HydrophobicContact CH2-CG2 3.55Å; W100-V104 HydrophobicContact CZ2-CG2 3.59Å; W100-V104 HydrophobicContact CZ3-CG2 3.69Å; W100-V104 WeakPolarHBondContact O-CG2 3.4Å; W100-V104 PolarHBondContact O-N 3.46Å; V101-V104 PolarHBondContact O-N 3.05Å; V104-F106 VanDerWaalsContact C-N 3.3Å; V104-F106 PolarHBondContact O-N 3.31Å; V104-I107 VanDerWaalsContact O-CG2 3.3Å; V104-I107 WeakPolarHBondContact O-CG2 3.16Å; V104-I107 PolarHBondContact O-N 2.91Å; V104-C108 WeakPolarHBondContact O-CB 3.43Å; V104-C108 PolarHBondContact O-N 3.14Å; V104-C108 PolarHBondContact O-SG 3.09Å; V104-C131 HydrophobicContact CG1-CB 4.13Å; V104-C131 HydrophobicContact CG2-CB 3.97Å; V104-L135 HydrophobicContact CB-CD1 4.4Å; V104-L135 HydrophobicContact CG1-CD1 3.81Å; V104-L135 HydrophobicContact CG2-CD1 4.27Å; V104-Q153 HydrophobicContact CG1-CG 4.14Å
105T97Very high95Very high10 Ų1027.6 Ų27.66%0.06113%0.129CC..Hα-helixtrans-59-44.1175.3-62.50000110.9S51 K52 V101 C102 Y103 N109 Q153S51-T105 WeakPolarHBondContact OG-CG2 3.41Å; K52-T105 HydrophobicContact CG-CG2 3.85Å; V101-T105 WeakPolarHBondContact O-CB 3.1Å; V101-T105 PolarHBondContact O-N 2.79Å; V101-T105 PolarHBondContact O-OG1 3.4Å; C102-T105 PolarHBondContact O-N 3.18Å; Y103-T105 VanDerWaalsContact C-N 3.31Å; Y103-T105 PolarHBondContact O-N 2.95Å; T105-N109 WeakPolarHBondContact CG2-ND2 3.33Å; T105-N109 WeakPolarHBondContact O-CB 3.39Å; T105-N109 PolarHBondContact O-N 3.04Å; T105-N109 PolarHBondContact O-ND2 3.2Å; T105-Q153 PolarHBondContact OG1-NE2 3.09Å
106F96.3Very high94.1Very high0 Ų021.8 Ų21.80%011%0.114CC..Hα-helixtrans-66.6-47.3-178.9-177.5-127.9000112.5V41 S44 A54 L78 L82 C102 Y103 V104 C108 N109 I110V41-F106 HydrophobicContact CB-CE1 4.33Å; V41-F106 HydrophobicContact CG1-CE1 4.45Å; V41-F106 HydrophobicContact CG2-CE1 3.79Å; V41-F106 HydrophobicContact CG2-CZ 4.29Å; S44-F106 WeakPolarHBondContact OG-CD2 3.47Å; S44-F106 WeakPolarHBondContact OG-CE2 3.39Å; A54-F106 HydrophobicContact CB-CD2 3.71Å; A54-F106 HydrophobicContact CB-CE2 3.45Å; A54-F106 VanDerWaalsContact CB-CE2 3.45Å; L78-F106 HydrophobicContact CD1-CE1 4.46Å; L78-F106 HydrophobicContact CD1-CZ 4.07Å; L82-F106 HydrophobicContact CD2-CD1 3.5Å; L82-F106 HydrophobicContact CD2-CE1 3.44Å; L82-F106 VanDerWaalsContact CD2-CE1 3.44Å; L82-F106 HydrophobicContact CG-CE1 4.14Å; C102-F106 WeakPolarHBondContact O-CB 3.46Å; C102-F106 PolarHBondContact O-N 3.06Å; Y103-F106 PolarHBondContact O-N 3.48Å; Y103-F106 VanDerWaalsContact O-N 3.12Å; V104-F106 VanDerWaalsContact C-N 3.3Å; V104-F106 PolarHBondContact O-N 3.31Å; F106-C108 VanDerWaalsContact C-N 3.31Å; F106-C108 PolarHBondContact O-N 3.22Å; F106-N109 WeakPolarHBondContact O-CB 3.13Å; F106-N109 PolarHBondContact O-N 2.98Å; F106-I110 HydrophobicContact CD2-CG1 4.13Å; F106-I110 HydrophobicContact CE1-CG1 4.38Å; F106-I110 HydrophobicContact CE2-CD1 3.73Å; F106-I110 HydrophobicContact CE2-CG1 3.75Å; F106-I110 HydrophobicContact CZ-CD1 3.93Å; F106-I110 HydrophobicContact CZ-CG1 3.9Å; F106-I110 WeakPolarHBondContact O-CG1 3.23Å; F106-I110 PolarHBondContact O-N 3.46Å
107I96.9Very high93.2Very high3 Ų326.5 Ų26.52%0.01514%0.135CC..Hα-helixtrans-64.3-37.3179-166.6171.4000111.9Y103 V104 I110 F111 L124 P127 V128Y103-I107 HydrophobicContact CE1-CG2 4.41Å; Y103-I107 PolarHBondContact O-N 3.4Å; V104-I107 VanDerWaalsContact O-CG2 3.3Å; V104-I107 WeakPolarHBondContact O-CG2 3.16Å; V104-I107 PolarHBondContact O-N 2.91Å; I107-I110 PolarHBondContact O-N 3.43Å; I107-F111 PolarHBondContact O-N 3.02Å; I107-L124 HydrophobicContact CD1-CD2 4.47Å; I107-L124 HydrophobicContact CG1-CD2 4.32Å; I107-P127 HydrophobicContact CD1-CB 3.59Å; I107-V128 HydrophobicContact CD1-CG2 4.48Å; I107-V128 HydrophobicContact CG1-CG2 4.06Å; I107-V128 HydrophobicContact CG2-CG2 4.47Å
108C96.6Very high92.3Very high0 Ų031.5 Ų31.50%016%0.161CC..Hα-helixtrans-66-39.1174.7-66.60000111.8V104 F106 F111 D112 Q153 I157V104-C108 WeakPolarHBondContact O-CB 3.43Å; V104-C108 PolarHBondContact O-N 3.14Å; V104-C108 PolarHBondContact O-SG 3.09Å; F106-C108 VanDerWaalsContact C-N 3.31Å; F106-C108 PolarHBondContact O-N 3.22Å; C108-F111 WeakPolarHBondContact O-CB 3.3Å; C108-F111 PolarHBondContact O-N 3Å; C108-D112 PolarHBondContact O-N 3.1Å; C108-Q153 HydrophobicContact CB-CB 4.43Å; C108-Q153 HydrophobicContact CB-CG 4.04Å; C108-I157 HydrophobicContact CB-CD1 3.65Å
109N94.1Very high91.6Very high0 Ų033.3 Ų33.30%017%0.171CC..Hα-helixtrans-62.2-43.3172.1-89.4-67.4000112.6S51 K52 T105 F106 F111 D112 Y113 R156S51-N109 PolarHBondContact O-ND2 3.38Å; S51-N109 VanDerWaalsContact O-ND2 3.09Å; K52-N109 PolarHBondContact O-OD1 3.3Å; T105-N109 WeakPolarHBondContact CG2-ND2 3.33Å; T105-N109 WeakPolarHBondContact O-CB 3.39Å; T105-N109 PolarHBondContact O-N 3.04Å; T105-N109 PolarHBondContact O-ND2 3.2Å; F106-N109 WeakPolarHBondContact O-CB 3.13Å; F106-N109 PolarHBondContact O-N 2.98Å; N109-F111 VanDerWaalsContact C-N 3.3Å; N109-F111 PolarHBondContact O-N 2.82Å; N109-D112 PolarHBondContact O-N 3.38Å; N109-Y113 VanDerWaalsContact O-CD2 3.3Å; N109-Y113 WeakPolarHBondContact O-CD2 3.44Å; N109-Y113 PolarHBondContact O-N 3.12Å; N109-R156 PolarHBondContact ND2-NH1 3.2Å; N109-R156 PolarHBondContact OD1-NH1 3.5Å; N109-R156 PolarHBondContact OD1-NH2 3.14Å
110I94.3Very high91Very high0 Ų034 Ų340%018%0.175CC..Hα-helixtrans-65.4-38.3177.6-63.8-66.4000110.7C58 L78 L82 F106 I107 D112 L114 M121 L124C58-I110 HydrophobicContact CB-CD1 3.64Å; L78-I110 HydrophobicContact CD2-CD1 4.08Å; L82-I110 HydrophobicContact CD1-CB 4.32Å; L82-I110 HydrophobicContact CD1-CG1 4.13Å; L82-I110 HydrophobicContact CD1-CG2 4.01Å; F106-I110 HydrophobicContact CD2-CG1 4.13Å; F106-I110 HydrophobicContact CE1-CG1 4.38Å; F106-I110 HydrophobicContact CE2-CD1 3.73Å; F106-I110 HydrophobicContact CE2-CG1 3.75Å; F106-I110 HydrophobicContact CZ-CD1 3.93Å; F106-I110 HydrophobicContact CZ-CG1 3.9Å; F106-I110 WeakPolarHBondContact O-CG1 3.23Å; F106-I110 PolarHBondContact O-N 3.46Å; I107-I110 PolarHBondContact O-N 3.43Å; I110-D112 VanDerWaalsContact C-N 3.33Å; I110-D112 PolarHBondContact O-N 2.86Å; I110-L114 HydrophobicContact CG2-CB 4Å; I110-L114 HydrophobicContact CG2-CD2 4.22Å; I110-L114 WeakPolarHBondContact O-CA 3.42Å; I110-L114 WeakPolarHBondContact O-CB 3.5Å; I110-L114 PolarHBondContact O-N 3.42Å; I110-M121 HydrophobicContact CG2-CE 4.49Å; I110-L124 HydrophobicContact CB-CD1 4.41Å; I110-L124 HydrophobicContact CG2-CD1 3.66Å
111F94.2Very high90.5Very high0 Ų034.8 Ų34.80%018%0.179CC..Hα-helixtrans-60.4-42.2172.6173-93.8000112.4I107 C108 N109 P120 L124 V125 V128 I157 Q160 L161I107-F111 PolarHBondContact O-N 3.02Å; C108-F111 WeakPolarHBondContact O-CB 3.3Å; C108-F111 PolarHBondContact O-N 3Å; N109-F111 VanDerWaalsContact C-N 3.3Å; N109-F111 PolarHBondContact O-N 2.82Å; F111-P120 HydrophobicContact CD2-CB 4.15Å; F111-P120 HydrophobicContact CE1-CB 4.49Å; F111-P120 HydrophobicContact CE2-CB 3.47Å; F111-P120 VanDerWaalsContact CE2-CB 3.47Å; F111-P120 HydrophobicContact CE2-CG 4.36Å; F111-P120 HydrophobicContact CZ-CB 3.68Å; F111-P120 HydrophobicContact CZ-CG 4.06Å; F111-L124 HydrophobicContact CB-CB 4.47Å; F111-L124 HydrophobicContact CB-CD1 4.38Å; F111-L124 HydrophobicContact CD2-CB 4.09Å; F111-V125 HydrophobicContact CE2-CG2 3.93Å; F111-V128 HydrophobicContact CB-CG2 3.92Å; F111-V128 HydrophobicContact CD2-CG2 4.48Å; F111-V128 HydrophobicContact CG-CG2 4.26Å; F111-I157 HydrophobicContact CD1-CB 4.15Å; F111-I157 HydrophobicContact CD1-CD1 3.77Å; F111-I157 HydrophobicContact CD1-CG2 4.19Å; F111-I157 HydrophobicContact CE1-CB 4.21Å; F111-I157 HydrophobicContact CE1-CD1 4.31Å; F111-Q160 HydrophobicContact CE1-CB 4.2Å; F111-L161 HydrophobicContact CD1-CD2 4.44Å; F111-L161 HydrophobicContact CE1-CD2 3.8Å; F111-L161 HydrophobicContact CE1-CG 3.93Å; F111-L161 HydrophobicContact CE2-CD2 3.97Å; F111-L161 HydrophobicContact CZ-CD2 3.54Å; F111-L161 HydrophobicContact CZ-CG 4.07Å
112D92.9Very high89.9Confident31 Ų3140 Ų4017%0.16621%0.21CC..Hα-helixtrans-68.9-48.6-179.5-166.925.8000112.5C108 N109 I110 K115 R156 I157 Q160C108-D112 PolarHBondContact O-N 3.1Å; N109-D112 PolarHBondContact O-N 3.38Å; I110-D112 VanDerWaalsContact C-N 3.33Å; I110-D112 PolarHBondContact O-N 2.86Å; D112-K115 WeakPolarHBondContact O-CE 3.36Å; D112-R156 IonicContact OD2-NH2 3.37Å; D112-I157 HydrophobicContact CB-CG2 3.75Å; D112-Q160 PolarHBondContact OD1-NE2 3.19Å
113Y90.1Very high89.6Confident74 Ų7443.5 Ų43.529%0.2924%0.239SC..Hα-helixtrans-87-37.2-174-73.7-75.2000113.8R56 Y59 N109 K115R56-Y113 HydrophobicContact CG-CD1 3.89Å; R56-Y113 HydrophobicContact CG-CD2 4.27Å; R56-Y113 HydrophobicContact CG-CE1 3.38Å; R56-Y113 HydrophobicContact CG-CE2 3.8Å; R56-Y113 HydrophobicContact CG-CG 4.32Å; Y59-Y113 WeakPolarHBondContact CD2-O 3.44Å; N109-Y113 VanDerWaalsContact O-CD2 3.3Å; N109-Y113 WeakPolarHBondContact O-CD2 3.44Å; N109-Y113 PolarHBondContact O-N 3.12Å; Y113-K115 PolarHBondContact O-N 3.42Å; Y113-K115 VanDerWaalsContact O-N 3.07Å
114L87.9Confident89.4Confident4 Ų443.8 Ų43.82%0.02124%0.241CC..  trans-88.283.1-171.4-145.574.7000111.3Y59 V62 R75 L78 I110 M121Y59-L114 HydrophobicContact CD2-CD1 4.4Å; V62-L114 HydrophobicContact CB-CD1 4.05Å; V62-L114 HydrophobicContact CG1-CD1 4.4Å; V62-L114 HydrophobicContact CG2-CD1 3.81Å; V62-L114 HydrophobicContact CG2-CD2 4.38Å; R75-L114 HydrophobicContact CG-CD2 3.98Å; L78-L114 HydrophobicContact CD2-CD2 4.35Å; I110-L114 HydrophobicContact CG2-CB 4Å; I110-L114 HydrophobicContact CG2-CD2 4.22Å; I110-L114 WeakPolarHBondContact O-CA 3.42Å; I110-L114 WeakPolarHBondContact O-CB 3.5Å; I110-L114 PolarHBondContact O-N 3.42Å; L114-M121 HydrophobicContact CB-CE 3.81Å; L114-M121 HydrophobicContact CD2-CE 3.61Å; L114-M121 HydrophobicContact CD2-SD 4.18Å; L114-M121 HydrophobicContact CG-CE 4.01Å; L114-M121 HydrophobicContact CG-SD 4.49Å; L114-M121 WeakPolarHBondContact O-CG 3.3Å
115K85.1Confident89.2Confident72 Ų7244.2 Ų44.231%0.31324%0.244SC..EExtended strand (participates in β ladder)trans-99.8145.2179.5-57.1-170-174.7-168.30112D112 Y113 M119D112-K115 WeakPolarHBondContact O-CE 3.36Å; Y113-K115 PolarHBondContact O-N 3.42Å; Y113-K115 VanDerWaalsContact O-N 3.07Å; K115-M119 CarbonylContact C-O 3.56Å; K115-M119 VanDerWaalsContact CA-O 3.29Å; K115-M119 WeakPolarHBondContact CA-O 3.37Å; K115-M119 WeakPolarHBondContact CB-O 3.39Å
