A0A060XNW6_ONCMY Loading...

Probable ribosome biogenesis protein RLP24

Involved in the biogenesis of the 60S ribosomal subunit. Ensures the docking of GTPBP4/NOG1 to pre-60S particles.

AlphaFold DB , UniProt , Accession A0A060XNW6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene RSL24D1, Length 162 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
1M89.2Confident95.7Very high212 Ų21275.9 Ų75.9100%1.04436%0.364SS*.  0133.30-164.5-178.7-149.300109.2P15M1-P15 HydrophobicContact CE-CB 3.46Å; M1-P15 VanDerWaalsContact CE-CB 3.46Å; M1-P15 HydrophobicContact CE-CG 3.34Å; M1-P15 HydrophobicContact CG-CB 4.46Å; M1-P15 HydrophobicContact CG-CG 3.49Å; M1-P15 VanDerWaalsContact CG-CG 3.49Å; M1-P15 HydrophobicContact SD-CG 4.03Å
2R92.5Very high95.8Very high143 Ų14376.2 Ų76.254%0.5438%0.376SS..  trans-121132.2-177.2-176.9171.9177.194.75.8111E4R2-E4 WeakPolarHBondContact CD-OE1 3.28Å; R2-E4 HydrophobicContact CG-CG 4.41Å; R2-E4 IonicContact NE-OE1 2.67Å; R2-E4 PolarHBondContact NE-OE1 3.36Å; R2-E4 IonicContact NE-OE2 3.23Å; R2-E4 PolarHBondContact NE-OE2 3.23Å
3I96.3Very high95.9Very high94 Ų9471.2 Ų71.248%0.48235%0.353SS..PPolyproline II helixtrans-87.8120.4169.8-57.6170.5000107.2P12 Y14I3-P12 HydrophobicContact CG2-CB 3.64Å; I3-Y14 HydrophobicContact CD1-CD1 4.14Å; I3-Y14 HydrophobicContact CD1-CE1 3.57Å; I3-Y14 HydrophobicContact CG1-CD1 4.03Å; I3-Y14 HydrophobicContact CG1-CE1 3.98Å
4E95.8Very high96Very high52 Ų5275.6 Ų75.624%0.24337%0.365CS..EExtended strand (participates in β ladder)trans-99159.6-178.8-63.7-72-168.300111.1R2 P12 V13R2-E4 WeakPolarHBondContact CD-OE1 3.28Å; R2-E4 HydrophobicContact CG-CG 4.41Å; R2-E4 IonicContact NE-OE1 2.67Å; R2-E4 PolarHBondContact NE-OE1 3.36Å; R2-E4 IonicContact NE-OE2 3.23Å; R2-E4 PolarHBondContact NE-OE2 3.23Å; E4-P12 CarbonylContact O-C 3.52Å; E4-V13 HydrophobicContact CB-CB 4.41Å; E4-V13 PolarHBondContact N-O 3.27Å; E4-V13 VanDerWaalsContact N-O 3.11Å; E4-V13 PolarHBondContact O-N 3.21Å
5K96.3Very high96Very high119 Ų11974.9 Ų74.952%0.51737%0.368SS..EExtended strand (participates in β ladder)trans-93.7133.4174.1-66.6-176.7-179.81760109.8E72K5-E72 WeakPolarHBondContact CE-OE1 3.34Å; K5-E72 IonicContact NZ-OE1 3.6Å; K5-E72 PolarHBondContact NZ-OE1 3.46Å; K5-E72 IonicContact NZ-OE2 2.77Å; K5-E72 PolarHBondContact NZ-OE2 3.08Å
6C97.8Very high96Very high4 Ų476.3 Ų76.33%0.02741%0.408CS..PPolyproline II helixtrans-66.3134.7173.1171.70000110.7F8 C9 S10 G11 V13 R30 C32C6-F8 VanDerWaalsContact C-N 3.32Å; C6-F8 PolarHBondContact O-N 3.44Å; C6-F8 PolarHBondContact SG-N 3.33Å; C6-F8 VanDerWaalsContact SG-N 3.42Å; C6-C9 HydrophobicContact CB-CB 4.44Å; C6-C9 WeakPolarHBondContact CB-SG 3.38Å; C6-C9 PolarHBondContact SG-N 3.36Å; C6-C9 VanDerWaalsContact SG-N 3.35Å; C6-C9 PolarHBondContact SG-SG 2.98Å; C6-S10 WeakPolarHBondContact O-CA 3.49Å; C6-S10 PolarHBondContact O-N 3.01Å; C6-G11 WeakPolarHBondContact CB-O 3.16Å; C6-G11 PolarHBondContact N-O 2.9Å; C6-V13 HydrophobicContact CB-CG2 3.85Å; C6-R30 CarbonylContact C-O 3.48Å; C6-R30 WeakPolarHBondContact CA-O 3.43Å; C6-C32 HydrophobicContact CB-CB 3.73Å; C6-C32 PolarHBondContact SG-N 3.38Å
7Y97.8Very high96Very high125 Ų12577.8 Ų77.849%0.4941%0.412SS..THydrogen-bonded Turntrans-59-40.5179.1-179.3-103.3000113.2F29 R30 F31 F40Y7-F29 AromaticContact CD1-CD1 3.89Å; Y7-F29 HydrophobicContact CD1-CD1 3.89Å; Y7-F29 HydrophobicContact CD1-CE1 4.44Å; Y7-F29 AromaticContact CD2-CD1 3.55Å; Y7-F29 HydrophobicContact CD2-CD1 3.55Å; Y7-F29 AromaticContact CD2-CE1 3.91Å; Y7-F29 HydrophobicContact CD2-CE1 3.91Å; Y7-F29 HydrophobicContact CE1-CD1 4.04Å; Y7-F29 HydrophobicContact CE1-CE1 4.14Å; Y7-F29 AromaticContact CE2-CD1 3.71Å; Y7-F29 HydrophobicContact CE2-CD1 3.71Å; Y7-F29 AromaticContact CE2-CE1 3.56Å; Y7-F29 HydrophobicContact CE2-CE1 3.56Å; Y7-F29 AromaticContact CG-CD1 3.63Å; Y7-F29 HydrophobicContact CG-CD1 3.63Å; Y7-F29 HydrophobicContact CG-CE1 4.33Å; Y7-F29 AromaticContact CZ-CD1 3.94Å; Y7-F29 AromaticContact CZ-CE1 3.67Å; Y7-R30 PolarHBondContact N-O 3.13Å; Y7-F31 HydrophobicContact CD1-CE1 4.18Å; Y7-F40 AromaticContact CD1-CD2 3.85Å; Y7-F40 HydrophobicContact CD1-CD2 3.85Å; Y7-F40 AromaticContact CD1-CE2 3.97Å; Y7-F40 HydrophobicContact CD1-CE2 3.97Å; Y7-F40 AromaticContact CE1-CD2 3.74Å; Y7-F40 HydrophobicContact CE1-CD2 3.74Å; Y7-F40 AromaticContact CE1-CE2 3.61Å; Y7-F40 HydrophobicContact CE1-CE2 3.61Å
8F97.8Very high95.9Very high0 Ų075.7 Ų75.70%041%0.412CS..THydrogen-bonded Turntrans-89.9-50.2-174.8-162-83.3000112.9C6 F31 C36 N39 R44 P46 T49 W51 T52C6-F8 VanDerWaalsContact C-N 3.32Å; C6-F8 PolarHBondContact O-N 3.44Å; C6-F8 PolarHBondContact SG-N 3.33Å; C6-F8 VanDerWaalsContact SG-N 3.42Å; F8-F31 HydrophobicContact CB-CD1 4.37Å; F8-F31 HydrophobicContact CB-CE1 4.42Å; F8-C36 HydrophobicContact CB-CB 3.85Å; F8-C36 HydrophobicContact CG-CB 4.39Å; F8-N39 HydrophobicContact CD2-CB 4.23Å; F8-N39 HydrophobicContact CE1-CB 3.95Å; F8-N39 HydrophobicContact CE2-CB 3.6Å; F8-N39 HydrophobicContact CZ-CB 3.46Å; F8-N39 VanDerWaalsContact CZ-CB 3.46Å; F8-R44 HydrophobicContact CE2-CB 4.41Å; F8-R44 WeakPolarHBondContact CE2-O 3.38Å; F8-R44 HydrophobicContact CZ-CB 4.4Å; F8-P46 HydrophobicContact CD2-CB 4.47Å; F8-P46 HydrophobicContact CD2-CG 3.73Å; F8-P46 HydrophobicContact CE2-CB 4.44Å; F8-P46 HydrophobicContact CE2-CG 3.83Å; F8-P46 HydrophobicContact CG-CG 4.26Å; F8-P46 HydrophobicContact CZ-CG 4.43Å; F8-T49 HydrophobicContact CE1-CG2 4.05Å; F8-T49 HydrophobicContact CZ-CG2 4.29Å; F8-W51 AromaticContact CD1-CH2 3.68Å; F8-W51 HydrophobicContact CD1-CH2 3.68Å; F8-W51 AromaticContact CD1-CZ2 3.86Å; F8-W51 HydrophobicContact CD1-CZ2 3.86Å; F8-W51 AromaticContact CE1-CH2 3.88Å; F8-W51 HydrophobicContact CE1-CH2 3.88Å; F8-W51 AromaticContact CE1-CZ2 3.54Å; F8-W51 HydrophobicContact CE1-CZ2 3.54Å; F8-T52 HydrophobicContact CD1-CG2 3.81Å; F8-T52 HydrophobicContact CE1-CG2 3.62Å; F8-T52 WeakPolarHBondContact O-CG2 3.45Å
9C96.3Very high96Very high17 Ų1775.1 Ų75.112%0.11541%0.411CS..THydrogen-bonded Turntrans-86.7-20.7-173.874.50000113.3C6 G11 C32 W51C6-C9 HydrophobicContact CB-CB 4.44Å; C6-C9 WeakPolarHBondContact CB-SG 3.38Å; C6-C9 PolarHBondContact SG-N 3.36Å; C6-C9 VanDerWaalsContact SG-N 3.35Å; C6-C9 PolarHBondContact SG-SG 2.98Å; C9-G11 PolarHBondContact O-N 3.47Å; C9-G11 VanDerWaalsContact O-N 3.13Å; C9-G11 PolarHBondContact SG-N 3.44Å; C9-C32 WeakPolarHBondContact CB-SG 3.41Å; C9-C32 WeakPolarHBondContact SG-CB 3.26Å; C9-C32 CovalentContact SG-SG 2.11Å; C9-C32 PolarHBondContact SG-SG 3.44Å; C9-W51 HydrophobicContact CB-CH2 4.13Å; C9-W51 HydrophobicContact CB-CZ3 3.64Å
10S96.4Very high96Very high50 Ų5075.8 Ų75.835%0.3541%0.412SS..  trans55.412.7-165.4-37.80000115.2C6C6-S10 WeakPolarHBondContact O-CA 3.49Å; C6-S10 PolarHBondContact O-N 3.01Å
11G96.1Very high96.1Very high19 Ų1976.3 Ų76.320%0.19641%0.411CS..  trans-75.7164.4171.200000112.2C6 C9C6-G11 WeakPolarHBondContact CB-O 3.16Å; C6-G11 PolarHBondContact N-O 2.9Å; C9-G11 PolarHBondContact O-N 3.47Å; C9-G11 VanDerWaalsContact O-N 3.13Å; C9-G11 PolarHBondContact SG-N 3.44Å
12P97.3Very high96.5Very high79 Ų7970.1 Ų70.151%0.51339%0.385SS..EExtended strand (participates in β ladder)trans-67.7144.7178.229.3-34.5000111.5I3 E4 Y14I3-P12 HydrophobicContact CG2-CB 3.64Å; E4-P12 CarbonylContact O-C 3.52Å; P12-Y14 HydrophobicContact CB-CE2 4.15Å; P12-Y14 HydrophobicContact CG-CE2 4.19Å
13V97.4Very high96.7Very high11 Ų1168.2 Ų68.27%0.06738%0.377CS..EExtended strand (participates in β ladder)trans-120.4106.5172.6-1740000106.9E4 C6 H17 C32E4-V13 HydrophobicContact CB-CB 4.41Å; E4-V13 PolarHBondContact N-O 3.27Å; E4-V13 VanDerWaalsContact N-O 3.11Å; E4-V13 PolarHBondContact O-N 3.21Å; C6-V13 HydrophobicContact CB-CG2 3.85Å; V13-H17 VanDerWaalsContact CG1-O 3.25Å; V13-H17 WeakPolarHBondContact CG1-O 3.48Å; V13-C32 HydrophobicContact CG2-CB 4.18Å
14Y96.8Very high96.8Very high134 Ų13471.7 Ų71.753%0.52540%0.397SS..  trans-78.5153.6174.8-67.8-85.7000110.3I3 P12 H17I3-Y14 HydrophobicContact CD1-CD1 4.14Å; I3-Y14 HydrophobicContact CD1-CE1 3.57Å; I3-Y14 HydrophobicContact CG1-CD1 4.03Å; I3-Y14 HydrophobicContact CG1-CE1 3.98Å; P12-Y14 HydrophobicContact CB-CE2 4.15Å; P12-Y14 HydrophobicContact CG-CE2 4.19Å; Y14-H17 WeakPolarHBondContact O-CB 3.39Å; Y14-H17 PolarHBondContact O-N 3.03Å; Y14-H17 VanDerWaalsContact O-N 3.09Å
15P96.8Very high96.9Very high64 Ų6472.5 Ų72.542%0.41640%0.403SS..THydrogen-bonded Turntrans-58.3144.1174.8-28.239.4000112.3M1 H17M1-P15 HydrophobicContact CE-CB 3.46Å; M1-P15 VanDerWaalsContact CE-CB 3.46Å; M1-P15 HydrophobicContact CE-CG 3.34Å; M1-P15 HydrophobicContact CG-CB 4.46Å; M1-P15 HydrophobicContact CG-CG 3.49Å; M1-P15 VanDerWaalsContact CG-CG 3.49Å; M1-P15 HydrophobicContact SD-CG 4.03Å; P15-H17 PolarHBondContact O-N 3.35Å
16G94.9Very high96.9Very high97 Ų9772 Ų72100%141%0.413SS*.THydrogen-bonded Turntrans75.9-2.7-172.400000114.7
17H95.8Very high96.9Very high102 Ų10277.2 Ų77.247%0.47244%0.436SS..SBendtrans-114140.8-178.2-164.5-72.1000112.5V13 Y14 P15 C32V13-H17 VanDerWaalsContact CG1-O 3.25Å; V13-H17 WeakPolarHBondContact CG1-O 3.48Å; Y14-H17 WeakPolarHBondContact O-CB 3.39Å; Y14-H17 PolarHBondContact O-N 3.03Å; Y14-H17 VanDerWaalsContact O-N 3.09Å; P15-H17 PolarHBondContact O-N 3.35Å; H17-C32 PolarHBondContact CE1-O 2.82Å; H17-C32 PolarHBondContact ND1-O 3.33Å
18G95.6Very high96.9Very high40 Ų4075.3 Ų75.341%0.41244%0.437SS..SBendtrans84.1-158.1173.100000113.3F31G18-F31 WeakPolarHBondContact CA-O 3.31Å
19T96.6Very high96.8Very high64 Ų6476 Ų7639%0.39344%0.44SS..EExtended strand (participates in β ladder)trans-139.2148.9-177.537.40000110.4F31T19-F31 PolarHBondContact N-O 3.25Å; T19-F31 PolarHBondContact O-N 3.17Å
