A0A3Q0KK00_SCHMA Loading...

Putative opsin-like receptor

AlphaFold DB , UniProt , Accession A0A3Q0KK00, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 381 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
1M38.1Very low70.9Confident236 Ų23690 Ų90100%1.16347%0.467SS*.  0112.20-81.1175.5-108.100107.7Q3M1-Q3 PolarHBondContact O-N 3.26Å; M1-Q3 VanDerWaalsContact O-N 3.16Å
2K51.6Low72.1Confident173 Ų17389.8 Ų89.875%0.75248%0.476SS*.  trans-64.9112.1162.2-76.4-177.6176.4-177.30105N4K2-N4 PolarHBondContact O-N 3.35Å; K2-N4 VanDerWaalsContact O-N 3.13Å
3Q58.1Low73.5Confident166 Ų16694.8 Ų94.878%0.77650%0.503SS*.  trans-58.9119.6166.5-84.3176.6-25.100105.7M1 L5M1-Q3 PolarHBondContact O-N 3.26Å; M1-Q3 VanDerWaalsContact O-N 3.16Å; Q3-L5 PolarHBondContact O-N 3.24Å
4N64.4Low74.9Confident118 Ų11891.7 Ų91.763%0.63149%0.487SS*.  trans-6689.6172.1-78-13000106.9K2 T6 I29K2-N4 PolarHBondContact O-N 3.35Å; K2-N4 VanDerWaalsContact O-N 3.13Å; N4-T6 PolarHBondContact O-N 3.16Å; N4-T6 VanDerWaalsContact O-N 3.16Å; N4-I29 HydrophobicContact CB-CD1 4.42Å; N4-I29 HydrophobicContact CB-CG2 4.17Å
5L75.6Confident76Confident84 Ų8494.2 Ų94.244%0.4450%0.5SS..  trans-65.8116.2175.6-73.8123.4000107.6Q3 Q30Q3-L5 PolarHBondContact O-N 3.24Å; L5-Q30 PolarHBondContact O-N 3.41Å; L5-Q30 VanDerWaalsContact O-N 3.14Å
6T81.7Confident77.1Confident46 Ų4693.7 Ų93.728%0.28250%0.498SS..BIsolated β-bridgetrans-77.7162.1168.864.30000108.9N4 A8 T9 Q30N4-T6 PolarHBondContact O-N 3.16Å; N4-T6 VanDerWaalsContact O-N 3.16Å; T6-A8 PolarHBondContact O-N 3.22Å; T6-T9 PolarHBondContact O-N 2.96Å; T6-T9 PolarHBondContact O-OG1 3.25Å; T6-Q30 PolarHBondContact O-NE2 3.28Å
7F81.5Confident78.2Confident0 Ų088.2 Ų88.20%047%0.468CS..G310 helixtrans-63.1-24.1172.7-71.7-66.8000112.8T9 L10 F28 Q30 Y36 G183 H185 P297F7-T9 PolarHBondContact O-N 3.48Å; F7-L10 HydrophobicContact CD1-CD1 3.57Å; F7-L10 HydrophobicContact CE1-CD1 4.25Å; F7-L10 PolarHBondContact O-N 2.79Å; F7-F28 HydrophobicContact CD2-CB 3.9Å; F7-F28 WeakPolarHBondContact CD2-O 3.44Å; F7-F28 HydrophobicContact CE2-CB 3.93Å; F7-F28 PolarHBondContact N-O 3.3Å; F7-Q30 HydrophobicContact CD1-CG 3.81Å; F7-Q30 HydrophobicContact CE1-CB 4.5Å; F7-Q30 HydrophobicContact CE1-CG 3.67Å; F7-Q30 HydrophobicContact CG-CG 4.39Å; F7-Q30 HydrophobicContact CZ-CG 4.15Å; F7-Y36 WeakPolarHBondContact CE1-OH 3.44Å; F7-G183 WeakPolarHBondContact CZ-O 3.33Å; F7-H185 AromaticContact CD1-CE1 3.25Å; F7-H185 WeakPolarHBondContact CD1-CE1 3.47Å; F7-H185 AromaticContact CD1-CG 3.83Å; F7-H185 AromaticContact CD1-ND1 2.98Å; F7-H185 WeakPolarHBondContact CD1-ND1 3.23Å; F7-H185 AromaticContact CD2-CE1 3.81Å; F7-H185 AromaticContact CE1-CE1 3.71Å; F7-H185 AromaticContact CE1-ND1 3.09Å; F7-H185 WeakPolarHBondContact CE1-ND1 3.2Å; F7-H185 AromaticContact CG-CE1 3.29Å; F7-H185 WeakPolarHBondContact CG-CE1 3.38Å; F7-H185 AromaticContact CG-ND1 3.57Å; F7-H185 AromaticContact CZ-ND1 3.75Å; F7-P297 HydrophobicContact CE2-CG 3.87Å; F7-P297 HydrophobicContact CZ-CG 4.41Å
8A74.3Confident79.1Confident58 Ų5885.3 Ų85.348%0.47946%0.459SS..G310 helixtrans-65-20.1-179.900000114.2T6 H26T6-A8 PolarHBondContact O-N 3.22Å; A8-H26 HydrophobicContact CB-CB 4.13Å
9T79.3Confident79.8Confident78 Ų7885.2 Ų85.248%0.47947%0.466SS..G310 helixtrans-109.111.7-173.960.90000113.7T6 F7T6-T9 PolarHBondContact O-N 2.96Å; T6-T9 PolarHBondContact O-OG1 3.25Å; F7-T9 PolarHBondContact O-N 3.48Å
10L84.9Confident80.6Confident15 Ų1582.3 Ų82.38%0.07945%0.449CS..SBendtrans-77.3-21.9-171.7-89.7177.9000115.2F7 P12 Q30 R102F7-L10 HydrophobicContact CD1-CD1 3.57Å; F7-L10 HydrophobicContact CE1-CD1 4.25Å; F7-L10 PolarHBondContact O-N 2.79Å; L10-P12 VanDerWaalsContact C-CD 3.47Å; L10-Q30 HydrophobicContact CD1-CG 4.34Å; L10-R102 HydrophobicContact CD1-CB 4.32Å; L10-R102 HydrophobicContact CD2-CB 4.16Å; L10-R102 PolarHBondContact O-NH1 3.24Å
11W90.2Very high81.3Confident16 Ų1678.8 Ų78.86%0.06143%0.431CS..  trans-129.661.9-175.6-59.2-87.6000111.8D13 D14 F17 A18 V21 R102 W103 H185W11-D13 PolarHBondContact O-N 3.4Å; W11-D14 HydrophobicContact CB-CB 4.25Å; W11-D14 PolarHBondContact O-N 2.98Å; W11-F17 HydrophobicContact CB-CD1 4.49Å; W11-F17 AromaticContact CD1-CD1 3.65Å; W11-F17 AromaticContact CD2-CD1 3.45Å; W11-F17 HydrophobicContact CD2-CD1 3.45Å; W11-F17 VanDerWaalsContact CD2-CD1 3.45Å; W11-F17 AromaticContact CD2-CE1 3.57Å; W11-F17 HydrophobicContact CD2-CE1 3.57Å; W11-F17 AromaticContact CE2-CD1 3.47Å; W11-F17 VanDerWaalsContact CE2-CD1 3.47Å; W11-F17 AromaticContact CE2-CE1 3.19Å; W11-F17 AromaticContact CE3-CD1 3.98Å; W11-F17 HydrophobicContact CE3-CD1 3.98Å; W11-F17 AromaticContact CE3-CE1 3.93Å; W11-F17 HydrophobicContact CE3-CE1 3.93Å; W11-F17 AromaticContact CG-CD1 3.65Å; W11-F17 HydrophobicContact CG-CD1 3.65Å; W11-F17 HydrophobicContact CG-CE1 4.22Å; W11-F17 AromaticContact CH2-CE1 3.76Å; W11-F17 HydrophobicContact CH2-CE1 3.76Å; W11-F17 HydrophobicContact CZ2-CD1 4.09Å; W11-F17 AromaticContact CZ2-CE1 3.32Å; W11-F17 HydrophobicContact CZ2-CE1 3.32Å; W11-F17 HydrophobicContact CZ2-CZ 4.09Å; W11-F17 HydrophobicContact CZ3-CE1 4.02Å; W11-F17 AromaticContact NE1-CD1 3.53Å; W11-F17 AromaticContact NE1-CE1 3.56Å; W11-A18 HydrophobicContact CB-CB 4.34Å; W11-V21 HydrophobicContact CE3-CG2 3.96Å; W11-V21 HydrophobicContact CH2-CG2 4.41Å; W11-V21 HydrophobicContact CZ3-CG2 3.7Å; W11-R102 HydrophobicContact CZ2-CB 4.01Å; W11-W103 PolarHBondContact NE1-O 3.15Å; W11-H185 HydrophobicContact CH2-CB 3.53Å; W11-H185 AromaticContact CH2-CD2 3.6Å; W11-H185 AromaticContact CH2-CG 3.72Å; W11-H185 HydrophobicContact CZ2-CB 4.03Å
12P85.6Confident84Confident88 Ų8869 Ų6957%0.57138%0.382SS*.THydrogen-bonded Turntrans-64.3-26.6179.328-34.9000113L10L10-P12 VanDerWaalsContact C-CD 3.47Å
13D89.8Confident86Confident154 Ų15464.8 Ų64.882%0.82437%0.374SS*.THydrogen-bonded Turntrans-102.20.3-176.9-50.3-53.5000113.3W11W11-D13 PolarHBondContact O-N 3.4Å
14D92.7Very high87.7Confident52 Ų5257.5 Ų57.528%0.27834%0.34SS..  trans-131.575.5-178.6-171.8-8.9000110.2W11 D16 F17 A18W11-D14 HydrophobicContact CB-CB 4.25Å; W11-D14 PolarHBondContact O-N 2.98Å; D14-D16 PolarHBondContact O-N 3.08Å; D14-D16 PolarHBondContact OD1-N 3.48Å; D14-F17 HydrophobicContact CB-CB 4.29Å; D14-F17 PolarHBondContact O-N 2.89Å; D14-F17 WeakPolarHBondContact OD1-CB 3.43Å; D14-F17 PolarHBondContact OD1-N 3.07Å; D14-F17 VanDerWaalsContact OD2-CB 3.31Å; D14-F17 WeakPolarHBondContact OD2-CB 3.31Å; D14-A18 WeakPolarHBondContact O-CB 3.5Å; D14-A18 PolarHBondContact O-N 3.39Å
15N92Very high89.1Confident129 Ų12951.9 Ų51.969%0.6931%0.31SS*.Hα-helixtrans-63.5-29.7-179.7-70.7-38.9000112.8S19N15-S19 WeakPolarHBondContact O-CB 3.22Å; N15-S19 PolarHBondContact O-N 3.07Å
16D94.3Very high89.9Confident86 Ų8651.4 Ų51.446%0.4631%0.305SS..Hα-helixtrans-70.1-44179.2-172.833.2000110.3D14 S19 K107D14-D16 PolarHBondContact O-N 3.08Å; D14-D16 PolarHBondContact OD1-N 3.48Å; D16-S19 PolarHBondContact O-N 3.14Å; D16-S19 PolarHBondContact O-OG 3.12Å; D16-K107 WeakPolarHBondContact OD1-CD 3.28Å; D16-K107 IonicContact OD1-NZ 3.04Å; D16-K107 PolarHBondContact OD1-NZ 3.17Å; D16-K107 VanDerWaalsContact OD2-CD 3.23Å; D16-K107 WeakPolarHBondContact OD2-CD 3.42Å; D16-K107 IonicContact OD2-NZ 3.8Å
17F95.3Very high90.3Very high0 Ų054.5 Ų54.50%032%0.315CS..Hα-helixtrans-66.8-43.6171.6-174.6-90.1000112.4W11 D14 S19 I20 V21 W103 C110 P181W11-F17 HydrophobicContact CB-CD1 4.49Å; W11-F17 AromaticContact CD1-CD1 3.65Å; W11-F17 AromaticContact CD2-CD1 3.45Å; W11-F17 HydrophobicContact CD2-CD1 3.45Å; W11-F17 VanDerWaalsContact CD2-CD1 3.45Å; W11-F17 AromaticContact CD2-CE1 3.57Å; W11-F17 HydrophobicContact CD2-CE1 3.57Å; W11-F17 AromaticContact CE2-CD1 3.47Å; W11-F17 VanDerWaalsContact CE2-CD1 3.47Å; W11-F17 AromaticContact CE2-CE1 3.19Å; W11-F17 AromaticContact CE3-CD1 3.98Å; W11-F17 HydrophobicContact CE3-CD1 3.98Å; W11-F17 AromaticContact CE3-CE1 3.93Å; W11-F17 HydrophobicContact CE3-CE1 3.93Å; W11-F17 AromaticContact CG-CD1 3.65Å; W11-F17 HydrophobicContact CG-CD1 3.65Å; W11-F17 HydrophobicContact CG-CE1 4.22Å; W11-F17 AromaticContact CH2-CE1 3.76Å; W11-F17 HydrophobicContact CH2-CE1 3.76Å; W11-F17 HydrophobicContact CZ2-CD1 4.09Å; W11-F17 AromaticContact CZ2-CE1 3.32Å; W11-F17 HydrophobicContact CZ2-CE1 3.32Å; W11-F17 HydrophobicContact CZ2-CZ 4.09Å; W11-F17 HydrophobicContact CZ3-CE1 4.02Å; W11-F17 AromaticContact NE1-CD1 3.53Å; W11-F17 AromaticContact NE1-CE1 3.56Å; D14-F17 HydrophobicContact CB-CB 4.29Å; D14-F17 PolarHBondContact O-N 2.89Å; D14-F17 WeakPolarHBondContact OD1-CB 3.43Å; D14-F17 PolarHBondContact OD1-N 3.07Å; D14-F17 VanDerWaalsContact OD2-CB 3.31Å; D14-F17 WeakPolarHBondContact OD2-CB 3.31Å; F17-S19 PolarHBondContact O-N 2.87Å; F17-S19 VanDerWaalsContact O-N 3.13Å; F17-I20 HydrophobicContact CD2-CD1 4.19Å; F17-I20 HydrophobicContact CD2-CG1 4.4Å; F17-I20 HydrophobicContact CE2-CD1 4.22Å; F17-I20 WeakPolarHBondContact O-CG1 3.43Å; F17-I20 PolarHBondContact O-N 3.48Å; F17-I20 VanDerWaalsContact O-N 3.07Å; F17-V21 HydrophobicContact CD1-CG2 4.18Å; F17-V21 HydrophobicContact CE1-CG2 3.89Å; F17-W103 AromaticContact CD2-CD1 3.93Å; F17-W103 HydrophobicContact CE2-CB 4.27Å; F17-W103 AromaticContact CE2-CD1 3.21Å; F17-W103 AromaticContact CE2-CG 3.91Å; F17-W103 HydrophobicContact CE2-CG 3.91Å; F17-W103 AromaticContact CE2-NE1 3.9Å; F17-W103 HydrophobicContact CZ-CB 3.76Å; F17-W103 AromaticContact CZ-CD1 3.62Å; F17-W103 AromaticContact CZ-CG 3.91Å; F17-W103 HydrophobicContact CZ-CG 3.91Å; F17-C110 HydrophobicContact CD2-CB 4.38Å; F17-C110 HydrophobicContact CE2-CB 3.76Å; F17-P181 HydrophobicContact CE1-CG 3.87Å; F17-P181 HydrophobicContact CE2-CG 3.91Å; F17-P181 HydrophobicContact CZ-CB 4.13Å; F17-P181 HydrophobicContact CZ-CG 3.28Å
18A93.8Very high90.9Very high36 Ų3656.4 Ų56.430%0.29832%0.323SS..Hα-helixtrans-56.6-31.1177.700000112.2W11 D14 I20 V21W11-A18 HydrophobicContact CB-CB 4.34Å; D14-A18 WeakPolarHBondContact O-CB 3.5Å; D14-A18 PolarHBondContact O-N 3.39Å; A18-I20 VanDerWaalsContact C-N 3.29Å; A18-I20 PolarHBondContact O-N 3.38Å; A18-V21 PolarHBondContact O-N 3.44Å
19S93.2Very high91.7Very high84 Ų8458.1 Ų58.159%0.58732%0.324SS*.Hα-helixtrans-66.1-24.4178.779.80000114.9N15 D16 F17N15-S19 WeakPolarHBondContact O-CB 3.22Å; N15-S19 PolarHBondContact O-N 3.07Å; D16-S19 PolarHBondContact O-N 3.14Å; D16-S19 PolarHBondContact O-OG 3.12Å; F17-S19 PolarHBondContact O-N 2.87Å; F17-S19 VanDerWaalsContact O-N 3.13Å
20I95.3Very high92.3Very high26 Ų2656 Ų5613%0.13331%0.308CS..THydrogen-bonded Turntrans-96.2-2.6178.664.8157.1000113.1F17 A18 H22 K107 C110 I180 P181F17-I20 HydrophobicContact CD2-CD1 4.19Å; F17-I20 HydrophobicContact CD2-CG1 4.4Å; F17-I20 HydrophobicContact CE2-CD1 4.22Å; F17-I20 WeakPolarHBondContact O-CG1 3.43Å; F17-I20 PolarHBondContact O-N 3.48Å; F17-I20 VanDerWaalsContact O-N 3.07Å; A18-I20 VanDerWaalsContact C-N 3.29Å; A18-I20 PolarHBondContact O-N 3.38Å; I20-H22 PolarHBondContact O-N 3Å; I20-K107 HydrophobicContact CD1-CG 3.92Å; I20-K107 HydrophobicContact CG1-CG 4.4Å; I20-K107 HydrophobicContact CG2-CD 4.14Å; I20-K107 HydrophobicContact CG2-CG 4.26Å; I20-C110 HydrophobicContact CD1-CB 4.31Å; I20-I180 WeakPolarHBondContact O-CG2 3.32Å; I20-P181 HydrophobicContact CD1-CG 4.46Å; I20-P181 WeakPolarHBondContact O-CD 3.32Å
21V95.5Very high92.6Very high10 Ų1056 Ų566%0.06131%0.309CS..SBendtrans-73.2115.7174.3-179.60000108.7W11 F17 A18 S23 P181 H185W11-V21 HydrophobicContact CE3-CG2 3.96Å; W11-V21 HydrophobicContact CH2-CG2 4.41Å; W11-V21 HydrophobicContact CZ3-CG2 3.7Å; F17-V21 HydrophobicContact CD1-CG2 4.18Å; F17-V21 HydrophobicContact CE1-CG2 3.89Å; A18-V21 PolarHBondContact O-N 3.44Å; V21-S23 PolarHBondContact O-N 2.96Å; V21-P181 HydrophobicContact CG2-CG 4.18Å; V21-H185 WeakPolarHBondContact CG1-NE2 3.49Å
22H94.9Very high92.8Very high29 Ų2958.8 Ų58.813%0.13433%0.325CS..  trans-65.4132.5-178.4-172.9-77000111.5I20 H24 W25 I180 L193 S194I20-H22 PolarHBondContact O-N 3Å; H22-H24 WeakPolarHBondContact ND1-CB 3.5Å; H22-H24 PolarHBondContact ND1-N 3.05Å; H22-H24 PolarHBondContact O-N 3.08Å; H22-W25 PolarHBondContact O-N 3.24Å; H22-I180 HydrophobicContact CB-CD1 3.81Å; H22-L193 HydrophobicContact CB-CD1 3.89Å; H22-S194 PolarHBondContact CD2-OG 3.13Å; H22-S194 VanDerWaalsContact CD2-OG 3.3Å
23S92.9Very high93.2Very high85 Ų8556.9 Ų56.959%0.59431%0.312SS*.G310 helixtrans-56.5-28.8-173.9620000114.9V21 W25 H26V21-S23 PolarHBondContact O-N 2.96Å; S23-W25 PolarHBondContact O-N 3.21Å; S23-W25 VanDerWaalsContact O-N 3.13Å; S23-H26 WeakPolarHBondContact O-CB 3.24Å; S23-H26 PolarHBondContact O-N 3.06Å
24H94Very high93.5Very high13 Ų1354.2 Ų54.26%0.0630%0.298CS..G310 helixtrans-48.8-36.5171.9175.174.1000112.8H22 K27 F28 L193 R292 L295H22-H24 WeakPolarHBondContact ND1-CB 3.5Å; H22-H24 PolarHBondContact ND1-N 3.05Å; H22-H24 PolarHBondContact O-N 3.08Å; H24-K27 VanDerWaalsContact CE1-CE 3.49Å; H24-K27 WeakPolarHBondContact CE1-CE 3.36Å; H24-K27 PolarHBondContact CE1-NZ 3.19Å; H24-K27 WeakPolarHBondContact ND1-CE 3.29Å; H24-K27 PolarHBondContact ND1-NZ 3.28Å; H24-K27 WeakPolarHBondContact O-CD 3.47Å; H24-K27 WeakPolarHBondContact O-CE 3.42Å; H24-K27 VanDerWaalsContact O-CG 3.29Å; H24-K27 WeakPolarHBondContact O-CG 3.49Å; H24-F28 AromaticContact NE2-CE2 3.77Å; H24-L193 HydrophobicContact CB-CD1 4.44Å; H24-R292 PolarHBondContact CE1-O 3.5Å; H24-L295 PolarHBondContact CE1-O 3.42Å; H24-L295 PolarHBondContact NE2-O 3.48Å
25W94.3Very high93.8Very high0 Ų056.9 Ų56.90%031%0.305CS..G310 helixtrans-77.2-22.9-177-60.8131000113.9H22 S23 K27 F28 P181 H185 L193 L295H22-W25 PolarHBondContact O-N 3.24Å; S23-W25 PolarHBondContact O-N 3.21Å; S23-W25 VanDerWaalsContact O-N 3.13Å; W25-K27 PolarHBondContact O-N 3.39Å; W25-K27 VanDerWaalsContact O-N 3.14Å; W25-F28 HydrophobicContact CE3-CD2 4.1Å; W25-F28 HydrophobicContact CE3-CE2 4.16Å; W25-F28 HydrophobicContact CZ3-CE2 4.44Å; W25-F28 PolarHBondContact O-N 2.9Å; W25-P181 PolarHBondContact NE1-O 3.21Å; W25-H185 AromaticContact CD1-NE2 3.69Å; W25-H185 AromaticContact CG-CE1 3.76Å; W25-H185 AromaticContact CG-NE2 3.75Å; W25-L193 HydrophobicContact CZ2-CD1 3.74Å; W25-L295 HydrophobicContact CH2-CD2 3.59Å; W25-L295 HydrophobicContact CH2-CG 4.08Å; W25-L295 HydrophobicContact CZ2-CD2 4.23Å; W25-L295 HydrophobicContact CZ3-CD2 4.43Å
26H91.9Very high94Very high74 Ų7450.8 Ų50.834%0.34327%0.272SS..G310 helixtrans-63.6-22.1-177.1-62.9165.3000113.7A8 S23 F28A8-H26 HydrophobicContact CB-CB 4.13Å; S23-H26 WeakPolarHBondContact O-CB 3.24Å; S23-H26 PolarHBondContact O-N 3.06Å; H26-F28 PolarHBondContact O-N 2.87Å
27K90.9Very high94.2Very high111 Ų11151.3 Ų51.348%0.48327%0.268SS..G310 helixtrans-75.2-9.7177.476.6-161.9-177.5-179.50113.7H24 W25 D293H24-K27 VanDerWaalsContact CE1-CE 3.49Å; H24-K27 WeakPolarHBondContact CE1-CE 3.36Å; H24-K27 PolarHBondContact CE1-NZ 3.19Å; H24-K27 WeakPolarHBondContact ND1-CE 3.29Å; H24-K27 PolarHBondContact ND1-NZ 3.28Å; H24-K27 WeakPolarHBondContact O-CD 3.47Å; H24-K27 WeakPolarHBondContact O-CE 3.42Å; H24-K27 VanDerWaalsContact O-CG 3.29Å; H24-K27 WeakPolarHBondContact O-CG 3.49Å; W25-K27 PolarHBondContact O-N 3.39Å; W25-K27 VanDerWaalsContact O-N 3.14Å; K27-D293 IonicContact NZ-OD1 2.74Å
28F92.8Very high94.4Very high41 Ų4155.9 Ų55.918%0.1829%0.292CS..SBendtrans-101.8144.8-178.2-61.7-80.7000112.2F7 H24 W25 H26 L295 T296 P297F7-F28 HydrophobicContact CD2-CB 3.9Å; F7-F28 WeakPolarHBondContact CD2-O 3.44Å; F7-F28 HydrophobicContact CE2-CB 3.93Å; F7-F28 PolarHBondContact N-O 3.3Å; H24-F28 AromaticContact NE2-CE2 3.77Å; W25-F28 HydrophobicContact CE3-CD2 4.1Å; W25-F28 HydrophobicContact CE3-CE2 4.16Å; W25-F28 HydrophobicContact CZ3-CE2 4.44Å; W25-F28 PolarHBondContact O-N 2.9Å; H26-F28 PolarHBondContact O-N 2.87Å; F28-L295 VanDerWaalsContact CZ-O 3.24Å; F28-L295 WeakPolarHBondContact CZ-O 3.33Å; F28-T296 HydrophobicContact CE1-CG2 4.11Å; F28-T296 HydrophobicContact CZ-CG2 4.46Å; F28-P297 HydrophobicContact CB-CG 3.97Å; F28-P297 HydrophobicContact CD1-CG 4.24Å; F28-P297 HydrophobicContact CD2-CG 4.27Å; F28-P297 HydrophobicContact CG-CG 3.91Å
29I91.9Very high94.6Very high94 Ų9454.7 Ų54.748%0.48228%0.281SS..BIsolated β-bridgetrans-81147.9166.8-57.9167.8000107.8N4N4-I29 HydrophobicContact CB-CD1 4.42Å; N4-I29 HydrophobicContact CB-CG2 4.17Å
30Q91.1Very high94.8Very high34 Ų3450.7 Ų50.716%0.15925%0.253CS..PPolyproline II helixtrans-57.9137.7172.7-74.3174.251.100111.4L5 T6 F7 L10L5-Q30 PolarHBondContact O-N 3.41Å; L5-Q30 VanDerWaalsContact O-N 3.14Å; T6-Q30 PolarHBondContact O-NE2 3.28Å; F7-Q30 HydrophobicContact CD1-CG 3.81Å; F7-Q30 HydrophobicContact CE1-CB 4.5Å; F7-Q30 HydrophobicContact CE1-CG 3.67Å; F7-Q30 HydrophobicContact CG-CG 4.39Å; F7-Q30 HydrophobicContact CZ-CG 4.15Å; L10-Q30 HydrophobicContact CD1-CG 4.34Å
31P92.5Very high95Very high13 Ų1353.7 Ų53.78%0.08427%0.269CS..PPolyproline II helixtrans-51.9158.9168.2-26.332.1000112.8Y35 Y36 F184 F298P31-Y35 HydrophobicContact CB-CD2 4.19Å; P31-Y36 HydrophobicContact CB-CD2 4.33Å; P31-Y36 HydrophobicContact CB-CE2 3.8Å; P31-Y36 WeakPolarHBondContact CD-OH 3.39Å; P31-Y36 HydrophobicContact CG-CE2 4.07Å; P31-Y36 WeakPolarHBondContact O-CE2 3.16Å; P31-F184 HydrophobicContact CB-CE1 4.27Å; P31-F184 HydrophobicContact CB-CZ 4.1Å; P31-F184 HydrophobicContact CG-CD1 4.43Å; P31-F184 HydrophobicContact CG-CD2 4.23Å; P31-F184 HydrophobicContact CG-CE1 4.03Å; P31-F184 HydrophobicContact CG-CE2 3.8Å; P31-F184 HydrophobicContact CG-CZ 3.7Å; P31-F298 HydrophobicContact CB-CE2 4.3Å; P31-F298 HydrophobicContact CB-CZ 4Å; P31-F298 HydrophobicContact CG-CE2 4.31Å; P31-F298 HydrophobicContact CG-CZ 4.36Å
32D93.4Very high95.1Very high75 Ų7557.3 Ų57.340%0.40128%0.282SS..PPolyproline II helixtrans-57.1137.2170.7-171.3-80.6000110.5L34 Y35D32-L34 PolarHBondContact O-N 3.47Å; D32-L34 VanDerWaalsContact OD1-CB 3.24Å; D32-L34 WeakPolarHBondContact OD1-CB 3.48Å; D32-L34 PolarHBondContact OD1-N 2.92Å; D32-Y35 HydrophobicContact CB-CD2 3.78Å; D32-Y35 HydrophobicContact CB-CE2 3.87Å; D32-Y35 WeakPolarHBondContact O-CD2 3.24Å; D32-Y35 PolarHBondContact O-N 2.94Å
33P94.6Very high95.3Very high48 Ų4856 Ų5631%0.31228%0.276SS..Hα-helixtrans-45.6-32.7175.6-35.339.6000115.3Y35 Y36 Y37P33-Y35 VanDerWaalsContact C-N 3.28Å; P33-Y35 PolarHBondContact O-N 3.42Å; P33-Y36 WeakPolarHBondContact O-CB 3.48Å; P33-Y36 PolarHBondContact O-N 3.33Å; P33-Y36 VanDerWaalsContact O-N 3.14Å; P33-Y37 HydrophobicContact CB-CE2 3.99Å; P33-Y37 VanDerWaalsContact O-CD2 3.24Å; P33-Y37 WeakPolarHBondContact O-CD2 3.36Å; P33-Y37 PolarHBondContact O-N 3.3Å
34L97.1Very high95.5Very high98 Ų9852.3 Ų52.351%0.51325%0.251SS..Hα-helixtrans-54.9-43.2176.7178.261.9000112.3D32 Y36 Y37 L38D32-L34 PolarHBondContact O-N 3.47Å; D32-L34 VanDerWaalsContact OD1-CB 3.24Å; D32-L34 WeakPolarHBondContact OD1-CB 3.48Å; D32-L34 PolarHBondContact OD1-N 2.92Å; L34-Y36 VanDerWaalsContact C-N 3.3Å; L34-Y36 PolarHBondContact O-N 2.55Å; L34-Y37 PolarHBondContact O-N 2.94Å; L34-L38 HydrophobicContact CD1-CD1 4.4Å; L34-L38 HydrophobicContact CD1-CG 4.31Å; L34-L38 HydrophobicContact CG-CD1 4.16Å; L34-L38 HydrophobicContact CG-CG 4.48Å; L34-L38 VanDerWaalsContact O-CG 3.32Å; L34-L38 WeakPolarHBondContact O-CG 3.4Å; L34-L38 PolarHBondContact O-N 3.44Å
35Y97.3Very high95.7Very high109 Ų10956.4 Ų56.443%0.42727%0.272SS..Hα-helixtrans-64.2-39-179.6-63.8-70.1000111.5P31 D32 P33 L38 V39 F298P31-Y35 HydrophobicContact CB-CD2 4.19Å; D32-Y35 HydrophobicContact CB-CD2 3.78Å; D32-Y35 HydrophobicContact CB-CE2 3.87Å; D32-Y35 WeakPolarHBondContact O-CD2 3.24Å; D32-Y35 PolarHBondContact O-N 2.94Å; P33-Y35 VanDerWaalsContact C-N 3.28Å; P33-Y35 PolarHBondContact O-N 3.42Å; Y35-L38 PolarHBondContact O-N 3.29Å; Y35-V39 WeakPolarHBondContact O-CB 3.25Å; Y35-V39 VanDerWaalsContact O-CG2 3.3Å; Y35-V39 WeakPolarHBondContact O-CG2 3.39Å; Y35-V39 PolarHBondContact O-N 2.81Å; Y35-F298 AromaticContact CD1-CE1 3.76Å; Y35-F298 HydrophobicContact CD1-CE1 3.76Å; Y35-F298 HydrophobicContact CD1-CZ 4.12Å; Y35-F298 HydrophobicContact CD2-CE1 4.21Å; Y35-F298 AromaticContact CD2-CZ 3.74Å; Y35-F298 HydrophobicContact CD2-CZ 3.74Å; Y35-F298 HydrophobicContact CE1-CE1 4.06Å; Y35-F298 HydrophobicContact CE1-CZ 4.26Å; Y35-F298 HydrophobicContact CE2-CE1 4.48Å; Y35-F298 AromaticContact CE2-CZ 3.89Å; Y35-F298 HydrophobicContact CE2-CZ 3.89Å; Y35-F298 AromaticContact CG-CE1 3.84Å; Y35-F298 HydrophobicContact CG-CE1 3.84Å; Y35-F298 AromaticContact CG-CZ 3.85Å; Y35-F298 HydrophobicContact CG-CZ 3.85Å
36Y97.6Very high96Very high1 Ų157 Ų570%0.00428%0.276CS..Hα-helixtrans-63.2-44.9175.5-74.3-83.3000112.2F7 P31 P33 L34 L38 V39 G40 A98 H101 F184 T186F7-Y36 WeakPolarHBondContact CE1-OH 3.44Å; P31-Y36 HydrophobicContact CB-CD2 4.33Å; P31-Y36 HydrophobicContact CB-CE2 3.8Å; P31-Y36 WeakPolarHBondContact CD-OH 3.39Å; P31-Y36 HydrophobicContact CG-CE2 4.07Å; P31-Y36 WeakPolarHBondContact O-CE2 3.16Å; P33-Y36 WeakPolarHBondContact O-CB 3.48Å; P33-Y36 PolarHBondContact O-N 3.33Å; P33-Y36 VanDerWaalsContact O-N 3.14Å; L34-Y36 VanDerWaalsContact C-N 3.3Å; L34-Y36 PolarHBondContact O-N 2.55Å; Y36-L38 PolarHBondContact O-N 3.36Å; Y36-V39 PolarHBondContact O-N 3.07Å; Y36-G40 PolarHBondContact O-N 3.03Å; Y36-A98 WeakPolarHBondContact CB-O 3.38Å; Y36-H101 WeakPolarHBondContact CB-CD2 3.13Å; Y36-H101 HydrophobicContact CD1-CB 4.13Å; Y36-H101 HydrophobicContact CD2-CB 4.21Å; Y36-H101 HydrophobicContact CE1-CB 4.2Å; Y36-H101 HydrophobicContact CE2-CB 4.28Å; Y36-H101 HydrophobicContact CG-CB 4.12Å; Y36-H101 AromaticContact CG-CD2 3.7Å; Y36-F184 HydrophobicContact CD1-CD1 4.11Å; Y36-F184 HydrophobicContact CE1-CB 4.35Å; Y36-F184 AromaticContact CE1-CD1 3.95Å; Y36-F184 HydrophobicContact CE1-CD1 3.95Å; Y36-F184 HydrophobicContact CE1-CG 4.48Å; Y36-F184 WeakPolarHBondContact CE1-O 3.4Å; Y36-F184 PolarHBondContact OH-O 2.94Å; Y36-T186 HydrophobicContact CD1-CG2 3.71Å; Y36-T186 HydrophobicContact CE1-CG2 3.63Å
37Y98.3Very high96.3Very high96 Ų9653.5 Ų53.538%0.37626%0.26SS..Hα-helixtrans-63.1-40.7175.6-61.4-43.4000112.4P33 L34 G40 I41 F99 H101P33-Y37 HydrophobicContact CB-CE2 3.99Å; P33-Y37 VanDerWaalsContact O-CD2 3.24Å; P33-Y37 WeakPolarHBondContact O-CD2 3.36Å; P33-Y37 PolarHBondContact O-N 3.3Å; L34-Y37 PolarHBondContact O-N 2.94Å; Y37-G40 PolarHBondContact O-N 2.93Å; Y37-I41 VanDerWaalsContact O-CG1 3.31Å; Y37-I41 WeakPolarHBondContact O-CG1 3.3Å; Y37-I41 PolarHBondContact O-N 3.36Å; Y37-F99 AromaticContact CD1-CD1 3.53Å; Y37-F99 HydrophobicContact CD1-CD1 3.53Å; Y37-F99 AromaticContact CD1-CE1 3.92Å; Y37-F99 HydrophobicContact CD1-CE1 3.92Å; Y37-F99 HydrophobicContact CD1-CG 4.41Å; Y37-F99 AromaticContact CE1-CD1 3.96Å; Y37-F99 HydrophobicContact CE1-CD1 3.96Å; Y37-H101 AromaticContact CE1-NE2 3.32Å; Y37-H101 VanDerWaalsContact CE1-NE2 3.32Å; Y37-H101 WeakPolarHBondContact CE1-NE2 3.26Å; Y37-H101 AromaticContact CE2-NE2 3.92Å; Y37-H101 AromaticContact CZ-CE1 3.8Å; Y37-H101 AromaticContact CZ-NE2 3.23Å; Y37-H101 PolarHBondContact OH-CE1 3.24Å; Y37-H101 PolarHBondContact OH-NE2 2.87Å
38L98.4Very high96.6Very high96 Ų9652.1 Ų52.150%0.50326%0.257SS..Hα-helixtrans-62.3-44.8175.5-69.6174.6000111.8L34 Y35 Y36 G40 Y42L34-L38 HydrophobicContact CD1-CD1 4.4Å; L34-L38 HydrophobicContact CD1-CG 4.31Å; L34-L38 HydrophobicContact CG-CD1 4.16Å; L34-L38 HydrophobicContact CG-CG 4.48Å; L34-L38 VanDerWaalsContact O-CG 3.32Å; L34-L38 WeakPolarHBondContact O-CG 3.4Å; L34-L38 PolarHBondContact O-N 3.44Å; Y35-L38 PolarHBondContact O-N 3.29Å; Y36-L38 PolarHBondContact O-N 3.36Å; L38-G40 VanDerWaalsContact C-N 3.35Å; L38-Y42 VanDerWaalsContact O-CB 3.24Å; L38-Y42 WeakPolarHBondContact O-CB 3.24Å; L38-Y42 PolarHBondContact O-N 3.29Å
39V98.2Very high96.9Very high11 Ų1154.5 Ų54.57%0.06727%0.271CS..Hα-helixtrans-59.5-45.9173.8166.40000110.8Y35 Y36 Y42 I43 A98 F184 E301 L305Y35-V39 WeakPolarHBondContact O-CB 3.25Å; Y35-V39 VanDerWaalsContact O-CG2 3.3Å; Y35-V39 WeakPolarHBondContact O-CG2 3.39Å; Y35-V39 PolarHBondContact O-N 2.81Å; Y36-V39 PolarHBondContact O-N 3.07Å; V39-Y42 PolarHBondContact O-N 3.13Å; V39-I43 WeakPolarHBondContact O-CB 3.34Å; V39-I43 WeakPolarHBondContact O-CG2 3.47Å; V39-I43 PolarHBondContact O-N 3.39Å; V39-A98 HydrophobicContact CG1-CB 4.09Å; V39-F184 HydrophobicContact CG2-CE1 4.3Å; V39-E301 WeakPolarHBondContact CG1-OE1 3.33Å; V39-E301 HydrophobicContact CG2-CG 4.23Å; V39-L305 HydrophobicContact CG1-CD2 4.1Å; V39-L305 HydrophobicContact CG2-CD1 4.18Å
40G98.3Very high97.2Very high0 Ų050 Ų500%025%0.248CC..Hα-helixtrans-60.8-47.6179.600000113Y36 Y37 L38 G44 T95Y36-G40 PolarHBondContact O-N 3.03Å; Y37-G40 PolarHBondContact O-N 2.93Å; L38-G40 VanDerWaalsContact C-N 3.35Å; G40-G44 PolarHBondContact O-N 2.88Å; G40-T95 WeakPolarHBondContact O-CG2 3.44Å
41I98.5Very high97.6Very high90 Ų9049.9 Ų49.946%0.46225%0.25SS..Hα-helixtrans-62.3-49.4175.8-67.3167.3000110.3Y37 G44 I45 F99Y37-I41 VanDerWaalsContact O-CG1 3.31Å; Y37-I41 WeakPolarHBondContact O-CG1 3.3Å; Y37-I41 PolarHBondContact O-N 3.36Å; I41-G44 PolarHBondContact O-N 3.39Å; I41-I45 HydrophobicContact CG2-CD1 3.97Å; I41-I45 WeakPolarHBondContact O-CG1 3.15Å; I41-I45 PolarHBondContact O-N 3.38Å; I41-F99 HydrophobicContact CG1-CZ 3.85Å
42Y98.6Very high97.8Very high86 Ų8655.2 Ų55.234%0.33728%0.275SS..Hα-helixtrans-58.1-53.2-179177.1-95.5000111.8L38 V39 G44 I45 V46 L305 T309L38-Y42 VanDerWaalsContact O-CB 3.24Å; L38-Y42 WeakPolarHBondContact O-CB 3.24Å; L38-Y42 PolarHBondContact O-N 3.29Å; V39-Y42 PolarHBondContact O-N 3.13Å; Y42-G44 VanDerWaalsContact C-N 3.3Å; Y42-G44 PolarHBondContact O-N 3Å; Y42-I45 PolarHBondContact O-N 2.99Å; Y42-V46 HydrophobicContact CD1-CG2 4.18Å; Y42-V46 HydrophobicContact CE1-CG2 3.77Å; Y42-V46 HydrophobicContact CE2-CG2 4.21Å; Y42-V46 WeakPolarHBondContact O-CG2 3.42Å; Y42-V46 PolarHBondContact O-N 2.64Å; Y42-L305 HydrophobicContact CD1-CB 4.34Å; Y42-L305 HydrophobicContact CD1-CD1 4.42Å; Y42-L305 HydrophobicContact CD1-CD2 4.13Å; Y42-L305 HydrophobicContact CE1-CB 3.87Å; Y42-L305 HydrophobicContact CE1-CD2 4.42Å; Y42-T309 PolarHBondContact OH-OG1 3.23Å
43I98.4Very high98Very high1 Ų152.4 Ų52.41%0.00526%0.264CS..Hα-helixtrans-70.2-29.6-177.6-160.972.3000112.1V39 V46 G47 K94 T95 K308V39-I43 WeakPolarHBondContact O-CB 3.34Å; V39-I43 WeakPolarHBondContact O-CG2 3.47Å; V39-I43 PolarHBondContact O-N 3.39Å; I43-V46 HydrophobicContact CD1-CG1 4.45Å; I43-G47 PolarHBondContact O-N 2.91Å; I43-K94 HydrophobicContact CD1-CD 4.36Å; I43-K94 HydrophobicContact CG1-CD 3.95Å; I43-K94 HydrophobicContact CG1-CG 4.27Å; I43-K94 HydrophobicContact CG2-CG 4.1Å; I43-T95 WeakPolarHBondContact CG2-OG1 3.32Å; I43-K308 HydrophobicContact CD1-CB 3.74Å; I43-K308 HydrophobicContact CD1-CD 3.61Å; I43-K308 HydrophobicContact CD1-CG 4.27Å; I43-K308 HydrophobicContact CG1-CD 4.5Å
44G98.4Very high98.2Very high7 Ų750.1 Ų50.17%0.07225%0.249CC..Hα-helixtrans-58.9-50.5171.100000111.5G40 I41 Y42 I48 T95G40-G44 PolarHBondContact O-N 2.88Å; I41-G44 PolarHBondContact O-N 3.39Å; Y42-G44 VanDerWaalsContact C-N 3.3Å; Y42-G44 PolarHBondContact O-N 3Å; G44-I48 WeakPolarHBondContact O-CB 3.2Å; G44-I48 WeakPolarHBondContact O-CD1 3.29Å; G44-I48 VanDerWaalsContact O-CG1 3.23Å; G44-I48 WeakPolarHBondContact O-CG1 3.25Å; G44-I48 PolarHBondContact O-N 3.24Å; G44-T95 WeakPolarHBondContact CA-OG1 3.35Å; G44-T95 PolarHBondContact N-OG1 3.48Å
45I98.5Very high98.3Very high99 Ų9947.2 Ų47.251%0.50824%0.237SC..Hα-helixtrans-62.7-49.3177.2-66.4167.7000110.8I41 Y42 G47 I48 L49I41-I45 HydrophobicContact CG2-CD1 3.97Å; I41-I45 WeakPolarHBondContact O-CG1 3.15Å; I41-I45 PolarHBondContact O-N 3.38Å; Y42-I45 PolarHBondContact O-N 2.99Å; I45-G47 PolarHBondContact O-N 3.36Å; I45-I48 PolarHBondContact O-N 3.45Å; I45-L49 HydrophobicContact CG2-CD1 3.78Å; I45-L49 HydrophobicContact CG2-CG 4.25Å; I45-L49 WeakPolarHBondContact O-CB 3.42Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 2.98Å; I45-L49 PolarHBondContact O-N 3.13Å
46V98.5Very high98.2Very high12 Ų1243.7 Ų43.77%0.07323%0.225CC..Hα-helixtrans-57.8-48179.5165.90000111.3Y42 I43 L49 A50 T309 V312Y42-V46 HydrophobicContact CD1-CG2 4.18Å; Y42-V46 HydrophobicContact CE1-CG2 3.77Å; Y42-V46 HydrophobicContact CE2-CG2 4.21Å; Y42-V46 WeakPolarHBondContact O-CG2 3.42Å; Y42-V46 PolarHBondContact O-N 2.64Å; I43-V46 HydrophobicContact CD1-CG1 4.45Å; V46-L49 PolarHBondContact O-N 3.16Å; V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 3.09Å; V46-A50 PolarHBondContact O-N 3.34Å; V46-T309 HydrophobicContact CG2-CG2 4.39Å; V46-V312 HydrophobicContact CB-CG2 4.5Å; V46-V312 HydrophobicContact CG1-CG2 3.88Å; V46-V312 WeakPolarHBondContact O-CG2 3.38Å
47G98.3Very high98.2Very high2 Ų243.9 Ų43.92%0.02123%0.226CC..Hα-helixtrans-60.5-48.3179.400000112.2I43 I45 A50 V51I43-G47 PolarHBondContact O-N 2.91Å; I45-G47 PolarHBondContact O-N 3.36Å; G47-A50 PolarHBondContact O-N 3.41Å; G47-V51 WeakPolarHBondContact O-CB 3.47Å; G47-V51 VanDerWaalsContact O-CG2 3.29Å; G47-V51 WeakPolarHBondContact O-CG2 3.23Å; G47-V51 PolarHBondContact O-N 3.38Å
48I98.4Very high98.2Very high82 Ų8240.9 Ų40.942%0.42122%0.217SC..Hα-helixtrans-61.5-48178.6-69.1166.2000111G44 I45 A50 V51 M52G44-I48 WeakPolarHBondContact O-CB 3.2Å; G44-I48 WeakPolarHBondContact O-CD1 3.29Å; G44-I48 VanDerWaalsContact O-CG1 3.23Å; G44-I48 WeakPolarHBondContact O-CG1 3.25Å; G44-I48 PolarHBondContact O-N 3.24Å; I45-I48 PolarHBondContact O-N 3.45Å; I48-A50 PolarHBondContact O-N 3.16Å; I48-V51 PolarHBondContact O-N 3.16Å; I48-M52 HydrophobicContact CG2-CG 4.38Å; I48-M52 HydrophobicContact CG2-SD 3.73Å; I48-M52 WeakPolarHBondContact O-CB 3.42Å; I48-M52 VanDerWaalsContact O-CG 3.29Å; I48-M52 WeakPolarHBondContact O-CG 3.31Å; I48-M52 PolarHBondContact O-N 3.3Å
49L98.2Very high98.1Very high90 Ų9039 Ų3947%0.47121%0.209SC..Hα-helixtrans-62.5-42.7179.8-71.2178.6000112.2I45 V46 G53 V312I45-L49 HydrophobicContact CG2-CD1 3.78Å; I45-L49 HydrophobicContact CG2-CG 4.25Å; I45-L49 WeakPolarHBondContact O-CB 3.42Å; I45-L49 VanDerWaalsContact O-CG 3.3Å; I45-L49 WeakPolarHBondContact O-CG 2.98Å; I45-L49 PolarHBondContact O-N 3.13Å; V46-L49 PolarHBondContact O-N 3.16Å; L49-G53 PolarHBondContact O-N 3.14Å; L49-V312 HydrophobicContact CB-CG1 4.32Å; L49-V312 HydrophobicContact CB-CG2 4.35Å
