A0A096NUX8_PAPAN Loading...

COMM domain containing 7

AlphaFold DB (A0A096NUX9), UniProt , Accession A0A096NUX8, Species PAPAN (Papio anubis, Olive baboon), Gene COMMD7, Length 200 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
1M50.6Low76.8Confident240 Ų24093.8 Ų93.8100%1.18249%0.493SS*.  0137.30-70.7-171.6-175.300107.9
2G60.3Low77.5Confident50 Ų5092.3 Ų92.352%0.51549%0.493SS..PPolyproline II helixtrans-62.8146.2176.700000110.8T98G2-T98 WeakPolarHBondContact O-CG2 3.39Å
3R77Confident78Confident185 Ų185100.1 Ų100.170%0.69853%0.525SS*.PPolyproline II helixtrans-70.9130.4175.1-152.3174.9-172.4-152.9-8.2108.1E8R3-E8 IonicContact CZ-OE1 3.89Å; R3-E8 IonicContact NH1-OE1 3.93Å; R3-E8 VanDerWaalsContact NH2-CD 3.34Å; R3-E8 IonicContact NH2-OE1 3.51Å; R3-E8 PolarHBondContact NH2-OE1 3.42Å; R3-E8 IonicContact NH2-OE2 2.77Å
4L87.3Confident78.5Confident15 Ų1596.8 Ų96.88%0.07952%0.519CS..PPolyproline II helixtrans-78.3145.8177-62.5179.2000110.4T7 V11 L77 D95 T98 L99L4-T7 HydrophobicContact CB-CG2 4.35Å; L4-T7 HydrophobicContact CD1-CG2 3.98Å; L4-V11 HydrophobicContact CD1-CG2 3.34Å; L4-V11 HydrophobicContact CG-CG2 4.26Å; L4-L77 HydrophobicContact CD1-CD2 4.21Å; L4-D95 HydrophobicContact CD2-CB 4.08Å; L4-T98 HydrophobicContact CD2-CG2 3.81Å; L4-L99 HydrophobicContact CD1-CD1 4.42Å; L4-L99 HydrophobicContact CD1-CD2 3.83Å; L4-L99 HydrophobicContact CD1-CG 4.25Å; L4-L99 HydrophobicContact CD2-CD2 4.2Å; L4-L99 HydrophobicContact CD2-CG 4.03Å
5H85.6Confident79.3Confident83 Ų8390.5 Ų90.538%0.38449%0.485SS..SBendtrans-73.3-39.4172.7-57.283.6000110.1T7 K85 L87 Q91 D95H5-T7 PolarHBondContact O-N 3.43Å; H5-K85 WeakPolarHBondContact O-CD 3.38Å; H5-K85 PolarHBondContact O-NZ 2.78Å; H5-L87 HydrophobicContact CB-CD1 3.86Å; H5-L87 HydrophobicContact CB-CD2 3.98Å; H5-Q91 HydrophobicContact CB-CB 4.36Å; H5-D95 IonicContact CE1-OD1 3.94Å; H5-D95 IonicContact CG-OD1 3.57Å; H5-D95 PolarHBondContact N-OD1 2.87Å; H5-D95 PolarHBondContact N-OD2 3.3Å; H5-D95 IonicContact ND1-OD1 3.49Å; H5-D95 PolarHBondContact ND1-OD1 3.33Å
6C84.3Confident79.8Confident5 Ų587 Ų873%0.03448%0.478CS..SBendtrans-67.7-28.3-176.162.70000114.3K85 L87 D95C6-K85 WeakPolarHBondContact O-CE 3.19Å; C6-L87 HydrophobicContact CB-CD1 3.83Å; C6-D95 VanDerWaalsContact CB-OD2 3.24Å; C6-D95 WeakPolarHBondContact CB-OD2 3.49Å; C6-D95 PolarHBondContact N-OD2 2.81Å; C6-D95 PolarHBondContact SG-OD2 3.37Å
7T82.4Confident80.5Confident28 Ų2884.4 Ų84.417%0.17248%0.475CS..  trans-148.7144.5179-1700000112.3L4 H5 D9L4-T7 HydrophobicContact CB-CG2 4.35Å; L4-T7 HydrophobicContact CD1-CG2 3.98Å; H5-T7 PolarHBondContact O-N 3.43Å; T7-D9 WeakPolarHBondContact OG1-CB 3.42Å; T7-D9 PolarHBondContact OG1-N 3.18Å
8E76.3Confident81.2Confident135 Ų13580.3 Ų80.363%0.63145%0.452SS*.SBendtrans-93.6-10.7167.8-58.1-161.9129.200112R3R3-E8 IonicContact CZ-OE1 3.89Å; R3-E8 IonicContact NH1-OE1 3.93Å; R3-E8 VanDerWaalsContact NH2-CD 3.34Å; R3-E8 IonicContact NH2-OE1 3.51Å; R3-E8 PolarHBondContact NH2-OE1 3.42Å; R3-E8 IonicContact NH2-OE2 2.77Å
9D78.6Confident81.9Confident118 Ų11876.1 Ų76.163%0.63143%0.428SS*.SBendtrans-73.3153.6179.1-64.1-43.1000111.6T7 V11T7-D9 WeakPolarHBondContact OG1-CB 3.42Å; T7-D9 PolarHBondContact OG1-N 3.18Å; D9-V11 PolarHBondContact O-N 3.48Å
10P78Confident82.4Confident123 Ų12377.5 Ų77.580%0.79943%0.431SS*.PPolyproline II helixtrans-59.3131.1172.524.1-32.8000111
11V84.5Confident82.8Confident50 Ų5077.2 Ų77.230%0.30343%0.427SS..PPolyproline II helixtrans-74.2134.1177.5-176.20000109.2L4 D9 V15 L99L4-V11 HydrophobicContact CD1-CG2 3.34Å; L4-V11 HydrophobicContact CG-CG2 4.26Å; D9-V11 PolarHBondContact O-N 3.48Å; V11-V15 HydrophobicContact CG1-CB 3.68Å; V11-V15 HydrophobicContact CG1-CG1 3.94Å; V11-V15 HydrophobicContact CG1-CG2 3.68Å; V11-L99 HydrophobicContact CG1-CD2 3.77Å; V11-L99 HydrophobicContact CG2-CD2 4.27Å
12P85.5Confident84.8Confident75 Ų7565.8 Ų65.849%0.48737%0.37SS..PPolyproline II helixtrans-58139.2175.1-21.931.2000112.1A14 V15P12-A14 PolarHBondContact O-N 3.06Å; P12-A14 VanDerWaalsContact O-N 3.14Å; P12-V15 HydrophobicContact CB-CG2 4.12Å; P12-V15 HydrophobicContact CG-CG2 4.27Å; P12-V15 WeakPolarHBondContact O-CB 3.48Å; P12-V15 WeakPolarHBondContact O-CG2 3.41Å; P12-V15 PolarHBondContact O-N 3.27Å
13E83.3Confident86.4Confident194 Ų19465.5 Ų65.591%0.90736%0.357SS*.THydrogen-bonded Turntrans-58.7-31-177-66.6-176.2165.900113.3V15E13-V15 PolarHBondContact O-N 2.95Å
14A85.8Confident87.2Confident54 Ų5464.4 Ų64.445%0.44636%0.36SS..Hα-helixtrans-61-26.9177.600000113.2P12 G16 G17 D18P12-A14 PolarHBondContact O-N 3.06Å; P12-A14 VanDerWaalsContact O-N 3.14Å; A14-G16 VanDerWaalsContact C-N 3.35Å; A14-G16 PolarHBondContact O-N 2.96Å; A14-G17 PolarHBondContact O-N 3.42Å; A14-D18 WeakPolarHBondContact O-CB 3.14Å; A14-D18 VanDerWaalsContact O-CG 3.27Å; A14-D18 PolarHBondContact O-N 3.35Å
15V89.6Confident87.4Confident2 Ų264.5 Ų64.51%0.01236%0.36CS..Hα-helixtrans-61.2-43.7-175.2178.50000111.1V11 P12 E13 G17 D18 M19 L99V11-V15 HydrophobicContact CG1-CB 3.68Å; V11-V15 HydrophobicContact CG1-CG1 3.94Å; V11-V15 HydrophobicContact CG1-CG2 3.68Å; P12-V15 HydrophobicContact CB-CG2 4.12Å; P12-V15 HydrophobicContact CG-CG2 4.27Å; P12-V15 WeakPolarHBondContact O-CB 3.48Å; P12-V15 WeakPolarHBondContact O-CG2 3.41Å; P12-V15 PolarHBondContact O-N 3.27Å; E13-V15 PolarHBondContact O-N 2.95Å; V15-G17 PolarHBondContact O-N 3.09Å; V15-D18 PolarHBondContact O-N 2.86Å; V15-M19 HydrophobicContact CG1-CE 3.91Å; V15-M19 HydrophobicContact CG1-CG 4.37Å; V15-M19 VanDerWaalsContact O-CG 3.28Å; V15-M19 WeakPolarHBondContact O-CG 3.48Å; V15-M19 PolarHBondContact O-N 2.79Å; V15-L99 HydrophobicContact CG1-CB 4.45Å; V15-L99 HydrophobicContact CG1-CD1 4.14Å; V15-L99 HydrophobicContact CG1-CD2 3.74Å; V15-L99 HydrophobicContact CG1-CG 4.34Å
16G88.4Confident87.7Confident35 Ų3562.3 Ų62.336%0.36136%0.36SS..Hα-helixtrans-62.7-42.9179.300000112.4A14 M19 Q20A14-G16 VanDerWaalsContact C-N 3.35Å; A14-G16 PolarHBondContact O-N 2.96Å; G16-M19 PolarHBondContact O-N 3.45Å; G16-Q20 WeakPolarHBondContact O-CG 3.23Å; G16-Q20 PolarHBondContact O-N 3.01Å
17G91.4Very high88.1Confident42 Ų4265.2 Ų65.243%0.43338%0.384SS..Hα-helixtrans-63.9-42.417600000112.5A14 V15 M19 Q20 Q21A14-G17 PolarHBondContact O-N 3.42Å; V15-G17 PolarHBondContact O-N 3.09Å; G17-M19 PolarHBondContact O-N 2.93Å; G17-Q20 PolarHBondContact O-N 3.12Å; G17-Q21 PolarHBondContact O-N 3.09Å
18D93.1Very high88.6Confident11 Ų1171.8 Ų71.86%0.05941%0.413CS..Hα-helixtrans-64.5-38.5177.6-72.3-18.3000112.1A14 V15 Q20 Q21 L22 S70 I71 S74A14-D18 WeakPolarHBondContact O-CB 3.14Å; A14-D18 VanDerWaalsContact O-CG 3.27Å; A14-D18 PolarHBondContact O-N 3.35Å; V15-D18 PolarHBondContact O-N 2.86Å; D18-Q20 VanDerWaalsContact C-N 3.32Å; D18-Q20 PolarHBondContact O-N 3.14Å; D18-Q21 PolarHBondContact O-N 3.23Å; D18-L22 WeakPolarHBondContact O-CG 3.3Å; D18-L22 PolarHBondContact O-N 3.5Å; D18-S70 PolarHBondContact OD1-OG 3.02Å; D18-S70 WeakPolarHBondContact OD2-CB 3.43Å; D18-S70 PolarHBondContact OD2-OG 2.89Å; D18-I71 HydrophobicContact CB-CG1 4.12Å; D18-S74 WeakPolarHBondContact OD2-CB 3.3Å; D18-S74 PolarHBondContact OD2-OG 3.15Å
19M93.7Very high89.4Confident0 Ų068.3 Ų68.30%040%0.397CS..Hα-helixtrans-65.1-36.1174.6-66.2-57.2162.900112.1V15 G16 G17 L22 N23 F96 L99 L101V15-M19 HydrophobicContact CG1-CE 3.91Å; V15-M19 HydrophobicContact CG1-CG 4.37Å; V15-M19 VanDerWaalsContact O-CG 3.28Å; V15-M19 WeakPolarHBondContact O-CG 3.48Å; V15-M19 PolarHBondContact O-N 2.79Å; G16-M19 PolarHBondContact O-N 3.45Å; G17-M19 PolarHBondContact O-N 2.93Å; M19-L22 WeakPolarHBondContact O-CB 3.48Å; M19-L22 PolarHBondContact O-N 3.2Å; M19-L22 HydrophobicContact SD-CD1 3.7Å; M19-N23 VanDerWaalsContact O-CG 3.25Å; M19-N23 PolarHBondContact O-N 3.47Å; M19-N23 PolarHBondContact O-ND2 3.09Å; M19-F96 HydrophobicContact CE-CD1 4.13Å; M19-F96 HydrophobicContact CE-CE1 4.01Å; M19-F96 HydrophobicContact SD-CD1 4.28Å; M19-L99 WeakPolarHBondContact CB-O 3.32Å; M19-L99 HydrophobicContact CE-CB 4.39Å; M19-L99 HydrophobicContact CE-CD1 4.12Å; M19-L99 HydrophobicContact CG-CB 3.99Å; M19-L99 WeakPolarHBondContact CG-O 3.35Å; M19-L101 HydrophobicContact SD-CB 4.22Å; M19-L101 HydrophobicContact SD-CD1 4.23Å
20Q91.9Very high90.2Very high104 Ų10462.9 Ų62.949%0.48637%0.367SS..Hα-helixtrans-66.8-37.9173-66-54.8-37.200112.3G16 G17 D18 N23 Q24 G100G16-Q20 WeakPolarHBondContact O-CG 3.23Å; G16-Q20 PolarHBondContact O-N 3.01Å; G17-Q20 PolarHBondContact O-N 3.12Å; D18-Q20 VanDerWaalsContact C-N 3.32Å; D18-Q20 PolarHBondContact O-N 3.14Å; Q20-N23 WeakPolarHBondContact O-CB 3.41Å; Q20-N23 PolarHBondContact O-N 3.46Å; Q20-Q24 PolarHBondContact O-N 2.96Å; Q20-G100 PolarHBondContact NE2-O 2.99Å
21Q91.8Very high90.9Very high73 Ų7358.4 Ų58.434%0.34134%0.339SS..Hα-helixtrans-65.8-39.7172.9-69-175.1-11.800111.9G17 D18 N23 Q24 S67 I71G17-Q21 PolarHBondContact O-N 3.09Å; D18-Q21 PolarHBondContact O-N 3.23Å; Q21-N23 PolarHBondContact O-N 2.92Å; Q21-Q24 WeakPolarHBondContact O-CB 3.37Å; Q21-Q24 PolarHBondContact O-N 2.88Å; Q21-S67 PolarHBondContact OE1-OG 2.98Å; Q21-I71 HydrophobicContact CB-CD1 4Å; Q21-I71 HydrophobicContact CB-CG1 4.48Å
22L92.6Very high91.4Very high0 Ų057.8 Ų57.80%034%0.34CS..Hα-helixtrans-59.9-36.4173.2-80.2164.9000112.3D18 M19 Q24 L25 F30 L33 I71 L75 L101 K105D18-L22 WeakPolarHBondContact O-CG 3.3Å; D18-L22 PolarHBondContact O-N 3.5Å; M19-L22 WeakPolarHBondContact O-CB 3.48Å; M19-L22 PolarHBondContact O-N 3.2Å; M19-L22 HydrophobicContact SD-CD1 3.7Å; L22-Q24 PolarHBondContact O-N 2.73Å; L22-L25 HydrophobicContact CD2-CD1 3.84Å; L22-L25 WeakPolarHBondContact O-CB 3.28Å; L22-L25 PolarHBondContact O-N 2.81Å; L22-L25 VanDerWaalsContact O-N 3.14Å; L22-F30 HydrophobicContact CD2-CD2 4.22Å; L22-F30 HydrophobicContact CD2-CE2 4.29Å; L22-L33 HydrophobicContact CD2-CD2 3.82Å; L22-I71 HydrophobicContact CD1-CG2 3.88Å; L22-I71 HydrophobicContact CD2-CG2 3.42Å; L22-I71 VanDerWaalsContact CD2-CG2 3.42Å; L22-I71 HydrophobicContact CG-CG2 3.56Å; L22-L75 HydrophobicContact CD1-CD1 3.94Å; L22-L75 HydrophobicContact CD1-CD2 3.67Å; L22-L75 HydrophobicContact CD1-CG 3.62Å; L22-L75 HydrophobicContact CD2-CD1 3.9Å; L22-L101 HydrophobicContact CB-CD1 3.89Å; L22-L101 HydrophobicContact CD1-CD1 4.35Å; L22-K105 PolarHBondContact O-NZ 2.79Å
23N94.2Very high91.8Very high44 Ų4454.3 Ų54.324%0.23532%0.317CS..Hα-helixtrans-62.5-25.9176-70.7-25.5000112.8M19 Q20 Q21 L25 G100 S102 K105M19-N23 VanDerWaalsContact O-CG 3.25Å; M19-N23 PolarHBondContact O-N 3.47Å; M19-N23 PolarHBondContact O-ND2 3.09Å; Q20-N23 WeakPolarHBondContact O-CB 3.41Å; Q20-N23 PolarHBondContact O-N 3.46Å; Q21-N23 PolarHBondContact O-N 2.92Å; N23-L25 VanDerWaalsContact C-N 3.34Å; N23-G100 PolarHBondContact ND2-O 3.41Å; N23-S102 PolarHBondContact OD1-N 3.39Å; N23-K105 VanDerWaalsContact CA-NZ 3.29Å; N23-K105 PolarHBondContact O-NZ 3.18Å
24Q92.9Very high92.3Very high161 Ų16145.1 Ų45.175%0.75227%0.274SS*.Hα-helixtrans-76.6-18.5176.9-59.817518.900113.7Q20 Q21 L22Q20-Q24 PolarHBondContact O-N 2.96Å; Q21-Q24 WeakPolarHBondContact O-CB 3.37Å; Q21-Q24 PolarHBondContact O-N 2.88Å; L22-Q24 PolarHBondContact O-N 2.73Å
25L91.8Very high92.6Very high18 Ų1847.3 Ų47.39%0.09428%0.275CS..SBendtrans-66.8139.4175.8-59.5-175.9000110.9L22 N23 Q29 L33 I63 K105L22-L25 HydrophobicContact CD2-CD1 3.84Å; L22-L25 WeakPolarHBondContact O-CB 3.28Å; L22-L25 PolarHBondContact O-N 2.81Å; L22-L25 VanDerWaalsContact O-N 3.14Å; N23-L25 VanDerWaalsContact C-N 3.34Å; L25-Q29 HydrophobicContact CB-CB 4.07Å; L25-L33 HydrophobicContact CD1-CD2 4.13Å; L25-I63 HydrophobicContact CD2-CD1 3.63Å; L25-K105 WeakPolarHBondContact O-CE 3.36Å; L25-K105 PolarHBondContact O-NZ 3.31Å
