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Large ribosomal subunit protein eL24

AlphaFold DB , UniProt , Accession Q9VJY6, Species DROME (Drosophila melanogaster, Fruit fly), Gene RpL24, Length 155 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
1M82.1Confident94.3Very high215 Ų21574.3 Ų74.3100%1.05939%0.392SS*.  01390-62-179.6-161.400109.7P15M1-P15 HydrophobicContact CB-CG 3.8Å; M1-P15 HydrophobicContact CG-CG 4.32Å; M1-P15 HydrophobicContact SD-CB 4.11Å; M1-P15 HydrophobicContact SD-CG 3.76Å
2K89.9Confident94.5Very high195 Ų19579.2 Ų79.285%0.84841%0.407SS*.PPolyproline II helixtrans-90.1131.8-178.7-174.9174.3-179.2174.30110.7
3I94.6Very high94.7Very high76 Ų7673.8 Ų73.839%0.3938%0.379SS..PPolyproline II helixtrans-86.4125.7174.1-62.8174.5000108.6K12 Y14I3-K12 HydrophobicContact CG2-CB 3.68Å; I3-K12 HydrophobicContact CG2-CD 4.32Å; I3-K12 HydrophobicContact CG2-CG 4Å; I3-Y14 HydrophobicContact CD1-CD1 4.16Å; I3-Y14 HydrophobicContact CD1-CE1 3.62Å; I3-Y14 HydrophobicContact CG1-CD1 4.19Å; I3-Y14 HydrophobicContact CG1-CE1 4.17Å
4G93.3Very high94.7Very high29 Ų2978.1 Ų78.130%0.29939%0.39SS..EExtended strand (participates in β ladder)trans-83.3169.6174.700000112.2K12 I13G4-K12 CarbonylContact O-C 3.54Å; G4-K12 WeakPolarHBondContact O-CA 3.49Å; G4-I13 PolarHBondContact N-O 3.38Å; G4-I13 PolarHBondContact O-N 3.33Å
5L96.5Very high94.8Very high116 Ų11677 Ų7761%0.60739%0.391SS*.EExtended strand (participates in β ladder)trans-119.3139.7169.7-67.2178.9000109.8A7 Y11 K12L5-A7 PolarHBondContact O-N 3.5Å; L5-Y11 WeakPolarHBondContact CA-O 3.46Å; L5-K12 HydrophobicContact CD2-CG 4.09Å
6C96.9Very high94.7Very high5 Ų577.8 Ų77.83%0.03442%0.424CS..  trans-69.9127.8174.4-178.90000110.8F8 S9 G10 Y11 I13 T30 L32 C36C6-F8 PolarHBondContact O-N 3.41Å; C6-F8 PolarHBondContact SG-N 3.04Å; C6-S9 VanDerWaalsContact CB-OG 3.25Å; C6-S9 WeakPolarHBondContact CB-OG 3.44Å; C6-S9 PolarHBondContact SG-OG 3.42Å; C6-S9 VanDerWaalsContact SG-OG 3.35Å; C6-G10 VanDerWaalsContact O-CA 3.31Å; C6-G10 WeakPolarHBondContact O-CA 3.34Å; C6-G10 PolarHBondContact O-N 3.09Å; C6-Y11 PolarHBondContact N-O 3.27Å; C6-I13 HydrophobicContact CB-CD1 3.85Å; C6-I13 HydrophobicContact CB-CG1 4.17Å; C6-T30 CarbonylContact C-O 3.59Å; C6-T30 WeakPolarHBondContact CA-O 3.43Å; C6-L32 HydrophobicContact CB-CB 4Å; C6-L32 PolarHBondContact SG-N 3.42Å; C6-L32 VanDerWaalsContact SG-N 3.43Å; C6-C36 VanDerWaalsContact SG-SG 3.68Å
7A96.7Very high94.7Very high42 Ų4280.6 Ų80.635%0.34743%0.433SS..THydrogen-bonded Turntrans-62.3-27.9178.900000114.1L5 F29 T30 F31L5-A7 PolarHBondContact O-N 3.5Å; A7-F29 HydrophobicContact CB-CB 4.05Å; A7-F29 HydrophobicContact CB-CD1 3.8Å; A7-F29 HydrophobicContact CB-CG 4.43Å; A7-T30 PolarHBondContact N-O 3.46Å; A7-F31 HydrophobicContact CB-CE1 4.11Å
8F97.6Very high94.6Very high2 Ų278.6 Ų78.61%0.00944%0.435CS..THydrogen-bonded Turntrans-92.6-55.8-179.3-171.1-93.3000112.2C6 F31 C36 R44 P46 V49 W51 T52C6-F8 PolarHBondContact O-N 3.41Å; C6-F8 PolarHBondContact SG-N 3.04Å; F8-F31 HydrophobicContact CB-CD1 4.31Å; F8-F31 HydrophobicContact CB-CE1 4.31Å; F8-C36 HydrophobicContact CB-CB 3.95Å; F8-C36 HydrophobicContact CD1-CB 4.44Å; F8-C36 HydrophobicContact CG-CB 4.48Å; F8-R44 HydrophobicContact CE2-CB 4.3Å; F8-R44 WeakPolarHBondContact CE2-O 3.49Å; F8-R44 HydrophobicContact CZ-CB 4.33Å; F8-P46 HydrophobicContact CD2-CG 3.77Å; F8-P46 HydrophobicContact CE2-CG 3.81Å; F8-P46 HydrophobicContact CG-CG 4.33Å; F8-P46 HydrophobicContact CZ-CG 4.39Å; F8-P46 WeakPolarHBondContact O-CB 3.43Å; F8-V49 HydrophobicContact CE1-CG1 4.4Å; F8-V49 HydrophobicContact CE1-CG2 4.5Å; F8-V49 HydrophobicContact CZ-CB 4.49Å; F8-V49 HydrophobicContact CZ-CG2 4Å; F8-W51 HydrophobicContact CD1-CH2 4.11Å; F8-W51 HydrophobicContact CD1-CZ2 4.28Å; F8-W51 HydrophobicContact CE1-CH2 4.23Å; F8-W51 AromaticContact CE1-CZ2 3.93Å; F8-W51 HydrophobicContact CE1-CZ2 3.93Å; F8-T52 HydrophobicContact CD1-CG2 4.2Å; F8-T52 HydrophobicContact CE1-CG2 3.92Å
9S96.8Very high94.6Very high0 Ų081.4 Ų81.40%044%0.442CS..THydrogen-bonded Turntrans-87.8-26.6-171.863.10000114.1C6 Y11 V53C6-S9 VanDerWaalsContact CB-OG 3.25Å; C6-S9 WeakPolarHBondContact CB-OG 3.44Å; C6-S9 PolarHBondContact SG-OG 3.42Å; C6-S9 VanDerWaalsContact SG-OG 3.35Å; S9-Y11 VanDerWaalsContact C-N 3.29Å; S9-Y11 WeakPolarHBondContact OG-CD2 3.45Å; S9-Y11 PolarHBondContact OG-N 3.04Å; S9-V53 WeakPolarHBondContact O-CB 3.28Å; S9-V53 WeakPolarHBondContact O-CG2 3.24Å; S9-V53 PolarHBondContact O-N 2.95Å
10G96.1Very high94.7Very high28 Ų2881.1 Ų81.129%0.28944%0.443SS..  trans795.5-17200000114.6C6C6-G10 VanDerWaalsContact O-CA 3.31Å; C6-G10 WeakPolarHBondContact O-CA 3.34Å; C6-G10 PolarHBondContact O-N 3.09Å
11Y96.5Very high94.7Very high109 Ų10978.9 Ų78.943%0.42743%0.43SS..  trans-73.7155.6175.2-73.8-63.9000112.4L5 C6 S9 W51L5-Y11 WeakPolarHBondContact CA-O 3.46Å; C6-Y11 PolarHBondContact N-O 3.27Å; S9-Y11 VanDerWaalsContact C-N 3.29Å; S9-Y11 WeakPolarHBondContact OG-CD2 3.45Å; S9-Y11 PolarHBondContact OG-N 3.04Å; Y11-W51 HydrophobicContact CD2-CZ3 4.43Å; Y11-W51 HydrophobicContact CE2-CE3 4.01Å; Y11-W51 HydrophobicContact CE2-CZ3 4.15Å; Y11-W51 PolarHBondContact OH-O 3.03Å
12K96.8Very high95.4Very high133 Ų13373.5 Ų73.558%0.57841%0.409SS*.EExtended strand (participates in β ladder)trans-68.4134.2176.1-68.2178.4-175.9177.70110.4I3 G4 L5I3-K12 HydrophobicContact CG2-CB 3.68Å; I3-K12 HydrophobicContact CG2-CD 4.32Å; I3-K12 HydrophobicContact CG2-CG 4Å; G4-K12 CarbonylContact O-C 3.54Å; G4-K12 WeakPolarHBondContact O-CA 3.49Å; L5-K12 HydrophobicContact CD2-CG 4.09Å
13I96.9Very high95.7Very high9 Ų968.5 Ų68.55%0.04639%0.387CS..EExtended strand (participates in β ladder)trans-110.7114.5174.9-57179000107.3G4 C6 H17 T30 L32G4-I13 PolarHBondContact N-O 3.38Å; G4-I13 PolarHBondContact O-N 3.33Å; C6-I13 HydrophobicContact CB-CD1 3.85Å; C6-I13 HydrophobicContact CB-CG1 4.17Å; I13-H17 HydrophobicContact CG2-CB 4.25Å; I13-H17 VanDerWaalsContact CG2-O 3.27Å; I13-H17 WeakPolarHBondContact CG2-O 3.44Å; I13-T30 HydrophobicContact CD1-CG2 3.54Å; I13-L32 HydrophobicContact CD1-CB 4.3Å; I13-L32 HydrophobicContact CG1-CB 4.11Å; I13-L32 HydrophobicContact CG1-CD1 4.02Å
14Y95.7Very high95.8Very high134 Ų13473.7 Ų73.753%0.52541%0.414SS..  trans-78.7156.7175-72.9-84.3000110.9I3 H17I3-Y14 HydrophobicContact CD1-CD1 4.16Å; I3-Y14 HydrophobicContact CD1-CE1 3.62Å; I3-Y14 HydrophobicContact CG1-CD1 4.19Å; I3-Y14 HydrophobicContact CG1-CE1 4.17Å; Y14-H17 WeakPolarHBondContact O-CB 3.45Å; Y14-H17 PolarHBondContact O-N 2.89Å
15P95.2Very high95.9Very high62 Ų6276.7 Ų76.740%0.40342%0.423SS..THydrogen-bonded Turntrans-50.9142.8172.9-25.835.1000111.8M1 H17M1-P15 HydrophobicContact CB-CG 3.8Å; M1-P15 HydrophobicContact CG-CG 4.32Å; M1-P15 HydrophobicContact SD-CB 4.11Å; M1-P15 HydrophobicContact SD-CG 3.76Å; P15-H17 VanDerWaalsContact C-N 3.28Å; P15-H17 PolarHBondContact O-N 3.01Å; P15-H17 PolarHBondContact O-ND1 2.82Å
16G93.2Very high95.9Very high90 Ų9073.8 Ų73.893%0.92842%0.422SS*.THydrogen-bonded Turntrans78.32.6-177.600000115.7
17H94.5Very high95.8Very high125 Ų12579.2 Ų79.258%0.57945%0.445SS*.  trans-116.7151.7-179.5-6472.2000112.6I13 Y14 P15I13-H17 HydrophobicContact CG2-CB 4.25Å; I13-H17 VanDerWaalsContact CG2-O 3.27Å; I13-H17 WeakPolarHBondContact CG2-O 3.44Å; Y14-H17 WeakPolarHBondContact O-CB 3.45Å; Y14-H17 PolarHBondContact O-N 2.89Å; P15-H17 VanDerWaalsContact C-N 3.28Å; P15-H17 PolarHBondContact O-N 3.01Å; P15-H17 PolarHBondContact O-ND1 2.82Å
18G94.3Very high95.7Very high44 Ų4481.2 Ų81.245%0.45446%0.456SS..SBendtrans76.3-164173.300000114.3F31 L32G18-F31 CarbonylContact C-O 3.59Å; G18-F31 WeakPolarHBondContact CA-O 3.49Å; G18-L32 VanDerWaalsContact CA-O 3.31Å; G18-L32 WeakPolarHBondContact CA-O 3.29Å