50A98.6Very high98Very high0 Ų038.5 Ų38.50%021%0.206CC..Hα-helixtrans-65.8-44.117800000111.8V46 G47 I48 N54 A86 A311 V312V46-A50 VanDerWaalsContact O-CB 3.3Å; V46-A50 WeakPolarHBondContact O-CB 3.09Å; V46-A50 PolarHBondContact O-N 3.34Å; G47-A50 PolarHBondContact O-N 3.41Å; I48-A50 PolarHBondContact O-N 3.16Å; A50-N54 WeakPolarHBondContact O-CB 3.47Å; A50-N54 PolarHBondContact O-N 2.8Å; A50-N54 PolarHBondContact O-ND2 3.45Å; A50-A86 HydrophobicContact CB-CB 3.41Å; A50-A86 VanDerWaalsContact CB-CB 3.41Å; A50-A311 HydrophobicContact CB-CB 3.8Å; A50-V312 HydrophobicContact CB-CG2 3.84Å
51V98.6Very high97.7Very high32 Ų3240 Ų4019%0.19421%0.212CC..Hα-helixtrans-60.6-49.6175.8167.50000110.3G47 I48 S55 F83 A86 L87G47-V51 WeakPolarHBondContact O-CB 3.47Å; G47-V51 VanDerWaalsContact O-CG2 3.29Å; G47-V51 WeakPolarHBondContact O-CG2 3.23Å; G47-V51 PolarHBondContact O-N 3.38Å; I48-V51 PolarHBondContact O-N 3.16Å; V51-S55 WeakPolarHBondContact O-CB 3.29Å; V51-S55 PolarHBondContact O-N 2.84Å; V51-S55 PolarHBondContact O-OG 3.24Å; V51-F83 HydrophobicContact CG1-CD2 4.13Å; V51-F83 HydrophobicContact CG1-CE2 3.76Å; V51-A86 HydrophobicContact CG2-CB 3.92Å; V51-L87 HydrophobicContact CG2-CB 4.23Å
52M97.9Very high97.5Very high125 Ų12540.8 Ų40.862%0.61622%0.217SC*.Hα-helixtrans-62.6-47.8179.2-71.817766.700112.3I48 S55 L56I48-M52 HydrophobicContact CG2-CG 4.38Å; I48-M52 HydrophobicContact CG2-SD 3.73Å; I48-M52 WeakPolarHBondContact O-CB 3.42Å; I48-M52 VanDerWaalsContact O-CG 3.29Å; I48-M52 WeakPolarHBondContact O-CG 3.31Å; I48-M52 PolarHBondContact O-N 3.3Å; M52-S55 PolarHBondContact O-N 3.48Å; M52-L56 PolarHBondContact O-N 2.8Å
53G97.9Very high97.2Very high15 Ų1541 Ų4116%0.15522%0.224CC..Hα-helixtrans-63.2-45.8-178.300000112.6L49 L56 V57L49-G53 PolarHBondContact O-N 3.14Å; G53-L56 WeakPolarHBondContact O-CB 3.38Å; G53-L56 PolarHBondContact O-N 3.18Å; G53-V57 WeakPolarHBondContact O-CG2 3.42Å; G53-V57 PolarHBondContact O-N 3.33Å; G53-V57 VanDerWaalsContact O-N 3.15Å
54N98.5Very high96.9Very high0 Ų041.2 Ų41.20%023%0.225CC..Hα-helixtrans-73.7-32.2179.5-71.5-65.5000112.1A50 L56 V57 I58 A79 D82 F83 A311A50-N54 WeakPolarHBondContact O-CB 3.47Å; A50-N54 PolarHBondContact O-N 2.8Å; A50-N54 PolarHBondContact O-ND2 3.45Å; N54-L56 VanDerWaalsContact C-N 3.33Å; N54-L56 PolarHBondContact O-N 3.41Å; N54-V57 PolarHBondContact O-N 2.84Å; N54-I58 WeakPolarHBondContact O-CD1 3.33Å; N54-I58 VanDerWaalsContact O-CG1 3.27Å; N54-I58 WeakPolarHBondContact O-CG1 3.4Å; N54-I58 PolarHBondContact O-N 3.18Å; N54-A79 HydrophobicContact CB-CB 4.28Å; N54-A79 WeakPolarHBondContact CB-O 3.42Å; N54-A79 WeakPolarHBondContact OD1-CA 3.26Å; N54-D82 WeakPolarHBondContact ND2-CB 3.48Å; N54-F83 HydrophobicContact CB-CB 3.86Å; N54-A311 PolarHBondContact ND2-O 3.37Å
55S98.3Very high96.4Very high38 Ų3848.9 Ų48.927%0.26626%0.257SS..Hα-helixtrans-58.9-45169.5-61.70000111.1V51 M52 V57 I58 T59 F83V51-S55 WeakPolarHBondContact O-CB 3.29Å; V51-S55 PolarHBondContact O-N 2.84Å; V51-S55 PolarHBondContact O-OG 3.24Å; M52-S55 PolarHBondContact O-N 3.48Å; S55-V57 VanDerWaalsContact C-N 3.34Å; S55-V57 PolarHBondContact O-N 2.9Å; S55-I58 PolarHBondContact O-N 3.42Å; S55-T59 WeakPolarHBondContact O-CB 3.1Å; S55-T59 PolarHBondContact O-N 2.77Å; S55-T59 PolarHBondContact O-OG1 2.94Å; S55-F83 WeakPolarHBondContact OG-CD2 3.44Å; S55-F83 WeakPolarHBondContact OG-CE2 3.43Å
56L96.8Very high95.9Very high35 Ų3546.7 Ų46.718%0.18324%0.244CC..Hα-helixtrans-58.7-44175.617665.6000111.9M52 G53 N54 T59 L60 I329 F333 L336M52-L56 PolarHBondContact O-N 2.8Å; G53-L56 WeakPolarHBondContact O-CB 3.38Å; G53-L56 PolarHBondContact O-N 3.18Å; N54-L56 VanDerWaalsContact C-N 3.33Å; N54-L56 PolarHBondContact O-N 3.41Å; L56-T59 PolarHBondContact O-N 2.65Å; L56-L60 HydrophobicContact CD1-CD1 3.87Å; L56-L60 HydrophobicContact CD1-CG 3.98Å; L56-L60 HydrophobicContact CG-CD1 4.05Å; L56-L60 HydrophobicContact CG-CG 4.48Å; L56-L60 WeakPolarHBondContact O-CB 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.36Å; L56-L60 PolarHBondContact O-N 2.98Å; L56-I329 HydrophobicContact CD2-CD1 4.31Å; L56-F333 HydrophobicContact CD1-CD2 3.65Å; L56-F333 HydrophobicContact CD1-CE2 3.58Å; L56-F333 HydrophobicContact CD1-CG 4.46Å; L56-F333 HydrophobicContact CD1-CZ 4.37Å; L56-L336 HydrophobicContact CD1-CD1 4.42Å; L56-L336 HydrophobicContact CD2-CD1 3.7Å
57V97.4Very high95.4Very high4 Ų446.3 Ų46.32%0.02424%0.242CC..Hα-helixtrans-59.7-49.1177.6175.90000110.9G53 N54 S55 L60 F61 I75 A79 P315 Y318 F325G53-V57 WeakPolarHBondContact O-CG2 3.42Å; G53-V57 PolarHBondContact O-N 3.33Å; G53-V57 VanDerWaalsContact O-N 3.15Å; N54-V57 PolarHBondContact O-N 2.84Å; S55-V57 VanDerWaalsContact C-N 3.34Å; S55-V57 PolarHBondContact O-N 2.9Å; V57-L60 PolarHBondContact O-N 3.39Å; V57-F61 PolarHBondContact O-N 3.46Å; V57-F61 VanDerWaalsContact O-N 3.14Å; V57-I75 HydrophobicContact CG1-CG2 4.17Å; V57-A79 HydrophobicContact CB-CB 3.95Å; V57-A79 HydrophobicContact CG1-CB 3.7Å; V57-P315 HydrophobicContact CG2-CB 4.09Å; V57-P315 HydrophobicContact CG2-CG 4.13Å; V57-Y318 HydrophobicContact CG2-CD2 4Å; V57-F325 HydrophobicContact CB-CE2 4.34Å; V57-F325 HydrophobicContact CB-CZ 4.32Å; V57-F325 HydrophobicContact CG1-CE2 4.4Å; V57-F325 HydrophobicContact CG2-CE2 4.1Å; V57-F325 HydrophobicContact CG2-CZ 3.65Å
58I97.8Very high95.2Very high34 Ų3451.1 Ų51.117%0.17426%0.259CS..Hα-helixtrans-61.6-49.4179-65.2163.5000110.4N54 S55 L60 F61 L62 A79 I80 F83N54-I58 WeakPolarHBondContact O-CD1 3.33Å; N54-I58 VanDerWaalsContact O-CG1 3.27Å; N54-I58 WeakPolarHBondContact O-CG1 3.4Å; N54-I58 PolarHBondContact O-N 3.18Å; S55-I58 PolarHBondContact O-N 3.42Å; I58-L60 PolarHBondContact O-N 3.39Å; I58-F61 PolarHBondContact O-N 2.9Å; I58-L62 HydrophobicContact CG2-CD1 4Å; I58-L62 HydrophobicContact CG2-CG 4.48Å; I58-L62 WeakPolarHBondContact O-CG 3.42Å; I58-L62 PolarHBondContact O-N 2.78Å; I58-A79 HydrophobicContact CD1-CB 4.41Å; I58-A79 HydrophobicContact CG1-CB 3.93Å; I58-I80 HydrophobicContact CD1-CG1 3.9Å; I58-I80 HydrophobicContact CG1-CG1 4.23Å; I58-F83 HydrophobicContact CD1-CB 4.37Å
59T96.3Very high94.9Very high56 Ų5649.2 Ų49.234%0.34425%0.251SS..Hα-helixtrans-58.9-46.7179.9-630000111.9S55 L56 F61 L62 L63S55-T59 WeakPolarHBondContact O-CB 3.1Å; S55-T59 PolarHBondContact O-N 2.77Å; S55-T59 PolarHBondContact O-OG1 2.94Å; L56-T59 PolarHBondContact O-N 2.65Å; T59-F61 VanDerWaalsContact C-N 3.32Å; T59-F61 PolarHBondContact O-N 3.16Å; T59-L62 PolarHBondContact O-N 2.81Å; T59-L63 HydrophobicContact CG2-CD1 3.53Å; T59-L63 HydrophobicContact CG2-CG 4.08Å; T59-L63 WeakPolarHBondContact O-CB 3.39Å; T59-L63 VanDerWaalsContact O-CG 3.28Å; T59-L63 WeakPolarHBondContact O-CG 3.47Å; T59-L63 PolarHBondContact O-N 3.28Å
60L95Very high94.8Very high0 Ų045.8 Ų45.80%024%0.235CC..Hα-helixtrans-63.1-38.9179.1-73.6177.9000112L56 V57 I58 L63 C64 L67 F325 E328 I329 F333L56-L60 HydrophobicContact CD1-CD1 3.87Å; L56-L60 HydrophobicContact CD1-CG 3.98Å; L56-L60 HydrophobicContact CG-CD1 4.05Å; L56-L60 HydrophobicContact CG-CG 4.48Å; L56-L60 WeakPolarHBondContact O-CB 3.31Å; L56-L60 WeakPolarHBondContact O-CG 3.36Å; L56-L60 PolarHBondContact O-N 2.98Å; V57-L60 PolarHBondContact O-N 3.39Å; I58-L60 PolarHBondContact O-N 3.39Å; L60-L63 PolarHBondContact O-N 2.92Å; L60-C64 WeakPolarHBondContact O-CB 3.29Å; L60-C64 PolarHBondContact O-N 2.93Å; L60-C64 PolarHBondContact O-SG 2.88Å; L60-L67 HydrophobicContact CB-CD1 4.08Å; L60-F325 HydrophobicContact CB-CD2 4.46Å; L60-F325 HydrophobicContact CB-CE2 3.98Å; L60-F325 HydrophobicContact CD1-CD2 3.97Å; L60-F325 HydrophobicContact CD1-CE1 4.38Å; L60-F325 HydrophobicContact CD1-CE2 3.42Å; L60-F325 VanDerWaalsContact CD1-CE2 3.42Å; L60-F325 HydrophobicContact CD1-CZ 3.66Å; L60-F325 HydrophobicContact CG-CE2 4.3Å; L60-E328 HydrophobicContact CD2-CB 4.19Å; L60-I329 HydrophobicContact CD1-CD1 4.34Å; L60-I329 HydrophobicContact CD1-CG1 3.53Å; L60-F333 HydrophobicContact CD2-CD2 4.36Å; L60-F333 HydrophobicContact CD2-CE2 3.94Å
61F93.1Very high94.5Very high31 Ų3147 Ų4714%0.13624%0.243CC..Hα-helixtrans-62.3-44.2174.5-179.3-91.6000112.6V57 I58 T59 L67 R68 N72 M73 V76V57-F61 PolarHBondContact O-N 3.46Å; V57-F61 VanDerWaalsContact O-N 3.14Å; I58-F61 PolarHBondContact O-N 2.9Å; T59-F61 VanDerWaalsContact C-N 3.32Å; T59-F61 PolarHBondContact O-N 3.16Å; F61-L67 HydrophobicContact CD2-CB 4.45Å; F61-L67 WeakPolarHBondContact CD2-O 3.43Å; F61-L67 WeakPolarHBondContact CE2-O 3.27Å; F61-R68 HydrophobicContact CD1-CG 4.42Å; F61-R68 HydrophobicContact CE1-CG 4.13Å; F61-R68 HydrophobicContact CE2-CB 4.42Å; F61-R68 HydrophobicContact CE2-CG 4.32Å; F61-R68 HydrophobicContact CZ-CB 4.27Å; F61-R68 HydrophobicContact CZ-CG 4.08Å; F61-R68 VanDerWaalsContact O-CG 3.32Å; F61-R68 WeakPolarHBondContact O-CG 3.23Å; F61-N72 HydrophobicContact CD2-CB 4.16Å; F61-N72 HydrophobicContact CE2-CB 3.84Å; F61-M73 HydrophobicContact CE2-CG 4.47Å; F61-M73 HydrophobicContact CZ-CG 3.87Å; F61-V76 HydrophobicContact CB-CG2 3.52Å; F61-V76 HydrophobicContact CD1-CG2 3.55Å; F61-V76 HydrophobicContact CD2-CG2 3.31Å; F61-V76 HydrophobicContact CE1-CG2 4.01Å; F61-V76 HydrophobicContact CE2-CG2 3.78Å; F61-V76 HydrophobicContact CG-CG2 3.17Å; F61-V76 HydrophobicContact CZ-CG2 4.11Å
62L93.6Very high94.3Very high108 Ų10846.4 Ų46.457%0.56524%0.238SC*.Hα-helixtrans-64.1-45.8178.8-66.8174.2000111.4I58 T59 R68I58-L62 HydrophobicContact CG2-CD1 4Å; I58-L62 HydrophobicContact CG2-CG 4.48Å; I58-L62 WeakPolarHBondContact O-CG 3.42Å; I58-L62 PolarHBondContact O-N 2.78Å; T59-L62 PolarHBondContact O-N 2.81Å; L62-R68 PolarHBondContact O-NE 3.15Å; L62-R68 PolarHBondContact O-NH2 3.04Å
63L92.4Very high94.3Very high91 Ų9142.5 Ų42.548%0.47622%0.219SC..Hα-helixtrans-75.9-27.4-175.6-65.7-179.7000113.8T59 L60 R332T59-L63 HydrophobicContact CG2-CD1 3.53Å; T59-L63 HydrophobicContact CG2-CG 4.08Å; T59-L63 WeakPolarHBondContact O-CB 3.39Å; T59-L63 VanDerWaalsContact O-CG 3.28Å; T59-L63 WeakPolarHBondContact O-CG 3.47Å; T59-L63 PolarHBondContact O-N 3.28Å; L60-L63 PolarHBondContact O-N 2.92Å; L63-R332 PolarHBondContact O-NH2 3.19Å
64C91.5Very high94.3Very high5 Ų541.9 Ų41.93%0.03421%0.212CC..  trans-110.4103.9-168.4-54.20000112L60 Q66 L67 R68 E328 R332L60-C64 WeakPolarHBondContact O-CB 3.29Å; L60-C64 PolarHBondContact O-N 2.93Å; L60-C64 PolarHBondContact O-SG 2.88Å; C64-Q66 PolarHBondContact O-N 3.27Å; C64-Q66 VanDerWaalsContact O-N 3.11Å; C64-L67 HydrophobicContact CB-CB 4.28Å; C64-L67 HydrophobicContact CB-CD1 3.95Å; C64-L67 HydrophobicContact CB-CG 4.01Å; C64-L67 PolarHBondContact O-N 3Å; C64-R68 PolarHBondContact O-N 3.49Å; C64-E328 HydrophobicContact CB-CG 4.07Å; C64-E328 VanDerWaalsContact SG-CD 3.6Å; C64-E328 PolarHBondContact SG-OE2 3.17Å; C64-R332 PolarHBondContact SG-NE 3.12Å; C64-R332 PolarHBondContact SG-NH2 3Å; C64-R332 VanDerWaalsContact SG-NH2 3.35Å
65K88.8Confident94.2Very high168 Ų16843 Ų4373%0.7322%0.218SC*.G310 helixtrans-51.8-36.6177.7-68.4-175.1179.5-178.20113.2L67 R68K65-L67 VanDerWaalsContact C-N 3.26Å; K65-L67 PolarHBondContact O-N 3.24Å; K65-R68 PolarHBondContact O-N 3.44Å
66Q87Confident94.2Very high52 Ų5242.1 Ų42.124%0.24321%0.211CC..G310 helixtrans-69-20.6-179.9-63.4-176.16.400114.1C64 Q357C64-Q66 PolarHBondContact O-N 3.27Å; C64-Q66 VanDerWaalsContact O-N 3.11Å; Q66-Q357 VanDerWaalsContact NE2-OE1 3.11Å
67L89.5Confident94.3Very high5 Ų540.9 Ų40.93%0.02620%0.204CC..G310 helixtrans-87.9-17.3175.4-66.3-179.5000112.3L60 F61 C64 K65 T69 N72 K324 F325 E328L60-L67 HydrophobicContact CB-CD1 4.08Å; F61-L67 HydrophobicContact CD2-CB 4.45Å; F61-L67 WeakPolarHBondContact CD2-O 3.43Å; F61-L67 WeakPolarHBondContact CE2-O 3.27Å; C64-L67 HydrophobicContact CB-CB 4.28Å; C64-L67 HydrophobicContact CB-CD1 3.95Å; C64-L67 HydrophobicContact CB-CG 4.01Å; C64-L67 PolarHBondContact O-N 3Å; K65-L67 VanDerWaalsContact C-N 3.26Å; K65-L67 PolarHBondContact O-N 3.24Å; L67-T69 VanDerWaalsContact C-N 3.25Å; L67-T69 PolarHBondContact O-N 3.05Å; L67-N72 WeakPolarHBondContact O-CB 3.32Å; L67-N72 PolarHBondContact O-ND2 3.14Å; L67-K324 HydrophobicContact CD2-CB 3.67Å; L67-F325 HydrophobicContact CD1-CD2 4.26Å; L67-E328 HydrophobicContact CD1-CG 4.27Å
68R93.2Very high94.3Very high103 Ų10340.7 Ų40.739%0.38920%0.203SC..  trans-77.378178.2-60.3-174.2-135.4156.8-3.1110.4F61 L62 C64 K65 Y151F61-R68 HydrophobicContact CD1-CG 4.42Å; F61-R68 HydrophobicContact CE1-CG 4.13Å; F61-R68 HydrophobicContact CE2-CB 4.42Å; F61-R68 HydrophobicContact CE2-CG 4.32Å; F61-R68 HydrophobicContact CZ-CB 4.27Å; F61-R68 HydrophobicContact CZ-CG 4.08Å; F61-R68 VanDerWaalsContact O-CG 3.32Å; F61-R68 WeakPolarHBondContact O-CG 3.23Å; L62-R68 PolarHBondContact O-NE 3.15Å; L62-R68 PolarHBondContact O-NH2 3.04Å; C64-R68 PolarHBondContact O-N 3.49Å; K65-R68 PolarHBondContact O-N 3.44Å; R68-Y151 PolarHBondContact O-OH 3.1Å
69T93.3Very high94.4Very high41 Ų4139.1 Ų39.125%0.25220%0.195SC..  trans-118.9155.117363.70000108.8L67 N72 M73L67-T69 VanDerWaalsContact C-N 3.25Å; L67-T69 PolarHBondContact O-N 3.05Å; T69-N72 PolarHBondContact O-N 3.45Å; T69-N72 VanDerWaalsContact O-N 3.11Å; T69-N72 WeakPolarHBondContact OG1-CB 3.43Å; T69-N72 VanDerWaalsContact OG1-CG 3.25Å; T69-N72 PolarHBondContact OG1-ND2 2.9Å; T69-M73 PolarHBondContact O-N 3.13Å
70P94.5Very high94.5Very high19 Ų1939.4 Ų39.412%0.12319%0.194CC..Hα-helixtrans-54.3-49.6-179.4-2230.4000113.2N72 M73 I149 Y151 V154P70-N72 PolarHBondContact O-N 2.96Å; P70-N72 VanDerWaalsContact O-N 3.17Å; P70-M73 WeakPolarHBondContact O-CB 3.25Å; P70-M73 PolarHBondContact O-N 3.18Å; P70-I149 HydrophobicContact CB-CG2 4.39Å; P70-I149 WeakPolarHBondContact CB-O 3.49Å; P70-I149 WeakPolarHBondContact CG-O 3.27Å; P70-Y151 HydrophobicContact CB-CD1 4.5Å; P70-Y151 HydrophobicContact CG-CD1 4.13Å; P70-Y151 HydrophobicContact CG-CD2 3.92Å; P70-Y151 HydrophobicContact CG-CE1 4.08Å; P70-Y151 HydrophobicContact CG-CE2 3.88Å; P70-Y151 HydrophobicContact CG-CG 4.04Å; P70-V154 HydrophobicContact CB-CG2 3.65Å; P70-V154 WeakPolarHBondContact O-CG2 3.32Å
71P93.7Very high94.7Very high26 Ų2639.4 Ų39.417%0.16919%0.194CC..Hα-helixtrans-57.4-35.7178.1-27.637.9000113.8M73 L74P71-M73 PolarHBondContact O-N 2.82Å; P71-L74 WeakPolarHBondContact O-CB 3.47Å; P71-L74 PolarHBondContact O-N 3.3Å; P71-L74 VanDerWaalsContact O-N 3.14Å
72N94.4Very high95Very high19 Ų1938 Ų3810%0.10219%0.188CC..Hα-helixtrans-70.8-16.9179.5-73-0.2000113.3F61 L67 T69 P70 L74 I75 V76F61-N72 HydrophobicContact CD2-CB 4.16Å; F61-N72 HydrophobicContact CE2-CB 3.84Å; L67-N72 WeakPolarHBondContact O-CB 3.32Å; L67-N72 PolarHBondContact O-ND2 3.14Å; T69-N72 PolarHBondContact O-N 3.45Å; T69-N72 VanDerWaalsContact O-N 3.11Å; T69-N72 WeakPolarHBondContact OG1-CB 3.43Å; T69-N72 VanDerWaalsContact OG1-CG 3.25Å; T69-N72 PolarHBondContact OG1-ND2 2.9Å; P70-N72 PolarHBondContact O-N 2.96Å; P70-N72 VanDerWaalsContact O-N 3.17Å; N72-L74 PolarHBondContact O-N 2.84Å; N72-I75 WeakPolarHBondContact O-CB 3.42Å; N72-I75 PolarHBondContact O-N 3.36Å; N72-V76 WeakPolarHBondContact O-CG2 3.45Å; N72-V76 PolarHBondContact O-N 2.79Å
73M97.3Very high95.2Very high43 Ų4335.5 Ų35.521%0.21217%0.173CC..Hα-helixtrans-65-30.4170.8-66.6178.667.600111.8F61 T69 P70 P71 V76 N77 Y151 V154 I155 I158F61-M73 HydrophobicContact CE2-CG 4.47Å; F61-M73 HydrophobicContact CZ-CG 3.87Å; T69-M73 PolarHBondContact O-N 3.13Å; P70-M73 WeakPolarHBondContact O-CB 3.25Å; P70-M73 PolarHBondContact O-N 3.18Å; P71-M73 PolarHBondContact O-N 2.82Å; M73-V76 PolarHBondContact O-N 2.92Å; M73-N77 WeakPolarHBondContact O-CB 3.31Å; M73-N77 PolarHBondContact O-N 2.69Å; M73-Y151 HydrophobicContact SD-CD1 3.6Å; M73-Y151 HydrophobicContact SD-CE1 3.99Å; M73-V154 HydrophobicContact CB-CG1 3.66Å; M73-I155 HydrophobicContact CE-CG1 3.94Å; M73-I158 HydrophobicContact CB-CD1 4.26Å; M73-I158 HydrophobicContact CE-CD1 4.44Å
74L98Very high95.5Very high1 Ų132.3 Ų32.31%0.00516%0.158CC..Hα-helixtrans-68.8-39171.6-64.3172.4000111.3P71 N72 V76 N77 L78 T127 F130 I131 V154 M157 I158P71-L74 WeakPolarHBondContact O-CB 3.47Å; P71-L74 PolarHBondContact O-N 3.3Å; P71-L74 VanDerWaalsContact O-N 3.14Å; N72-L74 PolarHBondContact O-N 2.84Å; L74-V76 VanDerWaalsContact C-N 3.28Å; L74-V76 PolarHBondContact O-N 3.38Å; L74-N77 PolarHBondContact O-N 3.49Å; L74-L78 WeakPolarHBondContact O-CB 3.46Å; L74-L78 PolarHBondContact O-N 3.12Å; L74-T127 HydrophobicContact CB-CG2 4.13Å; L74-T127 HydrophobicContact CD2-CG2 4.47Å; L74-T127 WeakPolarHBondContact O-CG2 3.39Å; L74-F130 HydrophobicContact CD1-CB 4.12Å; L74-F130 HydrophobicContact CD2-CB 4.14Å; L74-I131 HydrophobicContact CB-CD1 4.27Å; L74-I131 HydrophobicContact CB-CG1 3.7Å; L74-I131 HydrophobicContact CD1-CG1 4.1Å; L74-V154 HydrophobicContact CD2-CG1 3.95Å; L74-V154 HydrophobicContact CG-CG1 3.91Å; L74-M157 HydrophobicContact CD1-CE 3.98Å; L74-M157 HydrophobicContact CD2-CB 4.45Å; L74-I158 HydrophobicContact CD2-CG1 4.17Å
75I97.2Very high95.8Very high25 Ų2532.5 Ų32.513%0.12816%0.158CC..Hα-helixtrans-60.6-40.9174.2-64.5177.6000110.7V57 N72 L78 A79 Y318V57-I75 HydrophobicContact CG1-CG2 4.17Å; N72-I75 WeakPolarHBondContact O-CB 3.42Å; N72-I75 PolarHBondContact O-N 3.36Å; I75-L78 PolarHBondContact O-N 3.31Å; I75-A79 PolarHBondContact O-N 3.38Å; I75-Y318 HydrophobicContact CD1-CE1 4.42Å; I75-Y318 HydrophobicContact CG2-CD2 4.42Å; I75-Y318 HydrophobicContact CG2-CE1 4.22Å; I75-Y318 HydrophobicContact CG2-CE2 3.74Å
76V97.7Very high96.3Very high19 Ų1924.7 Ų24.712%0.11513%0.125CC..Hα-helixtrans-68-41.6175.5176.20000111.4F61 N72 M73 L74 L78 A79 I80F61-V76 HydrophobicContact CB-CG2 3.52Å; F61-V76 HydrophobicContact CD1-CG2 3.55Å; F61-V76 HydrophobicContact CD2-CG2 3.31Å; F61-V76 HydrophobicContact CE1-CG2 4.01Å; F61-V76 HydrophobicContact CE2-CG2 3.78Å; F61-V76 HydrophobicContact CG-CG2 3.17Å; F61-V76 HydrophobicContact CZ-CG2 4.11Å; N72-V76 WeakPolarHBondContact O-CG2 3.45Å; N72-V76 PolarHBondContact O-N 2.79Å; M73-V76 PolarHBondContact O-N 2.92Å; L74-V76 VanDerWaalsContact C-N 3.28Å; L74-V76 PolarHBondContact O-N 3.38Å; V76-L78 VanDerWaalsContact C-N 3.27Å; V76-L78 PolarHBondContact O-N 2.88Å; V76-A79 PolarHBondContact O-N 3.02Å; V76-A79 VanDerWaalsContact O-N 3.12Å; V76-I80 HydrophobicContact CG1-CD1 3.87Å; V76-I80 HydrophobicContact CG1-CG1 4.29Å; V76-I80 WeakPolarHBondContact O-CG1 3.19Å; V76-I80 PolarHBondContact O-N 2.75Å
77N98.6Very high96.9Very high8 Ų826 Ų264%0.04313%0.134CC..Hα-helixtrans-59.1-41.5175.6-169.467.1000111.5M73 L74 I80 S81 T127 I158 W162M73-N77 WeakPolarHBondContact O-CB 3.31Å; M73-N77 PolarHBondContact O-N 2.69Å; L74-N77 PolarHBondContact O-N 3.49Å; N77-I80 PolarHBondContact O-N 2.95Å; N77-S81 WeakPolarHBondContact O-CB 3.2Å; N77-S81 PolarHBondContact O-N 3.5Å; N77-T127 HydrophobicContact CB-CG2 4.32Å; N77-T127 PolarHBondContact ND2-OG1 3.42Å; N77-I158 HydrophobicContact CB-CD1 4.25Å; N77-I158 HydrophobicContact CB-CG1 4.19Å; N77-W162 PolarHBondContact OD1-NE1 3.46Å
78L98.6Very high97.3Very high0 Ų028.5 Ų28.50%015%0.146CC..Hα-helixtrans-61.7-44.4173.5-178.358.1000111.5L74 I75 V76 S81 D82 T127 M128 I131 L269L74-L78 WeakPolarHBondContact O-CB 3.46Å; L74-L78 PolarHBondContact O-N 3.12Å; I75-L78 PolarHBondContact O-N 3.31Å; V76-L78 VanDerWaalsContact C-N 3.27Å; V76-L78 PolarHBondContact O-N 2.88Å; L78-S81 WeakPolarHBondContact O-CB 3.43Å; L78-S81 PolarHBondContact O-N 3.43Å; L78-D82 PolarHBondContact O-N 3.01Å; L78-T127 HydrophobicContact CB-CG2 3.87Å; L78-M128 HydrophobicContact CD1-CE 4.06Å; L78-M128 HydrophobicContact CD1-CG 4.43Å; L78-M128 HydrophobicContact CD2-CE 3.96Å; L78-M128 HydrophobicContact CD2-CG 4.22Å; L78-I131 HydrophobicContact CD2-CD1 4.2Å; L78-L269 HydrophobicContact CD2-CD1 4.49Å
79A98.7Very high97.5Very high1 Ų123.7 Ų23.71%0.00813%0.128CC..Hα-helixtrans-65.7-38.317700000113.1N54 V57 I58 I75 V76 S81 F83N54-A79 HydrophobicContact CB-CB 4.28Å; N54-A79 WeakPolarHBondContact CB-O 3.42Å; N54-A79 WeakPolarHBondContact OD1-CA 3.26Å; V57-A79 HydrophobicContact CB-CB 3.95Å; V57-A79 HydrophobicContact CG1-CB 3.7Å; I58-A79 HydrophobicContact CD1-CB 4.41Å; I58-A79 HydrophobicContact CG1-CB 3.93Å; I75-A79 PolarHBondContact O-N 3.38Å; V76-A79 PolarHBondContact O-N 3.02Å; V76-A79 VanDerWaalsContact O-N 3.12Å; A79-S81 VanDerWaalsContact C-N 3.33Å; A79-F83 WeakPolarHBondContact O-CB 3.44Å; A79-F83 PolarHBondContact O-N 3Å
80I98.7Very high97.6Very high62 Ų6221.9 Ų21.932%0.31812%0.118SC..Hα-helixtrans-61.5-45.5174-70.7167.5000109.8I58 V76 N77 F83 S84 W162I58-I80 HydrophobicContact CD1-CG1 3.9Å; I58-I80 HydrophobicContact CG1-CG1 4.23Å; V76-I80 HydrophobicContact CG1-CD1 3.87Å; V76-I80 HydrophobicContact CG1-CG1 4.29Å; V76-I80 WeakPolarHBondContact O-CG1 3.19Å; V76-I80 PolarHBondContact O-N 2.75Å; N77-I80 PolarHBondContact O-N 2.95Å; I80-F83 PolarHBondContact O-N 2.83Å; I80-S84 WeakPolarHBondContact O-CB 3.43Å; I80-S84 PolarHBondContact O-N 2.9Å; I80-S84 PolarHBondContact O-OG 3.05Å; I80-W162 HydrophobicContact CG2-CZ2 4.34Å
81S98.7Very high97.6Very high0 Ų025.4 Ų25.40%013%0.131CC..Hα-helixtrans-59-52.7177.2-168.90000112.1N77 L78 A79 F83 S84 F85 F120 I123 S124N77-S81 WeakPolarHBondContact O-CB 3.2Å; N77-S81 PolarHBondContact O-N 3.5Å; L78-S81 WeakPolarHBondContact O-CB 3.43Å; L78-S81 PolarHBondContact O-N 3.43Å; A79-S81 VanDerWaalsContact C-N 3.33Å; S81-F83 VanDerWaalsContact C-N 3.34Å; S81-F83 PolarHBondContact O-N 2.58Å; S81-S84 PolarHBondContact O-N 2.92Å; S81-F85 VanDerWaalsContact O-CB 3.29Å; S81-F85 WeakPolarHBondContact O-CB 3.27Å; S81-F85 PolarHBondContact O-N 2.01Å; S81-F120 WeakPolarHBondContact OG-CA 3.24Å; S81-F120 PolarHBondContact OG-O 3.26Å; S81-I123 WeakPolarHBondContact OG-CB 3.41Å; S81-I123 WeakPolarHBondContact OG-CG2 3.49Å; S81-S124 VanDerWaalsContact CB-OG 3.29Å; S81-S124 WeakPolarHBondContact CB-OG 3.11Å; S81-S124 PolarHBondContact OG-N 3.08Å; S81-S124 PolarHBondContact OG-OG 3.14Å
82D98.8Very high97.7Very high2 Ų226.4 Ų26.41%0.01114%0.138CC..Hα-helixtrans-67.6-34-178.5-68-21.5000112.4N54 L78 A86 S124 A311 N314N54-D82 WeakPolarHBondContact ND2-CB 3.48Å; L78-D82 PolarHBondContact O-N 3.01Å; D82-A86 VanDerWaalsContact O-CB 3.27Å; D82-A86 WeakPolarHBondContact O-CB 2.96Å; D82-A86 PolarHBondContact O-N 2.96Å; D82-S124 PolarHBondContact OD1-OG 2.87Å; D82-A311 HydrophobicContact CB-CB 3.94Å; D82-N314 PolarHBondContact OD2-ND2 3.35Å
83F98.7Very high97.9Very high55 Ų5527.4 Ų27.424%0.24114%0.143CC..Hα-helixtrans-61.1-53.4171.4170-90000111V51 N54 S55 I58 A79 I80 S81 F85 A86 L87V51-F83 HydrophobicContact CG1-CD2 4.13Å; V51-F83 HydrophobicContact CG1-CE2 3.76Å; N54-F83 HydrophobicContact CB-CB 3.86Å; S55-F83 WeakPolarHBondContact OG-CD2 3.44Å; S55-F83 WeakPolarHBondContact OG-CE2 3.43Å; I58-F83 HydrophobicContact CD1-CB 4.37Å; A79-F83 WeakPolarHBondContact O-CB 3.44Å; A79-F83 PolarHBondContact O-N 3Å; I80-F83 PolarHBondContact O-N 2.83Å; S81-F83 VanDerWaalsContact C-N 3.34Å; S81-F83 PolarHBondContact O-N 2.58Å; F83-F85 VanDerWaalsContact C-N 3.34Å; F83-F85 PolarHBondContact O-N 3.47Å; F83-A86 PolarHBondContact O-N 3.32Å; F83-L87 HydrophobicContact CE1-CD2 3.83Å; F83-L87 HydrophobicContact CZ-CD2 4.05Å; F83-L87 VanDerWaalsContact O-CB 3.26Å; F83-L87 WeakPolarHBondContact O-CB 3.22Å; F83-L87 PolarHBondContact O-N 2.81Å
84S98.7Very high97.9Very high25 Ų2525.3 Ų25.318%0.17513%0.133CC..Hα-helixtrans-65.7-39.2-178.2-670000111.8I80 S81 I88 F120I80-S84 WeakPolarHBondContact O-CB 3.43Å; I80-S84 PolarHBondContact O-N 2.9Å; I80-S84 PolarHBondContact O-OG 3.05Å; S81-S84 PolarHBondContact O-N 2.92Å; S84-I88 PolarHBondContact O-N 3.39Å; S84-F120 VanDerWaalsContact CB-CE1 3.48Å
85F98.7Very high98Very high8 Ų825.7 Ų25.74%0.03514%0.135CC..Hα-helixtrans-56.4-55.8170.9-179.5-94.4000110.5S81 F83 L87 I88 N89 F120 W277 K308 A311S81-F85 VanDerWaalsContact O-CB 3.29Å; S81-F85 WeakPolarHBondContact O-CB 3.27Å; S81-F85 PolarHBondContact O-N 2.01Å; F83-F85 VanDerWaalsContact C-N 3.34Å; F83-F85 PolarHBondContact O-N 3.47Å; F85-L87 PolarHBondContact O-N 2.95Å; F85-I88 PolarHBondContact O-N 3.37Å; F85-N89 HydrophobicContact CD1-CB 4.47Å; F85-N89 HydrophobicContact CD2-CB 4.34Å; F85-N89 HydrophobicContact CE1-CB 4.28Å; F85-N89 HydrophobicContact CE2-CB 4.17Å; F85-N89 HydrophobicContact CZ-CB 4.15Å; F85-N89 WeakPolarHBondContact O-CA 3.29Å; F85-N89 WeakPolarHBondContact O-CB 3.32Å; F85-N89 PolarHBondContact O-N 2.97Å; F85-F120 HydrophobicContact CB-CB 3.71Å; F85-F120 HydrophobicContact CB-CG 4.4Å; F85-F120 HydrophobicContact CD2-CB 4.2Å; F85-F120 HydrophobicContact CG-CB 4.45Å; F85-W277 HydrophobicContact CE2-CH2 4.11Å; F85-W277 HydrophobicContact CE2-CZ2 4.01Å; F85-W277 HydrophobicContact CZ-CH2 4.3Å; F85-W277 AromaticContact CZ-CZ2 3.98Å; F85-W277 HydrophobicContact CZ-CZ2 3.98Å; F85-K308 HydrophobicContact CE1-CB 4.16Å; F85-K308 HydrophobicContact CE1-CG 4.04Å; F85-K308 HydrophobicContact CZ-CB 4.38Å; F85-K308 HydrophobicContact CZ-CG 3.83Å; F85-A311 HydrophobicContact CD1-CB 4.09Å
86A98.6Very high98Very high4 Ų427.3 Ų27.33%0.03314%0.143CC..Hα-helixtrans-64.7-36.8-177.100000113.6A50 V51 D82 F83 I88 G90 A311A50-A86 HydrophobicContact CB-CB 3.41Å; A50-A86 VanDerWaalsContact CB-CB 3.41Å; V51-A86 HydrophobicContact CG2-CB 3.92Å; D82-A86 VanDerWaalsContact O-CB 3.27Å; D82-A86 WeakPolarHBondContact O-CB 2.96Å; D82-A86 PolarHBondContact O-N 2.96Å; F83-A86 PolarHBondContact O-N 3.32Å; A86-I88 VanDerWaalsContact C-N 3.31Å; A86-I88 PolarHBondContact O-N 2.92Å; A86-G90 VanDerWaalsContact O-CA 3.26Å; A86-G90 WeakPolarHBondContact O-CA 3.47Å; A86-G90 PolarHBondContact O-N 3.45Å; A86-A311 HydrophobicContact CB-CB 4.45Å
87L98.4Very high98Very high81 Ų8126.4 Ų26.442%0.42414%0.138SC..Hα-helixtrans-63.5-35.5179-177.865.2000112.3V51 F83 F85V51-L87 HydrophobicContact CG2-CB 4.23Å; F83-L87 HydrophobicContact CE1-CD2 3.83Å; F83-L87 HydrophobicContact CZ-CD2 4.05Å; F83-L87 VanDerWaalsContact O-CB 3.26Å; F83-L87 WeakPolarHBondContact O-CB 3.22Å; F83-L87 PolarHBondContact O-N 2.81Å; F85-L87 PolarHBondContact O-N 2.95Å
88I98.1Very high98Very high56 Ų5626 Ų2629%0.28714%0.136SC..Hα-helixtrans-95.3-47.5-178.8-61.4167.9000111.1S84 F85 A86 L93 Y113 A116 F120S84-I88 PolarHBondContact O-N 3.39Å; F85-I88 PolarHBondContact O-N 3.37Å; A86-I88 VanDerWaalsContact C-N 3.31Å; A86-I88 PolarHBondContact O-N 2.92Å; I88-L93 HydrophobicContact CG2-CD1 4.32Å; I88-Y113 HydrophobicContact CG2-CD2 4.3Å; I88-Y113 WeakPolarHBondContact O-CD2 3.43Å; I88-Y113 VanDerWaalsContact O-CE2 3.27Å; I88-Y113 WeakPolarHBondContact O-CE2 3.21Å; I88-A116 HydrophobicContact CB-CB 4.19Å; I88-A116 HydrophobicContact CD1-CB 3.81Å; I88-A116 HydrophobicContact CG2-CB 3.69Å; I88-F120 HydrophobicContact CD1-CE2 3.96Å
89N98.3Very high98Very high2 Ų230.2 Ų30.21%0.01115%0.154CC..Hα-helixtrans-87.1-14.3-171.8-81.3-97.5000114.6F85 Y113 G117 K308F85-N89 HydrophobicContact CD1-CB 4.47Å; F85-N89 HydrophobicContact CD2-CB 4.34Å; F85-N89 HydrophobicContact CE1-CB 4.28Å; F85-N89 HydrophobicContact CE2-CB 4.17Å; F85-N89 HydrophobicContact CZ-CB 4.15Å; F85-N89 WeakPolarHBondContact O-CA 3.29Å; F85-N89 WeakPolarHBondContact O-CB 3.32Å; F85-N89 PolarHBondContact O-N 2.97Å; N89-Y113 VanDerWaalsContact CA-CE2 3.47Å; N89-Y113 WeakPolarHBondContact CA-OH 3.47Å; N89-Y113 HydrophobicContact CB-CE2 4.3Å; N89-Y113 PolarHBondContact O-OH 3.29Å; N89-Y113 WeakPolarHBondContact OD1-CE1 3.42Å; N89-Y113 VanDerWaalsContact OD1-CZ 3.25Å; N89-Y113 PolarHBondContact OD1-OH 3.21Å; N89-G117 WeakPolarHBondContact ND2-CA 3.36Å; N89-G117 PolarHBondContact ND2-N 2.96Å; N89-G117 VanDerWaalsContact ND2-N 3.14Å; N89-K308 PolarHBondContact OD1-NZ 3.22Å
90G95.7Very high97.8Very high3 Ų334.7 Ų34.73%0.03118%0.178CC..SBendtrans-100.8-115.917600000111.9A86 K94A86-G90 VanDerWaalsContact O-CA 3.26Å; A86-G90 WeakPolarHBondContact O-CA 3.47Å; A86-G90 PolarHBondContact O-N 3.45Å; G90-K94 PolarHBondContact O-N 3.26Å
91F94.4Very high97.7Very high94 Ų9433.6 Ų33.641%0.41217%0.172SC..THydrogen-bonded Turntrans-89.7131.5175.7-176.9-87000110.1T95F91-T95 HydrophobicContact CD2-CG2 3.79Å; F91-T95 HydrophobicContact CE2-CG2 4.19Å
92P96Very high97.5Very high47 Ų4738.3 Ų38.331%0.30519%0.189SC..THydrogen-bonded Turncis-99.3-2214.135.7-34.8000115.7K94 T95 I96P92-K94 PolarHBondContact O-N 3.04Å; P92-T95 PolarHBondContact O-N 3.26Å; P92-I96 HydrophobicContact CB-CD1 3.81Å; P92-I96 HydrophobicContact CB-CG1 4.39Å; P92-I96 WeakPolarHBondContact O-CB 3.39Å; P92-I96 WeakPolarHBondContact O-CG1 3.12Å; P92-I96 PolarHBondContact O-N 3.46Å
93L98.1Very high97.4Very high39 Ų3938.3 Ų38.320%0.20419%0.189CC..Hα-helixtrans-61.1-55.3-162.2-65.2179000113.7I88 A97 W103 W105 Y113I88-L93 HydrophobicContact CG2-CD1 4.32Å; L93-A97 VanDerWaalsContact O-CB 3.29Å; L93-A97 WeakPolarHBondContact O-CB 3.02Å; L93-A97 PolarHBondContact O-N 3.38Å; L93-W103 HydrophobicContact CB-CH2 4.27Å; L93-W103 HydrophobicContact CD1-CH2 4.5Å; L93-W105 HydrophobicContact CD2-CD2 3.71Å; L93-W105 VanDerWaalsContact CD2-CE2 3.45Å; L93-W105 HydrophobicContact CD2-CE3 4.2Å; L93-W105 HydrophobicContact CD2-CG 4.1Å; L93-W105 HydrophobicContact CD2-CH2 4.25Å; L93-W105 HydrophobicContact CD2-CZ2 3.76Å; L93-W105 HydrophobicContact CD2-CZ3 4.45Å; L93-W105 PolarHBondContact O-NE1 3.13Å; L93-Y113 HydrophobicContact CB-CD2 4.2Å; L93-Y113 HydrophobicContact CB-CE2 4.24Å; L93-Y113 HydrophobicContact CD1-CD2 4.04Å
94K98.2Very high97.2Very high0 Ų038.1 Ų38.10%020%0.203CC..Hα-helixtrans-67.7-39.9179.2179170.1173.5154.40111I43 G90 P92 A97 A98 Y113 E301 K308I43-K94 HydrophobicContact CD1-CD 4.36Å; I43-K94 HydrophobicContact CG1-CD 3.95Å; I43-K94 HydrophobicContact CG1-CG 4.27Å; I43-K94 HydrophobicContact CG2-CG 4.1Å; G90-K94 PolarHBondContact O-N 3.26Å; P92-K94 PolarHBondContact O-N 3.04Å; K94-A97 PolarHBondContact O-N 2.89Å; K94-A98 WeakPolarHBondContact O-CB 3.46Å; K94-A98 PolarHBondContact O-N 2.87Å; K94-Y113 HydrophobicContact CB-CE2 4.21Å; K94-Y113 WeakPolarHBondContact CB-OH 3.43Å; K94-E301 WeakPolarHBondContact CE-OE1 3.44Å; K94-E301 IonicContact NZ-OE1 3.74Å; K94-E301 PolarHBondContact NZ-OE1 3.01Å; K94-E301 IonicContact NZ-OE2 3.88Å; K94-K308 HydrophobicContact CD-CD 3.91Å
95T98.4Very high97.1Very high8 Ų842.2 Ų42.25%0.04921%0.214CC..Hα-helixtrans-57-53.9177.5-59.50000111.2G40 I43 G44 F91 P92 A97 A98 F99G40-T95 WeakPolarHBondContact O-CG2 3.44Å; I43-T95 WeakPolarHBondContact CG2-OG1 3.32Å; G44-T95 WeakPolarHBondContact CA-OG1 3.35Å; G44-T95 PolarHBondContact N-OG1 3.48Å; F91-T95 HydrophobicContact CD2-CG2 3.79Å; F91-T95 HydrophobicContact CE2-CG2 4.19Å; P92-T95 PolarHBondContact O-N 3.26Å; T95-A97 PolarHBondContact O-N 2.9Å; T95-A98 WeakPolarHBondContact O-CB 2.94Å; T95-A98 PolarHBondContact O-N 3.16Å; T95-F99 HydrophobicContact CG2-CD2 3.88Å; T95-F99 HydrophobicContact CG2-CE2 3.76Å; T95-F99 VanDerWaalsContact O-CD2 3.24Å; T95-F99 WeakPolarHBondContact O-CD2 3.27Å; T95-F99 PolarHBondContact O-N 3.17Å