26G92.6Very high92.8Very high36 Ų3648.4 Ų48.437%0.37128%0.281SS..  trans-62.7160.3168.600000111.7Q28 Q29 F30G26-Q28 VanDerWaalsContact C-N 3.27Å; G26-Q28 PolarHBondContact O-N 3.02Å; G26-Q29 PolarHBondContact O-N 3.1Å; G26-F30 PolarHBondContact O-N 3.47Å
27A91.8Very high92.9Very high66 Ų6646.8 Ų46.855%0.54527%0.265SS..Hα-helixtrans-54.4-42.2-179.700000112.8F30 S31A27-F30 PolarHBondContact O-N 3.09Å; A27-S31 WeakPolarHBondContact O-CB 3.47Å; A27-S31 PolarHBondContact O-N 3.38Å; A27-S31 PolarHBondContact O-OG 2.87Å
28Q92.8Very high92.9Very high166 Ų16645.2 Ų45.278%0.77625%0.246SC*.Hα-helixtrans-67-36.1177.8-69.3-174.7-14.900113.4G26 S31 A32G26-Q28 VanDerWaalsContact C-N 3.27Å; G26-Q28 PolarHBondContact O-N 3.02Å; Q28-S31 VanDerWaalsContact CA-OG 3.32Å; Q28-S31 WeakPolarHBondContact CA-OG 3.43Å; Q28-S31 PolarHBondContact O-OG 3.32Å; Q28-A32 WeakPolarHBondContact O-CB 3.36Å; Q28-A32 PolarHBondContact O-N 2.61Å
29Q93.1Very high92.7Very high63 Ų6347.3 Ų47.329%0.29426%0.255SS..Hα-helixtrans-69.8-42.3177.6-65173.8-36.700110.2L25 G26 A32 L33 F57 N61L25-Q29 HydrophobicContact CB-CB 4.07Å; G26-Q29 PolarHBondContact O-N 3.1Å; Q29-A32 PolarHBondContact O-N 3.36Å; Q29-L33 WeakPolarHBondContact O-CB 3.43Å; Q29-L33 PolarHBondContact O-N 2.9Å; Q29-F57 HydrophobicContact CB-CZ 4.2Å; Q29-F57 WeakPolarHBondContact O-CE2 3.42Å; Q29-F57 WeakPolarHBondContact O-CZ 3.41Å; Q29-N61 VanDerWaalsContact CD-OD1 3.3Å; Q29-N61 VanDerWaalsContact CG-OD1 3.3Å; Q29-N61 WeakPolarHBondContact CG-OD1 3.33Å; Q29-N61 PolarHBondContact NE2-OD1 3.23Å
30F95.1Very high92.5Very high3 Ų349.3 Ų49.31%0.01326%0.264CS..Hα-helixtrans-65-42.5176.1-177-100.2000111.9L22 G26 A27 L33 T34 L101 K105 Y108 F109L22-F30 HydrophobicContact CD2-CD2 4.22Å; L22-F30 HydrophobicContact CD2-CE2 4.29Å; G26-F30 PolarHBondContact O-N 3.47Å; A27-F30 PolarHBondContact O-N 3.09Å; F30-L33 PolarHBondContact O-N 2.91Å; F30-T34 WeakPolarHBondContact O-CB 3.45Å; F30-T34 PolarHBondContact O-N 3.34Å; F30-T34 PolarHBondContact O-OG1 3.48Å; F30-L101 HydrophobicContact CE2-CD1 4.25Å; F30-L101 HydrophobicContact CE2-CD2 4.44Å; F30-L101 HydrophobicContact CZ-CD2 4.12Å; F30-K105 HydrophobicContact CB-CD 4.41Å; F30-K105 HydrophobicContact CD1-CB 4.02Å; F30-K105 HydrophobicContact CD1-CD 4.3Å; F30-K105 HydrophobicContact CD1-CG 3.76Å; F30-K105 HydrophobicContact CD2-CB 4.48Å; F30-K105 HydrophobicContact CD2-CD 3.89Å; F30-K105 HydrophobicContact CD2-CG 4.22Å; F30-K105 HydrophobicContact CE1-CB 3.63Å; F30-K105 HydrophobicContact CE1-CG 3.92Å; F30-K105 WeakPolarHBondContact CE1-O 3.38Å; F30-K105 HydrophobicContact CE2-CB 4.14Å; F30-K105 HydrophobicContact CE2-CD 4.24Å; F30-K105 HydrophobicContact CE2-CG 4.38Å; F30-K105 HydrophobicContact CG-CB 4.43Å; F30-K105 HydrophobicContact CG-CD 3.93Å; F30-K105 HydrophobicContact CG-CG 3.91Å; F30-K105 HydrophobicContact CZ-CB 3.71Å; F30-K105 HydrophobicContact CZ-CG 4.24Å; F30-Y108 HydrophobicContact CD1-CD1 4.04Å; F30-Y108 AromaticContact CE1-CD1 3.82Å; F30-Y108 HydrophobicContact CE1-CD1 3.82Å; F30-F109 HydrophobicContact CZ-CB 4.48Å; F30-F109 HydrophobicContact CZ-CD2 4.48Å
31S94.3Very high92.2Very high29 Ų2945.4 Ų45.420%0.20325%0.246CC..Hα-helixtrans-62.1-46.5176.261.40000111.6A27 Q28 L33 T34 E35 Y108A27-S31 WeakPolarHBondContact O-CB 3.47Å; A27-S31 PolarHBondContact O-N 3.38Å; A27-S31 PolarHBondContact O-OG 2.87Å; Q28-S31 VanDerWaalsContact CA-OG 3.32Å; Q28-S31 WeakPolarHBondContact CA-OG 3.43Å; Q28-S31 PolarHBondContact O-OG 3.32Å; S31-L33 PolarHBondContact O-N 2.88Å; S31-T34 WeakPolarHBondContact O-CB 3.46Å; S31-T34 PolarHBondContact O-N 3.23Å; S31-E35 WeakPolarHBondContact O-CG 3.37Å; S31-E35 PolarHBondContact O-N 3.14Å; S31-Y108 VanDerWaalsContact CB-OH 3.26Å; S31-Y108 WeakPolarHBondContact CB-OH 3.26Å
32A94.1Very high91.8Very high38 Ų3842.8 Ų42.831%0.31424%0.235SC..Hα-helixtrans-61.2-44.4177.800000111.9Q28 Q29 T34 E35 V36 F57Q28-A32 WeakPolarHBondContact O-CB 3.36Å; Q28-A32 PolarHBondContact O-N 2.61Å; Q29-A32 PolarHBondContact O-N 3.36Å; A32-T34 VanDerWaalsContact C-N 3.33Å; A32-T34 PolarHBondContact O-N 2.73Å; A32-E35 PolarHBondContact O-N 3.32Å; A32-V36 WeakPolarHBondContact O-CG2 3.34Å; A32-V36 PolarHBondContact O-N 3.48Å; A32-F57 HydrophobicContact CB-CE2 4.21Å
33L94.3Very high91.3Very high2 Ų246.6 Ų46.61%0.0125%0.253CS..Hα-helixtrans-62.5-40.9176-177.661.8000112L22 L25 Q29 F30 S31 E35 V36 L37 L54 F57 L68 I71 V72 L75L22-L33 HydrophobicContact CD2-CD2 3.82Å; L25-L33 HydrophobicContact CD1-CD2 4.13Å; Q29-L33 WeakPolarHBondContact O-CB 3.43Å; Q29-L33 PolarHBondContact O-N 2.9Å; F30-L33 PolarHBondContact O-N 2.91Å; S31-L33 PolarHBondContact O-N 2.88Å; L33-E35 VanDerWaalsContact C-N 3.34Å; L33-V36 PolarHBondContact O-N 3.35Å; L33-L37 WeakPolarHBondContact O-CB 3.36Å; L33-L37 PolarHBondContact O-N 3.42Å; L33-L54 HydrophobicContact CD1-CD2 3.98Å; L33-F57 HydrophobicContact CB-CE1 4.42Å; L33-F57 HydrophobicContact CB-CE2 4.05Å; L33-F57 HydrophobicContact CB-CZ 3.87Å; L33-F57 HydrophobicContact CD1-CD1 4.45Å; L33-F57 HydrophobicContact CD1-CE1 4.36Å; L33-L68 HydrophobicContact CD1-CD1 4.02Å; L33-L68 HydrophobicContact CD2-CD1 4.27Å; L33-I71 HydrophobicContact CD2-CG2 4.23Å; L33-V72 HydrophobicContact CD1-CG2 4.22Å; L33-L75 HydrophobicContact CD2-CD1 3.97Å; L33-L75 HydrophobicContact CG-CD1 4.44Å
34T93.8Very high90.3Very high1 Ų146.5 Ų46.51%0.00626%0.255CS..Hα-helixtrans-63.8-40.6177.5-58.30000110.8F30 S31 A32 L37 F38 Y108 F109 K112F30-T34 WeakPolarHBondContact O-CB 3.45Å; F30-T34 PolarHBondContact O-N 3.34Å; F30-T34 PolarHBondContact O-OG1 3.48Å; S31-T34 WeakPolarHBondContact O-CB 3.46Å; S31-T34 PolarHBondContact O-N 3.23Å; A32-T34 VanDerWaalsContact C-N 3.33Å; A32-T34 PolarHBondContact O-N 2.73Å; T34-L37 PolarHBondContact O-N 2.94Å; T34-F38 HydrophobicContact CG2-CD2 3.64Å; T34-F38 HydrophobicContact CG2-CE2 3.71Å; T34-F38 WeakPolarHBondContact O-CD2 3.28Å; T34-F38 PolarHBondContact O-N 3.31Å; T34-Y108 HydrophobicContact CG2-CD1 4.41Å; T34-Y108 HydrophobicContact CG2-CE1 3.98Å; T34-F109 HydrophobicContact CG2-CD2 3.8Å; T34-F109 HydrophobicContact CG2-CE2 4.13Å; T34-K112 HydrophobicContact CG2-CB 4.4Å; T34-K112 HydrophobicContact CG2-CG 4.27Å
35E92.4Very high89.4Confident100 Ų10047.3 Ų47.347%0.46726%0.256SS..Hα-helixtrans-65-45176.9-7417817200112.4S31 A32 L33 L37 F38 H39 K112S31-E35 WeakPolarHBondContact O-CG 3.37Å; S31-E35 PolarHBondContact O-N 3.14Å; A32-E35 PolarHBondContact O-N 3.32Å; L33-E35 VanDerWaalsContact C-N 3.34Å; E35-L37 PolarHBondContact O-N 3.49Å; E35-F38 PolarHBondContact O-N 3.05Å; E35-H39 WeakPolarHBondContact O-CB 3.48Å; E35-H39 PolarHBondContact O-N 3.46Å; E35-K112 IonicContact OE1-NZ 3.86Å; E35-K112 PolarHBondContact OE1-NZ 3.27Å
36V92.4Very high88.9Confident24 Ų2450 Ų5015%0.14527%0.268CS..Hα-helixtrans-57.9-41.1173.3173.10000110.8A32 L33 F40 F50 Q53 L54A32-V36 WeakPolarHBondContact O-CG2 3.34Å; A32-V36 PolarHBondContact O-N 3.48Å; L33-V36 PolarHBondContact O-N 3.35Å; V36-F40 PolarHBondContact O-N 3.01Å; V36-F40 VanDerWaalsContact O-N 3.12Å; V36-F50 HydrophobicContact CG1-CD2 3.72Å; V36-F50 HydrophobicContact CG1-CE2 3.78Å; V36-Q53 HydrophobicContact CG1-CB 3.98Å; V36-Q53 HydrophobicContact CG2-CB 4.37Å; V36-L54 HydrophobicContact CG1-CD2 4.22Å
37L92.1Very high88.4Confident2 Ų251.6 Ų51.61%0.0127%0.27CS..Hα-helixtrans-67.9-45.2179.2-173145000112.6L33 T34 E35 F40 L41 L75 L76 F109L33-L37 WeakPolarHBondContact O-CB 3.36Å; L33-L37 PolarHBondContact O-N 3.42Å; T34-L37 PolarHBondContact O-N 2.94Å; E35-L37 PolarHBondContact O-N 3.49Å; L37-F40 PolarHBondContact O-N 3.37Å; L37-L41 HydrophobicContact CD2-CD1 3.58Å; L37-L41 HydrophobicContact CD2-CG 4.2Å; L37-L41 WeakPolarHBondContact O-CG 3.46Å; L37-L41 PolarHBondContact O-N 3.35Å; L37-L75 HydrophobicContact CD1-CB 3.69Å; L37-L75 HydrophobicContact CD1-CD1 4.15Å; L37-L76 HydrophobicContact CD1-CD2 3.98Å; L37-L76 HydrophobicContact CD1-CG 4.06Å; L37-L76 HydrophobicContact CD2-CD2 4.08Å; L37-L76 HydrophobicContact CG-CD2 3.91Å; L37-F109 HydrophobicContact CD2-CE2 4.15Å; L37-F109 HydrophobicContact CD2-CZ 4.11Å
38F91.1Very high88.1Confident8 Ų856.8 Ų56.84%0.03528%0.283CS..Hα-helixtrans-67.8-37.6178.1-89.3-81.7000112.3T34 E35 F40 L41 T42 F109 K112 W113 N116 L120T34-F38 HydrophobicContact CG2-CD2 3.64Å; T34-F38 HydrophobicContact CG2-CE2 3.71Å; T34-F38 WeakPolarHBondContact O-CD2 3.28Å; T34-F38 PolarHBondContact O-N 3.31Å; E35-F38 PolarHBondContact O-N 3.05Å; F38-F40 VanDerWaalsContact C-N 3.32Å; F38-F40 PolarHBondContact O-N 3.04Å; F38-L41 HydrophobicContact CD1-CD1 4.47Å; F38-L41 PolarHBondContact O-N 2.99Å; F38-T42 PolarHBondContact O-N 2.83Å; F38-T42 PolarHBondContact O-OG1 2.92Å; F38-T42 VanDerWaalsContact O-OG1 3.1Å; F38-F109 HydrophobicContact CE2-CD1 4.34Å; F38-F109 HydrophobicContact CE2-CD2 4.25Å; F38-F109 AromaticContact CE2-CE1 3.93Å; F38-F109 HydrophobicContact CE2-CE1 3.93Å; F38-F109 AromaticContact CE2-CE2 3.84Å; F38-F109 HydrophobicContact CE2-CE2 3.84Å; F38-F109 HydrophobicContact CE2-CG 4.49Å; F38-F109 AromaticContact CE2-CZ 3.67Å; F38-F109 HydrophobicContact CE2-CZ 3.67Å; F38-F109 HydrophobicContact CZ-CD1 4.35Å; F38-F109 AromaticContact CZ-CE1 3.8Å; F38-F109 HydrophobicContact CZ-CE1 3.8Å; F38-F109 AromaticContact CZ-CZ 3.89Å; F38-F109 HydrophobicContact CZ-CZ 3.89Å; F38-K112 HydrophobicContact CD2-CB 4.09Å; F38-K112 HydrophobicContact CE2-CB 3.64Å; F38-K112 HydrophobicContact CZ-CB 4.02Å; F38-W113 HydrophobicContact CE1-CE3 4.09Å; F38-W113 HydrophobicContact CZ-CB 4.13Å; F38-W113 HydrophobicContact CZ-CE3 4.21Å; F38-N116 HydrophobicContact CD1-CB 3.65Å; F38-N116 HydrophobicContact CE1-CB 3.84Å; F38-L120 HydrophobicContact CD1-CD1 4.16Å; F38-L120 HydrophobicContact CE1-CD1 4.04Å
39H89.2Confident88Confident56 Ų5655 Ų5526%0.25927%0.269SS..Hα-helixtrans-60.2-43.4174-175.653.3000111.4E35 T42 E43E35-H39 WeakPolarHBondContact O-CB 3.48Å; E35-H39 PolarHBondContact O-N 3.46Å; H39-T42 WeakPolarHBondContact CA-OG1 3.44Å; H39-T42 PolarHBondContact O-N 3.27Å; H39-T42 PolarHBondContact O-OG1 3.23Å; H39-E43 IonicContact CE1-OE1 2.77Å; H39-E43 IonicContact CE1-OE2 3.76Å; H39-E43 PolarHBondContact CE1-OE2 3.18Å; H39-E43 IonicContact ND1-OE1 3.91Å; H39-E43 PolarHBondContact O-N 3.36Å
