X6RKU3_HUMAN Loading...

F-box protein 42

AlphaFold DB , UniProt , Accession X6RKU3, Species HUMAN (Homo sapiens, Human), Gene FBXO42, Length 298 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
1M52.5Low81.3Confident206 Ų20678.8 Ų78.8100%1.01544%0.439SS*.  0120.80-66.5160.370.800106.7
2S58.2Low82.4Confident52 Ų5274.2 Ų74.236%0.36442%0.418SS..PPolyproline II helixtrans-71.8148167.5510000109.4W58 C59S2-W58 WeakPolarHBondContact OG-CZ3 3.48Å; S2-W58 PolarHBondContact OG-O 3.41Å; S2-C59 WeakPolarHBondContact OG-CA 3.22Å
3S64.6Low83.4Confident89 Ų8969.3 Ų69.362%0.62239%0.391SS*.PPolyproline II helixtrans-76.8149.4163.148.20000109.7
4P77Confident84.3Confident23 Ų2365.6 Ų65.615%0.14937%0.37CS..PPolyproline II helixtrans-56.4152.617023.4-32.4000111.5Q6 L17 G18P4-Q6 PolarHBondContact O-N 2.75Å; P4-L17 WeakPolarHBondContact CB-O 3.47Å; P4-G18 VanDerWaalsContact CB-O 3.24Å; P4-G18 WeakPolarHBondContact CB-O 3.49Å
5P81.6Confident85Confident16 Ų1662.4 Ų62.410%0.10435%0.351CS..PPolyproline II helixtrans-54.5129.5171.9-25.733.7000112.2I7 L17 L57 H60 A62P5-I7 HydrophobicContact CB-CD1 3.88Å; P5-L17 HydrophobicContact CB-CB 4.3Å; P5-L17 WeakPolarHBondContact CD-O 3.36Å; P5-L17 PolarHBondContact O-N 3.18Å; P5-L57 VanDerWaalsContact CD-O 3.24Å; P5-L57 WeakPolarHBondContact CD-O 3.46Å; P5-L57 VanDerWaalsContact CG-O 3.31Å; P5-L57 WeakPolarHBondContact CG-O 3.41Å; P5-H60 WeakPolarHBondContact CG-O 3.45Å; P5-A62 HydrophobicContact CB-CB 3.8Å; P5-A62 HydrophobicContact CG-CB 4.22Å
6Q90.7Very high85.5Confident85 Ų8559.8 Ų59.840%0.39734%0.335SS..EExtended strand (participates in β ladder)trans-121.8124.1172.9-53-172.82.400107.2P4 I14 L15 I16P4-Q6 PolarHBondContact O-N 2.75Å; Q6-I14 HydrophobicContact CB-CG2 4.29Å; Q6-L15 CarbonylContact C-O 3.6Å; Q6-L15 WeakPolarHBondContact CA-O 3.45Å; Q6-I16 HydrophobicContact CG-CG1 4.22Å
7I94Very high85.8Confident12 Ų1257.4 Ų57.46%0.06232%0.322CS..EExtended strand (participates in β ladder)trans-125.7123-171.6-56.793.2000108.6P5 I9 L15 L17 A62 R64 V69P5-I7 HydrophobicContact CB-CD1 3.88Å; I7-I9 HydrophobicContact CG2-CD1 4.21Å; I7-I9 PolarHBondContact O-N 3.41Å; I7-L15 HydrophobicContact CB-CB 4.39Å; I7-L15 PolarHBondContact N-O 3.26Å; I7-L15 PolarHBondContact O-N 3.48Å; I7-L17 HydrophobicContact CD1-CD1 3.79Å; I7-L17 HydrophobicContact CD1-CG 4.03Å; I7-A62 HydrophobicContact CD1-CB 4.31Å; I7-A62 HydrophobicContact CG1-CB 4.46Å; I7-R64 HydrophobicContact CG2-CB 3.81Å; I7-V69 HydrophobicContact CD1-CG1 4.04Å; I7-V69 HydrophobicContact CG1-CG1 3.98Å; I7-V69 HydrophobicContact CG2-CG2 4.03Å
8V94.5Very high85.9Confident96 Ų9654.8 Ų54.858%0.58231%0.31SS*.EExtended strand (participates in β ladder)trans-73.6121.7174.8-177.10000109.2D10V8-D10 VanDerWaalsContact CG1-O 3.25Å; V8-D10 WeakPolarHBondContact CG1-O 3.35Å
9I94.7Very high85.8Confident45 Ų4552.2 Ų52.223%0.23130%0.296CS..  trans-96.3-35.6179.3-56.6-56.4000110.7I7 T13 L15 L32 R64I7-I9 HydrophobicContact CG2-CD1 4.21Å; I7-I9 PolarHBondContact O-N 3.41Å; I9-T13 HydrophobicContact CB-CG2 4.22Å; I9-T13 PolarHBondContact N-O 3.4Å; I9-L15 HydrophobicContact CD1-CB 3.79Å; I9-L15 HydrophobicContact CD1-CD2 4.25Å; I9-L15 HydrophobicContact CG1-CB 3.74Å; I9-L32 HydrophobicContact CG1-CD2 4.37Å; I9-R64 VanDerWaalsContact O-CZ 3.3Å; I9-R64 PolarHBondContact O-NH1 2.8Å; I9-R64 PolarHBondContact O-NH2 3.08Å
10D92.7Very high85.5Confident71 Ų7150.7 Ų50.738%0.3829%0.289SS..SBendtrans-161.4-174.8171.856.364.5000108.9V8 A12 T13V8-D10 VanDerWaalsContact CG1-O 3.25Å; V8-D10 WeakPolarHBondContact CG1-O 3.35Å; D10-A12 PolarHBondContact O-N 2.75Å; D10-A12 VanDerWaalsContact O-N 3.11Å; D10-A12 WeakPolarHBondContact OD1-CA 3.44Å; D10-A12 PolarHBondContact OD1-N 3.06Å; D10-T13 VanDerWaalsContact CG-OG1 3.27Å; D10-T13 PolarHBondContact N-O 3.07Å; D10-T13 PolarHBondContact O-N 2.85Å; D10-T13 VanDerWaalsContact OD1-CB 3.28Å; D10-T13 WeakPolarHBondContact OD1-CB 3.25Å; D10-T13 PolarHBondContact OD1-N 3.3Å; D10-T13 PolarHBondContact OD1-OG1 3.2Å; D10-T13 WeakPolarHBondContact OD2-CB 3.45Å; D10-T13 PolarHBondContact OD2-OG1 3.34Å
11D93.9Very high85.1Confident172 Ų17250.8 Ų50.892%0.9230%0.301SS*.SBendtrans-62.2-18-176.3-56.3-43.2000114
12A95.1Very high86.2Confident23 Ų2342.3 Ų42.319%0.1927%0.266CS..SBendtrans-120.6-8.2-17800000114D10 M35 H36D10-A12 PolarHBondContact O-N 2.75Å; D10-A12 VanDerWaalsContact O-N 3.11Å; D10-A12 WeakPolarHBondContact OD1-CA 3.44Å; D10-A12 PolarHBondContact OD1-N 3.06Å; A12-M35 WeakPolarHBondContact O-CA 3.48Å; A12-M35 VanDerWaalsContact O-CB 3.29Å; A12-M35 WeakPolarHBondContact O-CB 3.37Å; A12-M35 WeakPolarHBondContact O-CE 3.46Å; A12-M35 PolarHBondContact O-N 3.49Å; A12-H36 HydrophobicContact CB-CB 3.92Å
13T94.9Very high86.8Confident11 Ų1146 Ų467%0.06729%0.289CS..EExtended strand (participates in β ladder)trans-124.6126-170.4-480000112.6I9 D10 L32 L33I9-T13 HydrophobicContact CB-CG2 4.22Å; I9-T13 PolarHBondContact N-O 3.4Å; D10-T13 VanDerWaalsContact CG-OG1 3.27Å; D10-T13 PolarHBondContact N-O 3.07Å; D10-T13 PolarHBondContact O-N 2.85Å; D10-T13 VanDerWaalsContact OD1-CB 3.28Å; D10-T13 WeakPolarHBondContact OD1-CB 3.25Å; D10-T13 PolarHBondContact OD1-N 3.3Å; D10-T13 PolarHBondContact OD1-OG1 3.2Å; D10-T13 WeakPolarHBondContact OD2-CB 3.45Å; D10-T13 PolarHBondContact OD2-OG1 3.34Å; T13-L32 HydrophobicContact CG2-CB 4.35Å; T13-L32 HydrophobicContact CG2-CD2 4.02Å; T13-L33 WeakPolarHBondContact CA-O 3.29Å
14I95.3Very high87.3Confident18 Ų1849.7 Ų49.79%0.09230%0.302CS..EExtended strand (participates in β ladder)trans-117.8129.5174.8-58.3172.3000109.7Q6 I16 L32 L33 M35Q6-I14 HydrophobicContact CB-CG2 4.29Å; I14-I16 HydrophobicContact CG2-CG1 4.22Å; I14-L32 CarbonylContact O-C 3.59Å; I14-L32 WeakPolarHBondContact O-CA 3.33Å; I14-L33 PolarHBondContact N-O 2.87Å; I14-L33 PolarHBondContact O-N 3.29Å; I14-M35 HydrophobicContact CD1-CE 3.75Å; I14-M35 HydrophobicContact CD1-SD 4.26Å; I14-M35 HydrophobicContact CG1-CE 3.88Å
15L95.4Very high87.3Confident17 Ų1750.3 Ų50.39%0.08931%0.309CS..EExtended strand (participates in β ladder)trans-89.7131167.8174.867.2000110.2Q6 I7 I9 L17 A30 W31 L32 L45 V69Q6-L15 CarbonylContact C-O 3.6Å; Q6-L15 WeakPolarHBondContact CA-O 3.45Å; I7-L15 HydrophobicContact CB-CB 4.39Å; I7-L15 PolarHBondContact N-O 3.26Å; I7-L15 PolarHBondContact O-N 3.48Å; I9-L15 HydrophobicContact CD1-CB 3.79Å; I9-L15 HydrophobicContact CD1-CD2 4.25Å; I9-L15 HydrophobicContact CG1-CB 3.74Å; L15-L17 HydrophobicContact CD1-CD2 3.96Å; L15-L17 HydrophobicContact CD2-CD2 4.06Å; L15-L17 HydrophobicContact CD2-CG 4.31Å; L15-L17 HydrophobicContact CG-CD2 3.97Å; L15-L17 HydrophobicContact CG-CG 4.19Å; L15-A30 HydrophobicContact CD1-CB 4.45Å; L15-W31 CarbonylContact C-O 3.59Å; L15-W31 WeakPolarHBondContact CA-O 3.33Å; L15-L32 HydrophobicContact CB-CD2 3.88Å; L15-L32 HydrophobicContact CD1-CD2 3.86Å; L15-L32 HydrophobicContact CG-CD2 4.47Å; L15-L45 HydrophobicContact CD1-CD1 3.54Å; L15-V69 HydrophobicContact CD2-CG2 3.93Å
16I92.9Very high87.3Confident20 Ų2053.7 Ų53.710%0.10333%0.326CS..EExtended strand (participates in β ladder)trans-118.5130.9176.2-66.3152.8000108.2Q6 I14 A30 W31 W42Q6-I16 HydrophobicContact CG-CG1 4.22Å; I14-I16 HydrophobicContact CG2-CG1 4.22Å; I16-A30 WeakPolarHBondContact O-CA 3.25Å; I16-W31 PolarHBondContact N-O 3Å; I16-W31 PolarHBondContact O-N 3.5Å; I16-W42 HydrophobicContact CD1-CH2 3.84Å; I16-W42 HydrophobicContact CD1-CZ3 3.58Å
17L90.8Very high87Confident20 Ų2054 Ų5411%0.10533%0.326CS..EExtended strand (participates in β ladder)trans-117.3109.7-175.6-64.3-178000111.2P4 P5 I7 L15 A30 L57 V69 V71P4-L17 WeakPolarHBondContact CB-O 3.47Å; P5-L17 HydrophobicContact CB-CB 4.3Å; P5-L17 WeakPolarHBondContact CD-O 3.36Å; P5-L17 PolarHBondContact O-N 3.18Å; I7-L17 HydrophobicContact CD1-CD1 3.79Å; I7-L17 HydrophobicContact CD1-CG 4.03Å; L15-L17 HydrophobicContact CD1-CD2 3.96Å; L15-L17 HydrophobicContact CD2-CD2 4.06Å; L15-L17 HydrophobicContact CD2-CG 4.31Å; L15-L17 HydrophobicContact CG-CD2 3.97Å; L15-L17 HydrophobicContact CG-CG 4.19Å; L17-A30 HydrophobicContact CD2-CB 3.65Å; L17-L57 HydrophobicContact CB-CD2 3.76Å; L17-L57 HydrophobicContact CB-CG 4.32Å; L17-V69 HydrophobicContact CD1-CG1 4.09Å; L17-V71 HydrophobicContact CD1-CG2 4.16Å
18G87.9Confident86.6Confident10 Ų1058 Ų5810%0.10334%0.343CS..EExtended strand (participates in β ladder)trans58.2-151.5175.500000115.1P4 F27 D29P4-G18 VanDerWaalsContact CB-O 3.24Å; P4-G18 WeakPolarHBondContact CB-O 3.49Å; G18-F27 CarbonylContact C-O 3.55Å; G18-F27 WeakPolarHBondContact CA-O 3.19Å; G18-D29 WeakPolarHBondContact CA-O 3.28Å; G18-D29 PolarHBondContact N-O 2.83Å