96I98.4Very high97Very high60 Ų6042.6 Ų42.631%0.30822%0.221SC..Hα-helixtrans-65.3-41.4-178.9-66.5174.8000110.8P92 A98 F99 N100 W105P92-I96 HydrophobicContact CB-CD1 3.81Å; P92-I96 HydrophobicContact CB-CG1 4.39Å; P92-I96 WeakPolarHBondContact O-CB 3.39Å; P92-I96 WeakPolarHBondContact O-CG1 3.12Å; P92-I96 PolarHBondContact O-N 3.46Å; I96-A98 VanDerWaalsContact C-N 3.27Å; I96-A98 PolarHBondContact O-N 3.35Å; I96-F99 PolarHBondContact O-N 3.42Å; I96-N100 WeakPolarHBondContact O-CB 3.18Å; I96-N100 PolarHBondContact O-N 3.14Å; I96-N100 PolarHBondContact O-ND2 3Å; I96-W105 HydrophobicContact CB-CZ2 4.07Å; I96-W105 HydrophobicContact CD1-CH2 4.35Å; I96-W105 HydrophobicContact CD1-CZ2 4.1Å; I96-W105 HydrophobicContact CG2-CZ2 3.94Å
97A98.1Very high97Very high0 Ų045 Ų450%023%0.23CC..Hα-helixtrans-58.9-40.1175.300000111.9L93 K94 T95 N100 H101 R102 W103 T186L93-A97 VanDerWaalsContact O-CB 3.29Å; L93-A97 WeakPolarHBondContact O-CB 3.02Å; L93-A97 PolarHBondContact O-N 3.38Å; K94-A97 PolarHBondContact O-N 2.89Å; T95-A97 PolarHBondContact O-N 2.9Å; A97-N100 CarbonylContact O-C 3.45Å; A97-N100 PolarHBondContact O-N 2.96Å; A97-H101 PolarHBondContact O-N 2.6Å; A97-R102 WeakPolarHBondContact CA-O 3.22Å; A97-R102 PolarHBondContact O-N 3.29Å; A97-R102 VanDerWaalsContact O-N 3.07Å; A97-R102 VanDerWaalsContact O-O 3.11Å; A97-W103 HydrophobicContact CB-CE3 4.14Å; A97-T186 WeakPolarHBondContact CB-O 3.25Å
98A98Very high96.9Very high0 Ų046.6 Ų46.60%024%0.239CC..Hα-helixtrans-63.5-47.5174.100000111.8Y36 V39 K94 T95 I96 N100 H101 T186Y36-A98 WeakPolarHBondContact CB-O 3.38Å; V39-A98 HydrophobicContact CG1-CB 4.09Å; K94-A98 WeakPolarHBondContact O-CB 3.46Å; K94-A98 PolarHBondContact O-N 2.87Å; T95-A98 WeakPolarHBondContact O-CB 2.94Å; T95-A98 PolarHBondContact O-N 3.16Å; I96-A98 VanDerWaalsContact C-N 3.27Å; I96-A98 PolarHBondContact O-N 3.35Å; A98-N100 PolarHBondContact O-N 3.42Å; A98-H101 PolarHBondContact O-CD2 3.15Å; A98-H101 PolarHBondContact O-N 3.29Å; A98-T186 HydrophobicContact CB-CG2 4.32Å
99F97.9Very high96.9Very high87 Ų8745.3 Ų45.338%0.38224%0.237SC..Hα-helixtrans-62.3-25.1175.4-81.1-79.9000114.1Y37 I41 T95 I96Y37-F99 AromaticContact CD1-CD1 3.53Å; Y37-F99 HydrophobicContact CD1-CD1 3.53Å; Y37-F99 AromaticContact CD1-CE1 3.92Å; Y37-F99 HydrophobicContact CD1-CE1 3.92Å; Y37-F99 HydrophobicContact CD1-CG 4.41Å; Y37-F99 AromaticContact CE1-CD1 3.96Å; Y37-F99 HydrophobicContact CE1-CD1 3.96Å; I41-F99 HydrophobicContact CG1-CZ 3.85Å; T95-F99 HydrophobicContact CG2-CD2 3.88Å; T95-F99 HydrophobicContact CG2-CE2 3.76Å; T95-F99 VanDerWaalsContact O-CD2 3.24Å; T95-F99 WeakPolarHBondContact O-CD2 3.27Å; T95-F99 PolarHBondContact O-N 3.17Å; I96-F99 PolarHBondContact O-N 3.42Å
100N96Very high97Very high96 Ų9645.2 Ų45.251%0.51324%0.236SC..THydrogen-bonded Turntrans-91.2-0.5175.2-70.2-25000113.8I96 A97 A98 R102I96-N100 WeakPolarHBondContact O-CB 3.18Å; I96-N100 PolarHBondContact O-N 3.14Å; I96-N100 PolarHBondContact O-ND2 3Å; A97-N100 CarbonylContact O-C 3.45Å; A97-N100 PolarHBondContact O-N 2.96Å; A98-N100 PolarHBondContact O-N 3.42Å; N100-R102 PolarHBondContact O-N 2.95Å; N100-R102 VanDerWaalsContact O-N 3.08Å
101H95.3Very high97.1Very high39 Ų3947.3 Ų47.318%0.18125%0.245CC..THydrogen-bonded Turntrans58.813.5-176.2-42.8149.3000115.3Y36 Y37 A97 A98Y36-H101 WeakPolarHBondContact CB-CD2 3.13Å; Y36-H101 HydrophobicContact CD1-CB 4.13Å; Y36-H101 HydrophobicContact CD2-CB 4.21Å; Y36-H101 HydrophobicContact CE1-CB 4.2Å; Y36-H101 HydrophobicContact CE2-CB 4.28Å; Y36-H101 HydrophobicContact CG-CB 4.12Å; Y36-H101 AromaticContact CG-CD2 3.7Å; Y37-H101 AromaticContact CE1-NE2 3.32Å; Y37-H101 VanDerWaalsContact CE1-NE2 3.32Å; Y37-H101 WeakPolarHBondContact CE1-NE2 3.26Å; Y37-H101 AromaticContact CE2-NE2 3.92Å; Y37-H101 AromaticContact CZ-CE1 3.8Å; Y37-H101 AromaticContact CZ-NE2 3.23Å; Y37-H101 PolarHBondContact OH-CE1 3.24Å; Y37-H101 PolarHBondContact OH-NE2 2.87Å; A97-H101 PolarHBondContact O-N 2.6Å; A98-H101 PolarHBondContact O-CD2 3.15Å; A98-H101 PolarHBondContact O-N 3.29Å
102R95.3Very high97.3Very high99 Ų9947 Ų4737%0.37425%0.247SC..SBendtrans-162.5156179.967.9179.1-176.6149.94.2111.7L10 W11 A97 N100 G104 H185L10-R102 HydrophobicContact CD1-CB 4.32Å; L10-R102 HydrophobicContact CD2-CB 4.16Å; L10-R102 PolarHBondContact O-NH1 3.24Å; W11-R102 HydrophobicContact CZ2-CB 4.01Å; A97-R102 WeakPolarHBondContact CA-O 3.22Å; A97-R102 PolarHBondContact O-N 3.29Å; A97-R102 VanDerWaalsContact O-N 3.07Å; A97-R102 VanDerWaalsContact O-O 3.11Å; N100-R102 PolarHBondContact O-N 2.95Å; N100-R102 VanDerWaalsContact O-N 3.08Å; R102-G104 PolarHBondContact O-N 3.45Å; R102-H185 CarbonylContact C-O 3.54Å
103W96.8Very high97.4Very high1 Ų144.8 Ų44.80%0.00423%0.233CC..  trans-68.8115.5168.4-173.9-94.4000109.5W11 F17 L93 A97 W105 G106 A109 C110 Y113 H185W11-W103 PolarHBondContact NE1-O 3.15Å; F17-W103 AromaticContact CD2-CD1 3.93Å; F17-W103 HydrophobicContact CE2-CB 4.27Å; F17-W103 AromaticContact CE2-CD1 3.21Å; F17-W103 AromaticContact CE2-CG 3.91Å; F17-W103 HydrophobicContact CE2-CG 3.91Å; F17-W103 AromaticContact CE2-NE1 3.9Å; F17-W103 HydrophobicContact CZ-CB 3.76Å; F17-W103 AromaticContact CZ-CD1 3.62Å; F17-W103 AromaticContact CZ-CG 3.91Å; F17-W103 HydrophobicContact CZ-CG 3.91Å; L93-W103 HydrophobicContact CB-CH2 4.27Å; L93-W103 HydrophobicContact CD1-CH2 4.5Å; A97-W103 HydrophobicContact CB-CE3 4.14Å; W103-W105 AromaticContact CD2-CD1 3.93Å; W103-W105 AromaticContact CE2-CD1 3.73Å; W103-W105 AromaticContact CH2-CD1 3.81Å; W103-W105 HydrophobicContact CZ2-CB 3.82Å; W103-W105 AromaticContact CZ2-CD1 3.69Å; W103-W105 HydrophobicContact CZ2-CG 4.09Å; W103-G106 PolarHBondContact NE1-O 3.33Å; W103-A109 HydrophobicContact CZ2-CB 4.02Å; W103-C110 HydrophobicContact CZ2-CB 4.33Å; W103-Y113 HydrophobicContact CH2-CD1 4.33Å; W103-Y113 AromaticContact CH2-CD2 3.45Å; W103-Y113 HydrophobicContact CH2-CD2 3.45Å; W103-Y113 VanDerWaalsContact CH2-CD2 3.45Å; W103-Y113 HydrophobicContact CH2-CE2 4.13Å; W103-Y113 AromaticContact CH2-CG 3.56Å; W103-Y113 HydrophobicContact CH2-CG 3.56Å; W103-Y113 HydrophobicContact CZ2-CG 4.45Å; W103-Y113 HydrophobicContact CZ3-CD1 4.46Å; W103-Y113 AromaticContact CZ3-CD2 3.84Å; W103-Y113 HydrophobicContact CZ3-CD2 3.84Å; W103-Y113 HydrophobicContact CZ3-CE2 4.06Å; W103-Y113 HydrophobicContact CZ3-CG 4.04Å; W103-H185 WeakPolarHBondContact CB-O 3.41Å; W103-H185 PolarHBondContact N-O 3.47Å
104G95Very high97.4Very high51 Ų5143 Ų4353%0.52622%0.223SC..  trans-108.69.3-175.200000114.8R102R102-G104 PolarHBondContact O-N 3.45Å
105W96.4Very high97.5Very high111 Ų11145 Ų4542%0.4223%0.233SC..SBendtrans-101.52.8-169.8-52.3105.3000114.2L93 I96 W103 A109L93-W105 HydrophobicContact CD2-CD2 3.71Å; L93-W105 VanDerWaalsContact CD2-CE2 3.45Å; L93-W105 HydrophobicContact CD2-CE3 4.2Å; L93-W105 HydrophobicContact CD2-CG 4.1Å; L93-W105 HydrophobicContact CD2-CH2 4.25Å; L93-W105 HydrophobicContact CD2-CZ2 3.76Å; L93-W105 HydrophobicContact CD2-CZ3 4.45Å; L93-W105 PolarHBondContact O-NE1 3.13Å; I96-W105 HydrophobicContact CB-CZ2 4.07Å; I96-W105 HydrophobicContact CD1-CH2 4.35Å; I96-W105 HydrophobicContact CD1-CZ2 4.1Å; I96-W105 HydrophobicContact CG2-CZ2 3.94Å; W103-W105 AromaticContact CD2-CD1 3.93Å; W103-W105 AromaticContact CE2-CD1 3.73Å; W103-W105 AromaticContact CH2-CD1 3.81Å; W103-W105 HydrophobicContact CZ2-CB 3.82Å; W103-W105 AromaticContact CZ2-CD1 3.69Å; W103-W105 HydrophobicContact CZ2-CG 4.09Å; W105-A109 HydrophobicContact CB-CB 3.52Å; W105-A109 WeakPolarHBondContact O-CB 3.46Å
106G96.6Very high97.5Very high17 Ų1744.9 Ų44.918%0.17523%0.232CC..Hα-helixtrans77176-176.700000114.1W103 C110W103-G106 PolarHBondContact NE1-O 3.33Å; G106-C110 PolarHBondContact O-N 3.28Å
107K97.2Very high97.4Very high53 Ų5342.5 Ų42.523%0.2322%0.222CC..Hα-helixtrans-63.3-52.3-174-178-174.6175.5-171.60113.8D16 I20 A109 C110 E111D16-K107 WeakPolarHBondContact OD1-CD 3.28Å; D16-K107 IonicContact OD1-NZ 3.04Å; D16-K107 PolarHBondContact OD1-NZ 3.17Å; D16-K107 VanDerWaalsContact OD2-CD 3.23Å; D16-K107 WeakPolarHBondContact OD2-CD 3.42Å; D16-K107 IonicContact OD2-NZ 3.8Å; I20-K107 HydrophobicContact CD1-CG 3.92Å; I20-K107 HydrophobicContact CG1-CG 4.4Å; I20-K107 HydrophobicContact CG2-CD 4.14Å; I20-K107 HydrophobicContact CG2-CG 4.26Å; K107-A109 VanDerWaalsContact C-N 3.27Å; K107-A109 PolarHBondContact O-N 2.72Å; K107-C110 WeakPolarHBondContact O-CA 3.47Å; K107-C110 WeakPolarHBondContact O-CB 3.48Å; K107-C110 PolarHBondContact O-N 3.38Å; K107-E111 VanDerWaalsContact CE-OE1 3.27Å; K107-E111 WeakPolarHBondContact CE-OE1 3.3Å; K107-E111 HydrophobicContact CG-CG 4.46Å; K107-E111 PolarHBondContact O-N 3.19Å
108L97.7Very high97.4Very high116 Ų11642.9 Ų42.961%0.60723%0.225SC*.Hα-helixtrans-58.1-41.5-178.1178.261.8000112C110 E111 L112L108-C110 VanDerWaalsContact C-N 3.3Å; L108-C110 PolarHBondContact O-N 3.36Å; L108-E111 PolarHBondContact O-N 2.94Å; L108-L112 HydrophobicContact CD1-CD1 4.1Å; L108-L112 HydrophobicContact CD1-CG 4.18Å; L108-L112 HydrophobicContact CG-CD1 4Å; L108-L112 HydrophobicContact CG-CG 4.47Å; L108-L112 WeakPolarHBondContact O-CB 3.35Å; L108-L112 VanDerWaalsContact O-CG 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.31Å; L108-L112 PolarHBondContact O-N 2.88Å
109A98.2Very high97.4Very high29 Ų2943.7 Ų43.724%0.2423%0.229CC..Hα-helixtrans-65.6-35.317700000112W103 W105 K107 Y113W103-A109 HydrophobicContact CZ2-CB 4.02Å; W105-A109 HydrophobicContact CB-CB 3.52Å; W105-A109 WeakPolarHBondContact O-CB 3.46Å; K107-A109 VanDerWaalsContact C-N 3.27Å; K107-A109 PolarHBondContact O-N 2.72Å; A109-Y113 WeakPolarHBondContact O-CB 3.21Å; A109-Y113 PolarHBondContact O-N 3.36Å
110C98.6Very high97.5Very high0 Ų040.7 Ų40.70%022%0.216CC..Hα-helixtrans-64-46.7175.1179.30000111.4F17 I20 W103 G106 K107 L108 Y113 G114 C188F17-C110 HydrophobicContact CD2-CB 4.38Å; F17-C110 HydrophobicContact CE2-CB 3.76Å; I20-C110 HydrophobicContact CD1-CB 4.31Å; W103-C110 HydrophobicContact CZ2-CB 4.33Å; G106-C110 PolarHBondContact O-N 3.28Å; K107-C110 WeakPolarHBondContact O-CA 3.47Å; K107-C110 WeakPolarHBondContact O-CB 3.48Å; K107-C110 PolarHBondContact O-N 3.38Å; L108-C110 VanDerWaalsContact C-N 3.3Å; L108-C110 PolarHBondContact O-N 3.36Å; C110-Y113 PolarHBondContact O-N 2.99Å; C110-G114 PolarHBondContact O-N 3.03Å; C110-C188 WeakPolarHBondContact CA-SG 3.45Å; C110-C188 HydrophobicContact CB-CB 3.95Å; C110-C188 WeakPolarHBondContact CB-SG 3.49Å; C110-C188 WeakPolarHBondContact O-CB 3.43Å; C110-C188 WeakPolarHBondContact SG-CB 3.34Å; C110-C188 CovalentContact SG-SG 2.01Å; C110-C188 PolarHBondContact SG-SG 3.22Å
111E98.4Very high97.6Very high46 Ų4636.4 Ų36.422%0.21519%0.194CC..Hα-helixtrans-62.7-46.7177.7-65.2170.8159.600111.5K107 L108 Y113 G114 F115 F173K107-E111 VanDerWaalsContact CE-OE1 3.27Å; K107-E111 WeakPolarHBondContact CE-OE1 3.3Å; K107-E111 HydrophobicContact CG-CG 4.46Å; K107-E111 PolarHBondContact O-N 3.19Å; L108-E111 PolarHBondContact O-N 2.94Å; E111-Y113 VanDerWaalsContact C-N 3.35Å; E111-Y113 PolarHBondContact O-N 2.6Å; E111-G114 PolarHBondContact O-N 3.22Å; E111-F115 VanDerWaalsContact O-CB 3.31Å; E111-F115 WeakPolarHBondContact O-CB 3.45Å; E111-F115 PolarHBondContact O-N 3.08Å; E111-F173 HydrophobicContact CB-CE1 3.95Å
112L98.6Very high97.7Very high87 Ų8735.4 Ų35.446%0.45519%0.189SC..Hα-helixtrans-65.1-36.5176.5-69.8174.4000112.7L108 A116 F173L108-L112 HydrophobicContact CD1-CD1 4.1Å; L108-L112 HydrophobicContact CD1-CG 4.18Å; L108-L112 HydrophobicContact CG-CD1 4Å; L108-L112 HydrophobicContact CG-CG 4.47Å; L108-L112 WeakPolarHBondContact O-CB 3.35Å; L108-L112 VanDerWaalsContact O-CG 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.31Å; L108-L112 PolarHBondContact O-N 2.88Å; L112-A116 VanDerWaalsContact O-CB 3.27Å; L112-A116 WeakPolarHBondContact O-CB 3.3Å; L112-A116 PolarHBondContact O-N 3.07Å; L112-F173 HydrophobicContact CD2-CZ 4.31Å
113Y98.7Very high97.9Very high1 Ų130.7 Ų30.70%0.00417%0.171CC..Hα-helixtrans-64.1-48.7175.4177.5-77.6000111I88 N89 L93 K94 W103 A109 C110 E111 A116 G117 C188 K308I88-Y113 HydrophobicContact CG2-CD2 4.3Å; I88-Y113 WeakPolarHBondContact O-CD2 3.43Å; I88-Y113 VanDerWaalsContact O-CE2 3.27Å; I88-Y113 WeakPolarHBondContact O-CE2 3.21Å; N89-Y113 VanDerWaalsContact CA-CE2 3.47Å; N89-Y113 WeakPolarHBondContact CA-OH 3.47Å; N89-Y113 HydrophobicContact CB-CE2 4.3Å; N89-Y113 PolarHBondContact O-OH 3.29Å; N89-Y113 WeakPolarHBondContact OD1-CE1 3.42Å; N89-Y113 VanDerWaalsContact OD1-CZ 3.25Å; N89-Y113 PolarHBondContact OD1-OH 3.21Å; L93-Y113 HydrophobicContact CB-CD2 4.2Å; L93-Y113 HydrophobicContact CB-CE2 4.24Å; L93-Y113 HydrophobicContact CD1-CD2 4.04Å; K94-Y113 HydrophobicContact CB-CE2 4.21Å; K94-Y113 WeakPolarHBondContact CB-OH 3.43Å; W103-Y113 HydrophobicContact CH2-CD1 4.33Å; W103-Y113 AromaticContact CH2-CD2 3.45Å; W103-Y113 HydrophobicContact CH2-CD2 3.45Å; W103-Y113 VanDerWaalsContact CH2-CD2 3.45Å; W103-Y113 HydrophobicContact CH2-CE2 4.13Å; W103-Y113 AromaticContact CH2-CG 3.56Å; W103-Y113 HydrophobicContact CH2-CG 3.56Å; W103-Y113 HydrophobicContact CZ2-CG 4.45Å; W103-Y113 HydrophobicContact CZ3-CD1 4.46Å; W103-Y113 AromaticContact CZ3-CD2 3.84Å; W103-Y113 HydrophobicContact CZ3-CD2 3.84Å; W103-Y113 HydrophobicContact CZ3-CE2 4.06Å; W103-Y113 HydrophobicContact CZ3-CG 4.04Å; A109-Y113 WeakPolarHBondContact O-CB 3.21Å; A109-Y113 PolarHBondContact O-N 3.36Å; C110-Y113 PolarHBondContact O-N 2.99Å; E111-Y113 VanDerWaalsContact C-N 3.35Å; E111-Y113 PolarHBondContact O-N 2.6Å; Y113-A116 PolarHBondContact O-N 3.43Å; Y113-G117 PolarHBondContact O-N 2.82Å; Y113-C188 HydrophobicContact CD1-CB 4.1Å; Y113-C188 VanDerWaalsContact CD1-O 3.22Å; Y113-C188 WeakPolarHBondContact CD1-O 3.22Å; Y113-C188 WeakPolarHBondContact CE1-O 3.47Å; Y113-K308 WeakPolarHBondContact OH-CE 3.34Å; Y113-K308 PolarHBondContact OH-NZ 3.5Å
114G98.5Very high98Very high1 Ų130.7 Ų30.71%0.0117%0.172CC..Hα-helixtrans-61.6-44.3177.300000111.8C110 E111 G117 S118 C188C110-G114 PolarHBondContact O-N 3.03Å; E111-G114 PolarHBondContact O-N 3.22Å; G114-G117 PolarHBondContact O-N 3.46Å; G114-S118 PolarHBondContact O-N 3.36Å; G114-C188 WeakPolarHBondContact CA-O 3.26Å
115F98.6Very high98.1Very high44 Ų4428.3 Ų28.319%0.19315%0.147CC..Hα-helixtrans-57.8-49173.2169.2-110.3000112.7E111 G117 S118 I119 S169 I170 F173 Y179E111-F115 VanDerWaalsContact O-CB 3.31Å; E111-F115 WeakPolarHBondContact O-CB 3.45Å; E111-F115 PolarHBondContact O-N 3.08Å; F115-G117 VanDerWaalsContact C-N 3.27Å; F115-G117 PolarHBondContact O-N 3.21Å; F115-S118 PolarHBondContact O-N 3.26Å; F115-I119 HydrophobicContact CE1-CD1 4.47Å; F115-I119 HydrophobicContact CE1-CG2 4.27Å; F115-I119 HydrophobicContact CE2-CB 4.2Å; F115-I119 HydrophobicContact CE2-CD1 4.18Å; F115-I119 HydrophobicContact CZ-CB 4.28Å; F115-I119 HydrophobicContact CZ-CD1 3.7Å; F115-I119 HydrophobicContact CZ-CG2 4.25Å; F115-I119 WeakPolarHBondContact O-CG2 3.37Å; F115-I119 PolarHBondContact O-N 2.75Å; F115-S169 WeakPolarHBondContact CD2-O 3.32Å; F115-I170 HydrophobicContact CE2-CG1 3.74Å; F115-I170 HydrophobicContact CZ-CG1 4.22Å; F115-F173 HydrophobicContact CB-CE2 3.73Å; F115-F173 HydrophobicContact CB-CZ 3.7Å; F115-F173 HydrophobicContact CD1-CE2 4.29Å; F115-F173 AromaticContact CD2-CE2 3.68Å; F115-F173 HydrophobicContact CD2-CE2 3.68Å; F115-F173 HydrophobicContact CD2-CZ 4.49Å; F115-F173 HydrophobicContact CE2-CE2 4.36Å; F115-F173 AromaticContact CG-CE2 3.63Å; F115-F173 HydrophobicContact CG-CE2 3.63Å; F115-F173 HydrophobicContact CG-CZ 4Å; F115-Y179 VanDerWaalsContact CA-CZ 3.45Å; F115-Y179 WeakPolarHBondContact CA-OH 3.3Å; F115-Y179 HydrophobicContact CB-CD2 4.44Å; F115-Y179 HydrophobicContact CB-CE2 3.79Å
116A98.6Very high98.2Very high5 Ų523.4 Ų23.44%0.04113%0.129CC..Hα-helixtrans-59.1-41.1177.800000111.4I88 L112 Y113 F120I88-A116 HydrophobicContact CB-CB 4.19Å; I88-A116 HydrophobicContact CD1-CB 3.81Å; I88-A116 HydrophobicContact CG2-CB 3.69Å; L112-A116 VanDerWaalsContact O-CB 3.27Å; L112-A116 WeakPolarHBondContact O-CB 3.3Å; L112-A116 PolarHBondContact O-N 3.07Å; Y113-A116 PolarHBondContact O-N 3.43Å; A116-F120 HydrophobicContact CB-CD2 4.2Å; A116-F120 HydrophobicContact CB-CE2 4.12Å; A116-F120 WeakPolarHBondContact O-CB 3.33Å; A116-F120 WeakPolarHBondContact O-CD2 3.41Å; A116-F120 PolarHBondContact O-N 3.28Å; A116-F120 VanDerWaalsContact O-N 3.16Å
117G98.2Very high98.3Very high9 Ų922.6 Ų22.69%0.09312%0.121CC..Hα-helixtrans-59.9-47175.800000112.1N89 Y113 G114 F115 G121N89-G117 WeakPolarHBondContact ND2-CA 3.36Å; N89-G117 PolarHBondContact ND2-N 2.96Å; N89-G117 VanDerWaalsContact ND2-N 3.14Å; Y113-G117 PolarHBondContact O-N 2.82Å; G114-G117 PolarHBondContact O-N 3.46Å; F115-G117 VanDerWaalsContact C-N 3.27Å; F115-G117 PolarHBondContact O-N 3.21Å; G117-G121 PolarHBondContact O-N 3.31Å; G117-G121 VanDerWaalsContact O-N 3.08Å
118S97.5Very high98.4Very high9 Ų920.3 Ų20.36%0.06311%0.111CC..Hα-helixtrans-63.2-56.3178.1-177.70000112.2G114 F115 F120 G121 F122 S169G114-S118 PolarHBondContact O-N 3.36Å; F115-S118 PolarHBondContact O-N 3.26Å; S118-F120 PolarHBondContact O-N 3.43Å; S118-G121 PolarHBondContact O-N 3.01Å; S118-F122 WeakPolarHBondContact O-CD2 3.12Å; S118-F122 PolarHBondContact O-N 2.85Å; S118-F122 VanDerWaalsContact OG-CE2 3.3Å; S118-F122 WeakPolarHBondContact OG-CE2 3.31Å; S118-S169 WeakPolarHBondContact OG-CB 3.44Å; S118-S169 PolarHBondContact OG-OG 3.45Å
119I98.4Very high98.4Very high16 Ų1614.9 Ų14.98%0.0828%0.083CC..Hα-helixtrans-63.6-47.1-172.3-168.2173.3000111.9F115 F122 I123 A166 S169F115-I119 HydrophobicContact CE1-CD1 4.47Å; F115-I119 HydrophobicContact CE1-CG2 4.27Å; F115-I119 HydrophobicContact CE2-CB 4.2Å; F115-I119 HydrophobicContact CE2-CD1 4.18Å; F115-I119 HydrophobicContact CZ-CB 4.28Å; F115-I119 HydrophobicContact CZ-CD1 3.7Å; F115-I119 HydrophobicContact CZ-CG2 4.25Å; F115-I119 WeakPolarHBondContact O-CG2 3.37Å; F115-I119 PolarHBondContact O-N 2.75Å; I119-F122 PolarHBondContact O-N 2.78Å; I119-I123 HydrophobicContact CD1-CD1 4.48Å; I119-I123 HydrophobicContact CG1-CD1 3.9Å; I119-I123 HydrophobicContact CG1-CG1 4.38Å; I119-I123 VanDerWaalsContact O-CG1 3.25Å; I119-I123 WeakPolarHBondContact O-CG1 3.45Å; I119-I123 PolarHBondContact O-N 3.45Å; I119-A166 HydrophobicContact CD1-CB 4.28Å; I119-S169 WeakPolarHBondContact CA-OG 3.5Å; I119-S169 PolarHBondContact N-OG 3.12Å
120F98.7Very high98.4Very high25 Ų2515 Ų1511%0.118%0.078CC..Hα-helixtrans-73.2-31.4-179.8-62.6-57.1000111.8S81 S84 F85 I88 A116 S118 F122 I123 S124 W162S81-F120 WeakPolarHBondContact OG-CA 3.24Å; S81-F120 PolarHBondContact OG-O 3.26Å; S84-F120 VanDerWaalsContact CB-CE1 3.48Å; F85-F120 HydrophobicContact CB-CB 3.71Å; F85-F120 HydrophobicContact CB-CG 4.4Å; F85-F120 HydrophobicContact CD2-CB 4.2Å; F85-F120 HydrophobicContact CG-CB 4.45Å; I88-F120 HydrophobicContact CD1-CE2 3.96Å; A116-F120 HydrophobicContact CB-CD2 4.2Å; A116-F120 HydrophobicContact CB-CE2 4.12Å; A116-F120 WeakPolarHBondContact O-CB 3.33Å; A116-F120 WeakPolarHBondContact O-CD2 3.41Å; A116-F120 PolarHBondContact O-N 3.28Å; A116-F120 VanDerWaalsContact O-N 3.16Å; S118-F120 PolarHBondContact O-N 3.43Å; F120-F122 VanDerWaalsContact C-N 3.35Å; F120-F122 PolarHBondContact O-N 2.85Å; F120-I123 HydrophobicContact CD1-CD1 3.98Å; F120-I123 HydrophobicContact CE1-CD1 4.32Å; F120-I123 PolarHBondContact O-N 2.97Å; F120-S124 WeakPolarHBondContact O-CB 3.48Å; F120-S124 PolarHBondContact O-N 3.37Å; F120-S124 PolarHBondContact O-OG 3.32Å; F120-W162 HydrophobicContact CE1-CH2 4.08Å; F120-W162 HydrophobicContact CE1-CZ3 4.37Å
121G97.8Very high98.4Very high5 Ų515.5 Ų15.55%0.0528%0.081CC..Hα-helixtrans-54.7-51.7168.300000111.4G117 S118 S124 L125 Y273G117-G121 PolarHBondContact O-N 3.31Å; G117-G121 VanDerWaalsContact O-N 3.08Å; S118-G121 PolarHBondContact O-N 3.01Å; G121-S124 PolarHBondContact O-N 3.24Å; G121-L125 PolarHBondContact O-N 3.16Å; G121-L125 VanDerWaalsContact O-N 3.12Å; G121-Y273 PolarHBondContact O-OH 3.5Å
122F98.1Very high98.4Very high18 Ų1813.3 Ų13.38%0.0797%0.071CC..Hα-helixtrans-70.9-34.5-179.9-69.6-51.7000114.4S118 I119 F120 S124 L125 T126 S165 L206 G210 F211S118-F122 WeakPolarHBondContact O-CD2 3.12Å; S118-F122 PolarHBondContact O-N 2.85Å; S118-F122 VanDerWaalsContact OG-CE2 3.3Å; S118-F122 WeakPolarHBondContact OG-CE2 3.31Å; I119-F122 PolarHBondContact O-N 2.78Å; F120-F122 VanDerWaalsContact C-N 3.35Å; F120-F122 PolarHBondContact O-N 2.85Å; F122-S124 VanDerWaalsContact C-N 3.31Å; F122-S124 PolarHBondContact O-N 2.96Å; F122-L125 PolarHBondContact O-N 3.3Å; F122-T126 VanDerWaalsContact O-CB 3.23Å; F122-T126 WeakPolarHBondContact O-CB 3.5Å; F122-T126 PolarHBondContact O-N 3.38Å; F122-T126 PolarHBondContact O-OG1 3.49Å; F122-S165 VanDerWaalsContact C-OG 3.22Å; F122-S165 PolarHBondContact O-OG 3.29Å; F122-L206 HydrophobicContact CE2-CD1 3.88Å; F122-L206 HydrophobicContact CE2-CD2 4.23Å; F122-L206 HydrophobicContact CE2-CG 3.7Å; F122-L206 HydrophobicContact CZ-CD1 4.08Å; F122-L206 HydrophobicContact CZ-CD2 3.56Å; F122-L206 HydrophobicContact CZ-CG 3.46Å; F122-L206 VanDerWaalsContact CZ-CG 3.46Å; F122-G210 VanDerWaalsContact CD1-O 3.24Å; F122-G210 WeakPolarHBondContact CD1-O 3.32Å; F122-G210 VanDerWaalsContact CE1-C 3.4Å; F122-G210 WeakPolarHBondContact CE1-O 3.25Å; F122-F211 HydrophobicContact CE1-CB 4.36Å
123I98.8Very high98.3Very high0 Ų011.4 Ų11.40%06%0.061CC..Hα-helixtrans-60.9-45.6173.2-71.2167.8000109S81 I119 F120 T127 T161 W162 S165S81-I123 WeakPolarHBondContact OG-CB 3.41Å; S81-I123 WeakPolarHBondContact OG-CG2 3.49Å; I119-I123 HydrophobicContact CD1-CD1 4.48Å; I119-I123 HydrophobicContact CG1-CD1 3.9Å; I119-I123 HydrophobicContact CG1-CG1 4.38Å; I119-I123 VanDerWaalsContact O-CG1 3.25Å; I119-I123 WeakPolarHBondContact O-CG1 3.45Å; I119-I123 PolarHBondContact O-N 3.45Å; F120-I123 HydrophobicContact CD1-CD1 3.98Å; F120-I123 HydrophobicContact CE1-CD1 4.32Å; F120-I123 PolarHBondContact O-N 2.97Å; I123-T127 WeakPolarHBondContact O-CB 3.36Å; I123-T127 PolarHBondContact O-N 3.41Å; I123-T127 PolarHBondContact O-OG1 3.01Å; I123-T161 HydrophobicContact CB-CG2 4.3Å; I123-T161 HydrophobicContact CG1-CG2 4.47Å; I123-T161 HydrophobicContact CG2-CG2 3.9Å; I123-W162 HydrophobicContact CD1-CD2 3.67Å; I123-W162 HydrophobicContact CD1-CE3 3.6Å; I123-W162 HydrophobicContact CD1-CG 4.3Å; I123-W162 HydrophobicContact CD1-CH2 4.03Å; I123-W162 HydrophobicContact CD1-CZ2 4.08Å; I123-W162 HydrophobicContact CD1-CZ3 3.79Å; I123-W162 HydrophobicContact CG1-CD2 4.47Å; I123-S165 WeakPolarHBondContact CA-OG 3.45Å; I123-S165 WeakPolarHBondContact CG1-OG 3.33Å; I123-S165 PolarHBondContact N-OG 3.18Å; I123-S165 VanDerWaalsContact N-OG 3.12Å
124S98.7Very high98.1Very high1 Ų111.5 Ų11.51%0.0076%0.061CC..Hα-helixtrans-61.2-49.1178.9-66.80000111.5S81 D82 F120 G121 F122 T127 M128S81-S124 VanDerWaalsContact CB-OG 3.29Å; S81-S124 WeakPolarHBondContact CB-OG 3.11Å; S81-S124 PolarHBondContact OG-N 3.08Å; S81-S124 PolarHBondContact OG-OG 3.14Å; D82-S124 PolarHBondContact OD1-OG 2.87Å; F120-S124 WeakPolarHBondContact O-CB 3.48Å; F120-S124 PolarHBondContact O-N 3.37Å; F120-S124 PolarHBondContact O-OG 3.32Å; G121-S124 PolarHBondContact O-N 3.24Å; F122-S124 VanDerWaalsContact C-N 3.31Å; F122-S124 PolarHBondContact O-N 2.96Å; S124-T127 PolarHBondContact O-N 2.83Å; S124-M128 WeakPolarHBondContact O-CG 3.35Å; S124-M128 PolarHBondContact O-N 2.95Å
125L98.4Very high97.9Very high1 Ų112.8 Ų12.81%0.0057%0.066CC..Hα-helixtrans-63.7-46.3179.6179.759.1000112.9G121 F122 T127 M128 A129 F211 P214 V215 I218 Y273G121-L125 PolarHBondContact O-N 3.16Å; G121-L125 VanDerWaalsContact O-N 3.12Å; F122-L125 PolarHBondContact O-N 3.3Å; L125-T127 VanDerWaalsContact C-N 3.32Å; L125-T127 PolarHBondContact O-N 3.41Å; L125-M128 WeakPolarHBondContact O-CB 3.32Å; L125-M128 PolarHBondContact O-N 2.87Å; L125-M128 VanDerWaalsContact O-N 3.15Å; L125-A129 PolarHBondContact O-N 2.86Å; L125-F211 HydrophobicContact CD2-CD2 3.69Å; L125-F211 HydrophobicContact CD2-CE2 4.29Å; L125-F211 HydrophobicContact CD2-CG 4.46Å; L125-P214 HydrophobicContact CD1-CB 4.4Å; L125-P214 HydrophobicContact CD2-CB 4.05Å; L125-P214 HydrophobicContact CD2-CG 4.43Å; L125-P214 HydrophobicContact CG-CB 3.74Å; L125-P214 HydrophobicContact CG-CG 4.43Å; L125-V215 HydrophobicContact CD1-CG2 4.14Å; L125-V215 HydrophobicContact CD2-CG2 4.34Å; L125-I218 HydrophobicContact CD1-CD1 3.95Å; L125-Y273 HydrophobicContact CB-CE1 3.84Å; L125-Y273 HydrophobicContact CD1-CD1 4Å; L125-Y273 HydrophobicContact CD1-CE1 3.78Å; L125-Y273 HydrophobicContact CD2-CE1 4.34Å; L125-Y273 HydrophobicContact CG-CE1 4.18Å
126T98.5Very high97.7Very high9 Ų912.7 Ų12.76%0.0556%0.064CC..Hα-helixtrans-67.4-35.9-180-55.50000111F122 M128 A129 F130 T161F122-T126 VanDerWaalsContact O-CB 3.23Å; F122-T126 WeakPolarHBondContact O-CB 3.5Å; F122-T126 PolarHBondContact O-N 3.38Å; F122-T126 PolarHBondContact O-OG1 3.49Å; T126-M128 VanDerWaalsContact C-N 3.34Å; T126-M128 PolarHBondContact O-N 2.93Å; T126-A129 WeakPolarHBondContact O-CB 3.37Å; T126-A129 PolarHBondContact O-N 2.69Å; T126-F130 HydrophobicContact CG2-CD2 4.18Å; T126-F130 HydrophobicContact CG2-CE2 4Å; T126-F130 WeakPolarHBondContact O-CD2 3.44Å; T126-F130 PolarHBondContact O-N 3.04Å; T126-T161 HydrophobicContact CG2-CG2 4.07Å
127T98.8Very high97.5Very high0 Ų015.1 Ų15.10%08%0.077CC..Hα-helixtrans-61.6-42.5171.1-580000111.2L74 N77 L78 I123 S124 L125 A129 F130 I131 T161L74-T127 HydrophobicContact CB-CG2 4.13Å; L74-T127 HydrophobicContact CD2-CG2 4.47Å; L74-T127 WeakPolarHBondContact O-CG2 3.39Å; N77-T127 HydrophobicContact CB-CG2 4.32Å; N77-T127 PolarHBondContact ND2-OG1 3.42Å; L78-T127 HydrophobicContact CB-CG2 3.87Å; I123-T127 WeakPolarHBondContact O-CB 3.36Å; I123-T127 PolarHBondContact O-N 3.41Å; I123-T127 PolarHBondContact O-OG1 3.01Å; S124-T127 PolarHBondContact O-N 2.83Å; L125-T127 VanDerWaalsContact C-N 3.32Å; L125-T127 PolarHBondContact O-N 3.41Å; T127-A129 VanDerWaalsContact C-N 3.3Å; T127-A129 PolarHBondContact O-N 3.38Å; T127-F130 PolarHBondContact O-N 2.96Å; T127-F130 VanDerWaalsContact O-N 3.17Å; T127-I131 HydrophobicContact CG2-CD1 4.14Å; T127-I131 HydrophobicContact CG2-CG1 4.48Å; T127-I131 WeakPolarHBondContact O-CG1 3.39Å; T127-I131 PolarHBondContact O-N 3.48Å; T127-T161 WeakPolarHBondContact OG1-CG2 3.45Å
128M98.6Very high97.2Very high4 Ų415.7 Ų15.72%0.028%0.078CC..Hα-helixtrans-62.5-36175.2-71.3-172-174.200112.5L78 S124 L125 T126 F130 I131 A132 I218 L269 V270 Y273L78-M128 HydrophobicContact CD1-CE 4.06Å; L78-M128 HydrophobicContact CD1-CG 4.43Å; L78-M128 HydrophobicContact CD2-CE 3.96Å; L78-M128 HydrophobicContact CD2-CG 4.22Å; S124-M128 WeakPolarHBondContact O-CG 3.35Å; S124-M128 PolarHBondContact O-N 2.95Å; L125-M128 WeakPolarHBondContact O-CB 3.32Å; L125-M128 PolarHBondContact O-N 2.87Å; L125-M128 VanDerWaalsContact O-N 3.15Å; T126-M128 VanDerWaalsContact C-N 3.34Å; T126-M128 PolarHBondContact O-N 2.93Å; M128-F130 VanDerWaalsContact C-N 3.35Å; M128-I131 PolarHBondContact O-N 2.94Å; M128-A132 WeakPolarHBondContact O-CB 3.38Å; M128-A132 PolarHBondContact O-N 3.3Å; M128-I218 HydrophobicContact CB-CD1 4.22Å; M128-L269 HydrophobicContact CE-CB 4.05Å; M128-L269 HydrophobicContact SD-CB 4.4Å; M128-V270 HydrophobicContact CB-CG2 4.12Å; M128-V270 HydrophobicContact SD-CG2 4.12Å; M128-Y273 HydrophobicContact CE-CD2 3.92Å; M128-Y273 HydrophobicContact CE-CG 4.15Å; M128-Y273 HydrophobicContact SD-CD2 4.28Å; M128-Y273 HydrophobicContact SD-CG 4.02Å
129A98.6Very high96.9Very high3 Ų316.5 Ų16.53%0.0258%0.081CC..Hα-helixtrans-62.1-42.8172.600000111.9L125 T126 T127 A132 L133 P214 I217 I218L125-A129 PolarHBondContact O-N 2.86Å; T126-A129 WeakPolarHBondContact O-CB 3.37Å; T126-A129 PolarHBondContact O-N 2.69Å; T127-A129 VanDerWaalsContact C-N 3.3Å; T127-A129 PolarHBondContact O-N 3.38Å; A129-A132 PolarHBondContact O-N 3.28Å; A129-L133 WeakPolarHBondContact O-CG 3.41Å; A129-L133 PolarHBondContact O-N 3.47Å; A129-P214 HydrophobicContact CB-CB 4.18Å; A129-I217 HydrophobicContact CB-CB 4.29Å; A129-I217 HydrophobicContact CB-CG2 4.03Å; A129-I218 VanDerWaalsContact CA-CG1 3.47Å; A129-I218 HydrophobicContact CB-CD1 4.2Å; A129-I218 HydrophobicContact CB-CG1 3.83Å
130F98.5Very high96.6Very high30 Ų3017.1 Ų17.113%0.1329%0.086CC..Hα-helixtrans-68.4-34.5174.9-82.9-53.5000113.9L74 T126 T127 M128 A132 L133 D134 M157 I160 T161L74-F130 HydrophobicContact CD1-CB 4.12Å; L74-F130 HydrophobicContact CD2-CB 4.14Å; T126-F130 HydrophobicContact CG2-CD2 4.18Å; T126-F130 HydrophobicContact CG2-CE2 4Å; T126-F130 WeakPolarHBondContact O-CD2 3.44Å; T126-F130 PolarHBondContact O-N 3.04Å; T127-F130 PolarHBondContact O-N 2.96Å; T127-F130 VanDerWaalsContact O-N 3.17Å; M128-F130 VanDerWaalsContact C-N 3.35Å; F130-A132 VanDerWaalsContact C-N 3.35Å; F130-L133 HydrophobicContact CD1-CD1 3.94Å; F130-L133 HydrophobicContact CE1-CD1 4.23Å; F130-L133 PolarHBondContact O-N 3.36Å; F130-D134 WeakPolarHBondContact O-CB 3.29Å; F130-D134 PolarHBondContact O-N 3.28Å; F130-M157 HydrophobicContact CB-CE 3.67Å; F130-M157 HydrophobicContact CD1-CB 4.06Å; F130-M157 HydrophobicContact CD1-CE 3.3Å; F130-M157 HydrophobicContact CD1-CG 3.91Å; F130-M157 HydrophobicContact CD1-SD 4.46Å; F130-M157 HydrophobicContact CD2-CB 4.3Å; F130-M157 HydrophobicContact CE1-CB 4.15Å; F130-M157 HydrophobicContact CE1-CE 4.17Å; F130-M157 HydrophobicContact CE1-CG 3.92Å; F130-M157 HydrophobicContact CE2-CB 4.39Å; F130-M157 WeakPolarHBondContact CE2-O 3.47Å; F130-M157 HydrophobicContact CG-CB 4.12Å; F130-M157 HydrophobicContact CG-CE 3.74Å; F130-M157 HydrophobicContact CG-CG 4.45Å; F130-M157 HydrophobicContact CZ-CB 4.31Å; F130-M157 HydrophobicContact CZ-CG 4.47Å; F130-I160 HydrophobicContact CE2-CB 4.37Å; F130-I160 HydrophobicContact CE2-CG2 4.1Å; F130-I160 HydrophobicContact CZ-CB 4.23Å; F130-I160 HydrophobicContact CZ-CG2 3.87Å; F130-T161 WeakPolarHBondContact CD2-OG1 3.36Å; F130-T161 WeakPolarHBondContact CE2-OG1 3.48Å
131I97.9Very high95.9Very high11 Ų1119.5 Ų19.56%0.05610%0.097CC..Hα-helixtrans-62.9-43.6170.7-68.3168.3000110L74 L78 T127 M128 D134 R135L74-I131 HydrophobicContact CB-CD1 4.27Å; L74-I131 HydrophobicContact CB-CG1 3.7Å; L74-I131 HydrophobicContact CD1-CG1 4.1Å; L78-I131 HydrophobicContact CD2-CD1 4.2Å; T127-I131 HydrophobicContact CG2-CD1 4.14Å; T127-I131 HydrophobicContact CG2-CG1 4.48Å; T127-I131 WeakPolarHBondContact O-CG1 3.39Å; T127-I131 PolarHBondContact O-N 3.48Å; M128-I131 PolarHBondContact O-N 2.94Å; I131-D134 PolarHBondContact O-N 3.19Å; I131-R135 WeakPolarHBondContact O-CG 3.27Å; I131-R135 PolarHBondContact O-N 2.93Å