40F88.6Confident87.8Confident42 Ų4252.8 Ų52.818%0.18426%0.259CS..Hα-helixtrans-62.9-41.4173.5172-108.3000113V36 L37 F38 T42 E43 P44 V47 F50 L76V36-F40 PolarHBondContact O-N 3.01Å; V36-F40 VanDerWaalsContact O-N 3.12Å; L37-F40 PolarHBondContact O-N 3.37Å; F38-F40 VanDerWaalsContact C-N 3.32Å; F38-F40 PolarHBondContact O-N 3.04Å; F40-T42 VanDerWaalsContact C-N 3.29Å; F40-T42 PolarHBondContact O-N 3.22Å; F40-E43 CarbonylContact O-C 3.58Å; F40-E43 VanDerWaalsContact O-C 3.3Å; F40-E43 PolarHBondContact O-N 2.96Å; F40-P44 WeakPolarHBondContact O-CA 3.4Å; F40-P44 VanDerWaalsContact O-N 3.17Å; F40-V47 HydrophobicContact CE2-CG2 4.26Å; F40-F50 HydrophobicContact CB-CB 4.35Å; F40-F50 HydrophobicContact CB-CD2 3.45Å; F40-F50 VanDerWaalsContact CB-CD2 3.45Å; F40-F50 HydrophobicContact CB-CE2 3.68Å; F40-F50 HydrophobicContact CB-CG 3.89Å; F40-F50 HydrophobicContact CB-CZ 4.32Å; F40-F50 HydrophobicContact CD1-CD1 4.38Å; F40-F50 HydrophobicContact CD1-CE1 4.13Å; F40-F50 HydrophobicContact CD1-CE2 4.26Å; F40-F50 HydrophobicContact CD1-CZ 4.04Å; F40-F50 HydrophobicContact CD2-CB 3.78Å; F40-F50 AromaticContact CD2-CD1 3.82Å; F40-F50 HydrophobicContact CD2-CD1 3.82Å; F40-F50 HydrophobicContact CD2-CD2 4.15Å; F40-F50 HydrophobicContact CD2-CE1 4.38Å; F40-F50 AromaticContact CD2-CG 3.66Å; F40-F50 HydrophobicContact CD2-CG 3.66Å; F40-F50 HydrophobicContact CE1-CE1 4.35Å; F40-F50 HydrophobicContact CE2-CD1 4.1Å; F40-F50 HydrophobicContact CE2-CG 4.37Å; F40-F50 HydrophobicContact CG-CB 4.29Å; F40-F50 AromaticContact CG-CD1 3.97Å; F40-F50 HydrophobicContact CG-CD1 3.97Å; F40-F50 AromaticContact CG-CD2 3.79Å; F40-F50 HydrophobicContact CG-CD2 3.79Å; F40-F50 HydrophobicContact CG-CE1 4.14Å; F40-F50 AromaticContact CG-CE2 3.95Å; F40-F50 HydrophobicContact CG-CE2 3.95Å; F40-F50 AromaticContact CG-CG 3.76Å; F40-F50 HydrophobicContact CG-CG 3.76Å; F40-F50 HydrophobicContact CG-CZ 4.11Å; F40-F50 HydrophobicContact CZ-CD1 4.5Å; F40-L76 HydrophobicContact CE1-CD1 4.47Å
41L85.9Confident87.5Confident22 Ų2256.3 Ų56.312%0.11528%0.277CS..Hα-helixtrans-63.7-34.8177-73.1176.2000112.3L37 F38 L76 P79 L120L37-L41 HydrophobicContact CD2-CD1 3.58Å; L37-L41 HydrophobicContact CD2-CG 4.2Å; L37-L41 WeakPolarHBondContact O-CG 3.46Å; L37-L41 PolarHBondContact O-N 3.35Å; F38-L41 HydrophobicContact CD1-CD1 4.47Å; F38-L41 PolarHBondContact O-N 2.99Å; L41-L76 HydrophobicContact CD1-CD2 4.45Å; L41-L76 HydrophobicContact CD2-CD2 3.73Å; L41-L76 HydrophobicContact CG-CD2 4.16Å; L41-P79 HydrophobicContact CD1-CB 3.93Å; L41-P79 HydrophobicContact CD1-CG 4.19Å; L41-L120 VanDerWaalsContact C-CD2 3.4Å; L41-L120 HydrophobicContact CB-CD1 4.44Å; L41-L120 HydrophobicContact CB-CD2 3.63Å; L41-L120 HydrophobicContact CD1-CD1 4.47Å; L41-L120 VanDerWaalsContact O-CD2 3.3Å; L41-L120 WeakPolarHBondContact O-CD2 3.31Å
42T84.1Confident87.4Confident17 Ų1757.7 Ų57.710%0.10429%0.291CS..Hα-helixtrans-78.3-31.9176.250.10000113.1F38 H39 F40 P44 T119 L120F38-T42 PolarHBondContact O-N 2.83Å; F38-T42 PolarHBondContact O-OG1 2.92Å; F38-T42 VanDerWaalsContact O-OG1 3.1Å; H39-T42 WeakPolarHBondContact CA-OG1 3.44Å; H39-T42 PolarHBondContact O-N 3.27Å; H39-T42 PolarHBondContact O-OG1 3.23Å; F40-T42 VanDerWaalsContact C-N 3.29Å; F40-T42 PolarHBondContact O-N 3.22Å; T42-P44 VanDerWaalsContact C-CD 3.45Å; T42-P44 WeakPolarHBondContact O-CD 3.31Å; T42-T119 HydrophobicContact CG2-CG2 4.43Å; T42-L120 HydrophobicContact CG2-CD2 3.68Å; T42-L120 HydrophobicContact CG2-CG 4.35Å
43E81.3Confident87.3Confident81 Ų8158.5 Ų58.538%0.37929%0.288SS..  trans-127.565.2-175.5-65.7179.7-150.400111.6H39 F40 K45 E46H39-E43 IonicContact CE1-OE1 2.77Å; H39-E43 IonicContact CE1-OE2 3.76Å; H39-E43 PolarHBondContact CE1-OE2 3.18Å; H39-E43 IonicContact ND1-OE1 3.91Å; H39-E43 PolarHBondContact O-N 3.36Å; F40-E43 CarbonylContact O-C 3.58Å; F40-E43 VanDerWaalsContact O-C 3.3Å; F40-E43 PolarHBondContact O-N 2.96Å; E43-K45 PolarHBondContact O-N 3.34Å; E43-E46 PolarHBondContact O-N 2.95Å; E43-E46 VanDerWaalsContact O-N 3.11Å
44P72Confident87.2Confident41 Ų4158.7 Ų58.727%0.26629%0.289SS..THydrogen-bonded Turntrans-66.5-8.7-171.826.1-35.7000114.3F40 T42 E46 V47F40-P44 WeakPolarHBondContact O-CA 3.4Å; F40-P44 VanDerWaalsContact O-N 3.17Å; T42-P44 VanDerWaalsContact C-CD 3.45Å; T42-P44 WeakPolarHBondContact O-CD 3.31Å; P44-E46 VanDerWaalsContact C-N 3.31Å; P44-V47 WeakPolarHBondContact O-CG2 3.34Å
45K74.8Confident87.2Confident179 Ų17961.1 Ų61.178%0.77831%0.306SS*.THydrogen-bonded Turntrans-75.5-19.6176.9-63.9-179.1-178176.80112.6E43 V47E43-K45 PolarHBondContact O-N 3.34Å; K45-V47 VanDerWaalsContact C-N 3.29Å; K45-V47 PolarHBondContact O-N 3.36Å
46E80.8Confident87.2Confident75 Ų7562.8 Ų62.835%0.3531%0.313SS..  trans-92.146-177.5-57.2-157.6161.800112.8E43 P44 E48 R49 F50E43-E46 PolarHBondContact O-N 2.95Å; E43-E46 VanDerWaalsContact O-N 3.11Å; P44-E46 VanDerWaalsContact C-N 3.31Å; E46-E48 VanDerWaalsContact C-N 3.29Å; E46-E48 PolarHBondContact O-N 3.47Å; E46-R49 HydrophobicContact CB-CB 4.09Å; E46-R49 PolarHBondContact O-N 2.89Å; E46-R49 IonicContact OE1-NH1 3.42Å; E46-R49 WeakPolarHBondContact OE2-CD 3.24Å; E46-R49 IonicContact OE2-CZ 3.19Å; E46-R49 IonicContact OE2-NE 2.64Å; E46-R49 IonicContact OE2-NH1 2.78Å; E46-R49 PolarHBondContact OE2-NH1 3.43Å; E46-F50 PolarHBondContact O-N 3.44Å
47V82.9Confident87.3Confident69 Ų6962.6 Ų62.642%0.41831%0.311SS..Hα-helixtrans-58-41-176.7-176.50000111.9F40 P44 K45 R49 F50 L51F40-V47 HydrophobicContact CE2-CG2 4.26Å; P44-V47 WeakPolarHBondContact O-CG2 3.34Å; K45-V47 VanDerWaalsContact C-N 3.29Å; K45-V47 PolarHBondContact O-N 3.36Å; V47-R49 PolarHBondContact O-N 3.45Å; V47-F50 PolarHBondContact O-N 3.22Å; V47-L51 HydrophobicContact CG1-CD1 4.18Å; V47-L51 HydrophobicContact CG1-CG 4.4Å; V47-L51 VanDerWaalsContact O-CG 3.31Å; V47-L51 WeakPolarHBondContact O-CG 3.42Å; V47-L51 PolarHBondContact O-N 3.49Å
48E86Confident87.3Confident174 Ų17462.8 Ų62.881%0.81331%0.312SS*.Hα-helixtrans-63.3-42.7179.6-66-175.4175.800112E46 L51 A52E46-E48 VanDerWaalsContact C-N 3.29Å; E46-E48 PolarHBondContact O-N 3.47Å; E48-L51 PolarHBondContact O-N 2.93Å; E48-A52 PolarHBondContact O-N 3.31Å
49R88.9Confident87.4Confident129 Ų12967.5 Ų67.549%0.48734%0.342SS..Hα-helixtrans-64.6-43.5176.8-170.6-175.2-170.7179.7-0.9111.2E46 V47 L51 A52 Q53E46-R49 HydrophobicContact CB-CB 4.09Å; E46-R49 PolarHBondContact O-N 2.89Å; E46-R49 IonicContact OE1-NH1 3.42Å; E46-R49 WeakPolarHBondContact OE2-CD 3.24Å; E46-R49 IonicContact OE2-CZ 3.19Å; E46-R49 IonicContact OE2-NE 2.64Å; E46-R49 IonicContact OE2-NH1 2.78Å; E46-R49 PolarHBondContact OE2-NH1 3.43Å; V47-R49 PolarHBondContact O-N 3.45Å; R49-L51 VanDerWaalsContact C-N 3.35Å; R49-L51 PolarHBondContact O-N 3.04Å; R49-A52 WeakPolarHBondContact O-CB 3.39Å; R49-A52 PolarHBondContact O-N 2.91Å; R49-Q53 WeakPolarHBondContact O-CG 3.41Å; R49-Q53 PolarHBondContact O-N 3.28Å
50F89.3Confident87.6Confident17 Ų1769.7 Ų69.78%0.07536%0.36CS..Hα-helixtrans-58.7-46.1175.2174.6-115.6000111.7V36 F40 E46 V47 A52 Q53 L54 V72V36-F50 HydrophobicContact CG1-CD2 3.72Å; V36-F50 HydrophobicContact CG1-CE2 3.78Å; F40-F50 HydrophobicContact CB-CB 4.35Å; F40-F50 HydrophobicContact CB-CD2 3.45Å; F40-F50 VanDerWaalsContact CB-CD2 3.45Å; F40-F50 HydrophobicContact CB-CE2 3.68Å; F40-F50 HydrophobicContact CB-CG 3.89Å; F40-F50 HydrophobicContact CB-CZ 4.32Å; F40-F50 HydrophobicContact CD1-CD1 4.38Å; F40-F50 HydrophobicContact CD1-CE1 4.13Å; F40-F50 HydrophobicContact CD1-CE2 4.26Å; F40-F50 HydrophobicContact CD1-CZ 4.04Å; F40-F50 HydrophobicContact CD2-CB 3.78Å; F40-F50 AromaticContact CD2-CD1 3.82Å; F40-F50 HydrophobicContact CD2-CD1 3.82Å; F40-F50 HydrophobicContact CD2-CD2 4.15Å; F40-F50 HydrophobicContact CD2-CE1 4.38Å; F40-F50 AromaticContact CD2-CG 3.66Å; F40-F50 HydrophobicContact CD2-CG 3.66Å; F40-F50 HydrophobicContact CE1-CE1 4.35Å; F40-F50 HydrophobicContact CE2-CD1 4.1Å; F40-F50 HydrophobicContact CE2-CG 4.37Å; F40-F50 HydrophobicContact CG-CB 4.29Å; F40-F50 AromaticContact CG-CD1 3.97Å; F40-F50 HydrophobicContact CG-CD1 3.97Å; F40-F50 AromaticContact CG-CD2 3.79Å; F40-F50 HydrophobicContact CG-CD2 3.79Å; F40-F50 HydrophobicContact CG-CE1 4.14Å; F40-F50 AromaticContact CG-CE2 3.95Å; F40-F50 HydrophobicContact CG-CE2 3.95Å; F40-F50 AromaticContact CG-CG 3.76Å; F40-F50 HydrophobicContact CG-CG 3.76Å; F40-F50 HydrophobicContact CG-CZ 4.11Å; F40-F50 HydrophobicContact CZ-CD1 4.5Å; E46-F50 PolarHBondContact O-N 3.44Å; V47-F50 PolarHBondContact O-N 3.22Å; F50-A52 VanDerWaalsContact C-N 3.33Å; F50-A52 PolarHBondContact O-N 3.49Å; F50-Q53 PolarHBondContact O-N 2.92Å; F50-L54 HydrophobicContact CD1-CD1 4.12Å; F50-L54 HydrophobicContact CD2-CG 4.37Å; F50-L54 HydrophobicContact CE1-CD1 3.57Å; F50-L54 HydrophobicContact CE1-CG 4.36Å; F50-L54 HydrophobicContact CE2-CD1 4.09Å; F50-L54 HydrophobicContact CE2-CD2 4.23Å; F50-L54 HydrophobicContact CE2-CG 4.09Å; F50-L54 HydrophobicContact CZ-CD1 3.58Å; F50-L54 HydrophobicContact CZ-CD2 4.36Å; F50-L54 HydrophobicContact CZ-CG 4.1Å; F50-L54 WeakPolarHBondContact O-CG 3.4Å; F50-L54 PolarHBondContact O-N 3.49Å; F50-V72 HydrophobicContact CE1-CG1 4.3Å; F50-V72 HydrophobicContact CZ-CG1 3.74Å
51L89.1Confident87.6Confident76 Ų7669.3 Ų69.340%0.39836%0.36SS..Hα-helixtrans-63.5-37.9177-69.9175.9000112.4V47 E48 R49 L54 S55V47-L51 HydrophobicContact CG1-CD1 4.18Å; V47-L51 HydrophobicContact CG1-CG 4.4Å; V47-L51 VanDerWaalsContact O-CG 3.31Å; V47-L51 WeakPolarHBondContact O-CG 3.42Å; V47-L51 PolarHBondContact O-N 3.49Å; E48-L51 PolarHBondContact O-N 2.93Å; R49-L51 VanDerWaalsContact C-N 3.35Å; R49-L51 PolarHBondContact O-N 3.04Å; L51-L54 PolarHBondContact O-N 3.33Å; L51-S55 WeakPolarHBondContact O-CB 3.47Å; L51-S55 PolarHBondContact O-N 2.96Å
52A91.5Very high87.8Confident59 Ų5979.5 Ų79.549%0.48840%0.396SS..Hα-helixtrans-63.4-46.9174.500000111.6E48 R49 F50 L54 S55 E56E48-A52 PolarHBondContact O-N 3.31Å; R49-A52 WeakPolarHBondContact O-CB 3.39Å; R49-A52 PolarHBondContact O-N 2.91Å; F50-A52 VanDerWaalsContact C-N 3.33Å; F50-A52 PolarHBondContact O-N 3.49Å; A52-L54 VanDerWaalsContact C-N 3.35Å; A52-L54 PolarHBondContact O-N 3.41Å; A52-S55 WeakPolarHBondContact O-CB 3.45Å; A52-S55 PolarHBondContact O-N 2.98Å; A52-S55 VanDerWaalsContact O-N 3.12Å; A52-E56 PolarHBondContact O-N 3.43Å
53Q92.6Very high88.2Confident55 Ų5580.4 Ų80.426%0.25740%0.4SS..Hα-helixtrans-61.9-39.8176.8-72.4177.3-39.300112.4V36 R49 F50 E56 F57V36-Q53 HydrophobicContact CG1-CB 3.98Å; V36-Q53 HydrophobicContact CG2-CB 4.37Å; R49-Q53 WeakPolarHBondContact O-CG 3.41Å; R49-Q53 PolarHBondContact O-N 3.28Å; F50-Q53 PolarHBondContact O-N 2.92Å; Q53-E56 PolarHBondContact O-N 3.28Å; Q53-F57 VanDerWaalsContact O-CB 3.31Å; Q53-F57 WeakPolarHBondContact O-CB 3.37Å; Q53-F57 PolarHBondContact O-N 3.3Å
54L93.1Very high88.7Confident5 Ų579.7 Ų79.73%0.02640%0.404CS..Hα-helixtrans-65.2-38.6173.6-71-176000112.1L33 V36 F50 L51 A52 F57 A58 L68 V72L33-L54 HydrophobicContact CD1-CD2 3.98Å; V36-L54 HydrophobicContact CG1-CD2 4.22Å; F50-L54 HydrophobicContact CD1-CD1 4.12Å; F50-L54 HydrophobicContact CD2-CG 4.37Å; F50-L54 HydrophobicContact CE1-CD1 3.57Å; F50-L54 HydrophobicContact CE1-CG 4.36Å; F50-L54 HydrophobicContact CE2-CD1 4.09Å; F50-L54 HydrophobicContact CE2-CD2 4.23Å; F50-L54 HydrophobicContact CE2-CG 4.09Å; F50-L54 HydrophobicContact CZ-CD1 3.58Å; F50-L54 HydrophobicContact CZ-CD2 4.36Å; F50-L54 HydrophobicContact CZ-CG 4.1Å; F50-L54 WeakPolarHBondContact O-CG 3.4Å; F50-L54 PolarHBondContact O-N 3.49Å; L51-L54 PolarHBondContact O-N 3.33Å; A52-L54 VanDerWaalsContact C-N 3.35Å; A52-L54 PolarHBondContact O-N 3.41Å; L54-F57 PolarHBondContact O-N 2.82Å; L54-A58 VanDerWaalsContact O-CB 3.3Å; L54-A58 WeakPolarHBondContact O-CB 3.34Å; L54-A58 PolarHBondContact O-N 2.72Å; L54-L68 HydrophobicContact CB-CD2 4.12Å; L54-L68 HydrophobicContact CD2-CD2 4.11Å; L54-L68 HydrophobicContact CD2-CG 4.39Å; L54-L68 WeakPolarHBondContact O-CD2 3.26Å; L54-V72 HydrophobicContact CD1-CG1 4.41Å; L54-V72 HydrophobicContact CD1-CG2 4.08Å; L54-V72 HydrophobicContact CD2-CG2 3.79Å
55S92.3Very high89.6Confident52 Ų5280.3 Ų80.336%0.36441%0.405SS..Hα-helixtrans-65.2-42176.7-169.10000111.9L51 A52 A58 T59L51-S55 WeakPolarHBondContact O-CB 3.47Å; L51-S55 PolarHBondContact O-N 2.96Å; A52-S55 WeakPolarHBondContact O-CB 3.45Å; A52-S55 PolarHBondContact O-N 2.98Å; A52-S55 VanDerWaalsContact O-N 3.12Å; S55-A58 PolarHBondContact O-N 3.49Å; S55-T59 PolarHBondContact O-N 3.07Å; S55-T59 VanDerWaalsContact O-N 3.09Å; S55-T59 PolarHBondContact O-OG1 2.95Å