116V78.3Confident89.2Confident58 Ų5848.1 Ų48.135%0.35226%0.264SS..EExtended strand (participates in β ladder)trans-109.6119.3170.6178.50000107.4N118 M119 M121V116-N118 VanDerWaalsContact C-N 3.28Å; V116-N118 PolarHBondContact O-N 2.9Å; V116-M119 PolarHBondContact N-O 3.37Å; V116-M119 WeakPolarHBondContact O-CB 3.34Å; V116-M119 PolarHBondContact O-N 3.41Å; V116-M121 HydrophobicContact CG2-CG 3.81Å; V116-M121 HydrophobicContact CG2-SD 4.21Å
117N76.8Confident89.2Confident152 Ų15249.4 Ų49.481%0.81327%0.272SS*.THydrogen-bonded Turntrans52.344-175.1-58.7-25.3000113.1M119N117-M119 PolarHBondContact O-N 2.96Å; N117-M119 VanDerWaalsContact O-N 3.09Å
118N77.4Confident89.3Confident144 Ų14449.3 Ų49.377%0.7727%0.271SS*.THydrogen-bonded Turntrans62.25.9-174.7-63.3-5.2000115.9V116V116-N118 VanDerWaalsContact C-N 3.28Å; V116-N118 PolarHBondContact O-N 2.9Å
119M80.9Confident89.3Confident127 Ų12749.3 Ų49.363%0.62627%0.271SS*.EExtended strand (participates in β ladder)trans-100.9140.8175-63.5-64.5-7100110.9K115 V116 N117K115-M119 CarbonylContact C-O 3.56Å; K115-M119 VanDerWaalsContact CA-O 3.29Å; K115-M119 WeakPolarHBondContact CA-O 3.37Å; K115-M119 WeakPolarHBondContact CB-O 3.39Å; V116-M119 PolarHBondContact N-O 3.37Å; V116-M119 WeakPolarHBondContact O-CB 3.34Å; V116-M119 PolarHBondContact O-N 3.41Å; N117-M119 PolarHBondContact O-N 2.96Å; N117-M119 VanDerWaalsContact O-N 3.09Å
120P84Confident89.5Confident22 Ų2251.6 Ų51.614%0.14328%0.283CS..EExtended strand (participates in β ladder)trans-57.9146.3171-21.332.1000111.6F111 V122F111-P120 HydrophobicContact CD2-CB 4.15Å; F111-P120 HydrophobicContact CE1-CB 4.49Å; F111-P120 HydrophobicContact CE2-CB 3.47Å; F111-P120 VanDerWaalsContact CE2-CB 3.47Å; F111-P120 HydrophobicContact CE2-CG 4.36Å; F111-P120 HydrophobicContact CZ-CB 3.68Å; F111-P120 HydrophobicContact CZ-CG 4.06Å; P120-V122 PolarHBondContact O-N 3.12Å
121M86.3Confident89.7Confident17 Ų1751.6 Ų51.68%0.08428%0.283CS..PPolyproline II helixtrans-71117.1177.5-69.4-175.9-54.700110.7L79 I110 L114 V116 A123 L124L79-M121 HydrophobicContact CD1-CE 4.43Å; L79-M121 HydrophobicContact CD1-SD 4.26Å; L79-M121 HydrophobicContact CD2-CE 3.92Å; I110-M121 HydrophobicContact CG2-CE 4.49Å; L114-M121 HydrophobicContact CB-CE 3.81Å; L114-M121 HydrophobicContact CD2-CE 3.61Å; L114-M121 HydrophobicContact CD2-SD 4.18Å; L114-M121 HydrophobicContact CG-CE 4.01Å; L114-M121 HydrophobicContact CG-SD 4.49Å; L114-M121 WeakPolarHBondContact O-CG 3.3Å; V116-M121 HydrophobicContact CG2-CG 3.81Å; V116-M121 HydrophobicContact CG2-SD 4.21Å; M121-A123 PolarHBondContact O-N 2.92Å; M121-A123 VanDerWaalsContact O-N 3.08Å; M121-L124 HydrophobicContact CB-CD1 4.47Å; M121-L124 HydrophobicContact CB-CG 4.47Å; M121-L124 HydrophobicContact CE-CD1 3.31Å; M121-L124 HydrophobicContact CE-CG 4.02Å; M121-L124 PolarHBondContact O-N 2.79Å
122V86.7Confident90Very high121 Ų12151.6 Ų51.673%0.73328%0.283SS*.Hα-helixtrans-52.9-33.9177.9179.90000112.3P120 L124 V125P120-V122 PolarHBondContact O-N 3.12Å; V122-L124 PolarHBondContact O-N 2.93Å; V122-L124 VanDerWaalsContact O-N 3.15Å; V122-V125 PolarHBondContact O-N 3.48Å
123A90.1Very high90.2Very high76 Ų7651.9 Ų51.963%0.62828%0.284SS*.Hα-helixtrans-60.6-21.717800000114.3M121 P127M121-A123 PolarHBondContact O-N 2.92Å; M121-A123 VanDerWaalsContact O-N 3.08Å; A123-P127 WeakPolarHBondContact O-CD 3.47Å; A123-P127 WeakPolarHBondContact O-CG 3.45Å
124L94.1Very high90.6Very high9 Ų949.9 Ų49.95%0.04728%0.276CS..Hα-helixtrans-97.3-16.1179.5-68.5-180000113.7L79 I107 I110 F111 M121 V122 L126 P127 V128L79-L124 HydrophobicContact CD2-CD1 4.33Å; L79-L124 HydrophobicContact CD2-CD2 3.89Å; L79-L124 HydrophobicContact CD2-CG 4.25Å; I107-L124 HydrophobicContact CD1-CD2 4.47Å; I107-L124 HydrophobicContact CG1-CD2 4.32Å; I110-L124 HydrophobicContact CB-CD1 4.41Å; I110-L124 HydrophobicContact CG2-CD1 3.66Å; F111-L124 HydrophobicContact CB-CB 4.47Å; F111-L124 HydrophobicContact CB-CD1 4.38Å; F111-L124 HydrophobicContact CD2-CB 4.09Å; M121-L124 HydrophobicContact CB-CD1 4.47Å; M121-L124 HydrophobicContact CB-CG 4.47Å; M121-L124 HydrophobicContact CE-CD1 3.31Å; M121-L124 HydrophobicContact CE-CG 4.02Å; M121-L124 PolarHBondContact O-N 2.79Å; V122-L124 PolarHBondContact O-N 2.93Å; V122-L124 VanDerWaalsContact O-N 3.15Å; L124-L126 PolarHBondContact O-N 2.82Å; L124-P127 WeakPolarHBondContact O-CD 3.42Å; L124-V128 WeakPolarHBondContact O-CB 3.34Å; L124-V128 VanDerWaalsContact O-CG2 3.23Å; L124-V128 WeakPolarHBondContact O-CG2 3.32Å; L124-V128 PolarHBondContact O-N 3.09Å
125V94Very high91.1Very high9 Ų949.7 Ų49.76%0.05528%0.275CS..Hα-helixtrans-58.2-53.9-175.7176.20000110.9F111 V122 V128 Y129 V164F111-V125 HydrophobicContact CE2-CG2 3.93Å; V122-V125 PolarHBondContact O-N 3.48Å; V125-V128 PolarHBondContact O-N 2.87Å; V125-Y129 HydrophobicContact CG1-CD2 3.82Å; V125-Y129 HydrophobicContact CG1-CE2 3.84Å; V125-Y129 VanDerWaalsContact O-CD2 3.28Å; V125-Y129 WeakPolarHBondContact O-CD2 3.32Å; V125-Y129 PolarHBondContact O-N 2.78Å; V125-V164 HydrophobicContact CB-CG1 4.48Å; V125-V164 HydrophobicContact CG1-CG1 3.91Å; V125-V164 HydrophobicContact CG2-CG1 3.73Å
126L95.3Very high91.8Very high92 Ų9246.3 Ų46.348%0.48226%0.261SS..Hα-helixtrans-64.8-48.6-179.2-68175.1000112.4L124 V128 Y129 D130L124-L126 PolarHBondContact O-N 2.82Å; L126-V128 VanDerWaalsContact C-N 3.31Å; L126-V128 PolarHBondContact O-N 2.9Å; L126-Y129 PolarHBondContact O-N 2.89Å; L126-D130 WeakPolarHBondContact O-CB 3.39Å; L126-D130 VanDerWaalsContact O-CG 3.3Å; L126-D130 PolarHBondContact O-N 3.12Å
127P97.2Very high92.7Very high27 Ų2746.9 Ų46.918%0.17526%0.26CS..Hα-helixtrans-54.8-41.4174.1-30.536.1000114.5F86 I107 A123 L124 D130 C131F86-P127 HydrophobicContact CD2-CB 4.12Å; F86-P127 HydrophobicContact CE2-CB 4Å; F86-P127 WeakPolarHBondContact CE2-O 3.49Å; F86-P127 HydrophobicContact CZ-CB 4.33Å; I107-P127 HydrophobicContact CD1-CB 3.59Å; A123-P127 WeakPolarHBondContact O-CD 3.47Å; A123-P127 WeakPolarHBondContact O-CG 3.45Å; L124-P127 WeakPolarHBondContact O-CD 3.42Å; P127-D130 PolarHBondContact O-N 3.43Å; P127-C131 PolarHBondContact O-N 3.13Å; P127-C131 PolarHBondContact O-SG 2.91Å
128V98.1Very high93.7Very high0 Ų042.8 Ų42.80%024%0.242CC..Hα-helixtrans-64.5-48.4177.3169.50000110.4I107 F111 L124 V125 L126 D130 C131 L132 I157 L161I107-V128 HydrophobicContact CD1-CG2 4.48Å; I107-V128 HydrophobicContact CG1-CG2 4.06Å; I107-V128 HydrophobicContact CG2-CG2 4.47Å; F111-V128 HydrophobicContact CB-CG2 3.92Å; F111-V128 HydrophobicContact CD2-CG2 4.48Å; F111-V128 HydrophobicContact CG-CG2 4.26Å; L124-V128 WeakPolarHBondContact O-CB 3.34Å; L124-V128 VanDerWaalsContact O-CG2 3.23Å; L124-V128 WeakPolarHBondContact O-CG2 3.32Å; L124-V128 PolarHBondContact O-N 3.09Å; V125-V128 PolarHBondContact O-N 2.87Å; L126-V128 VanDerWaalsContact C-N 3.31Å; L126-V128 PolarHBondContact O-N 2.9Å; V128-D130 VanDerWaalsContact C-N 3.32Å; V128-D130 PolarHBondContact O-N 3.18Å; V128-C131 WeakPolarHBondContact O-CB 3.42Å; V128-C131 PolarHBondContact O-N 3.08Å; V128-L132 HydrophobicContact CG1-CD1 4.16Å; V128-L132 HydrophobicContact CG1-CG 4.46Å; V128-L132 WeakPolarHBondContact O-CG 3.32Å; V128-L132 PolarHBondContact O-N 3.08Å; V128-I157 HydrophobicContact CG1-CD1 3.76Å; V128-L161 HydrophobicContact CB-CD2 4.41Å; V128-L161 HydrophobicContact CG1-CD1 3.69Å; V128-L161 HydrophobicContact CG1-CD2 3.92Å; V128-L161 HydrophobicContact CG1-CG 4.39Å
129Y98.3Very high94.7Very high0 Ų039.3 Ų39.30%022%0.223CC..Hα-helixtrans-58.6-43.4175.3-87.7-67.8000112.4V125 L126 C131 L132 M133 L161 N165 R168 M169V125-Y129 HydrophobicContact CG1-CD2 3.82Å; V125-Y129 HydrophobicContact CG1-CE2 3.84Å; V125-Y129 VanDerWaalsContact O-CD2 3.28Å; V125-Y129 WeakPolarHBondContact O-CD2 3.32Å; V125-Y129 PolarHBondContact O-N 2.78Å; L126-Y129 PolarHBondContact O-N 2.89Å; Y129-C131 VanDerWaalsContact C-N 3.27Å; Y129-C131 PolarHBondContact O-N 3.38Å; Y129-L132 PolarHBondContact O-N 2.93Å; Y129-L132 VanDerWaalsContact O-N 3.15Å; Y129-M133 WeakPolarHBondContact O-CB 3.21Å; Y129-M133 WeakPolarHBondContact O-CG 3.36Å; Y129-M133 PolarHBondContact O-N 2.69Å; Y129-L161 HydrophobicContact CD2-CD2 4.29Å; Y129-L161 HydrophobicContact CE2-CB 4.27Å; Y129-L161 HydrophobicContact CE2-CD2 3.93Å; Y129-L161 PolarHBondContact OH-O 3.06Å; Y129-N165 HydrophobicContact CE2-CB 3.97Å; Y129-N165 PolarHBondContact OH-O 2.92Å; Y129-R168 HydrophobicContact CD1-CB 3.99Å; Y129-R168 HydrophobicContact CD1-CG 3.48Å; Y129-R168 VanDerWaalsContact CD1-CG 3.48Å; Y129-R168 HydrophobicContact CD2-CB 4.26Å; Y129-R168 HydrophobicContact CD2-CG 3.94Å; Y129-R168 HydrophobicContact CE1-CB 3.82Å; Y129-R168 HydrophobicContact CE1-CG 3.86Å; Y129-R168 HydrophobicContact CE2-CB 4.11Å; Y129-R168 HydrophobicContact CE2-CG 4.3Å; Y129-R168 HydrophobicContact CG-CB 4.21Å; Y129-R168 HydrophobicContact CG-CG 3.52Å; Y129-M169 HydrophobicContact CE1-CB 4.41Å; Y129-M169 HydrophobicContact CE1-CE 4.07Å; Y129-M169 HydrophobicContact CE1-SD 4.5Å
130D98.3Very high95.5Very high48 Ų4833.3 Ų33.326%0.25719%0.193SC..Hα-helixtrans-62.4-35.8179.3-71.1-10000112F86 L126 P127 V128 R134 R168F86-D130 HydrophobicContact CE2-CB 4.03Å; F86-D130 HydrophobicContact CZ-CB 3.66Å; L126-D130 WeakPolarHBondContact O-CB 3.39Å; L126-D130 VanDerWaalsContact O-CG 3.3Å; L126-D130 PolarHBondContact O-N 3.12Å; P127-D130 PolarHBondContact O-N 3.43Å; V128-D130 VanDerWaalsContact C-N 3.32Å; V128-D130 PolarHBondContact O-N 3.18Å; D130-R134 WeakPolarHBondContact O-CB 3.39Å; D130-R134 PolarHBondContact O-N 3.34Å; D130-R168 IonicContact OD1-CZ 2.86Å; D130-R168 IonicContact OD1-NH2 3.33Å; D130-R168 PolarHBondContact OD1-NH2 2.77Å
131C98.5Very high96.2Very high0 Ų032.3 Ų32.30%019%0.187CC..Hα-helixtrans-64.5-47.5171-76.10000112.3W100 V104 P127 V128 Y129 R134 L135W100-C131 HydrophobicContact CH2-CB 4.16Å; V104-C131 HydrophobicContact CG1-CB 4.13Å; V104-C131 HydrophobicContact CG2-CB 3.97Å; P127-C131 PolarHBondContact O-N 3.13Å; P127-C131 PolarHBondContact O-SG 2.91Å; V128-C131 WeakPolarHBondContact O-CB 3.42Å; V128-C131 PolarHBondContact O-N 3.08Å; Y129-C131 VanDerWaalsContact C-N 3.27Å; Y129-C131 PolarHBondContact O-N 3.38Å; C131-R134 WeakPolarHBondContact O-CB 3.25Å; C131-R134 PolarHBondContact O-N 3.38Å; C131-L135 WeakPolarHBondContact O-CG 3.5Å; C131-L135 PolarHBondContact O-N 3.29Å