132A97.8Very high94.6Very high0 Ų024 Ų240%013%0.126CC..Hα-helixtrans-63.5-41.7176.900000111.7M128 A129 F130 R135 Y136 I218 Y222M128-A132 WeakPolarHBondContact O-CB 3.38Å; M128-A132 PolarHBondContact O-N 3.3Å; A129-A132 PolarHBondContact O-N 3.28Å; F130-A132 VanDerWaalsContact C-N 3.35Å; A132-R135 PolarHBondContact O-N 3.04Å; A132-Y136 WeakPolarHBondContact O-CB 3.47Å; A132-Y136 PolarHBondContact O-N 2.86Å; A132-I218 HydrophobicContact CB-CG1 4.29Å; A132-Y222 HydrophobicContact CB-CD2 4.45Å; A132-Y222 HydrophobicContact CB-CE2 3.84Å
133L96.1Very high93.2Very high48 Ų4830 Ų3025%0.25115%0.152SC..Hα-helixtrans-63.3-42.6175.1-77.5172.7000112.4A129 F130 R135 Y136 L137 I217 S221A129-L133 WeakPolarHBondContact O-CG 3.41Å; A129-L133 PolarHBondContact O-N 3.47Å; F130-L133 HydrophobicContact CD1-CD1 3.94Å; F130-L133 HydrophobicContact CE1-CD1 4.23Å; F130-L133 PolarHBondContact O-N 3.36Å; L133-R135 PolarHBondContact O-N 3.01Å; L133-Y136 WeakPolarHBondContact O-CB 3.43Å; L133-Y136 PolarHBondContact O-N 3.14Å; L133-L137 VanDerWaalsContact O-CG 3.32Å; L133-L137 WeakPolarHBondContact O-CG 3.29Å; L133-L137 PolarHBondContact O-N 3.46Å; L133-I217 HydrophobicContact CD1-CG2 3.65Å; L133-I217 HydrophobicContact CD2-CG2 3.93Å; L133-I217 HydrophobicContact CG-CG2 3.61Å; L133-S221 WeakPolarHBondContact CD2-OG 3.32Å
134D94.9Very high91.7Very high2 Ų235.3 Ų35.31%0.01118%0.177CC..Hα-helixtrans-57.7-47.3173.8170.760.2000111.7F130 I131 Y136 L137 V138 I149F130-D134 WeakPolarHBondContact O-CB 3.29Å; F130-D134 PolarHBondContact O-N 3.28Å; I131-D134 PolarHBondContact O-N 3.19Å; D134-Y136 VanDerWaalsContact C-N 3.31Å; D134-Y136 PolarHBondContact O-N 3.12Å; D134-L137 PolarHBondContact O-N 3.15Å; D134-V138 WeakPolarHBondContact O-CG2 3.47Å; D134-V138 PolarHBondContact O-N 2.87Å; D134-I149 HydrophobicContact CB-CD1 3.44Å; D134-I149 VanDerWaalsContact CB-CD1 3.44Å; D134-I149 HydrophobicContact CB-CG1 4.42Å; D134-I149 WeakPolarHBondContact OD1-CD1 3.09Å; D134-I149 VanDerWaalsContact OD1-CG1 3.26Å; D134-I149 WeakPolarHBondContact OD1-CG1 3.32Å
135R94.7Very high89.9Confident28 Ų2841.3 Ų41.311%0.10621%0.214CC..Hα-helixtrans-61.6-39.4174.3-63.9-63.485.8118.5-9.8112.2I131 A132 L133 I139 I225 A263I131-R135 WeakPolarHBondContact O-CG 3.27Å; I131-R135 PolarHBondContact O-N 2.93Å; A132-R135 PolarHBondContact O-N 3.04Å; L133-R135 PolarHBondContact O-N 3.01Å; R135-I139 WeakPolarHBondContact O-CB 3.13Å; R135-I139 VanDerWaalsContact O-CG1 3.31Å; R135-I139 WeakPolarHBondContact O-CG1 3.49Å; R135-I139 PolarHBondContact O-N 3.39Å; R135-I225 HydrophobicContact CB-CD1 3.9Å; R135-A263 HydrophobicContact CB-CB 4.12Å; R135-A263 HydrophobicContact CG-CB 4.12Å
136Y94.4Very high88.3Confident42 Ų4248.6 Ų48.617%0.16525%0.245CC..Hα-helixtrans-61.8-47.2175.3162.3-95.9000111.3A132 L133 D134 V138 I139 V140 Q141 Q224A132-Y136 WeakPolarHBondContact O-CB 3.47Å; A132-Y136 PolarHBondContact O-N 2.86Å; L133-Y136 WeakPolarHBondContact O-CB 3.43Å; L133-Y136 PolarHBondContact O-N 3.14Å; D134-Y136 VanDerWaalsContact C-N 3.31Å; D134-Y136 PolarHBondContact O-N 3.12Å; Y136-V138 PolarHBondContact O-N 3.25Å; Y136-I139 PolarHBondContact O-N 2.86Å; Y136-V140 HydrophobicContact CD2-CB 3.84Å; Y136-V140 HydrophobicContact CD2-CG1 4.28Å; Y136-V140 HydrophobicContact CD2-CG2 3.65Å; Y136-V140 HydrophobicContact CE2-CB 3.78Å; Y136-V140 HydrophobicContact CE2-CG1 3.73Å; Y136-V140 HydrophobicContact CE2-CG2 3.98Å; Y136-V140 VanDerWaalsContact O-CB 3.24Å; Y136-V140 WeakPolarHBondContact O-CB 3.38Å; Y136-V140 PolarHBondContact O-N 3.28Å; Y136-Q141 PolarHBondContact OH-NE2 3.45Å; Y136-Q224 HydrophobicContact CD2-CB 3.74Å; Y136-Q224 HydrophobicContact CD2-CG 4.4Å; Y136-Q224 HydrophobicContact CE2-CB 3.6Å; Y136-Q224 HydrophobicContact CE2-CG 3.94Å
137L93.4Very high87.1Confident57 Ų5748.2 Ų48.230%0.29824%0.243SC..Hα-helixtrans-60.3-46.9179.8-69.9173.8000111.2L133 D134 Q141 S147 I149L133-L137 VanDerWaalsContact O-CG 3.32Å; L133-L137 WeakPolarHBondContact O-CG 3.29Å; L133-L137 PolarHBondContact O-N 3.46Å; D134-L137 PolarHBondContact O-N 3.15Å; L137-Q141 HydrophobicContact CD2-CG 4.08Å; L137-Q141 WeakPolarHBondContact O-CB 3.24Å; L137-Q141 WeakPolarHBondContact O-CG 3.09Å; L137-Q141 PolarHBondContact O-N 3.33Å; L137-S147 WeakPolarHBondContact O-CB 3.39Å; L137-I149 HydrophobicContact CD1-CD1 4.29Å; L137-I149 HydrophobicContact CD1-CG1 4.25Å
138V92.3Very high86.5Confident21 Ų2154 Ų5413%0.12727%0.265CS..Hα-helixtrans-70.4-36-177.4177.30000113D134 Y136 D259D134-V138 WeakPolarHBondContact O-CG2 3.47Å; D134-V138 PolarHBondContact O-N 2.87Å; Y136-V138 PolarHBondContact O-N 3.25Å; V138-D259 HydrophobicContact CG1-CB 4.11Å; V138-D259 VanDerWaalsContact CG1-CG 3.43Å; V138-D259 VanDerWaalsContact CG1-OD2 3.25Å; V138-D259 WeakPolarHBondContact CG1-OD2 3.45Å
139I91.7Very high86Confident25 Ų2554.4 Ų54.413%0.12827%0.267CS..Hα-helixtrans-91.9-36.7-173.1-63.7170.5000112.6R135 Y136 I225 V229 D259 I260 A263R135-I139 WeakPolarHBondContact O-CB 3.13Å; R135-I139 VanDerWaalsContact O-CG1 3.31Å; R135-I139 WeakPolarHBondContact O-CG1 3.49Å; R135-I139 PolarHBondContact O-N 3.39Å; Y136-I139 PolarHBondContact O-N 2.86Å; I139-I225 HydrophobicContact CD1-CG2 4.13Å; I139-I225 HydrophobicContact CG2-CG2 4.31Å; I139-V229 HydrophobicContact CG2-CG2 3.96Å; I139-D259 HydrophobicContact CD1-CB 4.39Å; I139-D259 HydrophobicContact CG1-CB 4.03Å; I139-I260 HydrophobicContact CD1-CG1 4.5Å; I139-A263 HydrophobicContact CD1-CB 3.68Å
140V91.5Very high85.8Confident29 Ų2957.7 Ų57.718%0.17629%0.287CS..Hα-helixtrans-95.7-33.1-171-178.40000112.4Y136 Q224 I225 T228Y136-V140 HydrophobicContact CD2-CB 3.84Å; Y136-V140 HydrophobicContact CD2-CG1 4.28Å; Y136-V140 HydrophobicContact CD2-CG2 3.65Å; Y136-V140 HydrophobicContact CE2-CB 3.78Å; Y136-V140 HydrophobicContact CE2-CG1 3.73Å; Y136-V140 HydrophobicContact CE2-CG2 3.98Å; Y136-V140 VanDerWaalsContact O-CB 3.24Å; Y136-V140 WeakPolarHBondContact O-CB 3.38Å; Y136-V140 PolarHBondContact O-N 3.28Å; V140-Q224 HydrophobicContact CG2-CB 4.36Å; V140-I225 HydrophobicContact CG2-CG1 4.07Å; V140-T228 WeakPolarHBondContact CG1-OG1 3.49Å; V140-T228 HydrophobicContact CG2-CG2 4.45Å
141Q83.7Confident85.6Confident75 Ų7562 Ų6235%0.3530%0.304SS..  trans-78.1131.3-175.9-62.4-67.3-42.700111.2Y136 L137 F143Y136-Q141 PolarHBondContact OH-NE2 3.45Å; L137-Q141 HydrophobicContact CD2-CG 4.08Å; L137-Q141 WeakPolarHBondContact O-CB 3.24Å; L137-Q141 WeakPolarHBondContact O-CG 3.09Å; L137-Q141 PolarHBondContact O-N 3.33Å; Q141-F143 VanDerWaalsContact C-N 3.32Å; Q141-F143 PolarHBondContact O-N 2.86Å
142P70.7Confident85.5Confident101 Ų10163.7 Ų63.766%0.65632%0.323SS*.SBendtrans-73.3-22-176.128.1-34.4000113.6
143F69.1Low85.4Confident142 Ų14268.2 Ų68.262%0.62334%0.343SS*.  trans-99.2104.6-173.8-58-67.4000111.9Q141 T145 F146 S147Q141-F143 VanDerWaalsContact C-N 3.32Å; Q141-F143 PolarHBondContact O-N 2.86Å; F143-T145 PolarHBondContact O-N 2.95Å; F143-T145 VanDerWaalsContact O-N 3.15Å; F143-F146 HydrophobicContact CB-CD2 4.14Å; F143-F146 PolarHBondContact O-N 3.4Å; F143-F146 VanDerWaalsContact O-N 3.12Å; F143-S147 WeakPolarHBondContact O-CB 3.35Å; F143-S147 PolarHBondContact O-N 2.95Å; F143-S147 VanDerWaalsContact O-N 3.09Å; F143-S147 PolarHBondContact O-OG 3.33Å
144E66.6Low85.5Confident113 Ų11365.9 Ų65.953%0.52833%0.331SS..Hα-helixtrans-50.5-37.3179.3-69.5-75.5166.800113.7F146 S147 R148E144-F146 VanDerWaalsContact C-N 3.32Å; E144-F146 PolarHBondContact O-N 3.41Å; E144-S147 VanDerWaalsContact CA-OG 3.31Å; E144-S147 WeakPolarHBondContact CA-OG 3.08Å; E144-S147 PolarHBondContact O-N 2.99Å; E144-S147 PolarHBondContact O-OG 3.02Å; E144-S147 VanDerWaalsContact O-OG 3.05Å; E144-R148 IonicContact OE2-NE 3.9Å
145T62.7Low85.6Confident126 Ų12669.3 Ų69.377%0.77335%0.348SS*.Hα-helixtrans-66.7-32.8-177-49.20000112.9F143F143-T145 PolarHBondContact O-N 2.95Å; F143-T145 VanDerWaalsContact O-N 3.15Å
146F63.2Low85.8Confident154 Ų15472 Ų7268%0.67537%0.367SS*.Hα-helixtrans-96.7-19.2-179.7-64.3-69.8000112.9F143 E144F143-F146 HydrophobicContact CB-CD2 4.14Å; F143-F146 PolarHBondContact O-N 3.4Å; F143-F146 VanDerWaalsContact O-N 3.12Å; E144-F146 VanDerWaalsContact C-N 3.32Å; E144-F146 PolarHBondContact O-N 3.41Å
147S73.8Confident86Confident1 Ų171 Ų711%0.00736%0.364CS..Hα-helixtrans-76.8-36.1-174.667.70000113.4L137 F143 E144 I149L137-S147 WeakPolarHBondContact O-CB 3.39Å; F143-S147 WeakPolarHBondContact O-CB 3.35Å; F143-S147 PolarHBondContact O-N 2.95Å; F143-S147 VanDerWaalsContact O-N 3.09Å; F143-S147 PolarHBondContact O-OG 3.33Å; E144-S147 VanDerWaalsContact CA-OG 3.31Å; E144-S147 WeakPolarHBondContact CA-OG 3.08Å; E144-S147 PolarHBondContact O-N 2.99Å; E144-S147 PolarHBondContact O-OG 3.02Å; E144-S147 VanDerWaalsContact O-OG 3.05Å; S147-I149 PolarHBondContact O-N 3.16Å
148R85.4Confident86.2Confident122 Ų12269.8 Ų69.846%0.4636%0.358SS..SBendtrans-79.7127.1-177.6-63.2-152-174.6-166.62112E144 D255E144-R148 IonicContact OE2-NE 3.9Å; R148-D255 IonicContact NH2-OD2 3.85Å; R148-D255 PolarHBondContact NH2-OD2 3.47Å
149I89.5Confident86.5Confident12 Ų1275.1 Ų75.16%0.06238%0.38CS..PPolyproline II helixtrans-71.8130.9176.2-65.8-165000110.2P70 D134 L137 S147 K153 V154 M157P70-I149 HydrophobicContact CB-CG2 4.39Å; P70-I149 WeakPolarHBondContact CB-O 3.49Å; P70-I149 WeakPolarHBondContact CG-O 3.27Å; D134-I149 HydrophobicContact CB-CD1 3.44Å; D134-I149 VanDerWaalsContact CB-CD1 3.44Å; D134-I149 HydrophobicContact CB-CG1 4.42Å; D134-I149 WeakPolarHBondContact OD1-CD1 3.09Å; D134-I149 VanDerWaalsContact OD1-CG1 3.26Å; D134-I149 WeakPolarHBondContact OD1-CG1 3.32Å; L137-I149 HydrophobicContact CD1-CD1 4.29Å; L137-I149 HydrophobicContact CD1-CG1 4.25Å; S147-I149 PolarHBondContact O-N 3.16Å; I149-K153 HydrophobicContact CG2-CB 4.06Å; I149-V154 HydrophobicContact CB-CG2 4.47Å; I149-V154 HydrophobicContact CG2-CB 4.38Å; I149-V154 HydrophobicContact CG2-CG2 3.14Å; I149-M157 HydrophobicContact CD1-CE 3.73Å; I149-M157 HydrophobicContact CD1-SD 3.85Å; I149-M157 HydrophobicContact CG2-SD 4.35Å
150T93.6Very high86.8Confident73 Ų7377.8 Ų77.845%0.44839%0.393SS..PPolyproline II helixtrans-95.7164.1176.566.60000111.2G152 K153 V154T150-G152 VanDerWaalsContact C-N 3.31Å; T150-G152 PolarHBondContact O-N 3.21Å; T150-K153 PolarHBondContact O-N 3.49Å; T150-K153 VanDerWaalsContact O-N 3.15Å; T150-K153 WeakPolarHBondContact OG1-CG 3.42Å; T150-K153 PolarHBondContact OG1-N 3.4Å; T150-V154 WeakPolarHBondContact O-CG2 3.46Å; T150-V154 PolarHBondContact O-N 3.2Å; T150-V154 VanDerWaalsContact O-N 3.08Å
151Y95.1Very high87.2Confident121 Ų12176.4 Ų76.448%0.47539%0.385SS..Hα-helixtrans-54.2-44.9176.8-73.9-77.1000113.1R68 P70 M73 K153 V154 I155R68-Y151 PolarHBondContact O-OH 3.1Å; P70-Y151 HydrophobicContact CB-CD1 4.5Å; P70-Y151 HydrophobicContact CG-CD1 4.13Å; P70-Y151 HydrophobicContact CG-CD2 3.92Å; P70-Y151 HydrophobicContact CG-CE1 4.08Å; P70-Y151 HydrophobicContact CG-CE2 3.88Å; P70-Y151 HydrophobicContact CG-CG 4.04Å; M73-Y151 HydrophobicContact SD-CD1 3.6Å; M73-Y151 HydrophobicContact SD-CE1 3.99Å; Y151-K153 PolarHBondContact O-N 2.87Å; Y151-V154 PolarHBondContact O-N 3.13Å; Y151-I155 VanDerWaalsContact O-CG1 3.29Å; Y151-I155 WeakPolarHBondContact O-CG1 3.14Å; Y151-I155 PolarHBondContact O-N 3.45Å
152G95.8Very high87.9Confident45 Ų4577.1 Ų77.146%0.46439%0.385SS..Hα-helixtrans-60.5-43.4177.700000112.6T150 I155 V156T150-G152 VanDerWaalsContact C-N 3.31Å; T150-G152 PolarHBondContact O-N 3.21Å; G152-I155 PolarHBondContact O-N 2.96Å; G152-V156 WeakPolarHBondContact O-CG2 3.25Å; G152-V156 PolarHBondContact O-N 3.01Å; G152-V156 VanDerWaalsContact O-N 3.16Å
153K95.3Very high89.2Confident95 Ų9577.9 Ų77.941%0.41338%0.382SS..Hα-helixtrans-62.1-44.6177.4-71.7178.4-179.21780111.8I149 T150 Y151 I155 V156 M157I149-K153 HydrophobicContact CG2-CB 4.06Å; T150-K153 PolarHBondContact O-N 3.49Å; T150-K153 VanDerWaalsContact O-N 3.15Å; T150-K153 WeakPolarHBondContact OG1-CG 3.42Å; T150-K153 PolarHBondContact OG1-N 3.4Å; Y151-K153 PolarHBondContact O-N 2.87Å; K153-I155 PolarHBondContact O-N 3.03Å; K153-V156 PolarHBondContact O-N 3.33Å; K153-M157 VanDerWaalsContact O-CG 3.23Å; K153-M157 WeakPolarHBondContact O-CG 3.14Å; K153-M157 PolarHBondContact O-N 2.87Å
154V97.4Very high90.6Very high0 Ų074.8 Ų74.80%037%0.366CS..Hα-helixtrans-65.4-41179.5-174.90000112.1P70 M73 L74 I149 T150 Y151 V156 M157 I158P70-V154 HydrophobicContact CB-CG2 3.65Å; P70-V154 WeakPolarHBondContact O-CG2 3.32Å; M73-V154 HydrophobicContact CB-CG1 3.66Å; L74-V154 HydrophobicContact CD2-CG1 3.95Å; L74-V154 HydrophobicContact CG-CG1 3.91Å; I149-V154 HydrophobicContact CB-CG2 4.47Å; I149-V154 HydrophobicContact CG2-CB 4.38Å; I149-V154 HydrophobicContact CG2-CG2 3.14Å; T150-V154 WeakPolarHBondContact O-CG2 3.46Å; T150-V154 PolarHBondContact O-N 3.2Å; T150-V154 VanDerWaalsContact O-N 3.08Å; Y151-V154 PolarHBondContact O-N 3.13Å; V154-V156 VanDerWaalsContact C-N 3.27Å; V154-V156 PolarHBondContact O-N 3.43Å; V154-M157 WeakPolarHBondContact O-CB 3.31Å; V154-M157 PolarHBondContact O-N 3.5Å; V154-M157 VanDerWaalsContact O-N 3.12Å; V154-I158 HydrophobicContact CG1-CD1 3.85Å; V154-I158 HydrophobicContact CG1-CG1 4.17Å; V154-I158 WeakPolarHBondContact O-CG1 3.32Å; V154-I158 PolarHBondContact O-N 3.27Å
155I98.2Very high92.1Very high73 Ų7369.4 Ų69.437%0.37434%0.341SS..Hα-helixtrans-58.4-45.1178-71.2166.7000109.8M73 Y151 G152 K153 M157 I158 F159M73-I155 HydrophobicContact CE-CG1 3.94Å; Y151-I155 VanDerWaalsContact O-CG1 3.29Å; Y151-I155 WeakPolarHBondContact O-CG1 3.14Å; Y151-I155 PolarHBondContact O-N 3.45Å; G152-I155 PolarHBondContact O-N 2.96Å; K153-I155 PolarHBondContact O-N 3.03Å; I155-M157 PolarHBondContact O-N 3.36Å; I155-I158 PolarHBondContact O-N 2.93Å; I155-F159 HydrophobicContact CG2-CD2 3.75Å; I155-F159 HydrophobicContact CG2-CE2 3.55Å; I155-F159 WeakPolarHBondContact O-CD2 3.3Å; I155-F159 PolarHBondContact O-N 3.05Å
156V98.2Very high93.8Very high84 Ų8464.4 Ų64.451%0.50931%0.313SS..Hα-helixtrans-60.7-44.6174.3173.30000111.7G152 K153 V154 I158 F159 I160G152-V156 WeakPolarHBondContact O-CG2 3.25Å; G152-V156 PolarHBondContact O-N 3.01Å; G152-V156 VanDerWaalsContact O-N 3.16Å; K153-V156 PolarHBondContact O-N 3.33Å; V154-V156 VanDerWaalsContact C-N 3.27Å; V154-V156 PolarHBondContact O-N 3.43Å; V156-I158 VanDerWaalsContact C-N 3.32Å; V156-I158 PolarHBondContact O-N 3.31Å; V156-F159 PolarHBondContact O-N 3.29Å; V156-I160 HydrophobicContact CG1-CD1 3.87Å; V156-I160 HydrophobicContact CG1-CG1 4.44Å; V156-I160 WeakPolarHBondContact O-CG1 3.49Å; V156-I160 PolarHBondContact O-N 3.27Å
157M98.2Very high95.5Very high21 Ų2161.7 Ų61.710%0.10330%0.304CS..Hα-helixtrans-60.8-39.2177.2-65.3158.977.300112.3L74 F130 I149 K153 V154 I155 I160 T161L74-M157 HydrophobicContact CD1-CE 3.98Å; L74-M157 HydrophobicContact CD2-CB 4.45Å; F130-M157 HydrophobicContact CB-CE 3.67Å; F130-M157 HydrophobicContact CD1-CB 4.06Å; F130-M157 HydrophobicContact CD1-CE 3.3Å; F130-M157 HydrophobicContact CD1-CG 3.91Å; F130-M157 HydrophobicContact CD1-SD 4.46Å; F130-M157 HydrophobicContact CD2-CB 4.3Å; F130-M157 HydrophobicContact CE1-CB 4.15Å; F130-M157 HydrophobicContact CE1-CE 4.17Å; F130-M157 HydrophobicContact CE1-CG 3.92Å; F130-M157 HydrophobicContact CE2-CB 4.39Å; F130-M157 WeakPolarHBondContact CE2-O 3.47Å; F130-M157 HydrophobicContact CG-CB 4.12Å; F130-M157 HydrophobicContact CG-CE 3.74Å; F130-M157 HydrophobicContact CG-CG 4.45Å; F130-M157 HydrophobicContact CZ-CB 4.31Å; F130-M157 HydrophobicContact CZ-CG 4.47Å; I149-M157 HydrophobicContact CD1-CE 3.73Å; I149-M157 HydrophobicContact CD1-SD 3.85Å; I149-M157 HydrophobicContact CG2-SD 4.35Å; K153-M157 VanDerWaalsContact O-CG 3.23Å; K153-M157 WeakPolarHBondContact O-CG 3.14Å; K153-M157 PolarHBondContact O-N 2.87Å; V154-M157 WeakPolarHBondContact O-CB 3.31Å; V154-M157 PolarHBondContact O-N 3.5Å; V154-M157 VanDerWaalsContact O-N 3.12Å; I155-M157 PolarHBondContact O-N 3.36Å; M157-I160 PolarHBondContact O-N 2.99Å; M157-T161 WeakPolarHBondContact O-CB 3.38Å; M157-T161 PolarHBondContact O-N 2.74Å; M157-T161 PolarHBondContact O-OG1 3.4Å
158I98.7Very high96.5Very high32 Ų3263.7 Ų63.716%0.16431%0.312CS..Hα-helixtrans-64.3-49174.4-69.5170.7000109.7M73 L74 N77 V154 I155 V156 I160 T161 W162M73-I158 HydrophobicContact CB-CD1 4.26Å; M73-I158 HydrophobicContact CE-CD1 4.44Å; L74-I158 HydrophobicContact CD2-CG1 4.17Å; N77-I158 HydrophobicContact CB-CD1 4.25Å; N77-I158 HydrophobicContact CB-CG1 4.19Å; V154-I158 HydrophobicContact CG1-CD1 3.85Å; V154-I158 HydrophobicContact CG1-CG1 4.17Å; V154-I158 WeakPolarHBondContact O-CG1 3.32Å; V154-I158 PolarHBondContact O-N 3.27Å; I155-I158 PolarHBondContact O-N 2.93Å; V156-I158 VanDerWaalsContact C-N 3.32Å; V156-I158 PolarHBondContact O-N 3.31Å; I158-I160 VanDerWaalsContact C-N 3.31Å; I158-I160 PolarHBondContact O-N 2.76Å; I158-T161 WeakPolarHBondContact O-CA 3.24Å; I158-T161 VanDerWaalsContact O-CB 3.26Å; I158-T161 WeakPolarHBondContact O-CB 3.38Å; I158-T161 PolarHBondContact O-N 3.5Å; I158-W162 VanDerWaalsContact O-CD1 3.23Å; I158-W162 PolarHBondContact O-N 2.71Å
159F98.6Very high97.1Very high133 Ų13357.9 Ų57.958%0.58329%0.29SS*.Hα-helixtrans-57-44176.5-82.6-67000112.7I155 V156 T161 W162 I163I155-F159 HydrophobicContact CG2-CD2 3.75Å; I155-F159 HydrophobicContact CG2-CE2 3.55Å; I155-F159 WeakPolarHBondContact O-CD2 3.3Å; I155-F159 PolarHBondContact O-N 3.05Å; V156-F159 PolarHBondContact O-N 3.29Å; F159-T161 VanDerWaalsContact C-N 3.31Å; F159-T161 PolarHBondContact O-N 3.47Å; F159-W162 PolarHBondContact O-N 3.38Å; F159-I163 WeakPolarHBondContact O-CB 3.22Å; F159-I163 VanDerWaalsContact O-CG1 3.31Å; F159-I163 WeakPolarHBondContact O-CG1 3.41Å; F159-I163 PolarHBondContact O-N 2.86Å
160I98.6Very high97.5Very high81 Ų8160.4 Ų60.442%0.41530%0.303SS..Hα-helixtrans-59.3-44.8175.1-67.9166.7000110.5F130 V156 M157 I158 W162 I163 W164F130-I160 HydrophobicContact CE2-CB 4.37Å; F130-I160 HydrophobicContact CE2-CG2 4.1Å; F130-I160 HydrophobicContact CZ-CB 4.23Å; F130-I160 HydrophobicContact CZ-CG2 3.87Å; V156-I160 HydrophobicContact CG1-CD1 3.87Å; V156-I160 HydrophobicContact CG1-CG1 4.44Å; V156-I160 WeakPolarHBondContact O-CG1 3.49Å; V156-I160 PolarHBondContact O-N 3.27Å; M157-I160 PolarHBondContact O-N 2.99Å; I158-I160 VanDerWaalsContact C-N 3.31Å; I158-I160 PolarHBondContact O-N 2.76Å; I160-W162 VanDerWaalsContact C-N 3.34Å; I160-W162 PolarHBondContact O-N 3.25Å; I160-I163 PolarHBondContact O-N 2.95Å; I160-W164 WeakPolarHBondContact O-CB 3.33Å; I160-W164 PolarHBondContact O-N 2.86Å
161T98.7Very high97.7Very high0 Ų058.5 Ų58.50%029%0.292CS..Hα-helixtrans-56-48.4178.5-60.70000111.6I123 T126 T127 F130 M157 I158 F159 S165I123-T161 HydrophobicContact CB-CG2 4.3Å; I123-T161 HydrophobicContact CG1-CG2 4.47Å; I123-T161 HydrophobicContact CG2-CG2 3.9Å; T126-T161 HydrophobicContact CG2-CG2 4.07Å; T127-T161 WeakPolarHBondContact OG1-CG2 3.45Å; F130-T161 WeakPolarHBondContact CD2-OG1 3.36Å; F130-T161 WeakPolarHBondContact CE2-OG1 3.48Å; M157-T161 WeakPolarHBondContact O-CB 3.38Å; M157-T161 PolarHBondContact O-N 2.74Å; M157-T161 PolarHBondContact O-OG1 3.4Å; I158-T161 WeakPolarHBondContact O-CA 3.24Å; I158-T161 VanDerWaalsContact O-CB 3.26Å; I158-T161 WeakPolarHBondContact O-CB 3.38Å; I158-T161 PolarHBondContact O-N 3.5Å; F159-T161 VanDerWaalsContact C-N 3.31Å; F159-T161 PolarHBondContact O-N 3.47Å; T161-S165 WeakPolarHBondContact O-CB 3.33Å; T161-S165 PolarHBondContact O-N 3.48Å; T161-S165 PolarHBondContact O-OG 2.87Å
162W98.7Very high97.8Very high91 Ų9153.5 Ų53.535%0.34527%0.274SS..Hα-helixtrans-69.5-45-178.6-78.677.2000112.1N77 I80 F120 I123 I158 F159 I160 S165 A166N77-W162 PolarHBondContact OD1-NE1 3.46Å; I80-W162 HydrophobicContact CG2-CZ2 4.34Å; F120-W162 HydrophobicContact CE1-CH2 4.08Å; F120-W162 HydrophobicContact CE1-CZ3 4.37Å; I123-W162 HydrophobicContact CD1-CD2 3.67Å; I123-W162 HydrophobicContact CD1-CE3 3.6Å; I123-W162 HydrophobicContact CD1-CG 4.3Å; I123-W162 HydrophobicContact CD1-CH2 4.03Å; I123-W162 HydrophobicContact CD1-CZ2 4.08Å; I123-W162 HydrophobicContact CD1-CZ3 3.79Å; I123-W162 HydrophobicContact CG1-CD2 4.47Å; I158-W162 VanDerWaalsContact O-CD1 3.23Å; I158-W162 PolarHBondContact O-N 2.71Å; F159-W162 PolarHBondContact O-N 3.38Å; I160-W162 VanDerWaalsContact C-N 3.34Å; I160-W162 PolarHBondContact O-N 3.25Å; W162-S165 PolarHBondContact O-N 3.04Å; W162-A166 VanDerWaalsContact O-CB 3.25Å; W162-A166 WeakPolarHBondContact O-CB 3.48Å; W162-A166 PolarHBondContact O-N 3.15Å
163I98.6Very high97.9Very high117 Ų11755.2 Ų55.260%0.627%0.269SS*.Hα-helixtrans-62.4-45.6177.6-68.3168.6000110.7F159 I160 S165 A166 L167F159-I163 WeakPolarHBondContact O-CB 3.22Å; F159-I163 VanDerWaalsContact O-CG1 3.31Å; F159-I163 WeakPolarHBondContact O-CG1 3.41Å; F159-I163 PolarHBondContact O-N 2.86Å; I160-I163 PolarHBondContact O-N 2.95Å; I163-S165 PolarHBondContact O-N 3.21Å; I163-A166 PolarHBondContact O-N 3.01Å; I163-L167 WeakPolarHBondContact O-CB 3.38Å; I163-L167 PolarHBondContact O-N 3.12Å
164W98.3Very high98Very high77 Ų7758.2 Ų58.229%0.29228%0.282SS..Hα-helixtrans-61.7-44.8178.9-171.3-96.9000111.8I160 L167 W168 L209I160-W164 WeakPolarHBondContact O-CB 3.33Å; I160-W164 PolarHBondContact O-N 2.86Å; W164-L167 WeakPolarHBondContact O-CB 3.29Å; W164-L167 PolarHBondContact O-N 3.48Å; W164-W168 AromaticContact CD1-CD1 4Å; W164-W168 AromaticContact CD2-NE1 3.88Å; W164-W168 AromaticContact CE2-NE1 3.43Å; W164-W168 AromaticContact CZ2-NE1 3.61Å; W164-W168 AromaticContact NE1-CD1 3.74Å; W164-W168 AromaticContact NE1-NE1 3.63Å; W164-W168 PolarHBondContact O-N 3.36Å; W164-L209 HydrophobicContact CH2-CD2 4.37Å; W164-L209 HydrophobicContact CZ2-CB 3.97Å; W164-L209 HydrophobicContact CZ2-CD2 4.32Å; W164-L209 WeakPolarHBondContact CZ2-O 3.46Å; W164-L209 PolarHBondContact NE1-O 2.92Å
165S98.6Very high97.8Very high0 Ų060.7 Ų60.70%031%0.308CS..Hα-helixtrans-68.4-37179.9-54.50000112.2F122 I123 T161 W162 I163 S169F122-S165 VanDerWaalsContact C-OG 3.22Å; F122-S165 PolarHBondContact O-OG 3.29Å; I123-S165 WeakPolarHBondContact CA-OG 3.45Å; I123-S165 WeakPolarHBondContact CG1-OG 3.33Å; I123-S165 PolarHBondContact N-OG 3.18Å; I123-S165 VanDerWaalsContact N-OG 3.12Å; T161-S165 WeakPolarHBondContact O-CB 3.33Å; T161-S165 PolarHBondContact O-N 3.48Å; T161-S165 PolarHBondContact O-OG 2.87Å; W162-S165 PolarHBondContact O-N 3.04Å; I163-S165 PolarHBondContact O-N 3.21Å; S165-S169 WeakPolarHBondContact O-CB 3.45Å; S165-S169 PolarHBondContact O-N 3Å; S165-S169 PolarHBondContact O-OG 3.45Å
166A98.1Very high97.7Very high21 Ų2163.9 Ų63.917%0.17432%0.316CS..Hα-helixtrans-66.5-42.7174.600000111.8I119 W162 I163 W168 S169 I170I119-A166 HydrophobicContact CD1-CB 4.28Å; W162-A166 VanDerWaalsContact O-CB 3.25Å; W162-A166 WeakPolarHBondContact O-CB 3.48Å; W162-A166 PolarHBondContact O-N 3.15Å; I163-A166 PolarHBondContact O-N 3.01Å; A166-W168 PolarHBondContact O-N 3.38Å; A166-W168 VanDerWaalsContact O-N 3.17Å; A166-S169 PolarHBondContact O-N 2.64Å; A166-I170 HydrophobicContact CB-CD1 3.85Å; A166-I170 HydrophobicContact CB-CG1 4.41Å; A166-I170 WeakPolarHBondContact O-CB 3.42Å; A166-I170 VanDerWaalsContact O-CG1 3.3Å; A166-I170 WeakPolarHBondContact O-CG1 3.35Å; A166-I170 PolarHBondContact O-N 3.42Å
167L97.2Very high97.6Very high96 Ų9659.9 Ų59.950%0.50329%0.292SS..Hα-helixtrans-53.2-37.8178.3-178.964.5000112.4I163 W164 P171I163-L167 WeakPolarHBondContact O-CB 3.38Å; I163-L167 PolarHBondContact O-N 3.12Å; W164-L167 WeakPolarHBondContact O-CB 3.29Å; W164-L167 PolarHBondContact O-N 3.48Å; L167-P171 VanDerWaalsContact O-CD 3.25Å; L167-P171 WeakPolarHBondContact O-CD 3.35Å; L167-P171 VanDerWaalsContact O-CG 3.32Å; L167-P171 WeakPolarHBondContact O-CG 3.44Å
168W95.6Very high97.6Very high44 Ų4461.2 Ų61.217%0.16730%0.304CS..THydrogen-bonded Turntrans-94.4-4.3-179.6-59.6113.7000114.9W164 A166 F202 L209W164-W168 AromaticContact CD1-CD1 4Å; W164-W168 AromaticContact CD2-NE1 3.88Å; W164-W168 AromaticContact CE2-NE1 3.43Å; W164-W168 AromaticContact CZ2-NE1 3.61Å; W164-W168 AromaticContact NE1-CD1 3.74Å; W164-W168 AromaticContact NE1-NE1 3.63Å; W164-W168 PolarHBondContact O-N 3.36Å; A166-W168 PolarHBondContact O-N 3.38Å; A166-W168 VanDerWaalsContact O-N 3.17Å; W168-F202 VanDerWaalsContact O-CE2 3.29Å; W168-F202 WeakPolarHBondContact O-CE2 3.48Å; W168-L209 HydrophobicContact CD2-CB 4.16Å; W168-L209 VanDerWaalsContact CE2-CB 3.43Å; W168-L209 HydrophobicContact CH2-CB 3.97Å; W168-L209 HydrophobicContact CH2-CD1 3.19Å; W168-L209 HydrophobicContact CH2-CG 4.17Å; W168-L209 HydrophobicContact CZ2-CB 3.35Å; W168-L209 HydrophobicContact CZ2-CD1 3.22Å; W168-L209 HydrophobicContact CZ2-CG 3.85Å; W168-L209 HydrophobicContact CZ3-CD1 4.15Å
169S97.9Very high97.6Very high0 Ų060 Ų600%030%0.297CS..THydrogen-bonded Turntrans-112.9-25.1-178.9-53.60000113.2F115 S118 I119 S165 A166 P172 Y179F115-S169 WeakPolarHBondContact CD2-O 3.32Å; S118-S169 WeakPolarHBondContact OG-CB 3.44Å; S118-S169 PolarHBondContact OG-OG 3.45Å; I119-S169 WeakPolarHBondContact CA-OG 3.5Å; I119-S169 PolarHBondContact N-OG 3.12Å; S165-S169 WeakPolarHBondContact O-CB 3.45Å; S165-S169 PolarHBondContact O-N 3Å; S165-S169 PolarHBondContact O-OG 3.45Å; A166-S169 PolarHBondContact O-N 2.64Å; S169-P172 WeakPolarHBondContact O-CD 3.24Å; S169-Y179 PolarHBondContact O-OH 3.4Å
170I98.1Very high97.5Very high65 Ų6554.1 Ų54.133%0.33327%0.271SS..SBendtrans-76.8-34-178.3-70.8178.7000115.3F115 A166 P172 F173 F174F115-I170 HydrophobicContact CE2-CG1 3.74Å; F115-I170 HydrophobicContact CZ-CG1 4.22Å; A166-I170 HydrophobicContact CB-CD1 3.85Å; A166-I170 HydrophobicContact CB-CG1 4.41Å; A166-I170 WeakPolarHBondContact O-CB 3.42Å; A166-I170 VanDerWaalsContact O-CG1 3.3Å; A166-I170 WeakPolarHBondContact O-CG1 3.35Å; A166-I170 PolarHBondContact O-N 3.42Å; I170-P172 VanDerWaalsContact C-N 3.31Å; I170-P172 WeakPolarHBondContact O-CD 3.39Å; I170-F173 WeakPolarHBondContact O-CD2 3.48Å; I170-F173 PolarHBondContact O-N 2.85Å; I170-F174 HydrophobicContact CG2-CD2 3.86Å; I170-F174 HydrophobicContact CG2-CE2 3.4Å
171P97.8Very high97.5Very high33 Ų3350.3 Ų50.321%0.21425%0.252CS..G310 helixtrans-50.3-33.1-172-29.535000117.7L167 F173 F174 Y176 F202L167-P171 VanDerWaalsContact O-CD 3.25Å; L167-P171 WeakPolarHBondContact O-CD 3.35Å; L167-P171 VanDerWaalsContact O-CG 3.32Å; L167-P171 WeakPolarHBondContact O-CG 3.44Å; P171-F173 PolarHBondContact O-N 3.45Å; P171-F173 VanDerWaalsContact O-N 3.16Å; P171-F174 CarbonylContact O-C 3.4Å; P171-F174 WeakPolarHBondContact O-CA 3.37Å; P171-F174 PolarHBondContact O-N 3.47Å; P171-Y176 CarbonylContact C-O 3.59Å; P171-Y176 WeakPolarHBondContact CB-O 3.34Å; P171-Y176 PolarHBondContact O-N 3.15Å; P171-F202 HydrophobicContact CB-CD2 3.88Å; P171-F202 HydrophobicContact CB-CE2 4.17Å; P171-F202 HydrophobicContact CG-CD2 4.26Å; P171-F202 HydrophobicContact CG-CE2 4.31Å
172P97.7Very high97.3Very high15 Ų1550.4 Ų50.410%0.09725%0.252CS..G310 helixtrans-58.4-27.3177-30.339.4000114.6S169 I170 F174 G175 Y179 F202S169-P172 WeakPolarHBondContact O-CD 3.24Å; I170-P172 VanDerWaalsContact C-N 3.31Å; I170-P172 WeakPolarHBondContact O-CD 3.39Å; P172-F174 PolarHBondContact O-N 3.31Å; P172-G175 PolarHBondContact O-N 2.74Å; P172-Y179 HydrophobicContact CB-CD2 3.63Å; P172-Y179 HydrophobicContact CB-CE2 3.54Å; P172-Y179 HydrophobicContact CB-CG 4.42Å; P172-Y179 HydrophobicContact CG-CD2 4.19Å; P172-Y179 HydrophobicContact CG-CE2 3.68Å; P172-F202 VanDerWaalsContact CD-CE2 3.47Å; P172-F202 HydrophobicContact CG-CD1 4.25Å; P172-F202 HydrophobicContact CG-CD2 4.2Å; P172-F202 HydrophobicContact CG-CE1 3.68Å; P172-F202 HydrophobicContact CG-CE2 3.62Å; P172-F202 HydrophobicContact CG-CG 4.49Å; P172-F202 HydrophobicContact CG-CZ 3.33Å
173F97.7Very high97Very high82 Ų8246.1 Ų46.136%0.3624%0.236SC..G310 helixtrans-71.4-10.9174.6-65-69.2000113.6E111 L112 F115 I170 P171 Y179E111-F173 HydrophobicContact CB-CE1 3.95Å; L112-F173 HydrophobicContact CD2-CZ 4.31Å; F115-F173 HydrophobicContact CB-CE2 3.73Å; F115-F173 HydrophobicContact CB-CZ 3.7Å; F115-F173 HydrophobicContact CD1-CE2 4.29Å; F115-F173 AromaticContact CD2-CE2 3.68Å; F115-F173 HydrophobicContact CD2-CE2 3.68Å; F115-F173 HydrophobicContact CD2-CZ 4.49Å; F115-F173 HydrophobicContact CE2-CE2 4.36Å; F115-F173 AromaticContact CG-CE2 3.63Å; F115-F173 HydrophobicContact CG-CE2 3.63Å; F115-F173 HydrophobicContact CG-CZ 4Å; I170-F173 WeakPolarHBondContact O-CD2 3.48Å; I170-F173 PolarHBondContact O-N 2.85Å; P171-F173 PolarHBondContact O-N 3.45Å; P171-F173 VanDerWaalsContact O-N 3.16Å; F173-Y179 HydrophobicContact CD2-CE2 4.47Å; F173-Y179 HydrophobicContact CE2-CD2 4.47Å; F173-Y179 AromaticContact CE2-CE2 3.95Å; F173-Y179 HydrophobicContact CE2-CE2 3.95Å; F173-Y179 HydrophobicContact CZ-CD2 4.26Å; F173-Y179 HydrophobicContact CZ-CE2 4.15Å
174F97Very high96.9Very high158 Ų15840.7 Ų40.769%0.69321%0.208SC*.G310 helixtrans-116.716.7-178.5-62-84.2000112.4I170 P171 P172 Y176I170-F174 HydrophobicContact CG2-CD2 3.86Å; I170-F174 HydrophobicContact CG2-CE2 3.4Å; P171-F174 CarbonylContact O-C 3.4Å; P171-F174 WeakPolarHBondContact O-CA 3.37Å; P171-F174 PolarHBondContact O-N 3.47Å; P172-F174 PolarHBondContact O-N 3.31Å; F174-Y176 VanDerWaalsContact C-N 3.35Å
175G94.2Very high96.8Very high52 Ų5237 Ų3754%0.53619%0.194SC..THydrogen-bonded Turntrans81.27177.600000115.4P172P172-G175 PolarHBondContact O-N 2.74Å
176Y95.8Very high96.8Very high139 Ų13937 Ų3755%0.54519%0.194SC..SBendtrans-100.884.3171.1-73.9-90.6000109.3P171 F174 F202P171-Y176 CarbonylContact C-O 3.59Å; P171-Y176 WeakPolarHBondContact CB-O 3.34Å; P171-Y176 PolarHBondContact O-N 3.15Å; F174-Y176 VanDerWaalsContact C-N 3.35Å; Y176-F202 WeakPolarHBondContact O-CB 3.33Å; Y176-F202 WeakPolarHBondContact O-CD2 3.25Å; Y176-F202 WeakPolarHBondContact O-CG 3.46Å
177G96.4Very high96.7Very high1 Ų136 Ų361%0.0119%0.186CC..SBendtrans99.1178.7-168.200000112.2N199G177-N199 VanDerWaalsContact CA-OD1 3.24Å; G177-N199 WeakPolarHBondContact CA-OD1 3.27Å
178S97.3Very high96.8Very high49 Ų4931.5 Ų31.534%0.34316%0.163SC..  trans-148.2158.5174.2-70.50000110.7F190 D191 N199S178-F190 CarbonylContact O-C 3.45Å; S178-F190 WeakPolarHBondContact O-CA 3.2Å; S178-D191 WeakPolarHBondContact O-CB 3.32Å; S178-D191 PolarHBondContact O-N 3.02Å; S178-N199 PolarHBondContact N-OD1 2.91Å