20M97.1Very high96.9Very high90 Ų9079.7 Ų79.744%0.44345%0.452SS..EExtended strand (participates in β ladder)trans-111.8134.3171.6-174.5-172.9-54.300109.2V22 T28 F29 R30M20-V22 HydrophobicContact CG-CG2 4.39Å; M20-V22 HydrophobicContact SD-CG2 4.09Å; M20-T28 HydrophobicContact SD-CG2 4.24Å; M20-F29 CarbonylContact C-O 3.57Å; M20-F29 WeakPolarHBondContact CA-O 3.35Å; M20-R30 HydrophobicContact CE-CG 4.28Å; M20-R30 VanDerWaalsContact CE-NH2 3.26Å; M20-R30 HydrophobicContact CG-CG 4.33Å
21F97.5Very high97Very high86 Ų8677.3 Ų77.338%0.37744%0.435SS..EExtended strand (participates in β ladder)trans-113.9125.7168.6174-115000108.6R23 F29 F31 F40F21-R23 HydrophobicContact CE1-CB 3.94Å; F21-R23 HydrophobicContact CE1-CG 4.45Å; F21-R23 HydrophobicContact CZ-CB 4.36Å; F21-F29 HydrophobicContact CB-CB 4.45Å; F21-F29 AromaticContact CD1-CD2 3.81Å; F21-F29 HydrophobicContact CD1-CD2 3.81Å; F21-F29 HydrophobicContact CE1-CD2 4.39Å; F21-F29 PolarHBondContact N-O 2.99Å; F21-F29 PolarHBondContact O-N 3.47Å; F21-F31 HydrophobicContact CB-CE2 3.99Å; F21-F40 AromaticContact CD1-CE1 3.69Å; F21-F40 HydrophobicContact CD1-CE1 3.69Å; F21-F40 HydrophobicContact CD1-CZ 4.24Å; F21-F40 AromaticContact CE1-CE1 3.97Å; F21-F40 HydrophobicContact CE1-CE1 3.97Å; F21-F40 HydrophobicContact CE1-CZ 4.43Å
22V97.9Very high97Very high83 Ų8377.1 Ų77.150%0.50343%0.43SS..EExtended strand (participates in β ladder)trans-102.9123.9173.4-171.60000107.2M20 T28M20-V22 HydrophobicContact CG-CG2 4.39Å; M20-V22 HydrophobicContact SD-CG2 4.09Å; V22-T28 HydrophobicContact CG1-CG2 4.48Å; V22-T28 HydrophobicContact CG2-CG2 4.23Å
23R97.4Very high97Very high102 Ų10279.7 Ų79.739%0.38543%0.434SS..  trans-93.6157176.1-174.4170.168.2172.29.2109.7F21 D25 C26 K27 F29F21-R23 HydrophobicContact CE1-CB 3.94Å; F21-R23 HydrophobicContact CE1-CG 4.45Å; F21-R23 HydrophobicContact CZ-CB 4.36Å; R23-D25 VanDerWaalsContact CB-OD1 3.3Å; R23-D25 WeakPolarHBondContact CB-OD1 3.38Å; R23-D25 WeakPolarHBondContact CG-OD1 3.44Å; R23-D25 IonicContact CZ-OD1 3.6Å; R23-D25 IonicContact CZ-OD2 3.4Å; R23-D25 IonicContact NE-OD1 3.3Å; R23-D25 PolarHBondContact NE-OD1 3.46Å; R23-D25 IonicContact NE-OD2 3.76Å; R23-D25 PolarHBondContact NE-OD2 2.94Å; R23-D25 IonicContact NH2-OD1 3.6Å; R23-D25 IonicContact NH2-OD2 2.67Å; R23-D25 PolarHBondContact NH2-OD2 3.36Å; R23-D25 PolarHBondContact O-N 2.93Å; R23-C26 WeakPolarHBondContact O-CA 3.38Å; R23-C26 PolarHBondContact O-N 3.11Å; R23-K27 PolarHBondContact N-O 3.01Å; R23-F29 HydrophobicContact CB-CE2 3.95Å
24N97.3Very high97Very high168 Ų16883 Ų8390%0.89846%0.457SS*.THydrogen-bonded Turntrans-55.3-23-177.7-59.86.7000114.3C26N24-C26 PolarHBondContact O-N 3.4Å
25D97.7Very high97Very high68 Ų6882.2 Ų82.236%0.36446%0.456SS..THydrogen-bonded Turntrans-82.122173.169.4-28.6000113.5R23 K27R23-D25 VanDerWaalsContact CB-OD1 3.3Å; R23-D25 WeakPolarHBondContact CB-OD1 3.38Å; R23-D25 WeakPolarHBondContact CG-OD1 3.44Å; R23-D25 IonicContact CZ-OD1 3.6Å; R23-D25 IonicContact CZ-OD2 3.4Å; R23-D25 IonicContact NE-OD1 3.3Å; R23-D25 PolarHBondContact NE-OD1 3.46Å; R23-D25 IonicContact NE-OD2 3.76Å; R23-D25 PolarHBondContact NE-OD2 2.94Å; R23-D25 IonicContact NH2-OD1 3.6Å; R23-D25 IonicContact NH2-OD2 2.67Å; R23-D25 PolarHBondContact NH2-OD2 3.36Å; R23-D25 PolarHBondContact O-N 2.93Å; D25-K27 PolarHBondContact O-N 3.02Å; D25-K27 WeakPolarHBondContact OD1-CB 3.39Å; D25-K27 PolarHBondContact OD1-N 3.14Å; D25-K27 WeakPolarHBondContact OD2-CD 3.33Å; D25-K27 WeakPolarHBondContact OD2-CE 3.43Å; D25-K27 WeakPolarHBondContact OD2-CG 3.49Å; D25-K27 IonicContact OD2-NZ 2.93Å; D25-K27 PolarHBondContact OD2-NZ 2.97Å
26C97Very high97.1Very high109 Ų10979.3 Ų79.374%0.73644%0.437SS*.SBendtrans56.814.9-175.3-610000114.8R23 N24R23-C26 WeakPolarHBondContact O-CA 3.38Å; R23-C26 PolarHBondContact O-N 3.11Å; N24-C26 PolarHBondContact O-N 3.4Å
27K97.1Very high97.2Very high113 Ų11376.2 Ų76.249%0.49140%0.398SS..  trans-80.9129176.4-68.6-173.1-166.5157.70110.7R23 D25 F29R23-K27 PolarHBondContact N-O 3.01Å; D25-K27 PolarHBondContact O-N 3.02Å; D25-K27 WeakPolarHBondContact OD1-CB 3.39Å; D25-K27 PolarHBondContact OD1-N 3.14Å; D25-K27 WeakPolarHBondContact OD2-CD 3.33Å; D25-K27 WeakPolarHBondContact OD2-CE 3.43Å; D25-K27 WeakPolarHBondContact OD2-CG 3.49Å; D25-K27 IonicContact OD2-NZ 2.93Å; D25-K27 PolarHBondContact OD2-NZ 2.97Å; K27-F29 HydrophobicContact CB-CE2 3.93Å; K27-F29 HydrophobicContact CB-CZ 4.05Å
28T97.1Very high97.3Very high85 Ų8578 Ų7852%0.52140%0.404SS..EExtended strand (participates in β ladder)trans-98.8124.4178.955.80000110.4M20 V22M20-T28 HydrophobicContact SD-CG2 4.24Å; V22-T28 HydrophobicContact CG1-CG2 4.48Å; V22-T28 HydrophobicContact CG2-CG2 4.23Å
29F97.4Very high97.4Very high14 Ų1476.8 Ų76.86%0.06139%0.388CS..EExtended strand (participates in β ladder)trans-113.1113.6176.2-59.2-81000109.1Y7 M20 F21 R23 K27 F31 F40Y7-F29 AromaticContact CD1-CD1 3.89Å; Y7-F29 HydrophobicContact CD1-CD1 3.89Å; Y7-F29 HydrophobicContact CD1-CE1 4.44Å; Y7-F29 AromaticContact CD2-CD1 3.55Å; Y7-F29 HydrophobicContact CD2-CD1 3.55Å; Y7-F29 AromaticContact CD2-CE1 3.91Å; Y7-F29 HydrophobicContact CD2-CE1 3.91Å; Y7-F29 HydrophobicContact CE1-CD1 4.04Å; Y7-F29 HydrophobicContact CE1-CE1 4.14Å; Y7-F29 AromaticContact CE2-CD1 3.71Å; Y7-F29 HydrophobicContact CE2-CD1 3.71Å; Y7-F29 AromaticContact CE2-CE1 3.56Å; Y7-F29 HydrophobicContact CE2-CE1 3.56Å; Y7-F29 AromaticContact CG-CD1 3.63Å; Y7-F29 HydrophobicContact CG-CD1 3.63Å; Y7-F29 HydrophobicContact CG-CE1 4.33Å; Y7-F29 AromaticContact CZ-CD1 3.94Å; Y7-F29 AromaticContact CZ-CE1 3.67Å; M20-F29 CarbonylContact C-O 3.57Å; M20-F29 WeakPolarHBondContact CA-O 3.35Å; F21-F29 HydrophobicContact CB-CB 4.45Å; F21-F29 AromaticContact CD1-CD2 3.81Å; F21-F29 HydrophobicContact CD1-CD2 3.81Å; F21-F29 HydrophobicContact CE1-CD2 4.39Å; F21-F29 PolarHBondContact N-O 2.99Å; F21-F29 PolarHBondContact O-N 3.47Å; R23-F29 HydrophobicContact CB-CE2 3.95Å; K27-F29 HydrophobicContact CB-CE2 3.93Å; K27-F29 HydrophobicContact CB-CZ 4.05Å; F29-F31 HydrophobicContact CB-CE2 3.82Å; F29-F31 HydrophobicContact CB-CZ 3.71Å; F29-F40 HydrophobicContact CD1-CE2 4.21Å; F29-F40 HydrophobicContact CD1-CZ 4.31Å; F29-F40 HydrophobicContact CD2-CZ 4.09Å; F29-F40 HydrophobicContact CE1-CE2 4.37Å; F29-F40 HydrophobicContact CE1-CZ 4.48Å; F29-F40 HydrophobicContact CE2-CZ 4.26Å; F29-F40 HydrophobicContact CG-CE2 4.4Å; F29-F40 HydrophobicContact CG-CZ 4.1Å; F29-F40 HydrophobicContact CZ-CZ 4.45Å
30R97.6Very high97.5Very high95 Ų9575.9 Ų75.936%0.35838%0.379SS..EExtended strand (participates in β ladder)trans-96.1137175.3-65-178.9-176.2-100.36110.5C6 Y7 M20C6-R30 CarbonylContact C-O 3.48Å; C6-R30 WeakPolarHBondContact CA-O 3.43Å; Y7-R30 PolarHBondContact N-O 3.13Å; M20-R30 HydrophobicContact CE-CG 4.28Å; M20-R30 VanDerWaalsContact CE-NH2 3.26Å; M20-R30 HydrophobicContact CG-CG 4.33Å
31F98.3Very high97.5Very high0 Ų078.8 Ų78.80%039%0.389CS..EExtended strand (participates in β ladder)trans-122.2132.4-179.4-60.2-71.8000111.8Y7 F8 G18 T19 F21 F29 C36 L37 F40Y7-F31 HydrophobicContact CD1-CE1 4.18Å; F8-F31 HydrophobicContact CB-CD1 4.37Å; F8-F31 HydrophobicContact CB-CE1 4.42Å; G18-F31 WeakPolarHBondContact CA-O 3.31Å; T19-F31 PolarHBondContact N-O 3.25Å; T19-F31 PolarHBondContact O-N 3.17Å; F21-F31 HydrophobicContact CB-CE2 3.99Å; F29-F31 HydrophobicContact CB-CE2 3.82Å; F29-F31 HydrophobicContact CB-CZ 3.71Å; F31-C36 HydrophobicContact CB-CB 4.21Å; F31-C36 HydrophobicContact CD1-CB 3.96Å; F31-C36 HydrophobicContact CG-CB 4.49Å; F31-L37 HydrophobicContact CB-CB 4.4Å; F31-L37 HydrophobicContact CD2-CB 4.24Å; F31-L37 HydrophobicContact CD2-CD1 3.61Å; F31-L37 HydrophobicContact CE2-CD1 3.61Å; F31-L37 HydrophobicContact CG-CB 4.24Å; F31-L37 HydrophobicContact CG-CD1 4.41Å; F31-L37 HydrophobicContact CZ-CD1 4.43Å; F31-F40 HydrophobicContact CE1-CB 3.64Å; F31-F40 HydrophobicContact CE1-CD1 4.33Å; F31-F40 HydrophobicContact CE1-CD2 4.05Å; F31-F40 AromaticContact CE1-CG 3.76Å; F31-F40 HydrophobicContact CE1-CG 3.76Å; F31-F40 HydrophobicContact CE2-CD1 4.18Å; F31-F40 HydrophobicContact CE2-CG 4.42Å; F31-F40 HydrophobicContact CZ-CB 3.7Å; F31-F40 AromaticContact CZ-CD1 3.51Å; F31-F40 HydrophobicContact CZ-CD1 3.51Å; F31-F40 AromaticContact CZ-CD2 3.81Å; F31-F40 HydrophobicContact CZ-CD2 3.81Å; F31-F40 HydrophobicContact CZ-CE1 4.03Å; F31-F40 HydrophobicContact CZ-CE2 4.28Å; F31-F40 AromaticContact CZ-CG 3.38Å; F31-F40 HydrophobicContact CZ-CG 3.38Å; F31-F40 HydrophobicContact CZ-CZ 4.38Å
32C97.3Very high97.5Very high15 Ų1581.7 Ų81.710%0.10140%0.402CS..SBendtrans-63.5-44.6178.356.60000111.9C6 C9 V13 H17 C36C6-C32 HydrophobicContact CB-CB 3.73Å; C6-C32 PolarHBondContact SG-N 3.38Å; C9-C32 WeakPolarHBondContact CB-SG 3.41Å; C9-C32 WeakPolarHBondContact SG-CB 3.26Å; C9-C32 CovalentContact SG-SG 2.11Å; C9-C32 PolarHBondContact SG-SG 3.44Å; V13-C32 HydrophobicContact CG2-CB 4.18Å; H17-C32 PolarHBondContact CE1-O 2.82Å; H17-C32 PolarHBondContact ND1-O 3.33Å; C32-C36 PolarHBondContact SG-SG 3.02Å
33K96.7Very high97.5Very high134 Ų13487 Ų8758%0.58342%0.418SS*.SBendtrans-146.8164-175.1-59-176.3-178.9-171.60111.2K35 C36 L37K33-K35 PolarHBondContact O-N 3.07Å; K33-K35 VanDerWaalsContact O-N 3.16Å; K33-C36 WeakPolarHBondContact O-CB 3.44Å; K33-C36 PolarHBondContact O-N 3.32Å; K33-L37 PolarHBondContact O-N 3.15Å
34S97.2Very high97.5Very high79 Ų7988.8 Ų88.855%0.55243%0.425SS*.Hα-helixtrans-55.1-33.1176.663.60000113.3C36 L37 K38S34-C36 VanDerWaalsContact C-N 3.29Å; S34-C36 PolarHBondContact O-N 2.9Å; S34-L37 PolarHBondContact O-N 3.44Å; S34-K38 WeakPolarHBondContact O-CB 3.37Å; S34-K38 WeakPolarHBondContact O-CG 3.35Å; S34-K38 PolarHBondContact O-N 3.47Å