132L98.7Very high96.7Very high0 Ų035.2 Ų35.20%020%0.202CC..Hα-helixtrans-65.5-40.9179.4-60.6176.7000111.9V128 Y129 R134 L135 A136 L150 Q153 L154 L161 L172V128-L132 HydrophobicContact CG1-CD1 4.16Å; V128-L132 HydrophobicContact CG1-CG 4.46Å; V128-L132 WeakPolarHBondContact O-CG 3.32Å; V128-L132 PolarHBondContact O-N 3.08Å; Y129-L132 PolarHBondContact O-N 2.93Å; Y129-L132 VanDerWaalsContact O-N 3.15Å; L132-R134 VanDerWaalsContact C-N 3.25Å; L132-R134 PolarHBondContact O-N 3.08Å; L132-L135 PolarHBondContact O-N 2.84Å; L132-A136 WeakPolarHBondContact O-CB 3.18Å; L132-A136 PolarHBondContact O-N 3.37Å; L132-L150 HydrophobicContact CB-CD1 4.03Å; L132-L150 HydrophobicContact CD2-CD1 3.79Å; L132-L150 HydrophobicContact CG-CD1 4.47Å; L132-Q153 HydrophobicContact CD2-CB 3.82Å; L132-Q153 HydrophobicContact CD2-CG 4.35Å; L132-L154 HydrophobicContact CD1-CD2 4.27Å; L132-L161 HydrophobicContact CD1-CD1 3.6Å; L132-L172 HydrophobicContact CB-CD1 4.35Å; L132-L172 HydrophobicContact CB-CD2 3.87Å; L132-L172 HydrophobicContact CD1-CD2 4.22Å
133M98.6Very high97.2Very high37 Ų3732.5 Ų32.518%0.18218%0.184CC..Hα-helixtrans-63-33.7174.7-68.4-70-83.800111.6Y129 A136 Q137 E171 L172 L175Y129-M133 WeakPolarHBondContact O-CB 3.21Å; Y129-M133 WeakPolarHBondContact O-CG 3.36Å; Y129-M133 PolarHBondContact O-N 2.69Å; M133-A136 PolarHBondContact O-N 3.23Å; M133-Q137 WeakPolarHBondContact O-CG 3.49Å; M133-Q137 PolarHBondContact O-N 3.15Å; M133-Q137 PolarHBondContact O-NE2 3.28Å; M133-E171 HydrophobicContact CE-CB 4.22Å; M133-L172 HydrophobicContact CG-CD1 4.43Å; M133-L172 VanDerWaalsContact SD-CA 3.53Å; M133-L172 HydrophobicContact SD-CB 3.71Å; M133-L172 HydrophobicContact SD-CD1 3.76Å; M133-L172 HydrophobicContact SD-CG 4.33Å; M133-L175 HydrophobicContact CE-CD1 3.58Å; M133-L175 HydrophobicContact SD-CD1 3.73Å
134R98.6Very high97.5Very high32 Ų3233 Ų3312%0.12117%0.173CC..Hα-helixtrans-69-41174.6179.660.2-170.3101.3-17.2112.2E90 W100 D130 C131 L132 A136 Q137 D139E90-R134 WeakPolarHBondContact OE1-CD 3.48Å; E90-R134 IonicContact OE1-NE 3.75Å; E90-R134 PolarHBondContact OE1-NE 2.83Å; E90-R134 IonicContact OE2-CZ 3.46Å; E90-R134 IonicContact OE2-NE 3.82Å; E90-R134 PolarHBondContact OE2-NE 3.42Å; E90-R134 VanDerWaalsContact OE2-NE 3.09Å; E90-R134 IonicContact OE2-NH2 2.68Å; W100-R134 HydrophobicContact CH2-CB 4.4Å; W100-R134 HydrophobicContact CH2-CG 4.27Å; W100-R134 HydrophobicContact CZ2-CB 4.03Å; W100-R134 HydrophobicContact CZ2-CG 3.7Å; D130-R134 WeakPolarHBondContact O-CB 3.39Å; D130-R134 PolarHBondContact O-N 3.34Å; C131-R134 WeakPolarHBondContact O-CB 3.25Å; C131-R134 PolarHBondContact O-N 3.38Å; L132-R134 VanDerWaalsContact C-N 3.25Å; L132-R134 PolarHBondContact O-N 3.08Å; R134-A136 PolarHBondContact O-N 3.19Å; R134-Q137 WeakPolarHBondContact O-CB 3.49Å; R134-Q137 WeakPolarHBondContact O-CG 3.37Å; R134-Q137 PolarHBondContact O-N 2.93Å; R134-D139 IonicContact CZ-OD1 3.04Å; R134-D139 IonicContact CZ-OD2 2.75Å; R134-D139 IonicContact NH1-OD1 2.68Å; R134-D139 PolarHBondContact NH1-OD1 3.2Å; R134-D139 IonicContact NH1-OD2 3.2Å; R134-D139 PolarHBondContact NH1-OD2 3.28Å; R134-D139 IonicContact NH2-OD1 2.63Å; R134-D139 PolarHBondContact NH2-OD1 3.02Å; R134-D139 IonicContact NH2-OD2 3.81Å; R134-D139 PolarHBondContact NH2-OD2 2.88Å
135L98.6Very high97.6Very high0 Ų036.5 Ų36.50%019%0.189CC..Hα-helixtrans-68.4-24.3174.9-66.2175.4000112.6W100 V104 C131 L132 Q137 A140 E146 C149 L150W100-L135 HydrophobicContact CZ2-CD2 4.24Å; W100-L135 HydrophobicContact CZ2-CG 4.38Å; V104-L135 HydrophobicContact CB-CD1 4.4Å; V104-L135 HydrophobicContact CG1-CD1 3.81Å; V104-L135 HydrophobicContact CG2-CD1 4.27Å; C131-L135 WeakPolarHBondContact O-CG 3.5Å; C131-L135 PolarHBondContact O-N 3.29Å; L132-L135 PolarHBondContact O-N 2.84Å; L135-Q137 VanDerWaalsContact C-N 3.3Å; L135-A140 VanDerWaalsContact O-CB 3.31Å; L135-A140 WeakPolarHBondContact O-CB 3.34Å; L135-E146 HydrophobicContact CD2-CB 3.7Å; L135-E146 HydrophobicContact CD2-CG 3.8Å; L135-C149 HydrophobicContact CD1-CB 4.4Å; L135-L150 HydrophobicContact CB-CB 3.96Å; L135-L150 HydrophobicContact CB-CD1 4.14Å; L135-L150 HydrophobicContact CB-CD2 4.08Å; L135-L150 HydrophobicContact CB-CG 4.29Å; L135-L150 HydrophobicContact CD1-CB 3.99Å; L135-L150 HydrophobicContact CD1-CD1 4.48Å
136A98.5Very high97.9Very high2 Ų236.1 Ų36.12%0.01719%0.187CC..THydrogen-bonded Turntrans-841.5175.500000114.2L132 M133 R134 L150 L172 L175 L176L132-A136 WeakPolarHBondContact O-CB 3.18Å; L132-A136 PolarHBondContact O-N 3.37Å; M133-A136 PolarHBondContact O-N 3.23Å; R134-A136 PolarHBondContact O-N 3.19Å; A136-L150 HydrophobicContact CB-CD2 4.24Å; A136-L172 HydrophobicContact CB-CD1 3.57Å; A136-L175 HydrophobicContact CB-CB 4.11Å; A136-L175 HydrophobicContact CB-CD1 4.28Å; A136-L176 HydrophobicContact CB-CD2 3.8Å
137Q98.4Very high98Very high69 Ų6931.7 Ų31.732%0.32216%0.164SC..SBendtrans-72.1151.2177.2-65.6-56.8-57.500111.6M133 R134 L135 D139 A140 L141M133-Q137 WeakPolarHBondContact O-CG 3.49Å; M133-Q137 PolarHBondContact O-N 3.15Å; M133-Q137 PolarHBondContact O-NE2 3.28Å; R134-Q137 WeakPolarHBondContact O-CB 3.49Å; R134-Q137 WeakPolarHBondContact O-CG 3.37Å; R134-Q137 PolarHBondContact O-N 2.93Å; L135-Q137 VanDerWaalsContact C-N 3.3Å; Q137-D139 VanDerWaalsContact C-N 3.27Å; Q137-D139 WeakPolarHBondContact CB-OD1 3.25Å; Q137-D139 PolarHBondContact O-N 3.41Å; Q137-D139 VanDerWaalsContact O-N 3.13Å; Q137-A140 PolarHBondContact O-N 2.91Å; Q137-L141 WeakPolarHBondContact O-CG 3.45Å; Q137-L141 PolarHBondContact O-N 3.21Å
138P97.6Very high98Very high67 Ų6734.5 Ų34.544%0.43518%0.177SC..Hα-helixtrans-50.1-42.1-178.9-31.337.1000114.6A140 L141 L142 Q183P138-A140 VanDerWaalsContact C-N 3.34Å; P138-A140 PolarHBondContact O-N 3.08Å; P138-L141 PolarHBondContact O-N 3.02Å; P138-L142 WeakPolarHBondContact O-CG 3.19Å; P138-Q183 PolarHBondContact O-NE2 3.47Å; P138-Q183 VanDerWaalsContact O-NE2 3.12Å
139D97.3Very high98Very high71 Ų7134.8 Ų34.838%0.3818%0.179SC..Hα-helixtrans-70.4-29.3-179.973.6-51.3000113.3R93 R134 Q137R93-D139 IonicContact CZ-OD2 3.09Å; R93-D139 VanDerWaalsContact CZ-OD2 3.29Å; R93-D139 IonicContact NH1-OD2 3.59Å; R93-D139 PolarHBondContact NH1-OD2 2.75Å; R93-D139 IonicContact NH2-OD2 3.07Å; R93-D139 PolarHBondContact NH2-OD2 3.29Å; R93-D139 VanDerWaalsContact NH2-OD2 3.12Å; R134-D139 IonicContact CZ-OD1 3.04Å; R134-D139 IonicContact CZ-OD2 2.75Å; R134-D139 IonicContact NH1-OD1 2.68Å; R134-D139 PolarHBondContact NH1-OD1 3.2Å; R134-D139 IonicContact NH1-OD2 3.2Å; R134-D139 PolarHBondContact NH1-OD2 3.28Å; R134-D139 IonicContact NH2-OD1 2.63Å; R134-D139 PolarHBondContact NH2-OD1 3.02Å; R134-D139 IonicContact NH2-OD2 3.81Å; R134-D139 PolarHBondContact NH2-OD2 2.88Å; Q137-D139 VanDerWaalsContact C-N 3.27Å; Q137-D139 WeakPolarHBondContact CB-OD1 3.25Å; Q137-D139 PolarHBondContact O-N 3.41Å; Q137-D139 VanDerWaalsContact O-N 3.13Å
140A98.1Very high98.1Very high0 Ų034.8 Ų34.80%018%0.179CC..Hα-helixtrans-80.7-34.8176.900000111.9L135 Q137 P138 L142 N143 E146L135-A140 VanDerWaalsContact O-CB 3.31Å; L135-A140 WeakPolarHBondContact O-CB 3.34Å; Q137-A140 PolarHBondContact O-N 2.91Å; P138-A140 VanDerWaalsContact C-N 3.34Å; P138-A140 PolarHBondContact O-N 3.08Å; A140-L142 PolarHBondContact O-N 3.42Å; A140-N143 WeakPolarHBondContact O-CA 3.22Å; A140-N143 WeakPolarHBondContact O-CB 3.37Å; A140-N143 PolarHBondContact O-N 3.35Å; A140-E146 WeakPolarHBondContact CA-OE2 3.17Å; A140-E146 HydrophobicContact CB-CB 4.4Å
141L98.1Very high98.1Very high1 Ų132.8 Ų32.81%0.00517%0.168CC..Hα-helixtrans-64.9-20.5176.9-65.8-177000113.6Q137 P138 V147 L150 L186 L194Q137-L141 WeakPolarHBondContact O-CG 3.45Å; Q137-L141 PolarHBondContact O-N 3.21Å; P138-L141 PolarHBondContact O-N 3.02Å; L141-V147 HydrophobicContact CD2-CG2 4.07Å; L141-V147 WeakPolarHBondContact O-CG2 3.48Å; L141-L150 HydrophobicContact CD2-CD2 4.44Å; L141-L186 HydrophobicContact CB-CD2 3.9Å; L141-L186 VanDerWaalsContact O-CD2 3.26Å; L141-L186 WeakPolarHBondContact O-CD2 3.19Å; L141-L194 HydrophobicContact CD2-CD1 4.36Å; L141-L194 HydrophobicContact CD2-CD2 4.11Å
142L97.3Very high98Very high78 Ų7835.3 Ų35.341%0.40818%0.182SC..THydrogen-bonded Turntrans-76.3-11.5171.3-64.1177.3000113.1P138 A140 Q183 E184 L186P138-L142 WeakPolarHBondContact O-CG 3.19Å; A140-L142 PolarHBondContact O-N 3.42Å; L142-Q183 HydrophobicContact CD2-CG 4.14Å; L142-E184 WeakPolarHBondContact CD2-O 3.1Å; L142-L186 HydrophobicContact CD2-CD2 4.49Å
143N97.7Very high98Very high65 Ų6535.3 Ų35.335%0.34818%0.182SC..  trans-104.3110.7-180-127.5-56.6000110.2L97 A140 E145 E146 V147L97-N143 VanDerWaalsContact CD2-OD1 3.24Å; L97-N143 WeakPolarHBondContact CD2-OD1 3.26Å; A140-N143 WeakPolarHBondContact O-CA 3.22Å; A140-N143 WeakPolarHBondContact O-CB 3.37Å; A140-N143 PolarHBondContact O-N 3.35Å; N143-E145 VanDerWaalsContact C-N 3.29Å; N143-E145 PolarHBondContact O-N 3.32Å; N143-E146 HydrophobicContact CB-CB 4.19Å; N143-E146 HydrophobicContact CB-CG 4.2Å; N143-E146 PolarHBondContact O-N 2.96Å; N143-V147 PolarHBondContact O-N 3.01Å; N143-V147 VanDerWaalsContact O-N 3.12Å
144E96.6Very high98Very high87 Ų8733.6 Ų33.641%0.40717%0.173SC..Hα-helixtrans-60.6-36.4-174.4-168.4169.2118.200113E146 V147 D148 T187 M189E144-E146 VanDerWaalsContact C-N 3.3Å; E144-E146 PolarHBondContact O-N 3.37Å; E144-V147 PolarHBondContact O-N 3.48Å; E144-D148 WeakPolarHBondContact O-CB 3.5Å; E144-D148 PolarHBondContact O-N 3.38Å; E144-T187 PolarHBondContact OE2-OG1 3.13Å; E144-M189 HydrophobicContact CG-CB 4.28Å; E144-M189 HydrophobicContact CG-CG 4.21Å; E144-M189 WeakPolarHBondContact OE2-CB 3.45Å
145E96.9Very high97.9Very high82 Ų8234.9 Ų34.938%0.38318%0.181SC..Hα-helixtrans-63.8-34.2176.8-169.3-179.8174.400112.4L97 V101 N143 C149L97-E145 HydrophobicContact CD2-CB 4.24Å; V101-E145 HydrophobicContact CG1-CG 4.34Å; V101-E145 HydrophobicContact CG2-CG 4.2Å; V101-E145 WeakPolarHBondContact CG2-OE1 3.42Å; N143-E145 VanDerWaalsContact C-N 3.29Å; N143-E145 PolarHBondContact O-N 3.32Å; E145-C149 WeakPolarHBondContact O-CB 3.37Å; E145-C149 PolarHBondContact O-N 3Å; E145-C149 VanDerWaalsContact O-N 3.12Å
146E98.4Very high97.8Very high0 Ų038.2 Ų38.20%019%0.193CC..Hα-helixtrans-74.7-38.2176.3-73.1-170.2103.800111.9R93 L97 W100 V101 L135 A140 N143 E144 C149 L150R93-E146 IonicContact CZ-OE1 2.69Å; R93-E146 IonicContact CZ-OE2 2.7Å; R93-E146 IonicContact NE-OE1 3.91Å; R93-E146 PolarHBondContact NE-OE1 3.46Å; R93-E146 IonicContact NE-OE2 2.73Å; R93-E146 PolarHBondContact NE-OE2 3.4Å; R93-E146 IonicContact NH2-OE1 3.28Å; R93-E146 IonicContact NH2-OE2 2.87Å; R93-E146 PolarHBondContact NH2-OE2 2.86Å; L97-E146 HydrophobicContact CD1-CG 3.73Å; L97-E146 HydrophobicContact CG-CG 4.4Å; W100-E146 VanDerWaalsContact CD1-OE1 3.3Å; W100-E146 PolarHBondContact NE1-OE1 3.04Å; V101-E146 HydrophobicContact CG1-CG 4.09Å; L135-E146 HydrophobicContact CD2-CB 3.7Å; L135-E146 HydrophobicContact CD2-CG 3.8Å; A140-E146 WeakPolarHBondContact CA-OE2 3.17Å; A140-E146 HydrophobicContact CB-CB 4.4Å; N143-E146 HydrophobicContact CB-CB 4.19Å; N143-E146 HydrophobicContact CB-CG 4.2Å; N143-E146 PolarHBondContact O-N 2.96Å; E144-E146 VanDerWaalsContact C-N 3.3Å; E144-E146 PolarHBondContact O-N 3.37Å; E146-C149 PolarHBondContact O-N 2.89Å; E146-L150 WeakPolarHBondContact O-CB 3.39Å; E146-L150 PolarHBondContact O-N 2.97Å