19G83.8Confident86.4Confident5 Ų556.5 Ų56.55%0.05233%0.332CS..EExtended strand (participates in β ladder)trans152.7-171.1176.200000113.9F27G19-F27 PolarHBondContact N-O 3.02Å; G19-F27 VanDerWaalsContact N-O 3.08Å; G19-F27 PolarHBondContact O-N 3.48Å
20C79.1Confident86.3Confident23 Ų2354.8 Ų54.816%0.15532%0.324CS..EExtended strand (participates in β ladder)trans-128.6132.9170.6680000111.8A25 L26C20-A25 CarbonylContact C-O 3.51Å; C20-A25 VanDerWaalsContact CA-O 3.27Å; C20-A25 WeakPolarHBondContact CA-O 3.43Å; C20-L26 HydrophobicContact CB-CD2 4.09Å
21G76.8Confident86.4Confident53 Ų5353.7 Ų53.755%0.54632%0.315SS..EExtended strand (participates in β ladder)trans-94.7-11172.300000113.9A25G21-A25 PolarHBondContact N-O 3.38Å
22G76Confident86.5Confident27 Ų2746.9 Ų46.928%0.27828%0.278SS..EExtended strand (participates in β ladder)trans161.1-176.6-175.200000110.5N24 A25G22-N24 PolarHBondContact O-N 3.37Å; G22-N24 VanDerWaalsContact O-N 3.09Å; G22-A25 PolarHBondContact O-N 2.97Å
23P71.9Confident86.5Confident131 Ų13145.9 Ų45.985%0.85127%0.27SS*.THydrogen-bonded Turntrans-55.6-30.5-173.9-28.236000115.4
24N74.5Confident86.5Confident165 Ų16547 Ų4788%0.88227%0.274SS*.THydrogen-bonded Turntrans-119.115.3-176.7-58.4-29000112.9G22G22-N24 PolarHBondContact O-N 3.37Å; G22-N24 VanDerWaalsContact O-N 3.09Å
25A77.2Confident86.5Confident37 Ų3748.5 Ų48.531%0.30628%0.281SS..EExtended strand (participates in β ladder)trans-122.988-17700000109.4C20 G21 G22C20-A25 CarbonylContact C-O 3.51Å; C20-A25 VanDerWaalsContact CA-O 3.27Å; C20-A25 WeakPolarHBondContact CA-O 3.43Å; G21-A25 PolarHBondContact N-O 3.38Å; G22-A25 PolarHBondContact O-N 2.97Å
26L80.8Confident86.1Confident86 Ų8654 Ų5445%0.4531%0.307SS..EExtended strand (participates in β ladder)trans-100.8133.4174.8-60.6-173.7000109.8C20 E56C20-L26 HydrophobicContact CB-CD2 4.09Å; L26-E56 HydrophobicContact CD1-CG 4.19Å
27F84.4Confident85.4Confident92 Ų9256 Ų5640%0.40432%0.322SS..EExtended strand (participates in β ladder)trans-110.9138.1177.3-53.5-70.3000109.7G18 G19 D29G18-F27 CarbonylContact C-O 3.55Å; G18-F27 WeakPolarHBondContact CA-O 3.19Å; G19-F27 PolarHBondContact N-O 3.02Å; G19-F27 VanDerWaalsContact N-O 3.08Å; G19-F27 PolarHBondContact O-N 3.48Å; F27-D29 WeakPolarHBondContact CB-OD1 3.37Å
28K86.6Confident84.9Confident95 Ų9558.5 Ų58.541%0.41335%0.353SS..EExtended strand (participates in β ladder)trans-123.16.4178.5-64177.5174.3-172.10112.5E50K28-E50 HydrophobicContact CD-CG 3.94Å; K28-E50 WeakPolarHBondContact CD-OE1 3.41Å; K28-E50 WeakPolarHBondContact CE-OE1 3.45Å; K28-E50 IonicContact NZ-OE1 2.66Å; K28-E50 PolarHBondContact NZ-OE1 3.43Å
29D89.1Confident85Confident65 Ų6563.8 Ų63.835%0.34839%0.385SS..EExtended strand (participates in β ladder)trans-69.2168.7175.157.4-14.1000111.4G18 F27 W31G18-D29 WeakPolarHBondContact CA-O 3.28Å; G18-D29 PolarHBondContact N-O 2.83Å; F27-D29 WeakPolarHBondContact CB-OD1 3.37Å; D29-W31 PolarHBondContact OD2-NE1 3.03Å
30A92.8Very high85.6Confident9 Ų968.5 Ų68.57%0.07440%0.401CS..EExtended strand (participates in β ladder)trans-133141.5177.500000109.5L15 I16 L17 L45 V47L15-A30 HydrophobicContact CD1-CB 4.45Å; I16-A30 WeakPolarHBondContact O-CA 3.25Å; L17-A30 HydrophobicContact CD2-CB 3.65Å; A30-L45 HydrophobicContact CB-CB 4Å; A30-L45 HydrophobicContact CB-CD1 4.34Å; A30-L45 PolarHBondContact O-N 2.95Å; A30-V47 HydrophobicContact CB-CG2 3.95Å
31W95Very high86.3Confident49 Ų4969.7 Ų69.719%0.18641%0.413CS..EExtended strand (participates in β ladder)trans-138.3138.1-175.6-69.982.4000111.1L15 I16 D29 W42 Q43 P44L15-W31 CarbonylContact C-O 3.59Å; L15-W31 WeakPolarHBondContact CA-O 3.33Å; I16-W31 PolarHBondContact N-O 3Å; I16-W31 PolarHBondContact O-N 3.5Å; D29-W31 PolarHBondContact OD2-NE1 3.03Å; W31-W42 HydrophobicContact CB-CE3 4.49Å; W31-W42 HydrophobicContact CE3-CB 4.2Å; W31-W42 HydrophobicContact CZ3-CB 4.23Å; W31-Q43 CarbonylContact C-O 3.59Å; W31-Q43 WeakPolarHBondContact CA-O 3.5Å; W31-P44 HydrophobicContact CD2-CB 4.17Å; W31-P44 HydrophobicContact CE3-CB 3.96Å; W31-P44 HydrophobicContact CH2-CB 3.84Å; W31-P44 HydrophobicContact CH2-CG 4.23Å; W31-P44 HydrophobicContact CZ2-CB 4.03Å; W31-P44 HydrophobicContact CZ3-CB 3.81Å; W31-P44 HydrophobicContact CZ3-CG 4.07Å
32L95.4Very high87.2Confident28 Ų2870.9 Ų70.915%0.14740%0.401CS..EExtended strand (participates in β ladder)trans-94.2137.2162.2-62.6176.3000109.9I9 T13 I14 L15 Q43 L45I9-L32 HydrophobicContact CG1-CD2 4.37Å; T13-L32 HydrophobicContact CG2-CB 4.35Å; T13-L32 HydrophobicContact CG2-CD2 4.02Å; I14-L32 CarbonylContact O-C 3.59Å; I14-L32 WeakPolarHBondContact O-CA 3.33Å; L15-L32 HydrophobicContact CB-CD2 3.88Å; L15-L32 HydrophobicContact CD1-CD2 3.86Å; L15-L32 HydrophobicContact CG-CD2 4.47Å; L32-Q43 HydrophobicContact CB-CB 4.33Å; L32-Q43 PolarHBondContact N-O 2.96Å; L32-Q43 PolarHBondContact O-N 3.11Å; L32-L45 HydrophobicContact CD1-CD2 3.93Å; L32-L45 HydrophobicContact CD2-CD1 4.25Å; L32-L45 HydrophobicContact CG-CD1 4Å; L32-L45 HydrophobicContact CG-CD2 4.02Å; L32-L45 HydrophobicContact CG-CG 4.11Å
33L95.7Very high88Confident3 Ų373.7 Ų73.72%0.01641%0.407CS..EExtended strand (participates in β ladder)trans-106.5115.1165.517158.8000108.3T13 I14 M35 W40 W42T13-L33 WeakPolarHBondContact CA-O 3.29Å; I14-L33 PolarHBondContact N-O 2.87Å; I14-L33 PolarHBondContact O-N 3.29Å; L33-M35 HydrophobicContact CD1-CG 4.48Å; L33-M35 HydrophobicContact CD2-CG 4.42Å; L33-M35 HydrophobicContact CD2-SD 4.34Å; L33-M35 HydrophobicContact CG-CG 4.02Å; L33-W40 HydrophobicContact CD1-CB 3.88Å; L33-W40 HydrophobicContact CD1-CD2 4.48Å; L33-W40 HydrophobicContact CD1-CE3 4.12Å; L33-W40 HydrophobicContact CD1-CG 4.46Å; L33-W40 HydrophobicContact CD2-CE3 4.28Å; L33-W42 HydrophobicContact CB-CE3 4.22Å; L33-W42 HydrophobicContact CB-CH2 4.17Å; L33-W42 HydrophobicContact CB-CZ3 3.98Å; L33-W42 HydrophobicContact CD1-CD2 4.08Å; L33-W42 HydrophobicContact CD1-CE3 4.46Å; L33-W42 HydrophobicContact CD1-CH2 4.23Å; L33-W42 HydrophobicContact CD1-CZ2 3.81Å; L33-W42 HydrophobicContact CD2-CH2 3.98Å; L33-W42 HydrophobicContact CD2-CZ2 4.08Å; L33-W42 HydrophobicContact CG-CH2 4.36Å; L33-W42 HydrophobicContact CG-CZ2 4.39Å
34H95.2Very high89.1Confident34 Ų3471.3 Ų71.316%0.15739%0.391CS..EExtended strand (participates in β ladder)trans-98.5123.3177-62.8-71.4000110.4W40 A41 Q43H34-W40 VanDerWaalsContact O-CA 3.31Å; H34-W40 WeakPolarHBondContact O-CA 3.34Å; H34-W40 WeakPolarHBondContact O-CB 3.31Å; H34-A41 HydrophobicContact CB-CB 4.28Å; H34-A41 PolarHBondContact N-O 3.4Å; H34-A41 PolarHBondContact O-N 3.34Å; H34-Q43 PolarHBondContact NE2-OE1 3.11Å
35M95.3Very high90Very high49 Ų4966.3 Ų66.324%0.24136%0.364CS..  trans-114.42.1-174.9-54.5179.9-69.700113.5A12 I14 L33 S37 W40A12-M35 WeakPolarHBondContact O-CA 3.48Å; A12-M35 VanDerWaalsContact O-CB 3.29Å; A12-M35 WeakPolarHBondContact O-CB 3.37Å; A12-M35 WeakPolarHBondContact O-CE 3.46Å; A12-M35 PolarHBondContact O-N 3.49Å; I14-M35 HydrophobicContact CD1-CE 3.75Å; I14-M35 HydrophobicContact CD1-SD 4.26Å; I14-M35 HydrophobicContact CG1-CE 3.88Å; L33-M35 HydrophobicContact CD1-CG 4.48Å; L33-M35 HydrophobicContact CD2-CG 4.42Å; L33-M35 HydrophobicContact CD2-SD 4.34Å; L33-M35 HydrophobicContact CG-CG 4.02Å; M35-S37 PolarHBondContact O-N 2.89Å; M35-S37 VanDerWaalsContact O-N 3.11Å; M35-W40 HydrophobicContact CB-CG 4.39Å; M35-W40 HydrophobicContact CG-CD2 3.96Å; M35-W40 HydrophobicContact CG-CE3 4.49Å; M35-W40 HydrophobicContact CG-CG 4.14Å; M35-W40 HydrophobicContact CG-CZ2 4.38Å; M35-W40 HydrophobicContact SD-CH2 4.39Å; M35-W40 HydrophobicContact SD-CZ2 4.17Å
36H87.9Confident90.8Very high134 Ų13472.6 Ų72.662%0.6239%0.385SS*.SBendtrans-61.8-21.2-173.260.266.1000114.4A12A12-H36 HydrophobicContact CB-CB 3.92Å
37S77.4Confident91.3Very high62 Ų6271.6 Ų71.643%0.43438%0.382SS..SBendtrans-148.5149.2174.452.70000110M35 P39M35-S37 PolarHBondContact O-N 2.89Å; M35-S37 VanDerWaalsContact O-N 3.11Å; S37-P39 CarbonylContact O-C 3.29Å; S37-P39 VanDerWaalsContact O-C 3.29Å; S37-P39 VanDerWaalsContact O-O 3.07Å
38G79.8Confident91.6Very high72 Ų7273 Ų7374%0.74239%0.39SS*.SBendtrans-80140.5168.500000111.2
39P90.8Very high91.6Very high121 Ų12173.4 Ų73.479%0.78640%0.397SS*.SBendcis-73.2150.2-7.832.5-35.3000112S37S37-P39 CarbonylContact O-C 3.29Å; S37-P39 VanDerWaalsContact O-C 3.29Å; S37-P39 VanDerWaalsContact O-O 3.07Å