56E93.9Very high90.3Very high135 Ų13575.9 Ų75.963%0.63140%0.397SS*.Hα-helixtrans-64.3-46.3174.9-173177.3-177.300111.1A52 Q53 A58 T59 T60A52-E56 PolarHBondContact O-N 3.43Å; Q53-E56 PolarHBondContact O-N 3.28Å; E56-A58 VanDerWaalsContact C-N 3.35Å; E56-A58 PolarHBondContact O-N 3.35Å; E56-T59 PolarHBondContact O-N 2.82Å; E56-T60 WeakPolarHBondContact O-CB 3.31Å; E56-T60 PolarHBondContact O-N 3.33Å; E56-T60 PolarHBondContact O-OG1 3.46Å; E56-T60 VanDerWaalsContact O-OG1 3.09Å
57F93.3Very high90.8Very high21 Ų2173.6 Ų73.69%0.09239%0.389CS..Hα-helixtrans-59.2-44176.1-174.9-86.6000112.1Q29 A32 L33 Q53 L54 T59 T60 N61 I63 L68Q29-F57 HydrophobicContact CB-CZ 4.2Å; Q29-F57 WeakPolarHBondContact O-CE2 3.42Å; Q29-F57 WeakPolarHBondContact O-CZ 3.41Å; A32-F57 HydrophobicContact CB-CE2 4.21Å; L33-F57 HydrophobicContact CB-CE1 4.42Å; L33-F57 HydrophobicContact CB-CE2 4.05Å; L33-F57 HydrophobicContact CB-CZ 3.87Å; L33-F57 HydrophobicContact CD1-CD1 4.45Å; L33-F57 HydrophobicContact CD1-CE1 4.36Å; Q53-F57 VanDerWaalsContact O-CB 3.31Å; Q53-F57 WeakPolarHBondContact O-CB 3.37Å; Q53-F57 PolarHBondContact O-N 3.3Å; L54-F57 PolarHBondContact O-N 2.82Å; F57-T59 VanDerWaalsContact C-N 3.33Å; F57-T59 PolarHBondContact O-N 2.68Å; F57-T60 PolarHBondContact O-N 3.24Å; F57-N61 WeakPolarHBondContact CD2-ND2 3.28Å; F57-N61 HydrophobicContact CE1-CB 4.42Å; F57-N61 VanDerWaalsContact CE2-ND2 3.32Å; F57-N61 WeakPolarHBondContact CE2-ND2 3.49Å; F57-N61 WeakPolarHBondContact CG-ND2 3.43Å; F57-N61 WeakPolarHBondContact CZ-ND2 2.92Å; F57-N61 WeakPolarHBondContact O-CB 3.41Å; F57-N61 PolarHBondContact O-N 2.99Å; F57-N61 PolarHBondContact O-ND2 2.98Å; F57-I63 HydrophobicContact CE1-CD1 4Å; F57-L68 HydrophobicContact CB-CD2 4.41Å; F57-L68 HydrophobicContact CD1-CD1 3.94Å; F57-L68 HydrophobicContact CD1-CD2 3.78Å; F57-L68 HydrophobicContact CE1-CD1 4.04Å
58A93.2Very high91.3Very high5 Ų570.3 Ų70.34%0.04137%0.369CS..Hα-helixtrans-58.6-45.7176.400000111.5L54 S55 E56 R62 I63 L65 L68L54-A58 VanDerWaalsContact O-CB 3.3Å; L54-A58 WeakPolarHBondContact O-CB 3.34Å; L54-A58 PolarHBondContact O-N 2.72Å; S55-A58 PolarHBondContact O-N 3.49Å; E56-A58 VanDerWaalsContact C-N 3.35Å; E56-A58 PolarHBondContact O-N 3.35Å; A58-R62 WeakPolarHBondContact O-CA 3.39Å; A58-R62 PolarHBondContact O-N 3.29Å; A58-I63 CarbonylContact C-O 3.57Å; A58-I63 WeakPolarHBondContact CB-O 3.4Å; A58-I63 PolarHBondContact O-N 3.19Å; A58-L65 HydrophobicContact CB-CB 4.46Å; A58-L65 HydrophobicContact CB-CD1 4.31Å; A58-L68 HydrophobicContact CB-CD2 3.82Å
59T92.9Very high91.6Very high107 Ų10767.8 Ų67.866%0.65635%0.352SS*.Hα-helixtrans-65.3-48.2-179.1-51.70000111.4S55 E56 F57 N61 R62S55-T59 PolarHBondContact O-N 3.07Å; S55-T59 VanDerWaalsContact O-N 3.09Å; S55-T59 PolarHBondContact O-OG1 2.95Å; E56-T59 PolarHBondContact O-N 2.82Å; F57-T59 VanDerWaalsContact C-N 3.33Å; F57-T59 PolarHBondContact O-N 2.68Å; T59-N61 VanDerWaalsContact C-N 3.34Å; T59-N61 PolarHBondContact O-N 2.85Å; T59-R62 PolarHBondContact O-N 3.34Å
60T92.2Very high91.8Very high103 Ų10363.5 Ų63.563%0.63234%0.342SS*.Hα-helixtrans-63.2-38.9-179.4-61.90000112.2E56 F57E56-T60 WeakPolarHBondContact O-CB 3.31Å; E56-T60 PolarHBondContact O-N 3.33Å; E56-T60 PolarHBondContact O-OG1 3.46Å; E56-T60 VanDerWaalsContact O-OG1 3.09Å; F57-T60 PolarHBondContact O-N 3.24Å
61N90.2Very high92Very high34 Ų3462.9 Ų62.918%0.18234%0.339CS..Hα-helixtrans-95.33.9-176.2-61.8-70.1000113.7Q29 F57 T59 I63Q29-N61 VanDerWaalsContact CD-OD1 3.3Å; Q29-N61 VanDerWaalsContact CG-OD1 3.3Å; Q29-N61 WeakPolarHBondContact CG-OD1 3.33Å; Q29-N61 PolarHBondContact NE2-OD1 3.23Å; F57-N61 WeakPolarHBondContact CD2-ND2 3.28Å; F57-N61 HydrophobicContact CE1-CB 4.42Å; F57-N61 VanDerWaalsContact CE2-ND2 3.32Å; F57-N61 WeakPolarHBondContact CE2-ND2 3.49Å; F57-N61 WeakPolarHBondContact CG-ND2 3.43Å; F57-N61 WeakPolarHBondContact CZ-ND2 2.92Å; F57-N61 WeakPolarHBondContact O-CB 3.41Å; F57-N61 PolarHBondContact O-N 2.99Å; F57-N61 PolarHBondContact O-ND2 2.98Å; T59-N61 VanDerWaalsContact C-N 3.34Å; T59-N61 PolarHBondContact O-N 2.85Å; N61-I63 HydrophobicContact CB-CD1 3.81Å; N61-I63 HydrophobicContact CB-CG1 3.97Å; N61-I63 PolarHBondContact O-N 3.5Å
62R90.1Very high92.1Very high235 Ų23559.7 Ų59.789%0.88732%0.323SS*.THydrogen-bonded Turntrans54.735-177.3-56.2179.7179.1171.9-0.4113.3A58 T59A58-R62 WeakPolarHBondContact O-CA 3.39Å; A58-R62 PolarHBondContact O-N 3.29Å; T59-R62 PolarHBondContact O-N 3.34Å
63I91.9Very high92.1Very high36 Ų3664.3 Ų64.319%0.18533%0.332CS..  trans-97.7138.8175.7-55.5170.3000107.4L25 F57 A58 N61 L65 L68L25-I63 HydrophobicContact CD2-CD1 3.63Å; F57-I63 HydrophobicContact CE1-CD1 4Å; A58-I63 CarbonylContact C-O 3.57Å; A58-I63 WeakPolarHBondContact CB-O 3.4Å; A58-I63 PolarHBondContact O-N 3.19Å; N61-I63 HydrophobicContact CB-CD1 3.81Å; N61-I63 HydrophobicContact CB-CG1 3.97Å; N61-I63 PolarHBondContact O-N 3.5Å; I63-L65 PolarHBondContact O-N 3.35Å; I63-L68 HydrophobicContact CG2-CB 4.18Å
64S92.1Very high92.1Very high66 Ų6662 Ų6246%0.46232%0.322SS..  trans-66.7136.8173.564.60000110.3S66 S67 L68S64-S66 PolarHBondContact O-N 2.98Å; S64-S66 PolarHBondContact OG-OG 3.29Å; S64-S67 PolarHBondContact O-N 2.99Å; S64-S67 WeakPolarHBondContact OG-CB 3.35Å; S64-S67 PolarHBondContact OG-N 3.45Å; S64-L68 PolarHBondContact O-N 3.12Å
65L90.5Very high92Very high54 Ų5461.8 Ų61.828%0.28332%0.321SS..Hα-helixtrans-59.2-31.4-179.1-177.960.5000112.3A58 I63 R69A58-L65 HydrophobicContact CB-CB 4.46Å; A58-L65 HydrophobicContact CB-CD1 4.31Å; I63-L65 PolarHBondContact O-N 3.35Å; L65-R69 WeakPolarHBondContact O-CB 3.49Å; L65-R69 VanDerWaalsContact O-CG 3.23Å; L65-R69 WeakPolarHBondContact O-CG 3.19Å; L65-R69 PolarHBondContact O-N 3.27Å
66S89.8Confident92Very high87 Ų8760.5 Ų60.561%0.60831%0.31SS*.Hα-helixtrans-64.2-46.317451.30000112.3S64 R69 S70S64-S66 PolarHBondContact O-N 2.98Å; S64-S66 PolarHBondContact OG-OG 3.29Å; S66-R69 PolarHBondContact O-N 3.44Å; S66-S70 PolarHBondContact O-N 3.03Å; S66-S70 VanDerWaalsContact O-N 3.09Å
67S91.5Very high91.8Very high26 Ų2656.2 Ų56.218%0.18229%0.291CS..Hα-helixtrans-64.9-43.8177-153.60000110.8Q21 S64 R69 S70 I71Q21-S67 PolarHBondContact OE1-OG 2.98Å; S64-S67 PolarHBondContact O-N 2.99Å; S64-S67 WeakPolarHBondContact OG-CB 3.35Å; S64-S67 PolarHBondContact OG-N 3.45Å; S67-R69 VanDerWaalsContact C-N 3.32Å; S67-R69 PolarHBondContact O-N 2.74Å; S67-S70 WeakPolarHBondContact O-CB 2.92Å; S67-S70 PolarHBondContact O-N 2.9Å; S67-S70 VanDerWaalsContact O-N 3.09Å; S67-I71 WeakPolarHBondContact O-CG1 3.38Å; S67-I71 PolarHBondContact O-N 2.86Å
68L93.3Very high91.8Very high1 Ų155.2 Ų55.21%0.00529%0.287CS..Hα-helixtrans-61.2-40.1176.8-17563.1000112.1L33 L54 F57 A58 I63 S64 S70 I71 V72L33-L68 HydrophobicContact CD1-CD1 4.02Å; L33-L68 HydrophobicContact CD2-CD1 4.27Å; L54-L68 HydrophobicContact CB-CD2 4.12Å; L54-L68 HydrophobicContact CD2-CD2 4.11Å; L54-L68 HydrophobicContact CD2-CG 4.39Å; L54-L68 WeakPolarHBondContact O-CD2 3.26Å; F57-L68 HydrophobicContact CB-CD2 4.41Å; F57-L68 HydrophobicContact CD1-CD1 3.94Å; F57-L68 HydrophobicContact CD1-CD2 3.78Å; F57-L68 HydrophobicContact CE1-CD1 4.04Å; A58-L68 HydrophobicContact CB-CD2 3.82Å; I63-L68 HydrophobicContact CG2-CB 4.18Å; S64-L68 PolarHBondContact O-N 3.12Å; L68-S70 VanDerWaalsContact C-N 3.32Å; L68-S70 PolarHBondContact O-N 3.46Å; L68-I71 PolarHBondContact O-N 3.27Å; L68-V72 HydrophobicContact CD1-CG2 4.42Å; L68-V72 HydrophobicContact CG-CG2 4.44Å; L68-V72 WeakPolarHBondContact O-CB 3.5Å; L68-V72 VanDerWaalsContact O-CG2 3.26Å; L68-V72 WeakPolarHBondContact O-CG2 3.33Å; L68-V72 PolarHBondContact O-N 2.9Å
69R91.5Very high91.6Very high121 Ų12155 Ų5546%0.45729%0.285SS..Hα-helixtrans-63.2-37.4174.3-77.2171.9179.11751.2112.3L65 S66 S67 K73L65-R69 WeakPolarHBondContact O-CB 3.49Å; L65-R69 VanDerWaalsContact O-CG 3.23Å; L65-R69 WeakPolarHBondContact O-CG 3.19Å; L65-R69 PolarHBondContact O-N 3.27Å; S66-R69 PolarHBondContact O-N 3.44Å; S67-R69 VanDerWaalsContact C-N 3.32Å; S67-R69 PolarHBondContact O-N 2.74Å; R69-K73 VanDerWaalsContact O-CG 3.28Å; R69-K73 WeakPolarHBondContact O-CG 3.32Å; R69-K73 PolarHBondContact O-N 3.21Å; R69-K73 VanDerWaalsContact O-N 3.1Å
70S92.8Very high91.3Very high39 Ų3953.5 Ų53.527%0.27327%0.272SS..Hα-helixtrans-63.3-52.2173.6-163.70000110.5D18 S66 S67 L68 V72 K73 S74D18-S70 PolarHBondContact OD1-OG 3.02Å; D18-S70 WeakPolarHBondContact OD2-CB 3.43Å; D18-S70 PolarHBondContact OD2-OG 2.89Å; S66-S70 PolarHBondContact O-N 3.03Å; S66-S70 VanDerWaalsContact O-N 3.09Å; S67-S70 WeakPolarHBondContact O-CB 2.92Å; S67-S70 PolarHBondContact O-N 2.9Å; S67-S70 VanDerWaalsContact O-N 3.09Å; L68-S70 VanDerWaalsContact C-N 3.32Å; L68-S70 PolarHBondContact O-N 3.46Å; S70-V72 VanDerWaalsContact C-N 3.31Å; S70-V72 PolarHBondContact O-N 3.24Å; S70-K73 WeakPolarHBondContact O-CB 3.38Å; S70-K73 PolarHBondContact O-N 3.11Å; S70-S74 PolarHBondContact O-N 3.42Å; S70-S74 PolarHBondContact O-OG 3.49Å
71I93.7Very high91Very high4 Ų449.1 Ų49.12%0.02125%0.248CC..Hα-helixtrans-51.8-48.6176.6-72.8168.9000111.7D18 Q21 L22 L33 S67 L68 K73 S74 L75D18-I71 HydrophobicContact CB-CG1 4.12Å; Q21-I71 HydrophobicContact CB-CD1 4Å; Q21-I71 HydrophobicContact CB-CG1 4.48Å; L22-I71 HydrophobicContact CD1-CG2 3.88Å; L22-I71 HydrophobicContact CD2-CG2 3.42Å; L22-I71 VanDerWaalsContact CD2-CG2 3.42Å; L22-I71 HydrophobicContact CG-CG2 3.56Å; L33-I71 HydrophobicContact CD2-CG2 4.23Å; S67-I71 WeakPolarHBondContact O-CG1 3.38Å; S67-I71 PolarHBondContact O-N 2.86Å; L68-I71 PolarHBondContact O-N 3.27Å; I71-K73 PolarHBondContact O-N 3.06Å; I71-S74 PolarHBondContact O-N 3.47Å; I71-L75 HydrophobicContact CG2-CD1 4.07Å; I71-L75 WeakPolarHBondContact O-CB 3.41Å; I71-L75 PolarHBondContact O-N 2.96Å
72V92.3Very high91Very high8 Ų847.5 Ų47.55%0.04824%0.239CC..Hα-helixtrans-63.2-42.2179.2166.70000111.4L33 F50 L54 L68 S70 S74 L75 L76L33-V72 HydrophobicContact CD1-CG2 4.22Å; F50-V72 HydrophobicContact CE1-CG1 4.3Å; F50-V72 HydrophobicContact CZ-CG1 3.74Å; L54-V72 HydrophobicContact CD1-CG1 4.41Å; L54-V72 HydrophobicContact CD1-CG2 4.08Å; L54-V72 HydrophobicContact CD2-CG2 3.79Å; L68-V72 HydrophobicContact CD1-CG2 4.42Å; L68-V72 HydrophobicContact CG-CG2 4.44Å; L68-V72 WeakPolarHBondContact O-CB 3.5Å; L68-V72 VanDerWaalsContact O-CG2 3.26Å; L68-V72 WeakPolarHBondContact O-CG2 3.33Å; L68-V72 PolarHBondContact O-N 2.9Å; S70-V72 VanDerWaalsContact C-N 3.31Å; S70-V72 PolarHBondContact O-N 3.24Å; V72-S74 VanDerWaalsContact C-N 3.34Å; V72-S74 PolarHBondContact O-N 3.5Å; V72-L75 PolarHBondContact O-N 3.08Å; V72-L76 HydrophobicContact CG1-CD1 3.86Å; V72-L76 HydrophobicContact CG1-CG 4.36Å; V72-L76 WeakPolarHBondContact O-CB 3.5Å; V72-L76 VanDerWaalsContact O-CG 3.24Å; V72-L76 WeakPolarHBondContact O-CG 3.5Å; V72-L76 PolarHBondContact O-N 3.33Å
73K90.4Very high90.7Very high157 Ų15738.5 Ų38.568%0.68321%0.208SC*.Hα-helixtrans-61.5-44175.5-73.9173.3-179.5-175.40111.5R69 S70 I71 L76 L77R69-K73 VanDerWaalsContact O-CG 3.28Å; R69-K73 WeakPolarHBondContact O-CG 3.32Å; R69-K73 PolarHBondContact O-N 3.21Å; R69-K73 VanDerWaalsContact O-N 3.1Å; S70-K73 WeakPolarHBondContact O-CB 3.38Å; S70-K73 PolarHBondContact O-N 3.11Å; I71-K73 PolarHBondContact O-N 3.06Å; K73-L76 PolarHBondContact O-N 3.14Å; K73-L77 PolarHBondContact O-N 2.87Å