147V98.5Very high97.7Very high0 Ų038.1 Ų38.10%019%0.192CC..Hα-helixtrans-65.7-44.7175.4178.60000111L141 N143 E144 C149 L150 V151 A190 L193 L194L141-V147 HydrophobicContact CD2-CG2 4.07Å; L141-V147 WeakPolarHBondContact O-CG2 3.48Å; N143-V147 PolarHBondContact O-N 3.01Å; N143-V147 VanDerWaalsContact O-N 3.12Å; E144-V147 PolarHBondContact O-N 3.48Å; V147-C149 VanDerWaalsContact C-N 3.34Å; V147-C149 PolarHBondContact O-N 2.97Å; V147-L150 WeakPolarHBondContact O-CB 3.49Å; V147-L150 PolarHBondContact O-N 3.44Å; V147-V151 HydrophobicContact CG1-CG2 4.43Å; V147-V151 WeakPolarHBondContact O-CG2 3.33Å; V147-V151 PolarHBondContact O-N 3.26Å; V147-A190 HydrophobicContact CB-CB 4.43Å; V147-A190 HydrophobicContact CG1-CB 4.28Å; V147-A190 HydrophobicContact CG2-CB 4.16Å; V147-L193 HydrophobicContact CG1-CB 4.03Å; V147-L193 HydrophobicContact CG1-CD1 4.22Å; V147-L194 HydrophobicContact CG1-CD2 4.33Å; V147-L194 HydrophobicContact CG1-CG 4.19Å
148D97.9Very high97.7Very high86 Ų8634.9 Ų34.946%0.4618%0.178SC..Hα-helixtrans-57.5-48174.3-179.173000111.1E144 L150 V151 L152 L193E144-D148 WeakPolarHBondContact O-CB 3.5Å; E144-D148 PolarHBondContact O-N 3.38Å; D148-L150 PolarHBondContact O-N 3.19Å; D148-V151 PolarHBondContact O-N 3.4Å; D148-L152 WeakPolarHBondContact O-CB 3.31Å; D148-L152 PolarHBondContact O-N 3.21Å; D148-L193 HydrophobicContact CB-CD1 4.4Å
149C98.3Very high97.7Very high5 Ų535.9 Ų35.93%0.03418%0.176CC..Hα-helixtrans-58.9-45.8177.2-176.10000112.1V101 L135 E145 E146 V147 L152 Q153V101-C149 HydrophobicContact CB-CB 4.01Å; V101-C149 HydrophobicContact CG1-CB 4.01Å; L135-C149 HydrophobicContact CD1-CB 4.4Å; E145-C149 WeakPolarHBondContact O-CB 3.37Å; E145-C149 PolarHBondContact O-N 3Å; E145-C149 VanDerWaalsContact O-N 3.12Å; E146-C149 PolarHBondContact O-N 2.89Å; V147-C149 VanDerWaalsContact C-N 3.34Å; V147-C149 PolarHBondContact O-N 2.97Å; C149-L152 PolarHBondContact O-N 2.64Å; C149-Q153 VanDerWaalsContact O-CG 3.23Å; C149-Q153 WeakPolarHBondContact O-CG 3.3Å; C149-Q153 PolarHBondContact O-N 3Å; C149-Q153 PolarHBondContact O-NE2 3.07Å
150L98.7Very high97.6Very high0 Ų034.5 Ų34.50%017%0.168CC..Hα-helixtrans-59.2-52.1179.3176.555000111.9L132 L135 A136 L141 E146 V147 D148 Q153 L154 L176L132-L150 HydrophobicContact CB-CD1 4.03Å; L132-L150 HydrophobicContact CD2-CD1 3.79Å; L132-L150 HydrophobicContact CG-CD1 4.47Å; L135-L150 HydrophobicContact CB-CB 3.96Å; L135-L150 HydrophobicContact CB-CD1 4.14Å; L135-L150 HydrophobicContact CB-CD2 4.08Å; L135-L150 HydrophobicContact CB-CG 4.29Å; L135-L150 HydrophobicContact CD1-CB 3.99Å; L135-L150 HydrophobicContact CD1-CD1 4.48Å; A136-L150 HydrophobicContact CB-CD2 4.24Å; L141-L150 HydrophobicContact CD2-CD2 4.44Å; E146-L150 WeakPolarHBondContact O-CB 3.39Å; E146-L150 PolarHBondContact O-N 2.97Å; V147-L150 WeakPolarHBondContact O-CB 3.49Å; V147-L150 PolarHBondContact O-N 3.44Å; D148-L150 PolarHBondContact O-N 3.19Å; L150-Q153 PolarHBondContact O-N 2.95Å; L150-L154 HydrophobicContact CD1-CD1 3.99Å; L150-L154 HydrophobicContact CD1-CG 4.32Å; L150-L154 HydrophobicContact CG-CD1 4.18Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 2.98Å; L150-L176 HydrophobicContact CD2-CD2 3.69Å
151V98.2Very high97.5Very high6 Ų634.5 Ų34.54%0.03617%0.168CC..Hα-helixtrans-64.2-43.2-179.2172.90000110.3V147 D148 Q153 L154 H155 L193 V197V147-V151 HydrophobicContact CG1-CG2 4.43Å; V147-V151 WeakPolarHBondContact O-CG2 3.33Å; V147-V151 PolarHBondContact O-N 3.26Å; D148-V151 PolarHBondContact O-N 3.4Å; V151-Q153 VanDerWaalsContact C-N 3.33Å; V151-Q153 PolarHBondContact O-N 3.31Å; V151-L154 PolarHBondContact O-N 2.88Å; V151-H155 VanDerWaalsContact CG1-CE1 3.43Å; V151-H155 WeakPolarHBondContact CG1-CE1 3.3Å; V151-H155 WeakPolarHBondContact CG1-ND1 3.46Å; V151-H155 PolarHBondContact O-N 3.09Å; V151-H155 PolarHBondContact O-ND1 3.22Å; V151-L193 HydrophobicContact CG2-CB 4.13Å; V151-V197 HydrophobicContact CG1-CB 4.09Å; V151-V197 HydrophobicContact CG1-CG2 4.33Å; V151-V197 HydrophobicContact CG2-CB 3.99Å; V151-V197 HydrophobicContact CG2-CG1 3.97Å; V151-V197 HydrophobicContact CG2-CG2 4.44Å
152L97.6Very high97.5Very high54 Ų5436.7 Ų36.728%0.28318%0.178SC..Hα-helixtrans-56.7-44.3174.9177.764.7000112.2D148 C149 H155 R156D148-L152 WeakPolarHBondContact O-CB 3.31Å; D148-L152 PolarHBondContact O-N 3.21Å; C149-L152 PolarHBondContact O-N 2.64Å; L152-H155 PolarHBondContact O-N 2.95Å; L152-R156 VanDerWaalsContact O-CG 3.26Å; L152-R156 WeakPolarHBondContact O-CG 3.49Å; L152-R156 PolarHBondContact O-N 2.97Å
153Q98.3Very high97.4Very high0 Ų040.1 Ų40.10%019%0.189CC..Hα-helixtrans-69.5-39.1179-58.2-26.9-57.900111.8V104 T105 C108 L132 C149 L150 V151 H155 R156 I157V104-Q153 HydrophobicContact CG1-CG 4.14Å; T105-Q153 PolarHBondContact OG1-NE2 3.09Å; C108-Q153 HydrophobicContact CB-CB 4.43Å; C108-Q153 HydrophobicContact CB-CG 4.04Å; L132-Q153 HydrophobicContact CD2-CB 3.82Å; L132-Q153 HydrophobicContact CD2-CG 4.35Å; C149-Q153 VanDerWaalsContact O-CG 3.23Å; C149-Q153 WeakPolarHBondContact O-CG 3.3Å; C149-Q153 PolarHBondContact O-N 3Å; C149-Q153 PolarHBondContact O-NE2 3.07Å; L150-Q153 PolarHBondContact O-N 2.95Å; V151-Q153 VanDerWaalsContact C-N 3.33Å; V151-Q153 PolarHBondContact O-N 3.31Å; Q153-H155 VanDerWaalsContact C-N 3.31Å; Q153-H155 PolarHBondContact O-N 2.98Å; Q153-R156 PolarHBondContact O-N 3.07Å; Q153-R156 VanDerWaalsContact O-N 3.12Å; Q153-I157 WeakPolarHBondContact O-CG1 3.25Å; Q153-I157 PolarHBondContact O-N 3.47Å
154L98.4Very high97.2Very high1 Ų140.1 Ų40.11%0.00519%0.192CC..Hα-helixtrans-62.5-37.7176.2-74.3173.3000112.2L132 L150 V151 R156 G158 M169 L172 F173 L176 V197 W205L132-L154 HydrophobicContact CD1-CD2 4.27Å; L150-L154 HydrophobicContact CD1-CD1 3.99Å; L150-L154 HydrophobicContact CD1-CG 4.32Å; L150-L154 HydrophobicContact CG-CD1 4.18Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 2.98Å; V151-L154 PolarHBondContact O-N 2.88Å; L154-R156 VanDerWaalsContact C-N 3.29Å; L154-R156 PolarHBondContact O-N 3.04Å; L154-G158 WeakPolarHBondContact O-CA 3.49Å; L154-G158 PolarHBondContact O-N 3.31Å; L154-M169 HydrophobicContact CD2-CE 4.3Å; L154-M169 HydrophobicContact CD2-SD 4.15Å; L154-L172 HydrophobicContact CD2-CD2 3.95Å; L154-F173 HydrophobicContact CD1-CE2 4.16Å; L154-F173 HydrophobicContact CD1-CZ 4.19Å; L154-F173 HydrophobicContact CD2-CE2 4.11Å; L154-L176 HydrophobicContact CD1-CD1 4.05Å; L154-V197 HydrophobicContact CB-CG2 3.84Å; L154-V197 HydrophobicContact CD1-CG2 3.75Å; L154-V197 HydrophobicContact CG-CG2 4.46Å; L154-W205 HydrophobicContact CB-CZ3 4.24Å; L154-W205 HydrophobicContact CD2-CH2 4.14Å; L154-W205 HydrophobicContact CD2-CZ3 4.31Å; L154-W205 WeakPolarHBondContact O-CZ3 3.37Å
155H97.6Very high97.1Very high59 Ų5938.4 Ų38.427%0.27319%0.186SC..Hα-helixtrans-59.4-40.1172.2-82.373.8000113.1V151 L152 Q153 E196 F200V151-H155 VanDerWaalsContact CG1-CE1 3.43Å; V151-H155 WeakPolarHBondContact CG1-CE1 3.3Å; V151-H155 WeakPolarHBondContact CG1-ND1 3.46Å; V151-H155 PolarHBondContact O-N 3.09Å; V151-H155 PolarHBondContact O-ND1 3.22Å; L152-H155 PolarHBondContact O-N 2.95Å; Q153-H155 VanDerWaalsContact C-N 3.31Å; Q153-H155 PolarHBondContact O-N 2.98Å; H155-E196 IonicContact CE1-OE1 2.79Å; H155-E196 PolarHBondContact CE1-OE1 2.86Å; H155-E196 IonicContact CE1-OE2 3.43Å; H155-E196 PolarHBondContact CE1-OE2 3.32Å; H155-E196 IonicContact NE2-OE1 3.62Å; H155-E196 PolarHBondContact NE2-OE1 3.41Å; H155-E196 IonicContact NE2-OE2 3.06Å; H155-F200 AromaticContact CD2-CE1 3.93Å; H155-F200 AromaticContact CD2-CZ 3.98Å
156R95.8Very high97.1Very high69 Ų6937.8 Ų37.826%0.2619%0.19SC..Hα-helixtrans-84.1-44.9-171.2-68.1177.765.2-152.3-4.7113.1N109 D112 L152 Q153 L154N109-R156 PolarHBondContact ND2-NH1 3.2Å; N109-R156 PolarHBondContact OD1-NH1 3.5Å; N109-R156 PolarHBondContact OD1-NH2 3.14Å; D112-R156 IonicContact OD2-NH2 3.37Å; L152-R156 VanDerWaalsContact O-CG 3.26Å; L152-R156 WeakPolarHBondContact O-CG 3.49Å; L152-R156 PolarHBondContact O-N 2.97Å; Q153-R156 PolarHBondContact O-N 3.07Å; Q153-R156 VanDerWaalsContact O-N 3.12Å; L154-R156 VanDerWaalsContact C-N 3.29Å; L154-R156 PolarHBondContact O-N 3.04Å
157I96.8Very high97.1Very high0 Ų043.9 Ų43.90%022%0.219CC..Hα-helixtrans-126.52.6-17062.9162.8000113.5C108 F111 D112 V128 Q153 E159 Q160 L161C108-I157 HydrophobicContact CB-CD1 3.65Å; F111-I157 HydrophobicContact CD1-CB 4.15Å; F111-I157 HydrophobicContact CD1-CD1 3.77Å; F111-I157 HydrophobicContact CD1-CG2 4.19Å; F111-I157 HydrophobicContact CE1-CB 4.21Å; F111-I157 HydrophobicContact CE1-CD1 4.31Å; D112-I157 HydrophobicContact CB-CG2 3.75Å; V128-I157 HydrophobicContact CG1-CD1 3.76Å; Q153-I157 WeakPolarHBondContact O-CG1 3.25Å; Q153-I157 PolarHBondContact O-N 3.47Å; I157-E159 PolarHBondContact O-N 3.36Å; I157-Q160 PolarHBondContact O-N 3.5Å; I157-L161 HydrophobicContact CD1-CD1 3.71Å; I157-L161 HydrophobicContact CD1-CG 4.21Å; I157-L161 HydrophobicContact CG1-CD1 3.93Å; I157-L161 HydrophobicContact CG1-CG 4.43Å; I157-L161 WeakPolarHBondContact O-CB 3.46Å; I157-L161 WeakPolarHBondContact O-CG 3.14Å; I157-L161 PolarHBondContact O-N 3.44Å
158G97.6Very high97Very high1 Ų147.2 Ų47.21%0.0123%0.231CC..Hα-helixtrans-59.5-49.4-176.600000113.4L154 Q160 L161 E162 M169 W205L154-G158 WeakPolarHBondContact O-CA 3.49Å; L154-G158 PolarHBondContact O-N 3.31Å; G158-Q160 VanDerWaalsContact C-N 3.3Å; G158-Q160 PolarHBondContact O-N 3.45Å; G158-L161 PolarHBondContact O-N 2.82Å; G158-E162 WeakPolarHBondContact O-CB 3.39Å; G158-E162 PolarHBondContact O-N 3.32Å; G158-M169 WeakPolarHBondContact O-CE 3.38Å; G158-W205 VanDerWaalsContact C-CZ2 3.42Å; G158-W205 VanDerWaalsContact CA-CH2 3.43Å; G158-W205 VanDerWaalsContact CA-CZ3 3.43Å; G158-W205 WeakPolarHBondContact O-CZ2 3.39Å