19K94.8Very high95.7Very high132 Ų13283.2 Ų83.257%0.57447%0.465SS*.EExtended strand (participates in β ladder)trans-146.3145.8179.5-167.4178.3179.4-172.20110.2T30 F31K19-T30 WeakPolarHBondContact O-CA 3.31Å; K19-F31 PolarHBondContact N-O 3.32Å; K19-F31 PolarHBondContact O-N 2.79Å
20T95.8Very high95.6Very high76 Ų7685.3 Ų85.347%0.46648%0.477SS..EExtended strand (participates in β ladder)trans-101.4125.5171.4-600000109.3V22 F29 T30T20-V22 HydrophobicContact CG2-CG2 4.42Å; T20-F29 WeakPolarHBondContact CA-O 3.28Å; T20-T30 PolarHBondContact OG1-OG1 3.02Å
21M95.5Very high95.7Very high34 Ų3484 Ų8417%0.16746%0.464CS..EExtended strand (participates in β ladder)trans-105.1123.8172.5-178.1-167.971.500108.5K23 S28 F29 F31 Y40 L41M21-K23 HydrophobicContact CE-CG 3.99Å; M21-S28 WeakPolarHBondContact O-CA 3.35Å; M21-F29 HydrophobicContact CE-CB 4.23Å; M21-F29 HydrophobicContact CE-CD2 3.86Å; M21-F29 HydrophobicContact CE-CG 4.32Å; M21-F29 PolarHBondContact N-O 3.41Å; M21-F29 PolarHBondContact O-N 2.91Å; M21-F31 HydrophobicContact CB-CD2 4.37Å; M21-F31 HydrophobicContact CB-CE2 3.85Å; M21-F31 HydrophobicContact CE-CE2 3.93Å; M21-F31 HydrophobicContact CE-CZ 4.11Å; M21-F31 HydrophobicContact SD-CE2 4.15Å; M21-Y40 HydrophobicContact CE-CD1 3.8Å; M21-Y40 HydrophobicContact CE-CE1 3.27Å; M21-Y40 HydrophobicContact SD-CE1 4.46Å; M21-L41 HydrophobicContact SD-CD2 3.97Å
22V96.3Very high95.7Very high103 Ų10381.5 Ų81.562%0.62446%0.458SS*.EExtended strand (participates in β ladder)trans-102.4125.2173.7-175.30000107.9T20T20-V22 HydrophobicContact CG2-CG2 4.42Å
23K95.2Very high95.7Very high89 Ų8978.4 Ų78.439%0.38745%0.447SS..  trans-84.5164.8176.5-80.7-165.2161.9177.80111.6M21 D25 G26 K27 F29 Y40M21-K23 HydrophobicContact CE-CG 3.99Å; K23-D25 WeakPolarHBondContact CB-OD1 3.43Å; K23-D25 PolarHBondContact O-N 3.49Å; K23-G26 PolarHBondContact O-N 3.42Å; K23-K27 PolarHBondContact N-O 3.16Å; K23-F29 HydrophobicContact CD-CD2 4.41Å; K23-F29 HydrophobicContact CD-CE2 3.81Å; K23-F29 HydrophobicContact CG-CD2 4.3Å; K23-F29 HydrophobicContact CG-CE2 4.1Å; K23-Y40 WeakPolarHBondContact CE-OH 3.43Å; K23-Y40 PolarHBondContact NZ-OH 3.48Å
24I96.6Very high95.7Very high186 Ų18685.3 Ų85.395%0.95448%0.477SS*.THydrogen-bonded Turntrans-58.4-31.5177-58.5169.8000111.7G26I24-G26 PolarHBondContact O-N 2.85Å
25D96.6Very high95.7Very high91 Ų9184.2 Ų84.249%0.48748%0.475SS..THydrogen-bonded Turntrans-78.49.4176.669-21.7000113.9K23 K27K23-D25 WeakPolarHBondContact CB-OD1 3.43Å; K23-D25 PolarHBondContact O-N 3.49Å; D25-K27 PolarHBondContact O-N 3.38Å; D25-K27 WeakPolarHBondContact OD1-CB 3.47Å; D25-K27 PolarHBondContact OD1-N 3.33Å; D25-K27 VanDerWaalsContact OD2-CD 3.27Å; D25-K27 WeakPolarHBondContact OD2-CD 3.41Å; D25-K27 WeakPolarHBondContact OD2-CE 3.45Å; D25-K27 WeakPolarHBondContact OD2-CG 3.31Å; D25-K27 IonicContact OD2-NZ 2.72Å; D25-K27 PolarHBondContact OD2-NZ 3.08Å
26G95.4Very high95.8Very high56 Ų5681.2 Ų81.258%0.57746%0.456SS*.SBendtrans78.3-3.3-179.300000114.6K23 I24 S28K23-G26 PolarHBondContact O-N 3.42Å; I24-G26 PolarHBondContact O-N 2.85Å; G26-S28 PolarHBondContact O-N 3.18Å
27K95.4Very high96Very high119 Ų11979 Ų7952%0.51742%0.421SS..  trans-73.6127.3178-65.2-171.3-174.5109.30110.8K23 D25 F29K23-K27 PolarHBondContact N-O 3.16Å; D25-K27 PolarHBondContact O-N 3.38Å; D25-K27 WeakPolarHBondContact OD1-CB 3.47Å; D25-K27 PolarHBondContact OD1-N 3.33Å; D25-K27 VanDerWaalsContact OD2-CD 3.27Å; D25-K27 WeakPolarHBondContact OD2-CD 3.41Å; D25-K27 WeakPolarHBondContact OD2-CE 3.45Å; D25-K27 WeakPolarHBondContact OD2-CG 3.31Å; D25-K27 IonicContact OD2-NZ 2.72Å; D25-K27 PolarHBondContact OD2-NZ 3.08Å; K27-F29 HydrophobicContact CB-CD2 4.49Å; K27-F29 HydrophobicContact CB-CE2 3.61Å; K27-F29 HydrophobicContact CB-CZ 4Å; K27-F29 HydrophobicContact CD-CZ 4.27Å
28S95.4Very high96.1Very high83 Ų8381 Ų8158%0.5842%0.423SS*.EExtended strand (participates in β ladder)trans-98.1134.1174.358.40000111.4M21 G26M21-S28 WeakPolarHBondContact O-CA 3.35Å; G26-S28 PolarHBondContact O-N 3.18Å
29F95.7Very high96.3Very high45 Ų4579.3 Ų79.320%0.19741%0.405CS..EExtended strand (participates in β ladder)trans-125.6123.3176.8-61.8-86.9000109A7 T20 M21 K23 K27 F31 Y40A7-F29 HydrophobicContact CB-CB 4.05Å; A7-F29 HydrophobicContact CB-CD1 3.8Å; A7-F29 HydrophobicContact CB-CG 4.43Å; T20-F29 WeakPolarHBondContact CA-O 3.28Å; M21-F29 HydrophobicContact CE-CB 4.23Å; M21-F29 HydrophobicContact CE-CD2 3.86Å; M21-F29 HydrophobicContact CE-CG 4.32Å; M21-F29 PolarHBondContact N-O 3.41Å; M21-F29 PolarHBondContact O-N 2.91Å; K23-F29 HydrophobicContact CD-CD2 4.41Å; K23-F29 HydrophobicContact CD-CE2 3.81Å; K23-F29 HydrophobicContact CG-CD2 4.3Å; K23-F29 HydrophobicContact CG-CE2 4.1Å; K27-F29 HydrophobicContact CB-CD2 4.49Å; K27-F29 HydrophobicContact CB-CE2 3.61Å; K27-F29 HydrophobicContact CB-CZ 4Å; K27-F29 HydrophobicContact CD-CZ 4.27Å; F29-F31 HydrophobicContact CB-CE1 4.35Å; F29-F31 HydrophobicContact CB-CE2 3.98Å; F29-F31 HydrophobicContact CB-CZ 3.69Å; F29-F31 HydrophobicContact CG-CZ 4.5Å; F29-Y40 AromaticContact CD1-CE2 3.94Å; F29-Y40 HydrophobicContact CD1-CE2 3.94Å; F29-Y40 WeakPolarHBondContact CD2-OH 3.39Å; F29-Y40 AromaticContact CE1-CE2 3.98Å; F29-Y40 HydrophobicContact CE1-CE2 3.98Å; F29-Y40 WeakPolarHBondContact CE2-OH 3.45Å; F29-Y40 HydrophobicContact CG-CE2 4.28Å; F29-Y40 HydrophobicContact CZ-CE2 4.4Å; F29-Y40 WeakPolarHBondContact CZ-OH 3.4Å
30T96.6Very high96.4Very high43 Ų4375.2 Ų75.226%0.26439%0.386SS..EExtended strand (participates in β ladder)trans-98.1130.4174.7-46.10000109.8C6 A7 I13 K19 T20C6-T30 CarbonylContact C-O 3.59Å; C6-T30 WeakPolarHBondContact CA-O 3.43Å; A7-T30 PolarHBondContact N-O 3.46Å; I13-T30 HydrophobicContact CD1-CG2 3.54Å; K19-T30 WeakPolarHBondContact O-CA 3.31Å; T20-T30 PolarHBondContact OG1-OG1 3.02Å
31F97.6Very high96.4Very high2 Ų276.4 Ų76.41%0.00939%0.389CS..EExtended strand (participates in β ladder)trans-113.7139.1178.9-59.5-64.9000110.7A7 F8 G18 K19 M21 F29 C36 E37 Y40A7-F31 HydrophobicContact CB-CE1 4.11Å; F8-F31 HydrophobicContact CB-CD1 4.31Å; F8-F31 HydrophobicContact CB-CE1 4.31Å; G18-F31 CarbonylContact C-O 3.59Å; G18-F31 WeakPolarHBondContact CA-O 3.49Å; K19-F31 PolarHBondContact N-O 3.32Å; K19-F31 PolarHBondContact O-N 2.79Å; M21-F31 HydrophobicContact CB-CD2 4.37Å; M21-F31 HydrophobicContact CB-CE2 3.85Å; M21-F31 HydrophobicContact CE-CE2 3.93Å; M21-F31 HydrophobicContact CE-CZ 4.11Å; M21-F31 HydrophobicContact SD-CE2 4.15Å; F29-F31 HydrophobicContact CB-CE1 4.35Å; F29-F31 HydrophobicContact CB-CE2 3.98Å; F29-F31 HydrophobicContact CB-CZ 3.69Å; F29-F31 HydrophobicContact CG-CZ 4.5Å; F31-C36 HydrophobicContact CB-CB 4.21Å; F31-C36 HydrophobicContact CD1-CB 4.1Å; F31-E37 HydrophobicContact CB-CB 4.17Å; F31-E37 HydrophobicContact CD2-CB 3.89Å; F31-E37 HydrophobicContact CD2-CG 4.02Å; F31-E37 HydrophobicContact CE2-CB 4.49Å; F31-E37 HydrophobicContact CE2-CG 4.34Å; F31-E37 HydrophobicContact CG-CB 4Å; F31-Y40 HydrophobicContact CE1-CD1 4.34Å; F31-Y40 AromaticContact CE1-CD2 3.95Å; F31-Y40 HydrophobicContact CE1-CD2 3.95Å; F31-Y40 AromaticContact CE1-CG 3.7Å; F31-Y40 HydrophobicContact CE1-CG 3.7Å; F31-Y40 HydrophobicContact CE2-CD1 4.41Å; F31-Y40 AromaticContact CZ-CD1 3.59Å; F31-Y40 HydrophobicContact CZ-CD1 3.59Å; F31-Y40 AromaticContact CZ-CD2 3.87Å; F31-Y40 HydrophobicContact CZ-CD2 3.87Å; F31-Y40 HydrophobicContact CZ-CE1 4.21Å; F31-Y40 HydrophobicContact CZ-CE2 4.41Å; F31-Y40 AromaticContact CZ-CG 3.41Å; F31-Y40 HydrophobicContact CZ-CG 3.41Å; F31-Y40 VanDerWaalsContact CZ-CG 3.41Å