179Y98.3Very high96.9Very high6 Ų630.1 Ų30.12%0.02416%0.159CC..EExtended strand (participates in β ladder)trans-105.3124.9167.2-73.5-68.4000108.8F115 S169 P172 F173 T189 F190F115-Y179 VanDerWaalsContact CA-CZ 3.45Å; F115-Y179 WeakPolarHBondContact CA-OH 3.3Å; F115-Y179 HydrophobicContact CB-CD2 4.44Å; F115-Y179 HydrophobicContact CB-CE2 3.79Å; S169-Y179 PolarHBondContact O-OH 3.4Å; P172-Y179 HydrophobicContact CB-CD2 3.63Å; P172-Y179 HydrophobicContact CB-CE2 3.54Å; P172-Y179 HydrophobicContact CB-CG 4.42Å; P172-Y179 HydrophobicContact CG-CD2 4.19Å; P172-Y179 HydrophobicContact CG-CE2 3.68Å; F173-Y179 HydrophobicContact CD2-CE2 4.47Å; F173-Y179 HydrophobicContact CE2-CD2 4.47Å; F173-Y179 AromaticContact CE2-CE2 3.95Å; F173-Y179 HydrophobicContact CE2-CE2 3.95Å; F173-Y179 HydrophobicContact CZ-CD2 4.26Å; F173-Y179 HydrophobicContact CZ-CE2 4.15Å; Y179-T189 CarbonylContact C-O 3.58Å; Y179-T189 VanDerWaalsContact CA-O 3.27Å; Y179-T189 WeakPolarHBondContact CA-O 3.34Å; Y179-F190 HydrophobicContact CD1-CB 4.31Å; Y179-F190 HydrophobicContact CE1-CB 4.1Å
180I97.5Very high96.9Very high9 Ų930.9 Ų30.95%0.04616%0.162CC..EExtended strand (participates in β ladder)trans-133.5163-172.863.9164.8000111.5I20 H22 C188 T189 D191 L193I20-I180 WeakPolarHBondContact O-CG2 3.32Å; H22-I180 HydrophobicContact CB-CD1 3.81Å; I180-C188 CarbonylContact O-C 3.51Å; I180-C188 VanDerWaalsContact O-CA 3.26Å; I180-C188 WeakPolarHBondContact O-CA 3.29Å; I180-T189 PolarHBondContact N-O 3.31Å; I180-T189 PolarHBondContact O-N 2.97Å; I180-D191 HydrophobicContact CD1-CB 3.85Å; I180-D191 WeakPolarHBondContact CD1-OD1 3.26Å; I180-D191 HydrophobicContact CG1-CB 3.88Å; I180-D191 HydrophobicContact CG2-CB 4.04Å; I180-L193 HydrophobicContact CD1-CD1 4.03Å
181P97.3Very high96.8Very high1 Ų128.1 Ų28.11%0.00615%0.148CC..EExtended strand (participates in β ladder)trans-67.1143.3172.9-22.237.2000112.9F17 I20 V21 W25 H185F17-P181 HydrophobicContact CE1-CG 3.87Å; F17-P181 HydrophobicContact CE2-CG 3.91Å; F17-P181 HydrophobicContact CZ-CB 4.13Å; F17-P181 HydrophobicContact CZ-CG 3.28Å; I20-P181 HydrophobicContact CD1-CG 4.46Å; I20-P181 WeakPolarHBondContact O-CD 3.32Å; V21-P181 HydrophobicContact CG2-CG 4.18Å; W25-P181 PolarHBondContact NE1-O 3.21Å; P181-H185 HydrophobicContact CB-CB 4.38Å
182E95.2Very high96.7Very high3 Ų326.7 Ų26.71%0.01414%0.138CC..  trans-80.1174.7174.7-61.8-169.498.800111.9F184 H185 S187 T189 V304E182-F184 VanDerWaalsContact C-N 3.3Å; E182-F184 PolarHBondContact O-N 3.05Å; E182-F184 VanDerWaalsContact O-N 3.12Å; E182-H185 VanDerWaalsContact O-CA 3.29Å; E182-H185 WeakPolarHBondContact O-CA 3.44Å; E182-H185 PolarHBondContact O-N 2.76Å; E182-S187 PolarHBondContact N-O 3.32Å; E182-S187 WeakPolarHBondContact OE2-CB 3.42Å; E182-S187 PolarHBondContact OE2-OG 3.43Å; E182-T189 HydrophobicContact CG-CG2 3.4Å; E182-V304 WeakPolarHBondContact OE1-CG2 3.2Å
183G93.4Very high96.6Very high0 Ų026 Ų260%013%0.134CC..THydrogen-bonded Turntrans-60.6-28.6-16900000116.3F7 H185 S300F7-G183 WeakPolarHBondContact CZ-O 3.33Å; G183-H185 VanDerWaalsContact C-N 3.32Å; G183-H185 PolarHBondContact O-ND1 2.92Å; G183-S300 WeakPolarHBondContact CA-OG 3.39Å; G183-S300 PolarHBondContact N-OG 3.31Å
184F95.9Very high96.4Very high3 Ų323.1 Ų23.11%0.01312%0.124CC..THydrogen-bonded Turntrans-83.3-11.8171.8-90.9-132000113.3P31 Y36 V39 E182 T186 P297 F298 E301P31-F184 HydrophobicContact CB-CE1 4.27Å; P31-F184 HydrophobicContact CB-CZ 4.1Å; P31-F184 HydrophobicContact CG-CD1 4.43Å; P31-F184 HydrophobicContact CG-CD2 4.23Å; P31-F184 HydrophobicContact CG-CE1 4.03Å; P31-F184 HydrophobicContact CG-CE2 3.8Å; P31-F184 HydrophobicContact CG-CZ 3.7Å; Y36-F184 HydrophobicContact CD1-CD1 4.11Å; Y36-F184 HydrophobicContact CE1-CB 4.35Å; Y36-F184 AromaticContact CE1-CD1 3.95Å; Y36-F184 HydrophobicContact CE1-CD1 3.95Å; Y36-F184 HydrophobicContact CE1-CG 4.48Å; Y36-F184 WeakPolarHBondContact CE1-O 3.4Å; Y36-F184 PolarHBondContact OH-O 2.94Å; V39-F184 HydrophobicContact CG2-CE1 4.3Å; E182-F184 VanDerWaalsContact C-N 3.3Å; E182-F184 PolarHBondContact O-N 3.05Å; E182-F184 VanDerWaalsContact O-N 3.12Å; F184-T186 HydrophobicContact CB-CG2 4.42Å; F184-T186 PolarHBondContact O-N 3.32Å; F184-P297 HydrophobicContact CD2-CB 3.79Å; F184-P297 WeakPolarHBondContact CD2-O 3.48Å; F184-P297 HydrophobicContact CE2-CB 3.86Å; F184-P297 WeakPolarHBondContact CE2-O 3.35Å; F184-F298 AromaticContact CE2-CD1 4Å; F184-F298 HydrophobicContact CE2-CD1 4Å; F184-F298 HydrophobicContact CE2-CE1 4.2Å; F184-F298 HydrophobicContact CE2-CG 4.17Å; F184-F298 AromaticContact CZ-CD1 3.76Å; F184-F298 HydrophobicContact CZ-CD1 3.76Å; F184-F298 AromaticContact CZ-CE1 3.57Å; F184-F298 HydrophobicContact CZ-CE1 3.57Å; F184-F298 HydrophobicContact CZ-CG 4.35Å; F184-F298 AromaticContact CZ-CZ 3.99Å; F184-F298 HydrophobicContact CZ-CZ 3.99Å; F184-E301 HydrophobicContact CB-CG 4.37Å; F184-E301 WeakPolarHBondContact CB-OE2 3.43Å; F184-E301 HydrophobicContact CD1-CG 3.93Å; F184-E301 HydrophobicContact CD2-CB 3.45Å; F184-E301 VanDerWaalsContact CD2-CB 3.45Å; F184-E301 HydrophobicContact CD2-CG 3.75Å; F184-E301 HydrophobicContact CE1-CG 4.1Å; F184-E301 HydrophobicContact CE2-CB 3.58Å; F184-E301 HydrophobicContact CE2-CG 3.93Å; F184-E301 HydrophobicContact CG-CB 3.97Å; F184-E301 HydrophobicContact CG-CG 3.74Å; F184-E301 HydrophobicContact CZ-CB 4.2Å; F184-E301 HydrophobicContact CZ-CG 4.1Å
185H96.3Very high96.2Very high0 Ų019 Ų190%011%0.112CC..SBendtrans54.534.1-174.2-52.175.3000113.7F7 W11 V21 W25 R102 W103 P181 E182 G183F7-H185 AromaticContact CD1-CE1 3.25Å; F7-H185 WeakPolarHBondContact CD1-CE1 3.47Å; F7-H185 AromaticContact CD1-CG 3.83Å; F7-H185 AromaticContact CD1-ND1 2.98Å; F7-H185 WeakPolarHBondContact CD1-ND1 3.23Å; F7-H185 AromaticContact CD2-CE1 3.81Å; F7-H185 AromaticContact CE1-CE1 3.71Å; F7-H185 AromaticContact CE1-ND1 3.09Å; F7-H185 WeakPolarHBondContact CE1-ND1 3.2Å; F7-H185 AromaticContact CG-CE1 3.29Å; F7-H185 WeakPolarHBondContact CG-CE1 3.38Å; F7-H185 AromaticContact CG-ND1 3.57Å; F7-H185 AromaticContact CZ-ND1 3.75Å; W11-H185 HydrophobicContact CH2-CB 3.53Å; W11-H185 AromaticContact CH2-CD2 3.6Å; W11-H185 AromaticContact CH2-CG 3.72Å; W11-H185 HydrophobicContact CZ2-CB 4.03Å; V21-H185 WeakPolarHBondContact CG1-NE2 3.49Å; W25-H185 AromaticContact CD1-NE2 3.69Å; W25-H185 AromaticContact CG-CE1 3.76Å; W25-H185 AromaticContact CG-NE2 3.75Å; R102-H185 CarbonylContact C-O 3.54Å; W103-H185 WeakPolarHBondContact CB-O 3.41Å; W103-H185 PolarHBondContact N-O 3.47Å; P181-H185 HydrophobicContact CB-CB 4.38Å; E182-H185 VanDerWaalsContact O-CA 3.29Å; E182-H185 WeakPolarHBondContact O-CA 3.44Å; E182-H185 PolarHBondContact O-N 2.76Å; G183-H185 VanDerWaalsContact C-N 3.32Å; G183-H185 PolarHBondContact O-ND1 2.92Å
186T97.3Very high96.2Very high0 Ų019.8 Ų19.80%010%0.104CC..SBendtrans-112-4.6174.559.20000112.4Y36 A97 A98 F184Y36-T186 HydrophobicContact CD1-CG2 3.71Å; Y36-T186 HydrophobicContact CE1-CG2 3.63Å; A97-T186 WeakPolarHBondContact CB-O 3.25Å; A98-T186 HydrophobicContact CB-CG2 4.32Å; F184-T186 HydrophobicContact CB-CG2 4.42Å; F184-T186 PolarHBondContact O-N 3.32Å
187S98Very high96.1Very high0 Ų019 Ų190%011%0.108CC..SBendtrans-144.8164.6172.245.90000110E182E182-S187 PolarHBondContact N-O 3.32Å; E182-S187 WeakPolarHBondContact OE2-CB 3.42Å; E182-S187 PolarHBondContact OE2-OG 3.43Å
188C98.5Very high96.1Very high2 Ų221.2 Ų21.21%0.01412%0.123CC..EExtended strand (participates in β ladder)trans-124.8154.1178-60.50000110.6C110 Y113 G114 I180C110-C188 WeakPolarHBondContact CA-SG 3.45Å; C110-C188 HydrophobicContact CB-CB 3.95Å; C110-C188 WeakPolarHBondContact CB-SG 3.49Å; C110-C188 WeakPolarHBondContact O-CB 3.43Å; C110-C188 WeakPolarHBondContact SG-CB 3.34Å; C110-C188 CovalentContact SG-SG 2.01Å; C110-C188 PolarHBondContact SG-SG 3.22Å; Y113-C188 HydrophobicContact CD1-CB 4.1Å; Y113-C188 VanDerWaalsContact CD1-O 3.22Å; Y113-C188 WeakPolarHBondContact CD1-O 3.22Å; Y113-C188 WeakPolarHBondContact CE1-O 3.47Å; G114-C188 WeakPolarHBondContact CA-O 3.26Å; I180-C188 CarbonylContact O-C 3.51Å; I180-C188 VanDerWaalsContact O-CA 3.26Å; I180-C188 WeakPolarHBondContact O-CA 3.29Å
189T97.8Very high96Very high15 Ų1519.2 Ų19.29%0.09211%0.108CC..EExtended strand (participates in β ladder)trans-157.2179.8-178.2-165.30000109.7Y179 I180 E182 Y192 Y280Y179-T189 CarbonylContact C-O 3.58Å; Y179-T189 VanDerWaalsContact CA-O 3.27Å; Y179-T189 WeakPolarHBondContact CA-O 3.34Å; I180-T189 PolarHBondContact N-O 3.31Å; I180-T189 PolarHBondContact O-N 2.97Å; E182-T189 HydrophobicContact CG-CG2 3.4Å; T189-Y192 HydrophobicContact CG2-CD1 4.03Å; T189-Y192 HydrophobicContact CG2-CE1 3.61Å; T189-Y280 VanDerWaalsContact CG2-OH 3.27Å; T189-Y280 WeakPolarHBondContact CG2-OH 3.45Å; T189-Y280 PolarHBondContact OG1-OH 3.01Å
190F97.3Very high95.8Very high16 Ų1621.8 Ų21.87%0.0712%0.122CC..EExtended strand (participates in β ladder)trans-64.2146.3174.253.8-90.3000111.8S178 Y179 Y192 F202 N203 L206 Y280 C284S178-F190 CarbonylContact O-C 3.45Å; S178-F190 WeakPolarHBondContact O-CA 3.2Å; Y179-F190 HydrophobicContact CD1-CB 4.31Å; Y179-F190 HydrophobicContact CE1-CB 4.1Å; F190-Y192 HydrophobicContact CD2-CD1 4.36Å; F190-Y192 HydrophobicContact CE2-CD1 4.2Å; F190-Y192 VanDerWaalsContact O-CD1 3.31Å; F190-Y192 WeakPolarHBondContact O-CD1 3.37Å; F190-Y192 PolarHBondContact O-N 3.4Å; F190-F202 HydrophobicContact CB-CE1 3.77Å; F190-F202 HydrophobicContact CB-CZ 4.36Å; F190-N203 WeakPolarHBondContact CD2-OD1 3.41Å; F190-L206 HydrophobicContact CD1-CD1 4.03Å; F190-L206 HydrophobicContact CD2-CD1 4.48Å; F190-L206 HydrophobicContact CE1-CD1 4.25Å; F190-L206 HydrophobicContact CE1-CD2 4.34Å; F190-L206 HydrophobicContact CE2-CD2 4.39Å; F190-L206 HydrophobicContact CG-CD1 4.16Å; F190-L206 HydrophobicContact CZ-CD2 4.08Å; F190-Y280 AromaticContact CE1-CE1 3.97Å; F190-Y280 HydrophobicContact CE1-CE1 3.97Å; F190-Y280 AromaticContact CZ-CE1 3.78Å; F190-Y280 HydrophobicContact CZ-CE1 3.78Å; F190-C284 HydrophobicContact CE2-CB 4.34Å
191D96.7Very high95.6Very high6 Ų625.9 Ų25.93%0.03214%0.143CC..  trans-70.996.5177.8-174.2-4.3000111.1S178 I180 L193 S194 N203S178-D191 WeakPolarHBondContact O-CB 3.32Å; S178-D191 PolarHBondContact O-N 3.02Å; I180-D191 HydrophobicContact CD1-CB 3.85Å; I180-D191 WeakPolarHBondContact CD1-OD1 3.26Å; I180-D191 HydrophobicContact CG1-CB 3.88Å; I180-D191 HydrophobicContact CG2-CB 4.04Å; D191-L193 WeakPolarHBondContact OD1-CA 3.21Å; D191-L193 WeakPolarHBondContact OD1-CB 3.3Å; D191-L193 PolarHBondContact OD1-N 3.44Å; D191-S194 PolarHBondContact OD1-N 2.74Å; D191-S194 PolarHBondContact OD1-OG 2.95Å; D191-S194 WeakPolarHBondContact OD2-CB 3.4Å; D191-S194 PolarHBondContact OD2-OG 3.26Å; D191-N203 PolarHBondContact O-ND2 3.47Å
192Y95.1Very high95.6Very high3 Ų326.3 Ų26.31%0.01215%0.145CC..  trans-92.25.5172.557.6-104.7000113.1T189 F190 Y280 C284 T287 L295T189-Y192 HydrophobicContact CG2-CD1 4.03Å; T189-Y192 HydrophobicContact CG2-CE1 3.61Å; F190-Y192 HydrophobicContact CD2-CD1 4.36Å; F190-Y192 HydrophobicContact CE2-CD1 4.2Å; F190-Y192 VanDerWaalsContact O-CD1 3.31Å; F190-Y192 WeakPolarHBondContact O-CD1 3.37Å; F190-Y192 PolarHBondContact O-N 3.4Å; Y192-Y280 HydrophobicContact CE1-CE2 4.38Å; Y192-C284 VanDerWaalsContact CD1-SG 3.55Å; Y192-C284 HydrophobicContact CG-CB 4.26Å; Y192-T287 HydrophobicContact CD2-CG2 3.9Å; Y192-T287 WeakPolarHBondContact CD2-OG1 3.17Å; Y192-T287 HydrophobicContact CE2-CG2 4.18Å; Y192-T287 WeakPolarHBondContact O-CB 3.49Å; Y192-T287 PolarHBondContact O-OG1 3.17Å; Y192-L295 HydrophobicContact CE2-CD2 3.73Å
193L95.2Very high95.6Very high1 Ų126.2 Ų26.21%0.00514%0.144CC..SBendtrans-102-38.9-174-65.8172.7000112.9H22 H24 W25 I180 D191 T287 R292 L295H22-L193 HydrophobicContact CB-CD1 3.89Å; H24-L193 HydrophobicContact CB-CD1 4.44Å; W25-L193 HydrophobicContact CZ2-CD1 3.74Å; I180-L193 HydrophobicContact CD1-CD1 4.03Å; D191-L193 WeakPolarHBondContact OD1-CA 3.21Å; D191-L193 WeakPolarHBondContact OD1-CB 3.3Å; D191-L193 PolarHBondContact OD1-N 3.44Å; L193-T287 HydrophobicContact CD2-CG2 4.09Å; L193-R292 PolarHBondContact O-NH1 3.39Å; L193-L295 HydrophobicContact CD2-CD2 3.84Å
194S94.4Very high95.6Very high21 Ų2128.4 Ų28.415%0.14716%0.162CC..  trans-69.6142.7-178.9-64.50000111.5H22 D191 D196 N199H22-S194 PolarHBondContact CD2-OG 3.13Å; H22-S194 VanDerWaalsContact CD2-OG 3.3Å; D191-S194 PolarHBondContact OD1-N 2.74Å; D191-S194 PolarHBondContact OD1-OG 2.95Å; D191-S194 WeakPolarHBondContact OD2-CB 3.4Å; D191-S194 PolarHBondContact OD2-OG 3.26Å; S194-D196 VanDerWaalsContact CB-OD1 3.22Å; S194-D196 WeakPolarHBondContact CB-OD1 3.4Å; S194-N199 WeakPolarHBondContact CB-ND2 3.35Å
195T92.7Very high95.6Very high71 Ų7128.8 Ų28.844%0.43617%0.167SC..  trans-115.611.4-174.151.80000112.5L200 R292T195-L200 VanDerWaalsContact O-CD1 3.28Å; T195-L200 WeakPolarHBondContact O-CD1 3.45Å; T195-R292 VanDerWaalsContact CG2-NH1 3.26Å; T195-R292 PolarHBondContact OG1-NH1 2.99Å
196D93.5Very high95.5Very high69 Ų6929.3 Ų29.337%0.36917%0.17SC..SBendtrans-67.1154.2169.262-77.6000110.8S194 P198 N199 L200S194-D196 VanDerWaalsContact CB-OD1 3.22Å; S194-D196 WeakPolarHBondContact CB-OD1 3.4Å; D196-P198 VanDerWaalsContact OD2-CD 3.31Å; D196-P198 WeakPolarHBondContact OD2-CD 3.31Å; D196-N199 PolarHBondContact O-N 3.42Å; D196-N199 WeakPolarHBondContact OD1-CB 3.24Å; D196-N199 PolarHBondContact OD1-ND2 3.03Å; D196-N199 PolarHBondContact OD2-N 3.33Å; D196-N199 VanDerWaalsContact OD2-N 3.16Å; D196-N199 PolarHBondContact OD2-ND2 2.91Å; D196-L200 WeakPolarHBondContact O-CG 3.46Å; D196-L200 PolarHBondContact O-N 2.94Å
197L94.4Very high95.4Very high122 Ų12231.4 Ų31.464%0.63918%0.178SC*.Hα-helixtrans-59.1-44.7-171.4-178.865.5000113.6N199 L200 I201L197-N199 PolarHBondContact O-N 3.47Å; L197-L200 PolarHBondContact O-N 3.31Å; L197-I201 HydrophobicContact CD1-CD1 3.83Å; L197-I201 HydrophobicContact CD1-CG1 4Å; L197-I201 HydrophobicContact CD2-CD1 4.44Å; L197-I201 HydrophobicContact CG-CD1 3.77Å; L197-I201 HydrophobicContact CG-CG1 4.34Å; L197-I201 VanDerWaalsContact O-CG1 3.32Å; L197-I201 WeakPolarHBondContact O-CG1 3.4Å; L197-I201 PolarHBondContact O-N 3.46Å
198P95.6Very high95.2Very high48 Ų4836 Ų3631%0.31220%0.202SC..Hα-helixtrans-56.2-47.3174.1-26.534.7000113.7D196 I201 F202D196-P198 VanDerWaalsContact OD2-CD 3.31Å; D196-P198 WeakPolarHBondContact OD2-CD 3.31Å; P198-I201 PolarHBondContact O-N 3.38Å; P198-F202 WeakPolarHBondContact O-CB 3.38Å; P198-F202 PolarHBondContact O-N 3.32Å
199N95Very high95.1Very high8 Ų838.9 Ų38.94%0.04322%0.217CC..Hα-helixtrans-62-43.6176.3-89.3-57.9000112.1G177 S178 S194 D196 L197 F202 N203G177-N199 VanDerWaalsContact CA-OD1 3.24Å; G177-N199 WeakPolarHBondContact CA-OD1 3.27Å; S178-N199 PolarHBondContact N-OD1 2.91Å; S194-N199 WeakPolarHBondContact CB-ND2 3.35Å; D196-N199 PolarHBondContact O-N 3.42Å; D196-N199 WeakPolarHBondContact OD1-CB 3.24Å; D196-N199 PolarHBondContact OD1-ND2 3.03Å; D196-N199 PolarHBondContact OD2-N 3.33Å; D196-N199 VanDerWaalsContact OD2-N 3.16Å; D196-N199 PolarHBondContact OD2-ND2 2.91Å; L197-N199 PolarHBondContact O-N 3.47Å; N199-F202 PolarHBondContact O-N 3.01Å; N199-N203 WeakPolarHBondContact O-CB 3.35Å; N199-N203 PolarHBondContact O-N 3.37Å; N199-N203 PolarHBondContact O-ND2 2.87Å
200L94.2Very high95Very high60 Ų6038.2 Ų38.231%0.31421%0.212SC..Hα-helixtrans-63.5-44.5178.9-70.9177000112.4T195 D196 L197 A204 L288T195-L200 VanDerWaalsContact O-CD1 3.28Å; T195-L200 WeakPolarHBondContact O-CD1 3.45Å; D196-L200 WeakPolarHBondContact O-CG 3.46Å; D196-L200 PolarHBondContact O-N 2.94Å; L197-L200 PolarHBondContact O-N 3.31Å; L200-A204 VanDerWaalsContact O-CB 3.25Å; L200-A204 WeakPolarHBondContact O-CB 3.49Å; L200-A204 PolarHBondContact O-N 3.43Å; L200-L288 HydrophobicContact CD2-CD2 4.11Å
201I94.5Very high94.8Very high95 Ų9538.7 Ų38.749%0.48722%0.215SC..Hα-helixtrans-62.4-46.7177.6-69.7170.5000110.4L197 P198 A204 G205L197-I201 HydrophobicContact CD1-CD1 3.83Å; L197-I201 HydrophobicContact CD1-CG1 4Å; L197-I201 HydrophobicContact CD2-CD1 4.44Å; L197-I201 HydrophobicContact CG-CD1 3.77Å; L197-I201 HydrophobicContact CG-CG1 4.34Å; L197-I201 VanDerWaalsContact O-CG1 3.32Å; L197-I201 WeakPolarHBondContact O-CG1 3.4Å; L197-I201 PolarHBondContact O-N 3.46Å; P198-I201 PolarHBondContact O-N 3.38Å; I201-A204 PolarHBondContact O-N 3.31Å; I201-G205 PolarHBondContact O-N 2.94Å
202F96.2Very high94.8Very high10 Ų1042 Ų424%0.04423%0.232CC..Hα-helixtrans-58.8-51.7178.8169.5-108.8000111.7W168 P171 P172 Y176 F190 P198 N199 A204 G205 L206W168-F202 VanDerWaalsContact O-CE2 3.29Å; W168-F202 WeakPolarHBondContact O-CE2 3.48Å; P171-F202 HydrophobicContact CB-CD2 3.88Å; P171-F202 HydrophobicContact CB-CE2 4.17Å; P171-F202 HydrophobicContact CG-CD2 4.26Å; P171-F202 HydrophobicContact CG-CE2 4.31Å; P172-F202 VanDerWaalsContact CD-CE2 3.47Å; P172-F202 HydrophobicContact CG-CD1 4.25Å; P172-F202 HydrophobicContact CG-CD2 4.2Å; P172-F202 HydrophobicContact CG-CE1 3.68Å; P172-F202 HydrophobicContact CG-CE2 3.62Å; P172-F202 HydrophobicContact CG-CG 4.49Å; P172-F202 HydrophobicContact CG-CZ 3.33Å; Y176-F202 WeakPolarHBondContact O-CB 3.33Å; Y176-F202 WeakPolarHBondContact O-CD2 3.25Å; Y176-F202 WeakPolarHBondContact O-CG 3.46Å; F190-F202 HydrophobicContact CB-CE1 3.77Å; F190-F202 HydrophobicContact CB-CZ 4.36Å; P198-F202 WeakPolarHBondContact O-CB 3.38Å; P198-F202 PolarHBondContact O-N 3.32Å; N199-F202 PolarHBondContact O-N 3.01Å; F202-A204 PolarHBondContact O-N 3.09Å; F202-G205 PolarHBondContact O-N 3.32Å; F202-L206 HydrophobicContact CE1-CD1 4.11Å; F202-L206 HydrophobicContact CE2-CD1 4.42Å; F202-L206 HydrophobicContact CZ-CD1 3.72Å; F202-L206 WeakPolarHBondContact O-CB 3.37Å; F202-L206 PolarHBondContact O-N 3.22Å
203N95.7Very high94.9Very high1 Ų143.8 Ų43.81%0.00525%0.245CC..Hα-helixtrans-64.1-39.8179.8-82-84.8000112.6F190 D191 N199 L206 Y207 L288F190-N203 WeakPolarHBondContact CD2-OD1 3.41Å; D191-N203 PolarHBondContact O-ND2 3.47Å; N199-N203 WeakPolarHBondContact O-CB 3.35Å; N199-N203 PolarHBondContact O-N 3.37Å; N199-N203 PolarHBondContact O-ND2 2.87Å; N203-L206 PolarHBondContact O-N 2.91Å; N203-Y207 WeakPolarHBondContact O-CB 3.28Å; N203-Y207 PolarHBondContact O-N 3.28Å; N203-L288 HydrophobicContact CB-CD1 3.83Å; N203-L288 HydrophobicContact CB-CD2 3.48Å; N203-L288 VanDerWaalsContact CB-CD2 3.48Å; N203-L288 HydrophobicContact CB-CG 4.28Å
204A94Very high95Very high45 Ų4543.9 Ų43.937%0.37225%0.245SC..Hα-helixtrans-62.2-43.7175.900000111.6L200 I201 F202 Y207 I208L200-A204 VanDerWaalsContact O-CB 3.25Å; L200-A204 WeakPolarHBondContact O-CB 3.49Å; L200-A204 PolarHBondContact O-N 3.43Å; I201-A204 PolarHBondContact O-N 3.31Å; F202-A204 PolarHBondContact O-N 3.09Å; A204-Y207 PolarHBondContact O-N 2.88Å; A204-I208 WeakPolarHBondContact O-CB 3.27Å; A204-I208 VanDerWaalsContact O-CG1 3.29Å; A204-I208 WeakPolarHBondContact O-CG1 3.26Å; A204-I208 PolarHBondContact O-N 2.64Å
205G94.8Very high95.1Very high12 Ų1243.8 Ų43.812%0.12424%0.244CC..Hα-helixtrans-61.9-47.617500000112.3I201 F202 Y207 I208 L209 G210I201-G205 PolarHBondContact O-N 2.94Å; F202-G205 PolarHBondContact O-N 3.32Å; G205-Y207 VanDerWaalsContact C-N 3.31Å; G205-Y207 PolarHBondContact O-N 3.08Å; G205-I208 PolarHBondContact O-N 3.32Å; G205-L209 WeakPolarHBondContact O-CA 3.48Å; G205-L209 WeakPolarHBondContact O-CB 3.39Å; G205-L209 PolarHBondContact O-N 3.11Å; G205-G210 PolarHBondContact O-N 3.41Å
206L95.2Very high95.4Very high10 Ų1047.2 Ų47.25%0.05225%0.253CS..Iπ-helixtrans-56.7-44.4175.7-175.9151.9000111.6F122 F190 F202 N203 G210 F211F122-L206 HydrophobicContact CE2-CD1 3.88Å; F122-L206 HydrophobicContact CE2-CD2 4.23Å; F122-L206 HydrophobicContact CE2-CG 3.7Å; F122-L206 HydrophobicContact CZ-CD1 4.08Å; F122-L206 HydrophobicContact CZ-CD2 3.56Å; F122-L206 HydrophobicContact CZ-CG 3.46Å; F122-L206 VanDerWaalsContact CZ-CG 3.46Å; F190-L206 HydrophobicContact CD1-CD1 4.03Å; F190-L206 HydrophobicContact CD2-CD1 4.48Å; F190-L206 HydrophobicContact CE1-CD1 4.25Å; F190-L206 HydrophobicContact CE1-CD2 4.34Å; F190-L206 HydrophobicContact CE2-CD2 4.39Å; F190-L206 HydrophobicContact CG-CD1 4.16Å; F190-L206 HydrophobicContact CZ-CD2 4.08Å; F202-L206 HydrophobicContact CE1-CD1 4.11Å; F202-L206 HydrophobicContact CE2-CD1 4.42Å; F202-L206 HydrophobicContact CZ-CD1 3.72Å; F202-L206 WeakPolarHBondContact O-CB 3.37Å; F202-L206 PolarHBondContact O-N 3.22Å; N203-L206 PolarHBondContact O-N 2.91Å; L206-G210 CarbonylContact O-C 3.48Å; L206-G210 WeakPolarHBondContact O-CA 3.39Å; L206-G210 PolarHBondContact O-N 3.29Å; L206-F211 PolarHBondContact O-N 3.01Å
207Y94.1Very high95.6Very high44 Ų4446.5 Ų46.517%0.17325%0.248CC..Iπ-helixtrans-70.6-48.6180-158.7-96.3000112.6N203 A204 G205 F211 L212 A281 L285N203-Y207 WeakPolarHBondContact O-CB 3.28Å; N203-Y207 PolarHBondContact O-N 3.28Å; A204-Y207 PolarHBondContact O-N 2.88Å; G205-Y207 VanDerWaalsContact C-N 3.31Å; G205-Y207 PolarHBondContact O-N 3.08Å; Y207-F211 WeakPolarHBondContact O-CB 3.43Å; Y207-F211 PolarHBondContact O-N 2.83Å; Y207-L212 HydrophobicContact CD1-CD1 3.82Å; Y207-L212 HydrophobicContact CD1-CG 4.06Å; Y207-L212 HydrophobicContact CE1-CD1 3.84Å; Y207-L212 HydrophobicContact CE1-CD2 4.23Å; Y207-L212 HydrophobicContact CE1-CG 4.03Å; Y207-L212 WeakPolarHBondContact O-CG 3.29Å; Y207-L212 PolarHBondContact O-N 3.44Å; Y207-A281 HydrophobicContact CE2-CB 4.23Å; Y207-L285 HydrophobicContact CE1-CD1 4.3Å; Y207-L285 HydrophobicContact CE1-CD2 4.38Å; Y207-L285 HydrophobicContact CE2-CB 4.15Å
208I95.1Very high95.8Very high96 Ų9640.9 Ų40.949%0.49222%0.219SC..Iπ-helixtrans-74.2-48.8-174.9-64169.3000111.1A204 G205 L212 C213A204-I208 WeakPolarHBondContact O-CB 3.27Å; A204-I208 VanDerWaalsContact O-CG1 3.29Å; A204-I208 WeakPolarHBondContact O-CG1 3.26Å; A204-I208 PolarHBondContact O-N 2.64Å; G205-I208 PolarHBondContact O-N 3.32Å; I208-L212 WeakPolarHBondContact O-CB 3.35Å; I208-L212 PolarHBondContact O-N 2.93Å; I208-C213 PolarHBondContact O-N 2.99Å
209L95.8Very high95.9Very high64 Ų6443.5 Ų43.534%0.33523%0.229SC..Iπ-helixtrans-98.8-35.8-169.1-64.7165.8000112W164 W168 G205 P214W164-L209 HydrophobicContact CH2-CD2 4.37Å; W164-L209 HydrophobicContact CZ2-CB 3.97Å; W164-L209 HydrophobicContact CZ2-CD2 4.32Å; W164-L209 WeakPolarHBondContact CZ2-O 3.46Å; W164-L209 PolarHBondContact NE1-O 2.92Å; W168-L209 HydrophobicContact CD2-CB 4.16Å; W168-L209 VanDerWaalsContact CE2-CB 3.43Å; W168-L209 HydrophobicContact CH2-CB 3.97Å; W168-L209 HydrophobicContact CH2-CD1 3.19Å; W168-L209 HydrophobicContact CH2-CG 4.17Å; W168-L209 HydrophobicContact CZ2-CB 3.35Å; W168-L209 HydrophobicContact CZ2-CD1 3.22Å; W168-L209 HydrophobicContact CZ2-CG 3.85Å; W168-L209 HydrophobicContact CZ3-CD1 4.15Å; G205-L209 WeakPolarHBondContact O-CA 3.48Å; G205-L209 WeakPolarHBondContact O-CB 3.39Å; G205-L209 PolarHBondContact O-N 3.11Å; L209-P214 WeakPolarHBondContact O-CD 3.43Å
210G94.9Very high96.1Very high0 Ų047.2 Ų47.20%025%0.245CC..Iπ-helixtrans-73.2-44.8173.500000112.9F122 G205 L206 P214F122-G210 VanDerWaalsContact CD1-O 3.24Å; F122-G210 WeakPolarHBondContact CD1-O 3.32Å; F122-G210 VanDerWaalsContact CE1-C 3.4Å; F122-G210 WeakPolarHBondContact CE1-O 3.25Å; G205-G210 PolarHBondContact O-N 3.41Å; L206-G210 CarbonylContact O-C 3.48Å; L206-G210 WeakPolarHBondContact O-CA 3.39Å; L206-G210 PolarHBondContact O-N 3.29Å; G210-P214 WeakPolarHBondContact O-CG 3.4Å
211F94.6Very high96.2Very high27 Ų2744.4 Ų44.412%0.11823%0.23CC..Iπ-helixtrans-102.4-61.6-174.4-176.5-105.1000114.1F122 L125 L206 Y207 C213 P214 V215 L274 A281F122-F211 HydrophobicContact CE1-CB 4.36Å; L125-F211 HydrophobicContact CD2-CD2 3.69Å; L125-F211 HydrophobicContact CD2-CE2 4.29Å; L125-F211 HydrophobicContact CD2-CG 4.46Å; L206-F211 PolarHBondContact O-N 3.01Å; Y207-F211 WeakPolarHBondContact O-CB 3.43Å; Y207-F211 PolarHBondContact O-N 2.83Å; F211-C213 PolarHBondContact O-N 3.02Å; F211-P214 WeakPolarHBondContact O-CD 3.13Å; F211-V215 HydrophobicContact CE2-CG2 4.34Å; F211-V215 HydrophobicContact CZ-CG2 4.31Å; F211-V215 VanDerWaalsContact O-CG2 3.29Å; F211-V215 WeakPolarHBondContact O-CG2 3.38Å; F211-V215 PolarHBondContact O-N 2.68Å; F211-L274 HydrophobicContact CE2-CD2 4.27Å; F211-L274 HydrophobicContact CZ-CD2 4.21Å; F211-A281 HydrophobicContact CE1-CB 4.43Å; F211-A281 HydrophobicContact CZ-CB 4.37Å
212L95.6Very high96.4Very high74 Ų7440.9 Ų40.939%0.38721%0.211SC..Iπ-helixtrans-66.9-37.6-171.1-67.5178.9000113.5Y207 I208 V215 F216Y207-L212 HydrophobicContact CD1-CD1 3.82Å; Y207-L212 HydrophobicContact CD1-CG 4.06Å; Y207-L212 HydrophobicContact CE1-CD1 3.84Å; Y207-L212 HydrophobicContact CE1-CD2 4.23Å; Y207-L212 HydrophobicContact CE1-CG 4.03Å; Y207-L212 WeakPolarHBondContact O-CG 3.29Å; Y207-L212 PolarHBondContact O-N 3.44Å; I208-L212 WeakPolarHBondContact O-CB 3.35Å; I208-L212 PolarHBondContact O-N 2.93Å; L212-V215 PolarHBondContact O-N 2.7Å; L212-F216 WeakPolarHBondContact O-CB 3.46Å; L212-F216 PolarHBondContact O-N 3.22Å
213C97.2Very high96.4Very high42 Ų4247.3 Ų47.328%0.28424%0.236SC..Hα-helixtrans-60.8-53.4179.5173.20000112.6I208 F211 V215 F216 I217I208-C213 PolarHBondContact O-N 2.99Å; F211-C213 PolarHBondContact O-N 3.02Å; C213-V215 VanDerWaalsContact C-N 3.31Å; C213-V215 PolarHBondContact O-N 3.43Å; C213-F216 WeakPolarHBondContact O-CB 3.26Å; C213-F216 PolarHBondContact O-N 3.38Å; C213-I217 WeakPolarHBondContact O-CG1 3.43Å; C213-I217 PolarHBondContact O-N 3.48Å
214P97.9Very high96.5Very high3 Ų349.2 Ų49.22%0.01925%0.245CC..Hα-helixtrans-56.8-41171.9-30.837.7000114L125 A129 L209 G210 F211 F216 I217 I218L125-P214 HydrophobicContact CD1-CB 4.4Å; L125-P214 HydrophobicContact CD2-CB 4.05Å; L125-P214 HydrophobicContact CD2-CG 4.43Å; L125-P214 HydrophobicContact CG-CB 3.74Å; L125-P214 HydrophobicContact CG-CG 4.43Å; A129-P214 HydrophobicContact CB-CB 4.18Å; L209-P214 WeakPolarHBondContact O-CD 3.43Å; G210-P214 WeakPolarHBondContact O-CG 3.4Å; F211-P214 WeakPolarHBondContact O-CD 3.13Å; P214-F216 VanDerWaalsContact C-N 3.34Å; P214-F216 PolarHBondContact O-N 2.9Å; P214-I217 PolarHBondContact O-N 2.84Å; P214-I218 VanDerWaalsContact O-CG1 3.26Å; P214-I218 WeakPolarHBondContact O-CG1 3.41Å; P214-I218 PolarHBondContact O-N 2.89Å
215V97.4Very high96.6Very high19 Ų1947.4 Ų47.412%0.11523%0.229CC..Hα-helixtrans-62.2-42.1177.5172.30000111.4L125 F211 L212 C213 I218 I219 L274L125-V215 HydrophobicContact CD1-CG2 4.14Å; L125-V215 HydrophobicContact CD2-CG2 4.34Å; F211-V215 HydrophobicContact CE2-CG2 4.34Å; F211-V215 HydrophobicContact CZ-CG2 4.31Å; F211-V215 VanDerWaalsContact O-CG2 3.29Å; F211-V215 WeakPolarHBondContact O-CG2 3.38Å; F211-V215 PolarHBondContact O-N 2.68Å; L212-V215 PolarHBondContact O-N 2.7Å; C213-V215 VanDerWaalsContact C-N 3.31Å; C213-V215 PolarHBondContact O-N 3.43Å; V215-I218 WeakPolarHBondContact O-CB 3.47Å; V215-I218 PolarHBondContact O-N 2.89Å; V215-I219 HydrophobicContact CG1-CD1 3.75Å; V215-I219 HydrophobicContact CG1-CG1 4.37Å; V215-I219 WeakPolarHBondContact O-CG1 3.23Å; V215-I219 PolarHBondContact O-N 3.34Å; V215-L274 HydrophobicContact CG2-CD2 3.72Å
216F97.9Very high96.7Very high142 Ų14249.7 Ų49.762%0.62324%0.241SC*.Hα-helixtrans-61.5-45.3175.8177-97.7000111.7L212 C213 P214 I218 I219 F220L212-F216 WeakPolarHBondContact O-CB 3.46Å; L212-F216 PolarHBondContact O-N 3.22Å; C213-F216 WeakPolarHBondContact O-CB 3.26Å; C213-F216 PolarHBondContact O-N 3.38Å; P214-F216 VanDerWaalsContact C-N 3.34Å; P214-F216 PolarHBondContact O-N 2.9Å; F216-I218 VanDerWaalsContact C-N 3.28Å; F216-I218 PolarHBondContact O-N 3.17Å; F216-I219 PolarHBondContact O-N 3.27Å; F216-F220 WeakPolarHBondContact O-CB 3.46Å; F216-F220 PolarHBondContact O-N 3.33Å
217I98.2Very high96.7Very high54 Ų5454 Ų5428%0.27726%0.259SS..Hα-helixtrans-57.8-43.8175.9-68.1168.8000110.7A129 L133 C213 P214 S221A129-I217 HydrophobicContact CB-CB 4.29Å; A129-I217 HydrophobicContact CB-CG2 4.03Å; L133-I217 HydrophobicContact CD1-CG2 3.65Å; L133-I217 HydrophobicContact CD2-CG2 3.93Å; L133-I217 HydrophobicContact CG-CG2 3.61Å; C213-I217 WeakPolarHBondContact O-CG1 3.43Å; C213-I217 PolarHBondContact O-N 3.48Å; P214-I217 PolarHBondContact O-N 2.84Å; I217-S221 VanDerWaalsContact O-CB 3.3Å; I217-S221 WeakPolarHBondContact O-CB 3.41Å; I217-S221 PolarHBondContact O-N 2.99Å; I217-S221 PolarHBondContact O-OG 3.4Å
218I98.4Very high96.7Very high4 Ų453 Ų532%0.02126%0.257CS..Hα-helixtrans-61.2-51.4177.4-70.8164.9000111L125 M128 A129 A132 P214 V215 F216 F220 S221 Y222 V270L125-I218 HydrophobicContact CD1-CD1 3.95Å; M128-I218 HydrophobicContact CB-CD1 4.22Å; A129-I218 VanDerWaalsContact CA-CG1 3.47Å; A129-I218 HydrophobicContact CB-CD1 4.2Å; A129-I218 HydrophobicContact CB-CG1 3.83Å; A132-I218 HydrophobicContact CB-CG1 4.29Å; P214-I218 VanDerWaalsContact O-CG1 3.26Å; P214-I218 WeakPolarHBondContact O-CG1 3.41Å; P214-I218 PolarHBondContact O-N 2.89Å; V215-I218 WeakPolarHBondContact O-CB 3.47Å; V215-I218 PolarHBondContact O-N 2.89Å; F216-I218 VanDerWaalsContact C-N 3.28Å; F216-I218 PolarHBondContact O-N 3.17Å; I218-F220 PolarHBondContact O-N 2.86Å; I218-S221 PolarHBondContact O-N 2.89Å; I218-Y222 HydrophobicContact CG2-CD2 3.71Å; I218-Y222 HydrophobicContact CG2-CE2 3.71Å; I218-Y222 VanDerWaalsContact O-CD2 3.28Å; I218-Y222 WeakPolarHBondContact O-CD2 3.5Å; I218-Y222 PolarHBondContact O-N 2.87Å; I218-V270 HydrophobicContact CD1-CG2 4.17Å; I218-V270 HydrophobicContact CG2-CB 4.34Å; I218-V270 HydrophobicContact CG2-CG1 3.59Å; I218-V270 HydrophobicContact CG2-CG2 3.88Å
219I97.9Very high96.6Very high103 Ų10349.6 Ų49.653%0.52824%0.241SC..Hα-helixtrans-61.6-47.3-178.2-69.4169.6000110.4V215 F216 S221 Y222 Y223V215-I219 HydrophobicContact CG1-CD1 3.75Å; V215-I219 HydrophobicContact CG1-CG1 4.37Å; V215-I219 WeakPolarHBondContact O-CG1 3.23Å; V215-I219 PolarHBondContact O-N 3.34Å; F216-I219 PolarHBondContact O-N 3.27Å; I219-S221 PolarHBondContact O-N 3.44Å; I219-Y222 PolarHBondContact O-N 2.91Å; I219-Y223 WeakPolarHBondContact O-CB 3.33Å; I219-Y223 PolarHBondContact O-N 3.29Å
220F97.9Very high96.6Very high87 Ų8754.4 Ų54.438%0.38226%0.255SS..Hα-helixtrans-58.1-47.6177.2175.2-97.2000111.6F216 I218 Y222 Y223 Q224F216-F220 WeakPolarHBondContact O-CB 3.46Å; F216-F220 PolarHBondContact O-N 3.33Å; I218-F220 PolarHBondContact O-N 2.86Å; F220-Y222 PolarHBondContact O-N 3.17Å; F220-Y223 PolarHBondContact O-N 3.29Å; F220-Q224 HydrophobicContact CE1-CG 4.24Å; F220-Q224 HydrophobicContact CE2-CG 4.24Å; F220-Q224 HydrophobicContact CZ-CG 4.04Å; F220-Q224 WeakPolarHBondContact O-CG 3.39Å; F220-Q224 PolarHBondContact O-N 3.42Å; F220-Q224 VanDerWaalsContact O-N 3.13Å