159E97.1Very high97Very high88 Ų8843.1 Ų43.141%0.41121%0.209SC..Hα-helixtrans-60.9-40.4176.3-164.5-160.2-171.500111.8I157 E162 K163 W205I157-E159 PolarHBondContact O-N 3.36Å; E159-E162 PolarHBondContact O-N 3.03Å; E159-K163 WeakPolarHBondContact O-CG 3.4Å; E159-K163 PolarHBondContact O-N 3.33Å; E159-K163 VanDerWaalsContact O-N 3.11Å; E159-K163 VanDerWaalsContact OE1-CE 3.3Å; E159-K163 WeakPolarHBondContact OE1-CE 3.38Å; E159-K163 IonicContact OE1-NZ 3.54Å; E159-K163 PolarHBondContact OE1-NZ 3.03Å; E159-K163 IonicContact OE2-NZ 3.05Å; E159-K163 PolarHBondContact OE2-NZ 2.94Å; E159-K163 VanDerWaalsContact OE2-NZ 3.12Å; E159-W205 HydrophobicContact CB-CB 3.96Å; E159-W205 HydrophobicContact CB-CD2 4.05Å; E159-W205 HydrophobicContact CB-CG 3.58Å; E159-W205 HydrophobicContact CG-CB 4.3Å; E159-W205 HydrophobicContact CG-CG 3.96Å
160Q95.1Very high97.1Very high43 Ų4345.8 Ų45.820%0.20122%0.223CC..Hα-helixtrans-64.7-41.9178.3-65.2-173.474.200111.4F111 D112 I157 G158 V164F111-Q160 HydrophobicContact CE1-CB 4.2Å; D112-Q160 PolarHBondContact OD1-NE2 3.19Å; I157-Q160 PolarHBondContact O-N 3.5Å; G158-Q160 VanDerWaalsContact C-N 3.3Å; G158-Q160 PolarHBondContact O-N 3.45Å; Q160-V164 WeakPolarHBondContact O-CG2 3.35Å; Q160-V164 PolarHBondContact O-N 3.4Å
161L96.5Very high97.1Very high0 Ų049.1 Ų49.10%024%0.239CC..Hα-helixtrans-66.6-46176.6-77.5171.1000111.6F111 V128 Y129 L132 I157 G158 K163 V164 N165 M169F111-L161 HydrophobicContact CD1-CD2 4.44Å; F111-L161 HydrophobicContact CE1-CD2 3.8Å; F111-L161 HydrophobicContact CE1-CG 3.93Å; F111-L161 HydrophobicContact CE2-CD2 3.97Å; F111-L161 HydrophobicContact CZ-CD2 3.54Å; F111-L161 HydrophobicContact CZ-CG 4.07Å; V128-L161 HydrophobicContact CB-CD2 4.41Å; V128-L161 HydrophobicContact CG1-CD1 3.69Å; V128-L161 HydrophobicContact CG1-CD2 3.92Å; V128-L161 HydrophobicContact CG1-CG 4.39Å; Y129-L161 HydrophobicContact CD2-CD2 4.29Å; Y129-L161 HydrophobicContact CE2-CB 4.27Å; Y129-L161 HydrophobicContact CE2-CD2 3.93Å; Y129-L161 PolarHBondContact OH-O 3.06Å; L132-L161 HydrophobicContact CD1-CD1 3.6Å; I157-L161 HydrophobicContact CD1-CD1 3.71Å; I157-L161 HydrophobicContact CD1-CG 4.21Å; I157-L161 HydrophobicContact CG1-CD1 3.93Å; I157-L161 HydrophobicContact CG1-CG 4.43Å; I157-L161 WeakPolarHBondContact O-CB 3.46Å; I157-L161 WeakPolarHBondContact O-CG 3.14Å; I157-L161 PolarHBondContact O-N 3.44Å; G158-L161 PolarHBondContact O-N 2.82Å; L161-K163 VanDerWaalsContact C-N 3.31Å; L161-K163 PolarHBondContact O-N 3.4Å; L161-V164 WeakPolarHBondContact O-CA 3.41Å; L161-V164 WeakPolarHBondContact O-CB 3.44Å; L161-V164 PolarHBondContact O-N 3.14Å; L161-N165 PolarHBondContact O-N 2.96Å; L161-M169 HydrophobicContact CB-CE 3.69Å; L161-M169 HydrophobicContact CD1-CE 4.46Å
162E97.6Very high97.1Very high46 Ų4648.9 Ų48.922%0.21524%0.237CC..Hα-helixtrans-60.2-40.2-179.6-172.7175.4-120.900112.1G158 E159 V164 N165 S166 M169 R201 W205G158-E162 WeakPolarHBondContact O-CB 3.39Å; G158-E162 PolarHBondContact O-N 3.32Å; E159-E162 PolarHBondContact O-N 3.03Å; E162-V164 PolarHBondContact O-N 3.04Å; E162-N165 CarbonylContact O-C 3.51Å; E162-N165 PolarHBondContact O-N 2.87Å; E162-S166 WeakPolarHBondContact O-CA 3.37Å; E162-S166 PolarHBondContact O-N 3.22Å; E162-M169 HydrophobicContact CB-CB 4.2Å; E162-M169 HydrophobicContact CB-CE 4.21Å; E162-M169 HydrophobicContact CB-CG 4.05Å; E162-M169 HydrophobicContact CG-CB 4.07Å; E162-M169 HydrophobicContact CG-CG 4.07Å; E162-R201 IonicContact OE1-CZ 3.48Å; E162-R201 IonicContact OE1-NE 3.6Å; E162-R201 PolarHBondContact OE1-NE 3.22Å; E162-R201 IonicContact OE1-NH2 2.87Å; E162-R201 PolarHBondContact OE1-NH2 3.28Å; E162-W205 HydrophobicContact CB-CZ2 4.06Å; E162-W205 PolarHBondContact OE2-NE1 3.11Å
163K95Very high97.1Very high150 Ų15046.3 Ų46.365%0.65222%0.224SC*.Hα-helixtrans-60.5-29.7174-75170.5-177.1163.20112.9E159 L161E159-K163 WeakPolarHBondContact O-CG 3.4Å; E159-K163 PolarHBondContact O-N 3.33Å; E159-K163 VanDerWaalsContact O-N 3.11Å; E159-K163 VanDerWaalsContact OE1-CE 3.3Å; E159-K163 WeakPolarHBondContact OE1-CE 3.38Å; E159-K163 IonicContact OE1-NZ 3.54Å; E159-K163 PolarHBondContact OE1-NZ 3.03Å; E159-K163 IonicContact OE2-NZ 3.05Å; E159-K163 PolarHBondContact OE2-NZ 2.94Å; E159-K163 VanDerWaalsContact OE2-NZ 3.12Å; L161-K163 VanDerWaalsContact C-N 3.31Å; L161-K163 PolarHBondContact O-N 3.4Å
164V93.4Very high97.1Very high66 Ų6652 Ų5240%0.425%0.249SC..Hα-helixtrans-85-39178.7178.60000111.5V125 Q160 L161 E162V125-V164 HydrophobicContact CB-CG1 4.48Å; V125-V164 HydrophobicContact CG1-CG1 3.91Å; V125-V164 HydrophobicContact CG2-CG1 3.73Å; Q160-V164 WeakPolarHBondContact O-CG2 3.35Å; Q160-V164 PolarHBondContact O-N 3.4Å; L161-V164 WeakPolarHBondContact O-CA 3.41Å; L161-V164 WeakPolarHBondContact O-CB 3.44Å; L161-V164 PolarHBondContact O-N 3.14Å; E162-V164 PolarHBondContact O-N 3.04Å
165N95.1Very high97.1Very high51 Ų5154.4 Ų54.427%0.27326%0.261SS..  trans-151.785.2179.3-168.6-21.6000112.3Y129 L161 E162 Q167 R168 M169Y129-N165 HydrophobicContact CE2-CB 3.97Å; Y129-N165 PolarHBondContact OH-O 2.92Å; L161-N165 PolarHBondContact O-N 2.96Å; E162-N165 CarbonylContact O-C 3.51Å; E162-N165 PolarHBondContact O-N 2.87Å; N165-Q167 VanDerWaalsContact C-N 3.32Å; N165-Q167 PolarHBondContact O-N 2.99Å; N165-Q167 PolarHBondContact OD1-N 3.46Å; N165-R168 HydrophobicContact CB-CB 4.29Å; N165-R168 PolarHBondContact O-N 2.69Å; N165-R168 PolarHBondContact OD1-N 3.38Å; N165-R168 VanDerWaalsContact OD1-N 3.08Å; N165-M169 PolarHBondContact O-N 3.46Å
166S97.1Very high97.2Very high69 Ų6951.6 Ų51.648%0.48325%0.248SC..Hα-helixtrans-62.8-37.1-178.962.50000112.9E162 R168 M169 D170E162-S166 WeakPolarHBondContact O-CA 3.37Å; E162-S166 PolarHBondContact O-N 3.22Å; S166-R168 PolarHBondContact O-N 2.88Å; S166-M169 WeakPolarHBondContact O-CA 3.39Å; S166-M169 WeakPolarHBondContact O-CB 3.23Å; S166-M169 PolarHBondContact O-N 2.96Å; S166-M169 VanDerWaalsContact O-N 3.1Å; S166-D170 PolarHBondContact O-N 3.28Å
167Q97.7Very high97.3Very high128 Ų12853 Ų5360%0.59825%0.254SS*.Hα-helixtrans-60-45.5179.7-178.3-177-13.300111.7N165 M169 D170 E171N165-Q167 VanDerWaalsContact C-N 3.32Å; N165-Q167 PolarHBondContact O-N 2.99Å; N165-Q167 PolarHBondContact OD1-N 3.46Å; Q167-M169 VanDerWaalsContact C-N 3.26Å; Q167-M169 PolarHBondContact O-N 2.79Å; Q167-D170 WeakPolarHBondContact O-CB 3.39Å; Q167-D170 PolarHBondContact O-N 2.98Å; Q167-E171 PolarHBondContact NE2-OE1 2.9Å; Q167-E171 WeakPolarHBondContact O-CG 3.35Å; Q167-E171 PolarHBondContact O-N 3.47Å
168R97.8Very high97.4Very high70 Ų7057.1 Ų57.126%0.26428%0.276SS..Hα-helixtrans-67-31.3177.7-158.493166.9-168.9-1.4111.7Y129 D130 N165 S166 L172Y129-R168 HydrophobicContact CD1-CB 3.99Å; Y129-R168 HydrophobicContact CD1-CG 3.48Å; Y129-R168 VanDerWaalsContact CD1-CG 3.48Å; Y129-R168 HydrophobicContact CD2-CB 4.26Å; Y129-R168 HydrophobicContact CD2-CG 3.94Å; Y129-R168 HydrophobicContact CE1-CB 3.82Å; Y129-R168 HydrophobicContact CE1-CG 3.86Å; Y129-R168 HydrophobicContact CE2-CB 4.11Å; Y129-R168 HydrophobicContact CE2-CG 4.3Å; Y129-R168 HydrophobicContact CG-CB 4.21Å; Y129-R168 HydrophobicContact CG-CG 3.52Å; D130-R168 IonicContact OD1-CZ 2.86Å; D130-R168 IonicContact OD1-NH2 3.33Å; D130-R168 PolarHBondContact OD1-NH2 2.77Å; N165-R168 HydrophobicContact CB-CB 4.29Å; N165-R168 PolarHBondContact O-N 2.69Å; N165-R168 PolarHBondContact OD1-N 3.38Å; N165-R168 VanDerWaalsContact OD1-N 3.08Å; S166-R168 PolarHBondContact O-N 2.88Å; R168-L172 PolarHBondContact O-N 2.94Å
169M98.5Very high97.4Very high0 Ų057.5 Ų57.50%028%0.279CS..Hα-helixtrans-68-38172.9-168.960.275.200111.9Y129 L154 G158 L161 E162 N165 S166 Q167 L172 F173 W205Y129-M169 HydrophobicContact CE1-CB 4.41Å; Y129-M169 HydrophobicContact CE1-CE 4.07Å; Y129-M169 HydrophobicContact CE1-SD 4.5Å; L154-M169 HydrophobicContact CD2-CE 4.3Å; L154-M169 HydrophobicContact CD2-SD 4.15Å; G158-M169 WeakPolarHBondContact O-CE 3.38Å; L161-M169 HydrophobicContact CB-CE 3.69Å; L161-M169 HydrophobicContact CD1-CE 4.46Å; E162-M169 HydrophobicContact CB-CB 4.2Å; E162-M169 HydrophobicContact CB-CE 4.21Å; E162-M169 HydrophobicContact CB-CG 4.05Å; E162-M169 HydrophobicContact CG-CB 4.07Å; E162-M169 HydrophobicContact CG-CG 4.07Å; N165-M169 PolarHBondContact O-N 3.46Å; S166-M169 WeakPolarHBondContact O-CA 3.39Å; S166-M169 WeakPolarHBondContact O-CB 3.23Å; S166-M169 PolarHBondContact O-N 2.96Å; S166-M169 VanDerWaalsContact O-N 3.1Å; Q167-M169 VanDerWaalsContact C-N 3.26Å; Q167-M169 PolarHBondContact O-N 2.79Å; M169-L172 PolarHBondContact O-N 3.34Å; M169-L172 HydrophobicContact SD-CD2 4.06Å; M169-F173 HydrophobicContact CG-CD2 4.11Å; M169-F173 HydrophobicContact CG-CE2 4.29Å; M169-F173 WeakPolarHBondContact O-CD2 3.48Å; M169-F173 PolarHBondContact O-N 3.14Å; M169-F173 HydrophobicContact SD-CD2 3.73Å; M169-F173 HydrophobicContact SD-CE2 3.56Å; M169-F173 VanDerWaalsContact SD-CE2 3.56Å; M169-W205 HydrophobicContact CE-CH2 3.82Å; M169-W205 HydrophobicContact CE-CZ2 3.94Å; M169-W205 HydrophobicContact CG-CH2 4.37Å; M169-W205 HydrophobicContact CG-CZ2 4.03Å; M169-W205 HydrophobicContact SD-CH2 3.8Å; M169-W205 HydrophobicContact SD-CZ2 4.04Å
170D98.6Very high97.5Very high61 Ų6155.3 Ų55.333%0.32627%0.269SS..Hα-helixtrans-61.7-47.7173-71.9-35000111.6S166 Q167 L172 F173 F174 R201S166-D170 PolarHBondContact O-N 3.28Å; Q167-D170 WeakPolarHBondContact O-CB 3.39Å; Q167-D170 PolarHBondContact O-N 2.98Å; D170-L172 VanDerWaalsContact C-N 3.33Å; D170-L172 PolarHBondContact O-N 3.37Å; D170-F173 CarbonylContact O-C 3.4Å; D170-F173 PolarHBondContact O-N 3.1Å; D170-F173 VanDerWaalsContact O-N 3.16Å; D170-F174 HydrophobicContact CB-CE2 4.08Å; D170-F174 WeakPolarHBondContact O-CD2 3.4Å; D170-F174 WeakPolarHBondContact O-CG 3.28Å; D170-F174 PolarHBondContact O-N 2.92Å; D170-R201 IonicContact OD1-CZ 2.82Å; D170-R201 IonicContact OD1-NH1 2.78Å; D170-R201 PolarHBondContact OD1-NH1 2.72Å; D170-R201 IonicContact OD1-NH2 3.29Å; D170-R201 PolarHBondContact OD1-NH2 3.19Å
171E98.6Very high97.6Very high70 Ų7059.4 Ų59.433%0.32729%0.291SS..Hα-helixtrans-54.7-47.3175.1-70.5168.5-168.300111.9M133 Q167 F173 F174 L175M133-E171 HydrophobicContact CE-CB 4.22Å; Q167-E171 PolarHBondContact NE2-OE1 2.9Å; Q167-E171 WeakPolarHBondContact O-CG 3.35Å; Q167-E171 PolarHBondContact O-N 3.47Å; E171-F173 PolarHBondContact O-N 2.89Å; E171-F174 PolarHBondContact O-N 3.44Å; E171-L175 PolarHBondContact O-N 3.36Å