32L96.8Very high96.4Very high56 Ų5679.6 Ų79.629%0.29341%0.405SS..SBendtrans-69.3-43.4178.4176.466000111.5C6 I13 G18C6-L32 HydrophobicContact CB-CB 4Å; C6-L32 PolarHBondContact SG-N 3.42Å; C6-L32 VanDerWaalsContact SG-N 3.43Å; I13-L32 HydrophobicContact CD1-CB 4.3Å; I13-L32 HydrophobicContact CG1-CB 4.11Å; I13-L32 HydrophobicContact CG1-CD1 4.02Å; G18-L32 VanDerWaalsContact CA-O 3.31Å; G18-L32 WeakPolarHBondContact CA-O 3.29Å
33D95.7Very high96.4Very high67 Ų6784 Ų8436%0.35842%0.416SS..SBendtrans-148172.7-174.1636.9000111.7K35 C36 E37D33-K35 PolarHBondContact O-N 2.91Å; D33-K35 WeakPolarHBondContact OD1-CB 3.35Å; D33-K35 PolarHBondContact OD1-N 3.26Å; D33-C36 PolarHBondContact O-N 3.01Å; D33-C36 VanDerWaalsContact OD1-CB 3.28Å; D33-C36 WeakPolarHBondContact OD1-CB 3.45Å; D33-C36 PolarHBondContact OD1-N 3.36Å; D33-C36 PolarHBondContact OD1-SG 3.4Å; D33-E37 PolarHBondContact O-N 2.87Å
34K96.6Very high96.5Very high154 Ų15486.3 Ų86.367%0.6742%0.422SS*.Hα-helixtrans-60.6-28.2176.3-64.9-179.2-178.9178.40112.3R38K34-R38 WeakPolarHBondContact O-CB 3.48Å; K34-R38 VanDerWaalsContact O-CG 3.29Å; K34-R38 WeakPolarHBondContact O-CG 3.29Å; K34-R38 PolarHBondContact O-N 2.88Å
35K97Very high96.5Very high111 Ų11181.1 Ų81.148%0.48340%0.396SS..Hα-helixtrans-65.6-46178.3179.4-173.8-179.5-175.40111.1D33 S39 W51D33-K35 PolarHBondContact O-N 2.91Å; D33-K35 WeakPolarHBondContact OD1-CB 3.35Å; D33-K35 PolarHBondContact OD1-N 3.26Å; K35-S39 VanDerWaalsContact O-CB 3.3Å; K35-S39 WeakPolarHBondContact O-CB 3.35Å; K35-S39 PolarHBondContact O-N 3.4Å; K35-S39 PolarHBondContact O-OG 2.94Å; K35-W51 HydrophobicContact CD-CH2 4.27Å; K35-W51 HydrophobicContact CD-CZ2 4.02Å; K35-W51 VanDerWaalsContact CE-CZ2 3.45Å; K35-W51 HydrophobicContact CG-CZ2 4.31Å
36C97.4Very high96.6Very high0 Ų078 Ų780%038%0.38CS..Hα-helixtrans-63.9-46.8176.1-69.70000111.3C6 F8 F31 D33 S39 Y40C6-C36 VanDerWaalsContact SG-SG 3.68Å; F8-C36 HydrophobicContact CB-CB 3.95Å; F8-C36 HydrophobicContact CD1-CB 4.44Å; F8-C36 HydrophobicContact CG-CB 4.48Å; F31-C36 HydrophobicContact CB-CB 4.21Å; F31-C36 HydrophobicContact CD1-CB 4.1Å; D33-C36 PolarHBondContact O-N 3.01Å; D33-C36 VanDerWaalsContact OD1-CB 3.28Å; D33-C36 WeakPolarHBondContact OD1-CB 3.45Å; D33-C36 PolarHBondContact OD1-N 3.36Å; D33-C36 PolarHBondContact OD1-SG 3.4Å; C36-S39 PolarHBondContact O-N 3.08Å; C36-Y40 WeakPolarHBondContact O-CB 3.37Å; C36-Y40 PolarHBondContact O-N 3.34Å
37E96.6Very high96.6Very high42 Ų4281.3 Ų81.320%0.19638%0.376CS..Hα-helixtrans-59.3-53.6178.2-178.5-177-158.300111.5F31 D33 S39 Y40 L41F31-E37 HydrophobicContact CB-CB 4.17Å; F31-E37 HydrophobicContact CD2-CB 3.89Å; F31-E37 HydrophobicContact CD2-CG 4.02Å; F31-E37 HydrophobicContact CE2-CB 4.49Å; F31-E37 HydrophobicContact CE2-CG 4.34Å; F31-E37 HydrophobicContact CG-CB 4Å; D33-E37 PolarHBondContact O-N 2.87Å; E37-S39 VanDerWaalsContact C-N 3.31Å; E37-S39 PolarHBondContact O-N 2.99Å; E37-Y40 WeakPolarHBondContact O-CB 3.4Å; E37-Y40 PolarHBondContact O-N 3.37Å; E37-Y40 VanDerWaalsContact O-N 3.14Å; E37-L41 HydrophobicContact CG-CD1 4.08Å; E37-L41 WeakPolarHBondContact O-CG 3.44Å; E37-L41 PolarHBondContact O-N 2.99Å
38R97.2Very high96.7Very high167 Ų16783.7 Ų83.763%0.6339%0.386SS*.Hα-helixtrans-60-40.7178.4-73.6-179.3178.9-173.5-0.7112.1K34 Y40 L41 M42K34-R38 WeakPolarHBondContact O-CB 3.48Å; K34-R38 VanDerWaalsContact O-CG 3.29Å; K34-R38 WeakPolarHBondContact O-CG 3.29Å; K34-R38 PolarHBondContact O-N 2.88Å; R38-Y40 VanDerWaalsContact C-N 3.3Å; R38-Y40 PolarHBondContact O-N 3.23Å; R38-L41 PolarHBondContact O-N 2.94Å; R38-M42 HydrophobicContact CB-CE 4.27Å; R38-M42 WeakPolarHBondContact O-CB 3.4Å; R38-M42 WeakPolarHBondContact O-CE 3.48Å; R38-M42 VanDerWaalsContact O-CG 3.31Å; R38-M42 WeakPolarHBondContact O-CG 3.3Å; R38-M42 PolarHBondContact O-N 2.93Å
39S97.4Very high96.8Very high10 Ų1081 Ų817%0.0737%0.366CS..Hα-helixtrans-64.1-37.6178.2-60.10000112.2K35 C36 E37 R44K35-S39 VanDerWaalsContact O-CB 3.3Å; K35-S39 WeakPolarHBondContact O-CB 3.35Å; K35-S39 PolarHBondContact O-N 3.4Å; K35-S39 PolarHBondContact O-OG 2.94Å; C36-S39 PolarHBondContact O-N 3.08Å; E37-S39 VanDerWaalsContact C-N 3.31Å; E37-S39 PolarHBondContact O-N 2.99Å; S39-R44 WeakPolarHBondContact O-CB 3.41Å; S39-R44 PolarHBondContact O-N 3.14Å
40Y96.7Very high96.8Very high46 Ų4683.2 Ų83.218%0.1838%0.383CS..Hα-helixtrans-66.7-45.4173.5178.1-85.6000112.1M21 K23 F29 F31 C36 E37 R38 M42 K43M21-Y40 HydrophobicContact CE-CD1 3.8Å; M21-Y40 HydrophobicContact CE-CE1 3.27Å; M21-Y40 HydrophobicContact SD-CE1 4.46Å; K23-Y40 WeakPolarHBondContact CE-OH 3.43Å; K23-Y40 PolarHBondContact NZ-OH 3.48Å; F29-Y40 AromaticContact CD1-CE2 3.94Å; F29-Y40 HydrophobicContact CD1-CE2 3.94Å; F29-Y40 WeakPolarHBondContact CD2-OH 3.39Å; F29-Y40 AromaticContact CE1-CE2 3.98Å; F29-Y40 HydrophobicContact CE1-CE2 3.98Å; F29-Y40 WeakPolarHBondContact CE2-OH 3.45Å; F29-Y40 HydrophobicContact CG-CE2 4.28Å; F29-Y40 HydrophobicContact CZ-CE2 4.4Å; F29-Y40 WeakPolarHBondContact CZ-OH 3.4Å; F31-Y40 HydrophobicContact CE1-CD1 4.34Å; F31-Y40 AromaticContact CE1-CD2 3.95Å; F31-Y40 HydrophobicContact CE1-CD2 3.95Å; F31-Y40 AromaticContact CE1-CG 3.7Å; F31-Y40 HydrophobicContact CE1-CG 3.7Å; F31-Y40 HydrophobicContact CE2-CD1 4.41Å; F31-Y40 AromaticContact CZ-CD1 3.59Å; F31-Y40 HydrophobicContact CZ-CD1 3.59Å; F31-Y40 AromaticContact CZ-CD2 3.87Å; F31-Y40 HydrophobicContact CZ-CD2 3.87Å; F31-Y40 HydrophobicContact CZ-CE1 4.21Å; F31-Y40 HydrophobicContact CZ-CE2 4.41Å; F31-Y40 AromaticContact CZ-CG 3.41Å; F31-Y40 HydrophobicContact CZ-CG 3.41Å; F31-Y40 VanDerWaalsContact CZ-CG 3.41Å; C36-Y40 WeakPolarHBondContact O-CB 3.37Å; C36-Y40 PolarHBondContact O-N 3.34Å; E37-Y40 WeakPolarHBondContact O-CB 3.4Å; E37-Y40 PolarHBondContact O-N 3.37Å; E37-Y40 VanDerWaalsContact O-N 3.14Å; R38-Y40 VanDerWaalsContact C-N 3.3Å; R38-Y40 PolarHBondContact O-N 3.23Å; Y40-M42 VanDerWaalsContact C-N 3.32Å; Y40-M42 PolarHBondContact O-N 3.38Å; Y40-K43 WeakPolarHBondContact O-CA 3.29Å; Y40-K43 PolarHBondContact O-N 2.93Å
41L95.9Very high96.7Very high100 Ų10084.4 Ų84.452%0.52438%0.383SS..Hα-helixtrans-65.2-35.3178.5-68.6174.3000112.4M21 E37 R38 K43M21-L41 HydrophobicContact SD-CD2 3.97Å; E37-L41 HydrophobicContact CG-CD1 4.08Å; E37-L41 WeakPolarHBondContact O-CG 3.44Å; E37-L41 PolarHBondContact O-N 2.99Å; R38-L41 PolarHBondContact O-N 2.94Å; L41-K43 PolarHBondContact O-N 3.38Å; L41-K43 VanDerWaalsContact O-N 3.11Å
42M97Very high96.7Very high102 Ų10284.3 Ų84.350%0.50238%0.383SS..THydrogen-bonded Turntrans-70.65.7169-71.8-172.7-74.400113.6R38 Y40 R44R38-M42 HydrophobicContact CB-CE 4.27Å; R38-M42 WeakPolarHBondContact O-CB 3.4Å; R38-M42 WeakPolarHBondContact O-CE 3.48Å; R38-M42 VanDerWaalsContact O-CG 3.31Å; R38-M42 WeakPolarHBondContact O-CG 3.3Å; R38-M42 PolarHBondContact O-N 2.93Å; Y40-M42 VanDerWaalsContact C-N 3.32Å; Y40-M42 PolarHBondContact O-N 3.38Å; M42-R44 HydrophobicContact CB-CG 4.11Å; M42-R44 PolarHBondContact O-N 3.5Å; M42-R44 VanDerWaalsContact O-N 3.1Å
43K96.2Very high96.6Very high195 Ų19584.1 Ų84.185%0.84838%0.384SS*.THydrogen-bonded Turntrans55.229.1179.2-55.7179.4-178.2175.40113.5Y40 L41Y40-K43 WeakPolarHBondContact O-CA 3.29Å; Y40-K43 PolarHBondContact O-N 2.93Å; L41-K43 PolarHBondContact O-N 3.38Å; L41-K43 VanDerWaalsContact O-N 3.11Å
44R97.3Very high96.6Very high137 Ų13783.6 Ų83.652%0.51738%0.381SS..  trans-70.1136.4176.2-63.2-177.5178.8-168.6-2109.3F8 S39 M42 P46F8-R44 HydrophobicContact CE2-CB 4.3Å; F8-R44 WeakPolarHBondContact CE2-O 3.49Å; F8-R44 HydrophobicContact CZ-CB 4.33Å; S39-R44 WeakPolarHBondContact O-CB 3.41Å; S39-R44 PolarHBondContact O-N 3.14Å; M42-R44 HydrophobicContact CB-CG 4.11Å; M42-R44 PolarHBondContact O-N 3.5Å; M42-R44 VanDerWaalsContact O-N 3.1Å; R44-P46 WeakPolarHBondContact O-CD 3.39Å