74S92.6Very high90.3Very high7 Ų745.5 Ų45.55%0.04924%0.238CC..Hα-helixtrans-64.3-40.3177.2-67.30000111.9D18 S70 I71 V72 L77D18-S74 WeakPolarHBondContact OD2-CB 3.3Å; D18-S74 PolarHBondContact OD2-OG 3.15Å; S70-S74 PolarHBondContact O-N 3.42Å; S70-S74 PolarHBondContact O-OG 3.49Å; I71-S74 PolarHBondContact O-N 3.47Å; V72-S74 VanDerWaalsContact C-N 3.34Å; V72-S74 PolarHBondContact O-N 3.5Å; S74-L77 WeakPolarHBondContact O-CB 3.33Å; S74-L77 PolarHBondContact O-N 3.39Å
75L92.3Very high89.9Confident0 Ų046.9 Ų46.90%024%0.235CC..Hα-helixtrans-64.1-39.6173-83.6169.9000112.9L22 L33 L37 I71 V72 L77 P79 F96L22-L75 HydrophobicContact CD1-CD1 3.94Å; L22-L75 HydrophobicContact CD1-CD2 3.67Å; L22-L75 HydrophobicContact CD1-CG 3.62Å; L22-L75 HydrophobicContact CD2-CD1 3.9Å; L33-L75 HydrophobicContact CD2-CD1 3.97Å; L33-L75 HydrophobicContact CG-CD1 4.44Å; L37-L75 HydrophobicContact CD1-CB 3.69Å; L37-L75 HydrophobicContact CD1-CD1 4.15Å; I71-L75 HydrophobicContact CG2-CD1 4.07Å; I71-L75 WeakPolarHBondContact O-CB 3.41Å; I71-L75 PolarHBondContact O-N 2.96Å; V72-L75 PolarHBondContact O-N 3.08Å; L75-L77 PolarHBondContact O-N 3.29Å; L75-P79 WeakPolarHBondContact O-CD 3.44Å; L75-P79 WeakPolarHBondContact O-CG 3.37Å; L75-F96 HydrophobicContact CD2-CE1 3.85Å; L75-F96 HydrophobicContact CD2-CZ 4.26Å
76L91.3Very high89.7Confident24 Ų2449.4 Ų49.413%0.12626%0.258CS..Hα-helixtrans-70.5-15.9-178-75.6171.2000113.3L37 F40 L41 V72 K73 V78 P79 N80L37-L76 HydrophobicContact CD1-CD2 3.98Å; L37-L76 HydrophobicContact CD1-CG 4.06Å; L37-L76 HydrophobicContact CD2-CD2 4.08Å; L37-L76 HydrophobicContact CG-CD2 3.91Å; F40-L76 HydrophobicContact CE1-CD1 4.47Å; L41-L76 HydrophobicContact CD1-CD2 4.45Å; L41-L76 HydrophobicContact CD2-CD2 3.73Å; L41-L76 HydrophobicContact CG-CD2 4.16Å; V72-L76 HydrophobicContact CG1-CD1 3.86Å; V72-L76 HydrophobicContact CG1-CG 4.36Å; V72-L76 WeakPolarHBondContact O-CB 3.5Å; V72-L76 VanDerWaalsContact O-CG 3.24Å; V72-L76 WeakPolarHBondContact O-CG 3.5Å; V72-L76 PolarHBondContact O-N 3.33Å; K73-L76 PolarHBondContact O-N 3.14Å; L76-V78 PolarHBondContact O-N 2.77Å; L76-P79 HydrophobicContact CD2-CG 4.48Å; L76-P79 WeakPolarHBondContact O-CD 3.34Å; L76-P79 WeakPolarHBondContact O-CG 3.35Å; L76-N80 WeakPolarHBondContact O-CB 3.3Å; L76-N80 PolarHBondContact O-N 3.38Å; L76-N80 VanDerWaalsContact O-N 3.11Å; L76-N80 PolarHBondContact O-ND2 3.26Å
77L90.7Very high89.7Confident46 Ų4646.1 Ų46.124%0.24123%0.233CC..Hα-helixtrans-57.7-50.8179-175.9124.2000112L4 K73 S74 L75 G81 L99L4-L77 HydrophobicContact CD1-CD2 4.21Å; K73-L77 PolarHBondContact O-N 2.87Å; S74-L77 WeakPolarHBondContact O-CB 3.33Å; S74-L77 PolarHBondContact O-N 3.39Å; L75-L77 PolarHBondContact O-N 3.29Å; L77-G81 PolarHBondContact O-N 3.4Å; L77-G81 VanDerWaalsContact O-N 3.08Å; L77-L99 HydrophobicContact CD2-CD1 4.27Å
78V92.3Very high89.6Confident0 Ų048.7 Ų48.70%025%0.247CC..Hα-helixtrans-66.1-55.3-178-176.40000112.6L76 N80 G81 A82 V92 D95 F96 L99L76-V78 PolarHBondContact O-N 2.77Å; V78-N80 VanDerWaalsContact C-N 3.29Å; V78-N80 PolarHBondContact O-N 3.21Å; V78-G81 PolarHBondContact O-N 3.47Å; V78-A82 WeakPolarHBondContact O-CB 3.42Å; V78-A82 PolarHBondContact O-N 3.38Å; V78-V92 HydrophobicContact CG1-CB 4.48Å; V78-V92 HydrophobicContact CG1-CG1 3.96Å; V78-D95 HydrophobicContact CG1-CB 4.06Å; V78-D95 HydrophobicContact CG2-CB 4.42Å; V78-F96 HydrophobicContact CB-CD2 4.3Å; V78-F96 HydrophobicContact CB-CE1 4Å; V78-F96 HydrophobicContact CB-CE2 3.67Å; V78-F96 HydrophobicContact CB-CZ 3.52Å; V78-F96 HydrophobicContact CG1-CD2 3.99Å; V78-F96 HydrophobicContact CG1-CE2 3.64Å; V78-F96 HydrophobicContact CG1-CZ 4.06Å; V78-F96 HydrophobicContact CG2-CD1 3.96Å; V78-F96 HydrophobicContact CG2-CD2 4.35Å; V78-F96 HydrophobicContact CG2-CE1 3.66Å; V78-F96 HydrophobicContact CG2-CE2 4.07Å; V78-F96 HydrophobicContact CG2-CG 4.29Å; V78-F96 HydrophobicContact CG2-CZ 3.74Å; V78-L99 HydrophobicContact CG2-CD1 3.48Å; V78-L99 VanDerWaalsContact CG2-CD1 3.48Å
79P89.5Confident89.6Confident0 Ų049.6 Ų49.60%026%0.255CS..Hα-helixtrans-61.8-35.6-179.924.9-33.3000112.2L41 L75 L76 A82 L83 F109 W113L41-P79 HydrophobicContact CD1-CB 3.93Å; L41-P79 HydrophobicContact CD1-CG 4.19Å; L75-P79 WeakPolarHBondContact O-CD 3.44Å; L75-P79 WeakPolarHBondContact O-CG 3.37Å; L76-P79 HydrophobicContact CD2-CG 4.48Å; L76-P79 WeakPolarHBondContact O-CD 3.34Å; L76-P79 WeakPolarHBondContact O-CG 3.35Å; P79-A82 PolarHBondContact O-N 2.83Å; P79-L83 WeakPolarHBondContact O-CG 3.4Å; P79-L83 PolarHBondContact O-N 2.76Å; P79-F109 HydrophobicContact CB-CZ 4.5Å; P79-F109 HydrophobicContact CG-CZ 4.24Å; P79-W113 HydrophobicContact CB-CE3 4.12Å; P79-W113 HydrophobicContact CB-CH2 4.38Å; P79-W113 HydrophobicContact CB-CZ3 3.55Å; P79-W113 WeakPolarHBondContact O-CH2 3.47Å
80N87.5Confident89.7Confident75 Ų7551.8 Ų51.840%0.40127%0.268SS..Hα-helixtrans-65-43.3175.6-75.8-29.7000112.4L76 V78 A82 K84L76-N80 WeakPolarHBondContact O-CB 3.3Å; L76-N80 PolarHBondContact O-N 3.38Å; L76-N80 VanDerWaalsContact O-N 3.11Å; L76-N80 PolarHBondContact O-ND2 3.26Å; V78-N80 VanDerWaalsContact C-N 3.29Å; V78-N80 PolarHBondContact O-N 3.21Å; N80-A82 VanDerWaalsContact C-N 3.35Å; N80-K84 WeakPolarHBondContact O-CG 3.36Å; N80-K84 PolarHBondContact O-N 2.93Å
81G85.8Confident89.7Confident11 Ų1153 Ų5311%0.11327%0.27CS..Hα-helixtrans-70.1-3417400000112.4L77 V78 K84 K85L77-G81 PolarHBondContact O-N 3.4Å; L77-G81 VanDerWaalsContact O-N 3.08Å; V78-G81 PolarHBondContact O-N 3.47Å; G81-K84 PolarHBondContact O-N 2.99Å; G81-K85 PolarHBondContact O-N 2.96Å
82A88.9Confident89.7Confident0 Ų052.9 Ų52.90%027%0.269CS..Hα-helixtrans-67-38.7178.300000112.8V78 P79 N80 S86 L87 V92 W113V78-A82 WeakPolarHBondContact O-CB 3.42Å; V78-A82 PolarHBondContact O-N 3.38Å; P79-A82 PolarHBondContact O-N 2.83Å; N80-A82 VanDerWaalsContact C-N 3.35Å; A82-S86 CarbonylContact O-C 3.52Å; A82-S86 WeakPolarHBondContact O-CA 3.39Å; A82-S86 PolarHBondContact O-N 3.22Å; A82-L87 HydrophobicContact CB-CB 3.91Å; A82-L87 HydrophobicContact CB-CD1 3.96Å; A82-L87 HydrophobicContact CB-CG 4.17Å; A82-L87 PolarHBondContact O-N 2.77Å; A82-V92 HydrophobicContact CB-CG2 3.69Å; A82-W113 HydrophobicContact CB-CH2 3.49Å; A82-W113 VanDerWaalsContact CB-CH2 3.49Å; A82-W113 HydrophobicContact CB-CZ2 3.36Å; A82-W113 HydrophobicContact CB-CZ3 4.3Å
83L85.1Confident89.9Confident46 Ų4654.6 Ų54.624%0.24128%0.276CS..Hα-helixtrans-64.5-44.9172.2-72-178.8000111.2P79 K85 W113 L120P79-L83 WeakPolarHBondContact O-CG 3.4Å; P79-L83 PolarHBondContact O-N 2.76Å; L83-K85 PolarHBondContact O-N 3.48Å; L83-W113 HydrophobicContact CB-CH2 4.41Å; L83-W113 HydrophobicContact CD2-CH2 3.43Å; L83-W113 VanDerWaalsContact CD2-CH2 3.43Å; L83-W113 HydrophobicContact CD2-CZ2 4.15Å; L83-W113 HydrophobicContact CD2-CZ3 4.12Å; L83-W113 HydrophobicContact CG-CH2 3.61Å; L83-W113 HydrophobicContact CG-CZ3 4.22Å; L83-L120 HydrophobicContact CD1-CB 4.37Å; L83-L120 HydrophobicContact CD2-CB 3.57Å; L83-L120 HydrophobicContact CD2-CD1 4.39Å
84K83.1Confident90Very high184 Ų18448.8 Ų48.880%0.826%0.257SS*.Hα-helixtrans-65.8-36.6-177.5-72.6176.8-178.9-176.90113.3N80 G81N80-K84 WeakPolarHBondContact O-CG 3.36Å; N80-K84 PolarHBondContact O-N 2.93Å; G81-K84 PolarHBondContact O-N 2.99Å
85K84.1Confident90.1Very high95 Ų9548.4 Ų48.441%0.41326%0.255SS..THydrogen-bonded Turntrans-103.27.1-177.2-63.6-175.1179.9-172.40113.5H5 C6 G81 L83 L87H5-K85 WeakPolarHBondContact O-CD 3.38Å; H5-K85 PolarHBondContact O-NZ 2.78Å; C6-K85 WeakPolarHBondContact O-CE 3.19Å; G81-K85 PolarHBondContact O-N 2.96Å; L83-K85 PolarHBondContact O-N 3.48Å; K85-L87 HydrophobicContact CB-CD2 3.99Å; K85-L87 HydrophobicContact CB-CG 4.16Å; K85-L87 PolarHBondContact O-N 2.64Å
86S85.2Confident90.2Very high107 Ų10748.4 Ų48.475%0.74826%0.255SS*.THydrogen-bonded Turntrans51.349.3-178.3-56.30000113.4A82A82-S86 CarbonylContact O-C 3.52Å; A82-S86 WeakPolarHBondContact O-CA 3.39Å; A82-S86 PolarHBondContact O-N 3.22Å
87L89.1Confident90.4Very high18 Ų1850.8 Ų50.89%0.09427%0.267CS..  trans-73.5144.2-176-60.3-176.8000112.9H5 C6 A82 K85 Q91 V92 W113H5-L87 HydrophobicContact CB-CD1 3.86Å; H5-L87 HydrophobicContact CB-CD2 3.98Å; C6-L87 HydrophobicContact CB-CD1 3.83Å; A82-L87 HydrophobicContact CB-CB 3.91Å; A82-L87 HydrophobicContact CB-CD1 3.96Å; A82-L87 HydrophobicContact CB-CG 4.17Å; A82-L87 PolarHBondContact O-N 2.77Å; K85-L87 HydrophobicContact CB-CD2 3.99Å; K85-L87 HydrophobicContact CB-CG 4.16Å; K85-L87 PolarHBondContact O-N 2.64Å; L87-Q91 HydrophobicContact CB-CB 4.19Å; L87-Q91 HydrophobicContact CD2-CB 4.48Å; L87-V92 HydrophobicContact CB-CG2 4.2Å; L87-W113 PolarHBondContact O-NE1 3.11Å
88T91Very high90.5Very high79 Ų7951.6 Ų51.649%0.48527%0.274SS..  trans-74.7158.5173.1650000111.8K90 Q91 V92T88-K90 PolarHBondContact O-N 2.93Å; T88-Q91 PolarHBondContact O-N 3.49Å; T88-Q91 WeakPolarHBondContact OG1-CG 3.04Å; T88-Q91 PolarHBondContact OG1-N 2.95Å; T88-Q91 PolarHBondContact OG1-OE1 3.19Å; T88-V92 PolarHBondContact O-N 3.34Å
89A93.1Very high90.5Very high20 Ų2052.5 Ų52.517%0.16528%0.279CS..Hα-helixtrans-54.4-38176.400000113.2Q91 V92 Q93 S110 K114A89-Q91 PolarHBondContact O-N 2.91Å; A89-V92 PolarHBondContact O-N 3.42Å; A89-Q93 WeakPolarHBondContact O-CB 3.34Å; A89-Q93 PolarHBondContact O-N 3.3Å; A89-S110 WeakPolarHBondContact CB-O 2.89Å; A89-S110 WeakPolarHBondContact O-CB 3.2Å; A89-K114 HydrophobicContact CB-CB 4Å
90K93Very high90.6Very high168 Ų16853.7 Ų53.773%0.7329%0.291SS*.Hα-helixtrans-63.9-39.7176.4-68.5-173.3177.1-176.80112.6T88 Q93 A94T88-K90 PolarHBondContact O-N 2.93Å; K90-Q93 PolarHBondContact O-N 3.36Å; K90-A94 WeakPolarHBondContact O-CB 3.36Å; K90-A94 PolarHBondContact O-N 2.93Å
91Q91.9Very high91Very high65 Ų6550.4 Ų50.430%0.30427%0.273SS..Hα-helixtrans-69.8-40177-71.8164.6-45.800111.3H5 L87 T88 A89 Q93 A94 D95H5-Q91 HydrophobicContact CB-CB 4.36Å; L87-Q91 HydrophobicContact CB-CB 4.19Å; L87-Q91 HydrophobicContact CD2-CB 4.48Å; T88-Q91 PolarHBondContact O-N 3.49Å; T88-Q91 WeakPolarHBondContact OG1-CG 3.04Å; T88-Q91 PolarHBondContact OG1-N 2.95Å; T88-Q91 PolarHBondContact OG1-OE1 3.19Å; A89-Q91 PolarHBondContact O-N 2.91Å; Q91-Q93 VanDerWaalsContact C-N 3.34Å; Q91-Q93 PolarHBondContact O-N 2.82Å; Q91-A94 PolarHBondContact O-N 3.1Å; Q91-D95 PolarHBondContact O-N 2.88Å
92V94.2Very high91.5Very high0 Ų051.7 Ų51.70%028%0.281CS..Hα-helixtrans-60.3-44.2173.6170.60000111.2V78 A82 L87 T88 A89 D95 F96 F109 W113V78-V92 HydrophobicContact CG1-CB 4.48Å; V78-V92 HydrophobicContact CG1-CG1 3.96Å; A82-V92 HydrophobicContact CB-CG2 3.69Å; L87-V92 HydrophobicContact CB-CG2 4.2Å; T88-V92 PolarHBondContact O-N 3.34Å; A89-V92 PolarHBondContact O-N 3.42Å; V92-D95 PolarHBondContact O-N 2.97Å; V92-F96 HydrophobicContact CG1-CD2 3.89Å; V92-F96 HydrophobicContact CG1-CE2 3.83Å; V92-F96 WeakPolarHBondContact O-CD2 3.47Å; V92-F96 PolarHBondContact O-N 3.46Å; V92-F96 VanDerWaalsContact O-N 3.09Å; V92-F109 HydrophobicContact CG1-CD1 4.08Å; V92-F109 HydrophobicContact CG1-CE1 4.31Å; V92-W113 HydrophobicContact CG1-CB 4.46Å; V92-W113 HydrophobicContact CG1-CG 4.38Å; V92-W113 HydrophobicContact CG2-CD2 4.2Å; V92-W113 HydrophobicContact CG2-CG 4.12Å