172L98.8Very high97.6Very high0 Ų065.6 Ų65.60%032%0.324CS..Hα-helixtrans-59.1-47.6176.2177.760.4000111.7L132 M133 A136 L154 R168 M169 D170 F174 L175 L176L132-L172 HydrophobicContact CB-CD1 4.35Å; L132-L172 HydrophobicContact CB-CD2 3.87Å; L132-L172 HydrophobicContact CD1-CD2 4.22Å; M133-L172 HydrophobicContact CG-CD1 4.43Å; M133-L172 VanDerWaalsContact SD-CA 3.53Å; M133-L172 HydrophobicContact SD-CB 3.71Å; M133-L172 HydrophobicContact SD-CD1 3.76Å; M133-L172 HydrophobicContact SD-CG 4.33Å; A136-L172 HydrophobicContact CB-CD1 3.57Å; L154-L172 HydrophobicContact CD2-CD2 3.95Å; R168-L172 PolarHBondContact O-N 2.94Å; M169-L172 PolarHBondContact O-N 3.34Å; M169-L172 HydrophobicContact SD-CD2 4.06Å; D170-L172 VanDerWaalsContact C-N 3.33Å; D170-L172 PolarHBondContact O-N 3.37Å; L172-F174 VanDerWaalsContact C-N 3.29Å; L172-F174 PolarHBondContact O-N 3.22Å; L172-L175 WeakPolarHBondContact O-CB 3.28Å; L172-L175 PolarHBondContact O-N 3.47Å; L172-L175 VanDerWaalsContact O-N 3.14Å; L172-L176 WeakPolarHBondContact O-CG 3.38Å; L172-L176 PolarHBondContact O-N 3.09Å
173F98.7Very high97.5Very high1 Ų165.5 Ų65.50%0.00432%0.323CS..Hα-helixtrans-74.1-17.1-179.2-88.1-105.3000113.6L154 M169 D170 E171 L176 R177 V197 L198 R201 W205L154-F173 HydrophobicContact CD1-CE2 4.16Å; L154-F173 HydrophobicContact CD1-CZ 4.19Å; L154-F173 HydrophobicContact CD2-CE2 4.11Å; M169-F173 HydrophobicContact CG-CD2 4.11Å; M169-F173 HydrophobicContact CG-CE2 4.29Å; M169-F173 WeakPolarHBondContact O-CD2 3.48Å; M169-F173 PolarHBondContact O-N 3.14Å; M169-F173 HydrophobicContact SD-CD2 3.73Å; M169-F173 HydrophobicContact SD-CE2 3.56Å; M169-F173 VanDerWaalsContact SD-CE2 3.56Å; D170-F173 CarbonylContact O-C 3.4Å; D170-F173 PolarHBondContact O-N 3.1Å; D170-F173 VanDerWaalsContact O-N 3.16Å; E171-F173 PolarHBondContact O-N 2.89Å; F173-L176 HydrophobicContact CD1-CD1 4.24Å; F173-L176 HydrophobicContact CD2-CD1 4.28Å; F173-L176 HydrophobicContact CE1-CD1 4.2Å; F173-L176 HydrophobicContact CE2-CD1 4.23Å; F173-L176 HydrophobicContact CG-CD1 4.28Å; F173-L176 HydrophobicContact CZ-CD1 4.2Å; F173-R177 VanDerWaalsContact O-CG 3.27Å; F173-R177 WeakPolarHBondContact O-CG 3.49Å; F173-R177 PolarHBondContact O-N 2.95Å; F173-R177 PolarHBondContact O-NH1 2.84Å; F173-V197 HydrophobicContact CZ-CG2 4.34Å; F173-L198 HydrophobicContact CD1-CD2 3.8Å; F173-L198 HydrophobicContact CE1-CD2 4.23Å; F173-R201 HydrophobicContact CD1-CB 4.13Å; F173-R201 VanDerWaalsContact CD1-CD 3.43Å; F173-R201 HydrophobicContact CD1-CG 4.35Å; F173-R201 VanDerWaalsContact CD2-CD 3.49Å; F173-R201 HydrophobicContact CE1-CB 3.35Å; F173-R201 HydrophobicContact CE1-CG 3.94Å; F173-R201 HydrophobicContact CE2-CB 4.47Å; F173-R201 VanDerWaalsContact CE2-CD 3.41Å; F173-R201 HydrophobicContact CE2-CG 4.48Å; F173-R201 HydrophobicContact CZ-CB 3.56Å; F173-R201 HydrophobicContact CZ-CG 4.01Å; F173-W205 AromaticContact CE2-CH2 3.95Å; F173-W205 HydrophobicContact CE2-CH2 3.95Å; F173-W205 HydrophobicContact CZ-CH2 4.07Å; F173-W205 HydrophobicContact CZ-CZ3 4.39Å
174F98.4Very high97.5Very high120 Ų12066.6 Ų66.653%0.52633%0.331SS..Hα-helixtrans-67.4-46.4164.6-67.5-46.4000110.5D170 E171 L172 L176 R177 D178D170-F174 HydrophobicContact CB-CE2 4.08Å; D170-F174 WeakPolarHBondContact O-CD2 3.4Å; D170-F174 WeakPolarHBondContact O-CG 3.28Å; D170-F174 PolarHBondContact O-N 2.92Å; E171-F174 PolarHBondContact O-N 3.44Å; L172-F174 VanDerWaalsContact C-N 3.29Å; L172-F174 PolarHBondContact O-N 3.22Å; F174-L176 VanDerWaalsContact C-N 3.31Å; F174-L176 PolarHBondContact O-N 3.37Å; F174-R177 PolarHBondContact O-N 3.45Å; F174-R177 VanDerWaalsContact O-N 3.15Å; F174-D178 PolarHBondContact O-N 3.45Å
175L98.6Very high97.5Very high50 Ų5066.5 Ų66.526%0.26234%0.343SS..Hα-helixtrans-58.7-41.1175.4-62.6177.7000112.4M133 A136 E171 L172 R177 D178 G179M133-L175 HydrophobicContact CE-CD1 3.58Å; M133-L175 HydrophobicContact SD-CD1 3.73Å; A136-L175 HydrophobicContact CB-CB 4.11Å; A136-L175 HydrophobicContact CB-CD1 4.28Å; E171-L175 PolarHBondContact O-N 3.36Å; L172-L175 WeakPolarHBondContact O-CB 3.28Å; L172-L175 PolarHBondContact O-N 3.47Å; L172-L175 VanDerWaalsContact O-N 3.14Å; L175-R177 PolarHBondContact O-N 3.32Å; L175-D178 PolarHBondContact O-N 3.06Å; L175-G179 PolarHBondContact O-N 3.19Å
176L98.6Very high97.6Very high0 Ų064.9 Ų64.90%033%0.334CS..Hα-helixtrans-64.2-39.7177.4-60.7-176.9000112.5A136 L150 L154 L172 F173 F174 F180 L194 V197 L198A136-L176 HydrophobicContact CB-CD2 3.8Å; L150-L176 HydrophobicContact CD2-CD2 3.69Å; L154-L176 HydrophobicContact CD1-CD1 4.05Å; L172-L176 WeakPolarHBondContact O-CG 3.38Å; L172-L176 PolarHBondContact O-N 3.09Å; F173-L176 HydrophobicContact CD1-CD1 4.24Å; F173-L176 HydrophobicContact CD2-CD1 4.28Å; F173-L176 HydrophobicContact CE1-CD1 4.2Å; F173-L176 HydrophobicContact CE2-CD1 4.23Å; F173-L176 HydrophobicContact CG-CD1 4.28Å; F173-L176 HydrophobicContact CZ-CD1 4.2Å; F174-L176 VanDerWaalsContact C-N 3.31Å; F174-L176 PolarHBondContact O-N 3.37Å; L176-F180 VanDerWaalsContact O-CB 3.29Å; L176-F180 WeakPolarHBondContact O-CB 3.26Å; L176-F180 PolarHBondContact O-N 3.43Å; L176-L194 HydrophobicContact CD2-CD2 3.96Å; L176-V197 HydrophobicContact CD1-CG1 4.2Å; L176-L198 HydrophobicContact CB-CD2 4.22Å
177R98.6Very high97.6Very high99 Ų9963.9 Ų63.937%0.37433%0.325SS..Hα-helixtrans-68.7-44.4176.6-71.7178.2-166105.2-6111.4F173 F174 L175 G179 F180 L181 L198F173-R177 VanDerWaalsContact O-CG 3.27Å; F173-R177 WeakPolarHBondContact O-CG 3.49Å; F173-R177 PolarHBondContact O-N 2.95Å; F173-R177 PolarHBondContact O-NH1 2.84Å; F174-R177 PolarHBondContact O-N 3.45Å; F174-R177 VanDerWaalsContact O-N 3.15Å; L175-R177 PolarHBondContact O-N 3.32Å; R177-G179 VanDerWaalsContact C-N 3.33Å; R177-G179 PolarHBondContact O-N 2.87Å; R177-F180 PolarHBondContact O-N 3.4Å; R177-L181 WeakPolarHBondContact O-CB 3.36Å; R177-L181 VanDerWaalsContact O-CG 3.25Å; R177-L181 WeakPolarHBondContact O-CG 3.4Å; R177-L181 PolarHBondContact O-N 3.48Å; R177-L198 HydrophobicContact CG-CD1 4.41Å; R177-L198 HydrophobicContact CG-CD2 3.7Å
178D98.1Very high97.5Very high87 Ų8763 Ų6347%0.46533%0.333SS..Hα-helixtrans-60.6-45.8176.1-73.4-8.9000110.4F174 L175 F180 L181 L182F174-D178 PolarHBondContact O-N 3.45Å; L175-D178 PolarHBondContact O-N 3.06Å; D178-F180 PolarHBondContact O-N 3.06Å; D178-L181 PolarHBondContact O-N 3.27Å; D178-L182 HydrophobicContact CB-CD1 4.4Å; D178-L182 WeakPolarHBondContact O-CA 3.42Å; D178-L182 WeakPolarHBondContact O-CB 3.47Å; D178-L182 WeakPolarHBondContact O-CG 3.38Å; D178-L182 PolarHBondContact O-N 2.63Å
179G97.9Very high97.4Very high8 Ų863.9 Ų63.98%0.08234%0.341CS..Hα-helixtrans-57.5-48.8173.100000112.1L175 R177 L181 Q183L175-G179 PolarHBondContact O-N 3.19Å; R177-G179 VanDerWaalsContact C-N 3.33Å; R177-G179 PolarHBondContact O-N 2.87Å; G179-L181 PolarHBondContact O-N 3.26Å; G179-Q183 WeakPolarHBondContact O-CB 3.38Å; G179-Q183 PolarHBondContact O-N 2.95Å
180F97.9Very high97.3Very high43 Ų4363.9 Ų63.919%0.18934%0.341CS..Hα-helixtrans-62.5-40.1-179.5-175-94.7000113.5L176 R177 D178 R191 L194 L195 L198L176-F180 VanDerWaalsContact O-CB 3.29Å; L176-F180 WeakPolarHBondContact O-CB 3.26Å; L176-F180 PolarHBondContact O-N 3.43Å; R177-F180 PolarHBondContact O-N 3.4Å; D178-F180 PolarHBondContact O-N 3.06Å; F180-R191 HydrophobicContact CD2-CG 4.22Å; F180-R191 HydrophobicContact CE2-CG 3.52Å; F180-R191 WeakPolarHBondContact CE2-O 3.35Å; F180-R191 HydrophobicContact CZ-CG 4.17Å; F180-R191 PolarHBondContact O-NH1 3.42Å; F180-L194 HydrophobicContact CD2-CB 3.95Å; F180-L195 HydrophobicContact CE1-CD1 4.43Å; F180-L195 HydrophobicContact CE2-CB 3.88Å; F180-L195 HydrophobicContact CE2-CD1 4.36Å; F180-L195 HydrophobicContact CZ-CB 4.21Å; F180-L195 HydrophobicContact CZ-CD1 3.92Å; F180-L195 HydrophobicContact CZ-CG 4.48Å; F180-L198 HydrophobicContact CB-CD1 4.35Å; F180-L198 HydrophobicContact CG-CD1 4.35Å
181L97.8Very high97.3Very high129 Ų12965.7 Ų65.768%0.67534%0.344SS*.Hα-helixtrans-85.1-38-174.3-68.4172.4000113.5R177 D178 G179R177-L181 WeakPolarHBondContact O-CB 3.36Å; R177-L181 VanDerWaalsContact O-CG 3.25Å; R177-L181 WeakPolarHBondContact O-CG 3.4Å; R177-L181 PolarHBondContact O-N 3.48Å; D178-L181 PolarHBondContact O-N 3.27Å; G179-L181 PolarHBondContact O-N 3.26Å
182L97.3Very high97.2Very high130 Ų13065.1 Ų65.168%0.68134%0.342SS*.Hα-helixtrans-111-24.2-167.3-51.6177.4000113.3D178 E184D178-L182 HydrophobicContact CB-CD1 4.4Å; D178-L182 WeakPolarHBondContact O-CA 3.42Å; D178-L182 WeakPolarHBondContact O-CB 3.47Å; D178-L182 WeakPolarHBondContact O-CG 3.38Å; D178-L182 PolarHBondContact O-N 2.63Å; L182-E184 PolarHBondContact O-N 2.7Å
183Q95.3Very high97.2Very high44 Ų4466.6 Ų66.621%0.20635%0.35CS..  trans-74.1119.5-177.2-170.469.6200110.8P138 L142 G179 L186P138-Q183 PolarHBondContact O-NE2 3.47Å; P138-Q183 VanDerWaalsContact O-NE2 3.12Å; L142-Q183 HydrophobicContact CD2-CG 4.14Å; G179-Q183 WeakPolarHBondContact O-CB 3.38Å; G179-Q183 PolarHBondContact O-N 2.95Å; Q183-L186 HydrophobicContact CB-CD1 4.28Å; Q183-L186 HydrophobicContact CB-CD2 4.26Å; Q183-L186 HydrophobicContact CB-CG 4.11Å; Q183-L186 HydrophobicContact CG-CD2 3.86Å; Q183-L186 HydrophobicContact CG-CG 4.04Å
184E94.4Very high97.2Very high173 Ų17366.5 Ų66.581%0.80835%0.35SS*.THydrogen-bonded Turntrans-79.6150.2168.1-62.2-175.5-179.100110.6L142 L182L142-E184 WeakPolarHBondContact CD2-O 3.1Å; L182-E184 PolarHBondContact O-N 2.7Å
185G94.1Very high97.2Very high64 Ų6463.5 Ų63.566%0.6634%0.339SS*.THydrogen-bonded Turntrans83.37.6173.100000116.5T187G185-T187 PolarHBondContact O-N 3.25Å
186L96.7Very high97.1Very high16 Ų1661.2 Ų61.28%0.08433%0.327CS..  trans-58.9135.5169.2-63.6177.1000110.8L141 L142 Q183 L194L141-L186 HydrophobicContact CB-CD2 3.9Å; L141-L186 VanDerWaalsContact O-CD2 3.26Å; L141-L186 WeakPolarHBondContact O-CD2 3.19Å; L142-L186 HydrophobicContact CD2-CD2 4.49Å; Q183-L186 HydrophobicContact CB-CD1 4.28Å; Q183-L186 HydrophobicContact CB-CD2 4.26Å; Q183-L186 HydrophobicContact CB-CG 4.11Å; Q183-L186 HydrophobicContact CG-CD2 3.86Å; Q183-L186 HydrophobicContact CG-CG 4.04Å; L186-L194 HydrophobicContact CD1-CD1 4.12Å
187T96.6Very high97.1Very high48 Ų4861.2 Ų61.229%0.29433%0.327SS..  trans-65.8158.3171.875.60000110.5E144 G185 M189 A190 R191E144-T187 PolarHBondContact OE2-OG1 3.13Å; G185-T187 PolarHBondContact O-N 3.25Å; T187-M189 PolarHBondContact O-N 3.14Å; T187-A190 PolarHBondContact O-N 3.37Å; T187-A190 WeakPolarHBondContact OG1-CB 3.3Å; T187-A190 PolarHBondContact OG1-N 2.85Å; T187-R191 WeakPolarHBondContact O-CB 3.2Å; T187-R191 PolarHBondContact O-N 2.9Å