45N96.8Very high96.6Very high78 Ų7879 Ų7942%0.41736%0.359SS..  trans-81118176.5-172.8-25.4000110.1R47 K48N45-R47 PolarHBondContact O-N 2.95Å; N45-R47 VanDerWaalsContact O-N 3.07Å; N45-R47 WeakPolarHBondContact OD1-CB 3.47Å; N45-R47 PolarHBondContact OD1-N 3.02Å; N45-K48 HydrophobicContact CB-CG 4.42Å; N45-K48 PolarHBondContact O-N 3.31Å
46P97.6Very high96.5Very high24 Ų2478.8 Ų78.816%0.15636%0.356CS..G310 helixtrans-54-31.7178.6-26.734.7000113.5F8 R44 K48 V49 T52 L54F8-P46 HydrophobicContact CD2-CG 3.77Å; F8-P46 HydrophobicContact CE2-CG 3.81Å; F8-P46 HydrophobicContact CG-CG 4.33Å; F8-P46 HydrophobicContact CZ-CG 4.39Å; F8-P46 WeakPolarHBondContact O-CB 3.43Å; R44-P46 WeakPolarHBondContact O-CD 3.39Å; P46-K48 PolarHBondContact O-N 2.86Å; P46-K48 VanDerWaalsContact O-N 3.1Å; P46-V49 PolarHBondContact O-N 3.43Å; P46-T52 HydrophobicContact CB-CG2 4.32Å; P46-T52 PolarHBondContact O-OG1 3.28Å; P46-L54 HydrophobicContact CB-CB 4.35Å; P46-L54 HydrophobicContact CB-CD1 3.88Å; P46-L54 HydrophobicContact CG-CD1 4.37Å
47R96.4Very high96.3Very high127 Ų12787 Ų8748%0.47939%0.387SS..G310 helixtrans-67.1-11.2179.2-59.6176.8-176.6-88.13.3114N45 L54 Y55 K58N45-R47 PolarHBondContact O-N 2.95Å; N45-R47 VanDerWaalsContact O-N 3.07Å; N45-R47 WeakPolarHBondContact OD1-CB 3.47Å; N45-R47 PolarHBondContact OD1-N 3.02Å; R47-L54 HydrophobicContact CG-CB 4.3Å; R47-Y55 WeakPolarHBondContact O-CD2 3.32Å; R47-K58 HydrophobicContact CB-CD 4.3Å
48K97.2Very high96.2Very high168 Ų16891 Ų9173%0.7340%0.403SS*.G310 helixtrans-102.2-7.5172.5-63.4-172.7177.8-174.90112.6N45 P46N45-K48 HydrophobicContact CB-CG 4.42Å; N45-K48 PolarHBondContact O-N 3.31Å; P46-K48 PolarHBondContact O-N 2.86Å; P46-K48 VanDerWaalsContact O-N 3.1Å
49V96.8Very high96.1Very high28 Ų2886.5 Ų86.517%0.1739%0.389CS..  trans-100.4112.2-177.3-179.20000110.2F8 P46 W51 T52 Y55F8-V49 HydrophobicContact CE1-CG1 4.4Å; F8-V49 HydrophobicContact CE1-CG2 4.5Å; F8-V49 HydrophobicContact CZ-CB 4.49Å; F8-V49 HydrophobicContact CZ-CG2 4Å; P46-V49 PolarHBondContact O-N 3.43Å; V49-W51 VanDerWaalsContact C-N 3.33Å; V49-W51 VanDerWaalsContact CG1-CD1 3.5Å; V49-W51 HydrophobicContact CG1-CD2 4.31Å; V49-W51 HydrophobicContact CG1-CG 4.22Å; V49-W51 HydrophobicContact CG1-CZ2 4.22Å; V49-W51 PolarHBondContact O-N 3.47Å; V49-T52 HydrophobicContact CB-CG2 3.88Å; V49-T52 HydrophobicContact CG1-CG2 3.88Å; V49-T52 PolarHBondContact O-N 3.41Å; V49-T52 VanDerWaalsContact O-N 3.11Å; V49-T52 PolarHBondContact O-OG1 2.9Å; V49-Y55 WeakPolarHBondContact O-CB 3.35Å
50T96.2Very high95.7Very high90 Ų9094.9 Ų94.955%0.55242%0.419SS*.THydrogen-bonded Turntrans-55.2-38.1-164.652.90000115.4T52 Y55T50-T52 VanDerWaalsContact C-N 3.33Å; T50-T52 PolarHBondContact O-N 3.18Å; T50-Y55 HydrophobicContact CG2-CE1 4.2Å; T50-Y55 HydrophobicContact CG2-CE2 4.03Å; T50-Y55 WeakPolarHBondContact O-CD1 3.22Å
51W94.7Very high95.4Very high69 Ų6998.6 Ų98.626%0.26144%0.437SS..THydrogen-bonded Turntrans-82.9-5.9-175.160.1-92.8000114.1F8 Y11 K35 V49F8-W51 HydrophobicContact CD1-CH2 4.11Å; F8-W51 HydrophobicContact CD1-CZ2 4.28Å; F8-W51 HydrophobicContact CE1-CH2 4.23Å; F8-W51 AromaticContact CE1-CZ2 3.93Å; F8-W51 HydrophobicContact CE1-CZ2 3.93Å; Y11-W51 HydrophobicContact CD2-CZ3 4.43Å; Y11-W51 HydrophobicContact CE2-CE3 4.01Å; Y11-W51 HydrophobicContact CE2-CZ3 4.15Å; Y11-W51 PolarHBondContact OH-O 3.03Å; K35-W51 HydrophobicContact CD-CH2 4.27Å; K35-W51 HydrophobicContact CD-CZ2 4.02Å; K35-W51 VanDerWaalsContact CE-CZ2 3.45Å; K35-W51 HydrophobicContact CG-CZ2 4.31Å; V49-W51 VanDerWaalsContact C-N 3.33Å; V49-W51 VanDerWaalsContact CG1-CD1 3.5Å; V49-W51 HydrophobicContact CG1-CD2 4.31Å; V49-W51 HydrophobicContact CG1-CG 4.22Å; V49-W51 HydrophobicContact CG1-CZ2 4.22Å; V49-W51 PolarHBondContact O-N 3.47Å
52T96.9Very high94.6Very high0 Ų097 Ų970%045%0.445CS..SBendtrans-80.6150.8-179.769.90000111.9F8 P46 V49 T50 L54 Y55 R56F8-T52 HydrophobicContact CD1-CG2 4.2Å; F8-T52 HydrophobicContact CE1-CG2 3.92Å; P46-T52 HydrophobicContact CB-CG2 4.32Å; P46-T52 PolarHBondContact O-OG1 3.28Å; V49-T52 HydrophobicContact CB-CG2 3.88Å; V49-T52 HydrophobicContact CG1-CG2 3.88Å; V49-T52 PolarHBondContact O-N 3.41Å; V49-T52 VanDerWaalsContact O-N 3.11Å; V49-T52 PolarHBondContact O-OG1 2.9Å; T50-T52 VanDerWaalsContact C-N 3.33Å; T50-T52 PolarHBondContact O-N 3.18Å; T52-L54 PolarHBondContact O-N 3.41Å; T52-Y55 PolarHBondContact O-N 3.26Å; T52-Y55 WeakPolarHBondContact OG1-CB 3.49Å; T52-Y55 PolarHBondContact OG1-N 3.46Å; T52-Y55 VanDerWaalsContact OG1-N 3.16Å; T52-R56 PolarHBondContact O-N 3.24Å; T52-R56 VanDerWaalsContact O-N 3.11Å
53V95.2Very high93.7Very high52 Ų5296.1 Ų96.132%0.31544%0.441SS..Hα-helixtrans-59.5-36.7175.5176.10000111.2S9 R56 R57S9-V53 WeakPolarHBondContact O-CB 3.28Å; S9-V53 WeakPolarHBondContact O-CG2 3.24Å; S9-V53 PolarHBondContact O-N 2.95Å; V53-R56 PolarHBondContact O-N 3.05Å; V53-R57 PolarHBondContact O-N 3.26Å
54L95.5Very high92.3Very high56 Ų5695.5 Ų95.529%0.29344%0.441SS..Hα-helixtrans-66-39.6178.5-72175000112.7P46 R47 T52 K58P46-L54 HydrophobicContact CB-CB 4.35Å; P46-L54 HydrophobicContact CB-CD1 3.88Å; P46-L54 HydrophobicContact CG-CD1 4.37Å; R47-L54 HydrophobicContact CG-CB 4.3Å; T52-L54 PolarHBondContact O-N 3.41Å; L54-K58 WeakPolarHBondContact O-CB 3.11Å; L54-K58 PolarHBondContact O-N 3.44Å
55Y96.8Very high90.8Very high56 Ų5696.3 Ų96.322%0.2245%0.45CS..Hα-helixtrans-63-46.4172.5178.2-82.7000111R47 V49 T50 T52 R57 K58 H59R47-Y55 WeakPolarHBondContact O-CD2 3.32Å; V49-Y55 WeakPolarHBondContact O-CB 3.35Å; T50-Y55 HydrophobicContact CG2-CE1 4.2Å; T50-Y55 HydrophobicContact CG2-CE2 4.03Å; T50-Y55 WeakPolarHBondContact O-CD1 3.22Å; T52-Y55 PolarHBondContact O-N 3.26Å; T52-Y55 WeakPolarHBondContact OG1-CB 3.49Å; T52-Y55 PolarHBondContact OG1-N 3.46Å; T52-Y55 VanDerWaalsContact OG1-N 3.16Å; Y55-R57 VanDerWaalsContact C-N 3.34Å; Y55-R57 PolarHBondContact O-N 3.17Å; Y55-K58 PolarHBondContact O-N 3.45Å; Y55-H59 AromaticContact CD1-ND1 3.6Å; Y55-H59 AromaticContact CD2-CE1 3.37Å; Y55-H59 WeakPolarHBondContact CD2-CE1 3.37Å; Y55-H59 AromaticContact CD2-ND1 3.6Å; Y55-H59 HydrophobicContact CE1-CB 4.48Å; Y55-H59 AromaticContact CE1-CE1 3.98Å; Y55-H59 AromaticContact CE1-ND1 3.51Å; Y55-H59 AromaticContact CE2-CE1 3.11Å; Y55-H59 WeakPolarHBondContact CE2-CE1 3.48Å; Y55-H59 AromaticContact CE2-ND1 3.51Å; Y55-H59 AromaticContact CE2-NE2 3.87Å; Y55-H59 AromaticContact CG-CE1 3.9Å; Y55-H59 AromaticContact CG-ND1 3.63Å; Y55-H59 AromaticContact CZ-CE1 3.43Å; Y55-H59 VanDerWaalsContact CZ-CE1 3.43Å; Y55-H59 AromaticContact CZ-CG 4Å; Y55-H59 AromaticContact CZ-ND1 3.45Å; Y55-H59 AromaticContact CZ-NE2 3.98Å; Y55-H59 PolarHBondContact O-N 3.32Å; Y55-H59 PolarHBondContact O-ND1 2.97Å
56R95.1Very high89.2Confident108 Ų108101.6 Ų101.641%0.40847%0.473SS..Hα-helixtrans-59.9-43.6179.2-66.2-176.579.8-99.82.8111.7T52 V53 H59 R60 K61T52-R56 PolarHBondContact O-N 3.24Å; T52-R56 VanDerWaalsContact O-N 3.11Å; V53-R56 PolarHBondContact O-N 3.05Å; R56-H59 CarbonylContact O-C 3.57Å; R56-H59 PolarHBondContact O-N 3.18Å; R56-R60 PolarHBondContact O-N 3.33Å; R56-K61 HydrophobicContact CB-CB 4.02Å; R56-K61 HydrophobicContact CG-CB 4.26Å; R56-K61 PolarHBondContact NH1-O 3.47Å; R56-K61 VanDerWaalsContact NH1-O 3.11Å; R56-K61 PolarHBondContact NH2-O 2.86Å; R56-K61 PolarHBondContact O-N 3.14Å
57R92.6Very high87.6Confident173 Ų173104.3 Ų104.365%0.65350%0.497SS*.Hα-helixtrans-62.7-43.4176-170.6-179.3-69.9-168.3-2.1112.2V53 Y55 H59 R60 I63V53-R57 PolarHBondContact O-N 3.26Å; Y55-R57 VanDerWaalsContact C-N 3.34Å; Y55-R57 PolarHBondContact O-N 3.17Å; R57-H59 VanDerWaalsContact C-N 3.31Å; R57-H59 PolarHBondContact O-N 2.87Å; R57-R60 PolarHBondContact O-N 3.44Å; R57-I63 HydrophobicContact CG-CD1 4.36Å