93Q95.9Very high91.7Very high44 Ų4458.4 Ų58.421%0.20631%0.312CS..Hα-helixtrans-59.5-49.2175.4-170.3-171.716.100111.5A89 K90 Q91 D95 F96 I97 A106 T107A89-Q93 WeakPolarHBondContact O-CB 3.34Å; A89-Q93 PolarHBondContact O-N 3.3Å; K90-Q93 PolarHBondContact O-N 3.36Å; Q91-Q93 VanDerWaalsContact C-N 3.34Å; Q91-Q93 PolarHBondContact O-N 2.82Å; Q93-D95 VanDerWaalsContact C-N 3.3Å; Q93-D95 PolarHBondContact O-N 3.21Å; Q93-F96 PolarHBondContact O-N 3.27Å; Q93-I97 HydrophobicContact CG-CD1 4.01Å; Q93-I97 WeakPolarHBondContact O-CG1 3.39Å; Q93-I97 PolarHBondContact O-N 3.43Å; Q93-A106 HydrophobicContact CG-CB 4.12Å; Q93-T107 PolarHBondContact NE2-OG1 3.08Å
94A94.3Very high92.2Very high35 Ų3563 Ų6329%0.28933%0.332SS..Hα-helixtrans-60.5-39.1179.700000112.5K90 Q91 I97 T98K90-A94 WeakPolarHBondContact O-CB 3.36Å; K90-A94 PolarHBondContact O-N 2.93Å; Q91-A94 PolarHBondContact O-N 3.1Å; A94-I97 PolarHBondContact O-N 3.34Å; A94-T98 WeakPolarHBondContact O-CB 3.45Å; A94-T98 PolarHBondContact O-N 3.43Å; A94-T98 PolarHBondContact O-OG1 3.19Å
95D93.7Very high92.8Very high0 Ų055 Ų550%030%0.297CS..Hα-helixtrans-64.5-45.9176.4-78.11.1000111.5L4 H5 C6 V78 Q91 V92 Q93 I97 T98 L99L4-D95 HydrophobicContact CD2-CB 4.08Å; H5-D95 IonicContact CE1-OD1 3.94Å; H5-D95 IonicContact CG-OD1 3.57Å; H5-D95 PolarHBondContact N-OD1 2.87Å; H5-D95 PolarHBondContact N-OD2 3.3Å; H5-D95 IonicContact ND1-OD1 3.49Å; H5-D95 PolarHBondContact ND1-OD1 3.33Å; C6-D95 VanDerWaalsContact CB-OD2 3.24Å; C6-D95 WeakPolarHBondContact CB-OD2 3.49Å; C6-D95 PolarHBondContact N-OD2 2.81Å; C6-D95 PolarHBondContact SG-OD2 3.37Å; V78-D95 HydrophobicContact CG1-CB 4.06Å; V78-D95 HydrophobicContact CG2-CB 4.42Å; Q91-D95 PolarHBondContact O-N 2.88Å; V92-D95 PolarHBondContact O-N 2.97Å; Q93-D95 VanDerWaalsContact C-N 3.3Å; Q93-D95 PolarHBondContact O-N 3.21Å; D95-I97 PolarHBondContact O-N 3.34Å; D95-T98 WeakPolarHBondContact O-CB 3.47Å; D95-T98 PolarHBondContact O-N 3.4Å; D95-L99 VanDerWaalsContact O-CG 3.28Å; D95-L99 WeakPolarHBondContact O-CG 3.42Å; D95-L99 PolarHBondContact O-N 3.12Å
96F95.3Very high93.4Very high0 Ų050.4 Ų50.40%028%0.278CS..Hα-helixtrans-63.9-39.5176.8-84.9-61.8000113.3M19 L75 V78 V92 Q93 T98 L99 G100 L101 A106 F109M19-F96 HydrophobicContact CE-CD1 4.13Å; M19-F96 HydrophobicContact CE-CE1 4.01Å; M19-F96 HydrophobicContact SD-CD1 4.28Å; L75-F96 HydrophobicContact CD2-CE1 3.85Å; L75-F96 HydrophobicContact CD2-CZ 4.26Å; V78-F96 HydrophobicContact CB-CD2 4.3Å; V78-F96 HydrophobicContact CB-CE1 4Å; V78-F96 HydrophobicContact CB-CE2 3.67Å; V78-F96 HydrophobicContact CB-CZ 3.52Å; V78-F96 HydrophobicContact CG1-CD2 3.99Å; V78-F96 HydrophobicContact CG1-CE2 3.64Å; V78-F96 HydrophobicContact CG1-CZ 4.06Å; V78-F96 HydrophobicContact CG2-CD1 3.96Å; V78-F96 HydrophobicContact CG2-CD2 4.35Å; V78-F96 HydrophobicContact CG2-CE1 3.66Å; V78-F96 HydrophobicContact CG2-CE2 4.07Å; V78-F96 HydrophobicContact CG2-CG 4.29Å; V78-F96 HydrophobicContact CG2-CZ 3.74Å; V92-F96 HydrophobicContact CG1-CD2 3.89Å; V92-F96 HydrophobicContact CG1-CE2 3.83Å; V92-F96 WeakPolarHBondContact O-CD2 3.47Å; V92-F96 PolarHBondContact O-N 3.46Å; V92-F96 VanDerWaalsContact O-N 3.09Å; Q93-F96 PolarHBondContact O-N 3.27Å; F96-T98 VanDerWaalsContact C-N 3.32Å; F96-L99 PolarHBondContact O-N 3.33Å; F96-G100 PolarHBondContact O-N 3.01Å; F96-L101 HydrophobicContact CB-CB 4.13Å; F96-L101 HydrophobicContact CB-CD2 3.92Å; F96-L101 HydrophobicContact CD1-CD2 3.87Å; F96-L101 HydrophobicContact CG-CD2 3.96Å; F96-L101 VanDerWaalsContact O-CB 3.31Å; F96-L101 WeakPolarHBondContact O-CB 3.15Å; F96-L101 PolarHBondContact O-N 3.09Å; F96-A106 HydrophobicContact CB-CB 3.93Å; F96-F109 HydrophobicContact CD2-CD1 4.03Å; F96-F109 HydrophobicContact CD2-CG 4.35Å; F96-F109 AromaticContact CE2-CD1 3.31Å; F96-F109 HydrophobicContact CE2-CD1 3.31Å; F96-F109 HydrophobicContact CE2-CD2 4.31Å; F96-F109 AromaticContact CE2-CE1 3.44Å; F96-F109 HydrophobicContact CE2-CE1 3.44Å; F96-F109 VanDerWaalsContact CE2-CE1 3.44Å; F96-F109 HydrophobicContact CE2-CE2 4.4Å; F96-F109 AromaticContact CE2-CG 3.79Å; F96-F109 HydrophobicContact CE2-CG 3.79Å; F96-F109 HydrophobicContact CE2-CZ 4Å; F96-F109 HydrophobicContact CZ-CD1 4.03Å; F96-F109 HydrophobicContact CZ-CD2 4.33Å; F96-F109 AromaticContact CZ-CE1 3.87Å; F96-F109 HydrophobicContact CZ-CE1 3.87Å; F96-F109 HydrophobicContact CZ-CE2 4.17Å; F96-F109 HydrophobicContact CZ-CG 4.26Å; F96-F109 AromaticContact CZ-CZ 3.94Å; F96-F109 HydrophobicContact CZ-CZ 3.94Å
97I94.7Very high93.9Very high73 Ų7347.8 Ų47.837%0.37426%0.257SS..Hα-helixtrans-62.7-42.9174.3-68.1169.5000110.1Q93 A94 D95 L99 G100 E103 A106Q93-I97 HydrophobicContact CG-CD1 4.01Å; Q93-I97 WeakPolarHBondContact O-CG1 3.39Å; Q93-I97 PolarHBondContact O-N 3.43Å; A94-I97 PolarHBondContact O-N 3.34Å; D95-I97 PolarHBondContact O-N 3.34Å; I97-L99 PolarHBondContact O-N 3.43Å; I97-G100 PolarHBondContact O-N 2.75Å; I97-E103 HydrophobicContact CD1-CG 4.34Å; I97-A106 HydrophobicContact CD1-CB 4.39Å; I97-A106 HydrophobicContact CG1-CB 3.75Å
98T92.6Very high94.3Very high64 Ų6450.5 Ų50.539%0.39327%0.267SS..Hα-helixtrans-62.9-32.4177.4-58.60000112.1G2 L4 A94 D95 F96 G100G2-T98 WeakPolarHBondContact O-CG2 3.39Å; L4-T98 HydrophobicContact CD2-CG2 3.81Å; A94-T98 WeakPolarHBondContact O-CB 3.45Å; A94-T98 PolarHBondContact O-N 3.43Å; A94-T98 PolarHBondContact O-OG1 3.19Å; D95-T98 WeakPolarHBondContact O-CB 3.47Å; D95-T98 PolarHBondContact O-N 3.4Å; F96-T98 VanDerWaalsContact C-N 3.32Å; T98-G100 VanDerWaalsContact C-N 3.25Å; T98-G100 PolarHBondContact O-N 2.92Å
99L92.3Very high94.5Very high19 Ų1946.7 Ų46.710%0.09924%0.243CC..THydrogen-bonded Turntrans-77.3-7174.6-68.9174.9000113.7L4 V11 V15 M19 L77 V78 D95 F96 I97L4-L99 HydrophobicContact CD1-CD1 4.42Å; L4-L99 HydrophobicContact CD1-CD2 3.83Å; L4-L99 HydrophobicContact CD1-CG 4.25Å; L4-L99 HydrophobicContact CD2-CD2 4.2Å; L4-L99 HydrophobicContact CD2-CG 4.03Å; V11-L99 HydrophobicContact CG1-CD2 3.77Å; V11-L99 HydrophobicContact CG2-CD2 4.27Å; V15-L99 HydrophobicContact CG1-CB 4.45Å; V15-L99 HydrophobicContact CG1-CD1 4.14Å; V15-L99 HydrophobicContact CG1-CD2 3.74Å; V15-L99 HydrophobicContact CG1-CG 4.34Å; M19-L99 WeakPolarHBondContact CB-O 3.32Å; M19-L99 HydrophobicContact CE-CB 4.39Å; M19-L99 HydrophobicContact CE-CD1 4.12Å; M19-L99 HydrophobicContact CG-CB 3.99Å; M19-L99 WeakPolarHBondContact CG-O 3.35Å; L77-L99 HydrophobicContact CD2-CD1 4.27Å; V78-L99 HydrophobicContact CG2-CD1 3.48Å; V78-L99 VanDerWaalsContact CG2-CD1 3.48Å; D95-L99 VanDerWaalsContact O-CG 3.28Å; D95-L99 WeakPolarHBondContact O-CG 3.42Å; D95-L99 PolarHBondContact O-N 3.12Å; F96-L99 PolarHBondContact O-N 3.33Å; I97-L99 PolarHBondContact O-N 3.43Å
100G92.4Very high94.6Very high25 Ų2545.9 Ų45.926%0.25824%0.237SC..THydrogen-bonded Turntrans96.412.517600000115.1Q20 N23 F96 I97 T98Q20-G100 PolarHBondContact NE2-O 2.99Å; N23-G100 PolarHBondContact ND2-O 3.41Å; F96-G100 PolarHBondContact O-N 3.01Å; I97-G100 PolarHBondContact O-N 2.75Å; T98-G100 VanDerWaalsContact C-N 3.25Å; T98-G100 PolarHBondContact O-N 2.92Å
101L95.1Very high94.7Very high5 Ų542 Ų423%0.02622%0.221CC..  trans-72.9143.5170.3-166.869.2000110M19 L22 F30 F96 K105 A106M19-L101 HydrophobicContact SD-CB 4.22Å; M19-L101 HydrophobicContact SD-CD1 4.23Å; L22-L101 HydrophobicContact CB-CD1 3.89Å; L22-L101 HydrophobicContact CD1-CD1 4.35Å; F30-L101 HydrophobicContact CE2-CD1 4.25Å; F30-L101 HydrophobicContact CE2-CD2 4.44Å; F30-L101 HydrophobicContact CZ-CD2 4.12Å; F96-L101 HydrophobicContact CB-CB 4.13Å; F96-L101 HydrophobicContact CB-CD2 3.92Å; F96-L101 HydrophobicContact CD1-CD2 3.87Å; F96-L101 HydrophobicContact CG-CD2 3.96Å; F96-L101 VanDerWaalsContact O-CB 3.31Å; F96-L101 WeakPolarHBondContact O-CB 3.15Å; F96-L101 PolarHBondContact O-N 3.09Å; L101-K105 HydrophobicContact CD1-CB 4.1Å; L101-K105 HydrophobicContact CD1-CD 4.3Å; L101-K105 HydrophobicContact CD2-CB 3.98Å; L101-K105 HydrophobicContact CG-CB 3.86Å; L101-A106 HydrophobicContact CD2-CB 4.22Å
102S95.9Very high94.8Very high39 Ų3941 Ų4127%0.27322%0.216SC..  trans-61.5148.1177.573.80000111.8N23 E104 K105 A106N23-S102 PolarHBondContact OD1-N 3.39Å; S102-E104 VanDerWaalsContact C-N 3.28Å; S102-E104 PolarHBondContact O-N 2.7Å; S102-K105 PolarHBondContact O-N 3.05Å; S102-K105 VanDerWaalsContact O-N 3.15Å; S102-K105 WeakPolarHBondContact OG-CG 3.24Å; S102-A106 WeakPolarHBondContact O-CB 3.4Å; S102-A106 PolarHBondContact O-N 3.01Å
103E94.5Very high94.8Very high140 Ų14041.3 Ų41.365%0.65422%0.217SC*.Hα-helixtrans-57.9-40-177.9-174.1173-171.500112.3I97 K105 A106 T107I97-E103 HydrophobicContact CD1-CG 4.34Å; E103-K105 PolarHBondContact O-N 2.86Å; E103-A106 PolarHBondContact O-N 3.48Å; E103-T107 VanDerWaalsContact O-CB 3.29Å; E103-T107 WeakPolarHBondContact O-CB 3.29Å; E103-T107 PolarHBondContact O-N 3.47Å; E103-T107 PolarHBondContact O-OG1 3.5Å
104E94.9Very high94.6Very high143 Ų14345.5 Ų45.567%0.66823%0.234SC*.Hα-helixtrans-58.7-48.6176.2-172.9-172.5172.600111.9S102 T107 Y108S102-E104 VanDerWaalsContact C-N 3.28Å; S102-E104 PolarHBondContact O-N 2.7Å; E104-T107 PolarHBondContact O-N 2.92Å; E104-Y108 PolarHBondContact O-N 3.15Å
105K96.1Very high94.5Very high15 Ų1549.8 Ų49.87%0.06525%0.248CC..Hα-helixtrans-71.4-39-178.7-73.2176.6179.1167.20112L22 N23 L25 F30 L101 S102 E103 T107 Y108 F109L22-K105 PolarHBondContact O-NZ 2.79Å; N23-K105 VanDerWaalsContact CA-NZ 3.29Å; N23-K105 PolarHBondContact O-NZ 3.18Å; L25-K105 WeakPolarHBondContact O-CE 3.36Å; L25-K105 PolarHBondContact O-NZ 3.31Å; F30-K105 HydrophobicContact CB-CD 4.41Å; F30-K105 HydrophobicContact CD1-CB 4.02Å; F30-K105 HydrophobicContact CD1-CD 4.3Å; F30-K105 HydrophobicContact CD1-CG 3.76Å; F30-K105 HydrophobicContact CD2-CB 4.48Å; F30-K105 HydrophobicContact CD2-CD 3.89Å; F30-K105 HydrophobicContact CD2-CG 4.22Å; F30-K105 HydrophobicContact CE1-CB 3.63Å; F30-K105 HydrophobicContact CE1-CG 3.92Å; F30-K105 WeakPolarHBondContact CE1-O 3.38Å; F30-K105 HydrophobicContact CE2-CB 4.14Å; F30-K105 HydrophobicContact CE2-CD 4.24Å; F30-K105 HydrophobicContact CE2-CG 4.38Å; F30-K105 HydrophobicContact CG-CB 4.43Å; F30-K105 HydrophobicContact CG-CD 3.93Å; F30-K105 HydrophobicContact CG-CG 3.91Å; F30-K105 HydrophobicContact CZ-CB 3.71Å; F30-K105 HydrophobicContact CZ-CG 4.24Å; L101-K105 HydrophobicContact CD1-CB 4.1Å; L101-K105 HydrophobicContact CD1-CD 4.3Å; L101-K105 HydrophobicContact CD2-CB 3.98Å; L101-K105 HydrophobicContact CG-CB 3.86Å; S102-K105 PolarHBondContact O-N 3.05Å; S102-K105 VanDerWaalsContact O-N 3.15Å; S102-K105 WeakPolarHBondContact OG-CG 3.24Å; E103-K105 PolarHBondContact O-N 2.86Å; K105-T107 VanDerWaalsContact C-N 3.32Å; K105-Y108 PolarHBondContact O-N 2.99Å; K105-F109 WeakPolarHBondContact O-CB 3.17Å; K105-F109 PolarHBondContact O-N 2.64Å
106A96Very high94.2Very high0 Ų051.6 Ų51.60%026%0.258CS..Hα-helixtrans-62.2-42173.600000111.2Q93 F96 I97 L101 S102 E103 F109 S110Q93-A106 HydrophobicContact CG-CB 4.12Å; F96-A106 HydrophobicContact CB-CB 3.93Å; I97-A106 HydrophobicContact CD1-CB 4.39Å; I97-A106 HydrophobicContact CG1-CB 3.75Å; L101-A106 HydrophobicContact CD2-CB 4.22Å; S102-A106 WeakPolarHBondContact O-CB 3.4Å; S102-A106 PolarHBondContact O-N 3.01Å; E103-A106 PolarHBondContact O-N 3.48Å; A106-F109 PolarHBondContact O-N 3.24Å; A106-S110 WeakPolarHBondContact O-CB 3.22Å; A106-S110 PolarHBondContact O-N 2.78Å; A106-S110 PolarHBondContact O-OG 2.73Å