188S96.1Very high97.1Very high110 Ų11057.8 Ų57.877%0.76932%0.316SS*.Hα-helixtrans-58.6-39.4176.6-56.20000111.8R191 L192S188-R191 PolarHBondContact O-N 2.97Å; S188-L192 WeakPolarHBondContact O-CB 3.35Å; S188-L192 PolarHBondContact O-N 3.45Å
189M95.8Very high97.1Very high88 Ų8857.3 Ų57.343%0.43331%0.311SS..Hα-helixtrans-68.6-46.2177.4-174.759.372.900111.5E144 T187 R191 L192 L193E144-M189 HydrophobicContact CG-CB 4.28Å; E144-M189 HydrophobicContact CG-CG 4.21Å; E144-M189 WeakPolarHBondContact OE2-CB 3.45Å; T187-M189 PolarHBondContact O-N 3.14Å; M189-R191 VanDerWaalsContact C-N 3.25Å; M189-R191 PolarHBondContact O-N 3Å; M189-L192 WeakPolarHBondContact O-CB 3.31Å; M189-L192 PolarHBondContact O-N 2.88Å; M189-L192 VanDerWaalsContact O-N 3.08Å; M189-L192 HydrophobicContact SD-CD2 4.3Å; M189-L193 HydrophobicContact CG-CD1 3.98Å; M189-L193 HydrophobicContact CG-CG 4.25Å; M189-L193 WeakPolarHBondContact O-CB 3.41Å; M189-L193 WeakPolarHBondContact O-CG 3.38Å; M189-L193 PolarHBondContact O-N 2.92Å; M189-L193 HydrophobicContact SD-CD1 4.41Å; M189-L193 HydrophobicContact SD-CG 4.16Å
190A97.1Very high97.1Very high0 Ų058 Ų580%031%0.312CS..Hα-helixtrans-57.2-41.8175.900000111.5V147 T187 L194V147-A190 HydrophobicContact CB-CB 4.43Å; V147-A190 HydrophobicContact CG1-CB 4.28Å; V147-A190 HydrophobicContact CG2-CB 4.16Å; T187-A190 PolarHBondContact O-N 3.37Å; T187-A190 WeakPolarHBondContact OG1-CB 3.3Å; T187-A190 PolarHBondContact OG1-N 2.85Å; A190-L194 WeakPolarHBondContact O-CB 3.22Å; A190-L194 WeakPolarHBondContact O-CG 3.45Å; A190-L194 PolarHBondContact O-N 3.16Å
191R97.5Very high97.2Very high99 Ų9957.4 Ų57.437%0.37431%0.308SS..Hα-helixtrans-63.4-43175.4-169.7177.2-62.1-78.4-2.1112.1F180 T187 S188 M189 L195F180-R191 HydrophobicContact CD2-CG 4.22Å; F180-R191 HydrophobicContact CE2-CG 3.52Å; F180-R191 WeakPolarHBondContact CE2-O 3.35Å; F180-R191 HydrophobicContact CZ-CG 4.17Å; F180-R191 PolarHBondContact O-NH1 3.42Å; T187-R191 WeakPolarHBondContact O-CB 3.2Å; T187-R191 PolarHBondContact O-N 2.9Å; S188-R191 PolarHBondContact O-N 2.97Å; M189-R191 VanDerWaalsContact C-N 3.25Å; M189-R191 PolarHBondContact O-N 3Å; R191-L195 WeakPolarHBondContact O-CB 3.49Å; R191-L195 PolarHBondContact O-N 3.39Å
192L97.4Very high97.2Very high58 Ų5855.6 Ų55.630%0.30431%0.312SS..Hα-helixtrans-62-49.3177.5-170.873.9000111.3S188 M189 L194 L195 E196 Y214 Y215S188-L192 WeakPolarHBondContact O-CB 3.35Å; S188-L192 PolarHBondContact O-N 3.45Å; M189-L192 WeakPolarHBondContact O-CB 3.31Å; M189-L192 PolarHBondContact O-N 2.88Å; M189-L192 VanDerWaalsContact O-N 3.08Å; M189-L192 HydrophobicContact SD-CD2 4.3Å; L192-L194 PolarHBondContact O-N 3.39Å; L192-L195 PolarHBondContact O-N 3.47Å; L192-E196 WeakPolarHBondContact O-CB 3.44Å; L192-E196 PolarHBondContact O-N 3.05Å; L192-Y214 HydrophobicContact CD1-CE1 3.82Å; L192-Y215 HydrophobicContact CD1-CD1 3.7Å; L192-Y215 HydrophobicContact CD1-CE1 3.66Å; L192-Y215 HydrophobicContact CG-CD1 3.88Å; L192-Y215 HydrophobicContact CG-CE1 4.09Å
193L98.1Very high97.1Very high31 Ų3151.4 Ų51.416%0.16230%0.3CS..Hα-helixtrans-62.8-40.6179.2-68.8175.7000112.4V147 D148 V151 M189 E196 V197V147-L193 HydrophobicContact CG1-CB 4.03Å; V147-L193 HydrophobicContact CG1-CD1 4.22Å; D148-L193 HydrophobicContact CB-CD1 4.4Å; V151-L193 HydrophobicContact CG2-CB 4.13Å; M189-L193 HydrophobicContact CG-CD1 3.98Å; M189-L193 HydrophobicContact CG-CG 4.25Å; M189-L193 WeakPolarHBondContact O-CB 3.41Å; M189-L193 WeakPolarHBondContact O-CG 3.38Å; M189-L193 PolarHBondContact O-N 2.92Å; M189-L193 HydrophobicContact SD-CD1 4.41Å; M189-L193 HydrophobicContact SD-CG 4.16Å; L193-E196 PolarHBondContact O-N 2.87Å; L193-V197 PolarHBondContact O-N 2.93Å
194L98.4Very high97.2Very high0 Ų051.3 Ų51.30%031%0.31CS..Hα-helixtrans-66.1-40.7176.1-73.5175000112.1L141 V147 L176 F180 L186 A190 L192 V197 L198L141-L194 HydrophobicContact CD2-CD1 4.36Å; L141-L194 HydrophobicContact CD2-CD2 4.11Å; V147-L194 HydrophobicContact CG1-CD2 4.33Å; V147-L194 HydrophobicContact CG1-CG 4.19Å; L176-L194 HydrophobicContact CD2-CD2 3.96Å; F180-L194 HydrophobicContact CD2-CB 3.95Å; L186-L194 HydrophobicContact CD1-CD1 4.12Å; A190-L194 WeakPolarHBondContact O-CB 3.22Å; A190-L194 WeakPolarHBondContact O-CG 3.45Å; A190-L194 PolarHBondContact O-N 3.16Å; L192-L194 PolarHBondContact O-N 3.39Å; L194-V197 WeakPolarHBondContact O-CG1 3.4Å; L194-L198 WeakPolarHBondContact O-CB 3.32Å; L194-L198 WeakPolarHBondContact O-CD1 3.29Å; L194-L198 WeakPolarHBondContact O-CG 3.27Å; L194-L198 PolarHBondContact O-N 3.04Å; L194-L198 VanDerWaalsContact O-N 3.16Å
195L98.4Very high97.4Very high56 Ų5644 Ų4429%0.29328%0.275SS..Hα-helixtrans-65.3-44.4176.9-173.963.7000111.1F180 R191 L192 V197 L198 E199 Y215F180-L195 HydrophobicContact CE1-CD1 4.43Å; F180-L195 HydrophobicContact CE2-CB 3.88Å; F180-L195 HydrophobicContact CE2-CD1 4.36Å; F180-L195 HydrophobicContact CZ-CB 4.21Å; F180-L195 HydrophobicContact CZ-CD1 3.92Å; F180-L195 HydrophobicContact CZ-CG 4.48Å; R191-L195 WeakPolarHBondContact O-CB 3.49Å; R191-L195 PolarHBondContact O-N 3.39Å; L192-L195 PolarHBondContact O-N 3.47Å; L195-V197 PolarHBondContact O-N 2.73Å; L195-L198 WeakPolarHBondContact O-CB 3.37Å; L195-L198 PolarHBondContact O-N 2.6Å; L195-E199 PolarHBondContact O-N 2.92Å; L195-Y215 WeakPolarHBondContact CD2-OH 3.44Å; L195-Y215 VanDerWaalsContact CG-OH 3.24Å; L195-Y215 WeakPolarHBondContact CG-OH 3.48Å
196E98Very high97.5Very high3 Ų347.2 Ų47.21%0.01428%0.275CS..Hα-helixtrans-57.5-50178.3-174.8-75.7142.500111.1H155 L192 L193 L198 E199 F200 L207 Y215H155-E196 IonicContact CE1-OE1 2.79Å; H155-E196 PolarHBondContact CE1-OE1 2.86Å; H155-E196 IonicContact CE1-OE2 3.43Å; H155-E196 PolarHBondContact CE1-OE2 3.32Å; H155-E196 IonicContact NE2-OE1 3.62Å; H155-E196 PolarHBondContact NE2-OE1 3.41Å; H155-E196 IonicContact NE2-OE2 3.06Å; L192-E196 WeakPolarHBondContact O-CB 3.44Å; L192-E196 PolarHBondContact O-N 3.05Å; L193-E196 PolarHBondContact O-N 2.87Å; E196-L198 VanDerWaalsContact C-N 3.31Å; E196-L198 PolarHBondContact O-N 3.38Å; E196-E199 PolarHBondContact O-N 3.13Å; E196-F200 WeakPolarHBondContact O-CB 3.46Å; E196-F200 PolarHBondContact O-N 2.73Å; E196-L207 HydrophobicContact CG-CD1 4.47Å; E196-L207 HydrophobicContact CG-CD2 4.42Å; E196-L207 WeakPolarHBondContact OE1-CD1 3.29Å; E196-L207 WeakPolarHBondContact OE1-CD2 3.46Å; E196-Y215 HydrophobicContact CB-CD1 3.77Å; E196-Y215 HydrophobicContact CB-CD2 4.02Å; E196-Y215 HydrophobicContact CB-CE1 3.6Å; E196-Y215 HydrophobicContact CB-CE2 3.91Å; E196-Y215 HydrophobicContact CB-CG 3.99Å; E196-Y215 HydrophobicContact CG-CD1 3.98Å; E196-Y215 HydrophobicContact CG-CD2 3.57Å; E196-Y215 HydrophobicContact CG-CE1 4.22Å; E196-Y215 HydrophobicContact CG-CE2 3.88Å; E196-Y215 HydrophobicContact CG-CG 3.67Å
197V98.5Very high97.3Very high0 Ų048.4 Ų48.40%028%0.281CS..Hα-helixtrans-68.5-30.3-178.578.10000112.8V151 L154 F173 L176 L193 L194 L195 F200 R201V151-V197 HydrophobicContact CG1-CB 4.09Å; V151-V197 HydrophobicContact CG1-CG2 4.33Å; V151-V197 HydrophobicContact CG2-CB 3.99Å; V151-V197 HydrophobicContact CG2-CG1 3.97Å; V151-V197 HydrophobicContact CG2-CG2 4.44Å; L154-V197 HydrophobicContact CB-CG2 3.84Å; L154-V197 HydrophobicContact CD1-CG2 3.75Å; L154-V197 HydrophobicContact CG-CG2 4.46Å; F173-V197 HydrophobicContact CZ-CG2 4.34Å; L176-V197 HydrophobicContact CD1-CG1 4.2Å; L193-V197 PolarHBondContact O-N 2.93Å; L194-V197 WeakPolarHBondContact O-CG1 3.4Å; L195-V197 PolarHBondContact O-N 2.73Å; V197-F200 PolarHBondContact O-N 3.47Å; V197-R201 PolarHBondContact O-N 3.22Å
198L98.6Very high97.2Very high26 Ų2649 Ų4914%0.13629%0.288CS..Hα-helixtrans-64.6-44.9173.1-73.6170.6000110.9F173 L176 R177 F180 L194 L195 E196 A202F173-L198 HydrophobicContact CD1-CD2 3.8Å; F173-L198 HydrophobicContact CE1-CD2 4.23Å; L176-L198 HydrophobicContact CB-CD2 4.22Å; R177-L198 HydrophobicContact CG-CD1 4.41Å; R177-L198 HydrophobicContact CG-CD2 3.7Å; F180-L198 HydrophobicContact CB-CD1 4.35Å; F180-L198 HydrophobicContact CG-CD1 4.35Å; L194-L198 WeakPolarHBondContact O-CB 3.32Å; L194-L198 WeakPolarHBondContact O-CD1 3.29Å; L194-L198 WeakPolarHBondContact O-CG 3.27Å; L194-L198 PolarHBondContact O-N 3.04Å; L194-L198 VanDerWaalsContact O-N 3.16Å; L195-L198 WeakPolarHBondContact O-CB 3.37Å; L195-L198 PolarHBondContact O-N 2.6Å; E196-L198 VanDerWaalsContact C-N 3.31Å; E196-L198 PolarHBondContact O-N 3.38Å; L198-A202 WeakPolarHBondContact O-CB 3.15Å; L198-A202 PolarHBondContact O-N 3.13Å; L198-A202 VanDerWaalsContact O-N 3.08Å
199E98.1Very high97Very high77 Ų7748.2 Ų48.236%0.3628%0.282SS..Hα-helixtrans-65.9-41.1173.7-74.8-168.6-116.400112L195 E196 R201 A202 G203 Y215L195-E199 PolarHBondContact O-N 2.92Å; E196-E199 PolarHBondContact O-N 3.13Å; E199-R201 PolarHBondContact O-N 2.83Å; E199-A202 PolarHBondContact O-N 3.26Å; E199-A202 VanDerWaalsContact O-N 3.17Å; E199-G203 PolarHBondContact O-N 3.05Å; E199-Y215 PolarHBondContact OE1-OH 3.42Å
200F98.3Very high96.8Very high23 Ų2349 Ų4910%0.10129%0.292CS..Hα-helixtrans-57-48.5178.6-175.5-119.2000111.6H155 E196 V197 G203 W205 M206 L207H155-F200 AromaticContact CD2-CE1 3.93Å; H155-F200 AromaticContact CD2-CZ 3.98Å; E196-F200 WeakPolarHBondContact O-CB 3.46Å; E196-F200 PolarHBondContact O-N 2.73Å; V197-F200 PolarHBondContact O-N 3.47Å; F200-G203 PolarHBondContact O-N 3.39Å; F200-W205 AromaticContact CD1-CE3 3.79Å; F200-W205 HydrophobicContact CD1-CE3 3.79Å; F200-W205 HydrophobicContact CD1-CZ3 4.41Å; F200-W205 HydrophobicContact CE1-CB 4.1Å; F200-W205 AromaticContact CE1-CE3 3.67Å; F200-W205 HydrophobicContact CE1-CE3 3.67Å; F200-W205 WeakPolarHBondContact CE2-O 3.12Å; F200-W205 VanDerWaalsContact CZ-C 3.41Å; F200-W205 HydrophobicContact CZ-CB 4.19Å; F200-W205 WeakPolarHBondContact CZ-O 3.34Å; F200-W205 WeakPolarHBondContact O-CA 3.19Å; F200-W205 PolarHBondContact O-N 3.38Å; F200-M206 PolarHBondContact O-N 3.48Å; F200-L207 HydrophobicContact CB-CD2 3.99Å; F200-L207 HydrophobicContact CD2-CD2 4.11Å; F200-L207 HydrophobicContact CD2-CG 3.81Å