35K97.6Very high97.5Very high118 Ų11884.5 Ų84.551%0.51340%0.402SS..Hα-helixtrans-53.6-43.3171.9-178.6178.4-1781760112.5K33 N39 W51K33-K35 PolarHBondContact O-N 3.07Å; K33-K35 VanDerWaalsContact O-N 3.16Å; K35-N39 PolarHBondContact O-N 3.45Å; K35-N39 VanDerWaalsContact O-N 3.13Å; K35-N39 PolarHBondContact O-ND2 2.95Å; K35-W51 HydrophobicContact CD-CZ2 4.28Å; K35-W51 HydrophobicContact CG-CZ2 4.41Å
36C97.8Very high97.5Very high3 Ų382.3 Ų82.32%0.0239%0.392CS..Hα-helixtrans-71.2-43.3-179.5-670000111.3F8 F31 C32 K33 S34 N39 F40F8-C36 HydrophobicContact CB-CB 3.85Å; F8-C36 HydrophobicContact CG-CB 4.39Å; F31-C36 HydrophobicContact CB-CB 4.21Å; F31-C36 HydrophobicContact CD1-CB 3.96Å; F31-C36 HydrophobicContact CG-CB 4.49Å; C32-C36 PolarHBondContact SG-SG 3.02Å; K33-C36 WeakPolarHBondContact O-CB 3.44Å; K33-C36 PolarHBondContact O-N 3.32Å; S34-C36 VanDerWaalsContact C-N 3.29Å; S34-C36 PolarHBondContact O-N 2.9Å; C36-N39 PolarHBondContact O-N 2.93Å; C36-F40 WeakPolarHBondContact O-CB 3.31Å; C36-F40 PolarHBondContact O-N 3.31Å
37L97.8Very high97.4Very high33 Ų3385.6 Ų85.617%0.17339%0.388CS..Hα-helixtrans-60.7-47.9176179.466.3000111.4F31 K33 S34 N39 F40 K41F31-L37 HydrophobicContact CB-CB 4.4Å; F31-L37 HydrophobicContact CD2-CB 4.24Å; F31-L37 HydrophobicContact CD2-CD1 3.61Å; F31-L37 HydrophobicContact CE2-CD1 3.61Å; F31-L37 HydrophobicContact CG-CB 4.24Å; F31-L37 HydrophobicContact CG-CD1 4.41Å; F31-L37 HydrophobicContact CZ-CD1 4.43Å; K33-L37 PolarHBondContact O-N 3.15Å; S34-L37 PolarHBondContact O-N 3.44Å; L37-N39 PolarHBondContact O-N 3.2Å; L37-F40 WeakPolarHBondContact O-CB 3.41Å; L37-F40 PolarHBondContact O-N 3.36Å; L37-K41 HydrophobicContact CG-CD 4.47Å; L37-K41 WeakPolarHBondContact O-CG 3.34Å; L37-K41 PolarHBondContact O-N 3.17Å
38K98.1Very high97.4Very high138 Ų13888.5 Ų88.560%0.640%0.401SS*.Hα-helixtrans-60.5-42.4178.2-72.2179.6-177.6-176.80111.7S34 K41 K42S34-K38 WeakPolarHBondContact O-CB 3.37Å; S34-K38 WeakPolarHBondContact O-CG 3.35Å; S34-K38 PolarHBondContact O-N 3.47Å; K38-K41 PolarHBondContact O-N 3.46Å; K38-K42 WeakPolarHBondContact O-CB 3.46Å; K38-K42 WeakPolarHBondContact O-CG 3.47Å; K38-K42 PolarHBondContact O-N 3.07Å
39N97.9Very high97.4Very high15 Ų1585.6 Ų85.68%0.0838%0.383CS..Hα-helixtrans-66.7-36.7176.1-75.1-52.5000112.6F8 K35 C36 L37 K42 K43 R44F8-N39 HydrophobicContact CD2-CB 4.23Å; F8-N39 HydrophobicContact CE1-CB 3.95Å; F8-N39 HydrophobicContact CE2-CB 3.6Å; F8-N39 HydrophobicContact CZ-CB 3.46Å; F8-N39 VanDerWaalsContact CZ-CB 3.46Å; K35-N39 PolarHBondContact O-N 3.45Å; K35-N39 VanDerWaalsContact O-N 3.13Å; K35-N39 PolarHBondContact O-ND2 2.95Å; C36-N39 PolarHBondContact O-N 2.93Å; L37-N39 PolarHBondContact O-N 3.2Å; N39-K42 CarbonylContact O-C 3.52Å; N39-K42 PolarHBondContact O-N 2.83Å; N39-K43 PolarHBondContact O-N 3.32Å; N39-R44 HydrophobicContact CB-CB 4.44Å; N39-R44 PolarHBondContact O-N 3.35Å; N39-R44 VanDerWaalsContact OD1-CD 3.27Å; N39-R44 WeakPolarHBondContact OD1-CD 3.45Å; N39-R44 PolarHBondContact OD1-NH1 3.14Å
40F97.8Very high97.4Very high45 Ų4594.4 Ų94.420%0.19742%0.416CS..Hα-helixtrans-64.5-45.9173.8177.7-97.1000111.8Y7 F21 F29 F31 C36 L37 K42 K43Y7-F40 AromaticContact CD1-CD2 3.85Å; Y7-F40 HydrophobicContact CD1-CD2 3.85Å; Y7-F40 AromaticContact CD1-CE2 3.97Å; Y7-F40 HydrophobicContact CD1-CE2 3.97Å; Y7-F40 AromaticContact CE1-CD2 3.74Å; Y7-F40 HydrophobicContact CE1-CD2 3.74Å; Y7-F40 AromaticContact CE1-CE2 3.61Å; Y7-F40 HydrophobicContact CE1-CE2 3.61Å; F21-F40 AromaticContact CD1-CE1 3.69Å; F21-F40 HydrophobicContact CD1-CE1 3.69Å; F21-F40 HydrophobicContact CD1-CZ 4.24Å; F21-F40 AromaticContact CE1-CE1 3.97Å; F21-F40 HydrophobicContact CE1-CE1 3.97Å; F21-F40 HydrophobicContact CE1-CZ 4.43Å; F29-F40 HydrophobicContact CD1-CE2 4.21Å; F29-F40 HydrophobicContact CD1-CZ 4.31Å; F29-F40 HydrophobicContact CD2-CZ 4.09Å; F29-F40 HydrophobicContact CE1-CE2 4.37Å; F29-F40 HydrophobicContact CE1-CZ 4.48Å; F29-F40 HydrophobicContact CE2-CZ 4.26Å; F29-F40 HydrophobicContact CG-CE2 4.4Å; F29-F40 HydrophobicContact CG-CZ 4.1Å; F29-F40 HydrophobicContact CZ-CZ 4.45Å; F31-F40 HydrophobicContact CE1-CB 3.64Å; F31-F40 HydrophobicContact CE1-CD1 4.33Å; F31-F40 HydrophobicContact CE1-CD2 4.05Å; F31-F40 AromaticContact CE1-CG 3.76Å; F31-F40 HydrophobicContact CE1-CG 3.76Å; F31-F40 HydrophobicContact CE2-CD1 4.18Å; F31-F40 HydrophobicContact CE2-CG 4.42Å; F31-F40 HydrophobicContact CZ-CB 3.7Å; F31-F40 AromaticContact CZ-CD1 3.51Å; F31-F40 HydrophobicContact CZ-CD1 3.51Å; F31-F40 AromaticContact CZ-CD2 3.81Å; F31-F40 HydrophobicContact CZ-CD2 3.81Å; F31-F40 HydrophobicContact CZ-CE1 4.03Å; F31-F40 HydrophobicContact CZ-CE2 4.28Å; F31-F40 AromaticContact CZ-CG 3.38Å; F31-F40 HydrophobicContact CZ-CG 3.38Å; F31-F40 HydrophobicContact CZ-CZ 4.38Å; C36-F40 WeakPolarHBondContact O-CB 3.31Å; C36-F40 PolarHBondContact O-N 3.31Å; L37-F40 WeakPolarHBondContact O-CB 3.41Å; L37-F40 PolarHBondContact O-N 3.36Å; F40-K42 VanDerWaalsContact C-N 3.28Å; F40-K42 PolarHBondContact O-N 3.36Å; F40-K43 WeakPolarHBondContact O-CA 3.41Å; F40-K43 PolarHBondContact O-N 3.13Å
41K97.4Very high97.3Very high151 Ų15195 Ų9566%0.65742%0.418SS*.Hα-helixtrans-59.5-38.1174.1-71.9-174.5176.8-169.20112.1L37 K38 K43L37-K41 HydrophobicContact CG-CD 4.47Å; L37-K41 WeakPolarHBondContact O-CG 3.34Å; L37-K41 PolarHBondContact O-N 3.17Å; K38-K41 PolarHBondContact O-N 3.46Å; K41-K43 PolarHBondContact O-N 2.77Å; K41-K43 VanDerWaalsContact O-N 3.16Å
42K97.7Very high97.3Very high148 Ų14895 Ų9564%0.64342%0.418SS*.THydrogen-bonded Turntrans-73.89.1172.4-69.5-174.7177.2-165.90114.1K38 N39 F40 R44K38-K42 WeakPolarHBondContact O-CB 3.46Å; K38-K42 WeakPolarHBondContact O-CG 3.47Å; K38-K42 PolarHBondContact O-N 3.07Å; N39-K42 CarbonylContact O-C 3.52Å; N39-K42 PolarHBondContact O-N 2.83Å; F40-K42 VanDerWaalsContact C-N 3.28Å; F40-K42 PolarHBondContact O-N 3.36Å; K42-R44 HydrophobicContact CB-CG 4.19Å; K42-R44 PolarHBondContact O-N 2.95Å
43K97Very high97.2Very high193 Ų19398.6 Ų98.684%0.83943%0.432SS*.THydrogen-bonded Turntrans51.728.8-180-57.4-176.7179.9-179.10114N39 F40 K41N39-K43 PolarHBondContact O-N 3.32Å; F40-K43 WeakPolarHBondContact O-CA 3.41Å; F40-K43 PolarHBondContact O-N 3.13Å; K41-K43 PolarHBondContact O-N 2.77Å; K41-K43 VanDerWaalsContact O-N 3.16Å
44R97.6Very high97.2Very high140 Ų14093.6 Ų93.653%0.52842%0.416SS..  trans-72.6136.8178.6-69.8-176.3169.6-171-7.8110F8 N39 K42 P46F8-R44 HydrophobicContact CE2-CB 4.41Å; F8-R44 WeakPolarHBondContact CE2-O 3.38Å; F8-R44 HydrophobicContact CZ-CB 4.4Å; N39-R44 HydrophobicContact CB-CB 4.44Å; N39-R44 PolarHBondContact O-N 3.35Å; N39-R44 VanDerWaalsContact OD1-CD 3.27Å; N39-R44 WeakPolarHBondContact OD1-CD 3.45Å; N39-R44 PolarHBondContact OD1-NH1 3.14Å; K42-R44 HydrophobicContact CB-CG 4.19Å; K42-R44 PolarHBondContact O-N 2.95Å; R44-P46 WeakPolarHBondContact O-CD 3.3Å
45N96.8Very high97.3Very high79 Ų7991.2 Ų91.242%0.42240%0.396SS..  trans-78.1120.1177.9-171.5-21.6000110.6R47 K48 T49N45-R47 PolarHBondContact O-N 2.96Å; N45-R47 WeakPolarHBondContact OD1-CB 3.33Å; N45-R47 PolarHBondContact OD1-N 3.37Å; N45-K48 HydrophobicContact CB-CB 4.43Å; N45-K48 HydrophobicContact CB-CG 4.32Å; N45-K48 PolarHBondContact O-N 3.04Å; N45-K48 VanDerWaalsContact O-N 3.09Å; N45-T49 PolarHBondContact O-N 2.9Å; N45-T49 PolarHBondContact O-OG1 3.42Å
46P97.8Very high97.2Very high22 Ų2289 Ų8914%0.14338%0.384CS..G310 helixtrans-56.4-36.1175.7-23.132.5000112.6F8 R44 K48 T49 T52 A54F8-P46 HydrophobicContact CD2-CB 4.47Å; F8-P46 HydrophobicContact CD2-CG 3.73Å; F8-P46 HydrophobicContact CE2-CB 4.44Å; F8-P46 HydrophobicContact CE2-CG 3.83Å; F8-P46 HydrophobicContact CG-CG 4.26Å; F8-P46 HydrophobicContact CZ-CG 4.43Å; R44-P46 WeakPolarHBondContact O-CD 3.3Å; P46-K48 PolarHBondContact O-N 3.06Å; P46-T49 PolarHBondContact O-N 3.29Å; P46-T52 HydrophobicContact CB-CG2 4.48Å; P46-T52 PolarHBondContact O-OG1 3.14Å; P46-A54 HydrophobicContact CB-CB 4.13Å
47R96.5Very high97.1Very high178 Ų17893.7 Ų93.767%0.67240%0.404SS*.G310 helixtrans-66.2-19.5179.6-62.4-172.9-176.8-144.12.5114N45 F55N45-R47 PolarHBondContact O-N 2.96Å; N45-R47 WeakPolarHBondContact OD1-CB 3.33Å; N45-R47 PolarHBondContact OD1-N 3.37Å; R47-F55 WeakPolarHBondContact O-CD2 3.41Å
48K96.9Very high97Very high173 Ų17395.4 Ų95.475%0.75242%0.423SS*.G310 helixtrans-96.9-10.5172.9-63.7-170176-174.70112.4N45 P46 R50N45-K48 HydrophobicContact CB-CB 4.43Å; N45-K48 HydrophobicContact CB-CG 4.32Å; N45-K48 PolarHBondContact O-N 3.04Å; N45-K48 VanDerWaalsContact O-N 3.09Å; P46-K48 PolarHBondContact O-N 3.06Å; K48-R50 PolarHBondContact O-N 3Å
49T97.1Very high96.9Very high25 Ų2591.6 Ų91.615%0.15341%0.414CS..  trans-91105.8-175.6-56.60000111F8 N45 P46 W51 T52 F55F8-T49 HydrophobicContact CE1-CG2 4.05Å; F8-T49 HydrophobicContact CZ-CG2 4.29Å; N45-T49 PolarHBondContact O-N 2.9Å; N45-T49 PolarHBondContact O-OG1 3.42Å; P46-T49 PolarHBondContact O-N 3.29Å; T49-W51 VanDerWaalsContact C-N 3.29Å; T49-W51 HydrophobicContact CG2-CD2 4.35Å; T49-W51 HydrophobicContact CG2-CG 4.27Å; T49-W51 HydrophobicContact CG2-CZ2 4.24Å; T49-W51 PolarHBondContact O-N 3.07Å; T49-T52 HydrophobicContact CG2-CG2 3.92Å; T49-T52 PolarHBondContact O-N 3.04Å; T49-T52 PolarHBondContact O-OG1 2.87Å; T49-F55 WeakPolarHBondContact O-CB 3.41Å
50R96.6Very high96.8Very high198 Ų19892.9 Ų92.975%0.74743%0.43SS*.THydrogen-bonded Turntrans-52.2-33-166.8-69.9-177.9175.2146.9-2.5116.9K48 F55K48-R50 PolarHBondContact O-N 3Å; R50-F55 HydrophobicContact CB-CD1 4.37Å; R50-F55 HydrophobicContact CB-CE1 4.25Å; R50-F55 HydrophobicContact CG-CE1 4.12Å; R50-F55 HydrophobicContact CG-CE2 4.11Å; R50-F55 HydrophobicContact CG-CZ 3.89Å; R50-F55 VanDerWaalsContact O-CD1 3.3Å; R50-F55 WeakPolarHBondContact O-CD1 2.78Å