40W95.6Very high91.5Very high104 Ų10474.9 Ų74.939%0.39440%0.402SS..PPolyproline II helixtrans-59.7138.9175-62.8-13.3000111.5L33 H34 M35 L278 I281L33-W40 HydrophobicContact CD1-CB 3.88Å; L33-W40 HydrophobicContact CD1-CD2 4.48Å; L33-W40 HydrophobicContact CD1-CE3 4.12Å; L33-W40 HydrophobicContact CD1-CG 4.46Å; L33-W40 HydrophobicContact CD2-CE3 4.28Å; H34-W40 VanDerWaalsContact O-CA 3.31Å; H34-W40 WeakPolarHBondContact O-CA 3.34Å; H34-W40 WeakPolarHBondContact O-CB 3.31Å; M35-W40 HydrophobicContact CB-CG 4.39Å; M35-W40 HydrophobicContact CG-CD2 3.96Å; M35-W40 HydrophobicContact CG-CE3 4.49Å; M35-W40 HydrophobicContact CG-CG 4.14Å; M35-W40 HydrophobicContact CG-CZ2 4.38Å; M35-W40 HydrophobicContact SD-CH2 4.39Å; M35-W40 HydrophobicContact SD-CZ2 4.17Å; W40-L278 HydrophobicContact CZ3-CD2 3.98Å; W40-I281 HydrophobicContact CH2-CD1 3.7Å; W40-I281 HydrophobicContact CH2-CG2 4.27Å; W40-I281 HydrophobicContact CZ3-CD1 3.64Å
41A93.8Very high91Very high48 Ų4880.9 Ų80.940%0.39743%0.428SS..EExtended strand (participates in β ladder)trans-105.5139-178.100000111.4H34H34-A41 HydrophobicContact CB-CB 4.28Å; H34-A41 PolarHBondContact N-O 3.4Å; H34-A41 PolarHBondContact O-N 3.34Å
42W95.1Very high90.4Very high77 Ų7785.9 Ų85.929%0.29245%0.453SS..EExtended strand (participates in β ladder)trans-105.6127.4174.3-69.190.5000109.3I16 W31 L33 L274I16-W42 HydrophobicContact CD1-CH2 3.84Å; I16-W42 HydrophobicContact CD1-CZ3 3.58Å; W31-W42 HydrophobicContact CB-CE3 4.49Å; W31-W42 HydrophobicContact CE3-CB 4.2Å; W31-W42 HydrophobicContact CZ3-CB 4.23Å; L33-W42 HydrophobicContact CB-CE3 4.22Å; L33-W42 HydrophobicContact CB-CH2 4.17Å; L33-W42 HydrophobicContact CB-CZ3 3.98Å; L33-W42 HydrophobicContact CD1-CD2 4.08Å; L33-W42 HydrophobicContact CD1-CE3 4.46Å; L33-W42 HydrophobicContact CD1-CH2 4.23Å; L33-W42 HydrophobicContact CD1-CZ2 3.81Å; L33-W42 HydrophobicContact CD2-CH2 3.98Å; L33-W42 HydrophobicContact CD2-CZ2 4.08Å; L33-W42 HydrophobicContact CG-CH2 4.36Å; L33-W42 HydrophobicContact CG-CZ2 4.39Å; W42-L274 HydrophobicContact CZ2-CD1 4.07Å
43Q94.7Very high89.7Confident86 Ų8686.6 Ų86.640%0.40247%0.467SS..EExtended strand (participates in β ladder)trans-121.3117.2177.8175.4-176.9-12.900109.6W31 L32 H34W31-Q43 CarbonylContact C-O 3.59Å; W31-Q43 WeakPolarHBondContact CA-O 3.5Å; L32-Q43 HydrophobicContact CB-CB 4.33Å; L32-Q43 PolarHBondContact N-O 2.96Å; L32-Q43 PolarHBondContact O-N 3.11Å; H34-Q43 PolarHBondContact NE2-OE1 3.11Å
44P94.3Very high88.9Confident81 Ų8187.5 Ų87.553%0.52648%0.475SS..EExtended strand (participates in β ladder)trans-69.4138.9170.329.3-31.9000109.5W31W31-P44 HydrophobicContact CD2-CB 4.17Å; W31-P44 HydrophobicContact CE3-CB 3.96Å; W31-P44 HydrophobicContact CH2-CB 3.84Å; W31-P44 HydrophobicContact CH2-CG 4.23Å; W31-P44 HydrophobicContact CZ2-CB 4.03Å; W31-P44 HydrophobicContact CZ3-CB 3.81Å; W31-P44 HydrophobicContact CZ3-CG 4.07Å
45L93.6Very high88Confident61 Ų6187.8 Ų87.832%0.31948%0.48SS..EExtended strand (participates in β ladder)trans-98.7139.8170.6-63.5-175.7000109.9L15 A30 L32 V47L15-L45 HydrophobicContact CD1-CD1 3.54Å; A30-L45 HydrophobicContact CB-CB 4Å; A30-L45 HydrophobicContact CB-CD1 4.34Å; A30-L45 PolarHBondContact O-N 2.95Å; L32-L45 HydrophobicContact CD1-CD2 3.93Å; L32-L45 HydrophobicContact CD2-CD1 4.25Å; L32-L45 HydrophobicContact CG-CD1 4Å; L32-L45 HydrophobicContact CG-CD2 4.02Å; L32-L45 HydrophobicContact CG-CG 4.11Å; L45-V47 PolarHBondContact O-N 3.45Å
46K93.7Very high87.1Confident169 Ų16990.1 Ų90.174%0.73549%0.49SS*.PPolyproline II helixtrans-70.1117.9169-172.6-171.7-179.8-163.40108.4E48K46-E48 HydrophobicContact CD-CG 4.02Å; K46-E48 WeakPolarHBondContact CD-OE1 3.2Å; K46-E48 VanDerWaalsContact CE-OE1 3.23Å; K46-E48 WeakPolarHBondContact CE-OE1 3.43Å; K46-E48 HydrophobicContact CG-CG 4.16Å; K46-E48 IonicContact NZ-OE1 2.64Å; K46-E48 PolarHBondContact NZ-OE1 2.98Å
47V90.5Very high86.5Confident65 Ų6585 Ų8539%0.39447%0.467SS..PPolyproline II helixtrans-86.9125.2168-178.40000107.6A30 L45 E50A30-V47 HydrophobicContact CB-CG2 3.95Å; L45-V47 PolarHBondContact O-N 3.45Å; V47-E50 HydrophobicContact CG1-CB 4.42Å; V47-E50 HydrophobicContact CG1-CG 4.45Å
48E91.6Very high86.4Confident120 Ų12084.5 Ų84.556%0.56146%0.456SS*.  trans-111149.3174.5-60-169157.300109.4K46 E50K46-E48 HydrophobicContact CD-CG 4.02Å; K46-E48 WeakPolarHBondContact CD-OE1 3.2Å; K46-E48 VanDerWaalsContact CE-OE1 3.23Å; K46-E48 WeakPolarHBondContact CE-OE1 3.43Å; K46-E48 HydrophobicContact CG-CG 4.16Å; K46-E48 IonicContact NZ-OE1 2.64Å; K46-E48 PolarHBondContact NZ-OE1 2.98Å; E48-E50 PolarHBondContact O-N 3Å
49N87.5Confident86.2Confident105 Ų10583.6 Ų83.656%0.56144%0.437SS*.  trans57.445.2-179.2-43.7-64.2000113.2E51 H52 G53N49-E51 VanDerWaalsContact C-OE2 3.28Å; N49-E51 WeakPolarHBondContact CA-OE1 3.24Å; N49-E51 WeakPolarHBondContact CA-OE2 3.4Å; N49-E51 WeakPolarHBondContact CB-OE1 3.41Å; N49-E51 PolarHBondContact O-N 2.88Å; N49-H52 HydrophobicContact CB-CB 4.39Å; N49-H52 WeakPolarHBondContact O-CB 3.46Å; N49-H52 PolarHBondContact O-N 3.11Å; N49-G53 PolarHBondContact O-N 2.77Å
50E85.6Confident86Confident96 Ų9679.6 Ų79.645%0.44941%0.408SS..G310 helixtrans-57.5-30.9-175.9-164.1-152.4110.200112.8K28 V47 E48 H52 G53K28-E50 HydrophobicContact CD-CG 3.94Å; K28-E50 WeakPolarHBondContact CD-OE1 3.41Å; K28-E50 WeakPolarHBondContact CE-OE1 3.45Å; K28-E50 IonicContact NZ-OE1 2.66Å; K28-E50 PolarHBondContact NZ-OE1 3.43Å; V47-E50 HydrophobicContact CG1-CB 4.42Å; V47-E50 HydrophobicContact CG1-CG 4.45Å; E48-E50 PolarHBondContact O-N 3Å; E50-H52 PolarHBondContact O-N 3.22Å; E50-G53 PolarHBondContact O-N 3.01Å
51E82.6Confident85.6Confident135 Ų13578.9 Ų78.963%0.63142%0.417SS*.G310 helixtrans-64.8-23.3174.970.5-64.7151.600114N49N49-E51 VanDerWaalsContact C-OE2 3.28Å; N49-E51 WeakPolarHBondContact CA-OE1 3.24Å; N49-E51 WeakPolarHBondContact CA-OE2 3.4Å; N49-E51 WeakPolarHBondContact CB-OE1 3.41Å; N49-E51 PolarHBondContact O-N 2.88Å
52H82.3Confident85.5Confident154 Ų15478.1 Ų78.171%0.71341%0.411SS*.G310 helixtrans-92.5-6.2171.9-62.3100.4000112.6N49 E50N49-H52 HydrophobicContact CB-CB 4.39Å; N49-H52 WeakPolarHBondContact O-CB 3.46Å; N49-H52 PolarHBondContact O-N 3.11Å; E50-H52 PolarHBondContact O-N 3.22Å
53G80.7Confident85.3Confident43 Ų4377 Ų7744%0.44341%0.414SS..SBendtrans-65.5156.6177.200000112.7N49 E50N49-G53 PolarHBondContact O-N 2.77Å; E50-G53 PolarHBondContact O-N 3.01Å
54A79.1Confident85.3Confident22 Ų2277.9 Ų77.918%0.18241%0.414CS..PPolyproline II helixtrans-58.5133.4171.800000110.6L57 V71 S73A54-L57 HydrophobicContact CB-CD1 3.7Å; A54-V71 HydrophobicContact CB-CG1 4.41Å; A54-S73 WeakPolarHBondContact CB-OG 3.24Å
55P75.8Confident85.4Confident39 Ų3978.1 Ų78.125%0.25341%0.414SS..THydrogen-bonded Turntrans-58.8152.3168.829.6-36.6000109.4L57 H60 Q74 P76P55-L57 VanDerWaalsContact C-N 3.26Å; P55-L57 PolarHBondContact O-N 3.48Å; P55-H60 PolarHBondContact O-CD2 3.39Å; P55-H60 PolarHBondContact O-NE2 2.91Å; P55-H60 VanDerWaalsContact O-NE2 3.13Å; P55-Q74 WeakPolarHBondContact CG-O 3.34Å; P55-P76 HydrophobicContact CB-CG 4.05Å; P55-P76 HydrophobicContact CG-CG 3.91Å
56E76.6Confident85.3Confident98 Ų9877.8 Ų77.846%0.45843%0.425SS..THydrogen-bonded Turntrans44.845.1169.2-64.3-166.8178.300115.8L26 W58 C59L26-E56 HydrophobicContact CD1-CG 4.19Å; E56-W58 HydrophobicContact CB-CZ2 4.43Å; E56-W58 PolarHBondContact O-N 3.41Å; E56-C59 PolarHBondContact O-N 2.64Å; E56-C59 PolarHBondContact O-SG 3.38Å
57L76.1Confident85.3Confident26 Ų2678.1 Ų78.114%0.13643%0.429CS..G310 helixtrans-42.5-30.2-175.9-153.668.8000115.4P5 L17 A54 P55 C59 H60 V71P5-L57 VanDerWaalsContact CD-O 3.24Å; P5-L57 WeakPolarHBondContact CD-O 3.46Å; P5-L57 VanDerWaalsContact CG-O 3.31Å; P5-L57 WeakPolarHBondContact CG-O 3.41Å; L17-L57 HydrophobicContact CB-CD2 3.76Å; L17-L57 HydrophobicContact CB-CG 4.32Å; A54-L57 HydrophobicContact CB-CD1 3.7Å; P55-L57 VanDerWaalsContact C-N 3.26Å; P55-L57 PolarHBondContact O-N 3.48Å; L57-C59 VanDerWaalsContact C-N 3.29Å; L57-C59 PolarHBondContact O-N 3.34Å; L57-H60 PolarHBondContact O-N 2.89Å; L57-V71 HydrophobicContact CD1-CB 4.29Å; L57-V71 HydrophobicContact CD1-CG1 3.93Å; L57-V71 HydrophobicContact CD1-CG2 4.11Å
58W75.3Confident85.3Confident52 Ų5279 Ų7920%0.19744%0.437CS..G310 helixtrans-66.2-15.2178.764.8-89.9000115.8S2 E56S2-W58 WeakPolarHBondContact OG-CZ3 3.48Å; S2-W58 PolarHBondContact OG-O 3.41Å; E56-W58 HydrophobicContact CB-CZ2 4.43Å; E56-W58 PolarHBondContact O-N 3.41Å