107T96.4Very high93.8Very high51 Ų5152.7 Ų52.731%0.31327%0.267SS..Hα-helixtrans-62.4-49.3175.8-550000110.6Q93 E103 E104 K105 F109 S110 E111Q93-T107 PolarHBondContact NE2-OG1 3.08Å; E103-T107 VanDerWaalsContact O-CB 3.29Å; E103-T107 WeakPolarHBondContact O-CB 3.29Å; E103-T107 PolarHBondContact O-N 3.47Å; E103-T107 PolarHBondContact O-OG1 3.5Å; E104-T107 PolarHBondContact O-N 2.92Å; K105-T107 VanDerWaalsContact C-N 3.32Å; T107-F109 PolarHBondContact O-N 3.13Å; T107-S110 PolarHBondContact O-N 3.16Å; T107-S110 VanDerWaalsContact O-N 3.15Å; T107-S110 PolarHBondContact O-OG 3.3Å; T107-E111 PolarHBondContact O-N 2.89Å
108Y96.3Very high93.3Very high75 Ų7553.3 Ų53.329%0.29428%0.276SS..Hα-helixtrans-56.5-47.7176.7179.5-90.9000112.4F30 S31 T34 E104 K105 S110 E111 K112F30-Y108 HydrophobicContact CD1-CD1 4.04Å; F30-Y108 AromaticContact CE1-CD1 3.82Å; F30-Y108 HydrophobicContact CE1-CD1 3.82Å; S31-Y108 VanDerWaalsContact CB-OH 3.26Å; S31-Y108 WeakPolarHBondContact CB-OH 3.26Å; T34-Y108 HydrophobicContact CG2-CD1 4.41Å; T34-Y108 HydrophobicContact CG2-CE1 3.98Å; E104-Y108 PolarHBondContact O-N 3.15Å; K105-Y108 PolarHBondContact O-N 2.99Å; Y108-S110 VanDerWaalsContact C-N 3.32Å; Y108-S110 PolarHBondContact O-N 3.11Å; Y108-E111 PolarHBondContact O-N 2.78Å; Y108-K112 HydrophobicContact CD1-CG 4.42Å; Y108-K112 HydrophobicContact CE1-CG 3.92Å; Y108-K112 PolarHBondContact O-N 3.5Å; Y108-K112 VanDerWaalsContact O-N 3.12Å; Y108-K112 WeakPolarHBondContact OH-CE 2.83Å
109F96.1Very high92.9Very high0 Ų053 Ų530%027%0.274CS..Hα-helixtrans-62.3-40.8178.2-165.7-75.4000111.4F30 T34 L37 F38 P79 V92 F96 K105 A106 T107 E111 K112 W113F30-F109 HydrophobicContact CZ-CB 4.48Å; F30-F109 HydrophobicContact CZ-CD2 4.48Å; T34-F109 HydrophobicContact CG2-CD2 3.8Å; T34-F109 HydrophobicContact CG2-CE2 4.13Å; L37-F109 HydrophobicContact CD2-CE2 4.15Å; L37-F109 HydrophobicContact CD2-CZ 4.11Å; F38-F109 HydrophobicContact CE2-CD1 4.34Å; F38-F109 HydrophobicContact CE2-CD2 4.25Å; F38-F109 AromaticContact CE2-CE1 3.93Å; F38-F109 HydrophobicContact CE2-CE1 3.93Å; F38-F109 AromaticContact CE2-CE2 3.84Å; F38-F109 HydrophobicContact CE2-CE2 3.84Å; F38-F109 HydrophobicContact CE2-CG 4.49Å; F38-F109 AromaticContact CE2-CZ 3.67Å; F38-F109 HydrophobicContact CE2-CZ 3.67Å; F38-F109 HydrophobicContact CZ-CD1 4.35Å; F38-F109 AromaticContact CZ-CE1 3.8Å; F38-F109 HydrophobicContact CZ-CE1 3.8Å; F38-F109 AromaticContact CZ-CZ 3.89Å; F38-F109 HydrophobicContact CZ-CZ 3.89Å; P79-F109 HydrophobicContact CB-CZ 4.5Å; P79-F109 HydrophobicContact CG-CZ 4.24Å; V92-F109 HydrophobicContact CG1-CD1 4.08Å; V92-F109 HydrophobicContact CG1-CE1 4.31Å; F96-F109 HydrophobicContact CD2-CD1 4.03Å; F96-F109 HydrophobicContact CD2-CG 4.35Å; F96-F109 AromaticContact CE2-CD1 3.31Å; F96-F109 HydrophobicContact CE2-CD1 3.31Å; F96-F109 HydrophobicContact CE2-CD2 4.31Å; F96-F109 AromaticContact CE2-CE1 3.44Å; F96-F109 HydrophobicContact CE2-CE1 3.44Å; F96-F109 VanDerWaalsContact CE2-CE1 3.44Å; F96-F109 HydrophobicContact CE2-CE2 4.4Å; F96-F109 AromaticContact CE2-CG 3.79Å; F96-F109 HydrophobicContact CE2-CG 3.79Å; F96-F109 HydrophobicContact CE2-CZ 4Å; F96-F109 HydrophobicContact CZ-CD1 4.03Å; F96-F109 HydrophobicContact CZ-CD2 4.33Å; F96-F109 AromaticContact CZ-CE1 3.87Å; F96-F109 HydrophobicContact CZ-CE1 3.87Å; F96-F109 HydrophobicContact CZ-CE2 4.17Å; F96-F109 HydrophobicContact CZ-CG 4.26Å; F96-F109 AromaticContact CZ-CZ 3.94Å; F96-F109 HydrophobicContact CZ-CZ 3.94Å; K105-F109 WeakPolarHBondContact O-CB 3.17Å; K105-F109 PolarHBondContact O-N 2.64Å; A106-F109 PolarHBondContact O-N 3.24Å; T107-F109 PolarHBondContact O-N 3.13Å; F109-E111 VanDerWaalsContact C-N 3.33Å; F109-E111 PolarHBondContact O-N 3.42Å; F109-K112 PolarHBondContact O-N 3.45Å; F109-W113 WeakPolarHBondContact O-CB 3.47Å; F109-W113 PolarHBondContact O-N 3.49Å
110S95.6Very high92.5Very high3 Ų352.3 Ų52.32%0.02127%0.27CS..Hα-helixtrans-64.2-35.4179.477.30000113.3A89 A106 T107 Y108 W113 K114A89-S110 WeakPolarHBondContact CB-O 2.89Å; A89-S110 WeakPolarHBondContact O-CB 3.2Å; A106-S110 WeakPolarHBondContact O-CB 3.22Å; A106-S110 PolarHBondContact O-N 2.78Å; A106-S110 PolarHBondContact O-OG 2.73Å; T107-S110 PolarHBondContact O-N 3.16Å; T107-S110 VanDerWaalsContact O-N 3.15Å; T107-S110 PolarHBondContact O-OG 3.3Å; Y108-S110 VanDerWaalsContact C-N 3.32Å; Y108-S110 PolarHBondContact O-N 3.11Å; S110-W113 WeakPolarHBondContact O-CB 3.42Å; S110-W113 PolarHBondContact O-N 2.81Å; S110-K114 PolarHBondContact O-N 2.87Å
111E95Very high91.9Very high86 Ų8653 Ų5340%0.40227%0.274SS..Hα-helixtrans-69.7-41.9174.6-72.9-58.4141.100111.3T107 Y108 F109 W113 K114 Q115T107-E111 PolarHBondContact O-N 2.89Å; Y108-E111 PolarHBondContact O-N 2.78Å; F109-E111 VanDerWaalsContact C-N 3.33Å; F109-E111 PolarHBondContact O-N 3.42Å; E111-W113 VanDerWaalsContact C-N 3.3Å; E111-W113 PolarHBondContact O-N 3.38Å; E111-K114 WeakPolarHBondContact O-CB 3.46Å; E111-K114 PolarHBondContact O-N 3.15Å; E111-Q115 WeakPolarHBondContact O-CG 3.39Å; E111-Q115 PolarHBondContact O-N 2.88Å; E111-Q115 VanDerWaalsContact O-N 3.13Å
112K93.9Very high90.9Very high45 Ų4559.8 Ų59.820%0.19631%0.305CS..Hα-helixtrans-62-39.4171.9-72.2-68.6-168.2167.60111.7T34 E35 F38 Y108 F109 Q115 N116T34-K112 HydrophobicContact CG2-CB 4.4Å; T34-K112 HydrophobicContact CG2-CG 4.27Å; E35-K112 IonicContact OE1-NZ 3.86Å; E35-K112 PolarHBondContact OE1-NZ 3.27Å; F38-K112 HydrophobicContact CD2-CB 4.09Å; F38-K112 HydrophobicContact CE2-CB 3.64Å; F38-K112 HydrophobicContact CZ-CB 4.02Å; Y108-K112 HydrophobicContact CD1-CG 4.42Å; Y108-K112 HydrophobicContact CE1-CG 3.92Å; Y108-K112 PolarHBondContact O-N 3.5Å; Y108-K112 VanDerWaalsContact O-N 3.12Å; Y108-K112 WeakPolarHBondContact OH-CE 2.83Å; F109-K112 PolarHBondContact O-N 3.45Å; K112-Q115 PolarHBondContact O-N 3.26Å; K112-N116 PolarHBondContact O-N 2.81Å; K112-N116 VanDerWaalsContact O-N 3.1Å; K112-N116 PolarHBondContact O-ND2 3.33Å
113W94Very high89.7Confident6 Ų663.8 Ų63.82%0.02331%0.314CS..Hα-helixtrans-59.7-49.5173.3176.9-99.4000111.4F38 P79 A82 L83 L87 V92 F109 S110 E111 Q115 N116 A117 L120F38-W113 HydrophobicContact CE1-CE3 4.09Å; F38-W113 HydrophobicContact CZ-CB 4.13Å; F38-W113 HydrophobicContact CZ-CE3 4.21Å; P79-W113 HydrophobicContact CB-CE3 4.12Å; P79-W113 HydrophobicContact CB-CH2 4.38Å; P79-W113 HydrophobicContact CB-CZ3 3.55Å; P79-W113 WeakPolarHBondContact O-CH2 3.47Å; A82-W113 HydrophobicContact CB-CH2 3.49Å; A82-W113 VanDerWaalsContact CB-CH2 3.49Å; A82-W113 HydrophobicContact CB-CZ2 3.36Å; A82-W113 HydrophobicContact CB-CZ3 4.3Å; L83-W113 HydrophobicContact CB-CH2 4.41Å; L83-W113 HydrophobicContact CD2-CH2 3.43Å; L83-W113 VanDerWaalsContact CD2-CH2 3.43Å; L83-W113 HydrophobicContact CD2-CZ2 4.15Å; L83-W113 HydrophobicContact CD2-CZ3 4.12Å; L83-W113 HydrophobicContact CG-CH2 3.61Å; L83-W113 HydrophobicContact CG-CZ3 4.22Å; L87-W113 PolarHBondContact O-NE1 3.11Å; V92-W113 HydrophobicContact CG1-CB 4.46Å; V92-W113 HydrophobicContact CG1-CG 4.38Å; V92-W113 HydrophobicContact CG2-CD2 4.2Å; V92-W113 HydrophobicContact CG2-CG 4.12Å; F109-W113 WeakPolarHBondContact O-CB 3.47Å; F109-W113 PolarHBondContact O-N 3.49Å; S110-W113 WeakPolarHBondContact O-CB 3.42Å; S110-W113 PolarHBondContact O-N 2.81Å; E111-W113 VanDerWaalsContact C-N 3.3Å; E111-W113 PolarHBondContact O-N 3.38Å; W113-Q115 PolarHBondContact O-N 3.43Å; W113-N116 PolarHBondContact O-N 3.1Å; W113-N116 VanDerWaalsContact O-N 3.11Å; W113-A117 HydrophobicContact CD2-CB 4.39Å; W113-A117 HydrophobicContact CZ2-CB 4.4Å; W113-A117 WeakPolarHBondContact O-CA 3.47Å; W113-A117 WeakPolarHBondContact O-CB 3.29Å; W113-A117 PolarHBondContact O-N 3.45Å; W113-L120 HydrophobicContact CE3-CD1 4.36Å; W113-L120 HydrophobicContact CZ3-CD1 4.01Å
114K92.6Very high88.2Confident132 Ų13258.8 Ų58.857%0.57430%0.297SS*.Hα-helixtrans-55.8-38.7178.9-171.9-179.8173.4-1720112.8A89 S110 E111A89-K114 HydrophobicContact CB-CB 4Å; S110-K114 PolarHBondContact O-N 2.87Å; E111-K114 WeakPolarHBondContact O-CB 3.46Å; E111-K114 PolarHBondContact O-N 3.15Å
115Q91Very high86.5Confident124 Ų12456.8 Ų56.858%0.57929%0.29SS*.Hα-helixtrans-71.2-37.7178.7-67.8168.218.900112.6E111 K112 W113E111-Q115 WeakPolarHBondContact O-CG 3.39Å; E111-Q115 PolarHBondContact O-N 2.88Å; E111-Q115 VanDerWaalsContact O-N 3.13Å; K112-Q115 PolarHBondContact O-N 3.26Å; W113-Q115 PolarHBondContact O-N 3.43Å
116N88.5Confident84.5Confident39 Ų3957.4 Ų57.421%0.20930%0.3CS..Hα-helixtrans-99.7-16.9-172.1-68.6-80.3000114F38 K112 W113 P118 T119 L120F38-N116 HydrophobicContact CD1-CB 3.65Å; F38-N116 HydrophobicContact CE1-CB 3.84Å; K112-N116 PolarHBondContact O-N 2.81Å; K112-N116 VanDerWaalsContact O-N 3.1Å; K112-N116 PolarHBondContact O-ND2 3.33Å; W113-N116 PolarHBondContact O-N 3.1Å; W113-N116 VanDerWaalsContact O-N 3.11Å; N116-P118 VanDerWaalsContact C-CD 3.47Å; N116-T119 PolarHBondContact O-N 3.11Å; N116-T119 VanDerWaalsContact O-N 3.15Å; N116-L120 HydrophobicContact CB-CD1 4.17Å; N116-L120 HydrophobicContact CB-CG 4.39Å; N116-L120 WeakPolarHBondContact O-CG 3.29Å; N116-L120 PolarHBondContact O-N 2.74Å
117A85.4Confident82.4Confident22 Ų2261.9 Ų61.918%0.18232%0.321CS..Hα-helixtrans-55.2-41.2-176.200000113.8W113 L120 A121W113-A117 HydrophobicContact CD2-CB 4.39Å; W113-A117 HydrophobicContact CZ2-CB 4.4Å; W113-A117 WeakPolarHBondContact O-CA 3.47Å; W113-A117 WeakPolarHBondContact O-CB 3.29Å; W113-A117 PolarHBondContact O-N 3.45Å; A117-L120 PolarHBondContact O-N 3.23Å; A117-A121 WeakPolarHBondContact O-CB 3.33Å; A117-A121 PolarHBondContact O-N 2.92Å
118P84.2Confident80Confident86 Ų8664.2 Ų64.256%0.55834%0.336SS*.Hα-helixtrans-61.6-46.6175.9-22.834.4000112.4N116 A121 Q122N116-P118 VanDerWaalsContact C-CD 3.47Å; P118-A121 PolarHBondContact O-N 3.44Å; P118-Q122 WeakPolarHBondContact O-CB 3.15Å; P118-Q122 PolarHBondContact O-N 3.36Å
119T85.1Confident77.5Confident59 Ų5965.5 Ų65.536%0.36235%0.347SS..Hα-helixtrans-62.8-44.9178-51.10000111.1T42 N116 Q122 W123T42-T119 HydrophobicContact CG2-CG2 4.43Å; N116-T119 PolarHBondContact O-N 3.11Å; N116-T119 VanDerWaalsContact O-N 3.15Å; T119-Q122 PolarHBondContact O-N 3.13Å; T119-W123 PolarHBondContact O-N 2.96Å
120L83.5Confident75.2Confident3 Ų371.2 Ų71.22%0.01638%0.376CS..Hα-helixtrans-66.4-38.4178-67.4174.2000112.3F38 L41 T42 L83 W113 N116 A117 W123 A124F38-L120 HydrophobicContact CD1-CD1 4.16Å; F38-L120 HydrophobicContact CE1-CD1 4.04Å; L41-L120 VanDerWaalsContact C-CD2 3.4Å; L41-L120 HydrophobicContact CB-CD1 4.44Å; L41-L120 HydrophobicContact CB-CD2 3.63Å; L41-L120 HydrophobicContact CD1-CD1 4.47Å; L41-L120 VanDerWaalsContact O-CD2 3.3Å; L41-L120 WeakPolarHBondContact O-CD2 3.31Å; T42-L120 HydrophobicContact CG2-CD2 3.68Å; T42-L120 HydrophobicContact CG2-CG 4.35Å; L83-L120 HydrophobicContact CD1-CB 4.37Å; L83-L120 HydrophobicContact CD2-CB 3.57Å; L83-L120 HydrophobicContact CD2-CD1 4.39Å; W113-L120 HydrophobicContact CE3-CD1 4.36Å; W113-L120 HydrophobicContact CZ3-CD1 4.01Å; N116-L120 HydrophobicContact CB-CD1 4.17Å; N116-L120 HydrophobicContact CB-CG 4.39Å; N116-L120 WeakPolarHBondContact O-CG 3.29Å; N116-L120 PolarHBondContact O-N 2.74Å; A117-L120 PolarHBondContact O-N 3.23Å; L120-W123 PolarHBondContact O-N 3.26Å; L120-A124 VanDerWaalsContact O-CB 3.29Å; L120-A124 WeakPolarHBondContact O-CB 3.42Å; L120-A124 PolarHBondContact O-N 3.18Å
121A79.1Confident73.1Confident41 Ų4176.7 Ų76.734%0.33940%0.403SS..Hα-helixtrans-65.2-44.1174.600000110.8A117 P118 W123 A124 I125A117-A121 WeakPolarHBondContact O-CB 3.33Å; A117-A121 PolarHBondContact O-N 2.92Å; P118-A121 PolarHBondContact O-N 3.44Å; A121-W123 VanDerWaalsContact C-N 3.31Å; A121-W123 PolarHBondContact O-N 3.38Å; A121-A124 PolarHBondContact O-N 2.91Å; A121-I125 VanDerWaalsContact O-CB 3.3Å; A121-I125 WeakPolarHBondContact O-CB 3.48Å; A121-I125 WeakPolarHBondContact O-CD1 3.32Å; A121-I125 WeakPolarHBondContact O-CG1 3.36Å; A121-I125 PolarHBondContact O-N 3.02Å