58K94.3Very high86.4Confident124 Ų124103.6 Ų103.654%0.53951%0.512SS..Hα-helixtrans-59.6-41.1176.9-179-174.9172.2-164.60111.9R47 L54 Y55 R60R47-K58 HydrophobicContact CB-CD 4.3Å; L54-K58 WeakPolarHBondContact O-CB 3.11Å; L54-K58 PolarHBondContact O-N 3.44Å; Y55-K58 PolarHBondContact O-N 3.45Å; K58-R60 VanDerWaalsContact C-N 3.35Å
59H94.8Very high85.4Confident74 Ų74104.3 Ų104.334%0.34352%0.515SS..THydrogen-bonded Turntrans-96.716.3-177.4-5788.1000113.1Y55 R56 R57 K61Y55-H59 AromaticContact CD1-ND1 3.6Å; Y55-H59 AromaticContact CD2-CE1 3.37Å; Y55-H59 WeakPolarHBondContact CD2-CE1 3.37Å; Y55-H59 AromaticContact CD2-ND1 3.6Å; Y55-H59 HydrophobicContact CE1-CB 4.48Å; Y55-H59 AromaticContact CE1-CE1 3.98Å; Y55-H59 AromaticContact CE1-ND1 3.51Å; Y55-H59 AromaticContact CE2-CE1 3.11Å; Y55-H59 WeakPolarHBondContact CE2-CE1 3.48Å; Y55-H59 AromaticContact CE2-ND1 3.51Å; Y55-H59 AromaticContact CE2-NE2 3.87Å; Y55-H59 AromaticContact CG-CE1 3.9Å; Y55-H59 AromaticContact CG-ND1 3.63Å; Y55-H59 AromaticContact CZ-CE1 3.43Å; Y55-H59 VanDerWaalsContact CZ-CE1 3.43Å; Y55-H59 AromaticContact CZ-CG 4Å; Y55-H59 AromaticContact CZ-ND1 3.45Å; Y55-H59 AromaticContact CZ-NE2 3.98Å; Y55-H59 PolarHBondContact O-N 3.32Å; Y55-H59 PolarHBondContact O-ND1 2.97Å; R56-H59 CarbonylContact O-C 3.57Å; R56-H59 PolarHBondContact O-N 3.18Å; R57-H59 VanDerWaalsContact C-N 3.31Å; R57-H59 PolarHBondContact O-N 2.87Å; H59-K61 HydrophobicContact CB-CG 4.14Å; H59-K61 PolarHBondContact O-N 3.37Å
60R90.1Very high84.2Confident185 Ų185112.1 Ų112.170%0.69855%0.546SS*.THydrogen-bonded Turntrans49.931.9179.7-53.9-176.7-175.7-157.92.4114.3R56 R57 K58 G62 I63R56-R60 PolarHBondContact O-N 3.33Å; R57-R60 PolarHBondContact O-N 3.44Å; K58-R60 VanDerWaalsContact C-N 3.35Å; R60-G62 PolarHBondContact O-N 2.96Å; R60-I63 HydrophobicContact CB-CD1 4.38Å
61K90.4Very high83.2Confident125 Ų125119 Ų11954%0.54356%0.562SS.*THydrogen-bonded Turntrans-78.2118.6178.8-65.5-69.5-174.3178.10109.6R56 H59 I63R56-K61 HydrophobicContact CB-CB 4.02Å; R56-K61 HydrophobicContact CG-CB 4.26Å; R56-K61 PolarHBondContact NH1-O 3.47Å; R56-K61 VanDerWaalsContact NH1-O 3.11Å; R56-K61 PolarHBondContact NH2-O 2.86Å; R56-K61 PolarHBondContact O-N 3.14Å; H59-K61 HydrophobicContact CB-CG 4.14Å; H59-K61 PolarHBondContact O-N 3.37Å; K61-I63 VanDerWaalsContact C-N 3.25Å; K61-I63 PolarHBondContact O-N 3.11Å
62G79.2Confident82.4Confident67 Ų67121.3 Ų121.369%0.69158%0.584SS**THydrogen-bonded Turntrans66.425.1177.400000114.1R60R60-G62 PolarHBondContact O-N 2.96Å
63I76.8Confident81.5Confident83 Ų83132.5 Ų132.543%0.42663%0.626SS.*  trans-85.7112163.1-61.8-179.5000105.1R57 R60 K61 E65R57-I63 HydrophobicContact CG-CD1 4.36Å; R60-I63 HydrophobicContact CB-CD1 4.38Å; K61-I63 VanDerWaalsContact C-N 3.25Å; K61-I63 PolarHBondContact O-N 3.11Å; I63-E65 PolarHBondContact O-N 2.97Å
64E66.8Low80.7Confident182 Ų182141 Ų14185%0.8565%0.653SS**  trans-63.1117.8150.4-73.2178.4-17900104.8E66E64-E66 VanDerWaalsContact C-N 3.33Å; E64-E66 PolarHBondContact O-N 3.46Å
65E65.7Low80.1Confident153 Ų153144.3 Ų144.372%0.71568%0.675SS**  trans-55.5103.8177.8-65.5-170.2151.100107.2I63 A67I63-E65 PolarHBondContact O-N 2.97Å; E65-A67 PolarHBondContact O-N 3.13Å
66E64.1Low79.2Confident190 Ų190148.8 Ų148.889%0.88870%0.698SS**  trans-60.791.5161.4-83.4-169.6166.700104.3E64 S68E64-E66 VanDerWaalsContact C-N 3.33Å; E64-E66 PolarHBondContact O-N 3.46Å; E66-S68 PolarHBondContact O-N 3.14Å
67A64.8Low78.5Confident80 Ų80152 Ų15266%0.66172%0.715SS**  trans-6294.817800000104.9E65 K69E65-A67 PolarHBondContact O-N 3.13Å; A67-K69 VanDerWaalsContact C-N 3.29Å; A67-K69 PolarHBondContact O-N 2.75Å
68S71.4Confident77.7Confident113 Ų113152 Ų15279%0.7972%0.72SS**  trans-54.5105.4169.8-175.30000104.9E66 K70E66-S68 PolarHBondContact O-N 3.14Å; S68-K70 PolarHBondContact O-N 3.4Å
69K74.5Confident76.8Confident183 Ų183152.6 Ų152.680%0.79673%0.725SS**  trans-57.2113.4-171.8-72.3-176.8178.7-179.20106.4A67 R71A67-K69 VanDerWaalsContact C-N 3.29Å; A67-K69 PolarHBondContact O-N 2.75Å; K69-R71 VanDerWaalsContact C-N 3.33Å; K69-R71 PolarHBondContact O-N 2.86Å
70K73.1Confident75.9Confident191 Ų191159.9 Ų159.983%0.8375%0.749SS**  trans-60.897.5175.3-73.1-174.9179.2177.50107.9S68 T72S68-K70 PolarHBondContact O-N 3.4Å; K70-T72 VanDerWaalsContact C-N 3.29Å; K70-T72 HydrophobicContact CB-CG2 4.1Å; K70-T72 PolarHBondContact O-N 3.42Å
71R74.5Confident75.3Confident236 Ų236154 Ų15489%0.89174%0.74SS**  trans-78.483.2171.3-72-166.7-179.8-155.92.4108.4K69K69-R71 VanDerWaalsContact C-N 3.33Å; K69-R71 PolarHBondContact O-N 2.86Å
72T77.9Confident74.9Confident116 Ų116153.8 Ų153.871%0.71274%0.743SS**  trans-84.4-24.7-179.754.50000113.1K70 R74K70-T72 VanDerWaalsContact C-N 3.29Å; K70-T72 HydrophobicContact CB-CG2 4.1Å; K70-T72 PolarHBondContact O-N 3.42Å; T72-R74 PolarHBondContact O-N 3.38Å
73R77.4Confident74.9Confident236 Ų236157.9 Ų157.989%0.89176%0.755SS**  trans-85.3113.2-177.6-64.3-173.3-179.4-1790.6110.8
74R78.6Confident75Confident230 Ų230157.9 Ų157.987%0.86878%0.775SS**  trans-109.7119.2164.9-65.7-176.1-178.2-166.90.7108.3T72 Q76T72-R74 PolarHBondContact O-N 3.38Å; R74-Q76 PolarHBondContact O-N 3.05Å
75T82.6Confident75.6Confident126 Ų126150.6 Ų150.677%0.77375%0.746SS**  trans-74.1122.6173.9-53.80000109.2
76Q79.3Confident76.4Confident149 Ų149145.6 Ų145.670%0.69673%0.728SS**  trans-85.7127.8169.5-68.5-176.9-1300109.4R74 F78R74-Q76 PolarHBondContact O-N 3.05Å; Q76-F78 HydrophobicContact CB-CE2 3.92Å; Q76-F78 HydrophobicContact CB-CZ 4.01Å
77K80.6Confident77.1Confident175 Ų175140.2 Ų140.276%0.76171%0.705SS**  trans-108.1121.3178-71.7-174.6-178.4-1780108.8
78F74.8Confident77.9Confident174 Ų174139.7 Ų139.776%0.76370%0.701SS**  trans-108.653.3-179.8-59.5-78.5000111.4Q76Q76-F78 HydrophobicContact CB-CE2 3.92Å; Q76-F78 HydrophobicContact CB-CZ 4.01Å
79Q74.4Confident78.5Confident136 Ų136138.7 Ų138.764%0.63668%0.684SS**  trans-103.326.3-177.6-81.780.58.600113.6L87Q79-L87 HydrophobicContact CB-CD1 4.37Å; Q79-L87 WeakPolarHBondContact O-CD1 3.36Å
80R76.7Confident78.9Confident228 Ų228133.1 Ų133.186%0.8666%0.662SS**  trans-88.7133.5178-61.9-175.276.8167.62.8110.2
81A78.4Confident79.5Confident60 Ų60127.1 Ų127.150%0.49664%0.639SS.*  trans-66.4156.4165.100000110.1L87A81-L87 HydrophobicContact CB-CB 4.43Å
82I81.1Confident79.9Confident121 Ų121118.9 Ų118.962%0.62162%0.621SS**BIsolated β-bridgetrans-107.3144.2177.5-57.7173.9000107.1G84 A85I82-G84 PolarHBondContact O-N 3.11Å; I82-G84 VanDerWaalsContact O-N 3.13Å; I82-A85 PolarHBondContact N-O 3.34Å; I82-A85 CarbonylContact O-C 3.47Å; I82-A85 PolarHBondContact O-N 3.22Å
83V78.5Confident80.2Confident154 Ų154120.9 Ų120.993%0.93362%0.62SS**THydrogen-bonded Turntrans-56.2122.6173.6179.30000108.5
84G79.6Confident80.5Confident82 Ų82117.5 Ų117.585%0.84561%0.607SS**THydrogen-bonded Turntrans93.8-0.3-176.100000116.1I82I82-G84 PolarHBondContact O-N 3.11Å; I82-G84 VanDerWaalsContact O-N 3.13Å
85A79.2Confident80.9Confident29 Ų29111.7 Ų111.724%0.2459%0.593CS.*BIsolated β-bridgetrans-149.2123.616800000112.2I82 E89 I90I82-A85 PolarHBondContact N-O 3.34Å; I82-A85 CarbonylContact O-C 3.47Å; I82-A85 PolarHBondContact O-N 3.22Å; A85-E89 WeakPolarHBondContact CA-OE2 3.18Å; A85-I90 HydrophobicContact CB-CD1 4.3Å; A85-I90 HydrophobicContact CB-CG1 4.08Å
86S82.4Confident81.1Confident49 Ų49108.5 Ų108.534%0.34357%0.57SS.*  trans-69.9154.6175.771.80000111.5A88 E89 I90S86-A88 PolarHBondContact O-N 3.02Å; S86-E89 WeakPolarHBondContact CB-OE1 3.33Å; S86-E89 PolarHBondContact N-OE2 2.8Å; S86-E89 VanDerWaalsContact N-OE2 3.14Å; S86-E89 PolarHBondContact O-N 3.42Å; S86-E89 VanDerWaalsContact O-N 3.11Å; S86-E89 VanDerWaalsContact OG-CG 3.28Å; S86-E89 WeakPolarHBondContact OG-CG 3.33Å; S86-E89 PolarHBondContact OG-N 3.45Å; S86-E89 PolarHBondContact OG-OE1 2.91Å; S86-I90 WeakPolarHBondContact O-CG1 3.35Å; S86-I90 PolarHBondContact O-N 3.42Å; S86-I90 VanDerWaalsContact O-N 3.11Å