59C76.4Confident85.4Confident53 Ų5375.4 Ų75.436%0.35842%0.423SS..G310 helixtrans-112-5.5179.375.60000114.3S2 E56 L57S2-C59 WeakPolarHBondContact OG-CA 3.22Å; E56-C59 PolarHBondContact O-N 2.64Å; E56-C59 PolarHBondContact O-SG 3.38Å; L57-C59 VanDerWaalsContact C-N 3.29Å; L57-C59 PolarHBondContact O-N 3.34Å
60H84.8Confident85.6Confident38 Ų3873.2 Ų73.218%0.17641%0.413CS..SBendtrans-96140.5-174.7-70.4-52.5000113.3P5 P55 L57 V71 F72 S73P5-H60 WeakPolarHBondContact CG-O 3.45Å; P55-H60 PolarHBondContact O-CD2 3.39Å; P55-H60 PolarHBondContact O-NE2 2.91Å; P55-H60 VanDerWaalsContact O-NE2 3.13Å; L57-H60 PolarHBondContact O-N 2.89Å; H60-V71 HydrophobicContact CB-CG1 3.62Å; H60-F72 WeakPolarHBondContact CB-O 3.44Å; H60-F72 PolarHBondContact ND1-O 3.43Å; H60-S73 VanDerWaalsContact CD2-CB 3.47Å; H60-S73 WeakPolarHBondContact CD2-CB 3.46Å; H60-S73 WeakPolarHBondContact NE2-CB 3.35Å
61P88Confident85.8Confident88 Ų8870.3 Ų70.357%0.57140%0.402SS*.  trans-68.7135.717428.4-32.3000110.3F72P61-F72 HydrophobicContact CG-CB 4.26Å; P61-F72 PolarHBondContact O-N 2.98Å
62A90.8Very high86Confident32 Ų3270 Ų7026%0.26440%0.399SS..EExtended strand (participates in β ladder)trans-126.6149.9175.900000110.7P5 I7 V69 V70 V71P5-A62 HydrophobicContact CB-CB 3.8Å; P5-A62 HydrophobicContact CG-CB 4.22Å; I7-A62 HydrophobicContact CD1-CB 4.31Å; I7-A62 HydrophobicContact CG1-CB 4.46Å; A62-V69 HydrophobicContact CB-CG1 4.34Å; A62-V70 CarbonylContact C-O 3.57Å; A62-V70 VanDerWaalsContact CA-O 3.22Å; A62-V70 WeakPolarHBondContact CA-O 3.31Å; A62-V71 HydrophobicContact CB-CB 4.4Å; A62-V71 HydrophobicContact CB-CG1 4.37Å; A62-V71 HydrophobicContact CB-CG2 3.82Å
63C92.1Very high86.1Confident55 Ų5564.9 Ų64.937%0.37238%0.38SS..EExtended strand (participates in β ladder)trans-143.6155170.163.60000111.4V69 V70C63-V69 WeakPolarHBondContact O-CA 3.24Å; C63-V70 PolarHBondContact N-O 2.9Å; C63-V70 PolarHBondContact O-N 3.18Å
64R94.7Very high85.9Confident103 Ų10370.8 Ų70.839%0.38940%0.397SS..EExtended strand (participates in β ladder)trans-81.8134.6169.8-175.2-177.3174.3-174.811.9109.8I7 I9 G66 C68 V69I7-R64 HydrophobicContact CG2-CB 3.81Å; I9-R64 VanDerWaalsContact O-CZ 3.3Å; I9-R64 PolarHBondContact O-NH1 2.8Å; I9-R64 PolarHBondContact O-NH2 3.08Å; R64-G66 PolarHBondContact NE-O 2.95Å; R64-C68 CarbonylContact C-O 3.58Å; R64-C68 WeakPolarHBondContact CA-O 3.44Å; R64-V69 HydrophobicContact CB-CG2 4.45Å
65V95Very high85.1Confident86 Ų8672.4 Ų72.452%0.52141%0.41SS..EExtended strand (participates in β ladder)trans-130.6100.8173.8-175.30000107.5Q67 C68 V70V65-Q67 PolarHBondContact O-N 3.31Å; V65-C68 PolarHBondContact N-O 3.02Å; V65-C68 PolarHBondContact O-N 2.77Å; V65-V70 HydrophobicContact CB-CG2 4.42Å; V65-V70 HydrophobicContact CG2-CG2 4.08Å
66G93.1Very high84.4Confident54 Ų5476 Ų7656%0.55743%0.433SS*.THydrogen-bonded Turntrans60.5-117.4-172.900000112.1R64R64-G66 PolarHBondContact NE-O 2.95Å
67Q92.3Very high83.7Confident177 Ų17775.3 Ų75.383%0.82744%0.439SS*.THydrogen-bonded Turntrans-93.91.3177.3-60.5-58.1-3800113.6V65V65-Q67 PolarHBondContact O-N 3.31Å
68C92.3Very high82.6Confident82 Ų8277.6 Ų77.655%0.55447%0.469SS*.EExtended strand (participates in β ladder)trans-107.8157.1-179.8-59.30000111.2R64 V65R64-C68 CarbonylContact C-O 3.58Å; R64-C68 WeakPolarHBondContact CA-O 3.44Å; V65-C68 PolarHBondContact N-O 3.02Å; V65-C68 PolarHBondContact O-N 2.77Å
69V92.5Very high81.3Confident46 Ų4685.3 Ų85.328%0.27950%0.498SS..EExtended strand (participates in β ladder)trans-115.7125165.3176.80000108I7 L15 L17 A62 C63 R64I7-V69 HydrophobicContact CD1-CG1 4.04Å; I7-V69 HydrophobicContact CG1-CG1 3.98Å; I7-V69 HydrophobicContact CG2-CG2 4.03Å; L15-V69 HydrophobicContact CD2-CG2 3.93Å; L17-V69 HydrophobicContact CD1-CG1 4.09Å; A62-V69 HydrophobicContact CB-CG1 4.34Å; C63-V69 WeakPolarHBondContact O-CA 3.24Å; R64-V69 HydrophobicContact CB-CG2 4.45Å
70V92Very high79.9Confident58 Ų5885.3 Ų85.335%0.35250%0.501SS..EExtended strand (participates in β ladder)trans-106130.8-178.8-178.50000108.1A62 C63 V65 F72A62-V70 CarbonylContact C-O 3.57Å; A62-V70 VanDerWaalsContact CA-O 3.22Å; A62-V70 WeakPolarHBondContact CA-O 3.31Å; C63-V70 PolarHBondContact N-O 2.9Å; C63-V70 PolarHBondContact O-N 3.18Å; V65-V70 HydrophobicContact CB-CG2 4.42Å; V65-V70 HydrophobicContact CG2-CG2 4.08Å; V70-F72 HydrophobicContact CG1-CE1 4.4Å; V70-F72 HydrophobicContact CG1-CE2 4.06Å; V70-F72 HydrophobicContact CG1-CZ 4Å
71V89.9Confident78.3Confident35 Ų3589.5 Ų89.521%0.21253%0.532CS..EExtended strand (participates in β ladder)trans-116.2124.6175.9-170.30000109L17 A54 L57 H60 A62 S73L17-V71 HydrophobicContact CD1-CG2 4.16Å; A54-V71 HydrophobicContact CB-CG1 4.41Å; L57-V71 HydrophobicContact CD1-CB 4.29Å; L57-V71 HydrophobicContact CD1-CG1 3.93Å; L57-V71 HydrophobicContact CD1-CG2 4.11Å; H60-V71 HydrophobicContact CB-CG1 3.62Å; A62-V71 HydrophobicContact CB-CB 4.4Å; A62-V71 HydrophobicContact CB-CG1 4.37Å; A62-V71 HydrophobicContact CB-CG2 3.82Å; V71-S73 PolarHBondContact O-N 3.35Å
72F86.6Confident76.4Confident129 Ų12993.2 Ų93.257%0.56655%0.546SS*.  trans-92.3101.5-179.6-62.8-90.2000110.2H60 P61 V70H60-F72 WeakPolarHBondContact CB-O 3.44Å; H60-F72 PolarHBondContact ND1-O 3.43Å; P61-F72 HydrophobicContact CG-CB 4.26Å; P61-F72 PolarHBondContact O-N 2.98Å; V70-F72 HydrophobicContact CG1-CE1 4.4Å; V70-F72 HydrophobicContact CG1-CE2 4.06Å; V70-F72 HydrophobicContact CG1-CZ 4Å
73S83.2Confident74.3Confident46 Ų4695.4 Ų95.432%0.32256%0.56SS.*  trans-115.4163.6174.762.80000111.8A54 H60 V71A54-S73 WeakPolarHBondContact CB-OG 3.24Å; H60-S73 VanDerWaalsContact CD2-CB 3.47Å; H60-S73 WeakPolarHBondContact CD2-CB 3.46Å; H60-S73 WeakPolarHBondContact NE2-CB 3.35Å; V71-S73 PolarHBondContact O-N 3.35Å
74Q77.6Confident72.1Confident168 Ų16898.5 Ų98.579%0.78558%0.579SS**  trans-91.2134164-67.8-165.7-13.700108.9P55P55-Q74 WeakPolarHBondContact CG-O 3.34Å
75A62.8Low69.8Low55 Ų5597.1 Ų97.146%0.45559%0.585SS.*  trans-61136.9175.600000110.2S77 G78A75-S77 PolarHBondContact O-N 3.48Å; A75-G78 PolarHBondContact O-N 3Å
76P61Low67.6Low115 Ų11599.9 Ų99.975%0.74760%0.596SS**THydrogen-bonded Turntrans-56.2-19.5-179.5-27.134.2000114.9P55 G78P55-P76 HydrophobicContact CB-CG 4.05Å; P55-P76 HydrophobicContact CG-CG 3.91Å; P76-G78 PolarHBondContact O-N 2.86Å
77S60.4Low65.5Low84 Ų84104.5 Ų104.559%0.58761%0.608SS**THydrogen-bonded Turntrans-70.6-11.6-178.462.40000114.6A75 R79A75-S77 PolarHBondContact O-N 3.48Å; S77-R79 PolarHBondContact O-N 2.95Å
78G53.9Low63.3Low73 Ų73100.8 Ų100.875%0.75360%0.602SS**  trans64.5-8.6-17800000115.1A75 P76 A80A75-G78 PolarHBondContact O-N 3Å; P76-G78 PolarHBondContact O-N 2.86Å; G78-A80 PolarHBondContact O-N 3.19Å
79R48.5Very low61.3Low215 Ų215106.3 Ų106.381%0.81161%0.611SS**  trans-78.7108.8167.6-63.6-171.3-174.2-164.93106.9S77S77-R79 PolarHBondContact O-N 2.95Å
80A46.5Very low59.3Low52 Ų52109.6 Ų109.643%0.4363%0.633SS.*  trans-49.4147.3170.300000110.5G78 L82 S83G78-A80 PolarHBondContact O-N 3.19Å; A80-L82 PolarHBondContact O-N 3.48Å; A80-S83 WeakPolarHBondContact CB-OG 3.09Å
81P50.7Low57.1Low127 Ų127111.6 Ų111.683%0.82565%0.65SS**THydrogen-bonded Turntrans-56105.9171.224.7-33.4000107.9S83P81-S83 PolarHBondContact O-N 3.49Å; P81-S83 VanDerWaalsContact O-N 3.15Å
82L48.5Very low55Low165 Ų165115.7 Ų115.786%0.86468%0.677SS**THydrogen-bonded Turntrans9.683.1-167.2-66173000113.2A80 P84A80-L82 PolarHBondContact O-N 3.48Å; L82-P84 WeakPolarHBondContact O-CD 3.42Å
83S46.7Very low53.2Low78 Ų78117.5 Ų117.555%0.54569%0.691SS.*  trans-39.2118.4174.2-59.30000108.7A80 P81 S85A80-S83 WeakPolarHBondContact CB-OG 3.09Å; P81-S83 PolarHBondContact O-N 3.49Å; P81-S83 VanDerWaalsContact O-N 3.15Å; S83-S85 VanDerWaalsContact O-CA 3.3Å; S83-S85 WeakPolarHBondContact O-CA 3.4Å; S83-S85 PolarHBondContact O-N 3.28Å
84P45.2Very low51.4Low121 Ų121119.7 Ų119.779%0.78671%0.706SS**  trans-53.8108179-26.534.3000107L82 L86L82-P84 WeakPolarHBondContact O-CD 3.42Å; P84-L86 PolarHBondContact O-N 3.46Å
85S46.8Very low50Low73 Ų73116.5 Ų116.551%0.5171%0.708SS.*  trans-71.4114.7-155.241.30000107.8S83 N87 S88S83-S85 VanDerWaalsContact O-CA 3.3Å; S83-S85 WeakPolarHBondContact O-CA 3.4Å; S83-S85 PolarHBondContact O-N 3.28Å; S85-N87 PolarHBondContact O-N 3.34Å; S85-S88 PolarHBondContact O-N 2.82Å; S85-S88 PolarHBondContact O-OG 2.97Å; S85-S88 VanDerWaalsContact O-OG 3.13Å
86L48.4Very low49Very low144 Ų144118.4 Ų118.475%0.75472%0.715SS**G310 helixtrans-61.63.5177.1-67.3172.6000113.2P84 S88 R89P84-L86 PolarHBondContact O-N 3.46Å; L86-S88 PolarHBondContact O-N 2.89Å; L86-R89 WeakPolarHBondContact O-CG 3.4Å; L86-R89 PolarHBondContact O-N 3.33Å