221S97.7Very high96.5Very high0 Ų058.3 Ų58.30%028%0.275CS..Hα-helixtrans-57.9-48.4179.3-60.70000111.4L133 I217 I218 I219 Q224 I225L133-S221 WeakPolarHBondContact CD2-OG 3.32Å; I217-S221 VanDerWaalsContact O-CB 3.3Å; I217-S221 WeakPolarHBondContact O-CB 3.41Å; I217-S221 PolarHBondContact O-N 2.99Å; I217-S221 PolarHBondContact O-OG 3.4Å; I218-S221 PolarHBondContact O-N 2.89Å; I219-S221 PolarHBondContact O-N 3.44Å; S221-Q224 PolarHBondContact O-N 3.48Å; S221-I225 WeakPolarHBondContact O-CD1 3.42Å; S221-I225 VanDerWaalsContact O-CG1 3.25Å; S221-I225 WeakPolarHBondContact O-CG1 3.47Å; S221-I225 PolarHBondContact O-N 2.83Å
222Y97.5Very high96.3Very high21 Ų2160.4 Ų60.48%0.08229%0.287CS..Hα-helixtrans-73.8-32.8-179.1-73.2-56.2000114.2A132 I218 I219 F220 Q224 I225 V226 S266 I267 V270A132-Y222 HydrophobicContact CB-CD2 4.45Å; A132-Y222 HydrophobicContact CB-CE2 3.84Å; I218-Y222 HydrophobicContact CG2-CD2 3.71Å; I218-Y222 HydrophobicContact CG2-CE2 3.71Å; I218-Y222 VanDerWaalsContact O-CD2 3.28Å; I218-Y222 WeakPolarHBondContact O-CD2 3.5Å; I218-Y222 PolarHBondContact O-N 2.87Å; I219-Y222 PolarHBondContact O-N 2.91Å; F220-Y222 PolarHBondContact O-N 3.17Å; Y222-Q224 VanDerWaalsContact C-N 3.28Å; Y222-Q224 PolarHBondContact O-N 3.46Å; Y222-I225 HydrophobicContact CD1-CD1 3.65Å; Y222-I225 HydrophobicContact CE1-CD1 3.95Å; Y222-I225 PolarHBondContact O-N 2.93Å; Y222-V226 WeakPolarHBondContact O-CG2 3.36Å; Y222-V226 PolarHBondContact O-N 2.82Å; Y222-S266 WeakPolarHBondContact OH-CB 3.48Å; Y222-S266 PolarHBondContact OH-O 3.39Å; Y222-S266 PolarHBondContact OH-OG 2.89Å; Y222-I267 HydrophobicContact CD1-CD1 3.67Å; Y222-I267 HydrophobicContact CD1-CG1 3.43Å; Y222-I267 VanDerWaalsContact CD1-CG1 3.43Å; Y222-I267 HydrophobicContact CD2-CG1 4.03Å; Y222-I267 HydrophobicContact CE1-CD1 3.86Å; Y222-I267 HydrophobicContact CE1-CG1 3.24Å; Y222-I267 HydrophobicContact CE2-CG1 3.83Å; Y222-I267 HydrophobicContact CG-CD1 4.24Å; Y222-I267 HydrophobicContact CG-CG1 3.85Å; Y222-I267 VanDerWaalsContact CZ-CG1 3.45Å; Y222-I267 PolarHBondContact OH-N 2.98Å; Y222-V270 HydrophobicContact CE2-CG2 4.26Å
223Y97.6Very high96.1Very high146 Ų14660.1 Ų60.157%0.57328%0.284SS*.Hα-helixtrans-56.1-47.6171.6173-97.8000110.6I219 F220 V226 K227I219-Y223 WeakPolarHBondContact O-CB 3.33Å; I219-Y223 PolarHBondContact O-N 3.29Å; F220-Y223 PolarHBondContact O-N 3.29Å; Y223-V226 PolarHBondContact O-N 3.27Å; Y223-K227 WeakPolarHBondContact O-CB 3.45Å; Y223-K227 PolarHBondContact O-N 2.93Å
224Q96.6Very high95.9Very high40 Ų4062.8 Ų62.819%0.18730%0.295CS..Hα-helixtrans-67.4-41.3177.9-62.8-67.711.200112.5Y136 V140 F220 S221 Y222 V226 K227 T228Y136-Q224 HydrophobicContact CD2-CB 3.74Å; Y136-Q224 HydrophobicContact CD2-CG 4.4Å; Y136-Q224 HydrophobicContact CE2-CB 3.6Å; Y136-Q224 HydrophobicContact CE2-CG 3.94Å; V140-Q224 HydrophobicContact CG2-CB 4.36Å; F220-Q224 HydrophobicContact CE1-CG 4.24Å; F220-Q224 HydrophobicContact CE2-CG 4.24Å; F220-Q224 HydrophobicContact CZ-CG 4.04Å; F220-Q224 WeakPolarHBondContact O-CG 3.39Å; F220-Q224 PolarHBondContact O-N 3.42Å; F220-Q224 VanDerWaalsContact O-N 3.13Å; S221-Q224 PolarHBondContact O-N 3.48Å; Y222-Q224 VanDerWaalsContact C-N 3.28Å; Y222-Q224 PolarHBondContact O-N 3.46Å; Q224-V226 PolarHBondContact O-N 2.91Å; Q224-K227 PolarHBondContact O-N 2.99Å; Q224-T228 WeakPolarHBondContact O-CB 3.4Å; Q224-T228 PolarHBondContact O-N 2.94Å; Q224-T228 PolarHBondContact O-OG1 2.87Å; Q224-T228 VanDerWaalsContact O-OG1 3.11Å
225I95.8Very high95.5Very high8 Ų868.2 Ų68.24%0.04132%0.32CS..Hα-helixtrans-57.5-50.3175.5-70.4162.1000110.5R135 I139 V140 S221 Y222 K227 T228 V229R135-I225 HydrophobicContact CB-CD1 3.9Å; I139-I225 HydrophobicContact CD1-CG2 4.13Å; I139-I225 HydrophobicContact CG2-CG2 4.31Å; V140-I225 HydrophobicContact CG2-CG1 4.07Å; S221-I225 WeakPolarHBondContact O-CD1 3.42Å; S221-I225 VanDerWaalsContact O-CG1 3.25Å; S221-I225 WeakPolarHBondContact O-CG1 3.47Å; S221-I225 PolarHBondContact O-N 2.83Å; Y222-I225 HydrophobicContact CD1-CD1 3.65Å; Y222-I225 HydrophobicContact CE1-CD1 3.95Å; Y222-I225 PolarHBondContact O-N 2.93Å; I225-K227 PolarHBondContact O-N 3.15Å; I225-T228 PolarHBondContact O-N 3.49Å; I225-V229 HydrophobicContact CG2-CG2 4.26Å; I225-V229 WeakPolarHBondContact O-CB 3.46Å; I225-V229 VanDerWaalsContact O-CG2 3.26Å; I225-V229 WeakPolarHBondContact O-CG2 3.31Å; I225-V229 PolarHBondContact O-N 3.49Å
226V96.5Very high95.1Very high60 Ų6068.6 Ų68.636%0.36432%0.321SS..Hα-helixtrans-63.5-42.8-178.8171.60000111.1Y222 Y223 Q224 R230Y222-V226 WeakPolarHBondContact O-CG2 3.36Å; Y222-V226 PolarHBondContact O-N 2.82Å; Y223-V226 PolarHBondContact O-N 3.27Å; Q224-V226 PolarHBondContact O-N 2.91Å; V226-R230 WeakPolarHBondContact O-CB 3.43Å; V226-R230 WeakPolarHBondContact O-CG 3.3Å; V226-R230 PolarHBondContact O-N 3.39Å; V226-R230 VanDerWaalsContact O-N 3.07Å
227K96.4Very high94.6Very high100 Ų10067.2 Ų67.244%0.43532%0.318SS..Hα-helixtrans-57-51.9175.6-177.8-177.6175.9-175.40111.1Y223 Q224 I225 R230 L231Y223-K227 WeakPolarHBondContact O-CB 3.45Å; Y223-K227 PolarHBondContact O-N 2.93Å; Q224-K227 PolarHBondContact O-N 2.99Å; I225-K227 PolarHBondContact O-N 3.15Å; K227-R230 PolarHBondContact O-N 2.98Å; K227-L231 HydrophobicContact CG-CD1 4.15Å; K227-L231 WeakPolarHBondContact O-CG 3.46Å; K227-L231 PolarHBondContact O-N 3.05Å
228T93.8Very high94.3Very high23 Ų2371.6 Ų71.614%0.14134%0.335CS..Hα-helixtrans-67.2-40.4-177.8-60.70000112.7V140 Q224 I225 R230 L231 N232V140-T228 WeakPolarHBondContact CG1-OG1 3.49Å; V140-T228 HydrophobicContact CG2-CG2 4.45Å; Q224-T228 WeakPolarHBondContact O-CB 3.4Å; Q224-T228 PolarHBondContact O-N 2.94Å; Q224-T228 PolarHBondContact O-OG1 2.87Å; Q224-T228 VanDerWaalsContact O-OG1 3.11Å; I225-T228 PolarHBondContact O-N 3.49Å; T228-R230 VanDerWaalsContact C-N 3.33Å; T228-R230 PolarHBondContact O-N 3.28Å; T228-L231 PolarHBondContact O-N 3.41Å; T228-N232 WeakPolarHBondContact O-CB 3.42Å; T228-N232 VanDerWaalsContact O-CG 3.22Å; T228-N232 PolarHBondContact O-N 3.12Å; T228-N232 PolarHBondContact O-ND2 3.31Å
229V93.4Very high93.8Very high24 Ų2476.1 Ų76.115%0.14536%0.357CS..Hα-helixtrans-60.7-43.7176.2169.60000110.9I139 I225 N232 E233 I260I139-V229 HydrophobicContact CG2-CG2 3.96Å; I225-V229 HydrophobicContact CG2-CG2 4.26Å; I225-V229 WeakPolarHBondContact O-CB 3.46Å; I225-V229 VanDerWaalsContact O-CG2 3.26Å; I225-V229 WeakPolarHBondContact O-CG2 3.31Å; I225-V229 PolarHBondContact O-N 3.49Å; V229-N232 PolarHBondContact O-N 2.85Å; V229-E233 WeakPolarHBondContact O-CB 3.43Å; V229-E233 VanDerWaalsContact O-CG 3.28Å; V229-E233 WeakPolarHBondContact O-CG 3.23Å; V229-E233 PolarHBondContact O-N 3.16Å; V229-I260 HydrophobicContact CG2-CD1 4.3Å; V229-I260 HydrophobicContact CG2-CG1 4.24Å
230R95Very high93.4Very high165 Ų16571.3 Ų71.362%0.62333%0.333SS*.Hα-helixtrans-64.8-42.3177.6-72.7177.3178.9179.50.9112.4V226 K227 T228 E233 L234V226-R230 WeakPolarHBondContact O-CB 3.43Å; V226-R230 WeakPolarHBondContact O-CG 3.3Å; V226-R230 PolarHBondContact O-N 3.39Å; V226-R230 VanDerWaalsContact O-N 3.07Å; K227-R230 PolarHBondContact O-N 2.98Å; T228-R230 VanDerWaalsContact C-N 3.33Å; T228-R230 PolarHBondContact O-N 3.28Å; R230-E233 PolarHBondContact O-N 3.05Å; R230-L234 VanDerWaalsContact O-CG 3.31Å; R230-L234 WeakPolarHBondContact O-CG 3.46Å; R230-L234 PolarHBondContact O-N 3.32Å
231L93.9Very high92.9Very high83 Ų8375 Ų7544%0.43535%0.352SS..Hα-helixtrans-62.4-48.3177-70.6171.7000111.5K227 T228 E233 L234 E235K227-L231 HydrophobicContact CG-CD1 4.15Å; K227-L231 WeakPolarHBondContact O-CG 3.46Å; K227-L231 PolarHBondContact O-N 3.05Å; T228-L231 PolarHBondContact O-N 3.41Å; L231-E233 VanDerWaalsContact C-N 3.26Å; L231-E233 PolarHBondContact O-N 3.39Å; L231-L234 PolarHBondContact O-N 3.36Å; L231-L234 VanDerWaalsContact O-N 3.15Å; L231-E235 WeakPolarHBondContact O-CG 3.3Å; L231-E235 PolarHBondContact O-N 3.47Å
232N90.3Very high92.5Very high70 Ų7079.4 Ų79.437%0.37438%0.382SS..Hα-helixtrans-61.6-34.4177.6-69.9-14.2000112.3T228 V229 L236T228-N232 WeakPolarHBondContact O-CB 3.42Å; T228-N232 VanDerWaalsContact O-CG 3.22Å; T228-N232 PolarHBondContact O-N 3.12Å; T228-N232 PolarHBondContact O-ND2 3.31Å; V229-N232 PolarHBondContact O-N 2.85Å; N232-L236 WeakPolarHBondContact O-CB 3.26Å; N232-L236 PolarHBondContact O-N 3.07Å
233E90.5Very high92.1Very high69 Ų6983.3 Ų83.332%0.32240%0.404SS..Hα-helixtrans-68.2-42.5174.8-77178.816500112.3V229 R230 L231 L236 M237 K252V229-E233 WeakPolarHBondContact O-CB 3.43Å; V229-E233 VanDerWaalsContact O-CG 3.28Å; V229-E233 WeakPolarHBondContact O-CG 3.23Å; V229-E233 PolarHBondContact O-N 3.16Å; R230-E233 PolarHBondContact O-N 3.05Å; L231-E233 VanDerWaalsContact C-N 3.26Å; L231-E233 PolarHBondContact O-N 3.39Å; E233-L236 PolarHBondContact O-N 3.47Å; E233-M237 WeakPolarHBondContact O-CB 3.39Å; E233-M237 VanDerWaalsContact O-CG 3.24Å; E233-M237 WeakPolarHBondContact O-CG 3.28Å; E233-M237 PolarHBondContact O-N 3.45Å; E233-K252 IonicContact OE1-NZ 2.88Å; E233-K252 PolarHBondContact OE1-NZ 2.96Å
234L92.4Very high91.5Very high97 Ų9783.5 Ų83.551%0.50842%0.415SS..Hα-helixtrans-64.5-42.8176.1-69.2171.1000111.9R230 L231 M237 K238R230-L234 VanDerWaalsContact O-CG 3.31Å; R230-L234 WeakPolarHBondContact O-CG 3.46Å; R230-L234 PolarHBondContact O-N 3.32Å; L231-L234 PolarHBondContact O-N 3.36Å; L231-L234 VanDerWaalsContact O-N 3.15Å; L234-M237 PolarHBondContact O-N 3.15Å; L234-K238 WeakPolarHBondContact O-CG 3.48Å; L234-K238 PolarHBondContact O-N 3.37Å
235E90.9Very high90.8Very high118 Ų11885.2 Ų85.255%0.55143%0.425SS*.Hα-helixtrans-64.7-42.1176.3-71.7176.5178.500111.9L231 M237 K238 M239L231-E235 WeakPolarHBondContact O-CG 3.3Å; L231-E235 PolarHBondContact O-N 3.47Å; E235-M237 VanDerWaalsContact C-N 3.35Å; E235-M237 PolarHBondContact O-N 3.36Å; E235-K238 PolarHBondContact O-N 2.97Å; E235-M239 WeakPolarHBondContact O-CB 3.4Å; E235-M239 PolarHBondContact O-N 2.93Å
236L88.4Confident89.9Confident26 Ų2694.3 Ų94.314%0.13647%0.468CS..Hα-helixtrans-63.2-40.3175.5176.260.4000112.2N232 E233 M239 A240 P248 M251 K252N232-L236 WeakPolarHBondContact O-CB 3.26Å; N232-L236 PolarHBondContact O-N 3.07Å; E233-L236 PolarHBondContact O-N 3.47Å; L236-M239 PolarHBondContact O-N 3.43Å; L236-A240 WeakPolarHBondContact O-CB 3.39Å; L236-A240 PolarHBondContact O-N 3.32Å; L236-P248 WeakPolarHBondContact CD2-O 3.08Å; L236-P248 HydrophobicContact CG-CB 4.11Å; L236-M251 HydrophobicContact CD1-CB 3.6Å; L236-M251 HydrophobicContact CD1-CE 4.14Å; L236-M251 HydrophobicContact CD1-CG 4.04Å; L236-M251 HydrophobicContact CD1-SD 3.47Å; L236-M251 WeakPolarHBondContact CD1-SD 3.31Å; L236-K252 HydrophobicContact CD2-CD 4.32Å; L236-K252 HydrophobicContact CD2-CG 3.71Å
237M88.5Confident89Confident114 Ų11495.8 Ų95.856%0.56247%0.473SS*.Hα-helixtrans-63.3-43.4174.8-73.8174.8-176.700111.6E233 L234 E235 M239 A240 Q241E233-M237 WeakPolarHBondContact O-CB 3.39Å; E233-M237 VanDerWaalsContact O-CG 3.24Å; E233-M237 WeakPolarHBondContact O-CG 3.28Å; E233-M237 PolarHBondContact O-N 3.45Å; L234-M237 PolarHBondContact O-N 3.15Å; E235-M237 VanDerWaalsContact C-N 3.35Å; E235-M237 PolarHBondContact O-N 3.36Å; M237-M239 PolarHBondContact O-N 2.94Å; M237-A240 PolarHBondContact O-N 3.5Å; M237-Q241 WeakPolarHBondContact O-CB 3.29Å; M237-Q241 PolarHBondContact O-N 3.24Å
238K90.5Very high87.9Confident145 Ų14592.9 Ų92.963%0.6347%0.465SS*.Hα-helixtrans-61.7-42.6175.1-71.4172.3-179-179.60111.9L234 E235 Q241 S242L234-K238 WeakPolarHBondContact O-CG 3.48Å; L234-K238 PolarHBondContact O-N 3.37Å; E235-K238 PolarHBondContact O-N 2.97Å; K238-Q241 PolarHBondContact O-N 3.21Å; K238-S242 PolarHBondContact O-N 3.48Å
239M88.9Confident87Confident99 Ų9995.4 Ų95.449%0.48848%0.484SS..Hα-helixtrans-66.2-44.7177.8-174.9176.2-74.600111.6E235 L236 M237 Q241 S242 L243 M251E235-M239 WeakPolarHBondContact O-CB 3.4Å; E235-M239 PolarHBondContact O-N 2.93Å; L236-M239 PolarHBondContact O-N 3.43Å; M237-M239 PolarHBondContact O-N 2.94Å; M239-Q241 VanDerWaalsContact C-N 3.3Å; M239-Q241 PolarHBondContact O-N 2.89Å; M239-S242 WeakPolarHBondContact CA-OG 3.41Å; M239-S242 PolarHBondContact O-N 3.34Å; M239-S242 VanDerWaalsContact O-N 3.12Å; M239-S242 PolarHBondContact O-OG 2.97Å; M239-L243 HydrophobicContact CG-CD1 3.94Å; M239-L243 WeakPolarHBondContact O-CG 3.44Å; M239-L243 PolarHBondContact O-N 3.24Å; M239-M251 HydrophobicContact CG-CE 4Å; M239-M251 HydrophobicContact SD-CE 3.49Å; M239-M251 WeakPolarHBondContact SD-CE 3.34Å
240A89Confident86.1Confident3 Ų397.9 Ų97.93%0.02551%0.507CS..Hα-helixtrans-63-37.5176.800000112.3L236 M237 L243 D244 L245 P248L236-A240 WeakPolarHBondContact O-CB 3.39Å; L236-A240 PolarHBondContact O-N 3.32Å; M237-A240 PolarHBondContact O-N 3.5Å; A240-L243 CarbonylContact O-C 3.19Å; A240-L243 PolarHBondContact O-N 3.45Å; A240-D244 PolarHBondContact O-N 3.37Å; A240-L245 HydrophobicContact CB-CB 4.1Å; A240-L245 PolarHBondContact O-N 3.04Å; A240-P248 HydrophobicContact CB-CB 3.56Å; A240-P248 HydrophobicContact CB-CG 3.5Å; A240-P248 VanDerWaalsContact CB-CG 3.5Å
241Q88Confident85.1Confident164 Ų16493.4 Ų93.477%0.76649%0.494SS*.Hα-helixtrans-63.2-41.2172.1-172.8179.415.600111.8M237 K238 M239 L243 D244M237-Q241 WeakPolarHBondContact O-CB 3.29Å; M237-Q241 PolarHBondContact O-N 3.24Å; K238-Q241 PolarHBondContact O-N 3.21Å; M239-Q241 VanDerWaalsContact C-N 3.3Å; M239-Q241 PolarHBondContact O-N 2.89Å; Q241-L243 PolarHBondContact O-N 3.44Å; Q241-D244 PolarHBondContact O-N 2.93Å
242S88.4Confident84.3Confident92 Ų9292.8 Ų92.864%0.64349%0.487SS*.Hα-helixtrans-68.7-21.6177.270.20000114.2K238 M239K238-S242 PolarHBondContact O-N 3.48Å; M239-S242 WeakPolarHBondContact CA-OG 3.41Å; M239-S242 PolarHBondContact O-N 3.34Å; M239-S242 VanDerWaalsContact O-N 3.12Å; M239-S242 PolarHBondContact O-OG 2.97Å
243L88.8Confident83.8Confident103 Ų10393.2 Ų93.254%0.53949%0.492SS..THydrogen-bonded Turntrans-106.66.5-178.7-65.8175000113.2M239 A240 Q241 L245 M251M239-L243 HydrophobicContact CG-CD1 3.94Å; M239-L243 WeakPolarHBondContact O-CG 3.44Å; M239-L243 PolarHBondContact O-N 3.24Å; A240-L243 CarbonylContact O-C 3.19Å; A240-L243 PolarHBondContact O-N 3.45Å; Q241-L243 PolarHBondContact O-N 3.44Å; L243-L245 HydrophobicContact CB-CD1 3.87Å; L243-L245 HydrophobicContact CB-CG 3.78Å; L243-L245 HydrophobicContact CD1-CD1 3.94Å; L243-L245 PolarHBondContact O-N 2.92Å; L243-M251 HydrophobicContact CD1-CE 4.39Å
244D85.4Confident83.2Confident150 Ų15092.8 Ų92.880%0.80251%0.507SS*.THydrogen-bonded Turntrans4938.1-173.9-16234000114.1A240 Q241A240-D244 PolarHBondContact O-N 3.37Å; Q241-D244 PolarHBondContact O-N 2.93Å
245L81.4Confident82.7Confident76 Ų7692.5 Ų92.540%0.39851%0.506SS..  trans-85.1119.6-178.4-67.8172.4000111A240 L243 N247 M251A240-L245 HydrophobicContact CB-CB 4.1Å; A240-L245 PolarHBondContact O-N 3.04Å; L243-L245 HydrophobicContact CB-CD1 3.87Å; L243-L245 HydrophobicContact CB-CG 3.78Å; L243-L245 HydrophobicContact CD1-CD1 3.94Å; L243-L245 PolarHBondContact O-N 2.92Å; L245-N247 PolarHBondContact O-N 2.64Å; L245-M251 HydrophobicContact CD1-CE 4.22Å; L245-M251 HydrophobicContact CD1-CG 4.28Å; L245-M251 HydrophobicContact CD1-SD 3.5Å; L245-M251 WeakPolarHBondContact CD1-SD 3.29Å
246Q77.1Confident82.4Confident199 Ų19992.4 Ų92.493%0.9350%0.503SS*.SBendtrans-65.9-22.2176.9-64.8-177.11.800113.8
247N77.5Confident82.4Confident91 Ų9197.6 Ų97.649%0.48753%0.525SS..  trans-132.182-177.5-168.3-1.5000112.9L245 S249 A250L245-N247 PolarHBondContact O-N 2.64Å; N247-S249 PolarHBondContact O-N 3.31Å; N247-S249 VanDerWaalsContact O-N 3.13Å; N247-S249 WeakPolarHBondContact OD1-CB 3.24Å; N247-S249 PolarHBondContact OD1-N 2.98Å; N247-S249 PolarHBondContact OD1-OG 2.85Å; N247-A250 HydrophobicContact CB-CB 4.48Å; N247-A250 WeakPolarHBondContact O-CB 3.34Å; N247-A250 PolarHBondContact O-N 3.39Å; N247-A250 VanDerWaalsContact O-N 3.16Å
248P74.5Confident82.4Confident39 Ų3995 Ų9525%0.25352%0.521SS..G310 helixtrans-55.6-33.2176.7-17.524.1000112.4L236 A240 A250 M251L236-P248 WeakPolarHBondContact CD2-O 3.08Å; L236-P248 HydrophobicContact CG-CB 4.11Å; A240-P248 HydrophobicContact CB-CB 3.56Å; A240-P248 HydrophobicContact CB-CG 3.5Å; A240-P248 VanDerWaalsContact CB-CG 3.5Å; P248-A250 PolarHBondContact O-N 3.26Å; P248-M251 WeakPolarHBondContact O-CB 3.42Å; P248-M251 PolarHBondContact O-N 3.49Å
249S74.8Confident82.4Confident77 Ų7789.6 Ų89.654%0.53850%0.499SS..G310 helixtrans-65.5-22.3-175.979.40000113.8N247 M251 K252N247-S249 PolarHBondContact O-N 3.31Å; N247-S249 VanDerWaalsContact O-N 3.13Å; N247-S249 WeakPolarHBondContact OD1-CB 3.24Å; N247-S249 PolarHBondContact OD1-N 2.98Å; N247-S249 PolarHBondContact OD1-OG 2.85Å; S249-M251 PolarHBondContact O-N 3.42Å; S249-K252 PolarHBondContact O-N 2.94Å
250A73.2Confident82.6Confident76 Ų7686.5 Ų86.563%0.62848%0.484SS*.G310 helixtrans-68-20.817500000112.8N247 P248 K252N247-A250 HydrophobicContact CB-CB 4.48Å; N247-A250 WeakPolarHBondContact O-CB 3.34Å; N247-A250 PolarHBondContact O-N 3.39Å; N247-A250 VanDerWaalsContact O-N 3.16Å; P248-A250 PolarHBondContact O-N 3.26Å; A250-K252 VanDerWaalsContact C-N 3.31Å
251M75.5Confident82.8Confident71 Ų7190.4 Ų90.435%0.3550%0.502SS..G310 helixtrans-78.4-15.3177.5-54.9175.870.600112.6L236 M239 L243 L245 P248 S249 T253L236-M251 HydrophobicContact CD1-CB 3.6Å; L236-M251 HydrophobicContact CD1-CE 4.14Å; L236-M251 HydrophobicContact CD1-CG 4.04Å; L236-M251 HydrophobicContact CD1-SD 3.47Å; L236-M251 WeakPolarHBondContact CD1-SD 3.31Å; M239-M251 HydrophobicContact CG-CE 4Å; M239-M251 HydrophobicContact SD-CE 3.49Å; M239-M251 WeakPolarHBondContact SD-CE 3.34Å; L243-M251 HydrophobicContact CD1-CE 4.39Å; L245-M251 HydrophobicContact CD1-CE 4.22Å; L245-M251 HydrophobicContact CD1-CG 4.28Å; L245-M251 HydrophobicContact CD1-SD 3.5Å; L245-M251 WeakPolarHBondContact CD1-SD 3.29Å; P248-M251 WeakPolarHBondContact O-CB 3.42Å; P248-M251 PolarHBondContact O-N 3.49Å; S249-M251 PolarHBondContact O-N 3.42Å; M251-T253 PolarHBondContact O-N 2.94Å
252K76.8Confident83Confident69 Ų6984 Ų8430%0.348%0.477SS..SBendtrans-71.7124.6174.9-68.1-173178.9-1780109.1E233 L236 S249 A250E233-K252 IonicContact OE1-NZ 2.88Å; E233-K252 PolarHBondContact OE1-NZ 2.96Å; L236-K252 HydrophobicContact CD2-CD 4.32Å; L236-K252 HydrophobicContact CD2-CG 3.71Å; S249-K252 PolarHBondContact O-N 2.94Å; A250-K252 VanDerWaalsContact C-N 3.31Å
253T78.8Confident83.4Confident79 Ų7979.8 Ų79.849%0.48545%0.448SS..  trans-62.2149.3175.163.80000111M251 D255 K256 K257M251-T253 PolarHBondContact O-N 2.94Å; T253-D255 PolarHBondContact O-N 3.47Å; T253-K256 PolarHBondContact O-N 3.41Å; T253-K256 WeakPolarHBondContact OG1-CG 3.32Å; T253-K256 PolarHBondContact OG1-N 2.84Å; T253-K257 PolarHBondContact O-N 2.92Å
254G79.3Confident83.7Confident60 Ų6079.7 Ų79.762%0.61944%0.443SS*.Hα-helixtrans-56-38.4177.800000112.8K257 A258G254-K257 PolarHBondContact O-N 3.32Å; G254-A258 PolarHBondContact O-N 3.46Å
255D81.9Confident84.2Confident91 Ų9173.1 Ų73.149%0.48741%0.408SS..Hα-helixtrans-61.4-52.7176.9-77.215.7000111.8R148 T253 K257 A258 D259R148-D255 IonicContact NH2-OD2 3.85Å; R148-D255 PolarHBondContact NH2-OD2 3.47Å; T253-D255 PolarHBondContact O-N 3.47Å; D255-K257 PolarHBondContact O-N 2.88Å; D255-A258 WeakPolarHBondContact O-CA 3.48Å; D255-A258 WeakPolarHBondContact O-CB 3.4Å; D255-A258 PolarHBondContact O-N 3.03Å; D255-D259 PolarHBondContact O-N 3.27Å
256K84.6Confident84.9Confident116 Ų11669.8 Ų69.850%0.50439%0.392SS..Hα-helixtrans-57-39.3178.5-76.7-177.3179-173.70112.2T253 I260T253-K256 PolarHBondContact O-N 3.41Å; T253-K256 WeakPolarHBondContact OG1-CG 3.32Å; T253-K256 PolarHBondContact OG1-N 2.84Å; K256-I260 VanDerWaalsContact O-CG1 3.27Å; K256-I260 WeakPolarHBondContact O-CG1 3.35Å; K256-I260 PolarHBondContact O-N 3.06Å; K256-I260 VanDerWaalsContact O-N 3.08Å
257K87.2Confident85.8Confident136 Ų13662.9 Ų62.959%0.59136%0.36SS*.Hα-helixtrans-65.3-43.7176.1-174.7176.7-179.4174.60111.4T253 G254 D255 D259 I260 E261T253-K257 PolarHBondContact O-N 2.92Å; G254-K257 PolarHBondContact O-N 3.32Å; D255-K257 PolarHBondContact O-N 2.88Å; K257-D259 VanDerWaalsContact C-N 3.34Å; K257-I260 PolarHBondContact O-N 3Å; K257-E261 WeakPolarHBondContact O-CG 3.49Å; K257-E261 PolarHBondContact O-N 2.65Å
258A88.7Confident86.8Confident58 Ų5860.7 Ų60.748%0.47935%0.348SS..Hα-helixtrans-62.4-41.3177.800000111.8G254 D255 E261 A262G254-A258 PolarHBondContact O-N 3.46Å; D255-A258 WeakPolarHBondContact O-CA 3.48Å; D255-A258 WeakPolarHBondContact O-CB 3.4Å; D255-A258 PolarHBondContact O-N 3.03Å; A258-E261 PolarHBondContact O-N 2.93Å; A258-A262 WeakPolarHBondContact O-CB 3.14Å; A258-A262 PolarHBondContact O-N 3.41Å
259D90.9Very high87.9Confident33 Ų3359 Ų5918%0.17634%0.337CS..Hα-helixtrans-65.5-41.2178-66-39.9000112.1V138 I139 D255 K257 A262 A263V138-D259 HydrophobicContact CG1-CB 4.11Å; V138-D259 VanDerWaalsContact CG1-CG 3.43Å; V138-D259 VanDerWaalsContact CG1-OD2 3.25Å; V138-D259 WeakPolarHBondContact CG1-OD2 3.45Å; I139-D259 HydrophobicContact CD1-CB 4.39Å; I139-D259 HydrophobicContact CG1-CB 4.03Å; D255-D259 PolarHBondContact O-N 3.27Å; K257-D259 VanDerWaalsContact C-N 3.34Å; D259-A262 PolarHBondContact O-N 3.45Å; D259-A263 WeakPolarHBondContact O-CB 3.2Å; D259-A263 PolarHBondContact O-N 3.42Å
260I92.6Very high88.9Confident33 Ų3355.9 Ų55.917%0.16932%0.315CS..Hα-helixtrans-62.6-42.3174.2-69.7167.7000111.2I139 V229 K256 K257 A262 A263 K264I139-I260 HydrophobicContact CD1-CG1 4.5Å; V229-I260 HydrophobicContact CG2-CD1 4.3Å; V229-I260 HydrophobicContact CG2-CG1 4.24Å; K256-I260 VanDerWaalsContact O-CG1 3.27Å; K256-I260 WeakPolarHBondContact O-CG1 3.35Å; K256-I260 PolarHBondContact O-N 3.06Å; K256-I260 VanDerWaalsContact O-N 3.08Å; K257-I260 PolarHBondContact O-N 3Å; I260-A262 VanDerWaalsContact C-N 3.35Å; I260-A263 PolarHBondContact O-N 3.12Å; I260-K264 WeakPolarHBondContact O-CG 3.21Å; I260-K264 PolarHBondContact O-N 3.44Å
261E93.1Very high90.1Very high86 Ų8656.6 Ų56.640%0.40231%0.308SS..Hα-helixtrans-68-34.6176.8-67.7-54.9127.800112.3K257 A258 K264 T265K257-E261 WeakPolarHBondContact O-CG 3.49Å; K257-E261 PolarHBondContact O-N 2.65Å; A258-E261 PolarHBondContact O-N 2.93Å; E261-K264 PolarHBondContact O-N 3.49Å; E261-K264 IonicContact OE1-NZ 3.95Å; E261-K264 PolarHBondContact OE1-NZ 2.91Å; E261-T265 PolarHBondContact O-N 3.22Å; E261-T265 PolarHBondContact O-OG1 3.14Å
262A93.4Very high91.2Very high29 Ų2955.2 Ų55.224%0.2430%0.301CS..Hα-helixtrans-65.2-42.2172.100000111.5A258 D259 I260 T265 S266A258-A262 WeakPolarHBondContact O-CB 3.14Å; A258-A262 PolarHBondContact O-N 3.41Å; D259-A262 PolarHBondContact O-N 3.45Å; I260-A262 VanDerWaalsContact C-N 3.35Å; A262-T265 WeakPolarHBondContact O-CB 3.46Å; A262-T265 PolarHBondContact O-N 3.41Å; A262-S266 PolarHBondContact O-N 3.42Å; A262-S266 PolarHBondContact O-OG 2.82Å
263A95.4Very high92.2Very high3 Ų352.3 Ų52.33%0.02529%0.289CS..Hα-helixtrans-62.3-41.5174.600000112.5R135 I139 D259 I260 T265 S266 I267R135-A263 HydrophobicContact CB-CB 4.12Å; R135-A263 HydrophobicContact CG-CB 4.12Å; I139-A263 HydrophobicContact CD1-CB 3.68Å; D259-A263 WeakPolarHBondContact O-CB 3.2Å; D259-A263 PolarHBondContact O-N 3.42Å; I260-A263 PolarHBondContact O-N 3.12Å; A263-T265 VanDerWaalsContact C-N 3.29Å; A263-T265 PolarHBondContact O-N 3.05Å; A263-S266 WeakPolarHBondContact CA-OG 3.14Å; A263-S266 PolarHBondContact O-N 3.3Å; A263-S266 PolarHBondContact O-OG 3.41Å; A263-I267 WeakPolarHBondContact O-CG1 3.26Å; A263-I267 PolarHBondContact O-N 3.15Å
264K95.4Very high93.1Very high101 Ų10150 Ų5044%0.43927%0.273SS..Hα-helixtrans-61.2-39.2173-72173.5-174.8170.70112.1I260 E261 I267 I268I260-K264 WeakPolarHBondContact O-CG 3.21Å; I260-K264 PolarHBondContact O-N 3.44Å; E261-K264 PolarHBondContact O-N 3.49Å; E261-K264 IonicContact OE1-NZ 3.95Å; E261-K264 PolarHBondContact OE1-NZ 2.91Å; K264-I267 PolarHBondContact O-N 3.19Å; K264-I268 WeakPolarHBondContact O-CD1 3.21Å; K264-I268 WeakPolarHBondContact O-CG1 3.35Å; K264-I268 PolarHBondContact O-N 3.48Å
265T95.8Very high93.9Very high12 Ų1253 Ų537%0.07427%0.273CS..Hα-helixtrans-62.9-47.4176.7-58.30000110.4E261 A262 A263 I267 I268 L269 V317 K321E261-T265 PolarHBondContact O-N 3.22Å; E261-T265 PolarHBondContact O-OG1 3.14Å; A262-T265 WeakPolarHBondContact O-CB 3.46Å; A262-T265 PolarHBondContact O-N 3.41Å; A263-T265 VanDerWaalsContact C-N 3.29Å; A263-T265 PolarHBondContact O-N 3.05Å; T265-I267 PolarHBondContact O-N 3.09Å; T265-I268 WeakPolarHBondContact O-CB 3.43Å; T265-I268 PolarHBondContact O-N 3.4Å; T265-I268 VanDerWaalsContact O-N 3.15Å; T265-L269 WeakPolarHBondContact O-CG 3.34Å; T265-L269 PolarHBondContact O-N 3.33Å; T265-V317 HydrophobicContact CG2-CG1 3.83Å; T265-K321 HydrophobicContact CG2-CB 4.21Å
266S96Very high94.7Very high7 Ų749 Ų495%0.04925%0.251CS..Hα-helixtrans-68-30.5179.756.20000113.7Y222 A262 A263 I268 L269 V270Y222-S266 WeakPolarHBondContact OH-CB 3.48Å; Y222-S266 PolarHBondContact OH-O 3.39Å; Y222-S266 PolarHBondContact OH-OG 2.89Å; A262-S266 PolarHBondContact O-N 3.42Å; A262-S266 PolarHBondContact O-OG 2.82Å; A263-S266 WeakPolarHBondContact CA-OG 3.14Å; A263-S266 PolarHBondContact O-N 3.3Å; A263-S266 PolarHBondContact O-OG 3.41Å; S266-I268 VanDerWaalsContact C-N 3.29Å; S266-I268 PolarHBondContact O-N 3.08Å; S266-L269 PolarHBondContact O-N 3.15Å; S266-V270 WeakPolarHBondContact O-CG2 3.31Å; S266-V270 PolarHBondContact O-N 3.46Å; S266-V270 VanDerWaalsContact O-N 3.09Å
267I96.9Very high95.3Very high53 Ų5345.2 Ų45.227%0.27223%0.234SC..Hα-helixtrans-58.9-43.1170.1-70.8169000110.6Y222 A263 K264 T265 L269 V270 L271Y222-I267 HydrophobicContact CD1-CD1 3.67Å; Y222-I267 HydrophobicContact CD1-CG1 3.43Å; Y222-I267 VanDerWaalsContact CD1-CG1 3.43Å; Y222-I267 HydrophobicContact CD2-CG1 4.03Å; Y222-I267 HydrophobicContact CE1-CD1 3.86Å; Y222-I267 HydrophobicContact CE1-CG1 3.24Å; Y222-I267 HydrophobicContact CE2-CG1 3.83Å; Y222-I267 HydrophobicContact CG-CD1 4.24Å; Y222-I267 HydrophobicContact CG-CG1 3.85Å; Y222-I267 VanDerWaalsContact CZ-CG1 3.45Å; Y222-I267 PolarHBondContact OH-N 2.98Å; A263-I267 WeakPolarHBondContact O-CG1 3.26Å; A263-I267 PolarHBondContact O-N 3.15Å; K264-I267 PolarHBondContact O-N 3.19Å; T265-I267 PolarHBondContact O-N 3.09Å; I267-L269 PolarHBondContact O-N 3.12Å; I267-V270 PolarHBondContact O-N 3.45Å; I267-L271 HydrophobicContact CG2-CD1 3.86Å; I267-L271 HydrophobicContact CG2-CG 4.22Å; I267-L271 WeakPolarHBondContact O-CG 3.28Å; I267-L271 PolarHBondContact O-N 3.03Å
268I97.5Very high95.7Very high46 Ų4640.7 Ų40.724%0.23622%0.219CC..Hα-helixtrans-64.8-42.3-179-66.7161.6000111K264 T265 S266 V270 L271 L272 V317 K321K264-I268 WeakPolarHBondContact O-CD1 3.21Å; K264-I268 WeakPolarHBondContact O-CG1 3.35Å; K264-I268 PolarHBondContact O-N 3.48Å; T265-I268 WeakPolarHBondContact O-CB 3.43Å; T265-I268 PolarHBondContact O-N 3.4Å; T265-I268 VanDerWaalsContact O-N 3.15Å; S266-I268 VanDerWaalsContact C-N 3.29Å; S266-I268 PolarHBondContact O-N 3.08Å; I268-V270 VanDerWaalsContact C-N 3.32Å; I268-V270 PolarHBondContact O-N 2.94Å; I268-L271 PolarHBondContact O-N 3.3Å; I268-L272 HydrophobicContact CG2-CD1 3.76Å; I268-L272 HydrophobicContact CG2-CG 4.37Å; I268-L272 WeakPolarHBondContact O-CB 3.45Å; I268-L272 VanDerWaalsContact O-CG 3.31Å; I268-L272 WeakPolarHBondContact O-CG 3.44Å; I268-L272 PolarHBondContact O-N 2.99Å; I268-V317 HydrophobicContact CG2-CG1 4.26Å; I268-V317 HydrophobicContact CG2-CG2 4Å; I268-K321 HydrophobicContact CD1-CD 3.62Å; I268-K321 VanDerWaalsContact CD1-CE 3.5Å
269L97.5Very high96.1Very high4 Ų440.1 Ų40.12%0.02121%0.211CC..Hα-helixtrans-58.6-46.8175.8-54.3179.2000111.1L78 M128 T265 S266 I267 L272 Y273 N314 V317 Y318L78-L269 HydrophobicContact CD2-CD1 4.49Å; M128-L269 HydrophobicContact CE-CB 4.05Å; M128-L269 HydrophobicContact SD-CB 4.4Å; T265-L269 WeakPolarHBondContact O-CG 3.34Å; T265-L269 PolarHBondContact O-N 3.33Å; S266-L269 PolarHBondContact O-N 3.15Å; I267-L269 PolarHBondContact O-N 3.12Å; L269-L272 PolarHBondContact O-N 3.43Å; L269-Y273 WeakPolarHBondContact O-CB 3.5Å; L269-Y273 PolarHBondContact O-N 3.32Å; L269-N314 HydrophobicContact CD2-CB 4.35Å; L269-N314 WeakPolarHBondContact CD2-OD1 3.29Å; L269-V317 HydrophobicContact CD2-CB 3.56Å; L269-V317 HydrophobicContact CD2-CG1 3.53Å; L269-V317 HydrophobicContact CD2-CG2 3.97Å; L269-V317 HydrophobicContact CG-CG1 4.41Å; L269-Y318 HydrophobicContact CD1-CE1 3.75Å; L269-Y318 VanDerWaalsContact CD1-OH 3.28Å; L269-Y318 WeakPolarHBondContact CD1-OH 3.35Å; L269-Y318 HydrophobicContact CD2-CE1 4.39Å
270V97.3Very high96.3Very high11 Ų1139 Ų397%0.06720%0.204CC..Hα-helixtrans-60-48.2177.4164.30000111.2M128 I218 Y222 S266 I267 I268 L272 Y273 L274M128-V270 HydrophobicContact CB-CG2 4.12Å; M128-V270 HydrophobicContact SD-CG2 4.12Å; I218-V270 HydrophobicContact CD1-CG2 4.17Å; I218-V270 HydrophobicContact CG2-CB 4.34Å; I218-V270 HydrophobicContact CG2-CG1 3.59Å; I218-V270 HydrophobicContact CG2-CG2 3.88Å; Y222-V270 HydrophobicContact CE2-CG2 4.26Å; S266-V270 WeakPolarHBondContact O-CG2 3.31Å; S266-V270 PolarHBondContact O-N 3.46Å; S266-V270 VanDerWaalsContact O-N 3.09Å; I267-V270 PolarHBondContact O-N 3.45Å; I268-V270 VanDerWaalsContact C-N 3.32Å; I268-V270 PolarHBondContact O-N 2.94Å; V270-L272 VanDerWaalsContact C-N 3.35Å; V270-L272 PolarHBondContact O-N 3.49Å; V270-Y273 PolarHBondContact O-N 3.15Å; V270-L274 HydrophobicContact CG1-CD1 3.83Å; V270-L274 HydrophobicContact CG1-CG 4.3Å; V270-L274 WeakPolarHBondContact O-CB 3.43Å; V270-L274 WeakPolarHBondContact O-CG 3.39Å; V270-L274 PolarHBondContact O-N 3.23Å
271L97.8Very high96.4Very high91 Ų9138 Ų3848%0.47620%0.201SC..Hα-helixtrans-61.9-44.3-179.8-70.6174.7000111.3I267 I268 L274 M275I267-L271 HydrophobicContact CG2-CD1 3.86Å; I267-L271 HydrophobicContact CG2-CG 4.22Å; I267-L271 WeakPolarHBondContact O-CG 3.28Å; I267-L271 PolarHBondContact O-N 3.03Å; I268-L271 PolarHBondContact O-N 3.3Å; L271-L274 PolarHBondContact O-N 3.35Å; L271-M275 HydrophobicContact CB-CE 4.2Å; L271-M275 VanDerWaalsContact O-CB 3.3Å; L271-M275 WeakPolarHBondContact O-CB 3.45Å; L271-M275 WeakPolarHBondContact O-CE 3.46Å; L271-M275 WeakPolarHBondContact O-CG 3.47Å; L271-M275 PolarHBondContact O-N 3.18Å