87L79.2Confident81.4Confident76 Ų76108.6 Ų108.640%0.39857%0.568SS.*Hα-helixtrans-58.4-34177.9-175.7124.4000111.8Q79 A81 I90 L91Q79-L87 HydrophobicContact CB-CD1 4.37Å; Q79-L87 WeakPolarHBondContact O-CD1 3.36Å; A81-L87 HydrophobicContact CB-CB 4.43Å; L87-I90 PolarHBondContact O-N 2.69Å; L87-L91 HydrophobicContact CD2-CD1 3.67Å; L87-L91 HydrophobicContact CG-CD1 4.26Å; L87-L91 WeakPolarHBondContact O-CB 3.43Å; L87-L91 WeakPolarHBondContact O-CG 3.31Å; L87-L91 PolarHBondContact O-N 2.81Å
88A82.2Confident81.7Confident69 Ų69105 Ų10557%0.5756%0.563SS**Hα-helixtrans-64.3-43.8175.700000112.1S86 L91 A92S86-A88 PolarHBondContact O-N 3.02Å; A88-L91 PolarHBondContact O-N 3.04Å; A88-A92 VanDerWaalsContact O-CB 3.32Å; A88-A92 WeakPolarHBondContact O-CB 3.43Å; A88-A92 PolarHBondContact O-N 3.32Å
89E83.7Confident82.3Confident93 Ų93103.8 Ų103.844%0.43556%0.56SS.*Hα-helixtrans-64.2-40.8176.6-73153.4-139.300112.5A85 S86 A92 K93A85-E89 WeakPolarHBondContact CA-OE2 3.18Å; S86-E89 WeakPolarHBondContact CB-OE1 3.33Å; S86-E89 PolarHBondContact N-OE2 2.8Å; S86-E89 VanDerWaalsContact N-OE2 3.14Å; S86-E89 PolarHBondContact O-N 3.42Å; S86-E89 VanDerWaalsContact O-N 3.11Å; S86-E89 VanDerWaalsContact OG-CG 3.28Å; S86-E89 WeakPolarHBondContact OG-CG 3.33Å; S86-E89 PolarHBondContact OG-N 3.45Å; S86-E89 PolarHBondContact OG-OE1 2.91Å; E89-A92 PolarHBondContact O-N 3.03Å; E89-K93 WeakPolarHBondContact O-CB 3.45Å; E89-K93 WeakPolarHBondContact O-CG 3.04Å; E89-K93 PolarHBondContact O-N 3.41Å
90I83.6Confident83Confident65 Ų65100.2 Ų100.233%0.33355%0.547SS..Hα-helixtrans-63.1-45.5177.4-64.4170.8000110A85 S86 L87 R94A85-I90 HydrophobicContact CB-CD1 4.3Å; A85-I90 HydrophobicContact CB-CG1 4.08Å; S86-I90 WeakPolarHBondContact O-CG1 3.35Å; S86-I90 PolarHBondContact O-N 3.42Å; S86-I90 VanDerWaalsContact O-N 3.11Å; L87-I90 PolarHBondContact O-N 2.69Å; I90-R94 VanDerWaalsContact O-CB 3.3Å; I90-R94 WeakPolarHBondContact O-CB 3.38Å; I90-R94 PolarHBondContact O-N 3.29Å
91L84.8Confident83.5Confident66 Ų6695 Ų9535%0.34653%0.527SS..Hα-helixtrans-65.5-42.4177.5-73.8171.7000112L87 A88 R94 N95L87-L91 HydrophobicContact CD2-CD1 3.67Å; L87-L91 HydrophobicContact CG-CD1 4.26Å; L87-L91 WeakPolarHBondContact O-CB 3.43Å; L87-L91 WeakPolarHBondContact O-CG 3.31Å; L87-L91 PolarHBondContact O-N 2.81Å; A88-L91 PolarHBondContact O-N 3.04Å; L91-R94 PolarHBondContact O-N 3.01Å; L91-N95 VanDerWaalsContact O-CB 3.24Å; L91-N95 WeakPolarHBondContact O-CB 3.41Å; L91-N95 VanDerWaalsContact O-CG 3.23Å; L91-N95 PolarHBondContact O-N 3.39Å; L91-N95 PolarHBondContact O-ND2 2.83Å
92A83.4Confident84.1Confident63 Ų6398.4 Ų98.452%0.52153%0.531SS..Hα-helixtrans-59.8-50177.100000111.2A88 E89 R94 N95 M96A88-A92 VanDerWaalsContact O-CB 3.32Å; A88-A92 WeakPolarHBondContact O-CB 3.43Å; A88-A92 PolarHBondContact O-N 3.32Å; E89-A92 PolarHBondContact O-N 3.03Å; A92-R94 PolarHBondContact O-N 2.71Å; A92-N95 PolarHBondContact O-N 3.3Å; A92-M96 WeakPolarHBondContact O-CG 3.36Å; A92-M96 PolarHBondContact O-N 3.3Å
93K83.3Confident84.5Confident157 Ų15795.3 Ų95.368%0.68352%0.523SS*.Hα-helixtrans-61.8-41176.9-73.6177.5-179.71730112.3E89 M96E89-K93 WeakPolarHBondContact O-CB 3.45Å; E89-K93 WeakPolarHBondContact O-CG 3.04Å; E89-K93 PolarHBondContact O-N 3.41Å; K93-M96 VanDerWaalsContact O-CG 3.29Å; K93-M96 WeakPolarHBondContact O-CG 3.36Å
94R84.9Confident85.1Confident165 Ų16593 Ų9362%0.62350%0.502SS*.Hα-helixtrans-66.9-40.9179.3-165.8-179.775.7168.53.5112I90 L91 A92 M96 R101I90-R94 VanDerWaalsContact O-CB 3.3Å; I90-R94 WeakPolarHBondContact O-CB 3.38Å; I90-R94 PolarHBondContact O-N 3.29Å; L91-R94 PolarHBondContact O-N 3.01Å; A92-R94 PolarHBondContact O-N 2.71Å; R94-M96 VanDerWaalsContact C-N 3.3Å; R94-M96 PolarHBondContact O-N 2.77Å; R94-R101 PolarHBondContact O-NH2 2.79Å
95N86Confident85.6Confident109 Ų10996.6 Ų96.658%0.58349%0.49SS*.THydrogen-bonded Turntrans-88.68.6-175.4-62.3-15.6000113.4L91 A92 K97L91-N95 VanDerWaalsContact O-CB 3.24Å; L91-N95 WeakPolarHBondContact O-CB 3.41Å; L91-N95 VanDerWaalsContact O-CG 3.23Å; L91-N95 PolarHBondContact O-N 3.39Å; L91-N95 PolarHBondContact O-ND2 2.83Å; A92-N95 PolarHBondContact O-N 3.3Å; N95-K97 PolarHBondContact O-N 3.11Å
96M86Confident86.2Confident59 Ų5998.7 Ų98.729%0.29150%0.497SS..  trans-52.4129.7170.2-72.4-87-89.400110.5A92 K93 R94 V100 R101 Q104A92-M96 WeakPolarHBondContact O-CG 3.36Å; A92-M96 PolarHBondContact O-N 3.3Å; K93-M96 VanDerWaalsContact O-CG 3.29Å; K93-M96 WeakPolarHBondContact O-CG 3.36Å; R94-M96 VanDerWaalsContact C-N 3.3Å; R94-M96 PolarHBondContact O-N 2.77Å; M96-V100 HydrophobicContact CE-CB 4.26Å; M96-V100 HydrophobicContact CE-CG1 3.36Å; M96-V100 HydrophobicContact SD-CG1 4.16Å; M96-R101 HydrophobicContact CB-CG 4.12Å; M96-R101 PolarHBondContact O-NE 2.95Å; M96-R101 PolarHBondContact O-NH2 3.04Å; M96-Q104 VanDerWaalsContact CE-NE2 3.35Å
97K87Confident86.7Confident150 Ų150102.5 Ų102.565%0.65251%0.51SS*.  trans-53.6143.6177.4-71.5-176.9177.6-179.80110.4N95 E99 V100 R101N95-K97 PolarHBondContact O-N 3.11Å; K97-E99 PolarHBondContact O-N 3.11Å; K97-E99 VanDerWaalsContact O-N 3.14Å; K97-V100 HydrophobicContact CB-CG2 4.27Å; K97-V100 PolarHBondContact O-N 2.92Å; K97-R101 PolarHBondContact O-N 2.77Å
98P87.4Confident87.3Confident99 Ų99101.8 Ų101.864%0.64351%0.514SS*.Hα-helixtrans-57.9-31-17720.9-31.4000113R101 K102P98-R101 PolarHBondContact O-N 3.22Å; P98-K102 WeakPolarHBondContact O-CB 3.12Å; P98-K102 PolarHBondContact O-N 3.41Å
99E87.6Confident87.8Confident150 Ų150102 Ų10270%0.70151%0.505SS*.Hα-helixtrans-61.3-46.6174.8-65.8169.5-176.300112.4K97 R101 K102 A103K97-E99 PolarHBondContact O-N 3.11Å; K97-E99 VanDerWaalsContact O-N 3.14Å; E99-R101 VanDerWaalsContact C-N 3.33Å; E99-R101 PolarHBondContact O-N 2.94Å; E99-K102 PolarHBondContact O-N 3.21Å; E99-K102 VanDerWaalsContact O-N 3.17Å; E99-A103 PolarHBondContact O-N 2.97Å
100V87.7Confident88.2Confident60 Ų60104 Ų10436%0.36451%0.513SS..Hα-helixtrans-64.8-40.7179-1740000110.4M96 K97 K102 A103 Q104M96-V100 HydrophobicContact CE-CB 4.26Å; M96-V100 HydrophobicContact CE-CG1 3.36Å; M96-V100 HydrophobicContact SD-CG1 4.16Å; K97-V100 HydrophobicContact CB-CG2 4.27Å; K97-V100 PolarHBondContact O-N 2.92Å; V100-K102 VanDerWaalsContact C-N 3.33Å; V100-K102 PolarHBondContact O-N 3.16Å; V100-A103 PolarHBondContact O-N 3.07Å; V100-Q104 WeakPolarHBondContact O-CG 3.16Å; V100-Q104 PolarHBondContact O-N 3.47Å
101R88.4Confident88.7Confident120 Ų120104 Ų10445%0.45352%0.515SS..Hα-helixtrans-64.1-38.4174.9-62.6-164.7-145.5133-1.1112.2R94 M96 K97 P98 E99 R105R94-R101 PolarHBondContact O-NH2 2.79Å; M96-R101 HydrophobicContact CB-CG 4.12Å; M96-R101 PolarHBondContact O-NE 2.95Å; M96-R101 PolarHBondContact O-NH2 3.04Å; K97-R101 PolarHBondContact O-N 2.77Å; P98-R101 PolarHBondContact O-N 3.22Å; E99-R101 VanDerWaalsContact C-N 3.33Å; E99-R101 PolarHBondContact O-N 2.94Å; R101-R105 WeakPolarHBondContact O-CB 3.11Å; R101-R105 PolarHBondContact O-N 3.1Å
102K89.7Confident89Confident131 Ų131103.3 Ų103.357%0.5752%0.519SS*.Hα-helixtrans-67-44.4177.9-170.1-179.1176.1-1730110.8P98 E99 V100 Q104 R105 D106P98-K102 WeakPolarHBondContact O-CB 3.12Å; P98-K102 PolarHBondContact O-N 3.41Å; E99-K102 PolarHBondContact O-N 3.21Å; E99-K102 VanDerWaalsContact O-N 3.17Å; V100-K102 VanDerWaalsContact C-N 3.33Å; V100-K102 PolarHBondContact O-N 3.16Å; K102-Q104 PolarHBondContact O-N 3.47Å; K102-R105 WeakPolarHBondContact O-CB 3.43Å; K102-R105 PolarHBondContact O-N 3.18Å; K102-D106 VanDerWaalsContact O-CG 3.3Å; K102-D106 PolarHBondContact O-N 3.11Å