87N49.3Very low48.5Very low152 Ų152117.9 Ų117.981%0.81371%0.711SS**G310 helixtrans-67.8-15.7164.8-58.73.2000112.4S85 R89S85-N87 PolarHBondContact O-N 3.34Å; N87-R89 PolarHBondContact O-N 2.81Å
88S46.8Very low47.7Very low98 Ų98120 Ų12069%0.68572%0.723SS**G310 helixtrans-84.233.6162.662.20000112.7S85 L86 P90S85-S88 PolarHBondContact O-N 2.82Å; S85-S88 PolarHBondContact O-OG 2.97Å; S85-S88 VanDerWaalsContact O-OG 3.13Å; L86-S88 PolarHBondContact O-N 2.89Å; S88-P90 WeakPolarHBondContact O-CD 3.27Å
89R50.3Low47.2Very low198 Ų198121 Ų12175%0.74772%0.724SS**  trans-64.8113.1154.1-87.2-178.5176.4-138.1-1.2107.4L86 N87 S91L86-R89 WeakPolarHBondContact O-CG 3.4Å; L86-R89 PolarHBondContact O-N 3.33Å; N87-R89 PolarHBondContact O-N 2.81Å; R89-S91 PolarHBondContact O-N 2.82Å
90P50.4Low47.4Very low116 Ų116118.5 Ų118.575%0.75373%0.726SS**  trans-55.3132.7154.727-33000106.6S88S88-P90 WeakPolarHBondContact O-CD 3.27Å
91S45.2Very low47.4Very low100 Ų100122.6 Ų122.670%0.69975%0.745SS**  trans-47.4134.5173.8-55.60000108.7R89 I93R89-S91 PolarHBondContact O-N 2.82Å; S91-I93 PolarHBondContact O-N 3.07Å
92P45.5Very low47.3Very low120 Ų120121.6 Ų121.678%0.77974%0.739SS**  trans-58.3111.417125.2-31.9000106.9S94P92-S94 PolarHBondContact O-N 2.82Å
93I49.7Very low47Very low167 Ų167122.2 Ų122.286%0.85674%0.737SS**  trans-57116173.7-64174.9000105.1S91 A95S91-I93 PolarHBondContact O-N 3.07Å; I93-A95 PolarHBondContact O-N 2.84Å
94S45.6Very low46.9Very low93 Ų93124 Ų12465%0.6575%0.745SS**  trans-63.9102.7-170-156.60000108.9P92 T96P92-S94 PolarHBondContact O-N 2.82Å; S94-T96 PolarHBondContact O-N 2.85Å; S94-T96 PolarHBondContact OG-OG1 3.48Å
95A47Very low46.8Very low100 Ų100129.3 Ų129.383%0.82675%0.749SS**  trans-74.853.4169.900000109.8I93 P97I93-A95 PolarHBondContact O-N 2.84Å; A95-P97 WeakPolarHBondContact O-CD 3.2Å
96T42.9Very low46.7Very low96 Ų96133.6 Ų133.659%0.58976%0.761SS**  trans-103.899.5173.9-51.30000106.4S94S94-T96 PolarHBondContact O-N 2.85Å; S94-T96 PolarHBondContact OG-OG1 3.48Å
97P49.8Very low46.1Very low103 Ų103137.1 Ų137.167%0.66977%0.766SS**  trans-58.7144.9163.528.1-33.6000108.2A95 A99A95-P97 WeakPolarHBondContact O-CD 3.2Å; P97-A99 PolarHBondContact O-N 3.35Å
98P43.9Very low45.6Very low130 Ų130139.9 Ų139.984%0.84477%0.765SS**  trans-66.396.8-17426.5-34.3000110.8
99A44.6Very low45.4Very low92 Ų92140.6 Ų140.676%0.7677%0.77SS**  trans-84.6125.7169.300000108.8P97P97-A99 PolarHBondContact O-N 3.35Å
100L51.1Low44.7Very low163 Ų163140.2 Ų140.285%0.85378%0.777SS**  trans-72.8154.7174.9-61.2167.5000110.5
101V47.4Very low43.9Very low138 Ų138140.3 Ų140.384%0.83678%0.78SS**  trans93.5139.8164.7-1690000117
102P48.5Very low43.8Very low107 Ų107141.5 Ų141.570%0.69579%0.786SS**  trans-111.4171.4-164.610.215.1000117.7
103E41.9Very low43.5Very low177 Ų177142.3 Ų142.383%0.82779%0.788SS**  trans69.4155.3161.1-74.3-168.7106.300119.6
104T44.4Very low43.6Very low115 Ų115145.8 Ų145.871%0.70679%0.79SS**  cis-155.4166.2-0.113.20000113.3
105R43.1Very low43.1Very low234 Ų234146.6 Ų146.688%0.88380%0.796SS**  trans93.8137.1144.4-120.8177.2-167.1179.65.7122.1
106E45.9Very low42.9Very low162 Ų162150.5 Ų150.576%0.75780%0.8SS**  trans-98.4156.3-176.5-3895.713400113.8
107Y35.9Very low43.1Very low218 Ų218153.4 Ų153.486%0.85581%0.812SS**  trans-156122.1141.8-138.1-100.4000116.1
108R38.2Very low42.8Very low210 Ų210155.8 Ų155.879%0.79281%0.814SS**  trans1.8128.2150.5-154178.3-165.293.9-2.5119.2
109S41.8Very low43.2Very low113 Ų113153.2 Ų153.279%0.7980%0.804SS**  trans-108.2146.417454.40000114
110Q36Very low43.4Very low190 Ų190154.8 Ų154.889%0.88881%0.806SS**  trans-135.3149.4159.8-75.1-164.9-3.300109.2
111S34.7Very low43.5Very low118 Ų118150.9 Ų150.983%0.82579%0.791SS**  trans-134.8117.6-179-174.80000111.7
112P41.7Very low43.2Very low126 Ų126151 Ų15182%0.81879%0.792SS**  trans-77.6-176.6170.2-21.236.3000115.4
113V40.3Very low43.1Very low137 Ų137152.2 Ų152.283%0.8379%0.792SS**  trans-101.3144.6-156169.60000115.2
114R51.1Low43.7Very low239 Ų239146.9 Ų146.990%0.90279%0.785SS**  trans-16.8151.5169.8-39.2-163.779.8-179.43.8122.6
115S34.8Very low44.2Very low111 Ų111151.9 Ų151.978%0.77679%0.791SS**  trans-167.2117.1135.2-162.10000108.3
116M42.1Very low44.2Very low182 Ų182148.8 Ų148.890%0.89778%0.78SS**  88.168.276-155.5175.190.300115.2
117D49.1Very low44.3Very low157 Ų157144.3 Ų144.384%0.8478%0.777SS**  trans-160.7126.1146.7-174.956.2000108
118E41.9Very low44.6Very low153 Ų153140.7 Ų140.772%0.71578%0.778SS**  trans-155.5122.2176.3-158.5158.879.400111.9W126E118-W126 VanDerWaalsContact CD-CZ3 3.49Å; E118-W126 HydrophobicContact CG-CH2 4.31Å; E118-W126 HydrophobicContact CG-CZ3 4.2Å; E118-W126 VanDerWaalsContact OE1-CH2 3.24Å; E118-W126 WeakPolarHBondContact OE1-CH2 3.46Å; E118-W126 WeakPolarHBondContact OE1-CZ3 3.37Å
119A51.8Low44.9Very low76 Ų76138.6 Ų138.663%0.62878%0.781SS**PPolyproline II helixtrans-86.3161.9-171.400000113.7C121A119-C121 PolarHBondContact O-N 3.23Å
120P49.8Very low45.4Very low124 Ų124144.5 Ų144.581%0.80579%0.787SS**PPolyproline II helixtrans-65133.1-174.5-21.433.7000114
121C52.8Low45.6Very low82 Ų82141.8 Ų141.855%0.55479%0.785SS**PPolyproline II helixtrans-76.5120.4-178.7-62.40000112.3A119 W126A119-C121 PolarHBondContact O-N 3.23Å; C121-W126 WeakPolarHBondContact SG-CZ2 3.47Å
122V41.9Very low45.7Very low139 Ų139146.5 Ų146.584%0.84279%0.785SS**SBendtrans-110.12.5-178-670000116
123N46.9Very low46Very low133 Ų133145.4 Ų145.471%0.71179%0.787SS**SBendtrans-150.817.5174.366.64.8000115.2R125N123-R125 PolarHBondContact O-N 2.89Å
124G53.7Low45.7Very low66 Ų66146.1 Ų146.168%0.6878%0.781SS**SBendtrans65.55.2170.900000117.2
125R54.3Low45Very low220 Ų220144.8 Ų144.883%0.8378%0.776SS**  trans-114.196.2-176-166.4178.2-175.7-162.41.4112.4N123 G127N123-R125 PolarHBondContact O-N 2.89Å; R125-G127 PolarHBondContact O-N 3.38Å
126W44.5Very low44.9Very low168 Ų168147.7 Ų147.764%0.63678%0.777SS**  trans-62.8116.7171.6-64.791.9000111.4E118 C121E118-W126 VanDerWaalsContact CD-CZ3 3.49Å; E118-W126 HydrophobicContact CG-CH2 4.31Å; E118-W126 HydrophobicContact CG-CZ3 4.2Å; E118-W126 VanDerWaalsContact OE1-CH2 3.24Å; E118-W126 WeakPolarHBondContact OE1-CH2 3.46Å; E118-W126 WeakPolarHBondContact OE1-CZ3 3.37Å; C121-W126 WeakPolarHBondContact SG-CZ2 3.47Å
127G47.9Very low44.4Very low68 Ų68145.3 Ų145.370%0.70177%0.773SS**  trans-104.5124.7173.400000111.1R125 L129R125-G127 PolarHBondContact O-N 3.38Å; G127-L129 PolarHBondContact O-N 2.92Å
128T42Very low44.3Very low143 Ų143143.2 Ų143.288%0.87777%0.768SS**  trans-90.3105.2178.9-350000110.6
129L43.3Very low43.8Very low165 Ų165142 Ų14286%0.86478%0.776SS**PPolyproline II helixtrans-85.2131.4173.8-64.6179.5000110.8G127G127-L129 PolarHBondContact O-N 2.92Å
130R53.2Low42.7Very low238 Ų238141.5 Ų141.590%0.89878%0.779SS**PPolyproline II helixtrans-82129.1178.3-67.2-175176.9-170.3-0.9110.5R132R130-R132 PolarHBondContact O-N 3.09Å
131P39.3Very low41.9Very low132 Ų132141.1 Ų141.186%0.85778%0.779SS**PPolyproline II helixtrans-64.5133.2173.6-23.434.8000112.6
132R37.4Very low41.1Very low217 Ų217146.3 Ų146.382%0.81979%0.787SS**PPolyproline II helixtrans-79.8117.9172.9178.2-176.9177.7113.9-4.3109.2R130R130-R132 PolarHBondContact O-N 3.09Å
133A48.7Very low40.9Very low104 Ų104147.2 Ų147.286%0.8678%0.782SS**PPolyproline II helixtrans-78.9124.5176.800000111.4
134Q33.9Very low40.1Very low151 Ų151144.9 Ų144.971%0.70679%0.789SS**  trans-145.992.4170.6-167.6165.3-33.700112.9
135R36.3Very low39.6Very low212 Ų212147.2 Ų147.280%0.880%0.795SS**  56.3127.5124.7-126.8-158.9-112.6-101.4-2.9120.9
136Q32.1Very low38.7Very low171 Ų171145 Ų14580%0.79980%0.799SS**  trans96.9131.4146.5-50.5-171.3-68.400120.5
137T32Very low38.3Very low132 Ų132142.1 Ų142.181%0.8181%0.805SS**  trans-89.5-169.1168.354.20000109.3
138P47.8Very low38.1Very low113 Ų113145.3 Ų145.373%0.73481%0.813SS**  cis-141.6-176.41.943.2-24.4000117.3
139S30.2Very low38Very low127 Ų127142.9 Ų142.989%0.88881%0.807SS**  trans71.4146.8157.8-146.80000117.6
140G27.9Very low37.8Very low67 Ų67146.3 Ų146.369%0.69181%0.809SS**  cis169164.3-8.100000112.3
141S33.3Very low36.7Very low115 Ų115138.3 Ų138.380%0.80480%0.8SS**  trans107.4125.1147.5-152.50000121.9
142R36.9Very low36.7Very low192 Ų192139.1 Ų139.173%0.72580%0.798SS**  trans48.4121.1147.2-66.9-174.6104161.15124
143E37.9Very low36.4Very low157 Ų157132.4 Ų132.473%0.73480%0.795SS**  56.6131122.3-62.4157.5-175.400121.6