201R98.4Very high96.6Very high31 Ų3149.2 Ų49.212%0.11729%0.293CS..Hα-helixtrans-67.3-41.3174.9-175.5177.9176.6-130-2.9112E162 D170 F173 V197 E199 G203 G204 W205E162-R201 IonicContact OE1-CZ 3.48Å; E162-R201 IonicContact OE1-NE 3.6Å; E162-R201 PolarHBondContact OE1-NE 3.22Å; E162-R201 IonicContact OE1-NH2 2.87Å; E162-R201 PolarHBondContact OE1-NH2 3.28Å; D170-R201 IonicContact OD1-CZ 2.82Å; D170-R201 IonicContact OD1-NH1 2.78Å; D170-R201 PolarHBondContact OD1-NH1 2.72Å; D170-R201 IonicContact OD1-NH2 3.29Å; D170-R201 PolarHBondContact OD1-NH2 3.19Å; F173-R201 HydrophobicContact CD1-CB 4.13Å; F173-R201 VanDerWaalsContact CD1-CD 3.43Å; F173-R201 HydrophobicContact CD1-CG 4.35Å; F173-R201 VanDerWaalsContact CD2-CD 3.49Å; F173-R201 HydrophobicContact CE1-CB 3.35Å; F173-R201 HydrophobicContact CE1-CG 3.94Å; F173-R201 HydrophobicContact CE2-CB 4.47Å; F173-R201 VanDerWaalsContact CE2-CD 3.41Å; F173-R201 HydrophobicContact CE2-CG 4.48Å; F173-R201 HydrophobicContact CZ-CB 3.56Å; F173-R201 HydrophobicContact CZ-CG 4.01Å; V197-R201 PolarHBondContact O-N 3.22Å; E199-R201 PolarHBondContact O-N 2.83Å; R201-G203 PolarHBondContact O-N 2.97Å; R201-G204 PolarHBondContact O-N 3.44Å; R201-W205 HydrophobicContact CB-CH2 4.47Å; R201-W205 HydrophobicContact CG-CH2 4.27Å; R201-W205 HydrophobicContact CG-CZ2 3.91Å
202A97.6Very high96.2Very high91 Ų9149.2 Ų49.275%0.75230%0.297SS*.Hα-helixtrans-61.2-31178.600000112.7L198 E199 G204L198-A202 WeakPolarHBondContact O-CB 3.15Å; L198-A202 PolarHBondContact O-N 3.13Å; L198-A202 VanDerWaalsContact O-N 3.08Å; E199-A202 PolarHBondContact O-N 3.26Å; E199-A202 VanDerWaalsContact O-N 3.17Å; A202-G204 PolarHBondContact O-N 3.12Å
203G97.1Very high95.9Very high41 Ų4152.9 Ų52.942%0.42331%0.311SS..THydrogen-bonded Turntrans-78.26.3172.100000115E199 F200 R201E199-G203 PolarHBondContact O-N 3.05Å; F200-G203 PolarHBondContact O-N 3.39Å; R201-G203 PolarHBondContact O-N 2.97Å
204G97.2Very high95.7Very high42 Ų4256.6 Ų56.643%0.43332%0.323SS..THydrogen-bonded Turntrans75.743.9-176.300000112.8R201 A202 M206R201-G204 PolarHBondContact O-N 3.44Å; A202-G204 PolarHBondContact O-N 3.12Å; G204-M206 VanDerWaalsContact C-N 3.3Å; G204-M206 PolarHBondContact O-N 2.92Å
205W98Very high95.4Very high20 Ų2057.9 Ų57.98%0.07633%0.328CS..SBendtrans61.138.3-174.7-5292.3000112.8L154 G158 E159 E162 M169 F173 F200 R201L154-W205 HydrophobicContact CB-CZ3 4.24Å; L154-W205 HydrophobicContact CD2-CH2 4.14Å; L154-W205 HydrophobicContact CD2-CZ3 4.31Å; L154-W205 WeakPolarHBondContact O-CZ3 3.37Å; G158-W205 VanDerWaalsContact C-CZ2 3.42Å; G158-W205 VanDerWaalsContact CA-CH2 3.43Å; G158-W205 VanDerWaalsContact CA-CZ3 3.43Å; G158-W205 WeakPolarHBondContact O-CZ2 3.39Å; E159-W205 HydrophobicContact CB-CB 3.96Å; E159-W205 HydrophobicContact CB-CD2 4.05Å; E159-W205 HydrophobicContact CB-CG 3.58Å; E159-W205 HydrophobicContact CG-CB 4.3Å; E159-W205 HydrophobicContact CG-CG 3.96Å; E162-W205 HydrophobicContact CB-CZ2 4.06Å; E162-W205 PolarHBondContact OE2-NE1 3.11Å; M169-W205 HydrophobicContact CE-CH2 3.82Å; M169-W205 HydrophobicContact CE-CZ2 3.94Å; M169-W205 HydrophobicContact CG-CH2 4.37Å; M169-W205 HydrophobicContact CG-CZ2 4.03Å; M169-W205 HydrophobicContact SD-CH2 3.8Å; M169-W205 HydrophobicContact SD-CZ2 4.04Å; F173-W205 AromaticContact CE2-CH2 3.95Å; F173-W205 HydrophobicContact CE2-CH2 3.95Å; F173-W205 HydrophobicContact CZ-CH2 4.07Å; F173-W205 HydrophobicContact CZ-CZ3 4.39Å; F200-W205 AromaticContact CD1-CE3 3.79Å; F200-W205 HydrophobicContact CD1-CE3 3.79Å; F200-W205 HydrophobicContact CD1-CZ3 4.41Å; F200-W205 HydrophobicContact CE1-CB 4.1Å; F200-W205 AromaticContact CE1-CE3 3.67Å; F200-W205 HydrophobicContact CE1-CE3 3.67Å; F200-W205 WeakPolarHBondContact CE2-O 3.12Å; F200-W205 VanDerWaalsContact CZ-C 3.41Å; F200-W205 HydrophobicContact CZ-CB 4.19Å; F200-W205 WeakPolarHBondContact CZ-O 3.34Å; F200-W205 WeakPolarHBondContact O-CA 3.19Å; F200-W205 PolarHBondContact O-N 3.38Å; R201-W205 HydrophobicContact CB-CH2 4.47Å; R201-W205 HydrophobicContact CG-CH2 4.27Å; R201-W205 HydrophobicContact CG-CZ2 3.91Å
206M95.9Very high94.9Very high131 Ų13161.5 Ų61.565%0.64534%0.339SS*.  trans-144.9138.1175.1-68.2-170.8-66.600109.8F200 G204F200-M206 PolarHBondContact O-N 3.48Å; G204-M206 VanDerWaalsContact C-N 3.3Å; G204-M206 PolarHBondContact O-N 2.92Å
207L93.3Very high94Very high42 Ų4264.7 Ų64.722%0.2236%0.362CS..  trans-82.7141.2171.6-73.3-179.2000111.3E196 F200 A211 Y216E196-L207 HydrophobicContact CG-CD1 4.47Å; E196-L207 HydrophobicContact CG-CD2 4.42Å; E196-L207 WeakPolarHBondContact OE1-CD1 3.29Å; E196-L207 WeakPolarHBondContact OE1-CD2 3.46Å; F200-L207 HydrophobicContact CB-CD2 3.99Å; F200-L207 HydrophobicContact CD2-CD2 4.11Å; F200-L207 HydrophobicContact CD2-CG 3.81Å; L207-A211 HydrophobicContact CD2-CB 4.06Å; L207-Y216 HydrophobicContact CD1-CD2 4.49Å; L207-Y216 HydrophobicContact CD1-CE2 3.61Å
208S93.4Very high92.3Very high61 Ų6171.1 Ų71.143%0.42739%0.392SS..  trans-68.2158.2167.476.50000110.8T210 A211 H212S208-T210 PolarHBondContact O-N 3.08Å; S208-A211 PolarHBondContact O-N 3.36Å; S208-A211 WeakPolarHBondContact OG-CB 3.41Å; S208-A211 PolarHBondContact OG-N 3.04Å; S208-H212 WeakPolarHBondContact O-CB 3.26Å; S208-H212 PolarHBondContact O-N 3.09Å
209S91.2Very high90Very high93 Ų9377.1 Ų77.165%0.6542%0.422SS*.Hα-helixtrans-59.8-29.4174.955.30000113.1K213S209-K213 WeakPolarHBondContact O-CG 3.38Å; S209-K213 PolarHBondContact O-N 3.17Å
210T92.4Very high87.6Confident105 Ų10578 Ų7864%0.64444%0.443SS*.Hα-helixtrans-74.8-47.1178.4-52.60000110.6S208 H212 K213 Y214S208-T210 PolarHBondContact O-N 3.08Å; T210-H212 VanDerWaalsContact C-N 3.32Å; T210-H212 PolarHBondContact O-N 3.46Å; T210-K213 PolarHBondContact O-N 3.07Å; T210-Y214 PolarHBondContact O-N 3.37Å
211A92.2Very high84.7Confident4 Ų487.9 Ų87.93%0.03350%0.497CS..Hα-helixtrans-58.7-45.3174.900000110.9L207 S208 K213 Y214 Y215L207-A211 HydrophobicContact CD2-CB 4.06Å; S208-A211 PolarHBondContact O-N 3.36Å; S208-A211 WeakPolarHBondContact OG-CB 3.41Å; S208-A211 PolarHBondContact OG-N 3.04Å; A211-K213 VanDerWaalsContact C-N 3.26Å; A211-K213 PolarHBondContact O-N 3.17Å; A211-Y214 PolarHBondContact O-N 2.79Å; A211-Y214 VanDerWaalsContact O-N 3.1Å; A211-Y215 HydrophobicContact CB-CD2 4.09Å; A211-Y215 HydrophobicContact CB-CE2 3.91Å; A211-Y215 WeakPolarHBondContact O-CD2 3.37Å; A211-Y215 PolarHBondContact O-N 3.43Å
212H91Very high84Confident98 Ų9890.8 Ų90.845%0.45452%0.516SS..Hα-helixtrans-57.8-38.4177.9-16979.5000112.9S208 T210 Y216S208-H212 WeakPolarHBondContact O-CB 3.26Å; S208-H212 PolarHBondContact O-N 3.09Å; T210-H212 VanDerWaalsContact C-N 3.32Å; T210-H212 PolarHBondContact O-N 3.46Å; H212-Y216 AromaticContact CE1-CD2 3.76Å; H212-Y216 AromaticContact ND1-CD2 3.51Å; H212-Y216 AromaticContact ND1-CE2 3.98Å; H212-Y216 WeakPolarHBondContact O-CB 3.47Å; H212-Y216 WeakPolarHBondContact O-CD2 3.48Å; H212-Y216 PolarHBondContact O-N 3.33Å; H212-Y216 VanDerWaalsContact O-N 3.07Å
213K91.1Very high83.3Confident135 Ų13590.7 Ų90.759%0.58750%0.504SS*.Hα-helixtrans-67.2-45.7174.9-73.1175.5-177.6-178.10112S209 T210 A211 Y215 S217 E218S209-K213 WeakPolarHBondContact O-CG 3.38Å; S209-K213 PolarHBondContact O-N 3.17Å; T210-K213 PolarHBondContact O-N 3.07Å; A211-K213 VanDerWaalsContact C-N 3.26Å; A211-K213 PolarHBondContact O-N 3.17Å; K213-Y215 PolarHBondContact O-N 3Å; K213-S217 CarbonylContact O-C 3.51Å; K213-S217 VanDerWaalsContact O-CA 3.31Å; K213-S217 WeakPolarHBondContact O-CA 3.44Å; K213-S217 VanDerWaalsContact O-CB 3.24Å; K213-S217 WeakPolarHBondContact O-CB 3.36Å; K213-S217 PolarHBondContact O-N 3.27Å; K213-E218 PolarHBondContact O-N 3.44Å
214Y92Very high82.5Confident109 Ų10993.5 Ų93.543%0.42751%0.508SS..Hα-helixtrans-60.3-46-179.9-179.3-100.7000112.2L192 T210 A211L192-Y214 HydrophobicContact CD1-CE1 3.82Å; T210-Y214 PolarHBondContact O-N 3.37Å; A211-Y214 PolarHBondContact O-N 2.79Å; A211-Y214 VanDerWaalsContact O-N 3.1Å
215Y92Very high81.7Confident27 Ų2796.5 Ų96.511%0.10651%0.513CS..Hα-helixtrans-83.3-27.2-175.4-62.6-64.3000114.7L192 L195 E196 E199 A211 K213L192-Y215 HydrophobicContact CD1-CD1 3.7Å; L192-Y215 HydrophobicContact CD1-CE1 3.66Å; L192-Y215 HydrophobicContact CG-CD1 3.88Å; L192-Y215 HydrophobicContact CG-CE1 4.09Å; L195-Y215 WeakPolarHBondContact CD2-OH 3.44Å; L195-Y215 VanDerWaalsContact CG-OH 3.24Å; L195-Y215 WeakPolarHBondContact CG-OH 3.48Å; E196-Y215 HydrophobicContact CB-CD1 3.77Å; E196-Y215 HydrophobicContact CB-CD2 4.02Å; E196-Y215 HydrophobicContact CB-CE1 3.6Å; E196-Y215 HydrophobicContact CB-CE2 3.91Å; E196-Y215 HydrophobicContact CB-CG 3.99Å; E196-Y215 HydrophobicContact CG-CD1 3.98Å; E196-Y215 HydrophobicContact CG-CD2 3.57Å; E196-Y215 HydrophobicContact CG-CE1 4.22Å; E196-Y215 HydrophobicContact CG-CE2 3.88Å; E196-Y215 HydrophobicContact CG-CG 3.67Å; E199-Y215 PolarHBondContact OE1-OH 3.42Å; A211-Y215 HydrophobicContact CB-CD2 4.09Å; A211-Y215 HydrophobicContact CB-CE2 3.91Å; A211-Y215 WeakPolarHBondContact O-CD2 3.37Å; A211-Y215 PolarHBondContact O-N 3.43Å; K213-Y215 PolarHBondContact O-N 3Å
216Y89.1Confident80.7Confident133 Ų133101.3 Ų101.352%0.52254%0.54SS..Hα-helixtrans-127.9-7.5-170.5-54.5-73.3000115.4L207 H212L207-Y216 HydrophobicContact CD1-CD2 4.49Å; L207-Y216 HydrophobicContact CD1-CE2 3.61Å; H212-Y216 AromaticContact CE1-CD2 3.76Å; H212-Y216 AromaticContact ND1-CD2 3.51Å; H212-Y216 AromaticContact ND1-CE2 3.98Å; H212-Y216 WeakPolarHBondContact O-CB 3.47Å; H212-Y216 WeakPolarHBondContact O-CD2 3.48Å; H212-Y216 PolarHBondContact O-N 3.33Å; H212-Y216 VanDerWaalsContact O-N 3.07Å
217S79.1Confident79.6Confident70 Ų7099.3 Ų99.349%0.4953%0.533SS..THydrogen-bonded Turntrans-118.7-19.4-178.4-50.40000114K213 I219K213-S217 CarbonylContact O-C 3.51Å; K213-S217 VanDerWaalsContact O-CA 3.31Å; K213-S217 WeakPolarHBondContact O-CA 3.44Å; K213-S217 VanDerWaalsContact O-CB 3.24Å; K213-S217 WeakPolarHBondContact O-CB 3.36Å; K213-S217 PolarHBondContact O-N 3.27Å; S217-I219 VanDerWaalsContact C-N 3.31Å; S217-I219 PolarHBondContact O-N 2.98Å
218E62.6Low78.7Confident135 Ų135103.4 Ų103.463%0.63156%0.555SS**  trans-72.292.7168.2-70.7-173.2-178.800108.2K213 A220K213-E218 PolarHBondContact O-N 3.44Å; E218-A220 PolarHBondContact O-N 3.31Å; E218-A220 VanDerWaalsContact O-N 3.09Å
219I50.4Low77.5Confident151 Ų151106.7 Ų106.777%0.77457%0.565SS**  trans-59.9111.9161.1-60.3171.2000104.7S217 D221S217-I219 VanDerWaalsContact C-N 3.31Å; S217-I219 PolarHBondContact O-N 2.98Å; I219-D221 PolarHBondContact O-N 3.15Å
220A47.6Very low76.4Confident96 Ų96107.8 Ų107.879%0.79356%0.558SS**  trans-57.7112.3168.400000107.8E218E218-A220 PolarHBondContact O-N 3.31Å; E218-A220 VanDerWaalsContact O-N 3.09Å
221D37.3Very low74.9Confident231 Ų231108.1 Ų108.1100%1.23555%0.55SS**  trans-62.80168.9-79.8-33.9000111.3I219I219-D221 PolarHBondContact O-N 3.15Å

Retrieved 221 of 221 residues in 553.3 ms (Link to these results)

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