103A91Very high89.5Confident56 Ų56106.4 Ų106.446%0.46352%0.521SS..Hα-helixtrans-58.6-47.3175.700000112.2E99 V100 R105 D106 Q107E99-A103 PolarHBondContact O-N 2.97Å; V100-A103 PolarHBondContact O-N 3.07Å; A103-R105 VanDerWaalsContact C-N 3.33Å; A103-R105 PolarHBondContact O-N 3.47Å; A103-D106 PolarHBondContact O-N 3.29Å; A103-Q107 WeakPolarHBondContact O-CB 3.5Å; A103-Q107 PolarHBondContact O-N 2.91Å
104Q89.9Confident89.8Confident105 Ų105104.9 Ų104.949%0.49152%0.516SS..Hα-helixtrans-60.7-40.9175.5-72.9178-8.600112.3M96 V100 K102 A108M96-Q104 VanDerWaalsContact CE-NE2 3.35Å; V100-Q104 WeakPolarHBondContact O-CG 3.16Å; V100-Q104 PolarHBondContact O-N 3.47Å; K102-Q104 PolarHBondContact O-N 3.47Å; Q104-A108 WeakPolarHBondContact O-CB 3.44Å; Q104-A108 PolarHBondContact O-N 3.1Å
105R91Very high90.1Very high158 Ų158103 Ų10360%0.59651%0.514SS*.Hα-helixtrans-63.8-46.3176.3-176.7-175.7-66.6142.4-2111.6R101 K102 A103 Q107 A108 I109R101-R105 WeakPolarHBondContact O-CB 3.11Å; R101-R105 PolarHBondContact O-N 3.1Å; K102-R105 WeakPolarHBondContact O-CB 3.43Å; K102-R105 PolarHBondContact O-N 3.18Å; A103-R105 VanDerWaalsContact C-N 3.33Å; A103-R105 PolarHBondContact O-N 3.47Å; R105-Q107 VanDerWaalsContact C-N 3.33Å; R105-Q107 PolarHBondContact O-N 3.05Å; R105-A108 PolarHBondContact O-N 2.91Å; R105-I109 HydrophobicContact CG-CD1 3.99Å; R105-I109 VanDerWaalsContact O-CG1 3.29Å; R105-I109 WeakPolarHBondContact O-CG1 3.25Å; R105-I109 PolarHBondContact O-N 2.87Å
106D92Very high90.3Very high72 Ų72104.3 Ų104.339%0.38552%0.515SS..Hα-helixtrans-66.4-38.5-178.8-68.8-21.5000111K102 A103 I109 K110K102-D106 VanDerWaalsContact O-CG 3.3Å; K102-D106 PolarHBondContact O-N 3.11Å; A103-D106 PolarHBondContact O-N 3.29Å; D106-I109 PolarHBondContact O-N 3.46Å; D106-K110 WeakPolarHBondContact O-CG 3.27Å; D106-K110 PolarHBondContact O-N 2.9Å
107Q91.3Very high90.4Very high130 Ų130110.4 Ų110.461%0.60754%0.535SS*.Hα-helixtrans-62.6-46.1172.2-172.1176.30.400111.7A103 R105 I109 K110 V111A103-Q107 WeakPolarHBondContact O-CB 3.5Å; A103-Q107 PolarHBondContact O-N 2.91Å; R105-Q107 VanDerWaalsContact C-N 3.33Å; R105-Q107 PolarHBondContact O-N 3.05Å; Q107-I109 VanDerWaalsContact C-N 3.31Å; Q107-I109 PolarHBondContact O-N 3.11Å; Q107-K110 WeakPolarHBondContact O-CB 3.44Å; Q107-K110 PolarHBondContact O-N 2.88Å; Q107-K110 VanDerWaalsContact O-N 3.14Å; Q107-V111 WeakPolarHBondContact O-CG2 3.42Å; Q107-V111 PolarHBondContact O-N 2.72Å
108A92.1Very high90.4Very high60 Ų60106.2 Ų106.250%0.49653%0.528SS..Hα-helixtrans-61.1-38.9176.500000112.3Q104 R105 V111 A112Q104-A108 WeakPolarHBondContact O-CB 3.44Å; Q104-A108 PolarHBondContact O-N 3.1Å; R105-A108 PolarHBondContact O-N 2.91Å; A108-V111 PolarHBondContact O-N 3.38Å; A108-A112 WeakPolarHBondContact O-CB 3.3Å; A108-A112 PolarHBondContact O-N 3.35Å
109I92.5Very high90.5Very high73 Ų73105.5 Ų105.537%0.37452%0.522SS..Hα-helixtrans-65.2-39.6175.2-69.4166.5000111.2R105 D106 Q107 K113R105-I109 HydrophobicContact CG-CD1 3.99Å; R105-I109 VanDerWaalsContact O-CG1 3.29Å; R105-I109 WeakPolarHBondContact O-CG1 3.25Å; R105-I109 PolarHBondContact O-N 2.87Å; D106-I109 PolarHBondContact O-N 3.46Å; Q107-I109 VanDerWaalsContact C-N 3.31Å; Q107-I109 PolarHBondContact O-N 3.11Å; I109-K113 HydrophobicContact CG2-CD 4.1Å; I109-K113 HydrophobicContact CG2-CG 4.46Å; I109-K113 WeakPolarHBondContact O-CB 3.47Å; I109-K113 VanDerWaalsContact O-CG 3.29Å; I109-K113 WeakPolarHBondContact O-CG 3.42Å; I109-K113 PolarHBondContact O-N 3.38Å
110K93.1Very high90.4Very high136 Ų136104.4 Ų104.459%0.59152%0.515SS*.Hα-helixtrans-62.1-50.9175.8-74174.9-178.9-177.40111.1D106 Q107 A112 K113 E114D106-K110 WeakPolarHBondContact O-CG 3.27Å; D106-K110 PolarHBondContact O-N 2.9Å; Q107-K110 WeakPolarHBondContact O-CB 3.44Å; Q107-K110 PolarHBondContact O-N 2.88Å; Q107-K110 VanDerWaalsContact O-N 3.14Å; K110-A112 VanDerWaalsContact C-N 3.33Å; K110-A112 PolarHBondContact O-N 2.74Å; K110-K113 WeakPolarHBondContact O-CB 3.31Å; K110-K113 PolarHBondContact O-N 3.03Å; K110-K113 VanDerWaalsContact O-N 3.08Å; K110-E114 WeakPolarHBondContact O-CG 3.5Å; K110-E114 PolarHBondContact O-N 2.99Å
111V92.9Very high90.1Very high65 Ų65104.3 Ų104.339%0.39452%0.52SS..Hα-helixtrans-57.6-45.5177.31750000111Q107 A108 K113 E114 Q115Q107-V111 WeakPolarHBondContact O-CG2 3.42Å; Q107-V111 PolarHBondContact O-N 2.72Å; A108-V111 PolarHBondContact O-N 3.38Å; V111-K113 VanDerWaalsContact C-N 3.33Å; V111-K113 PolarHBondContact O-N 3.34Å; V111-E114 PolarHBondContact O-N 3.28Å; V111-Q115 HydrophobicContact CG1-CG 4.44Å; V111-Q115 WeakPolarHBondContact O-CG 3.33Å; V111-Q115 PolarHBondContact O-N 3.48Å
112A92.1Very high89.7Confident52 Ų52101.6 Ų101.643%0.4352%0.524SS..Hα-helixtrans-63-37.8177.200000112.7A108 K110 K116A108-A112 WeakPolarHBondContact O-CB 3.3Å; A108-A112 PolarHBondContact O-N 3.35Å; K110-A112 VanDerWaalsContact C-N 3.33Å; K110-A112 PolarHBondContact O-N 2.74Å; A112-K116 WeakPolarHBondContact O-CB 3.48Å; A112-K116 PolarHBondContact O-N 3.26Å
113K93.9Very high89.2Confident127 Ų127102.9 Ų102.955%0.55253%0.529SS*.Hα-helixtrans-67.1-40.3174.9-78.1176.2179.1178.40111.6I109 K110 V111 K116 R117I109-K113 HydrophobicContact CG2-CD 4.1Å; I109-K113 HydrophobicContact CG2-CG 4.46Å; I109-K113 WeakPolarHBondContact O-CB 3.47Å; I109-K113 VanDerWaalsContact O-CG 3.29Å; I109-K113 WeakPolarHBondContact O-CG 3.42Å; I109-K113 PolarHBondContact O-N 3.38Å; K110-K113 WeakPolarHBondContact O-CB 3.31Å; K110-K113 PolarHBondContact O-N 3.03Å; K110-K113 VanDerWaalsContact O-N 3.08Å; V111-K113 VanDerWaalsContact C-N 3.33Å; V111-K113 PolarHBondContact O-N 3.34Å; K113-K116 PolarHBondContact O-N 2.92Å; K113-R117 VanDerWaalsContact O-CG 3.31Å; K113-R117 WeakPolarHBondContact O-CG 3.34Å; K113-R117 PolarHBondContact O-N 3.19Å
114E90.3Very high88.4Confident125 Ų125108.6 Ų108.658%0.58454%0.543SS*.Hα-helixtrans-66.4-46.8176.9-75.1171.5-17700111.7K110 V111 K116 R117 A118K110-E114 WeakPolarHBondContact O-CG 3.5Å; K110-E114 PolarHBondContact O-N 2.99Å; V111-E114 PolarHBondContact O-N 3.28Å; E114-K116 VanDerWaalsContact C-N 3.28Å; E114-K116 PolarHBondContact O-N 3.43Å; E114-R117 CarbonylContact O-C 3.58Å; E114-R117 WeakPolarHBondContact O-CA 3.48Å; E114-R117 WeakPolarHBondContact O-CB 3.28Å; E114-R117 PolarHBondContact O-N 2.96Å; E114-A118 WeakPolarHBondContact O-CB 3.42Å; E114-A118 PolarHBondContact O-N 2.85Å
115Q90Very high87.2Confident125 Ų125107.8 Ų107.858%0.58456%0.555SS**Hα-helixtrans-55.9-44.5172.3-73.2178.8-13.700111.2V111 R117 A118 V119V111-Q115 HydrophobicContact CG1-CG 4.44Å; V111-Q115 WeakPolarHBondContact O-CG 3.33Å; V111-Q115 PolarHBondContact O-N 3.48Å; Q115-R117 VanDerWaalsContact C-N 3.33Å; Q115-R117 PolarHBondContact O-N 3.44Å; Q115-A118 PolarHBondContact O-N 2.84Å; Q115-V119 VanDerWaalsContact O-CG2 3.28Å; Q115-V119 WeakPolarHBondContact O-CG2 3.01Å; Q115-V119 PolarHBondContact O-N 3.31Å
116K90.9Very high85.8Confident138 Ų138104.2 Ų104.260%0.656%0.559SS**Hα-helixtrans-64-35.9175.9-170.3174.3-175.7173.60112.7A112 K113 E114 K120A112-K116 WeakPolarHBondContact O-CB 3.48Å; A112-K116 PolarHBondContact O-N 3.26Å; K113-K116 PolarHBondContact O-N 2.92Å; E114-K116 VanDerWaalsContact C-N 3.28Å; E114-K116 PolarHBondContact O-N 3.43Å; K116-K120 WeakPolarHBondContact O-CB 3.45Å; K116-K120 VanDerWaalsContact O-CG 3.31Å; K116-K120 WeakPolarHBondContact O-CG 3.06Å; K116-K120 PolarHBondContact O-N 2.9Å; K116-K120 VanDerWaalsContact O-N 3.08Å
117R88.5Confident84Confident187 Ų187103.9 Ų103.971%0.70657%0.566SS**Hα-helixtrans-68.6-44.3174.6-75.7174.3178.2-156.2-0.5111.2K113 E114 Q115 K120 A121K113-R117 VanDerWaalsContact O-CG 3.31Å; K113-R117 WeakPolarHBondContact O-CG 3.34Å; K113-R117 PolarHBondContact O-N 3.19Å; E114-R117 CarbonylContact O-C 3.58Å; E114-R117 WeakPolarHBondContact O-CA 3.48Å; E114-R117 WeakPolarHBondContact O-CB 3.28Å; E114-R117 PolarHBondContact O-N 2.96Å; Q115-R117 VanDerWaalsContact C-N 3.33Å; Q115-R117 PolarHBondContact O-N 3.44Å; R117-K120 CarbonylContact O-C 3.56Å; R117-K120 WeakPolarHBondContact O-CB 3.29Å; R117-K120 PolarHBondContact O-N 3.14Å; R117-A121 WeakPolarHBondContact O-CB 3.47Å; R117-A121 PolarHBondContact O-N 3.35Å