144G30.7Very low36.1Very low84 Ų84132.7 Ų132.787%0.86679%0.792SS**  trans170.990.7166.500000114.3
145S42Very low37Very low115 Ų115131.4 Ų131.480%0.80480%0.796SS**  trans-88.6156171.6-54.10000111.6
146L35Very low37.1Very low175 Ų175128 Ų12892%0.91679%0.793SS**  173.4153.4127.5-91.2173000112.4
147S36.6Very low37.5Very low107 Ų107127.3 Ų127.375%0.74879%0.793SS**  trans-84.8-177.7-174.7-43.90000114.1
148P44.2Very low37.5Very low134 Ų134129.2 Ų129.287%0.8780%0.798SS**  -140.6177.6102.339.1-26.8000114.9
149A38.5Very low36.7Very low92 Ų92127.3 Ų127.376%0.7680%0.8SS**  trans-148.5160.2-173.400000114.9
150R39.3Very low36.7Very low237 Ų237125.4 Ų125.489%0.89480%0.8SS**  trans79.8152.2151.4-84-173.6168.7178.3-3.8123.7
151G31.6Very low37.4Very low70 Ų70127.4 Ų127.472%0.72280%0.804SS**  trans125.773.1172.100000112.9
152D39Very low37.4Very low150 Ų150130 Ų13080%0.80281%0.807SS**  70.4128.965.4-76.5-37.7000116.7
153G30.6Very low37.4Very low75 Ų75126.5 Ų126.577%0.77381%0.812SS**  trans168.492.7172.300000116.5
154S43.1Very low38Very low111 Ų111125.1 Ų125.178%0.77682%0.817SS**  trans-152.7143.8167.2-69.90000111.2
155P52.9Low37.9Very low123 Ų123124.2 Ų124.280%0.79981%0.808SS**  -140.9164.5123.630.5-12.8000112.9
156I38Very low37.5Very low142 Ų142125.7 Ų125.773%0.72881%0.812SS**  cis108.698.410.2-63.3173.9000115.5
157L40.8Very low37.4Very low156 Ų156121.9 Ų121.982%0.81781%0.806SS**  trans74.5119.8146.7-61.8172.5000124.5
158N31.1Very low37.2Very low171 Ų171121.3 Ų121.391%0.91481%0.807SS**  -178.5164.1125.2-99.1-59.6000109.9
159G31.3Very low36.7Very low74 Ų74121.8 Ų121.876%0.76381%0.808SS**  cis149.8104.8-11.600000114.1
160G30.2Very low36.4Very low87 Ų87121.1 Ų121.190%0.89781%0.81SS**  trans162.1153.5174.100000116.5
161S42.1Very low36Very low109 Ų109113.1 Ų113.176%0.76280%0.801SS**  trans-134.3174.5-170.759.10000114.4
162L33.1Very low36Very low169 Ų169115.7 Ų115.789%0.88581%0.808SS**  trans104.8135.8164.3-53.1178.1000119
163S37.8Very low35.7Very low118 Ų118114 Ų11483%0.82581%0.807SS**  trans-85.5-177.5171.1-46.90000111.1
164P49.7Very low36.2Very low128 Ų128118.6 Ų118.683%0.83181%0.813SS**  cis-141.5-177.57.344.2-25.5000117.3
165G29.4Very low35.5Very low65 Ų65121.1 Ų121.167%0.6782%0.819SS**  trans112.5118.5138.400000121.4
166T33Very low34.7Very low146 Ų146119.9 Ų119.990%0.89681%0.812SS**  trans57.9110.9144.453.70000122.9
167A33.3Very low35.5Very low96 Ų96118.2 Ų118.279%0.79381%0.811SS**  138.9121.3105.700000117.4
168A31.4Very low34.9Very low94 Ų94116.2 Ų116.278%0.77781%0.805SS**  trans61.8108.2141.900000122.4
169V34.6Very low35Very low145 Ų145116.5 Ų116.588%0.87980%0.801SS**  169.3131.4101.6152.20000111
170G32.4Very low35.1Very low78 Ų78116.8 Ų116.880%0.80480%0.796SS**  trans69111.8168.400000115.8
171G30.2Very low35.1Very low68 Ų68120.9 Ų120.970%0.70180%0.796SS**  cis88.678.130.800000109.3
172S32.7Very low34.9Very low124 Ų124121 Ų12187%0.86780%0.797SS**  68.9140.398.167.60000114.1
173S31.7Very low35.3Very low114 Ų114118.7 Ų118.780%0.79779%0.792SS**  cis-162.9158.5-9.4-176.60000106.4
174L40.6Very low35Very low172 Ų172118.4 Ų118.490%0.90179%0.79SS**  trans-82.5124.7164.8-72.4166000109.2
175D29Very low34.6Very low165 Ų165118.4 Ų118.488%0.88279%0.788SS**  trans-155.2159.9148-158.516000110.5
176S36.1Very low35.1Very low96 Ų96121.3 Ų121.367%0.67179%0.794SS**  trans-99.6-166.9-176.3-133.30000111.1
177P54.5Low35.3Very low108 Ų108120 Ų12070%0.70179%0.791SS**  cis-130.9-160.9-23.9231.8000112.3
178V30Very low35.4Very low113 Ų113119.8 Ų119.869%0.68579%0.79SS**  trans108.3125.4147.5-173.10000119.9
179Q32.3Very low36.4Very low177 Ų177119.8 Ų119.883%0.82778%0.782SS**  trans80.4114.1152.5-84.4169.347.400124.6
180A32.9Very low36.3Very low81 Ų81121.9 Ų121.967%0.66978%0.782SS**  87.4165.2115.900000122
181I31Very low36.2Very low172 Ų172120.8 Ų120.888%0.88277%0.771SS**  trans70121.6170.265.2167.4000120.7
182S37.7Very low36.3Very low112 Ų112129.1 Ų129.178%0.78378%0.783SS**  trans-70.8175167.6-42.90000112.4
183P41.3Very low36.6Very low120 Ų120129.5 Ų129.578%0.77978%0.775SS**  -142.4138.5116.133.9-19.2000116.9
184S31.1Very low36.8Very low113 Ų113130.9 Ų130.979%0.7977%0.773SS**  trans37.8133.8132-49.10000123.9
185T41.3Very low36.8Very low128 Ų128130.9 Ų130.979%0.78577%0.766SS**  trans-66167156.747.40000113.7
186P40.4Very low37.1Very low125 Ų125130.5 Ų130.581%0.81276%0.762SS**  trans-123.4158.7139.336.9-29.2000113.4
187S36.8Very low37.1Very low118 Ų118129.2 Ų129.283%0.82576%0.764SS**  trans-98.9171.6-176.3-44.50000113.2
188A35.3Very low36.1Very low93 Ų93132 Ų13277%0.76977%0.772SS**  trans-52.5173.4170.700000114.3
189P51.5Low36.7Very low94 Ų94132.8 Ų132.861%0.6178%0.783SS**  cis-152.2-175.14640.9-17.5000118.8
190E34.5Very low37Very low188 Ų188132.3 Ų132.388%0.87979%0.785SS**  trans60.4148158.7-67.7131-156.200119.5
191G29.7Very low37.2Very low56 Ų56132.6 Ų132.658%0.57779%0.787SS**  cis175.1-173.3-1.900000111.5
192Y32.1Very low37.6Very low243 Ų243130.8 Ų130.895%0.95379%0.787SS**  trans73149.7170.585.1-99000122
193D37.9Very low37.6Very low131 Ų131136.8 Ų136.870%0.70179%0.792SS**  trans-136.3139.1-170.4162.737.8000109.2
194L36.8Very low37.7Very low144 Ų144143.4 Ų143.475%0.75480%0.802SS**  trans179119.4134.8-12068.2000113.7
195K41.5Very low38.2Very low171 Ų171141.5 Ų141.574%0.74380%0.8SS**  47.9115.9127-159.4-169.5-170.3177.90120.6
196I34.3Very low38.1Very low157 Ų157141 Ų14181%0.80580%0.802SS**  -170.9143.5110.7-110.890.9000108.3
197G35.3Very low38.1Very low69 Ų69142.8 Ų142.871%0.71180%0.804SS**  trans-95.5156.1-170.600000115.8
198L35.1Very low38.4Very low166 Ų166142.4 Ų142.487%0.86980%0.798SS**  trans-135119159.4-77.5173.5000109.2L200L198-L200 PolarHBondContact O-N 3.05Å
199S41.4Very low38.5Very low131 Ų131143.2 Ų143.292%0.91679%0.79SS**  trans-73.3122.5177.2-60.70000111
200L37.9Very low38Very low167 Ų167148.1 Ų148.187%0.87481%0.805SS**  trans-127.6142.6168.1-79.6167.5000110.1L198L198-L200 PolarHBondContact O-N 3.05Å
201A39.1Very low38.2Very low86 Ų86145.9 Ų145.971%0.71179%0.792SS**PPolyproline II helixtrans-65.3148-159.800000114.9R203A201-R203 PolarHBondContact O-N 3.21Å
202P38.7Very low38.7Very low135 Ų135149.6 Ų149.688%0.87780%0.798SS**PPolyproline II helixtrans-65117.9174.7-16.830.2000111.5
203R37.3Very low39.1Very low238 Ų238145.1 Ų145.190%0.89879%0.79SS**PPolyproline II helixtrans-69.2137.4166.4-74.3-75.7-149.1161.97.9109.4A201 G205A201-R203 PolarHBondContact O-N 3.21Å; R203-G205 PolarHBondContact O-N 3.01Å
204R44.4Very low39.4Very low258 Ų258150 Ų15097%0.97480%0.799SS**SBendtrans-45.7126171.4-89.4-176.8167.8-174.3-3111.4
205G41.7Very low39.6Very low74 Ų74150.6 Ų150.676%0.76380%0.802SS**  trans165.410.6173.600000116.5R203R203-G205 PolarHBondContact O-N 3.01Å
206S38.6Very low39.2Very low117 Ų117145.6 Ų145.682%0.81880%0.799SS**PPolyproline II helixtrans-72.6127.4-178.950.50000112.4
207L40.8Very low39.3Very low163 Ų163143 Ų14385%0.85379%0.794SS**PPolyproline II helixtrans-51.4135.4168.2-174.274.2000111
208P41.8Very low39.4Very low109 Ų109146.1 Ų146.171%0.70879%0.794SS**PPolyproline II helixtrans-71.4147.9173.829.2-33.6000112.1
209D38.9Very low39.3Very low110 Ų110144.9 Ų144.959%0.58879%0.788SS**PPolyproline II helixtrans-61.5148.6-177.3-91.8-41.7000114.1K211D209-K211 HydrophobicContact CB-CD 4.1Å; D209-K211 HydrophobicContact CB-CG 4.06Å; D209-K211 PolarHBondContact O-N 2.96Å; D209-K211 IonicContact OD2-NZ 2.75Å; D209-K211 PolarHBondContact OD2-NZ 2.88Å
210Q41Very low39.2Very low198 Ų198145 Ų14593%0.92578%0.778SS**THydrogen-bonded Turntrans-72.730.8-176.9-156.5-167.9-76.800115.1
211K38.4Very low38.6Very low141 Ų141143.3 Ų143.361%0.61377%0.77SS**THydrogen-bonded Turntrans-114.7-13.8-171.763.7-165.1169.7-148.50116D209D209-K211 HydrophobicContact CB-CD 4.1Å; D209-K211 HydrophobicContact CB-CG 4.06Å; D209-K211 PolarHBondContact O-N 2.96Å; D209-K211 IonicContact OD2-NZ 2.75Å; D209-K211 PolarHBondContact OD2-NZ 2.88Å
212D38.8Very low38.5Very low133 Ų133149.6 Ų149.671%0.71178%0.775SS**  trans-97.70.8-174.5-60.4-40.3000114.4R214D212-R214 VanDerWaalsContact C-N 3.34Å; D212-R214 PolarHBondContact O-N 3.49Å; D212-R214 VanDerWaalsContact O-N 3.08Å
213L41.4Very low38.2Very low149 Ų149149.4 Ų149.478%0.7877%0.766SS**  trans-84.872.5174.2-75.2169.2000111.8
214R44.4Very low38.1Very low233 Ų233145.8 Ų145.888%0.87976%0.764SS**  trans-119.765166-63.8-70.8-99-175.1-5.6109.7D212D212-R214 VanDerWaalsContact C-N 3.34Å; D212-R214 PolarHBondContact O-N 3.49Å; D212-R214 VanDerWaalsContact O-N 3.08Å
215L41.3Very low37.5Very low158 Ų158142.3 Ų142.383%0.82776%0.756SS**PPolyproline II helixtrans-86.7135.6168.6-72.8167.9000109.3