51W95.8Very high96.6Very high108 Ų10894.5 Ų94.541%0.40944%0.438SS..THydrogen-bonded Turntrans-84.9-11-175.961.4-95.9000114F8 C9 K35 T49F8-W51 AromaticContact CD1-CH2 3.68Å; F8-W51 HydrophobicContact CD1-CH2 3.68Å; F8-W51 AromaticContact CD1-CZ2 3.86Å; F8-W51 HydrophobicContact CD1-CZ2 3.86Å; F8-W51 AromaticContact CE1-CH2 3.88Å; F8-W51 HydrophobicContact CE1-CH2 3.88Å; F8-W51 AromaticContact CE1-CZ2 3.54Å; F8-W51 HydrophobicContact CE1-CZ2 3.54Å; C9-W51 HydrophobicContact CB-CH2 4.13Å; C9-W51 HydrophobicContact CB-CZ3 3.64Å; K35-W51 HydrophobicContact CD-CZ2 4.28Å; K35-W51 HydrophobicContact CG-CZ2 4.41Å; T49-W51 VanDerWaalsContact C-N 3.29Å; T49-W51 HydrophobicContact CG2-CD2 4.35Å; T49-W51 HydrophobicContact CG2-CG 4.27Å; T49-W51 HydrophobicContact CG2-CZ2 4.24Å; T49-W51 PolarHBondContact O-N 3.07Å
52T97.5Very high96.4Very high0 Ų088.5 Ų88.50%041%0.412CS..SBendtrans-78.3153.4-179.269.70000111.5F8 P46 T49 A54 F55 R56F8-T52 HydrophobicContact CD1-CG2 3.81Å; F8-T52 HydrophobicContact CE1-CG2 3.62Å; F8-T52 WeakPolarHBondContact O-CG2 3.45Å; P46-T52 HydrophobicContact CB-CG2 4.48Å; P46-T52 PolarHBondContact O-OG1 3.14Å; T49-T52 HydrophobicContact CG2-CG2 3.92Å; T49-T52 PolarHBondContact O-N 3.04Å; T49-T52 PolarHBondContact O-OG1 2.87Å; T52-A54 VanDerWaalsContact C-N 3.26Å; T52-A54 PolarHBondContact O-N 2.88Å; T52-F55 PolarHBondContact O-N 3.48Å; T52-F55 PolarHBondContact OG1-N 3.02Å; T52-F55 VanDerWaalsContact OG1-N 3.14Å; T52-R56 WeakPolarHBondContact O-CG 3.44Å; T52-R56 PolarHBondContact O-N 3.17Å
53K96.6Very high96.3Very high90 Ų9083.2 Ų83.239%0.39139%0.39SS..Hα-helixtrans-65-32.2171.9-66.6-64.4-169.4173.20112.4R56 K57 E62K53-R56 PolarHBondContact O-N 3.49Å; K53-K57 WeakPolarHBondContact O-CG 3.26Å; K53-K57 PolarHBondContact O-N 3.28Å; K53-E62 WeakPolarHBondContact CD-OE1 3.25Å; K53-E62 WeakPolarHBondContact CD-OE2 3.31Å; K53-E62 IonicContact NZ-OE1 3.27Å; K53-E62 PolarHBondContact NZ-OE1 2.98Å; K53-E62 IonicContact NZ-OE2 3.82Å
54A96.8Very high96.1Very high29 Ų2977.6 Ų77.624%0.2437%0.372CS..Hα-helixtrans-58.5-49.2175.500000112P46 T52 A58P46-A54 HydrophobicContact CB-CB 4.13Å; T52-A54 VanDerWaalsContact C-N 3.26Å; T52-A54 PolarHBondContact O-N 2.88Å; A54-A58 WeakPolarHBondContact O-CB 3.35Å; A54-A58 PolarHBondContact O-N 3.2Å
55F97.8Very high95.8Very high30 Ų3076.9 Ų76.913%0.13238%0.383CS..Hα-helixtrans-60.3-45.9174173.2-86.8000111.5R47 T49 R50 T52 K57 A58 S59 K61R47-F55 WeakPolarHBondContact O-CD2 3.41Å; T49-F55 WeakPolarHBondContact O-CB 3.41Å; R50-F55 HydrophobicContact CB-CD1 4.37Å; R50-F55 HydrophobicContact CB-CE1 4.25Å; R50-F55 HydrophobicContact CG-CE1 4.12Å; R50-F55 HydrophobicContact CG-CE2 4.11Å; R50-F55 HydrophobicContact CG-CZ 3.89Å; R50-F55 VanDerWaalsContact O-CD1 3.3Å; R50-F55 WeakPolarHBondContact O-CD1 2.78Å; T52-F55 PolarHBondContact O-N 3.48Å; T52-F55 PolarHBondContact OG1-N 3.02Å; T52-F55 VanDerWaalsContact OG1-N 3.14Å; F55-K57 PolarHBondContact O-N 3.46Å; F55-A58 PolarHBondContact O-N 3.23Å; F55-S59 WeakPolarHBondContact CE1-OG 3.42Å; F55-S59 WeakPolarHBondContact CE2-OG 3.28Å; F55-S59 VanDerWaalsContact CZ-OG 3.28Å; F55-S59 WeakPolarHBondContact CZ-OG 3.22Å; F55-S59 VanDerWaalsContact O-CB 3.3Å; F55-S59 WeakPolarHBondContact O-CB 3.39Å; F55-S59 PolarHBondContact O-N 2.89Å; F55-S59 PolarHBondContact O-OG 3.22Å; F55-K61 HydrophobicContact CE1-CD 4.18Å
56R96.9Very high95.6Very high71 Ų7174.4 Ų74.427%0.26837%0.37SS..Hα-helixtrans-61.8-43.2-177-69.9174.566.993.93.1112.2T52 K53 G60 K61 E62T52-R56 WeakPolarHBondContact O-CG 3.44Å; T52-R56 PolarHBondContact O-N 3.17Å; K53-R56 PolarHBondContact O-N 3.49Å; R56-G60 PolarHBondContact O-N 3.38Å; R56-K61 HydrophobicContact CB-CB 4.03Å; R56-K61 HydrophobicContact CG-CB 4.35Å; R56-K61 HydrophobicContact CG-CD 4.46Å; R56-K61 WeakPolarHBondContact O-CA 3.49Å; R56-K61 WeakPolarHBondContact O-CB 3.3Å; R56-K61 PolarHBondContact O-N 3.33Å; R56-E62 HydrophobicContact CB-CG 4.12Å; R56-E62 IonicContact CZ-OE1 3.36Å; R56-E62 IonicContact NE-OE1 2.67Å; R56-E62 PolarHBondContact NE-OE1 3.28Å; R56-E62 IonicContact NH2-OE1 2.76Å
57K95Very high95.4Very high102 Ų10278.7 Ų78.744%0.44339%0.391SS..Hα-helixtrans-65.8-46.1175.2-72-174.1176.9-165.80112.1K53 F55 S59 G60 E62 T64K53-K57 WeakPolarHBondContact O-CG 3.26Å; K53-K57 PolarHBondContact O-N 3.28Å; F55-K57 PolarHBondContact O-N 3.46Å; K57-S59 VanDerWaalsContact C-N 3.29Å; K57-S59 PolarHBondContact O-N 3.25Å; K57-G60 PolarHBondContact O-N 2.96Å; K57-E62 HydrophobicContact CG-CB 4.44Å; K57-T64 HydrophobicContact CB-CG2 3.8Å; K57-T64 HydrophobicContact CG-CG2 4.07Å
58A95.9Very high95.2Very high68 Ų6870.9 Ų70.956%0.56236%0.364SS*.Hα-helixtrans-64.8-32.8179.600000113.1A54 F55 G60A54-A58 WeakPolarHBondContact O-CB 3.35Å; A54-A58 PolarHBondContact O-N 3.2Å; F55-A58 PolarHBondContact O-N 3.23Å; A58-G60 VanDerWaalsContact C-N 3.33Å
59S96Very high95Very high58 Ų5864.9 Ų64.941%0.40634%0.34SS..THydrogen-bonded Turntrans-91.614.9-179.5-48.60000113.4F55 K57 K61F55-S59 WeakPolarHBondContact CE1-OG 3.42Å; F55-S59 WeakPolarHBondContact CE2-OG 3.28Å; F55-S59 VanDerWaalsContact CZ-OG 3.28Å; F55-S59 WeakPolarHBondContact CZ-OG 3.22Å; F55-S59 VanDerWaalsContact O-CB 3.3Å; F55-S59 WeakPolarHBondContact O-CB 3.39Å; F55-S59 PolarHBondContact O-N 2.89Å; F55-S59 PolarHBondContact O-OG 3.22Å; K57-S59 VanDerWaalsContact C-N 3.29Å; K57-S59 PolarHBondContact O-N 3.25Å; S59-K61 PolarHBondContact O-N 3.09Å
60G94.4Very high94.8Very high42 Ų4270.2 Ų70.243%0.43336%0.363SS..THydrogen-bonded Turntrans64.622.2179.600000115R56 K57 A58R56-G60 PolarHBondContact O-N 3.38Å; K57-G60 PolarHBondContact O-N 2.96Å; A58-G60 VanDerWaalsContact C-N 3.33Å
61K94.7Very high94.7Very high80 Ų8067.2 Ų67.235%0.34836%0.356SS..SBendtrans-85.4-9.6-179.9-62.9-169.8178.8-166.90113.9F55 R56 S59 R111F55-K61 HydrophobicContact CE1-CD 4.18Å; R56-K61 HydrophobicContact CB-CB 4.03Å; R56-K61 HydrophobicContact CG-CB 4.35Å; R56-K61 HydrophobicContact CG-CD 4.46Å; R56-K61 WeakPolarHBondContact O-CA 3.49Å; R56-K61 WeakPolarHBondContact O-CB 3.3Å; R56-K61 PolarHBondContact O-N 3.33Å; S59-K61 PolarHBondContact O-N 3.09Å; K61-R111 VanDerWaalsContact C-NH1 3.32Å; K61-R111 VanDerWaalsContact CB-NH1 3.34Å; K61-R111 PolarHBondContact O-NH1 3.23Å
62E94Very high94.4Very high25 Ų2568 Ų6812%0.11736%0.364CS..SBendtrans-137.9155.7177.5-68.6-174.5179.300109.6K53 R56 K57 T64K53-E62 WeakPolarHBondContact CD-OE1 3.25Å; K53-E62 WeakPolarHBondContact CD-OE2 3.31Å; K53-E62 IonicContact NZ-OE1 3.27Å; K53-E62 PolarHBondContact NZ-OE1 2.98Å; K53-E62 IonicContact NZ-OE2 3.82Å; R56-E62 HydrophobicContact CB-CG 4.12Å; R56-E62 IonicContact CZ-OE1 3.36Å; R56-E62 IonicContact NE-OE1 2.67Å; R56-E62 PolarHBondContact NE-OE1 3.28Å; R56-E62 IonicContact NH2-OE1 2.76Å; K57-E62 HydrophobicContact CG-CB 4.44Å; E62-T64 PolarHBondContact O-N 3.07Å
63L94.4Very high94.1Very high37 Ų3774.9 Ų74.919%0.19439%0.394CS..  trans-67.2118.7173.3-173.363.7000109.5D66 R103 Q104 F107L63-D66 HydrophobicContact CD2-CB 3.8Å; L63-D66 HydrophobicContact CG-CB 4.12Å; L63-R103 HydrophobicContact CD2-CB 4.13Å; L63-Q104 HydrophobicContact CB-CG 4.49Å; L63-F107 HydrophobicContact CB-CB 4.44Å; L63-F107 HydrophobicContact CB-CG 4.24Å; L63-F107 HydrophobicContact CD1-CD2 4.02Å; L63-F107 HydrophobicContact CD1-CE2 4.44Å
64T92Very high93.9Very high74 Ų7480.1 Ų80.145%0.45441%0.411SS..  trans-100.4-38.2-175.147.90000113.2K57 E62 L69K57-T64 HydrophobicContact CB-CG2 3.8Å; K57-T64 HydrophobicContact CG-CG2 4.07Å; E62-T64 PolarHBondContact O-N 3.07Å; T64-L69 WeakPolarHBondContact O-CD1 3.16Å
65V91.9Very high93.8Very high125 Ų12586.9 Ų86.976%0.75843%0.431SS*.SBendtrans-110.9108.2-177.4-176.20000108.1
66D92.8Very high93.6Very high27 Ų2792.2 Ų92.214%0.14446%0.461CS..  trans-160.6137.9176.9-177.4-91.7000110.7L63 C68 L69 R103L63-D66 HydrophobicContact CD2-CB 3.8Å; L63-D66 HydrophobicContact CG-CB 4.12Å; D66-C68 PolarHBondContact O-N 3.31Å; D66-C68 WeakPolarHBondContact OD1-CA 3.36Å; D66-C68 WeakPolarHBondContact OD1-CB 3.41Å; D66-C68 PolarHBondContact OD1-N 3.3Å; D66-C68 PolarHBondContact OD1-SG 3.46Å; D66-C68 VanDerWaalsContact OD1-SG 3.32Å; D66-L69 HydrophobicContact CB-CD1 4.45Å; D66-L69 HydrophobicContact CB-CG 4.36Å; D66-L69 WeakPolarHBondContact O-CB 3.42Å; D66-L69 PolarHBondContact O-N 2.98Å; D66-R103 IonicContact OD1-NH1 2.94Å; D66-R103 PolarHBondContact OD1-NH1 3.39Å; D66-R103 WeakPolarHBondContact OD2-CD 3.3Å; D66-R103 IonicContact OD2-CZ 3.64Å; D66-R103 IonicContact OD2-NE 3.6Å; D66-R103 IonicContact OD2-NH1 2.65Å; D66-R103 PolarHBondContact OD2-NH1 3.45Å
67N93.8Very high93.5Very high112 Ų11294.7 Ų94.760%0.59948%0.483SS*.G310 helixtrans-61.3-27.4-176.7-590.3000112.6L69 E70N67-L69 PolarHBondContact O-N 2.86Å; N67-E70 PolarHBondContact O-N 3.44Å
68C93.2Very high93.5Very high14 Ų1494.5 Ų94.510%0.09550%0.5CS..G310 helixtrans-65.7-21176.8-58.30000112.4D66 V96 K100D66-C68 PolarHBondContact O-N 3.31Å; D66-C68 WeakPolarHBondContact OD1-CA 3.36Å; D66-C68 WeakPolarHBondContact OD1-CB 3.41Å; D66-C68 PolarHBondContact OD1-N 3.3Å; D66-C68 PolarHBondContact OD1-SG 3.46Å; D66-C68 VanDerWaalsContact OD1-SG 3.32Å; C68-V96 HydrophobicContact CB-CG1 4.11Å; C68-K100 HydrophobicContact CB-CB 4.03Å
69L91.8Very high93.4Very high47 Ų4796.4 Ų96.425%0.24651%0.505CS..G310 helixtrans-77.4-23.2178.1-60178.9000112.8T64 D66 N67 F71 E72 K100T64-L69 WeakPolarHBondContact O-CD1 3.16Å; D66-L69 HydrophobicContact CB-CD1 4.45Å; D66-L69 HydrophobicContact CB-CG 4.36Å; D66-L69 WeakPolarHBondContact O-CB 3.42Å; D66-L69 PolarHBondContact O-N 2.98Å; N67-L69 PolarHBondContact O-N 2.86Å; L69-F71 PolarHBondContact O-N 2.91Å; L69-E72 PolarHBondContact O-N 3.42Å; L69-K100 HydrophobicContact CD2-CD 4.26Å