272L98.2Very high96.5Very high41 Ų4138.4 Ų38.422%0.21521%0.205CC..Hα-helixtrans-62-43.9176.2-70.6168.5000111.6I268 L269 V270 M275 S276 Y313 V317I268-L272 HydrophobicContact CG2-CD1 3.76Å; I268-L272 HydrophobicContact CG2-CG 4.37Å; I268-L272 WeakPolarHBondContact O-CB 3.45Å; I268-L272 VanDerWaalsContact O-CG 3.31Å; I268-L272 WeakPolarHBondContact O-CG 3.44Å; I268-L272 PolarHBondContact O-N 2.99Å; L269-L272 PolarHBondContact O-N 3.43Å; V270-L272 VanDerWaalsContact C-N 3.35Å; V270-L272 PolarHBondContact O-N 3.49Å; L272-M275 HydrophobicContact CD2-CE 3.93Å; L272-M275 HydrophobicContact CG-CE 4.44Å; L272-S276 WeakPolarHBondContact O-CB 3.35Å; L272-S276 PolarHBondContact O-N 3.24Å; L272-S276 PolarHBondContact O-OG 3.41Å; L272-Y313 HydrophobicContact CB-CD2 4.05Å; L272-Y313 HydrophobicContact CB-CG 4.3Å; L272-Y313 HydrophobicContact CD1-CG 4.31Å; L272-Y313 HydrophobicContact CD2-CG 4.5Å; L272-V317 HydrophobicContact CD1-CG2 3.67Å
273Y98.3Very high96.5Very high9 Ų938 Ų384%0.03520%0.199CC..Hα-helixtrans-60.8-51.3176.6-174.1-83.2000111.5G121 L125 M128 L269 V270 M275 S276 W277G121-Y273 PolarHBondContact O-OH 3.5Å; L125-Y273 HydrophobicContact CB-CE1 3.84Å; L125-Y273 HydrophobicContact CD1-CD1 4Å; L125-Y273 HydrophobicContact CD1-CE1 3.78Å; L125-Y273 HydrophobicContact CD2-CE1 4.34Å; L125-Y273 HydrophobicContact CG-CE1 4.18Å; M128-Y273 HydrophobicContact CE-CD2 3.92Å; M128-Y273 HydrophobicContact CE-CG 4.15Å; M128-Y273 HydrophobicContact SD-CD2 4.28Å; M128-Y273 HydrophobicContact SD-CG 4.02Å; L269-Y273 WeakPolarHBondContact O-CB 3.5Å; L269-Y273 PolarHBondContact O-N 3.32Å; V270-Y273 PolarHBondContact O-N 3.15Å; Y273-M275 PolarHBondContact O-N 2.97Å; Y273-S276 WeakPolarHBondContact O-CB 3.27Å; Y273-S276 PolarHBondContact O-N 3.39Å; Y273-S276 VanDerWaalsContact O-N 3.14Å; Y273-W277 AromaticContact CD2-CD1 3.92Å; Y273-W277 HydrophobicContact CE1-CB 4.29Å; Y273-W277 AromaticContact CE1-CD1 3.69Å; Y273-W277 AromaticContact CE1-CG 3.97Å; Y273-W277 HydrophobicContact CE1-CG 3.97Å; Y273-W277 AromaticContact CE2-CD1 3.64Å; Y273-W277 AromaticContact CE2-NE1 3.52Å; Y273-W277 AromaticContact CZ-CD1 3.51Å; Y273-W277 AromaticContact CZ-CG 3.98Å; Y273-W277 AromaticContact CZ-NE1 3.63Å; Y273-W277 PolarHBondContact O-N 3.08Å
274L97.1Very high96.4Very high31 Ų3138 Ų3816%0.16220%0.199CC..Hα-helixtrans-65.2-40.5-179.4-65.9178.9000112F211 V215 V270 L271 S276 W277 S278F211-L274 HydrophobicContact CE2-CD2 4.27Å; F211-L274 HydrophobicContact CZ-CD2 4.21Å; V215-L274 HydrophobicContact CG2-CD2 3.72Å; V270-L274 HydrophobicContact CG1-CD1 3.83Å; V270-L274 HydrophobicContact CG1-CG 4.3Å; V270-L274 WeakPolarHBondContact O-CB 3.43Å; V270-L274 WeakPolarHBondContact O-CG 3.39Å; V270-L274 PolarHBondContact O-N 3.23Å; L271-L274 PolarHBondContact O-N 3.35Å; L274-S276 PolarHBondContact O-N 2.96Å; L274-W277 PolarHBondContact O-N 2.79Å; L274-S278 WeakPolarHBondContact O-CB 3.41Å; L274-S278 PolarHBondContact O-N 2.91Å; L274-S278 PolarHBondContact O-OG 3.01Å
275M97.2Very high96.3Very high123 Ų12336.1 Ų36.161%0.60619%0.194SC*.Hα-helixtrans-62.2-34.2174.6-74.1-173.4-71.100112.2L271 L272 Y273 P279L271-M275 HydrophobicContact CB-CE 4.2Å; L271-M275 VanDerWaalsContact O-CB 3.3Å; L271-M275 WeakPolarHBondContact O-CB 3.45Å; L271-M275 WeakPolarHBondContact O-CE 3.46Å; L271-M275 WeakPolarHBondContact O-CG 3.47Å; L271-M275 PolarHBondContact O-N 3.18Å; L272-M275 HydrophobicContact CD2-CE 3.93Å; L272-M275 HydrophobicContact CG-CE 4.44Å; Y273-M275 PolarHBondContact O-N 2.97Å; M275-P279 VanDerWaalsContact O-CD 3.25Å; M275-P279 WeakPolarHBondContact O-CD 3.43Å
276S98.1Very high96.1Very high6 Ų639.4 Ų39.44%0.04221%0.209CC..Hα-helixtrans-73-44.8179-56.40000112.4L272 Y273 L274 F306 A307 Y313L272-S276 WeakPolarHBondContact O-CB 3.35Å; L272-S276 PolarHBondContact O-N 3.24Å; L272-S276 PolarHBondContact O-OG 3.41Å; Y273-S276 WeakPolarHBondContact O-CB 3.27Å; Y273-S276 PolarHBondContact O-N 3.39Å; Y273-S276 VanDerWaalsContact O-N 3.14Å; L274-S276 PolarHBondContact O-N 2.96Å; S276-F306 WeakPolarHBondContact CB-O 3.5Å; S276-F306 CarbonylContact O-C 3.55Å; S276-A307 WeakPolarHBondContact O-CA 3.39Å; S276-A307 PolarHBondContact O-N 3.32Å; S276-Y313 VanDerWaalsContact OG-CE2 3.27Å; S276-Y313 WeakPolarHBondContact OG-CE2 3.1Å
277W97.4Very high95.9Very high37 Ų3739.1 Ų39.114%0.1421%0.207CC..Hα-helixtrans-90.4-25.7-172.3-79.587.3000114.2F85 Y273 L274 Y280 A281 A307 S310F85-W277 HydrophobicContact CE2-CH2 4.11Å; F85-W277 HydrophobicContact CE2-CZ2 4.01Å; F85-W277 HydrophobicContact CZ-CH2 4.3Å; F85-W277 AromaticContact CZ-CZ2 3.98Å; F85-W277 HydrophobicContact CZ-CZ2 3.98Å; Y273-W277 AromaticContact CD2-CD1 3.92Å; Y273-W277 HydrophobicContact CE1-CB 4.29Å; Y273-W277 AromaticContact CE1-CD1 3.69Å; Y273-W277 AromaticContact CE1-CG 3.97Å; Y273-W277 HydrophobicContact CE1-CG 3.97Å; Y273-W277 AromaticContact CE2-CD1 3.64Å; Y273-W277 AromaticContact CE2-NE1 3.52Å; Y273-W277 AromaticContact CZ-CD1 3.51Å; Y273-W277 AromaticContact CZ-CG 3.98Å; Y273-W277 AromaticContact CZ-NE1 3.63Å; Y273-W277 PolarHBondContact O-N 3.08Å; L274-W277 PolarHBondContact O-N 2.79Å; W277-Y280 HydrophobicContact CE3-CD1 4.25Å; W277-Y280 HydrophobicContact CZ3-CD1 4.25Å; W277-Y280 PolarHBondContact O-N 3.43Å; W277-Y280 VanDerWaalsContact O-N 3.15Å; W277-A281 PolarHBondContact O-N 2.92Å; W277-A307 HydrophobicContact CD2-CB 3.84Å; W277-A307 HydrophobicContact CE3-CB 3.91Å; W277-A307 HydrophobicContact CG-CB 4.32Å; W277-A307 HydrophobicContact CH2-CB 4.44Å; W277-A307 HydrophobicContact CZ2-CB 4.36Å; W277-A307 HydrophobicContact CZ3-CB 4.21Å; W277-A307 PolarHBondContact NE1-O 2.88Å; W277-S310 PolarHBondContact NE1-OG 3.29Å
278S94.8Very high95.4Very high40 Ų4038.5 Ų38.528%0.2820%0.204SC..Hα-helixtrans-59.6-41.6-176.7-62.90000113.7L274 Y280 A281 I282L274-S278 WeakPolarHBondContact O-CB 3.41Å; L274-S278 PolarHBondContact O-N 2.91Å; L274-S278 PolarHBondContact O-OG 3.01Å; S278-Y280 VanDerWaalsContact C-N 3.25Å; S278-Y280 PolarHBondContact O-N 2.9Å; S278-A281 PolarHBondContact O-N 3.18Å; S278-I282 WeakPolarHBondContact O-CB 3.49Å; S278-I282 WeakPolarHBondContact O-CD1 3.43Å; S278-I282 WeakPolarHBondContact O-CG1 3.27Å; S278-I282 PolarHBondContact O-N 3.28Å
279P96.6Very high95Very high47 Ų4741.9 Ų41.931%0.30522%0.222SC..Hα-helixtrans-55.9-41.5175.9-27.236.3000112.6M275 V283 P303M275-P279 VanDerWaalsContact O-CD 3.25Å; M275-P279 WeakPolarHBondContact O-CD 3.43Å; P279-V283 PolarHBondContact O-N 3.41Å; P279-V283 VanDerWaalsContact O-N 3.13Å; P279-P303 HydrophobicContact CB-CB 3.98Å; P279-P303 HydrophobicContact CB-CG 4.37Å
280Y96.2Very high94.5Very high10 Ų1044.2 Ų44.24%0.03925%0.246CC..Hα-helixtrans-70.2-45.7178.4179.7-101.2000111T189 F190 Y192 W277 S278 I282 V283 C284 P303 V304T189-Y280 VanDerWaalsContact CG2-OH 3.27Å; T189-Y280 WeakPolarHBondContact CG2-OH 3.45Å; T189-Y280 PolarHBondContact OG1-OH 3.01Å; F190-Y280 AromaticContact CE1-CE1 3.97Å; F190-Y280 HydrophobicContact CE1-CE1 3.97Å; F190-Y280 AromaticContact CZ-CE1 3.78Å; F190-Y280 HydrophobicContact CZ-CE1 3.78Å; Y192-Y280 HydrophobicContact CE1-CE2 4.38Å; W277-Y280 HydrophobicContact CE3-CD1 4.25Å; W277-Y280 HydrophobicContact CZ3-CD1 4.25Å; W277-Y280 PolarHBondContact O-N 3.43Å; W277-Y280 VanDerWaalsContact O-N 3.15Å; S278-Y280 VanDerWaalsContact C-N 3.25Å; S278-Y280 PolarHBondContact O-N 2.9Å; Y280-I282 VanDerWaalsContact C-N 3.27Å; Y280-I282 PolarHBondContact O-N 3.22Å; Y280-V283 PolarHBondContact O-N 2.99Å; Y280-V283 VanDerWaalsContact O-N 3.14Å; Y280-C284 VanDerWaalsContact CE1-SG 3.59Å; Y280-C284 VanDerWaalsContact CZ-SG 3.51Å; Y280-C284 PolarHBondContact O-N 3.34Å; Y280-C284 PolarHBondContact O-SG 3.34Å; Y280-C284 VanDerWaalsContact O-SG 3.38Å; Y280-P303 HydrophobicContact CD2-CB 4.46Å; Y280-V304 HydrophobicContact CD2-CG2 3.51Å; Y280-V304 HydrophobicContact CE2-CG2 3.47Å; Y280-V304 VanDerWaalsContact CE2-CG2 3.47Å
281A95.1Very high94Very high12 Ų1246.2 Ų46.210%0.09926%0.261CS..Hα-helixtrans-59.5-36.1176.400000112.8Y207 F211 W277 S278 L285Y207-A281 HydrophobicContact CE2-CB 4.23Å; F211-A281 HydrophobicContact CE1-CB 4.43Å; F211-A281 HydrophobicContact CZ-CB 4.37Å; W277-A281 PolarHBondContact O-N 2.92Å; S278-A281 PolarHBondContact O-N 3.18Å; A281-L285 VanDerWaalsContact O-CB 3.32Å; A281-L285 WeakPolarHBondContact O-CB 3.31Å; A281-L285 PolarHBondContact O-N 3.41Å
282I94.3Very high93.5Very high94 Ų9445.7 Ų45.748%0.48225%0.252SS..Hα-helixtrans-67.5-45.1175.4-70.1164000110.4S278 Y280 L285 M286S278-I282 WeakPolarHBondContact O-CB 3.49Å; S278-I282 WeakPolarHBondContact O-CD1 3.43Å; S278-I282 WeakPolarHBondContact O-CG1 3.27Å; S278-I282 PolarHBondContact O-N 3.28Å; Y280-I282 VanDerWaalsContact C-N 3.27Å; Y280-I282 PolarHBondContact O-N 3.22Å; I282-L285 PolarHBondContact O-N 3.15Å; I282-M286 HydrophobicContact CG2-CG 4.34Å; I282-M286 HydrophobicContact CG2-SD 4.09Å; I282-M286 VanDerWaalsContact O-CG 3.3Å; I282-M286 WeakPolarHBondContact O-CG 3.35Å; I282-M286 PolarHBondContact O-N 3.48Å
283V94.5Very high92.9Very high20 Ų2049.4 Ų49.412%0.12127%0.273CS..Hα-helixtrans-60-47.5177163.90000111.4P279 Y280 L285 M286 T287 L295 P303P279-V283 PolarHBondContact O-N 3.41Å; P279-V283 VanDerWaalsContact O-N 3.13Å; Y280-V283 PolarHBondContact O-N 2.99Å; Y280-V283 VanDerWaalsContact O-N 3.14Å; V283-L285 VanDerWaalsContact C-N 3.3Å; V283-L285 PolarHBondContact O-N 3.46Å; V283-M286 PolarHBondContact O-N 3.33Å; V283-T287 PolarHBondContact O-N 2.98Å; V283-T287 VanDerWaalsContact O-N 3.16Å; V283-L295 HydrophobicContact CG1-CD1 3.51Å; V283-P303 HydrophobicContact CG2-CG 4Å
284C93.6Very high92.4Very high4 Ų452.5 Ų52.53%0.02730%0.295CS..Hα-helixtrans-62.6-36.7175.3-61.40000112.1F190 Y192 Y280 T287 L288F190-C284 HydrophobicContact CE2-CB 4.34Å; Y192-C284 VanDerWaalsContact CD1-SG 3.55Å; Y192-C284 HydrophobicContact CG-CB 4.26Å; Y280-C284 VanDerWaalsContact CE1-SG 3.59Å; Y280-C284 VanDerWaalsContact CZ-SG 3.51Å; Y280-C284 PolarHBondContact O-N 3.34Å; Y280-C284 PolarHBondContact O-SG 3.34Å; Y280-C284 VanDerWaalsContact O-SG 3.38Å; C284-T287 PolarHBondContact O-OG1 2.98Å; C284-L288 WeakPolarHBondContact O-CD1 3.37Å; C284-L288 VanDerWaalsContact O-CG 3.23Å; C284-L288 WeakPolarHBondContact O-CG 3.5Å; C284-L288 PolarHBondContact O-N 3.35Å
285L92.6Very high92.2Very high61 Ų6151.5 Ų51.532%0.31929%0.29SS..Hα-helixtrans-66.6-41.4175.6-178.464.3000111.6Y207 A281 I282 V283 T287 L288 I289Y207-L285 HydrophobicContact CE1-CD1 4.3Å; Y207-L285 HydrophobicContact CE1-CD2 4.38Å; Y207-L285 HydrophobicContact CE2-CB 4.15Å; A281-L285 VanDerWaalsContact O-CB 3.32Å; A281-L285 WeakPolarHBondContact O-CB 3.31Å; A281-L285 PolarHBondContact O-N 3.41Å; I282-L285 PolarHBondContact O-N 3.15Å; V283-L285 VanDerWaalsContact C-N 3.3Å; V283-L285 PolarHBondContact O-N 3.46Å; L285-T287 VanDerWaalsContact C-N 3.29Å; L285-T287 PolarHBondContact O-N 3.11Å; L285-L288 PolarHBondContact O-N 3.05Å; L285-I289 HydrophobicContact CD1-CG2 4.22Å; L285-I289 WeakPolarHBondContact O-CG1 3.35Å; L285-I289 PolarHBondContact O-N 2.82Å
286M92.2Very high92.1Very high80 Ų8047.5 Ų47.539%0.39427%0.273SS..Hα-helixtrans-60.1-38.9178.7-75.8178.468.800112I282 V283 I289 G290 S291I282-M286 HydrophobicContact CG2-CG 4.34Å; I282-M286 HydrophobicContact CG2-SD 4.09Å; I282-M286 VanDerWaalsContact O-CG 3.3Å; I282-M286 WeakPolarHBondContact O-CG 3.35Å; I282-M286 PolarHBondContact O-N 3.48Å; V283-M286 PolarHBondContact O-N 3.33Å; M286-I289 WeakPolarHBondContact O-CG1 3.48Å; M286-G290 PolarHBondContact O-N 3.43Å; M286-S291 WeakPolarHBondContact O-CA 3.35Å; M286-S291 WeakPolarHBondContact O-CB 3.24Å; M286-S291 PolarHBondContact O-N 3.49Å
287T90.6Very high92Very high2 Ų247.5 Ų47.51%0.01227%0.273CS..Hα-helixtrans-68.9-40.2176.157.20000111.5Y192 L193 V283 C284 L285 I289 G290 R292 L295Y192-T287 HydrophobicContact CD2-CG2 3.9Å; Y192-T287 WeakPolarHBondContact CD2-OG1 3.17Å; Y192-T287 HydrophobicContact CE2-CG2 4.18Å; Y192-T287 WeakPolarHBondContact O-CB 3.49Å; Y192-T287 PolarHBondContact O-OG1 3.17Å; L193-T287 HydrophobicContact CD2-CG2 4.09Å; V283-T287 PolarHBondContact O-N 2.98Å; V283-T287 VanDerWaalsContact O-N 3.16Å; C284-T287 PolarHBondContact O-OG1 2.98Å; L285-T287 VanDerWaalsContact C-N 3.29Å; L285-T287 PolarHBondContact O-N 3.11Å; T287-I289 PolarHBondContact O-N 3.23Å; T287-G290 PolarHBondContact O-N 3.04Å; T287-G290 VanDerWaalsContact O-N 3.12Å; T287-R292 HydrophobicContact CG2-CB 4.29Å; T287-L295 HydrophobicContact CG2-CD2 3.83Å
288L87.1Confident91.9Very high39 Ų3949.2 Ų49.220%0.20428%0.281CS..Hα-helixtrans-63.5-36.3177.3-69.7167.9000113.3L200 N203 C284 L285 G290L200-L288 HydrophobicContact CD2-CD2 4.11Å; N203-L288 HydrophobicContact CB-CD1 3.83Å; N203-L288 HydrophobicContact CB-CD2 3.48Å; N203-L288 VanDerWaalsContact CB-CD2 3.48Å; N203-L288 HydrophobicContact CB-CG 4.28Å; C284-L288 WeakPolarHBondContact O-CD1 3.37Å; C284-L288 VanDerWaalsContact O-CG 3.23Å; C284-L288 WeakPolarHBondContact O-CG 3.5Å; C284-L288 PolarHBondContact O-N 3.35Å; L285-L288 PolarHBondContact O-N 3.05Å; L288-G290 PolarHBondContact O-N 3.29Å
289I88.6Confident91.8Very high118 Ų11852.5 Ų52.561%0.60529%0.292SS*.THydrogen-bonded Turntrans-83.78.3176.668.5179.8000113.5L285 M286 T287L285-I289 HydrophobicContact CD1-CG2 4.22Å; L285-I289 WeakPolarHBondContact O-CG1 3.35Å; L285-I289 PolarHBondContact O-N 2.82Å; M286-I289 WeakPolarHBondContact O-CG1 3.48Å; T287-I289 PolarHBondContact O-N 3.23Å
290G86.3Confident91.7Very high52 Ų5250.2 Ų50.254%0.53628%0.277SS..THydrogen-bonded Turntrans98.34.3171.300000116.2M286 T287 L288 R292M286-G290 PolarHBondContact O-N 3.43Å; T287-G290 PolarHBondContact O-N 3.04Å; T287-G290 VanDerWaalsContact O-N 3.12Å; L288-G290 PolarHBondContact O-N 3.29Å; G290-R292 PolarHBondContact O-N 3.14Å
291S87.5Confident91.8Very high53 Ų5349.9 Ų49.937%0.37128%0.276SS..  trans-88.931.2178.5-57.90000113.4M286 D293 S294M286-S291 WeakPolarHBondContact O-CA 3.35Å; M286-S291 WeakPolarHBondContact O-CB 3.24Å; M286-S291 PolarHBondContact O-N 3.49Å; S291-D293 VanDerWaalsContact C-N 3.33Å; S291-D293 PolarHBondContact O-N 3.42Å; S291-S294 PolarHBondContact O-OG 2.96Å
292R86.8Confident91.8Very high81 Ų8153.9 Ų53.931%0.30630%0.295SS..G310 helixtrans-67.6-29.2-175.867.3-178.5178.1-160.4-5.5114H24 L193 T195 T287 G290 S294 L295H24-R292 PolarHBondContact CE1-O 3.5Å; L193-R292 PolarHBondContact O-NH1 3.39Å; T195-R292 VanDerWaalsContact CG2-NH1 3.26Å; T195-R292 PolarHBondContact OG1-NH1 2.99Å; T287-R292 HydrophobicContact CG2-CB 4.29Å; G290-R292 PolarHBondContact O-N 3.14Å; R292-S294 VanDerWaalsContact C-N 3.25Å; R292-S294 PolarHBondContact O-N 3.02Å; R292-L295 VanDerWaalsContact O-CB 3.24Å; R292-L295 WeakPolarHBondContact O-CB 3.49Å; R292-L295 PolarHBondContact O-N 2.9Å
293D86.6Confident92Very high119 Ų11950.1 Ų50.164%0.63628%0.277SS*.G310 helixtrans-65.8-27.9-173.8-72-38.8000113.6K27 S291 L295K27-D293 IonicContact NZ-OD1 2.74Å; S291-D293 VanDerWaalsContact C-N 3.33Å; S291-D293 PolarHBondContact O-N 3.42Å; D293-L295 VanDerWaalsContact C-N 3.28Å; D293-L295 PolarHBondContact O-N 3.28Å
294S87.4Confident92.1Very high73 Ų7349.3 Ų49.351%0.5127%0.272SS..G310 helixtrans-76.9-9.517448.70000114.5S291 R292 T296 H299S291-S294 PolarHBondContact O-OG 2.96Å; R292-S294 VanDerWaalsContact C-N 3.25Å; R292-S294 PolarHBondContact O-N 3.02Å; S294-T296 PolarHBondContact O-N 3.39Å; S294-H299 PolarHBondContact O-ND1 2.95Å
295L93.5Very high92.4Very high10 Ų1050 Ų505%0.05228%0.275CS..  trans-76.8118.1-177.1-169.973.2000110.8H24 W25 F28 Y192 L193 V283 T287 R292 D293 H299H24-L295 PolarHBondContact CE1-O 3.42Å; H24-L295 PolarHBondContact NE2-O 3.48Å; W25-L295 HydrophobicContact CH2-CD2 3.59Å; W25-L295 HydrophobicContact CH2-CG 4.08Å; W25-L295 HydrophobicContact CZ2-CD2 4.23Å; W25-L295 HydrophobicContact CZ3-CD2 4.43Å; F28-L295 VanDerWaalsContact CZ-O 3.24Å; F28-L295 WeakPolarHBondContact CZ-O 3.33Å; Y192-L295 HydrophobicContact CE2-CD2 3.73Å; L193-L295 HydrophobicContact CD2-CD2 3.84Å; V283-L295 HydrophobicContact CG1-CD1 3.51Å; T287-L295 HydrophobicContact CG2-CD2 3.83Å; R292-L295 VanDerWaalsContact O-CB 3.24Å; R292-L295 WeakPolarHBondContact O-CB 3.49Å; R292-L295 PolarHBondContact O-N 2.9Å; D293-L295 VanDerWaalsContact C-N 3.28Å; D293-L295 PolarHBondContact O-N 3.28Å; L295-H299 HydrophobicContact CD1-CB 3.77Å
296T95Very high92.6Very high40 Ų4052.5 Ų52.525%0.24528%0.284CS..  trans-104.5163.8174.6720000110.1F28 S294 F298 H299 S300F28-T296 HydrophobicContact CE1-CG2 4.11Å; F28-T296 HydrophobicContact CZ-CG2 4.46Å; S294-T296 PolarHBondContact O-N 3.39Å; T296-F298 PolarHBondContact O-N 2.93Å; T296-F298 VanDerWaalsContact O-N 3.15Å; T296-F298 PolarHBondContact OG1-N 2.99Å; T296-H299 PolarHBondContact O-N 3.2Å; T296-H299 PolarHBondContact OG1-N 3.4Å; T296-H299 PolarHBondContact OG1-ND1 3.2Å; T296-S300 PolarHBondContact O-N 2.88Å; T296-S300 VanDerWaalsContact O-N 3.1Å; T296-S300 PolarHBondContact O-OG 3.42Å
297P94.9Very high92.9Very high6 Ų648.9 Ų48.94%0.03927%0.266CS..Hα-helixtrans-50.4-38.6173.6-31.437.2000113.8F7 F28 F184 S300 E301F7-P297 HydrophobicContact CE2-CG 3.87Å; F7-P297 HydrophobicContact CZ-CG 4.41Å; F28-P297 HydrophobicContact CB-CG 3.97Å; F28-P297 HydrophobicContact CD1-CG 4.24Å; F28-P297 HydrophobicContact CD2-CG 4.27Å; F28-P297 HydrophobicContact CG-CG 3.91Å; F184-P297 HydrophobicContact CD2-CB 3.79Å; F184-P297 WeakPolarHBondContact CD2-O 3.48Å; F184-P297 HydrophobicContact CE2-CB 3.86Å; F184-P297 WeakPolarHBondContact CE2-O 3.35Å; P297-S300 PolarHBondContact O-N 2.74Å; P297-S300 PolarHBondContact O-OG 2.74Å; P297-E301 VanDerWaalsContact O-CB 3.26Å; P297-E301 WeakPolarHBondContact O-CB 3.16Å; P297-E301 PolarHBondContact O-N 3.42Å
298F95.1Very high93.3Very high73 Ų7349.5 Ų49.532%0.3227%0.269SS..Hα-helixtrans-73.3-36.4178.8-72.8-81.6000113.1P31 Y35 F184 T296 S300 E301 L302P31-F298 HydrophobicContact CB-CE2 4.3Å; P31-F298 HydrophobicContact CB-CZ 4Å; P31-F298 HydrophobicContact CG-CE2 4.31Å; P31-F298 HydrophobicContact CG-CZ 4.36Å; Y35-F298 AromaticContact CD1-CE1 3.76Å; Y35-F298 HydrophobicContact CD1-CE1 3.76Å; Y35-F298 HydrophobicContact CD1-CZ 4.12Å; Y35-F298 HydrophobicContact CD2-CE1 4.21Å; Y35-F298 AromaticContact CD2-CZ 3.74Å; Y35-F298 HydrophobicContact CD2-CZ 3.74Å; Y35-F298 HydrophobicContact CE1-CE1 4.06Å; Y35-F298 HydrophobicContact CE1-CZ 4.26Å; Y35-F298 HydrophobicContact CE2-CE1 4.48Å; Y35-F298 AromaticContact CE2-CZ 3.89Å; Y35-F298 HydrophobicContact CE2-CZ 3.89Å; Y35-F298 AromaticContact CG-CE1 3.84Å; Y35-F298 HydrophobicContact CG-CE1 3.84Å; Y35-F298 AromaticContact CG-CZ 3.85Å; Y35-F298 HydrophobicContact CG-CZ 3.85Å; F184-F298 AromaticContact CE2-CD1 4Å; F184-F298 HydrophobicContact CE2-CD1 4Å; F184-F298 HydrophobicContact CE2-CE1 4.2Å; F184-F298 HydrophobicContact CE2-CG 4.17Å; F184-F298 AromaticContact CZ-CD1 3.76Å; F184-F298 HydrophobicContact CZ-CD1 3.76Å; F184-F298 AromaticContact CZ-CE1 3.57Å; F184-F298 HydrophobicContact CZ-CE1 3.57Å; F184-F298 HydrophobicContact CZ-CG 4.35Å; F184-F298 AromaticContact CZ-CZ 3.99Å; F184-F298 HydrophobicContact CZ-CZ 3.99Å; T296-F298 PolarHBondContact O-N 2.93Å; T296-F298 VanDerWaalsContact O-N 3.15Å; T296-F298 PolarHBondContact OG1-N 2.99Å; F298-S300 VanDerWaalsContact C-N 3.25Å; F298-S300 PolarHBondContact O-N 2.72Å; F298-E301 PolarHBondContact O-N 3.23Å; F298-L302 PolarHBondContact O-N 3.12Å; F298-L302 VanDerWaalsContact O-N 3.16Å
299H93.8Very high93.8Very high108 Ų10848.1 Ų48.150%0.526%0.262SS..Hα-helixtrans-65.2-29.7174.6-66.9137.1000112.1S294 L295 T296 P303S294-H299 PolarHBondContact O-ND1 2.95Å; L295-H299 HydrophobicContact CD1-CB 3.77Å; T296-H299 PolarHBondContact O-N 3.2Å; T296-H299 PolarHBondContact OG1-N 3.4Å; T296-H299 PolarHBondContact OG1-ND1 3.2Å; H299-P303 WeakPolarHBondContact O-CD 3.47Å; H299-P303 VanDerWaalsContact O-CG 3.31Å; H299-P303 WeakPolarHBondContact O-CG 3.46Å
300S94.8Very high94.3Very high0 Ų042.8 Ų42.80%024%0.235CC..Hα-helixtrans-80.5-41170.653.30000112.9G183 T296 P297 F298 V304G183-S300 WeakPolarHBondContact CA-OG 3.39Å; G183-S300 PolarHBondContact N-OG 3.31Å; T296-S300 PolarHBondContact O-N 2.88Å; T296-S300 VanDerWaalsContact O-N 3.1Å; T296-S300 PolarHBondContact O-OG 3.42Å; P297-S300 PolarHBondContact O-N 2.74Å; P297-S300 PolarHBondContact O-OG 2.74Å; F298-S300 VanDerWaalsContact C-N 3.25Å; F298-S300 PolarHBondContact O-N 2.72Å; S300-V304 WeakPolarHBondContact O-CG2 3.18Å
301E97.1Very high94.8Very high2 Ų240.3 Ų40.31%0.00921%0.21CC..Hα-helixtrans-73.3-44.9-169.4-174.861.5-156.700113.1V39 K94 F184 P297 F298 V304 L305V39-E301 WeakPolarHBondContact CG1-OE1 3.33Å; V39-E301 HydrophobicContact CG2-CG 4.23Å; K94-E301 WeakPolarHBondContact CE-OE1 3.44Å; K94-E301 IonicContact NZ-OE1 3.74Å; K94-E301 PolarHBondContact NZ-OE1 3.01Å; K94-E301 IonicContact NZ-OE2 3.88Å; F184-E301 HydrophobicContact CB-CG 4.37Å; F184-E301 WeakPolarHBondContact CB-OE2 3.43Å; F184-E301 HydrophobicContact CD1-CG 3.93Å; F184-E301 HydrophobicContact CD2-CB 3.45Å; F184-E301 VanDerWaalsContact CD2-CB 3.45Å; F184-E301 HydrophobicContact CD2-CG 3.75Å; F184-E301 HydrophobicContact CE1-CG 4.1Å; F184-E301 HydrophobicContact CE2-CB 3.58Å; F184-E301 HydrophobicContact CE2-CG 3.93Å; F184-E301 HydrophobicContact CG-CB 3.97Å; F184-E301 HydrophobicContact CG-CG 3.74Å; F184-E301 HydrophobicContact CZ-CB 4.2Å; F184-E301 HydrophobicContact CZ-CG 4.1Å; P297-E301 VanDerWaalsContact O-CB 3.26Å; P297-E301 WeakPolarHBondContact O-CB 3.16Å; P297-E301 PolarHBondContact O-N 3.42Å; F298-E301 PolarHBondContact O-N 3.23Å; E301-V304 WeakPolarHBondContact O-CB 3.46Å; E301-V304 PolarHBondContact O-N 3.18Å; E301-V304 VanDerWaalsContact O-N 3.15Å; E301-L305 WeakPolarHBondContact O-CG 3.2Å; E301-L305 PolarHBondContact O-N 3.04Å; E301-L305 VanDerWaalsContact O-N 3.13Å
302L96.8Very high95.4Very high96 Ų9638.6 Ų38.650%0.50320%0.197SC..Hα-helixtrans-59.8-48.5-176-72.2174.3000112.7F298 V304 L305 F306F298-L302 PolarHBondContact O-N 3.12Å; F298-L302 VanDerWaalsContact O-N 3.16Å; L302-V304 VanDerWaalsContact C-N 3.28Å; L302-V304 PolarHBondContact O-N 2.95Å; L302-L305 HydrophobicContact CD2-CD1 4.39Å; L302-L305 WeakPolarHBondContact O-CB 3.35Å; L302-L305 PolarHBondContact O-N 3.4Å; L302-L305 VanDerWaalsContact O-N 3.15Å; L302-F306 WeakPolarHBondContact O-CD2 3.35Å; L302-F306 PolarHBondContact O-N 2.94Å
303P97.5Very high95.9Very high15 Ų1538 Ų3810%0.09720%0.196CC..Hα-helixtrans-57.9-36.2174.5-28.138.2000114.5P279 Y280 V283 H299 L305 F306 A307P279-P303 HydrophobicContact CB-CB 3.98Å; P279-P303 HydrophobicContact CB-CG 4.37Å; Y280-P303 HydrophobicContact CD2-CB 4.46Å; V283-P303 HydrophobicContact CG2-CG 4Å; H299-P303 WeakPolarHBondContact O-CD 3.47Å; H299-P303 VanDerWaalsContact O-CG 3.31Å; H299-P303 WeakPolarHBondContact O-CG 3.46Å; P303-L305 VanDerWaalsContact C-N 3.3Å; P303-L305 PolarHBondContact O-N 2.98Å; P303-F306 PolarHBondContact O-N 3.36Å; P303-A307 PolarHBondContact O-N 2.91Å
304V97.4Very high96.4Very high4 Ų432.5 Ų32.52%0.02417%0.166CC..Hα-helixtrans-63.2-38.5177.21720000111.2E182 Y280 S300 E301 L302 A307 K308E182-V304 WeakPolarHBondContact OE1-CG2 3.2Å; Y280-V304 HydrophobicContact CD2-CG2 3.51Å; Y280-V304 HydrophobicContact CE2-CG2 3.47Å; Y280-V304 VanDerWaalsContact CE2-CG2 3.47Å; S300-V304 WeakPolarHBondContact O-CG2 3.18Å; E301-V304 WeakPolarHBondContact O-CB 3.46Å; E301-V304 PolarHBondContact O-N 3.18Å; E301-V304 VanDerWaalsContact O-N 3.15Å; L302-V304 VanDerWaalsContact C-N 3.28Å; L302-V304 PolarHBondContact O-N 2.95Å; V304-A307 PolarHBondContact O-N 3.04Å; V304-K308 HydrophobicContact CG1-CD 4.06Å; V304-K308 WeakPolarHBondContact O-CB 3.41Å; V304-K308 WeakPolarHBondContact O-CG 3.48Å; V304-K308 PolarHBondContact O-N 2.95Å
305L98.1Very high96.9Very high19 Ų1929.6 Ų29.610%0.09915%0.145CC..Hα-helixtrans-62.9-47.8175.4-59.9179.9000111.1V39 Y42 E301 L302 P303 A307 K308 T309V39-L305 HydrophobicContact CG1-CD2 4.1Å; V39-L305 HydrophobicContact CG2-CD1 4.18Å; Y42-L305 HydrophobicContact CD1-CB 4.34Å; Y42-L305 HydrophobicContact CD1-CD1 4.42Å; Y42-L305 HydrophobicContact CD1-CD2 4.13Å; Y42-L305 HydrophobicContact CE1-CB 3.87Å; Y42-L305 HydrophobicContact CE1-CD2 4.42Å; E301-L305 WeakPolarHBondContact O-CG 3.2Å; E301-L305 PolarHBondContact O-N 3.04Å; E301-L305 VanDerWaalsContact O-N 3.13Å; L302-L305 HydrophobicContact CD2-CD1 4.39Å; L302-L305 WeakPolarHBondContact O-CB 3.35Å; L302-L305 PolarHBondContact O-N 3.4Å; L302-L305 VanDerWaalsContact O-N 3.15Å; P303-L305 VanDerWaalsContact C-N 3.3Å; P303-L305 PolarHBondContact O-N 2.98Å; L305-A307 PolarHBondContact O-N 3.27Å; L305-K308 PolarHBondContact O-N 2.91Å; L305-T309 PolarHBondContact O-N 3.36Å; L305-T309 VanDerWaalsContact O-N 3.12Å; L305-T309 PolarHBondContact O-OG1 3.36Å
306F97.8Very high97Very high112 Ų11233.5 Ų33.549%0.49117%0.166SC..Hα-helixtrans-58.9-45.7176.3-70.3-71000112.3S276 L302 P303 K308 T309S276-F306 WeakPolarHBondContact CB-O 3.5Å; S276-F306 CarbonylContact O-C 3.55Å; L302-F306 WeakPolarHBondContact O-CD2 3.35Å; L302-F306 PolarHBondContact O-N 2.94Å; P303-F306 PolarHBondContact O-N 3.36Å; F306-K308 VanDerWaalsContact C-N 3.33Å; F306-K308 PolarHBondContact O-N 3.41Å; F306-T309 PolarHBondContact O-N 3.45Å
307A98.4Very high97.1Very high4 Ų432.3 Ų32.33%0.03316%0.158CC..Hα-helixtrans-58.6-44.9177.400000111.3S276 W277 P303 V304 L305 T309 S310S276-A307 WeakPolarHBondContact O-CA 3.39Å; S276-A307 PolarHBondContact O-N 3.32Å; W277-A307 HydrophobicContact CD2-CB 3.84Å; W277-A307 HydrophobicContact CE3-CB 3.91Å; W277-A307 HydrophobicContact CG-CB 4.32Å; W277-A307 HydrophobicContact CH2-CB 4.44Å; W277-A307 HydrophobicContact CZ2-CB 4.36Å; W277-A307 HydrophobicContact CZ3-CB 4.21Å; W277-A307 PolarHBondContact NE1-O 2.88Å; P303-A307 PolarHBondContact O-N 2.91Å; V304-A307 PolarHBondContact O-N 3.04Å; L305-A307 PolarHBondContact O-N 3.27Å; A307-T309 VanDerWaalsContact C-N 3.28Å; A307-T309 PolarHBondContact O-N 2.8Å; A307-S310 VanDerWaalsContact O-CB 3.29Å; A307-S310 WeakPolarHBondContact O-CB 3.25Å; A307-S310 PolarHBondContact O-N 2.88Å; A307-S310 VanDerWaalsContact O-N 3.16Å; A307-S310 PolarHBondContact O-OG 3.34Å
308K98.3Very high97Very high15 Ų1532.3 Ų32.37%0.06516%0.157CC..Hα-helixtrans-66.6-28.2-179.7-71.4177.7-166-69.90113.3I43 F85 N89 K94 Y113 V304 L305 F306 S310I43-K308 HydrophobicContact CD1-CB 3.74Å; I43-K308 HydrophobicContact CD1-CD 3.61Å; I43-K308 HydrophobicContact CD1-CG 4.27Å; I43-K308 HydrophobicContact CG1-CD 4.5Å; F85-K308 HydrophobicContact CE1-CB 4.16Å; F85-K308 HydrophobicContact CE1-CG 4.04Å; F85-K308 HydrophobicContact CZ-CB 4.38Å; F85-K308 HydrophobicContact CZ-CG 3.83Å; N89-K308 PolarHBondContact OD1-NZ 3.22Å; K94-K308 HydrophobicContact CD-CD 3.91Å; Y113-K308 WeakPolarHBondContact OH-CE 3.34Å; Y113-K308 PolarHBondContact OH-NZ 3.5Å; V304-K308 HydrophobicContact CG1-CD 4.06Å; V304-K308 WeakPolarHBondContact O-CB 3.41Å; V304-K308 WeakPolarHBondContact O-CG 3.48Å; V304-K308 PolarHBondContact O-N 2.95Å; L305-K308 PolarHBondContact O-N 2.91Å; F306-K308 VanDerWaalsContact C-N 3.33Å; F306-K308 PolarHBondContact O-N 3.41Å; K308-S310 PolarHBondContact O-N 2.86Å
309T98.3Very high96.8Very high11 Ų1130 Ų307%0.06715%0.152CC..Hα-helixtrans-68.4-16.8176.6-52.20000113.1Y42 V46 L305 F306 A307 A311 V312 Y313Y42-T309 PolarHBondContact OH-OG1 3.23Å; V46-T309 HydrophobicContact CG2-CG2 4.39Å; L305-T309 PolarHBondContact O-N 3.36Å; L305-T309 VanDerWaalsContact O-N 3.12Å; L305-T309 PolarHBondContact O-OG1 3.36Å; F306-T309 PolarHBondContact O-N 3.45Å; A307-T309 VanDerWaalsContact C-N 3.28Å; A307-T309 PolarHBondContact O-N 2.8Å; T309-A311 PolarHBondContact O-N 2.94Å; T309-A311 VanDerWaalsContact O-N 3.08Å; T309-V312 WeakPolarHBondContact O-CB 3.42Å; T309-V312 PolarHBondContact O-N 2.91Å; T309-Y313 HydrophobicContact CG2-CE1 4.26Å; T309-Y313 HydrophobicContact CG2-CE2 4.18Å; T309-Y313 WeakPolarHBondContact CG2-OH 3.28Å
310S98.4Very high96.7Very high5 Ų528.7 Ų28.74%0.03515%0.151CC..Hα-helixtrans-54.6-34.5-179.175.80000113.2W277 A307 K308 V312 Y313W277-S310 PolarHBondContact NE1-OG 3.29Å; A307-S310 VanDerWaalsContact O-CB 3.29Å; A307-S310 WeakPolarHBondContact O-CB 3.25Å; A307-S310 PolarHBondContact O-N 2.88Å; A307-S310 VanDerWaalsContact O-N 3.16Å; A307-S310 PolarHBondContact O-OG 3.34Å; K308-S310 PolarHBondContact O-N 2.86Å; S310-V312 PolarHBondContact O-N 3.22Å; S310-Y313 PolarHBondContact O-N 3.49Å
311A98.3Very high96.5Very high1 Ų133.6 Ų33.61%0.00817%0.173CC..Hα-helixtrans-66-17.8-178.600000114A50 N54 D82 F85 A86 T309A50-A311 HydrophobicContact CB-CB 3.8Å; N54-A311 PolarHBondContact ND2-O 3.37Å; D82-A311 HydrophobicContact CB-CB 3.94Å; F85-A311 HydrophobicContact CD1-CB 4.09Å; A86-A311 HydrophobicContact CB-CB 4.45Å; T309-A311 PolarHBondContact O-N 2.94Å; T309-A311 VanDerWaalsContact O-N 3.08Å
312V98.5Very high96.1Very high17 Ų1735.1 Ų35.110%0.10318%0.18CC..Hα-helixtrans-82.6-31.2179.8178.70000111.8V46 L49 A50 T309 S310 N314 I316V46-V312 HydrophobicContact CB-CG2 4.5Å; V46-V312 HydrophobicContact CG1-CG2 3.88Å; V46-V312 WeakPolarHBondContact O-CG2 3.38Å; L49-V312 HydrophobicContact CB-CG1 4.32Å; L49-V312 HydrophobicContact CB-CG2 4.35Å; A50-V312 HydrophobicContact CB-CG2 3.84Å; T309-V312 WeakPolarHBondContact O-CB 3.42Å; T309-V312 PolarHBondContact O-N 2.91Å; S310-V312 PolarHBondContact O-N 3.22Å; V312-N314 PolarHBondContact O-N 3.11Å; V312-I316 HydrophobicContact CG1-CD1 3.8Å
313Y98.2Very high95.7Very high68 Ų6833.2 Ų33.227%0.26717%0.173SC..Hα-helixtrans-70.8-37.1-166.3-64.7-46.7000113.9L272 S276 T309 S310 I316 V317L272-Y313 HydrophobicContact CB-CD2 4.05Å; L272-Y313 HydrophobicContact CB-CG 4.3Å; L272-Y313 HydrophobicContact CD1-CG 4.31Å; L272-Y313 HydrophobicContact CD2-CG 4.5Å; S276-Y313 VanDerWaalsContact OG-CE2 3.27Å; S276-Y313 WeakPolarHBondContact OG-CE2 3.1Å; T309-Y313 HydrophobicContact CG2-CE1 4.26Å; T309-Y313 HydrophobicContact CG2-CE2 4.18Å; T309-Y313 WeakPolarHBondContact CG2-OH 3.28Å; S310-Y313 PolarHBondContact O-N 3.49Å; Y313-I316 WeakPolarHBondContact O-CB 3.13Å; Y313-I316 PolarHBondContact O-N 2.9Å; Y313-V317 WeakPolarHBondContact O-CG2 3.41Å; Y313-V317 PolarHBondContact O-N 3.46Å
314N97.8Very high95.3Very high4 Ų437.3 Ų37.32%0.02119%0.189CC..Hα-helixtrans-61.1-52.3-171.5-64.4-23.2000112.7D82 L269 V312 I316 V317 Y318D82-N314 PolarHBondContact OD2-ND2 3.35Å; L269-N314 HydrophobicContact CD2-CB 4.35Å; L269-N314 WeakPolarHBondContact CD2-OD1 3.29Å; V312-N314 PolarHBondContact O-N 3.11Å; N314-I316 VanDerWaalsContact C-N 3.29Å; N314-I316 PolarHBondContact O-N 3.37Å; N314-V317 PolarHBondContact O-N 3.03Å; N314-Y318 HydrophobicContact CB-CE2 4.02Å; N314-Y318 WeakPolarHBondContact O-CD2 3.43Å; N314-Y318 PolarHBondContact O-N 2.92Å