216G32.9Very low37.1Very low66 Ų66144.3 Ų144.368%0.6876%0.756SS**PPolyproline II helixtrans-70.3148.5-165.500000114.3I218G216-I218 PolarHBondContact O-N 3.33Å
217S36.5Very low36.7Very low101 Ų101143.8 Ų143.871%0.70676%0.758SS**PPolyproline II helixtrans-57125.6165.3-162.90000109.3D219S217-D219 PolarHBondContact OG-OD2 2.83Å
218I37.7Very low36.4Very low136 Ų136141.5 Ų141.570%0.69776%0.756SS**  trans-114.292.5164.366.2108.9000107.4G216 L220G216-I218 PolarHBondContact O-N 3.33Å; I218-L220 HydrophobicContact CD1-CD1 3.63Å; I218-L220 HydrophobicContact CD1-CG 3.95Å; I218-L220 PolarHBondContact O-N 3.08Å
219D32.2Very low36.1Very low139 Ų139141.6 Ų141.674%0.74376%0.76SS**  trans-70.295179.7-77.3-92.9000110.7S217 N221S217-D219 PolarHBondContact OG-OD2 2.83Å; D219-N221 VanDerWaalsContact C-N 3.3Å; D219-N221 PolarHBondContact O-N 2.93Å
220L38.3Very low35.6Very low135 Ų135141.4 Ų141.471%0.70777%0.766SS**  trans-88.970.5166.9-75.8169000110I218 W222I218-L220 HydrophobicContact CD1-CD1 3.63Å; I218-L220 HydrophobicContact CD1-CG 3.95Å; I218-L220 PolarHBondContact O-N 3.08Å; L220-W222 PolarHBondContact O-N 2.78Å
221N27Very low35.1Very low131 Ų131139.9 Ų139.970%0.70177%0.765SS**  trans-65.599.7175.2179.231.8000111.3D219D219-N221 VanDerWaalsContact C-N 3.3Å; D219-N221 PolarHBondContact O-N 2.93Å
222W35.9Very low35.3Very low218 Ų218138.6 Ų138.683%0.82677%0.771SS**  trans-92.3101.8160.8-74.198.6000109L220 L224L220-W222 PolarHBondContact O-N 2.78Å; W222-L224 PolarHBondContact O-N 2.94Å
223D31.9Very low35.2Very low130 Ų130140.3 Ų140.370%0.69578%0.777SS**  trans-61.699.2-175.7-165.1-37000111.8K225D223-K225 PolarHBondContact O-N 2.8Å; D223-K225 PolarHBondContact OD1-N 2.85Å
224L36.4Very low34.9Very low163 Ų163140.4 Ų140.485%0.85378%0.778SS**  trans-92.782.2172.4-82.6164.2000109.6W222 P226W222-L224 PolarHBondContact O-N 2.94Å; L224-P226 WeakPolarHBondContact O-CD 3.4Å
225K30.3Very low34.3Very low184 Ų184132.6 Ų132.680%0.877%0.77SS**  trans-52116173.8-176.5174.5-176.7172.30111.7D223 A227D223-K225 PolarHBondContact O-N 2.8Å; D223-K225 PolarHBondContact OD1-N 2.85Å; K225-A227 PolarHBondContact O-N 2.81Å
226P34.2Very low33.9Very low116 Ų116133.4 Ų133.475%0.75377%0.772SS**  trans-74.7126.5177.129.2-32.8000110.6L224 S228L224-P226 WeakPolarHBondContact O-CD 3.4Å; P226-S228 PolarHBondContact O-N 2.76Å
227A31Very low34Very low106 Ų106135.5 Ų135.588%0.87677%0.767SS**  trans-76.6111.2168.400000109.3K225K225-A227 PolarHBondContact O-N 2.81Å
228S34.6Very low33.9Very low116 Ų116138.1 Ų138.181%0.81177%0.774SS**  trans-67.6134.1178.852.50000112.3P226P226-S228 PolarHBondContact O-N 2.76Å
229S33.9Very low33.9Very low111 Ų111142.7 Ų142.778%0.77678%0.782SS**  trans-64.4138.7168.554.30000113.2
230S29.8Very low34.1Very low105 Ų105143.1 Ų143.173%0.73479%0.79SS**  163.1139.4129.650.10000111.9
231N30.8Very low34Very low166 Ų166143.3 Ų143.389%0.88880%0.796SS**  trans-173.2118.8144.3-96.4-18.8000109.1
232P41.9Very low34.2Very low115 Ų115140.8 Ų140.875%0.74780%0.801SS**  trans-104142.4172.536.2-28.9000113.1
233M36.8Very low34Very low168 Ų168134.5 Ų134.583%0.82880%0.804SS**  trans57.8152.5141.3-145.361.717300122.3
234D34.8Very low34.2Very low151 Ų151134 Ų13481%0.80781%0.81SS**  trans68.3140.8169.2-57.4-41.1000117.4
235G31.5Very low34.2Very low69 Ų69134.9 Ų134.971%0.71181%0.812SS**  cis168177.4-2.600000111.2
236M33.9Very low34.4Very low175 Ų175135.7 Ų135.786%0.86281%0.81SS**  trans86.7129169.4-132.671-172.400119.8
237D35.3Very low34.5Very low110 Ų110137.1 Ų137.159%0.58881%0.807SS**  trans-61.4160.8-169.828.3-83.3000121.5
238N33.8Very low35.2Very low157 Ų157137.3 Ų137.384%0.8480%0.799SS**  -158.8155.6116-110.2-51.7000115.6
239R38.5Very low35.9Very low232 Ų232137.7 Ų137.788%0.87580%0.799SS**  trans-80.1156.4-172.8-63.9171.1169.1-177.5-4114.1
240T34.8Very low36.1Very low147 Ų147140.3 Ų140.390%0.90280%0.799SS**  -162.7152.7127.8-78.40000112.5
241V36.3Very low36.5Very low140 Ų140143.1 Ų143.185%0.84880%0.8SS**  trans-72.3142-166.3163.40000116.8
242G31.3Very low37.1Very low77 Ų77140.8 Ų140.879%0.79479%0.792SS**  103119.4122.600000120.5
243G31.9Very low36.8Very low86 Ų86142.9 Ų142.989%0.88780%0.797SS**  trans157.3121164.100000113.1
244S36Very low36.5Very low119 Ų119138.7 Ų138.783%0.83280%0.797SS**  trans-114.9132.2-175.3176.60000111.8
245M36.8Very low36.9Very low182 Ų182138.3 Ų138.390%0.89780%0.8SS**  trans-166.7104.3151.8-107.3175.3-164.900114.8
246R34.9Very low37.1Very low201 Ų201143.6 Ų143.676%0.75881%0.806SS**  64.6111.7129.4-58.7-89.4-80.9-164.9-4.6122.6
247H36.5Very low37.3Very low146 Ų146140.2 Ų140.268%0.67680%0.795SS**  trans80.1158.8134.9-71.3-38.2000120
248P45.1Very low37.8Very low110 Ų110140 Ų14071%0.71480%0.799SS**  -131.4-179.1-85.827.3-2000113.9
249P49.8Very low38.1Very low124 Ų124138.3 Ų138.381%0.80580%0.797SS**  trans-94141.9-177.135.5-33.1000114.5
250E36.6Very low37.8Very low167 Ų167135.5 Ų135.578%0.7879%0.794SS**  trans-143.2151.1169.5-64.2-156.3114.600110.5
251Q38.7Very low38.1Very low163 Ų163135.1 Ų135.176%0.76279%0.791SS**  cis-151.1143.5-26.6-102.3-172.556.600105.8
252T44.6Very low37.8Very low118 Ų118133.4 Ų133.472%0.72479%0.791SS**  trans-78.9140.5168.9155.70000109.7
253N34.6Very low37.8Very low158 Ų158135.2 Ų135.285%0.84579%0.792SS**  trans168.2134.6131.7-81.8-23.9000111.2
254G30.4Very low37.7Very low81 Ų81135.1 Ų135.184%0.83578%0.783SS**  trans160.936.7174.300000117.8H256G254-H256 PolarHBondContact O-N 3.49Å
255V43.8Very low37.4Very low142 Ų142137.6 Ų137.686%0.86179%0.786SS**  trans-74.1122.6169.2176.80000109.2
256H35Very low37.5Very low181 Ų181133.7 Ų133.784%0.83878%0.783SS**  trans-140.7137.8154.2-160.3-81.9000112.2G254G254-H256 PolarHBondContact O-N 3.49Å
257T39.1Very low37.6Very low104 Ų104126.9 Ų126.964%0.63878%0.775SS**  trans-80.3151.4-165.4-49.90000112.7
258P45.2Very low37.8Very low104 Ų104124.7 Ų124.768%0.67578%0.782SS**  trans-87.7158.2-175.535-38000114.3
259P39.3Very low38.1Very low122 Ų122122.1 Ų122.179%0.79276%0.764SS**  trans-94.5106.7164.933.3-27.7000112.7
260H33.4Very low38.1Very low174 Ų174118.9 Ų118.981%0.80674%0.744SS**  trans18.3116.5142-62.2-86.6000121.5
261V42Very low38.5Very low139 Ų139116 Ų11684%0.84274%0.74SS**  19.2116.5126.1-166.30000118
262A28.5Very low39.1Very low104 Ų104109.5 Ų109.586%0.8672%0.717SS**  trans-131.7139.1144.700000109.2
263S31Very low39.6Very low114 Ų114105.6 Ų105.680%0.79770%0.697SS**  trans-97.5162.2-168.9-172.10000113.2
264A30.3Very low41Very low85 Ų85101.1 Ų101.170%0.70267%0.673SS**  trans66.8128.117000000116.1
265L30.3Very low42.4Very low171 Ų171105 Ų10590%0.89566%0.662SS**  -142.9153.255.2-88.1155.8000113.3G267L265-G267 PolarHBondContact O-N 3.37Å
266A39.3Very low43.1Very low100 Ų100104.2 Ų104.283%0.82664%0.643SS**PPolyproline II helixtrans-62.2121.7176.800000111.1A268A266-A268 PolarHBondContact O-N 3.24Å
267G36.8Very low44.4Very low58 Ų5896.3 Ų96.360%0.59861%0.609SS**PPolyproline II helixtrans-64117.6-176.600000112.2L265 V269L265-G267 PolarHBondContact O-N 3.37Å; G267-V269 PolarHBondContact O-N 3.37Å
268A40.4Very low45.7Very low100 Ų10095.5 Ų95.583%0.82660%0.6SS**PPolyproline II helixtrans-74.4117.6179.500000111.4A266 S270A266-A268 PolarHBondContact O-N 3.24Å; A268-S270 PolarHBondContact O-N 3.45Å
269V50.4Low46.8Very low55 Ų5595 Ų9533%0.33359%0.589SS.*PPolyproline II helixtrans-62.9131.7164.7-104.80000109.8G267G267-V269 PolarHBondContact O-N 3.37Å
270S50.5Low47.8Very low56 Ų5691.1 Ų91.139%0.39257%0.566SS.*PPolyproline II helixtrans-59.6129.9-179.8179.70000111.3A268 G272 A273 L274A268-S270 PolarHBondContact O-N 3.45Å; S270-G272 PolarHBondContact O-N 3.24Å; S270-G272 VanDerWaalsContact O-N 3.09Å; S270-A273 WeakPolarHBondContact O-CB 3.08Å; S270-A273 PolarHBondContact O-N 3.13Å; S270-L274 PolarHBondContact O-N 2.79Å
271P45.3Very low49.3Very low106 Ų10684.9 Ų84.969%0.68854%0.539SS*.Hα-helixtrans-55.1-32.3179.2-28.235.1000113.7R275P271-R275 WeakPolarHBondContact O-CB 3.43Å; P271-R275 PolarHBondContact O-N 3.3Å
272G50.8Low50.4Low27 Ų2785.9 Ų85.928%0.27853%0.532SS..Hα-helixtrans-72.1-32.4176.300000113.7S270 R276S270-G272 PolarHBondContact O-N 3.24Å; S270-G272 VanDerWaalsContact O-N 3.09Å; G272-R276 WeakPolarHBondContact O-CG 3.42Å; G272-R276 PolarHBondContact O-N 3.09Å; G272-R276 PolarHBondContact O-NE 2.86Å; G272-R276 PolarHBondContact O-NH1 3.29Å