70E93.2Very high93.5Very high138 Ų138102.5 Ų102.565%0.64552%0.524SS*.THydrogen-bonded Turntrans-68.9-22.2-178.3-60.1-172.9159.500113.1N67 E72N67-E70 PolarHBondContact O-N 3.44Å; E70-E72 PolarHBondContact O-N 2.76Å
71F93.6Very high93.6Very high134 Ų134108 Ų10859%0.58853%0.533SS*.THydrogen-bonded Turntrans-64.6-28.9175.5-70.5-91.1000112.4L69 K73 V96L69-F71 PolarHBondContact O-N 2.91Å; F71-K73 PolarHBondContact O-N 3.18Å; F71-V96 HydrophobicContact CB-CG1 4.46Å; F71-V96 HydrophobicContact CD1-CG2 4.39Å; F71-V96 HydrophobicContact CD2-CG1 4Å; F71-V96 HydrophobicContact CD2-CG2 4.35Å; F71-V96 HydrophobicContact CE1-CG2 4.3Å; F71-V96 HydrophobicContact CE2-CG2 4.26Å; F71-V96 HydrophobicContact CG-CG1 4.23Å; F71-V96 HydrophobicContact CG-CG2 4.42Å; F71-V96 HydrophobicContact CZ-CG2 4.23Å
72E90.2Very high93.8Very high124 Ų124109.8 Ų109.858%0.57954%0.543SS*.SBendtrans-84.751.2179.9-156.9-162.5166.100111.9K5 L69 E70K5-E72 WeakPolarHBondContact CE-OE1 3.34Å; K5-E72 IonicContact NZ-OE1 3.6Å; K5-E72 PolarHBondContact NZ-OE1 3.46Å; K5-E72 IonicContact NZ-OE2 2.77Å; K5-E72 PolarHBondContact NZ-OE2 3.08Å; L69-E72 PolarHBondContact O-N 3.42Å; E70-E72 PolarHBondContact O-N 2.76Å
73K92Very high93.9Very high146 Ų146117.8 Ų117.864%0.63557%0.571SS**PPolyproline II helixtrans-96.1145.7178.769-176.7-178.5-1770113F71 R75F71-K73 PolarHBondContact O-N 3.18Å; K73-R75 HydrophobicContact CG-CG 4.47Å; K73-R75 PolarHBondContact O-N 3.25Å
74R91.8Very high94.1Very high199 Ų199122.7 Ų122.775%0.75159%0.594SS**PPolyproline II helixtrans-74.4118.3169.9-173.4175.6-177.7165.70.9108.6
75R93.4Very high94.3Very high172 Ų172122.7 Ų122.765%0.64959%0.59SS**PPolyproline II helixtrans-92.9122.9174.1-60.9-176.6-172.4138.60.9108.8K73K73-R75 HydrophobicContact CG-CG 4.47Å; K73-R75 PolarHBondContact O-N 3.25Å
76N94.6Very high94.5Very high142 Ų142123.5 Ų123.576%0.75958%0.58SS**  trans-94.3-16.9176.8-64.2-20.7000112.3
77V95.3Very high94.8Very high123 Ų123125.6 Ų125.675%0.74560%0.597SS**SBendtrans-101.1126.3175.4-177.10000108.8
78A94.3Very high95Very high97 Ų97126.7 Ų126.780%0.80260%0.596SS**  trans-78.1144.4175.100000110.5
79V94.8Very high95.1Very high108 Ų108128.1 Ų128.166%0.65561%0.605SS**  trans-108.8141.1174.2-1790000107.7Y81 L85V79-Y81 PolarHBondContact O-N 2.72Å; V79-L85 HydrophobicContact CG1-CD2 4.29Å
80K96.8Very high95.3Very high186 Ų186129.3 Ų129.381%0.80961%0.614SS**  trans-58138.5175.2-170.8174-178.6177.90109.8Q82K80-Q82 PolarHBondContact O-N 3.31Å
81Y97.1Very high95.5Very high158 Ų158127.6 Ų127.662%0.6261%0.606SS**  trans-63.6128179.2174.3-96.5000111.2V79 W86V79-Y81 PolarHBondContact O-N 2.72Å; Y81-W86 AromaticContact CD2-CD1 3.29Å; Y81-W86 HydrophobicContact CD2-CG 4.24Å; Y81-W86 AromaticContact CD2-NE1 3.3Å; Y81-W86 VanDerWaalsContact CD2-NE1 3.3Å; Y81-W86 AromaticContact CE2-CD1 3.38Å; Y81-W86 AromaticContact CE2-CG 3.98Å; Y81-W86 HydrophobicContact CE2-CG 3.98Å; Y81-W86 AromaticContact CE2-NE1 3.82Å
82Q97.9Very high95.7Very high118 Ų118123.4 Ų123.455%0.55160%0.596SS**  trans-136.2123.3171.2-72.5-178.8-35.100109.1K80 E84 L85 W86K80-Q82 PolarHBondContact O-N 3.31Å; Q82-E84 PolarHBondContact O-N 3.39Å; Q82-L85 HydrophobicContact CB-CB 3.96Å; Q82-L85 PolarHBondContact O-N 2.98Å; Q82-W86 VanDerWaalsContact O-CD1 3.25Å; Q82-W86 PolarHBondContact O-N 3.44Å; Q82-W86 VanDerWaalsContact O-N 3.11Å
83R97.6Very high96Very high192 Ų192123.4 Ų123.473%0.72560%0.597SS**Hα-helixtrans-59.1-45.4-173.6-174.3176.6178.9167.2-1.5112.4L85 W86 S87R83-L85 PolarHBondContact O-N 3.29Å; R83-W86 PolarHBondContact O-N 3.45Å; R83-S87 PolarHBondContact O-N 2.88Å; R83-S87 PolarHBondContact O-OG 2.91Å
84E97.7Very high96.2Very high141 Ų141125.7 Ų125.766%0.65960%0.602SS**Hα-helixtrans-61.4-43.5179.6-65-174.2-174.200112.7Q82 W86 S87 K88Q82-E84 PolarHBondContact O-N 3.39Å; E84-W86 VanDerWaalsContact C-N 3.33Å; E84-W86 PolarHBondContact O-N 3.25Å; E84-S87 PolarHBondContact O-N 3.09Å; E84-K88 WeakPolarHBondContact O-CB 3.36Å; E84-K88 WeakPolarHBondContact O-CG 3.45Å; E84-K88 PolarHBondContact O-N 2.83Å
85L97.2Very high96.5Very high74 Ų74122.2 Ų122.239%0.38759%0.592SS.*Hα-helixtrans-59.4-45.5176.517963.6000110.9V79 Q82 R83 T89V79-L85 HydrophobicContact CG1-CD2 4.29Å; Q82-L85 HydrophobicContact CB-CB 3.96Å; Q82-L85 PolarHBondContact O-N 2.98Å; R83-L85 PolarHBondContact O-N 3.29Å; L85-T89 VanDerWaalsContact O-CB 3.3Å; L85-T89 WeakPolarHBondContact O-CB 3.41Å; L85-T89 PolarHBondContact O-N 2.96Å; L85-T89 PolarHBondContact O-OG1 3.04Å
86W96.3Very high96.6Very high141 Ų141115.2 Ų115.253%0.53457%0.569SS.*Hα-helixtrans-65.3-44.1178.8-83100.3000112.4Y81 Q82 R83 E84 T89 V90Y81-W86 AromaticContact CD2-CD1 3.29Å; Y81-W86 HydrophobicContact CD2-CG 4.24Å; Y81-W86 AromaticContact CD2-NE1 3.3Å; Y81-W86 VanDerWaalsContact CD2-NE1 3.3Å; Y81-W86 AromaticContact CE2-CD1 3.38Å; Y81-W86 AromaticContact CE2-CG 3.98Å; Y81-W86 HydrophobicContact CE2-CG 3.98Å; Y81-W86 AromaticContact CE2-NE1 3.82Å; Q82-W86 VanDerWaalsContact O-CD1 3.25Å; Q82-W86 PolarHBondContact O-N 3.44Å; Q82-W86 VanDerWaalsContact O-N 3.11Å; R83-W86 PolarHBondContact O-N 3.45Å; E84-W86 VanDerWaalsContact C-N 3.33Å; E84-W86 PolarHBondContact O-N 3.25Å; W86-T89 WeakPolarHBondContact O-CB 3.44Å; W86-T89 PolarHBondContact O-N 3.3Å; W86-V90 WeakPolarHBondContact O-CG2 3.4Å; W86-V90 PolarHBondContact O-N 3.17Å
87S97.8Very high96.7Very high72 Ų72113.2 Ų113.250%0.50356%0.555SS.*Hα-helixtrans-59-50175.6-64.30000111.9R83 E84 T89 V90 E91R83-S87 PolarHBondContact O-N 2.88Å; R83-S87 PolarHBondContact O-OG 2.91Å; E84-S87 PolarHBondContact O-N 3.09Å; S87-T89 VanDerWaalsContact C-N 3.28Å; S87-T89 PolarHBondContact O-N 3.24Å; S87-V90 PolarHBondContact O-N 2.92Å; S87-E91 PolarHBondContact O-N 2.67Å
88K97.9Very high96.8Very high134 Ų134109 Ų10958%0.58354%0.535SS*.Hα-helixtrans-60.6-38.1176.6-70.7173.4-177.6171.20111.7E84 E91 A92E84-K88 WeakPolarHBondContact O-CB 3.36Å; E84-K88 WeakPolarHBondContact O-CG 3.45Å; E84-K88 PolarHBondContact O-N 2.83Å; K88-E91 PolarHBondContact O-N 3.16Å; K88-A92 WeakPolarHBondContact O-CB 3.27Å; K88-A92 PolarHBondContact O-N 3.34Å
89T96.6Very high96.9Very high44 Ų44107.9 Ų107.927%0.2752%0.516SS..Hα-helixtrans-64.8-44.6178.3-600000111.9L85 W86 S87 E91 A92 M93L85-T89 VanDerWaalsContact O-CB 3.3Å; L85-T89 WeakPolarHBondContact O-CB 3.41Å; L85-T89 PolarHBondContact O-N 2.96Å; L85-T89 PolarHBondContact O-OG1 3.04Å; W86-T89 WeakPolarHBondContact O-CB 3.44Å; W86-T89 PolarHBondContact O-N 3.3Å; S87-T89 VanDerWaalsContact C-N 3.28Å; S87-T89 PolarHBondContact O-N 3.24Å; T89-E91 VanDerWaalsContact C-N 3.34Å; T89-E91 PolarHBondContact O-N 2.9Å; T89-A92 PolarHBondContact O-N 3.02Å; T89-M93 HydrophobicContact CG2-CG 4.45Å; T89-M93 HydrophobicContact CG2-SD 4.28Å; T89-M93 VanDerWaalsContact O-CG 3.27Å; T89-M93 WeakPolarHBondContact O-CG 3.42Å; T89-M93 PolarHBondContact O-N 3.3Å
90V96.4Very high97Very high72 Ų72104.6 Ų104.644%0.43649%0.493SS..Hα-helixtrans-63.8-40.5179.1172.10000111.2W86 S87 M93 R94W86-V90 WeakPolarHBondContact O-CG2 3.4Å; W86-V90 PolarHBondContact O-N 3.17Å; S87-V90 PolarHBondContact O-N 2.92Å; V90-M93 PolarHBondContact O-N 3.44Å; V90-R94 PolarHBondContact O-N 3.44Å
91E97.4Very high97Very high102 Ų102104.8 Ų104.848%0.47749%0.488SS..Hα-helixtrans-64.4-46.6175-165.4-164.7148.200111.7S87 K88 T89 M93 R94 K95S87-E91 PolarHBondContact O-N 2.67Å; K88-E91 PolarHBondContact O-N 3.16Å; T89-E91 VanDerWaalsContact C-N 3.34Å; T89-E91 PolarHBondContact O-N 2.9Å; E91-M93 VanDerWaalsContact C-N 3.31Å; E91-M93 PolarHBondContact O-N 3.14Å; E91-R94 PolarHBondContact O-N 2.93Å; E91-K95 PolarHBondContact O-N 2.81Å; E91-K95 WeakPolarHBondContact OE1-CE 3.36Å; E91-K95 IonicContact OE1-NZ 2.8Å; E91-K95 PolarHBondContact OE1-NZ 2.65Å
92A97.5Very high97Very high46 Ų46105.1 Ų105.138%0.3849%0.493SS..Hα-helixtrans-59.7-40.2177.200000112.1K88 T89 R94 K95 V96K88-A92 WeakPolarHBondContact O-CB 3.27Å; K88-A92 PolarHBondContact O-N 3.34Å; T89-A92 PolarHBondContact O-N 3.02Å; A92-R94 VanDerWaalsContact C-N 3.33Å; A92-R94 PolarHBondContact O-N 3.04Å; A92-K95 PolarHBondContact O-N 3.06Å; A92-V96 VanDerWaalsContact O-CG2 3.3Å; A92-V96 WeakPolarHBondContact O-CG2 3.34Å; A92-V96 PolarHBondContact O-N 2.77Å
93M96.3Very high96.9Very high125 Ų125104.8 Ų104.862%0.61649%0.486SS*.Hα-helixtrans-58.7-41.3177.6-76.5176.866.200112.7T89 V90 E91 V96 E97T89-M93 HydrophobicContact CG2-CG 4.45Å; T89-M93 HydrophobicContact CG2-SD 4.28Å; T89-M93 VanDerWaalsContact O-CG 3.27Å; T89-M93 WeakPolarHBondContact O-CG 3.42Å; T89-M93 PolarHBondContact O-N 3.3Å; V90-M93 PolarHBondContact O-N 3.44Å; E91-M93 VanDerWaalsContact C-N 3.31Å; E91-M93 PolarHBondContact O-N 3.14Å; M93-V96 PolarHBondContact O-N 3.22Å; M93-E97 PolarHBondContact O-N 3.4Å
94R96.9Very high96.8Very high194 Ų19498.5 Ų98.573%0.73247%0.465SS*.Hα-helixtrans-64.2-44.5176.9-66.4177.1-178.8-179.50.2111.3V90 E91 A92 E97 G98V90-R94 PolarHBondContact O-N 3.44Å; E91-R94 PolarHBondContact O-N 2.93Å; A92-R94 VanDerWaalsContact C-N 3.33Å; A92-R94 PolarHBondContact O-N 3.04Å; R94-E97 PolarHBondContact O-N 2.98Å; R94-G98 PolarHBondContact O-N 3.38Å; R94-G98 VanDerWaalsContact O-N 3.09Å
95K96.8Very high96.8Very high126 Ų12694.5 Ų94.555%0.54846%0.456SS..Hα-helixtrans-62-46.4177.5-72.5174.8170.9167.50111.5E91 A92 E97 G98 I99E91-K95 PolarHBondContact O-N 2.81Å; E91-K95 WeakPolarHBondContact OE1-CE 3.36Å; E91-K95 IonicContact OE1-NZ 2.8Å; E91-K95 PolarHBondContact OE1-NZ 2.65Å; A92-K95 PolarHBondContact O-N 3.06Å; K95-E97 PolarHBondContact O-N 2.8Å; K95-G98 PolarHBondContact O-N 3.06Å; K95-I99 WeakPolarHBondContact O-CG1 3.45Å; K95-I99 PolarHBondContact O-N 3.38Å