315P97Very high94.9Very high11 Ų1137.6 Ų37.67%0.07119%0.191CC..Hα-helixtrans-54.7-40.5174.3-27.334.9000114.2V57 Y318 A319V57-P315 HydrophobicContact CG2-CB 4.09Å; V57-P315 HydrophobicContact CG2-CG 4.13Å; P315-Y318 PolarHBondContact O-N 3.04Å; P315-A319 WeakPolarHBondContact O-CB 3.32Å; P315-A319 PolarHBondContact O-N 2.89Å
316I95.6Very high94.6Very high93 Ų9337.6 Ų37.648%0.47719%0.189SC..Hα-helixtrans-63-47.7178.7-62.8174000110V312 Y313 N314 Y318 A319 V320V312-I316 HydrophobicContact CG1-CD1 3.8Å; Y313-I316 WeakPolarHBondContact O-CB 3.13Å; Y313-I316 PolarHBondContact O-N 2.9Å; N314-I316 VanDerWaalsContact C-N 3.29Å; N314-I316 PolarHBondContact O-N 3.37Å; I316-Y318 VanDerWaalsContact C-N 3.31Å; I316-Y318 PolarHBondContact O-N 3.12Å; I316-A319 PolarHBondContact O-N 2.68Å; I316-V320 WeakPolarHBondContact O-CG2 3.41Å; I316-V320 PolarHBondContact O-N 3.3Å
317V96.4Very high94.3Very high14 Ų1433 Ų339%0.08517%0.169CC..Hα-helixtrans-61.5-40.4178.6173.80000111T265 I268 L269 L272 Y313 N314 V320 K321T265-V317 HydrophobicContact CG2-CG1 3.83Å; I268-V317 HydrophobicContact CG2-CG1 4.26Å; I268-V317 HydrophobicContact CG2-CG2 4Å; L269-V317 HydrophobicContact CD2-CB 3.56Å; L269-V317 HydrophobicContact CD2-CG1 3.53Å; L269-V317 HydrophobicContact CD2-CG2 3.97Å; L269-V317 HydrophobicContact CG-CG1 4.41Å; L272-V317 HydrophobicContact CD1-CG2 3.67Å; Y313-V317 WeakPolarHBondContact O-CG2 3.41Å; Y313-V317 PolarHBondContact O-N 3.46Å; N314-V317 PolarHBondContact O-N 3.03Å; V317-V320 PolarHBondContact O-N 3.12Å; V317-K321 WeakPolarHBondContact O-CB 3.44Å; V317-K321 PolarHBondContact O-N 3.41Å
318Y94Very high93.9Very high6 Ų633.5 Ų33.52%0.02417%0.171CC..Hα-helixtrans-64.7-44.5175.4-58.9-43.7000112.5V57 I75 L269 N314 P315 I316 V320 K321 H322V57-Y318 HydrophobicContact CG2-CD2 4Å; I75-Y318 HydrophobicContact CD1-CE1 4.42Å; I75-Y318 HydrophobicContact CG2-CD2 4.42Å; I75-Y318 HydrophobicContact CG2-CE1 4.22Å; I75-Y318 HydrophobicContact CG2-CE2 3.74Å; L269-Y318 HydrophobicContact CD1-CE1 3.75Å; L269-Y318 VanDerWaalsContact CD1-OH 3.28Å; L269-Y318 WeakPolarHBondContact CD1-OH 3.35Å; L269-Y318 HydrophobicContact CD2-CE1 4.39Å; N314-Y318 HydrophobicContact CB-CE2 4.02Å; N314-Y318 WeakPolarHBondContact O-CD2 3.43Å; N314-Y318 PolarHBondContact O-N 2.92Å; P315-Y318 PolarHBondContact O-N 3.04Å; I316-Y318 VanDerWaalsContact C-N 3.31Å; I316-Y318 PolarHBondContact O-N 3.12Å; Y318-V320 PolarHBondContact O-N 3.28Å; Y318-K321 PolarHBondContact O-N 3.29Å; Y318-H322 HydrophobicContact CD1-CB 4.29Å; Y318-H322 WeakPolarHBondContact O-CB 3.49Å; Y318-H322 PolarHBondContact O-N 3.13Å
319A91.3Very high93.6Very high26 Ų2632.8 Ų32.822%0.21517%0.168CC..Hα-helixtrans-62.3-24.1175.500000112.7P315 I316 R326 I329P315-A319 WeakPolarHBondContact O-CB 3.32Å; P315-A319 PolarHBondContact O-N 2.89Å; I316-A319 PolarHBondContact O-N 2.68Å; A319-R326 WeakPolarHBondContact O-CG 3.49Å; A319-R326 PolarHBondContact O-NH1 2.62Å; A319-R326 VanDerWaalsContact O-NH1 3.12Å; A319-I329 HydrophobicContact CB-CD1 4.02Å
320V90.9Very high93.2Very high80 Ų8034.7 Ų34.749%0.48518%0.176SC..Hα-helixtrans-93.5-36.8177.2177.40000112.9I316 V317 Y318 R326I316-V320 WeakPolarHBondContact O-CG2 3.41Å; I316-V320 PolarHBondContact O-N 3.3Å; V317-V320 PolarHBondContact O-N 3.12Å; Y318-V320 PolarHBondContact O-N 3.28Å; V320-R326 VanDerWaalsContact C-NH1 3.31Å; V320-R326 VanDerWaalsContact CA-NH1 3.35Å; V320-R326 WeakPolarHBondContact O-CD 3.38Å; V320-R326 PolarHBondContact O-NH1 3.37Å
321K90.1Very high92.8Very high103 Ų10341.9 Ų41.945%0.44821%0.207SC..Hα-helixtrans-121-18.3-166.4-62.8-159.5174.2-152.50115.9T265 I268 V317 Y318 P323T265-K321 HydrophobicContact CG2-CB 4.21Å; I268-K321 HydrophobicContact CD1-CD 3.62Å; I268-K321 VanDerWaalsContact CD1-CE 3.5Å; V317-K321 WeakPolarHBondContact O-CB 3.44Å; V317-K321 PolarHBondContact O-N 3.41Å; Y318-K321 PolarHBondContact O-N 3.29Å; K321-P323 WeakPolarHBondContact O-CD 3.45Å
322H89.2Confident92.4Very high33 Ų3346.4 Ų46.415%0.15322%0.223CC..  trans-91.1104.9-174.5-172.4-40.9000110.9Y318 K324 F325 R326Y318-H322 HydrophobicContact CD1-CB 4.29Å; Y318-H322 WeakPolarHBondContact O-CB 3.49Å; Y318-H322 PolarHBondContact O-N 3.13Å; H322-K324 PolarHBondContact O-N 3.19Å; H322-F325 HydrophobicContact CB-CB 3.81Å; H322-F325 PolarHBondContact ND1-N 3Å; H322-F325 WeakPolarHBondContact O-CB 3.47Å; H322-F325 PolarHBondContact O-N 3.05Å; H322-R326 WeakPolarHBondContact O-CG 3.39Å; H322-R326 PolarHBondContact O-N 2.83Å
323P88.2Confident92Very high57 Ų5748.4 Ų48.437%0.3723%0.231SC..Hα-helixtrans-62.2-48.8-166.1-24.636.4000113.4K321 F325 R326 M327 E346K321-P323 WeakPolarHBondContact O-CD 3.45Å; P323-F325 VanDerWaalsContact C-N 3.31Å; P323-F325 PolarHBondContact O-N 3.21Å; P323-R326 WeakPolarHBondContact O-CB 3.35Å; P323-R326 PolarHBondContact O-N 3.39Å; P323-M327 WeakPolarHBondContact O-CE 3.2Å; P323-M327 WeakPolarHBondContact O-CG 3.45Å; P323-M327 PolarHBondContact O-N 3.26Å; P323-E346 HydrophobicContact CB-CG 4.26Å
324K88.2Confident91.5Very high100 Ų10048.8 Ų48.844%0.43524%0.242SC..Hα-helixtrans-60.5-40.2178.7-64.2-176.6178.9177.40112.7L67 H322 M327 E328L67-K324 HydrophobicContact CD2-CB 3.67Å; H322-K324 PolarHBondContact O-N 3.19Å; K324-M327 HydrophobicContact CB-CE 4.45Å; K324-M327 HydrophobicContact CG-CE 4.27Å; K324-M327 PolarHBondContact O-N 3.49Å; K324-E328 PolarHBondContact O-N 3.08Å
325F90.6Very high91.1Very high11 Ų1155.5 Ų55.55%0.04827%0.271CS..Hα-helixtrans-65.3-46.1177.2-171.5-102.9000111.6V57 L60 L67 H322 P323 M327 E328 I329V57-F325 HydrophobicContact CB-CE2 4.34Å; V57-F325 HydrophobicContact CB-CZ 4.32Å; V57-F325 HydrophobicContact CG1-CE2 4.4Å; V57-F325 HydrophobicContact CG2-CE2 4.1Å; V57-F325 HydrophobicContact CG2-CZ 3.65Å; L60-F325 HydrophobicContact CB-CD2 4.46Å; L60-F325 HydrophobicContact CB-CE2 3.98Å; L60-F325 HydrophobicContact CD1-CD2 3.97Å; L60-F325 HydrophobicContact CD1-CE1 4.38Å; L60-F325 HydrophobicContact CD1-CE2 3.42Å; L60-F325 VanDerWaalsContact CD1-CE2 3.42Å; L60-F325 HydrophobicContact CD1-CZ 3.66Å; L60-F325 HydrophobicContact CG-CE2 4.3Å; L67-F325 HydrophobicContact CD1-CD2 4.26Å; H322-F325 HydrophobicContact CB-CB 3.81Å; H322-F325 PolarHBondContact ND1-N 3Å; H322-F325 WeakPolarHBondContact O-CB 3.47Å; H322-F325 PolarHBondContact O-N 3.05Å; P323-F325 VanDerWaalsContact C-N 3.31Å; P323-F325 PolarHBondContact O-N 3.21Å; F325-M327 VanDerWaalsContact C-N 3.31Å; F325-M327 PolarHBondContact O-N 2.99Å; F325-E328 PolarHBondContact O-N 3.28Å; F325-E328 VanDerWaalsContact O-N 3.17Å; F325-I329 HydrophobicContact CD1-CD1 3.53Å; F325-I329 HydrophobicContact CD1-CG1 4.32Å; F325-I329 HydrophobicContact CE1-CD1 3.24Å; F325-I329 HydrophobicContact CE1-CG1 4.14Å; F325-I329 HydrophobicContact CZ-CD1 4Å; F325-I329 PolarHBondContact O-N 3.45Å
326R91.6Very high90.7Very high19 Ų1959.1 Ų59.17%0.07229%0.289CS..Hα-helixtrans-55.7-43.8175.6-74.6173.561.492.917.8112.8A319 V320 H322 P323 E328 I329 E330 C340 P341 P342 E346A319-R326 WeakPolarHBondContact O-CG 3.49Å; A319-R326 PolarHBondContact O-NH1 2.62Å; A319-R326 VanDerWaalsContact O-NH1 3.12Å; V320-R326 VanDerWaalsContact C-NH1 3.31Å; V320-R326 VanDerWaalsContact CA-NH1 3.35Å; V320-R326 WeakPolarHBondContact O-CD 3.38Å; V320-R326 PolarHBondContact O-NH1 3.37Å; H322-R326 WeakPolarHBondContact O-CG 3.39Å; H322-R326 PolarHBondContact O-N 2.83Å; P323-R326 WeakPolarHBondContact O-CB 3.35Å; P323-R326 PolarHBondContact O-N 3.39Å; R326-E328 VanDerWaalsContact C-N 3.34Å; R326-I329 PolarHBondContact O-N 3.32Å; R326-E330 PolarHBondContact O-N 2.89Å; R326-C340 PolarHBondContact NH2-O 2.89Å; R326-P341 VanDerWaalsContact NH2-C 3.34Å; R326-P341 PolarHBondContact NH2-O 3.26Å; R326-P342 HydrophobicContact CB-CG 4.26Å; R326-E346 IonicContact NE-OE2 2.72Å
327M90.4Very high90.2Very high14 Ų1455.4 Ų55.47%0.06927%0.27CS..Hα-helixtrans-68.2-34.5-179.9-66.4179.3-63.200112.2P323 K324 F325 E330 K331 P342 E346 N350P323-M327 WeakPolarHBondContact O-CE 3.2Å; P323-M327 WeakPolarHBondContact O-CG 3.45Å; P323-M327 PolarHBondContact O-N 3.26Å; K324-M327 HydrophobicContact CB-CE 4.45Å; K324-M327 HydrophobicContact CG-CE 4.27Å; K324-M327 PolarHBondContact O-N 3.49Å; F325-M327 VanDerWaalsContact C-N 3.31Å; F325-M327 PolarHBondContact O-N 2.99Å; M327-E330 PolarHBondContact O-N 3.24Å; M327-K331 WeakPolarHBondContact O-CB 2.92Å; M327-K331 PolarHBondContact O-N 3.24Å; M327-K331 VanDerWaalsContact O-N 3.1Å; M327-P342 HydrophobicContact CG-CB 4.33Å; M327-E346 HydrophobicContact CG-CB 4.42Å; M327-E346 HydrophobicContact SD-CB 3.84Å; M327-N350 VanDerWaalsContact CB-ND2 3.31Å; M327-N350 WeakPolarHBondContact CB-ND2 3.4Å; M327-N350 HydrophobicContact CE-CB 4.11Å; M327-N350 WeakPolarHBondContact CE-ND2 3.34Å; M327-N350 WeakPolarHBondContact CE-OD1 3.4Å; M327-N350 HydrophobicContact SD-CB 3.52Å; M327-N350 VanDerWaalsContact SD-CB 3.52Å; M327-N350 PolarHBondContact SD-ND2 3.2Å
328E90.8Very high89.5Confident15 Ų1559.7 Ų59.77%0.0730%0.3CS..Hα-helixtrans-73.1-33.6174-69.2-60.5140.400112.6L60 C64 L67 K324 F325 R326 R332L60-E328 HydrophobicContact CD2-CB 4.19Å; C64-E328 HydrophobicContact CB-CG 4.07Å; C64-E328 VanDerWaalsContact SG-CD 3.6Å; C64-E328 PolarHBondContact SG-OE2 3.17Å; L67-E328 HydrophobicContact CD1-CG 4.27Å; K324-E328 PolarHBondContact O-N 3.08Å; F325-E328 PolarHBondContact O-N 3.28Å; F325-E328 VanDerWaalsContact O-N 3.17Å; R326-E328 VanDerWaalsContact C-N 3.34Å; E328-R332 WeakPolarHBondContact O-CB 3.44Å; E328-R332 WeakPolarHBondContact O-CG 3.35Å; E328-R332 PolarHBondContact O-N 3.05Å; E328-R332 VanDerWaalsContact O-N 3.12Å; E328-R332 IonicContact OE2-NE 3.36Å; E328-R332 PolarHBondContact OE2-NE 3.24Å; E328-R332 IonicContact OE2-NH2 3.19Å
329I91.7Very high88.8Confident1 Ų165.5 Ų65.51%0.00534%0.34CS..Hα-helixtrans-63.4-47.9169.3-66.4169.9000110.3L56 L60 A319 F325 R326 K331 R332 F333 L336 I337L56-I329 HydrophobicContact CD2-CD1 4.31Å; L60-I329 HydrophobicContact CD1-CD1 4.34Å; L60-I329 HydrophobicContact CD1-CG1 3.53Å; A319-I329 HydrophobicContact CB-CD1 4.02Å; F325-I329 HydrophobicContact CD1-CD1 3.53Å; F325-I329 HydrophobicContact CD1-CG1 4.32Å; F325-I329 HydrophobicContact CE1-CD1 3.24Å; F325-I329 HydrophobicContact CE1-CG1 4.14Å; F325-I329 HydrophobicContact CZ-CD1 4Å; F325-I329 PolarHBondContact O-N 3.45Å; R326-I329 PolarHBondContact O-N 3.32Å; I329-K331 PolarHBondContact O-N 3.36Å; I329-R332 PolarHBondContact O-N 3.49Å; I329-F333 HydrophobicContact CG2-CB 4.35Å; I329-F333 CarbonylContact O-C 3.12Å; I329-F333 WeakPolarHBondContact O-CA 3.46Å; I329-F333 PolarHBondContact O-N 2.95Å; I329-L336 HydrophobicContact CG2-CB 4.04Å; I329-I337 HydrophobicContact CB-CD1 4.46Å; I329-I337 HydrophobicContact CB-CG2 4.37Å; I329-I337 HydrophobicContact CG2-CB 4.4Å; I329-I337 HydrophobicContact CG2-CD1 4.16Å; I329-I337 HydrophobicContact CG2-CG1 4.07Å; I329-I337 HydrophobicContact CG2-CG2 3.56Å
330E90.7Very high88.4Confident51 Ų5167.9 Ų67.924%0.23835%0.354CS..Hα-helixtrans-54.3-44.5178.7-172.4174.1-148.500111.5R326 M327 P334 I337 P342 R347R326-E330 PolarHBondContact O-N 2.89Å; M327-E330 PolarHBondContact O-N 3.24Å; E330-P334 WeakPolarHBondContact O-CB 3.5Å; E330-I337 VanDerWaalsContact CA-CD1 3.43Å; E330-I337 HydrophobicContact CB-CD1 3.53Å; E330-I337 HydrophobicContact CG-CD1 4.14Å; E330-P342 HydrophobicContact CB-CG 3.88Å; E330-P342 HydrophobicContact CG-CG 4.26Å; E330-P342 WeakPolarHBondContact OE1-CD 3.49Å; E330-P342 WeakPolarHBondContact OE2-CD 3.37Å; E330-P342 WeakPolarHBondContact OE2-CG 3.34Å; E330-R347 IonicContact OE1-CZ 3.07Å; E330-R347 IonicContact OE1-NE 2.65Å; E330-R347 PolarHBondContact OE1-NE 3.26Å; E330-R347 IonicContact OE1-NH2 2.74Å; E330-R347 PolarHBondContact OE1-NH2 3.02Å; E330-R347 IonicContact OE2-NE 3.17Å; E330-R347 PolarHBondContact OE2-NE 2.76Å
331K89.4Confident88Confident155 Ų15567.3 Ų67.367%0.67435%0.352SS*.Hα-helixtrans-69-38.1-177.2-176.8179.5178-178.60113.4M327 I329M327-K331 WeakPolarHBondContact O-CB 2.92Å; M327-K331 PolarHBondContact O-N 3.24Å; M327-K331 VanDerWaalsContact O-N 3.1Å; I329-K331 PolarHBondContact O-N 3.36Å
332R90Very high87.6Confident96 Ų9662.6 Ų62.636%0.36233%0.332SS..Hα-helixtrans-107.4-33.3-167.6-64.7172.8-180-97.79113.6L63 C64 E328 I329L63-R332 PolarHBondContact O-NH2 3.19Å; C64-R332 PolarHBondContact SG-NE 3.12Å; C64-R332 PolarHBondContact SG-NH2 3Å; C64-R332 VanDerWaalsContact SG-NH2 3.35Å; E328-R332 WeakPolarHBondContact O-CB 3.44Å; E328-R332 WeakPolarHBondContact O-CG 3.35Å; E328-R332 PolarHBondContact O-N 3.05Å; E328-R332 VanDerWaalsContact O-N 3.12Å; E328-R332 IonicContact OE2-NE 3.36Å; E328-R332 PolarHBondContact OE2-NE 3.24Å; E328-R332 IonicContact OE2-NH2 3.19Å; I329-R332 PolarHBondContact O-N 3.49Å
333F90.4Very high87.3Confident60 Ų6068 Ų6826%0.26336%0.355SS..  trans-136.658.6-175.4-51.3-74.1000110.4L56 L60 I329 F335 L336L56-F333 HydrophobicContact CD1-CD2 3.65Å; L56-F333 HydrophobicContact CD1-CE2 3.58Å; L56-F333 HydrophobicContact CD1-CG 4.46Å; L56-F333 HydrophobicContact CD1-CZ 4.37Å; L60-F333 HydrophobicContact CD2-CD2 4.36Å; L60-F333 HydrophobicContact CD2-CE2 3.94Å; I329-F333 HydrophobicContact CG2-CB 4.35Å; I329-F333 CarbonylContact O-C 3.12Å; I329-F333 WeakPolarHBondContact O-CA 3.46Å; I329-F333 PolarHBondContact O-N 2.95Å; F333-F335 HydrophobicContact CB-CE1 3.99Å; F333-F335 HydrophobicContact CB-CZ 4.33Å; F333-F335 HydrophobicContact CD1-CE1 4.08Å; F333-F335 HydrophobicContact CD1-CZ 4.27Å; F333-F335 PolarHBondContact O-N 3.35Å; F333-F335 VanDerWaalsContact O-N 3.08Å; F333-L336 HydrophobicContact CB-CB 4.48Å; F333-L336 HydrophobicContact CB-CD1 3.67Å; F333-L336 HydrophobicContact CB-CG 4Å; F333-L336 HydrophobicContact CG-CD1 4.23Å; F333-L336 WeakPolarHBondContact O-CB 3.33Å; F333-L336 PolarHBondContact O-N 3.43Å
334P87.9Confident86.9Confident75 Ų7570.2 Ų70.249%0.48737%0.369SS..G310 helixtrans-57.3-30.5-173.321.4-33.2000113.4E330 L336 I337 C338E330-P334 WeakPolarHBondContact O-CB 3.5Å; P334-L336 PolarHBondContact O-N 3.32Å; P334-I337 PolarHBondContact O-N 3.26Å; P334-C338 PolarHBondContact O-N 3.16Å
335F89.4Confident86.3Confident145 Ų14574.1 Ų74.164%0.63639%0.386SS*.G310 helixtrans-61.4-26.7177.865.8-89.6000113.5F333 I337F333-F335 HydrophobicContact CB-CE1 3.99Å; F333-F335 HydrophobicContact CB-CZ 4.33Å; F333-F335 HydrophobicContact CD1-CE1 4.08Å; F333-F335 HydrophobicContact CD1-CZ 4.27Å; F333-F335 PolarHBondContact O-N 3.35Å; F333-F335 VanDerWaalsContact O-N 3.08Å; F335-I337 VanDerWaalsContact C-N 3.31Å; F335-I337 PolarHBondContact O-N 3.19Å
336L87.5Confident85.7Confident88 Ų8875.2 Ų75.246%0.46139%0.392SS..G310 helixtrans-73.7-20.5179.6-66.8-179.6000113.6L56 I329 F333 P334L56-L336 HydrophobicContact CD1-CD1 4.42Å; L56-L336 HydrophobicContact CD2-CD1 3.7Å; I329-L336 HydrophobicContact CG2-CB 4.04Å; F333-L336 HydrophobicContact CB-CB 4.48Å; F333-L336 HydrophobicContact CB-CD1 3.67Å; F333-L336 HydrophobicContact CB-CG 4Å; F333-L336 HydrophobicContact CG-CD1 4.23Å; F333-L336 WeakPolarHBondContact O-CB 3.33Å; F333-L336 PolarHBondContact O-N 3.43Å; P334-L336 PolarHBondContact O-N 3.32Å
337I85.5Confident85Confident14 Ų1479.7 Ų79.77%0.07241%0.408CS..G310 helixtrans-125.619.1-176.961.9168.7000113I329 E330 P334 F335 C339 C340 P342I329-I337 HydrophobicContact CB-CD1 4.46Å; I329-I337 HydrophobicContact CB-CG2 4.37Å; I329-I337 HydrophobicContact CG2-CB 4.4Å; I329-I337 HydrophobicContact CG2-CD1 4.16Å; I329-I337 HydrophobicContact CG2-CG1 4.07Å; I329-I337 HydrophobicContact CG2-CG2 3.56Å; E330-I337 VanDerWaalsContact CA-CD1 3.43Å; E330-I337 HydrophobicContact CB-CD1 3.53Å; E330-I337 HydrophobicContact CG-CD1 4.14Å; P334-I337 PolarHBondContact O-N 3.26Å; F335-I337 VanDerWaalsContact C-N 3.31Å; F335-I337 PolarHBondContact O-N 3.19Å; I337-C339 PolarHBondContact O-N 2.85Å; I337-C339 VanDerWaalsContact O-N 3.12Å; I337-C340 CarbonylContact O-C 3.27Å; I337-C340 VanDerWaalsContact O-C 3.27Å; I337-C340 PolarHBondContact O-N 3.46Å; I337-P342 HydrophobicContact CD1-CG 4.12Å
338C81.2Confident84.3Confident105 Ų10584.2 Ų84.271%0.70943%0.433SS*.THydrogen-bonded Turntrans-52-36.9179.7-174.40000112.3P334P334-C338 PolarHBondContact O-N 3.16Å
339C80.8Confident83.3Confident128 Ų12889 Ų8987%0.86546%0.455SS*.THydrogen-bonded Turntrans-75.8-19.6178.4-62.20000114.3I337I337-C339 PolarHBondContact O-N 2.85Å; I337-C339 VanDerWaalsContact O-N 3.12Å
340C81.5Confident82.3Confident75 Ų7590.5 Ų90.551%0.50746%0.463SS..SBendtrans-145.962.2-169-71.50000112.5R326 I337R326-C340 PolarHBondContact NH2-O 2.89Å; I337-C340 CarbonylContact O-C 3.27Å; I337-C340 VanDerWaalsContact O-C 3.27Å; I337-C340 PolarHBondContact O-N 3.46Å
341P82Confident81.4Confident69 Ų6991.2 Ų91.245%0.44847%0.471SS..PPolyproline II helixtrans-63.1156.5-176.326.4-34.9000113R326R326-P341 VanDerWaalsContact NH2-C 3.34Å; R326-P341 PolarHBondContact NH2-O 3.26Å
342P82.7Confident80.6Confident4 Ų487.3 Ų87.33%0.02646%0.457CS..PPolyproline II helixtrans-57147.6175.2-2639.2000112.7R326 M327 E330 I337 E346R326-P342 HydrophobicContact CB-CG 4.26Å; M327-P342 HydrophobicContact CG-CB 4.33Å; E330-P342 HydrophobicContact CB-CG 3.88Å; E330-P342 HydrophobicContact CG-CG 4.26Å; E330-P342 WeakPolarHBondContact OE1-CD 3.49Å; E330-P342 WeakPolarHBondContact OE2-CD 3.37Å; E330-P342 WeakPolarHBondContact OE2-CG 3.34Å; I337-P342 HydrophobicContact CD1-CG 4.12Å; P342-E346 WeakPolarHBondContact CA-OE2 3.49Å; P342-E346 HydrophobicContact CB-CB 4.47Å; P342-E346 WeakPolarHBondContact CB-OE2 3.3Å
343K82.6Confident79.6Confident145 Ų14585.1 Ų85.163%0.6345%0.454SS*.PPolyproline II helixtrans-68.7149.4-178.3-66.1176.6-179.7174.50110K345 E346 R347K343-K345 PolarHBondContact O-N 3.1Å; K343-K345 VanDerWaalsContact O-N 3.1Å; K343-E346 HydrophobicContact CB-CG 4.14Å; K343-E346 PolarHBondContact N-OE2 3.09Å; K343-E346 WeakPolarHBondContact O-CA 3.2Å; K343-E346 WeakPolarHBondContact O-CB 3.46Å; K343-E346 PolarHBondContact O-N 3.37Å; K343-R347 PolarHBondContact O-N 3.37Å
344P79.9Confident78.5Confident105 Ų10584.7 Ų84.768%0.68246%0.458SS*.Hα-helixtrans-53.5-36.2178.4-28.534.8000114.1E346 R347 L348P344-E346 VanDerWaalsContact C-N 3.33Å; P344-E346 PolarHBondContact O-N 3.36Å; P344-R347 PolarHBondContact O-N 3.23Å; P344-L348 PolarHBondContact O-N 2.99Å
345K76.3Confident77.7Confident181 Ų18188 Ų8879%0.78747%0.465SS*.Hα-helixtrans-63.6-36175.8-68.4-171.7178.1-1760113K343 Q349K343-K345 PolarHBondContact O-N 3.1Å; K343-K345 VanDerWaalsContact O-N 3.1Å; K345-Q349 WeakPolarHBondContact O-CB 3.44Å; K345-Q349 PolarHBondContact O-N 3.22Å; K345-Q349 VanDerWaalsContact O-N 3.09Å
346E76.7Confident76.7Confident34 Ų3485 Ų8516%0.15945%0.454CS..Hα-helixtrans-66.9-48.2176.9-61.7171.8160.700109.4P323 R326 M327 P342 K343 P344 L348 Q349 N350P323-E346 HydrophobicContact CB-CG 4.26Å; R326-E346 IonicContact NE-OE2 2.72Å; M327-E346 HydrophobicContact CG-CB 4.42Å; M327-E346 HydrophobicContact SD-CB 3.84Å; P342-E346 WeakPolarHBondContact CA-OE2 3.49Å; P342-E346 HydrophobicContact CB-CB 4.47Å; P342-E346 WeakPolarHBondContact CB-OE2 3.3Å; K343-E346 HydrophobicContact CB-CG 4.14Å; K343-E346 PolarHBondContact N-OE2 3.09Å; K343-E346 WeakPolarHBondContact O-CA 3.2Å; K343-E346 WeakPolarHBondContact O-CB 3.46Å; K343-E346 PolarHBondContact O-N 3.37Å; P344-E346 VanDerWaalsContact C-N 3.33Å; P344-E346 PolarHBondContact O-N 3.36Å; E346-L348 PolarHBondContact O-N 3.37Å; E346-Q349 PolarHBondContact O-N 3.07Å; E346-N350 PolarHBondContact O-N 3.41Å
347R77.6Confident75.4Confident113 Ų11384.9 Ų84.943%0.42645%0.452SS..Hα-helixtrans-56.8-47.2176-66-172.7-173.4158.55.3112.1E330 K343 P344 Q349 N350 T351E330-R347 IonicContact OE1-CZ 3.07Å; E330-R347 IonicContact OE1-NE 2.65Å; E330-R347 PolarHBondContact OE1-NE 3.26Å; E330-R347 IonicContact OE1-NH2 2.74Å; E330-R347 PolarHBondContact OE1-NH2 3.02Å; E330-R347 IonicContact OE2-NE 3.17Å; E330-R347 PolarHBondContact OE2-NE 2.76Å; K343-R347 PolarHBondContact O-N 3.37Å; P344-R347 PolarHBondContact O-N 3.23Å; R347-Q349 PolarHBondContact O-N 3.1Å; R347-N350 PolarHBondContact O-N 3.49Å; R347-T351 PolarHBondContact O-N 3.02Å; R347-T351 PolarHBondContact O-OG1 2.89Å
348L75.6Confident74.4Confident110 Ų11089 Ų8958%0.57648%0.477SS*.Hα-helixtrans-59.6-47.5178.8-178.763.3000111.7P344 E346 N350 T351 I352P344-L348 PolarHBondContact O-N 2.99Å; E346-L348 PolarHBondContact O-N 3.37Å; L348-N350 VanDerWaalsContact C-N 3.28Å; L348-N350 PolarHBondContact O-N 2.95Å; L348-T351 PolarHBondContact O-N 3.13Å; L348-I352 HydrophobicContact CD1-CD1 4.22Å; L348-I352 HydrophobicContact CD1-CG1 4.46Å; L348-I352 HydrophobicContact CG-CD1 3.99Å; L348-I352 WeakPolarHBondContact O-CG1 3.4Å; L348-I352 PolarHBondContact O-N 3.27Å
349Q70.7Confident73.3Confident114 Ų11486.9 Ų86.953%0.53346%0.464SS..Hα-helixtrans-58.6-42.6177.5-172.165.920.700111.3K345 E346 R347 I352 V353K345-Q349 WeakPolarHBondContact O-CB 3.44Å; K345-Q349 PolarHBondContact O-N 3.22Å; K345-Q349 VanDerWaalsContact O-N 3.09Å; E346-Q349 PolarHBondContact O-N 3.07Å; R347-Q349 PolarHBondContact O-N 3.1Å; Q349-I352 PolarHBondContact O-N 2.65Å; Q349-V353 VanDerWaalsContact O-CG2 3.3Å; Q349-V353 WeakPolarHBondContact O-CG2 3.31Å; Q349-V353 PolarHBondContact O-N 2.96Å
350N70.8Confident72Confident33 Ų3387 Ų8718%0.17645%0.452CS..Hα-helixtrans-67.1-38.6177.1-10822.8000113.4M327 E346 R347 L348 I352 V353 S354M327-N350 VanDerWaalsContact CB-ND2 3.31Å; M327-N350 WeakPolarHBondContact CB-ND2 3.4Å; M327-N350 HydrophobicContact CE-CB 4.11Å; M327-N350 WeakPolarHBondContact CE-ND2 3.34Å; M327-N350 WeakPolarHBondContact CE-OD1 3.4Å; M327-N350 HydrophobicContact SD-CB 3.52Å; M327-N350 VanDerWaalsContact SD-CB 3.52Å; M327-N350 PolarHBondContact SD-ND2 3.2Å; E346-N350 PolarHBondContact O-N 3.41Å; R347-N350 PolarHBondContact O-N 3.49Å; L348-N350 VanDerWaalsContact C-N 3.28Å; L348-N350 PolarHBondContact O-N 2.95Å; N350-I352 VanDerWaalsContact C-N 3.33Å; N350-V353 PolarHBondContact O-N 3.41Å; N350-S354 WeakPolarHBondContact O-CB 3.29Å; N350-S354 PolarHBondContact O-N 3.04Å; N350-S354 PolarHBondContact O-OG 2.99Å
351T71.7Confident70.5Confident66 Ų6689 Ų8941%0.40546%0.456SS..Hα-helixtrans-64.5-38174.8-55.80000111.7R347 L348 S354 K355R347-T351 PolarHBondContact O-N 3.02Å; R347-T351 PolarHBondContact O-OG1 2.89Å; L348-T351 PolarHBondContact O-N 3.13Å; T351-S354 WeakPolarHBondContact CA-OG 3.37Å; T351-S354 PolarHBondContact O-OG 3.21Å; T351-K355 HydrophobicContact CG2-CD 4.38Å; T351-K355 WeakPolarHBondContact O-CB 3.34Å; T351-K355 VanDerWaalsContact O-CG 3.29Å; T351-K355 WeakPolarHBondContact O-CG 3.49Å; T351-K355 PolarHBondContact O-N 2.9Å
352I72.4Confident68.6Low74 Ų7487.4 Ų87.438%0.37945%0.452SS..Hα-helixtrans-66.6-48.8176.1-66.9165.7000110.1L348 Q349 N350 S354 K355 I356L348-I352 HydrophobicContact CD1-CD1 4.22Å; L348-I352 HydrophobicContact CD1-CG1 4.46Å; L348-I352 HydrophobicContact CG-CD1 3.99Å; L348-I352 WeakPolarHBondContact O-CG1 3.4Å; L348-I352 PolarHBondContact O-N 3.27Å; Q349-I352 PolarHBondContact O-N 2.65Å; N350-I352 VanDerWaalsContact C-N 3.33Å; I352-S354 VanDerWaalsContact C-N 3.34Å; I352-S354 PolarHBondContact O-N 3.46Å; I352-K355 PolarHBondContact O-N 2.9Å; I352-I356 HydrophobicContact CG2-CD1 3.72Å; I352-I356 HydrophobicContact CG2-CG1 4.39Å; I352-I356 WeakPolarHBondContact O-CG1 3.32Å; I352-I356 PolarHBondContact O-N 3.23Å
353V67.7Low66.8Low50 Ų5093.8 Ų93.830%0.30349%0.485SS..Hα-helixtrans-60.5-42.8178.81720000111.3Q349 N350 I356 Q357Q349-V353 VanDerWaalsContact O-CG2 3.3Å; Q349-V353 WeakPolarHBondContact O-CG2 3.31Å; Q349-V353 PolarHBondContact O-N 2.96Å; N350-V353 PolarHBondContact O-N 3.41Å; V353-I356 PolarHBondContact O-N 2.96Å; V353-Q357 WeakPolarHBondContact O-CG 3.28Å; V353-Q357 PolarHBondContact O-N 3.34Å
354S67.6Low64.5Low51 Ų5189.8 Ų89.836%0.35749%0.485SS..Hα-helixtrans-65.5-40.2177.567.20000112.2N350 T351 I352 Q357 V358N350-S354 WeakPolarHBondContact O-CB 3.29Å; N350-S354 PolarHBondContact O-N 3.04Å; N350-S354 PolarHBondContact O-OG 2.99Å; T351-S354 WeakPolarHBondContact CA-OG 3.37Å; T351-S354 PolarHBondContact O-OG 3.21Å; I352-S354 VanDerWaalsContact C-N 3.34Å; I352-S354 PolarHBondContact O-N 3.46Å; S354-Q357 PolarHBondContact O-N 3.37Å; S354-V358 VanDerWaalsContact O-CG2 3.28Å; S354-V358 WeakPolarHBondContact O-CG2 3.4Å; S354-V358 PolarHBondContact O-N 2.84Å
355K71.3Confident62.3Low143 Ų14390 Ų9062%0.62249%0.485SS*.Hα-helixtrans-63.6-41.7174.2-77.1-179.6178.7-174.90112.4T351 I352 V358 S359T351-K355 HydrophobicContact CG2-CD 4.38Å; T351-K355 WeakPolarHBondContact O-CB 3.34Å; T351-K355 VanDerWaalsContact O-CG 3.29Å; T351-K355 WeakPolarHBondContact O-CG 3.49Å; T351-K355 PolarHBondContact O-N 2.9Å; I352-K355 PolarHBondContact O-N 2.9Å; K355-V358 PolarHBondContact O-N 2.89Å; K355-S359 PolarHBondContact O-N 3.3Å; K355-S359 PolarHBondContact O-OG 2.95Å
356I67.8Low60.3Low82 Ų8287.5 Ų87.542%0.42148%0.484SS..Hα-helixtrans-63.8-41.8176.3-67.3167.6000110.8I352 V353 S359 Q360I352-I356 HydrophobicContact CG2-CD1 3.72Å; I352-I356 HydrophobicContact CG2-CG1 4.39Å; I352-I356 WeakPolarHBondContact O-CG1 3.32Å; I352-I356 PolarHBondContact O-N 3.23Å; V353-I356 PolarHBondContact O-N 2.96Å; I356-S359 WeakPolarHBondContact CA-OG 3.2Å; I356-S359 PolarHBondContact O-N 3.36Å; I356-S359 PolarHBondContact O-OG 2.99Å; I356-Q360 HydrophobicContact CG2-CG 4.48Å; I356-Q360 WeakPolarHBondContact O-CB 3.4Å; I356-Q360 WeakPolarHBondContact O-CG 3.36Å; I356-Q360 PolarHBondContact O-N 2.89Å
357Q61.1Low58Low86 Ų8691.7 Ų91.740%0.40252%0.517SS..Hα-helixtrans-63-41.8175.2-73.5-174.6-49.700111.5Q66 V353 S354 Q360 I361Q66-Q357 VanDerWaalsContact NE2-OE1 3.11Å; V353-Q357 WeakPolarHBondContact O-CG 3.28Å; V353-Q357 PolarHBondContact O-N 3.34Å; S354-Q357 PolarHBondContact O-N 3.37Å; Q357-Q360 PolarHBondContact O-N 3.3Å; Q357-I361 WeakPolarHBondContact O-CD1 3.45Å; Q357-I361 WeakPolarHBondContact O-CG1 3.37Å; Q357-I361 PolarHBondContact O-N 3.43Å
358V63.6Low55.6Low100 Ų10090.1 Ų90.161%0.60654%0.536SS*.Hα-helixtrans-65.5-40.4175.4173.60000111.5S354 K355 I361 G362S354-V358 VanDerWaalsContact O-CG2 3.28Å; S354-V358 WeakPolarHBondContact O-CG2 3.4Å; S354-V358 PolarHBondContact O-N 2.84Å; K355-V358 PolarHBondContact O-N 2.89Å; V358-I361 PolarHBondContact O-N 3.15Å; V358-G362 PolarHBondContact O-N 3.48Å
359S59.2Low53.3Low61 Ų6188.3 Ų88.343%0.42754%0.544SS..Hα-helixtrans-68.3-36.3176.961.90000112.4K355 I356 I361 G362 I363K355-S359 PolarHBondContact O-N 3.3Å; K355-S359 PolarHBondContact O-OG 2.95Å; I356-S359 WeakPolarHBondContact CA-OG 3.2Å; I356-S359 PolarHBondContact O-N 3.36Å; I356-S359 PolarHBondContact O-OG 2.99Å; S359-I361 VanDerWaalsContact C-N 3.34Å; S359-G362 PolarHBondContact O-N 3.26Å; S359-I363 VanDerWaalsContact O-CG1 3.29Å; S359-I363 WeakPolarHBondContact O-CG1 3.29Å; S359-I363 PolarHBondContact O-N 3.28Å
360Q52.9Low51.3Low132 Ų13290.3 Ų90.362%0.61756%0.558SS**Hα-helixtrans-67.4-34.8173.2-75-177.4-17.400112.1I356 Q357 G364I356-Q360 HydrophobicContact CG2-CG 4.48Å; I356-Q360 WeakPolarHBondContact O-CB 3.4Å; I356-Q360 WeakPolarHBondContact O-CG 3.36Å; I356-Q360 PolarHBondContact O-N 2.89Å; Q357-Q360 PolarHBondContact O-N 3.3Å; Q360-G364 PolarHBondContact O-N 2.87Å; Q360-G364 VanDerWaalsContact O-N 3.15Å
361I51.1Low49.2Very low116 Ų11697 Ų9760%0.59559%0.588SS**Hα-helixtrans-66.6-40.3171.2-66.8162.4000110.5Q357 V358 S359 I363 G364 T365Q357-I361 WeakPolarHBondContact O-CD1 3.45Å; Q357-I361 WeakPolarHBondContact O-CG1 3.37Å; Q357-I361 PolarHBondContact O-N 3.43Å; V358-I361 PolarHBondContact O-N 3.15Å; S359-I361 VanDerWaalsContact C-N 3.34Å; I361-I363 PolarHBondContact O-N 3.13Å; I361-G364 PolarHBondContact O-N 2.95Å; I361-G364 VanDerWaalsContact O-N 3.13Å; I361-T365 PolarHBondContact O-N 3.21Å; I361-T365 PolarHBondContact O-OG1 3.3Å
362G41.5Very low47.1Very low36 Ų36100.6 Ų100.637%0.37161%0.605SS.*Hα-helixtrans-67.5-29.6177.400000114.5V358 S359V358-G362 PolarHBondContact O-N 3.48Å; S359-G362 PolarHBondContact O-N 3.26Å
363I43.9Very low45Very low137 Ų137103.4 Ų103.470%0.70363%0.626SS**Hα-helixtrans-75.2-29.7171.3-64.7163.9000110.6S359 I361S359-I363 VanDerWaalsContact O-CG1 3.29Å; S359-I363 WeakPolarHBondContact O-CG1 3.29Å; S359-I363 PolarHBondContact O-N 3.28Å; I361-I363 PolarHBondContact O-N 3.13Å
364G35.4Very low43.2Very low62 Ų62108.8 Ų108.864%0.63965%0.652SS**Hα-helixtrans-77.2-13.9179.700000115.9Q360 I361Q360-G364 PolarHBondContact O-N 2.87Å; Q360-G364 VanDerWaalsContact O-N 3.15Å; I361-G364 PolarHBondContact O-N 2.95Å; I361-G364 VanDerWaalsContact O-N 3.13Å
365T33.8Very low41.3Very low110 Ų110113.1 Ų113.168%0.67567%0.671SS**THydrogen-bonded Turntrans-106.64.5-179.142.50000115.1I361 S367I361-T365 PolarHBondContact O-N 3.21Å; I361-T365 PolarHBondContact O-OG1 3.3Å; T365-S367 PolarHBondContact O-N 3.39Å
366V32.8Very low39.3Very low127 Ų127112 Ų11277%0.7768%0.677SS**  trans-97.869.7168.9-169.50000109.5
367S30.3Very low37.8Very low123 Ų123115.2 Ų115.286%0.8670%0.7SS**  trans-138.367.7161.5-179.90000108.1T365T365-S367 PolarHBondContact O-N 3.39Å
368G27.1Very low36.4Very low79 Ų79119.7 Ų119.781%0.81472%0.718SS**  trans-172.888.9177.400000109
369G27.2Very low34.5Very low72 Ų72126.1 Ų126.174%0.74273%0.731SS**  trans165.168.5-179.300000113.4
370N27.5Very low33.2Very low157 Ų157131.8 Ų131.884%0.8475%0.751SS**  trans27.7113.2149.5-67.4-4.8000119.3
371E26.3Very low32.3Very low172 Ų172136.9 Ų136.980%0.80478%0.782SS**  -3.5145.3128.8-68.3175.4152.700117.6
372N27.5Very low31.4Very low143 Ų143138 Ų13877%0.76579%0.792SS**  trans8889.7165.3-55-32000115.7
373T29.3Very low30.8Very low133 Ų133143.3 Ų143.382%0.81681%0.814SS**  -170.2140.9108.511.70000113.9
374L29.5Very low30.1Very low163 Ų163143.7 Ų143.785%0.85382%0.82SS**  trans86.978.1150.8-72.2149.2000118.6
375N28.5Very low29.8Very low142 Ų142148.5 Ų148.576%0.75983%0.831SS**  trans-39.9151.8140.8-79.1-35.6000114.7
376T28.8Very low29.5Very low119 Ų119150.9 Ų150.973%0.7384%0.841SS**  trans69.7100.8145.741.10000119.7
377V35.7Very low29.3Very low149 Ų149152.5 Ų152.590%0.90385%0.845SS**  -133.998.7129.2-177.50000108.1
378K32Very low29.2Very low180 Ų180154.6 Ų154.678%0.78384%0.844SS**  trans-68.6128.9157.9-75.4176.8168.6-177.60106.7
379R24Very low29.4Very low235 Ų235160.4 Ų160.489%0.88785%0.847SS**  36.4103.689.1-110.9-169.9-170.8172.93.1113.6
380E31.2Very low29.6Very low181 Ų181167.8 Ų167.885%0.84686%0.855SS**  trans-167.4126.8134.6-103159.1-158.700108.4
381D34.7Very low29.8Very low239 Ų239168.7 Ų168.7100%1.27886%0.857SS**  trans53.50162.8-53.4-20000122

Retrieved 381 of 381 residues in 868.5 ms (Link to these results)

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