118A86.8Confident82.2Confident62 Ų62103.6 Ų103.651%0.51258%0.576SS.*Hα-helixtrans-60.6-46.2176.300000111.6E114 Q115 K120 A121 A122E114-A118 WeakPolarHBondContact O-CB 3.42Å; E114-A118 PolarHBondContact O-N 2.85Å; Q115-A118 PolarHBondContact O-N 2.84Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 2.82Å; A118-A121 PolarHBondContact O-N 3.24Å; A118-A121 VanDerWaalsContact O-N 3.16Å; A118-A122 WeakPolarHBondContact O-CB 3.45Å; A118-A122 PolarHBondContact O-N 2.99Å
119V88.1Confident80.5Confident83 Ų83105.1 Ų105.150%0.50359%0.589SS.*Hα-helixtrans-60.9-40174.4172.90000111.4Q115 K123Q115-V119 VanDerWaalsContact O-CG2 3.28Å; Q115-V119 WeakPolarHBondContact O-CG2 3.01Å; Q115-V119 PolarHBondContact O-N 3.31Å; V119-K123 WeakPolarHBondContact O-CB 3.49Å; V119-K123 WeakPolarHBondContact O-CG 3.31Å; V119-K123 PolarHBondContact O-N 3.44Å
120K86.8Confident79Confident128 Ų128107.7 Ų107.756%0.55761%0.61SS**Hα-helixtrans-67.2-37.8175-79-177.3175.3-165.40112.8K116 R117 A118 K123 K124K116-K120 WeakPolarHBondContact O-CB 3.45Å; K116-K120 VanDerWaalsContact O-CG 3.31Å; K116-K120 WeakPolarHBondContact O-CG 3.06Å; K116-K120 PolarHBondContact O-N 2.9Å; K116-K120 VanDerWaalsContact O-N 3.08Å; R117-K120 CarbonylContact O-C 3.56Å; R117-K120 WeakPolarHBondContact O-CB 3.29Å; R117-K120 PolarHBondContact O-N 3.14Å; A118-K120 VanDerWaalsContact C-N 3.31Å; A118-K120 PolarHBondContact O-N 2.82Å; K120-K123 PolarHBondContact O-N 3.44Å; K120-K124 PolarHBondContact O-N 3.29Å
121A82.1Confident76.9Confident57 Ų57105.9 Ų105.947%0.47162%0.62SS.*Hα-helixtrans-68-44.7177.300000111R117 A118 K123 K124 A125R117-A121 WeakPolarHBondContact O-CB 3.47Å; R117-A121 PolarHBondContact O-N 3.35Å; A118-A121 PolarHBondContact O-N 3.24Å; A118-A121 VanDerWaalsContact O-N 3.16Å; A121-K123 VanDerWaalsContact C-N 3.33Å; A121-K123 PolarHBondContact O-N 2.89Å; A121-K124 PolarHBondContact O-N 3.22Å; A121-K124 VanDerWaalsContact O-N 3.09Å; A121-A125 PolarHBondContact O-N 2.8Å
122A79.7Confident74.6Confident64 Ų64112.7 Ų112.753%0.52965%0.645SS.*Hα-helixtrans-59.2-42.5173.400000111.9A118 K124 A125 A126A118-A122 WeakPolarHBondContact O-CB 3.45Å; A118-A122 PolarHBondContact O-N 2.99Å; A122-K124 VanDerWaalsContact C-N 3.33Å; A122-K124 PolarHBondContact O-N 3.04Å; A122-A125 PolarHBondContact O-N 3.25Å; A122-A126 WeakPolarHBondContact O-CB 3.27Å; A122-A126 PolarHBondContact O-N 3Å
123K78.8Confident72.4Confident157 Ų157119.9 Ų119.968%0.68367%0.666SS**Hα-helixtrans-63.7-33.2173.8-76.5-175.1178.6-165.80113.7V119 K120 A121V119-K123 WeakPolarHBondContact O-CB 3.49Å; V119-K123 WeakPolarHBondContact O-CG 3.31Å; V119-K123 PolarHBondContact O-N 3.44Å; K120-K123 PolarHBondContact O-N 3.44Å; A121-K123 VanDerWaalsContact C-N 3.33Å; A121-K123 PolarHBondContact O-N 2.89Å
124K74.3Confident70.2Confident176 Ų176119.5 Ų119.577%0.76568%0.679SS**Hα-helixtrans-75.3-35.8175.4-80.9-171.6173.2-167.60112.5K120 A121 A122 A126 A127K120-K124 PolarHBondContact O-N 3.29Å; A121-K124 PolarHBondContact O-N 3.22Å; A121-K124 VanDerWaalsContact O-N 3.09Å; A122-K124 VanDerWaalsContact C-N 3.33Å; A122-K124 PolarHBondContact O-N 3.04Å; K124-A126 VanDerWaalsContact C-N 3.3Å; K124-A127 PolarHBondContact O-N 3.32Å
125A64.4Low68.5Low88 Ų88118 Ų11873%0.72769%0.689SS**Hα-helixtrans-71-26.5176.300000112.6A121 A122A121-A125 PolarHBondContact O-N 2.8Å; A122-A125 PolarHBondContact O-N 3.25Å
126A61Low66.4Low83 Ų83117.5 Ų117.569%0.68670%0.696SS**THydrogen-bonded Turntrans-87.95.2175.700000114.4A122 K124 P128A122-A126 WeakPolarHBondContact O-CB 3.27Å; A122-A126 PolarHBondContact O-N 3Å; K124-A126 VanDerWaalsContact C-N 3.3Å; A126-P128 WeakPolarHBondContact O-CD 3.44Å
127A54.3Low64.2Low65 Ų65120.1 Ų120.154%0.53771%0.708SS.*SBendtrans-86.911617600000110.2K124K124-A127 PolarHBondContact O-N 3.32Å
128P54.1Low62.6Low124 Ų124120.6 Ų120.681%0.80572%0.718SS**PPolyproline II helixtrans-66.9142.8179.227.4-32.5000111A126A126-P128 WeakPolarHBondContact O-CD 3.44Å
129A57.2Low60.5Low93 Ų93127.9 Ų127.977%0.76974%0.738SS**PPolyproline II helixtrans-54.9133.1-175.600000112.2A131A129-A131 PolarHBondContact O-N 2.8Å
130P59.5Low58.9Low126 Ų126129 Ų12982%0.81876%0.755SS**PPolyproline II helixtrans-71.3120.1178.427.5-31.1000110.2K132P130-K132 PolarHBondContact O-N 2.94Å
131A50.1Low57.3Low99 Ų99127.3 Ų127.382%0.81877%0.765SS**PPolyproline II helixtrans-58.7128.8172.700000110.9A129 K133A129-A131 PolarHBondContact O-N 2.8Å; A131-K133 PolarHBondContact O-N 2.83Å
132K43.1Very low55.6Low208 Ų208133.6 Ų133.690%0.90478%0.782SS**PPolyproline II helixtrans-55.7122.2179.2-65.5172.6177.9176.20111.4P130P130-K132 PolarHBondContact O-N 2.94Å
133K45.9Very low54.4Low203 Ų203136.7 Ų136.788%0.88379%0.794SS**  trans-137.8120.7151.5-74.3-169.8178.6179.40110A131A131-K133 PolarHBondContact O-N 2.83Å
134S49.5Very low53.2Low118 Ų118134.9 Ų134.983%0.82580%0.797SS**  trans-51.6160.1158.944.10000110.6
135A54.3Low52.4Low94 Ų94135.6 Ų135.678%0.77780%0.803SS**  cis-164.5-177.617.500000107.6
136P44.4Very low51.9Low114 Ų114141.1 Ų141.174%0.7481%0.81SS**  trans-109.9177.9-140.242.3-37.3000117.4
137K46Very low51.5Low194 Ų194141.8 Ų141.884%0.84382%0.816SS**  trans80115.9162.7-72177.6174.9174.40117
138Q54.3Low52Low197 Ų197143 Ų14392%0.92183%0.826SS**  -165.3138.9110.5-99.2166.45.700111.3
139K42.8Very low52.4Low215 Ų215142.7 Ų142.794%0.93582%0.824SS**  trans-76.4134.6179.9-63.2172.3175.6179.30108.9
140A53.8Low52.3Low105 Ų105150.2 Ų150.287%0.86883%0.832SS**  trans-147.2140.4160.400000110.6
141A54.7Low52.3Low93 Ų93150.8 Ų150.877%0.76983%0.833SS**  trans-70.8136.5-162.200000115.3V143A141-V143 PolarHBondContact O-N 2.81Å
142K45.1Very low52.3Low189 Ų189149.8 Ų149.882%0.82283%0.832SS**  14.1103.4127.7-161.7175.7-171.3-1790116.3
143V55.5Low52.6Low129 Ų129143.3 Ų143.378%0.78283%0.825SS**  trans-135.9106.1147-177.70000109.2A141 Q145A141-V143 PolarHBondContact O-N 2.81Å; V143-Q145 PolarHBondContact O-N 3.44Å
144T52.1Low52.9Low120 Ų120143.4 Ų143.474%0.73683%0.825SS**  trans-64.2115.9167.437.80000110.5
145Q58.3Low52.6Low190 Ų190153.3 Ų153.389%0.88885%0.845SS**PPolyproline II helixtrans-94120.2162.7-75.1-170.4-13.600110V143V143-Q145 PolarHBondContact O-N 3.44Å
146K54.5Low52.5Low205 Ų205156.3 Ų156.389%0.89185%0.848SS**PPolyproline II helixtrans-55.6144.3-179.8-77.9170.8169.6175.30112
147A53.2Low53Low97 Ų97158.5 Ų158.580%0.80285%0.854SS**PPolyproline II helixtrans-54.8133.5168.700000112.1
148A63.1Low53.4Low90 Ų90156.6 Ų156.674%0.74485%0.854SS**PPolyproline II helixtrans-79.9134.1164.500000109.9
149P63.3Low53.3Low118 Ų118154.2 Ų154.277%0.76685%0.851SS**PPolyproline II helixtrans-75.7130.5176.230.3-30.9000110V151P149-V151 PolarHBondContact O-N 3.21Å
150R55.6Low54Low250 Ų250150.4 Ų150.494%0.94385%0.845SS**  trans-78.6107.7170.2-75.9-177.9159.1179.2-5.6108.9G152R150-G152 PolarHBondContact O-N 3.04Å
151V60Low54Low138 Ų138153.4 Ų153.484%0.83684%0.844SS**  trans-69.2112.1167.41790000108.2P149 G153P149-V151 PolarHBondContact O-N 3.21Å; V151-G153 PolarHBondContact O-N 3.41Å
152G48.1Very low53.9Low78 Ų78157.7 Ų157.780%0.80485%0.849SS**  trans-73.8108.1169.900000110.2R150R150-G152 PolarHBondContact O-N 3.04Å
153G50.2Low54.6Low73 Ų73155.3 Ų155.375%0.75385%0.851SS**  trans-96.6101.4166.600000110.2V151V151-G153 PolarHBondContact O-N 3.41Å
154K51.9Low54.5Low204 Ų204157.5 Ų157.589%0.88786%0.857SS**  trans-158.192.2157.1-110.4-179.7-175.6-171.80109.3
155R44.4Very low54.8Low327 Ų327160.9 Ų160.9100%1.23487%0.868SS**  trans-112.10135.1-87.6-173.4168.6-179.4-2.6106.5

Retrieved 155 of 155 residues in 102.9 ms (Link to these results)