96V96.7Very high96.7Very high25 Ų2595.8 Ų95.815%0.15246%0.46CS..Hα-helixtrans-61.7-44179.1171.70000111.6C68 F71 A92 M93 G98 I99 K100C68-V96 HydrophobicContact CB-CG1 4.11Å; F71-V96 HydrophobicContact CB-CG1 4.46Å; F71-V96 HydrophobicContact CD1-CG2 4.39Å; F71-V96 HydrophobicContact CD2-CG1 4Å; F71-V96 HydrophobicContact CD2-CG2 4.35Å; F71-V96 HydrophobicContact CE1-CG2 4.3Å; F71-V96 HydrophobicContact CE2-CG2 4.26Å; F71-V96 HydrophobicContact CG-CG1 4.23Å; F71-V96 HydrophobicContact CG-CG2 4.42Å; F71-V96 HydrophobicContact CZ-CG2 4.23Å; A92-V96 VanDerWaalsContact O-CG2 3.3Å; A92-V96 WeakPolarHBondContact O-CG2 3.34Å; A92-V96 PolarHBondContact O-N 2.77Å; M93-V96 PolarHBondContact O-N 3.22Å; V96-G98 VanDerWaalsContact C-N 3.33Å; V96-G98 PolarHBondContact O-N 2.81Å; V96-I99 PolarHBondContact O-N 3.18Å; V96-K100 VanDerWaalsContact O-CB 3.31Å; V96-K100 WeakPolarHBondContact O-CB 3.03Å; V96-K100 PolarHBondContact O-N 3.32Å
97E96.3Very high96.7Very high100 Ų10092.3 Ų92.347%0.46745%0.449SS..Hα-helixtrans-65.8-37178.1-172.260.5-153.700111.7M93 R94 K95 K100 R101M93-E97 PolarHBondContact O-N 3.4Å; R94-E97 PolarHBondContact O-N 2.98Å; K95-E97 PolarHBondContact O-N 2.8Å; E97-K100 PolarHBondContact O-N 3.3Å; E97-K100 IonicContact OE1-NZ 3.69Å; E97-K100 IonicContact OE2-NZ 3.4Å; E97-K100 PolarHBondContact OE2-NZ 3.49Å; E97-R101 WeakPolarHBondContact O-CB 3.42Å; E97-R101 PolarHBondContact O-N 3.49Å
98G97.3Very high96.6Very high33 Ų3391.7 Ų91.734%0.3444%0.439SS..Hα-helixtrans-59.7-47.5172.800000113R94 K95 V96 R101 K102R94-G98 PolarHBondContact O-N 3.38Å; R94-G98 VanDerWaalsContact O-N 3.09Å; K95-G98 PolarHBondContact O-N 3.06Å; V96-G98 VanDerWaalsContact C-N 3.33Å; V96-G98 PolarHBondContact O-N 2.81Å; G98-R101 PolarHBondContact O-N 2.92Å; G98-K102 WeakPolarHBondContact O-CG 3.37Å; G98-K102 PolarHBondContact O-N 2.97Å; G98-K102 VanDerWaalsContact O-N 3.13Å
99I96.8Very high96.5Very high75 Ų7591 Ų9139%0.38544%0.437SS..Hα-helixtrans-63.2-47.7177.6-66.1166.5000110.5K95 V96 R101 K102 R103K95-I99 WeakPolarHBondContact O-CG1 3.45Å; K95-I99 PolarHBondContact O-N 3.38Å; V96-I99 PolarHBondContact O-N 3.18Å; I99-R101 VanDerWaalsContact C-N 3.34Å; I99-R101 PolarHBondContact O-N 3.02Å; I99-K102 PolarHBondContact O-N 2.96Å; I99-R103 HydrophobicContact CG2-CG 4.41Å; I99-R103 WeakPolarHBondContact O-CG 3.28Å; I99-R103 PolarHBondContact O-N 3.22Å
100K96.3Very high96.5Very high39 Ų3993 Ų9317%0.1745%0.445CS..Hα-helixtrans-57.4-45.7178.4177.1-178.6158.9-1540111.8C68 L69 V96 E97 K102 R103 Q104C68-K100 HydrophobicContact CB-CB 4.03Å; L69-K100 HydrophobicContact CD2-CD 4.26Å; V96-K100 VanDerWaalsContact O-CB 3.31Å; V96-K100 WeakPolarHBondContact O-CB 3.03Å; V96-K100 PolarHBondContact O-N 3.32Å; E97-K100 PolarHBondContact O-N 3.3Å; E97-K100 IonicContact OE1-NZ 3.69Å; E97-K100 IonicContact OE2-NZ 3.4Å; E97-K100 PolarHBondContact OE2-NZ 3.49Å; K100-K102 PolarHBondContact O-N 2.93Å; K100-R103 PolarHBondContact O-N 3.02Å; K100-Q104 HydrophobicContact CG-CG 4.5Å; K100-Q104 WeakPolarHBondContact O-CB 3.39Å; K100-Q104 VanDerWaalsContact O-CG 3.28Å; K100-Q104 WeakPolarHBondContact O-CG 3.3Å; K100-Q104 PolarHBondContact O-N 3.27Å
101R96.1Very high96.4Very high190 Ų19093.8 Ų93.872%0.71744%0.441SS*.Hα-helixtrans-61.1-44.5177.6-174.5176.4177.6178.1-1.3111.5E97 G98 I99 Q104 A105E97-R101 WeakPolarHBondContact O-CB 3.42Å; E97-R101 PolarHBondContact O-N 3.49Å; G98-R101 PolarHBondContact O-N 2.92Å; I99-R101 VanDerWaalsContact C-N 3.34Å; I99-R101 PolarHBondContact O-N 3.02Å; R101-Q104 PolarHBondContact O-N 3.36Å; R101-A105 VanDerWaalsContact O-CB 3.32Å; R101-A105 WeakPolarHBondContact O-CB 3.12Å; R101-A105 PolarHBondContact O-N 3.37Å
102K97Very high96.2Very high165 Ų16594 Ų9472%0.71744%0.444SS*.Hα-helixtrans-59.8-49.4176.6-72.4178.5-179.7-175.50111.6G98 I99 K100 Q104 A105 Q106G98-K102 WeakPolarHBondContact O-CG 3.37Å; G98-K102 PolarHBondContact O-N 2.97Å; G98-K102 VanDerWaalsContact O-N 3.13Å; I99-K102 PolarHBondContact O-N 2.96Å; K100-K102 PolarHBondContact O-N 2.93Å; K102-Q104 PolarHBondContact O-N 2.76Å; K102-A105 PolarHBondContact O-N 2.96Å; K102-Q106 PolarHBondContact O-N 3.38Å
103R96.7Very high96.1Very high110 Ų11097.4 Ų97.442%0.41545%0.451SS..Hα-helixtrans-63.4-42.8179.5-68.6-176.4-178.2175.90.5112.6L63 D66 I99 K100 Q106 F107L63-R103 HydrophobicContact CD2-CB 4.13Å; D66-R103 IonicContact OD1-NH1 2.94Å; D66-R103 PolarHBondContact OD1-NH1 3.39Å; D66-R103 WeakPolarHBondContact OD2-CD 3.3Å; D66-R103 IonicContact OD2-CZ 3.64Å; D66-R103 IonicContact OD2-NE 3.6Å; D66-R103 IonicContact OD2-NH1 2.65Å; D66-R103 PolarHBondContact OD2-NH1 3.45Å; I99-R103 HydrophobicContact CG2-CG 4.41Å; I99-R103 WeakPolarHBondContact O-CG 3.28Å; I99-R103 PolarHBondContact O-N 3.22Å; K100-R103 PolarHBondContact O-N 3.02Å; R103-Q106 PolarHBondContact O-N 3.43Å; R103-F107 PolarHBondContact O-N 3.37Å
104Q95.6Very high95.9Very high61 Ų6198.5 Ų98.529%0.28545%0.452SS..Hα-helixtrans-64.1-41.3176.2-73.5-178.8-12.200112.2L63 K100 R101 K102 F107 I108L63-Q104 HydrophobicContact CB-CG 4.49Å; K100-Q104 HydrophobicContact CG-CG 4.5Å; K100-Q104 WeakPolarHBondContact O-CB 3.39Å; K100-Q104 VanDerWaalsContact O-CG 3.28Å; K100-Q104 WeakPolarHBondContact O-CG 3.3Å; K100-Q104 PolarHBondContact O-N 3.27Å; R101-Q104 PolarHBondContact O-N 3.36Å; K102-Q104 PolarHBondContact O-N 2.76Å; Q104-F107 PolarHBondContact O-N 3.13Å; Q104-I108 VanDerWaalsContact O-CG1 3.3Å; Q104-I108 WeakPolarHBondContact O-CG1 3.32Å; Q104-I108 PolarHBondContact O-N 3.33Å
105A96.2Very high95.8Very high56 Ų5691.1 Ų91.146%0.46344%0.437SS..Hα-helixtrans-62.3-45.417600000111.2R101 K102 F107 I108 F109R101-A105 VanDerWaalsContact O-CB 3.32Å; R101-A105 WeakPolarHBondContact O-CB 3.12Å; R101-A105 PolarHBondContact O-N 3.37Å; K102-A105 PolarHBondContact O-N 2.96Å; A105-F107 PolarHBondContact O-N 3.42Å; A105-I108 PolarHBondContact O-N 2.86Å; A105-F109 WeakPolarHBondContact O-CB 3.09Å; A105-F109 PolarHBondContact O-N 2.95Å
106Q96.6Very high95.6Very high102 Ų10292.7 Ų92.748%0.47744%0.443SS..Hα-helixtrans-60-44.1176.5-170.76434.700112.1K102 R103 I108 F109 N110K102-Q106 PolarHBondContact O-N 3.38Å; R103-Q106 PolarHBondContact O-N 3.43Å; Q106-I108 VanDerWaalsContact C-N 3.34Å; Q106-I108 PolarHBondContact O-N 2.86Å; Q106-F109 PolarHBondContact O-N 3.18Å; Q106-N110 PolarHBondContact NE2-OD1 3.43Å; Q106-N110 WeakPolarHBondContact O-CB 3.46Å; Q106-N110 VanDerWaalsContact O-CG 3.28Å; Q106-N110 PolarHBondContact O-N 2.94Å
107F96.4Very high95.5Very high68 Ų6896.6 Ų96.630%0.29846%0.46SS..Hα-helixtrans-59.8-44.7177-178.3-91.5000111.8L63 R103 Q104 A105 R111L63-F107 HydrophobicContact CB-CB 4.44Å; L63-F107 HydrophobicContact CB-CG 4.24Å; L63-F107 HydrophobicContact CD1-CD2 4.02Å; L63-F107 HydrophobicContact CD1-CE2 4.44Å; R103-F107 PolarHBondContact O-N 3.37Å; Q104-F107 PolarHBondContact O-N 3.13Å; A105-F107 PolarHBondContact O-N 3.42Å; F107-R111 PolarHBondContact O-N 2.94Å; F107-R111 VanDerWaalsContact O-N 3.17Å
108I94.9Very high95.4Very high58 Ų5896.4 Ų96.430%0.29746%0.462SS..Hα-helixtrans-65.8-42.9177.7-67.7167.2000110.7Q104 A105 Q106 R111 L112Q104-I108 VanDerWaalsContact O-CG1 3.3Å; Q104-I108 WeakPolarHBondContact O-CG1 3.32Å; Q104-I108 PolarHBondContact O-N 3.33Å; A105-I108 PolarHBondContact O-N 2.86Å; Q106-I108 VanDerWaalsContact C-N 3.34Å; Q106-I108 PolarHBondContact O-N 2.86Å; I108-R111 PolarHBondContact O-N 3.04Å; I108-L112 HydrophobicContact CG2-CD1 3.77Å; I108-L112 HydrophobicContact CG2-CG 4.28Å; I108-L112 WeakPolarHBondContact O-CG 3.07Å; I108-L112 PolarHBondContact O-N 2.83Å
109F96.3Very high95.3Very high121 Ų121101 Ų10153%0.53148%0.475SS..Hα-helixtrans-60.3-51.1178.4177.5-98.6000111.7A105 Q106 R111 L112 K113A105-F109 WeakPolarHBondContact O-CB 3.09Å; A105-F109 PolarHBondContact O-N 2.95Å; Q106-F109 PolarHBondContact O-N 3.18Å; F109-R111 PolarHBondContact O-N 3.37Å; F109-L112 PolarHBondContact O-N 3.13Å; F109-L112 VanDerWaalsContact O-N 3.09Å; F109-K113 PolarHBondContact O-N 2.67Å
110N95.1Very high95.2Very high84 Ų84104.4 Ų104.445%0.44949%0.486SS..Hα-helixtrans-57.9-37.8178-71.2-8.8000111.9Q106Q106-N110 PolarHBondContact NE2-OD1 3.43Å; Q106-N110 WeakPolarHBondContact O-CB 3.46Å; Q106-N110 VanDerWaalsContact O-CG 3.28Å; Q106-N110 PolarHBondContact O-N 2.94Å
111R94.4Very high95.2Very high90 Ų90108.4 Ų108.434%0.3451%0.506SS..Hα-helixtrans-67.3-44.7175.6-171.7-16668.4-154.9-7.1112.3K61 F107 I108 F109K61-R111 VanDerWaalsContact C-NH1 3.32Å; K61-R111 VanDerWaalsContact CB-NH1 3.34Å; K61-R111 PolarHBondContact O-NH1 3.23Å; F107-R111 PolarHBondContact O-N 2.94Å; F107-R111 VanDerWaalsContact O-N 3.17Å; I108-R111 PolarHBondContact O-N 3.04Å; F109-R111 PolarHBondContact O-N 3.37Å
112L94.3Very high95.1Very high106 Ų106105.6 Ų105.656%0.55550%0.501SS*.Hα-helixtrans-72-28.7-178.1-69175.3000112.7I108 F109 K114 G115I108-L112 HydrophobicContact CG2-CD1 3.77Å; I108-L112 HydrophobicContact CG2-CG 4.28Å; I108-L112 WeakPolarHBondContact O-CG 3.07Å; I108-L112 PolarHBondContact O-N 2.83Å; F109-L112 PolarHBondContact O-N 3.13Å; F109-L112 VanDerWaalsContact O-N 3.09Å; L112-K114 PolarHBondContact O-N 2.93Å; L112-K114 VanDerWaalsContact O-N 3.17Å; L112-G115 PolarHBondContact O-N 3.46Å
113K95.3Very high95Very high118 Ų118100 Ų10051%0.51349%0.485SS..Hα-helixtrans-52.9-37.2178.8-173.6178179-1780113F109 G115 K116 Q117F109-K113 PolarHBondContact O-N 2.67Å; K113-G115 PolarHBondContact O-N 2.92Å; K113-K116 PolarHBondContact O-N 3.23Å; K113-Q117 PolarHBondContact O-N 3.31Å