273A55.2Low51.7Low37 Ų3783.6 Ų83.631%0.30651%0.513SS..Hα-helixtrans-70.7-50.5173.900000110.2S270 R275 R276 S277S270-A273 WeakPolarHBondContact O-CB 3.08Å; S270-A273 PolarHBondContact O-N 3.13Å; A273-R275 VanDerWaalsContact C-N 3.32Å; A273-R275 PolarHBondContact O-N 2.99Å; A273-R276 PolarHBondContact O-N 3.02Å; A273-S277 PolarHBondContact O-N 2.82Å; A273-S277 PolarHBondContact O-OG 2.86Å
274L64Low52.6Low64 Ų6484.7 Ų84.734%0.33551%0.507SS..Hα-helixtrans-55.7-45.9176.4-179.361.8000111.7W42 S270 S277 L278W42-L274 HydrophobicContact CZ2-CD1 4.07Å; S270-L274 PolarHBondContact O-N 2.79Å; L274-S277 PolarHBondContact O-N 2.82Å; L274-L278 HydrophobicContact CD1-CD1 4.19Å; L274-L278 HydrophobicContact CD1-CG 4.37Å; L274-L278 HydrophobicContact CG-CD1 4.04Å; L274-L278 WeakPolarHBondContact O-CG 3.44Å; L274-L278 PolarHBondContact O-N 3Å
275R58.9Low54.1Low162 Ų16285.8 Ų85.861%0.61151%0.51SS*.Hα-helixtrans-60.5-47.3177.8-179.6172.7177.7161.33.2112.7P271 A273 S277 L278 E279P271-R275 WeakPolarHBondContact O-CB 3.43Å; P271-R275 PolarHBondContact O-N 3.3Å; A273-R275 VanDerWaalsContact C-N 3.32Å; A273-R275 PolarHBondContact O-N 2.99Å; R275-S277 VanDerWaalsContact C-N 3.34Å; R275-S277 PolarHBondContact O-N 2.83Å; R275-L278 PolarHBondContact O-N 2.87Å; R275-E279 HydrophobicContact CG-CG 4.42Å; R275-E279 WeakPolarHBondContact CG-OE1 3.01Å; R275-E279 IonicContact CZ-OE1 3.46Å; R275-E279 IonicContact NE-OE1 2.77Å; R275-E279 PolarHBondContact NE-OE1 3.01Å; R275-E279 IonicContact NH2-OE1 3.22Å; R275-E279 PolarHBondContact NH2-OE1 3.18Å; R275-E279 WeakPolarHBondContact O-CB 3.4Å; R275-E279 WeakPolarHBondContact O-CG 3.41Å; R275-E279 PolarHBondContact O-N 3.13Å
276R59Low55.2Low125 Ų12582.1 Ų82.147%0.47250%0.498SS..Hα-helixtrans-64.3-38.3178.4-73.2-174.7-58.5-99.96.6112.1G272 A273 E279 A280G272-R276 WeakPolarHBondContact O-CG 3.42Å; G272-R276 PolarHBondContact O-N 3.09Å; G272-R276 PolarHBondContact O-NE 2.86Å; G272-R276 PolarHBondContact O-NH1 3.29Å; A273-R276 PolarHBondContact O-N 3.02Å; R276-E279 PolarHBondContact O-N 3.19Å; R276-A280 WeakPolarHBondContact O-CB 3.23Å; R276-A280 PolarHBondContact O-N 3.41Å
277S62Low55.8Low15 Ų1586.3 Ų86.311%0.10550%0.498CS..Hα-helixtrans-63.8-44.2174.6-60.50000111.7A273 L274 R275 A280 I281A273-S277 PolarHBondContact O-N 2.82Å; A273-S277 PolarHBondContact O-OG 2.86Å; L274-S277 PolarHBondContact O-N 2.82Å; R275-S277 VanDerWaalsContact C-N 3.34Å; R275-S277 PolarHBondContact O-N 2.83Å; S277-A280 PolarHBondContact O-N 3.5Å; S277-I281 WeakPolarHBondContact O-CD1 3.3Å; S277-I281 VanDerWaalsContact O-CG1 3.25Å; S277-I281 WeakPolarHBondContact O-CG1 3.46Å; S277-I281 PolarHBondContact O-N 3.28Å
278L67.8Low56.5Low87 Ų8786.1 Ų86.146%0.45550%0.496SS..Hα-helixtrans-64.5-39.8175.4-70.1170000112.6W40 L274 R275 K282W40-L278 HydrophobicContact CZ3-CD2 3.98Å; L274-L278 HydrophobicContact CD1-CD1 4.19Å; L274-L278 HydrophobicContact CD1-CG 4.37Å; L274-L278 HydrophobicContact CG-CD1 4.04Å; L274-L278 WeakPolarHBondContact O-CG 3.44Å; L274-L278 PolarHBondContact O-N 3Å; R275-L278 PolarHBondContact O-N 2.87Å; L278-K282 WeakPolarHBondContact O-CB 3.45Å; L278-K282 PolarHBondContact O-N 3.2Å
279E67.4Low56.7Low95 Ų9587.7 Ų87.744%0.44450%0.498SS..Hα-helixtrans-66.3-38.5175.3-74.5171.717800111.8R275 R276 K282 A283R275-E279 HydrophobicContact CG-CG 4.42Å; R275-E279 WeakPolarHBondContact CG-OE1 3.01Å; R275-E279 IonicContact CZ-OE1 3.46Å; R275-E279 IonicContact NE-OE1 2.77Å; R275-E279 PolarHBondContact NE-OE1 3.01Å; R275-E279 IonicContact NH2-OE1 3.22Å; R275-E279 PolarHBondContact NH2-OE1 3.18Å; R275-E279 WeakPolarHBondContact O-CB 3.4Å; R275-E279 WeakPolarHBondContact O-CG 3.41Å; R275-E279 PolarHBondContact O-N 3.13Å; R276-E279 PolarHBondContact O-N 3.19Å; E279-K282 PolarHBondContact O-N 2.93Å; E279-A283 WeakPolarHBondContact O-CB 3.49Å; E279-A283 PolarHBondContact O-N 3.49Å
280A60.5Low56.3Low39 Ų3990.9 Ų90.932%0.32252%0.523SS..Hα-helixtrans-64.7-46.6174.200000112.2R276 S277 K282 A283 M284R276-A280 WeakPolarHBondContact O-CB 3.23Å; R276-A280 PolarHBondContact O-N 3.41Å; S277-A280 PolarHBondContact O-N 3.5Å; A280-K282 VanDerWaalsContact C-N 3.3Å; A280-K282 PolarHBondContact O-N 2.66Å; A280-A283 WeakPolarHBondContact O-CB 3.49Å; A280-A283 PolarHBondContact O-N 2.64Å; A280-A283 VanDerWaalsContact O-N 3.11Å; A280-M284 WeakPolarHBondContact O-CG 3.21Å; A280-M284 PolarHBondContact O-N 2.93Å
281I65.8Low55.9Low44 Ų4493 Ų9323%0.22654%0.543CS..Hα-helixtrans-61.4-40.9177.2-65.5162.9000110.6W40 S277 A283 M284 S285W40-I281 HydrophobicContact CH2-CD1 3.7Å; W40-I281 HydrophobicContact CH2-CG2 4.27Å; W40-I281 HydrophobicContact CZ3-CD1 3.64Å; S277-I281 WeakPolarHBondContact O-CD1 3.3Å; S277-I281 VanDerWaalsContact O-CG1 3.25Å; S277-I281 WeakPolarHBondContact O-CG1 3.46Å; S277-I281 PolarHBondContact O-N 3.28Å; I281-A283 PolarHBondContact O-N 3.31Å; I281-M284 HydrophobicContact CG1-CE 4.22Å; I281-M284 PolarHBondContact O-N 2.78Å; I281-S285 PolarHBondContact O-N 3.01Å
282K64.1Low55.7Low159 Ų15993.6 Ų93.669%0.69155%0.55SS*.Hα-helixtrans-63.1-39173.7-175.4173.6-179.8178.10112.7L278 E279 A280 S285 S286L278-K282 WeakPolarHBondContact O-CB 3.45Å; L278-K282 PolarHBondContact O-N 3.2Å; E279-K282 PolarHBondContact O-N 2.93Å; A280-K282 VanDerWaalsContact C-N 3.3Å; A280-K282 PolarHBondContact O-N 2.66Å; K282-S285 PolarHBondContact O-N 2.79Å; K282-S286 PolarHBondContact O-N 3.15Å
283A54.8Low55.2Low57 Ų5797.1 Ų97.147%0.47158%0.577SS.*Hα-helixtrans-66.6-40.717700000112.1E279 A280 I281 S286E279-A283 WeakPolarHBondContact O-CB 3.49Å; E279-A283 PolarHBondContact O-N 3.49Å; A280-A283 WeakPolarHBondContact O-CB 3.49Å; A280-A283 PolarHBondContact O-N 2.64Å; A280-A283 VanDerWaalsContact O-N 3.11Å; I281-A283 PolarHBondContact O-N 3.31Å; A283-S286 PolarHBondContact O-N 2.84Å; A283-S286 PolarHBondContact O-OG 2.84Å
284M51.5Low54.4Low137 Ų13799.9 Ų99.968%0.67560%0.599SS**Hα-helixtrans-62.2-41.5173.2-64.5-168.4-63.300111.9A280 I281 S286 K287A280-M284 WeakPolarHBondContact O-CG 3.21Å; A280-M284 PolarHBondContact O-N 2.93Å; I281-M284 HydrophobicContact CG1-CE 4.22Å; I281-M284 PolarHBondContact O-N 2.78Å; M284-S286 VanDerWaalsContact C-N 3.31Å; M284-S286 PolarHBondContact O-N 3.34Å; M284-K287 PolarHBondContact O-N 3.3Å
285S61.6Low53.4Low108 Ų108105.3 Ų105.376%0.75563%0.627SS**Hα-helixtrans-66.3-28176.7176.20000113.9I281 K282I281-S285 PolarHBondContact O-N 3.01Å; K282-S285 PolarHBondContact O-N 2.79Å
286S52.8Low52.4Low93 Ų93102.7 Ų102.765%0.6563%0.634SS**THydrogen-bonded Turntrans-81-9.7-178.768.20000115.6K282 A283 M284 G288K282-S286 PolarHBondContact O-N 3.15Å; A283-S286 PolarHBondContact O-N 2.84Å; A283-S286 PolarHBondContact O-OG 2.84Å; M284-S286 VanDerWaalsContact C-N 3.31Å; M284-S286 PolarHBondContact O-N 3.34Å; S286-G288 VanDerWaalsContact C-N 3.34Å; S286-G288 PolarHBondContact O-N 3.36Å
287K52.9Low51.6Low189 Ų189102.3 Ų102.382%0.82265%0.648SS**  trans-87.474.4-177.6-161.2160.2-172.9173.60111.3M284M284-K287 PolarHBondContact O-N 3.3Å
288G51Low51Low54 Ų54111.2 Ų111.256%0.55771%0.705SS**PPolyproline II helixtrans-58.6158.1174.700000113.1S286S286-G288 VanDerWaalsContact C-N 3.34Å; S286-G288 PolarHBondContact O-N 3.36Å
289P44.4Very low50.1Low133 Ų133112.5 Ų112.586%0.86472%0.718SS**PPolyproline II helixtrans-64.5137.6-176.726.5-34.3000111.6A291P289-A291 PolarHBondContact O-N 2.93Å
290S41.1Very low49.2Very low122 Ų122113.4 Ų113.485%0.85373%0.732SS**PPolyproline II helixtrans-67.7126.2173.2-147.90000109.3S292S290-S292 PolarHBondContact O-N 3.17Å
291A42.4Very low48.6Very low100 Ų100117.5 Ų117.583%0.82676%0.755SS**  trans-69.8111.8-173.800000111.8P289P289-A291 PolarHBondContact O-N 2.93Å
292S41.1Very low47.6Very low118 Ų118121.8 Ų121.883%0.82579%0.786SS**PPolyproline II helixtrans-79.3124.1163.3-69.30000109.4S290 A294S290-S292 PolarHBondContact O-N 3.17Å; S292-A294 PolarHBondContact O-N 3.46Å
293A39.9Very low46.5Very low102 Ų102119.5 Ų119.584%0.84379%0.792SS**PPolyproline II helixtrans-65.9126.7178.800000111.2
294A40.2Very low46Very low94 Ų94123.7 Ų123.778%0.77781%0.814SS**PPolyproline II helixtrans-83.2124.717500000110.7S292S292-A294 PolarHBondContact O-N 3.46Å
295L41.7Very low45.6Very low178 Ų178122.7 Ų122.793%0.93282%0.824SS**PPolyproline II helixtrans-86.3124.6162.7-88.1151000108.6
296S38.1Very low44.4Very low107 Ų107123.8 Ų123.875%0.74883%0.829SS**PPolyproline II helixtrans-99.6136.8175.7-54.20000110.7
297P41.5Very low43.7Very low117 Ų117126.4 Ų126.476%0.7684%0.844SS**PPolyproline II helixtrans-80154.4163.535.6-33.4000110.2
298P49.6Very low42.8Very low203 Ų203120.7 Ų120.7100%1.31885%0.846SS**  -123.4085.838.2-33.8000114.9

Retrieved 298 of 298 residues in 37.3 ms (Link to these results)