114K92.6Very high94.9Very high147 Ų14798.6 Ų98.664%0.63949%0.485SS*.Hα-helixtrans-62.7-39.2177.7-65.2-172.8177.1-170.80112.8L112 K116 Q117 L118L112-K114 PolarHBondContact O-N 2.93Å; L112-K114 VanDerWaalsContact O-N 3.17Å; K114-K116 VanDerWaalsContact C-N 3.33Å; K114-K116 PolarHBondContact O-N 3.4Å; K114-Q117 PolarHBondContact O-N 3.46Å; K114-L118 PolarHBondContact O-N 3.04Å
115G93.6Very high94.9Very high40 Ų4097.8 Ų97.841%0.41249%0.486SS..Hα-helixtrans-64-39.1179.200000112.4L112 K113 Q117 L118 E119L112-G115 PolarHBondContact O-N 3.46Å; K113-G115 PolarHBondContact O-N 2.92Å; G115-Q117 VanDerWaalsContact C-N 3.27Å; G115-Q117 PolarHBondContact O-N 2.92Å; G115-L118 PolarHBondContact O-N 3.13Å; G115-E119 WeakPolarHBondContact O-CB 3.34Å; G115-E119 PolarHBondContact O-N 3.32Å
116K93.6Very high94.8Very high158 Ų158100.8 Ų100.869%0.68749%0.49SS*.Hα-helixtrans-64.5-29.7178.2-169.1174.7-177.4177.40113.2K113 K114 K120K113-K116 PolarHBondContact O-N 3.23Å; K114-K116 VanDerWaalsContact C-N 3.33Å; K114-K116 PolarHBondContact O-N 3.4Å; K116-K120 PolarHBondContact O-N 2.85Å
117Q93.9Very high94.5Very high107 Ų10799.7 Ų99.750%0.549%0.49SS..Hα-helixtrans-70.7-48176.5-69.3174.5-41.200110.7K113 K114 G115 E119 K120 E121K113-Q117 PolarHBondContact O-N 3.31Å; K114-Q117 PolarHBondContact O-N 3.46Å; G115-Q117 VanDerWaalsContact C-N 3.27Å; G115-Q117 PolarHBondContact O-N 2.92Å; Q117-E119 VanDerWaalsContact C-N 3.35Å; Q117-E119 PolarHBondContact O-N 3.48Å; Q117-K120 WeakPolarHBondContact O-CB 3.43Å; Q117-K120 PolarHBondContact O-N 3.45Å; Q117-E121 WeakPolarHBondContact O-CG 3.32Å; Q117-E121 PolarHBondContact O-N 3.21Å
118L94.9Very high94.2Very high97 Ų97104 Ų10451%0.50851%0.509SS..Hα-helixtrans-60.5-44.2176.5-64.5174.2000111.7K114 G115 K120 E121 E122K114-L118 PolarHBondContact O-N 3.04Å; G115-L118 PolarHBondContact O-N 3.13Å; L118-K120 VanDerWaalsContact C-N 3.27Å; L118-K120 PolarHBondContact O-N 2.97Å; L118-E121 PolarHBondContact O-N 2.91Å; L118-E121 VanDerWaalsContact O-N 3.13Å; L118-E122 WeakPolarHBondContact O-CB 3.33Å; L118-E122 WeakPolarHBondContact O-CG 3.43Å; L118-E122 PolarHBondContact O-N 3.26Å
119E95.1Very high93.9Very high130 Ų130108.2 Ų108.261%0.60753%0.525SS*.Hα-helixtrans-58.2-40176.3-177.2179.4-160.800112G115 Q117 A123G115-E119 WeakPolarHBondContact O-CB 3.34Å; G115-E119 PolarHBondContact O-N 3.32Å; Q117-E119 VanDerWaalsContact C-N 3.35Å; Q117-E119 PolarHBondContact O-N 3.48Å; E119-A123 VanDerWaalsContact O-CB 3.26Å; E119-A123 WeakPolarHBondContact O-CB 3.3Å; E119-A123 PolarHBondContact O-N 3.25Å
120K95.4Very high93.6Very high146 Ų146105.4 Ų105.464%0.63552%0.516SS*.Hα-helixtrans-65.9-42.4176.2-173.9-179178.5-175.60111.7K116 Q117 L118 I124K116-K120 PolarHBondContact O-N 2.85Å; Q117-K120 WeakPolarHBondContact O-CB 3.43Å; Q117-K120 PolarHBondContact O-N 3.45Å; L118-K120 VanDerWaalsContact C-N 3.27Å; L118-K120 PolarHBondContact O-N 2.97Å; K120-I124 HydrophobicContact CG-CD1 4.18Å; K120-I124 WeakPolarHBondContact O-CD1 3.33Å; K120-I124 VanDerWaalsContact O-CG1 3.25Å; K120-I124 WeakPolarHBondContact O-CG1 3.46Å; K120-I124 PolarHBondContact O-N 2.81Å; K120-I124 VanDerWaalsContact O-N 3.07Å
121E95.1Very high93.2Very high123 Ų123105.7 Ų105.758%0.57552%0.516SS*.Hα-helixtrans-66.1-44.1178.2-70.1167-167.200111.5Q117 L118 I124 S125Q117-E121 WeakPolarHBondContact O-CG 3.32Å; Q117-E121 PolarHBondContact O-N 3.21Å; L118-E121 PolarHBondContact O-N 2.91Å; L118-E121 VanDerWaalsContact O-N 3.13Å; E121-I124 PolarHBondContact O-N 2.83Å; E121-S125 PolarHBondContact O-N 3.34Å
122E94.9Very high92.5Very high130 Ų130106 Ų10661%0.60752%0.522SS*.Hα-helixtrans-60.9-46.6175.1-74174.5-179.700111.1L118 I124 S125 E126L118-E122 WeakPolarHBondContact O-CB 3.33Å; L118-E122 WeakPolarHBondContact O-CG 3.43Å; L118-E122 PolarHBondContact O-N 3.26Å; E122-I124 PolarHBondContact O-N 3.32Å; E122-S125 CarbonylContact O-C 3.59Å; E122-S125 WeakPolarHBondContact O-CB 3.48Å; E122-S125 PolarHBondContact O-N 3.33Å; E122-S125 VanDerWaalsContact O-N 3.14Å; E122-E126 WeakPolarHBondContact O-CB 3.46Å; E122-E126 PolarHBondContact O-N 3.27Å
123A94.3Very high92.1Very high47 Ų47107.2 Ų107.239%0.38853%0.528SS..Hα-helixtrans-61-42177.300000112.3E119 S125 E126 V127E119-A123 VanDerWaalsContact O-CB 3.26Å; E119-A123 WeakPolarHBondContact O-CB 3.3Å; E119-A123 PolarHBondContact O-N 3.25Å; A123-S125 VanDerWaalsContact C-N 3.35Å; A123-E126 PolarHBondContact O-N 2.93Å; A123-V127 VanDerWaalsContact O-CG2 3.31Å; A123-V127 WeakPolarHBondContact O-CG2 3.17Å; A123-V127 PolarHBondContact O-N 2.88Å
124I94.6Very high91.4Very high82 Ų82108.1 Ų108.142%0.42154%0.537SS..Hα-helixtrans-63.1-43.1175-67.8163.8000110.4K120 E121 E122 K128K120-I124 HydrophobicContact CG-CD1 4.18Å; K120-I124 WeakPolarHBondContact O-CD1 3.33Å; K120-I124 VanDerWaalsContact O-CG1 3.25Å; K120-I124 WeakPolarHBondContact O-CG1 3.46Å; K120-I124 PolarHBondContact O-N 2.81Å; K120-I124 VanDerWaalsContact O-N 3.07Å; E121-I124 PolarHBondContact O-N 2.83Å; E122-I124 PolarHBondContact O-N 3.32Å; I124-K128 HydrophobicContact CG2-CD 4.16Å; I124-K128 WeakPolarHBondContact O-CB 3.4Å; I124-K128 VanDerWaalsContact O-CG 3.26Å; I124-K128 WeakPolarHBondContact O-CG 3.46Å; I124-K128 PolarHBondContact O-N 2.74Å
125S95.2Very high90.5Very high43 Ų43107.1 Ų107.130%0.30153%0.533SS..Hα-helixtrans-63.1-42.3176.2167.90000111.8E121 E122 A123 K128 K129E121-S125 PolarHBondContact O-N 3.34Å; E122-S125 CarbonylContact O-C 3.59Å; E122-S125 WeakPolarHBondContact O-CB 3.48Å; E122-S125 PolarHBondContact O-N 3.33Å; E122-S125 VanDerWaalsContact O-N 3.14Å; A123-S125 VanDerWaalsContact C-N 3.35Å; S125-K128 PolarHBondContact O-N 3.35Å; S125-K129 VanDerWaalsContact O-CG 3.31Å; S125-K129 WeakPolarHBondContact O-CG 3.39Å; S125-K129 PolarHBondContact O-N 3.34Å; S125-K129 WeakPolarHBondContact OG-CE 3.32Å; S125-K129 PolarHBondContact OG-NZ 3.39Å
126E94.6Very high89.7Confident119 Ų119107.9 Ų107.956%0.55654%0.535SS*.Hα-helixtrans-64.7-48.1-179.6-172.6173.7-168.600111E122 A123 K128 K129 N130E122-E126 WeakPolarHBondContact O-CB 3.46Å; E122-E126 PolarHBondContact O-N 3.27Å; A123-E126 PolarHBondContact O-N 2.93Å; E126-K128 VanDerWaalsContact C-N 3.3Å; E126-K128 PolarHBondContact O-N 3.16Å; E126-K129 PolarHBondContact O-N 2.11Å; E126-N130 VanDerWaalsContact O-CB 3.3Å; E126-N130 WeakPolarHBondContact O-CB 3.31Å; E126-N130 PolarHBondContact O-N 3.49Å
127V90.9Very high88.5Confident79 Ų79104.7 Ų104.748%0.47953%0.53SS..Hα-helixtrans-59.4-41.6175.4173.30000111.1A123 I131A123-V127 VanDerWaalsContact O-CG2 3.31Å; A123-V127 WeakPolarHBondContact O-CG2 3.17Å; A123-V127 PolarHBondContact O-N 2.88Å; V127-I131 HydrophobicContact CG1-CD1 4.42Å; V127-I131 WeakPolarHBondContact O-CA 3.4Å; V127-I131 WeakPolarHBondContact O-CB 3.44Å; V127-I131 PolarHBondContact O-N 3.5Å
128K89Confident87.2Confident159 Ų159106.3 Ų106.369%0.69154%0.537SS*.Hα-helixtrans-63.4-42.9177.5-77.2176.9178.9-175.60112.8I124 S125 E126I124-K128 HydrophobicContact CG2-CD 4.16Å; I124-K128 WeakPolarHBondContact O-CB 3.4Å; I124-K128 VanDerWaalsContact O-CG 3.26Å; I124-K128 WeakPolarHBondContact O-CG 3.46Å; I124-K128 PolarHBondContact O-N 2.74Å; S125-K128 PolarHBondContact O-N 3.35Å; E126-K128 VanDerWaalsContact C-N 3.3Å; E126-K128 PolarHBondContact O-N 3.16Å
129K89.6Confident85.7Confident147 Ų147104.2 Ų104.264%0.63953%0.534SS*.Hα-helixtrans-74.2-41.2-179.3-70.3173.4-176.8177.90111.9S125 E126 H132S125-K129 VanDerWaalsContact O-CG 3.31Å; S125-K129 WeakPolarHBondContact O-CG 3.39Å; S125-K129 PolarHBondContact O-N 3.34Å; S125-K129 WeakPolarHBondContact OG-CE 3.32Å; S125-K129 PolarHBondContact OG-NZ 3.39Å; E126-K129 PolarHBondContact O-N 2.11Å; K129-H132 PolarHBondContact O-ND1 3.21Å
130N89.4Confident84.1Confident61 Ų6199.2 Ų99.233%0.32652%0.517SS..SBendtrans-105.419.8-169.1-61.8-20.5000113.4E126 H132 L133E126-N130 VanDerWaalsContact O-CB 3.3Å; E126-N130 WeakPolarHBondContact O-CB 3.31Å; E126-N130 PolarHBondContact O-N 3.49Å; N130-H132 PolarHBondContact O-N 3.06Å; N130-L133 HydrophobicContact CB-CD1 3.95Å; N130-L133 HydrophobicContact CB-CG 4.36Å; N130-L133 WeakPolarHBondContact O-CB 3.36Å; N130-L133 PolarHBondContact O-N 3.48Å
131I85.8Confident82.6Confident90 Ų9098.2 Ų98.246%0.46251%0.513SS..G310 helixtrans-54.9-30.8179.9-16861000112.8V127 L133 I134 K135V127-I131 HydrophobicContact CG1-CD1 4.42Å; V127-I131 WeakPolarHBondContact O-CA 3.4Å; V127-I131 WeakPolarHBondContact O-CB 3.44Å; V127-I131 PolarHBondContact O-N 3.5Å; I131-L133 PolarHBondContact O-N 3.26Å; I131-I134 PolarHBondContact O-N 2.88Å; I131-I134 VanDerWaalsContact O-N 3.14Å; I131-K135 PolarHBondContact O-N 3.26Å
132H81.5Confident80.9Confident98 Ų9895.4 Ų95.445%0.45451%0.511SS..G310 helixtrans-64.4-22.5179.466.4-85.5000114K129 N130 I134 K135K129-H132 PolarHBondContact O-ND1 3.21Å; N130-H132 PolarHBondContact O-N 3.06Å; H132-I134 VanDerWaalsContact C-N 3.32Å; H132-K135 CarbonylContact C-O 3.57Å; H132-K135 WeakPolarHBondContact CA-O 3.32Å; H132-K135 VanDerWaalsContact O-O 3.1Å
133L84.4Confident79.4Confident130 Ų13096.1 Ų96.168%0.68151%0.512SS*.G310 helixtrans-75.7-22.7176.1-60.8179.4000112.4N130 I131N130-L133 HydrophobicContact CB-CD1 3.95Å; N130-L133 HydrophobicContact CB-CG 4.36Å; N130-L133 WeakPolarHBondContact O-CB 3.36Å; N130-L133 PolarHBondContact O-N 3.48Å; I131-L133 PolarHBondContact O-N 3.26Å
134I80.7Confident78.2Confident137 Ų13797.5 Ų97.570%0.70352%0.515SS*.THydrogen-bonded Turntrans-96.7-40.1-179.7-58173.8000110.3I131 H132I131-I134 PolarHBondContact O-N 2.88Å; I131-I134 VanDerWaalsContact O-N 3.14Å; H132-I134 VanDerWaalsContact C-N 3.32Å
135K74.2Confident76.8Confident127 Ų12798.8 Ų98.855%0.55252%0.523SS*.SBendtrans-125120.9179.9-169164.3-179.81710108.8I131 H132 A139I131-K135 PolarHBondContact O-N 3.26Å; H132-K135 CarbonylContact C-O 3.57Å; H132-K135 WeakPolarHBondContact CA-O 3.32Å; H132-K135 VanDerWaalsContact O-O 3.1Å; K135-A139 WeakPolarHBondContact CE-O 3.25Å; K135-A139 WeakPolarHBondContact CG-O 3.39Å
136A76.7Confident75.3Confident56 Ų56102.6 Ų102.646%0.46354%0.536SS..  trans-55.3138.8176.300000109.5H138 A139A136-H138 PolarHBondContact O-N 3.09Å; A136-A139 HydrophobicContact CB-CB 3.85Å; A136-A139 PolarHBondContact O-N 3.37Å
137P68.8Low74.2Confident90 Ų90103 Ų10358%0.58454%0.538SS*.THydrogen-bonded Turntrans-59.9-15-170.217.9-29.9000115K141P137-K141 WeakPolarHBondContact O-CE 3.49Å
138H65.9Low73.5Confident141 Ų141105.9 Ų105.965%0.65354%0.543SS*.THydrogen-bonded Turntrans-107.7-16.2174.8-60.2-80.1000113.9A136 G140 K141A136-H138 PolarHBondContact O-N 3.09Å; H138-G140 PolarHBondContact O-N 2.84Å; H138-K141 PolarHBondContact O-N 3.18Å
139A64.5Low72.3Confident54 Ų54104.5 Ų104.545%0.44654%0.541SS..THydrogen-bonded Turntrans-72.5100.8-179.600000109.3K135 A136K135-A139 WeakPolarHBondContact CE-O 3.25Å; K135-A139 WeakPolarHBondContact CG-O 3.39Å; A136-A139 HydrophobicContact CB-CB 3.85Å; A136-A139 PolarHBondContact O-N 3.37Å
140G61.5Low71.7Confident24 Ų24101.3 Ų101.325%0.24753%0.534CS..THydrogen-bonded Turntrans123.3-17.2179.400000114.8H138 A142 K143 V144H138-G140 PolarHBondContact O-N 2.84Å; G140-A142 VanDerWaalsContact C-N 3.3Å; G140-A142 PolarHBondContact O-N 2.93Å; G140-K143 PolarHBondContact O-N 3.11Å; G140-V144 VanDerWaalsContact O-CG2 3.31Å; G140-V144 WeakPolarHBondContact O-CG2 3.25Å; G140-V144 PolarHBondContact O-N 2.67Å; G140-V144 VanDerWaalsContact O-N 3.15Å
141K63Low71.1Confident125 Ų125104.2 Ų104.254%0.54355%0.546SS..Hα-helixtrans-64.2-36.1174.1-71.1-175.9179.3177.20112P137 H138 L145P137-K141 WeakPolarHBondContact O-CE 3.49Å; H138-K141 PolarHBondContact O-N 3.18Å; K141-L145 WeakPolarHBondContact O-CB 2.99Å; K141-L145 PolarHBondContact O-N 2.93Å
142A59.3Low70.7Confident64 Ų64106.2 Ų106.253%0.52955%0.551SS.*Hα-helixtrans-63.3-48.7176.300000112.5G140 V144 L145 E146G140-A142 VanDerWaalsContact C-N 3.3Å; G140-A142 PolarHBondContact O-N 2.93Å; A142-V144 PolarHBondContact O-N 2.91Å; A142-L145 WeakPolarHBondContact O-CB 3.33Å; A142-L145 PolarHBondContact O-N 3.3Å; A142-E146 PolarHBondContact O-N 3.23Å
143K64.1Low70.3Confident145 Ų145106.8 Ų106.863%0.6356%0.557SS**Hα-helixtrans-63.8-39177.8-73.3-167.8172-168.70113.3G140 L145 E146 E147G140-K143 PolarHBondContact O-N 3.11Å; K143-L145 VanDerWaalsContact C-N 3.32Å; K143-E146 PolarHBondContact O-N 2.9Å; K143-E147 WeakPolarHBondContact O-CG 3.22Å; K143-E147 PolarHBondContact O-N 3.38Å
144V69Low69.5Low76 Ų76106.2 Ų106.246%0.46155%0.55SS.*Hα-helixtrans-69.5-31.2176.7174.60000111.8G140 A142 K148G140-V144 VanDerWaalsContact O-CG2 3.31Å; G140-V144 WeakPolarHBondContact O-CG2 3.25Å; G140-V144 PolarHBondContact O-N 2.67Å; G140-V144 VanDerWaalsContact O-N 3.15Å; A142-V144 PolarHBondContact O-N 2.91Å; V144-K148 WeakPolarHBondContact O-CB 3.25Å; V144-K148 WeakPolarHBondContact O-CG 3.17Å; V144-K148 PolarHBondContact O-N 3.47Å
145L64.4Low68.9Low110 Ų110105.3 Ų105.358%0.57654%0.543SS*.Hα-helixtrans-70.7-43.4172.6-90.3158000111.6K141 A142 K143 K148 M149K141-L145 WeakPolarHBondContact O-CB 2.99Å; K141-L145 PolarHBondContact O-N 2.93Å; A142-L145 WeakPolarHBondContact O-CB 3.33Å; A142-L145 PolarHBondContact O-N 3.3Å; K143-L145 VanDerWaalsContact C-N 3.32Å; L145-K148 PolarHBondContact O-N 3.32Å; L145-M149 WeakPolarHBondContact O-CG 3.3Å; L145-M149 PolarHBondContact O-N 3.36Å
146E63.3Low68.6Low123 Ų123104 Ų10458%0.57554%0.542SS*.Hα-helixtrans-59.7-49174.1-75.9172.4162.300111.6A142 K143 K148 M149 V150A142-E146 PolarHBondContact O-N 3.23Å; K143-E146 PolarHBondContact O-N 2.9Å; E146-K148 VanDerWaalsContact C-N 3.31Å; E146-K148 PolarHBondContact O-N 2.95Å; E146-M149 PolarHBondContact O-N 3.47Å; E146-M149 VanDerWaalsContact O-N 3.11Å; E146-V150 WeakPolarHBondContact O-CG2 3.41Å; E146-V150 PolarHBondContact O-N 3.18Å
147E71.6Confident68Low128 Ų128105.8 Ų105.860%0.59855%0.547SS*.Hα-helixtrans-59.5-39.6177-75.8170.9178.400112.3K143 V150 Q151K143-E147 WeakPolarHBondContact O-CG 3.22Å; K143-E147 PolarHBondContact O-N 3.38Å; E147-V150 PolarHBondContact O-N 3.29Å; E147-Q151 PolarHBondContact O-N 3.23Å
148K76.4Confident67.4Low138 Ų138108.7 Ų108.760%0.655%0.553SS**Hα-helixtrans-67.8-35.7174.3-81.7-177.2174.3-1720113.4V144 L145 E146 K152V144-K148 WeakPolarHBondContact O-CB 3.25Å; V144-K148 WeakPolarHBondContact O-CG 3.17Å; V144-K148 PolarHBondContact O-N 3.47Å; L145-K148 PolarHBondContact O-N 3.32Å; E146-K148 VanDerWaalsContact C-N 3.31Å; E146-K148 PolarHBondContact O-N 2.95Å; K148-K152 WeakPolarHBondContact O-CB 3.44Å; K148-K152 PolarHBondContact O-N 3.41Å; K148-K152 VanDerWaalsContact O-N 3.08Å
149M65.1Low67Low130 Ų130109.3 Ų109.364%0.6456%0.558SS**Hα-helixtrans-69.2-38.3175.6-74.6179.596.900111.4L145 E146 K152 L153L145-M149 WeakPolarHBondContact O-CG 3.3Å; L145-M149 PolarHBondContact O-N 3.36Å; E146-M149 PolarHBondContact O-N 3.47Å; E146-M149 VanDerWaalsContact O-N 3.11Å; M149-K152 PolarHBondContact O-N 2.67Å; M149-L153 WeakPolarHBondContact O-CB 3.3Å; M149-L153 WeakPolarHBondContact O-CD1 3.27Å; M149-L153 WeakPolarHBondContact O-CG 3.5Å; M149-L153 PolarHBondContact O-N 3.47Å
150V75.9Confident66.5Low81 Ų81109.4 Ų109.449%0.49156%0.564SS.*Hα-helixtrans-66.3-43.4175.7174.40000111.6E146 E147 L153 Q154E146-V150 WeakPolarHBondContact O-CG2 3.41Å; E146-V150 PolarHBondContact O-N 3.18Å; E147-V150 PolarHBondContact O-N 3.29Å; V150-L153 PolarHBondContact O-N 3.09Å; V150-Q154 PolarHBondContact O-N 3.28Å
151Q77.1Confident66Low122 Ų122115.2 Ų115.257%0.5759%0.59SS**Hα-helixtrans-61.1-44.6174.4-85.8-176.1-36.700112.4E147 L153 Q154 E155E147-Q151 PolarHBondContact O-N 3.23Å; Q151-L153 VanDerWaalsContact C-N 3.32Å; Q151-L153 PolarHBondContact O-N 3.48Å; Q151-Q154 PolarHBondContact O-N 3.38Å; Q151-Q154 VanDerWaalsContact O-N 3.14Å; Q151-E155 PolarHBondContact O-N 3.11Å
152K77.2Confident65Low132 Ų132119.6 Ų119.657%0.57462%0.619SS**Hα-helixtrans-63.7-39178.1-163.4176.2-177-176.70112K148 M149 Q154 E155 D156K148-K152 WeakPolarHBondContact O-CB 3.44Å; K148-K152 PolarHBondContact O-N 3.41Å; K148-K152 VanDerWaalsContact O-N 3.08Å; M149-K152 PolarHBondContact O-N 2.67Å; K152-Q154 VanDerWaalsContact C-N 3.32Å; K152-Q154 PolarHBondContact O-N 3.33Å; K152-E155 PolarHBondContact O-N 3.46Å; K152-D156 WeakPolarHBondContact O-CB 3.42Å; K152-D156 PolarHBondContact O-N 3.26Å
153L72.3Confident65.3Low109 Ų109122.4 Ų122.457%0.57162%0.623SS**Hα-helixtrans-63.5-35.1173.2-79.3163.5000112.7M149 V150 Q151 V157M149-L153 WeakPolarHBondContact O-CB 3.3Å; M149-L153 WeakPolarHBondContact O-CD1 3.27Å; M149-L153 WeakPolarHBondContact O-CG 3.5Å; M149-L153 PolarHBondContact O-N 3.47Å; V150-L153 PolarHBondContact O-N 3.09Å; Q151-L153 VanDerWaalsContact C-N 3.32Å; Q151-L153 PolarHBondContact O-N 3.48Å; L153-V157 WeakPolarHBondContact O-CB 3.4Å; L153-V157 WeakPolarHBondContact O-CG2 3.36Å; L153-V157 PolarHBondContact O-N 3.35Å; L153-V157 VanDerWaalsContact O-N 3.13Å
154Q67.8Low65.4Low118 Ų118121.2 Ų121.255%0.55162%0.623SS**Hα-helixtrans-69.2-43.1174.1-85.9171.9-58.400112.1V150 Q151 K152 D156 V157 E158V150-Q154 PolarHBondContact O-N 3.28Å; Q151-Q154 PolarHBondContact O-N 3.38Å; Q151-Q154 VanDerWaalsContact O-N 3.14Å; K152-Q154 VanDerWaalsContact C-N 3.32Å; K152-Q154 PolarHBondContact O-N 3.33Å; Q154-D156 VanDerWaalsContact C-N 3.35Å; Q154-V157 PolarHBondContact O-N 2.99Å; Q154-E158 PolarHBondContact O-N 3.46Å
155E69.8Low65.2Low118 Ų118123.7 Ų123.755%0.55163%0.632SS**Hα-helixtrans-62.5-40.5174.6-70.5173.7173.500111.9Q151 K152 V157 E158 M159Q151-E155 PolarHBondContact O-N 3.11Å; K152-E155 PolarHBondContact O-N 3.46Å; E155-V157 VanDerWaalsContact C-N 3.3Å; E155-V157 PolarHBondContact O-N 3.23Å; E155-E158 PolarHBondContact O-N 2.97Å; E155-M159 VanDerWaalsContact O-CG 3.28Å; E155-M159 WeakPolarHBondContact O-CG 3.32Å; E155-M159 PolarHBondContact O-N 3.39Å
156D66.4Low65.2Low100 Ų100124.5 Ų124.554%0.53564%0.635SS.*Hα-helixtrans-69.4-26.4178.3-69.2-26000112.5K152 Q154K152-D156 WeakPolarHBondContact O-CB 3.42Å; K152-D156 PolarHBondContact O-N 3.26Å; Q154-D156 VanDerWaalsContact C-N 3.35Å
157V64.3Low65.4Low94 Ų94124.6 Ų124.657%0.5764%0.639SS**Hα-helixtrans-79.4-39.9174.7169.40000111.4L153 Q154 E155 M159 G160L153-V157 WeakPolarHBondContact O-CB 3.4Å; L153-V157 WeakPolarHBondContact O-CG2 3.36Å; L153-V157 PolarHBondContact O-N 3.35Å; L153-V157 VanDerWaalsContact O-N 3.13Å; Q154-V157 PolarHBondContact O-N 2.99Å; E155-V157 VanDerWaalsContact C-N 3.3Å; E155-V157 PolarHBondContact O-N 3.23Å; V157-M159 VanDerWaalsContact C-N 3.26Å; V157-M159 PolarHBondContact O-N 2.95Å; V157-G160 PolarHBondContact O-N 3.21Å
158E56.3Low64.9Low150 Ų150124.3 Ų124.370%0.70164%0.642SS**Hα-helixtrans-66-26.2176.5-74.1179.2172.900113Q154 E155Q154-E158 PolarHBondContact O-N 3.46Å; E155-E158 PolarHBondContact O-N 2.97Å
159M57.9Low64.1Low155 Ų155123.4 Ų123.476%0.76465%0.645SS**THydrogen-bonded Turntrans-83.8-3.6176.6-69.3-71.6-58.700114.4E155 V157E155-M159 VanDerWaalsContact O-CG 3.28Å; E155-M159 WeakPolarHBondContact O-CG 3.32Å; E155-M159 PolarHBondContact O-N 3.39Å; V157-M159 VanDerWaalsContact C-N 3.26Å; V157-M159 PolarHBondContact O-N 2.95Å
160G53.3Low64.1Low55 Ų55122.8 Ų122.857%0.56765%0.645SS**THydrogen-bonded Turntrans-103.9-2-178.100000115.2V157V157-G160 PolarHBondContact O-N 3.21Å
161D50.9Low63.1Low147 Ų147126.3 Ų126.379%0.78666%0.658SS**  trans-104.910.1-178.2-81.5-27.2000113.7
162D43.6Very low61.8Low216 Ų216126.7 Ų126.7100%1.15567%0.666SS**  trans-104.90166.7-84.4-26.4000111.3

Retrieved 162 of 162 residues in 655.3 ms (Link to these results)

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