122Q74.4Confident71.1Confident147 Ų14776.3 Ų76.369%0.68740%0.404SS*.Hα-helixtrans-60.9-39.7175-169.3176.210.700111.8P118 T119 G126P118-Q122 WeakPolarHBondContact O-CB 3.15Å; P118-Q122 PolarHBondContact O-N 3.36Å; T119-Q122 PolarHBondContact O-N 3.13Å; Q122-G126 PolarHBondContact O-N 3.2Å
123W70.2Confident69.7Low122 Ų12277.2 Ų77.246%0.46241%0.409SS..Hα-helixtrans-67.5-44.6173.1-86.4110.8000113.1T119 L120 A121 I125 G126 Q127T119-W123 PolarHBondContact O-N 2.96Å; L120-W123 PolarHBondContact O-N 3.26Å; A121-W123 VanDerWaalsContact C-N 3.31Å; A121-W123 PolarHBondContact O-N 3.38Å; W123-I125 VanDerWaalsContact C-N 3.34Å; W123-G126 CarbonylContact O-C 3.58Å; W123-G126 WeakPolarHBondContact O-CA 3.47Å; W123-G126 PolarHBondContact O-N 3.38Å; W123-G126 VanDerWaalsContact O-N 3.16Å; W123-Q127 WeakPolarHBondContact O-CG 3.46Å; W123-Q127 PolarHBondContact O-N 3Å
124A64.5Low68.6Low36 Ų3681.5 Ų81.530%0.29843%0.432SS..Hα-helixtrans-64.4-39.7178.300000111.6L120 A121 Q127 T128L120-A124 VanDerWaalsContact O-CB 3.29Å; L120-A124 WeakPolarHBondContact O-CB 3.42Å; L120-A124 PolarHBondContact O-N 3.18Å; A121-A124 PolarHBondContact O-N 2.91Å; A124-Q127 PolarHBondContact O-N 3.48Å; A124-T128 VanDerWaalsContact O-CB 3.29Å; A124-T128 WeakPolarHBondContact O-CB 3.45Å; A124-T128 PolarHBondContact O-N 2.9Å; A124-T128 PolarHBondContact O-OG1 2.78Å
125I58Low68.1Low101 Ų10179.6 Ų79.652%0.51843%0.427SS..Hα-helixtrans-64.6-44.7170.7-68.2164.2000109.6A121 W123 Q127 T128 L129A121-I125 VanDerWaalsContact O-CB 3.3Å; A121-I125 WeakPolarHBondContact O-CB 3.48Å; A121-I125 WeakPolarHBondContact O-CD1 3.32Å; A121-I125 WeakPolarHBondContact O-CG1 3.36Å; A121-I125 PolarHBondContact O-N 3.02Å; W123-I125 VanDerWaalsContact C-N 3.34Å; I125-Q127 PolarHBondContact O-N 2.9Å; I125-T128 PolarHBondContact O-N 3.45Å; I125-L129 HydrophobicContact CG2-CD1 3.47Å; I125-L129 VanDerWaalsContact CG2-CD1 3.47Å; I125-L129 HydrophobicContact CG2-CG 4.01Å; I125-L129 WeakPolarHBondContact O-CB 3.42Å; I125-L129 VanDerWaalsContact O-CG 3.23Å; I125-L129 WeakPolarHBondContact O-CG 3.24Å; I125-L129 PolarHBondContact O-N 2.81Å
126G55.5Low67.6Low27 Ų2777.7 Ų77.728%0.27842%0.421SS..Hα-helixtrans-56.4-47.9174.800000112.5Q122 W123 M130Q122-G126 PolarHBondContact O-N 3.2Å; W123-G126 CarbonylContact O-C 3.58Å; W123-G126 WeakPolarHBondContact O-CA 3.47Å; W123-G126 PolarHBondContact O-N 3.38Å; W123-G126 VanDerWaalsContact O-N 3.16Å; G126-M130 WeakPolarHBondContact O-CB 3.41Å; G126-M130 WeakPolarHBondContact O-CG 3.43Å; G126-M130 PolarHBondContact O-N 3.12Å
127Q50.3Low67.4Low94 Ų9479.4 Ų79.444%0.43943%0.428SS..Hα-helixtrans-70.1-34.6177.8-69.6-154.5-5.700113.4W123 A124 I125 M130W123-Q127 WeakPolarHBondContact O-CG 3.46Å; W123-Q127 PolarHBondContact O-N 3Å; A124-Q127 PolarHBondContact O-N 3.48Å; I125-Q127 PolarHBondContact O-N 2.9Å; Q127-M130 PolarHBondContact O-N 3.35Å
128T46Very low67.3Low100 Ų10082.2 Ų82.261%0.61344%0.438SS*.Hα-helixtrans-73.9-40.7176.6-54.90000111.1A124 I125 M130 I131A124-T128 VanDerWaalsContact O-CB 3.29Å; A124-T128 WeakPolarHBondContact O-CB 3.45Å; A124-T128 PolarHBondContact O-N 2.9Å; A124-T128 PolarHBondContact O-OG1 2.78Å; I125-T128 PolarHBondContact O-N 3.45Å; T128-M130 VanDerWaalsContact C-N 3.25Å; T128-M130 PolarHBondContact O-N 2.99Å; T128-I131 PolarHBondContact O-N 2.74Å; T128-I131 VanDerWaalsContact O-N 3.13Å
129L44.7Very low67.1Low103 Ų10386.1 Ų86.154%0.53944%0.441SS..Hα-helixtrans-65.2-29.7171.9-72.9171.5000111.2I125 I131 Q133I125-L129 HydrophobicContact CG2-CD1 3.47Å; I125-L129 VanDerWaalsContact CG2-CD1 3.47Å; I125-L129 HydrophobicContact CG2-CG 4.01Å; I125-L129 WeakPolarHBondContact O-CB 3.42Å; I125-L129 VanDerWaalsContact O-CG 3.23Å; I125-L129 WeakPolarHBondContact O-CG 3.24Å; I125-L129 PolarHBondContact O-N 2.81Å; L129-I131 PolarHBondContact O-N 2.82Å; L129-Q133 WeakPolarHBondContact O-CG 3.11Å
130M46.9Very low67Low120 Ų12089.8 Ų89.859%0.59145%0.452SS*.THydrogen-bonded Turntrans-67.4-10.7173.8-66.4-116.7170.500113.7G126 Q127 T128G126-M130 WeakPolarHBondContact O-CB 3.41Å; G126-M130 WeakPolarHBondContact O-CG 3.43Å; G126-M130 PolarHBondContact O-N 3.12Å; Q127-M130 PolarHBondContact O-N 3.35Å; T128-M130 VanDerWaalsContact C-N 3.25Å; T128-M130 PolarHBondContact O-N 2.99Å
131I52.4Low66.7Low118 Ų11894.9 Ų94.961%0.60547%0.474SS*.EExtended strand (participates in β ladder)trans-97.6106.2172.4-58.6167.7000106.9T128 L129T128-I131 PolarHBondContact O-N 2.74Å; T128-I131 VanDerWaalsContact O-N 3.13Å; L129-I131 PolarHBondContact O-N 2.82Å
132N53.8Low66.6Low78 Ų7893.6 Ų93.642%0.41747%0.466SS..EExtended strand (participates in β ladder)trans73.446.1-178.6-50-40.1000114.8L134 V164 K165 K166N132-L134 PolarHBondContact O-N 3.16Å; N132-L134 VanDerWaalsContact O-N 3.16Å; N132-V164 HydrophobicContact CB-CG1 3.45Å; N132-V164 VanDerWaalsContact CB-CG1 3.45Å; N132-K165 CarbonylContact C-O 3.55Å; N132-K165 WeakPolarHBondContact CA-O 3.43Å; N132-K165 PolarHBondContact N-O 2.82Å; N132-K166 WeakPolarHBondContact OD1-CD 3.39Å; N132-K166 WeakPolarHBondContact OD1-CE 3.09Å; N132-K166 WeakPolarHBondContact OD1-CG 3.35Å
133Q64.1Low66.3Low64 Ų6491.1 Ų91.130%0.29946%0.46SS..EExtended strand (participates in β ladder)trans-59.2121.3172.7-69.6-176.7-26.400110L129 I135 V164 K165L129-Q133 WeakPolarHBondContact O-CG 3.11Å; Q133-I135 WeakPolarHBondContact O-CG1 3.27Å; Q133-I135 PolarHBondContact O-N 2.94Å; Q133-I135 VanDerWaalsContact O-N 3.09Å; Q133-V164 CarbonylContact O-C 3.58Å; Q133-V164 VanDerWaalsContact O-CA 3.27Å; Q133-V164 WeakPolarHBondContact O-CA 3.22Å; Q133-K165 HydrophobicContact CB-CB 3.92Å; Q133-K165 PolarHBondContact N-O 2.81Å; Q133-K165 VanDerWaalsContact N-O 3.12Å; Q133-K165 PolarHBondContact O-N 2.76Å
134L70.2Confident66.1Low95 Ų9588.6 Ų88.650%0.49746%0.459SS..EExtended strand (participates in β ladder)trans-70.4104.1165.7-176.266.2000108N132 D136 L162 V164N132-L134 PolarHBondContact O-N 3.16Å; N132-L134 VanDerWaalsContact O-N 3.16Å; L134-D136 VanDerWaalsContact CD1-O 3.26Å; L134-D136 WeakPolarHBondContact CD1-O 2.86Å; L134-L162 HydrophobicContact CD1-CB 3.57Å; L134-L162 HydrophobicContact CD1-CD2 3.65Å; L134-L162 HydrophobicContact CD1-CG 4.11Å; L134-L162 HydrophobicContact CD2-CD2 4.11Å; L134-V164 HydrophobicContact CD1-CG2 4.25Å
135I81.4Confident65.5Low93 Ų9392.2 Ų92.248%0.47748%0.482SS..EExtended strand (participates in β ladder)trans-86.6-35.1-177.7-45.9171.6000110.7Q133 V163 K165 T170Q133-I135 WeakPolarHBondContact O-CG1 3.27Å; Q133-I135 PolarHBondContact O-N 2.94Å; Q133-I135 VanDerWaalsContact O-N 3.09Å; I135-V163 PolarHBondContact N-O 2.89Å; I135-K165 HydrophobicContact CD1-CB 3.42Å; I135-K165 VanDerWaalsContact CD1-CB 3.42Å; I135-K165 HydrophobicContact CD1-CD 4.01Å; I135-K165 HydrophobicContact CD1-CG 3.71Å; I135-K165 HydrophobicContact CG1-CB 3.73Å; I135-K165 HydrophobicContact CG1-CG 4.47Å; I135-T170 HydrophobicContact CD1-CG2 4.18Å
136D82.4Confident65.3Low83 Ų8389.8 Ų89.844%0.44448%0.482SS..EExtended strand (participates in β ladder)trans-151.2155.3-176.9-163.88.1000110.5L134 V163L134-D136 VanDerWaalsContact CD1-O 3.26Å; L134-D136 WeakPolarHBondContact CD1-O 2.86Å; D136-V163 HydrophobicContact CB-CB 3.77Å; D136-V163 HydrophobicContact CB-CG1 4.45Å; D136-V163 HydrophobicContact CB-CG2 3.85Å; D136-V163 PolarHBondContact N-O 2.79Å; D136-V163 PolarHBondContact O-N 2.83Å
137M82.5Confident65.2Low76 Ų7694.7 Ų94.737%0.37451%0.511SS..EExtended strand (participates in β ladder)trans-139.9112.4176.4178.3176.974.300109.3L160 K161 L162M137-L160 HydrophobicContact CG-CD2 4.11Å; M137-L160 HydrophobicContact SD-CD2 3.93Å; M137-K161 WeakPolarHBondContact CA-O 3.3Å; M137-L162 HydrophobicContact CB-CD2 4.18Å; M137-L162 HydrophobicContact CG-CD2 3.76Å; M137-L162 HydrophobicContact SD-CD2 3.95Å
138E84.3Confident65.2Low81 Ų8195.1 Ų95.138%0.37953%0.525SS..EExtended strand (participates in β ladder)trans-98.8142.8170-65.4169.4-146.200109.2K161E138-K161 HydrophobicContact CB-CB 4.22Å; E138-K161 HydrophobicContact CB-CD 4.4Å; E138-K161 VanDerWaalsContact CD-NZ 3.32Å; E138-K161 PolarHBondContact N-O 3.42Å; E138-K161 PolarHBondContact O-N 2.78Å; E138-K161 IonicContact OE1-NZ 3.73Å; E138-K161 PolarHBondContact OE1-NZ 3.09Å; E138-K161 WeakPolarHBondContact OE2-CD 3.42Å; E138-K161 IonicContact OE2-NZ 3.66Å; E138-K161 PolarHBondContact OE2-NZ 2.81Å
139W80.6Confident65.6Low167 Ų167100 Ų10063%0.63354%0.54SS*.EExtended strand (participates in β ladder)trans-130.1145.7174.363.4-91.2000111F141 L158 Q159 L160W139-F141 HydrophobicContact CE3-CB 4.31Å; W139-F141 HydrophobicContact CZ3-CB 3.94Å; W139-L158 HydrophobicContact CB-CD1 4.3Å; W139-L158 HydrophobicContact CE3-CD1 3.91Å; W139-Q159 CarbonylContact C-O 3.58Å; W139-Q159 WeakPolarHBondContact CA-O 3.16Å; W139-L160 HydrophobicContact CB-CD2 3.73Å
140K82.5Confident65.8Low136 Ų136102.5 Ų102.559%0.59155%0.554SS**EExtended strand (participates in β ladder)trans-130.2126.9173.5-66.3-177.1-178.6178.50109.3Q159K140-Q159 HydrophobicContact CB-CB 4.43Å; K140-Q159 PolarHBondContact N-O 2.73Å; K140-Q159 PolarHBondContact O-N 2.81Å
141F77.8Confident65.7Low110 Ų110105.9 Ų105.948%0.48257%0.568SS.*EExtended strand (participates in β ladder)trans-96.2117.5176.4-174.2-98.6000109.5W139 V143 I156 L158W139-F141 HydrophobicContact CE3-CB 4.31Å; W139-F141 HydrophobicContact CZ3-CB 3.94Å; F141-V143 HydrophobicContact CD1-CG2 3.99Å; F141-V143 HydrophobicContact CE1-CG2 3.41Å; F141-V143 VanDerWaalsContact CE1-CG2 3.41Å; F141-V143 HydrophobicContact CZ-CG2 4.25Å; F141-I156 HydrophobicContact CD2-CG2 4.45Å; F141-I156 HydrophobicContact CE1-CG2 4.29Å; F141-I156 HydrophobicContact CE2-CG2 3.43Å; F141-I156 VanDerWaalsContact CE2-CG2 3.43Å; F141-I156 HydrophobicContact CZ-CG2 3.33Å; F141-L158 HydrophobicContact CB-CD1 4.35Å; F141-L158 HydrophobicContact CD2-CD1 4.25Å
142G76.4Confident65.5Low15 Ų15109.2 Ų109.216%0.15558%0.578CS.*EExtended strand (participates in β ladder)trans-105.9128.5-179.600000111.4F157G142-F157 PolarHBondContact N-O 2.75Å; G142-F157 PolarHBondContact O-N 2.82Å; G142-F157 VanDerWaalsContact O-N 3.08Å
143V68.9Low65.1Low94 Ų94112.1 Ų112.157%0.5760%0.599SS**EExtended strand (participates in β ladder)trans-116.7114.1166.7-176.60000107.2F141F141-V143 HydrophobicContact CD1-CG2 3.99Å; F141-V143 HydrophobicContact CE1-CG2 3.41Å; F141-V143 VanDerWaalsContact CE1-CG2 3.41Å; F141-V143 HydrophobicContact CZ-CG2 4.25Å
144T64.2Low64.6Low70 Ų70110.4 Ų110.443%0.42960%0.598SS.*  trans-90.7110.2175.4-52.70000109G146 G154T144-G146 PolarHBondContact O-N 2.81Å; T144-G154 VanDerWaalsContact O-CA 3.25Å; T144-G154 WeakPolarHBondContact O-CA 2.83Å
145S53.3Low64Low112 Ų112109.5 Ų109.578%0.78360%0.6SS**  trans-75.7111.7172.247.80000110.4
146G54.1Low63.3Low50 Ų50108.2 Ų108.252%0.51559%0.593SS.*  trans-77.3123.6170.600000110.5T144T144-G146 PolarHBondContact O-N 2.81Å
147S52Low63.1Low129 Ų129106.8 Ų106.890%0.90258%0.583SS**  trans-89.62.3-177.8179.10000114.5
148S51.8Low63Low104 Ų104103.8 Ų103.873%0.72757%0.568SS**SBendtrans-137.5125.6-175.955.10000112L150S148-L150 PolarHBondContact O-N 3.41Å
149E52.7Low62.9Low201 Ų201103.4 Ų103.494%0.93957%0.566SS**SBendtrans-63.190.1176.5-68.1158.2149.200111.2
150L49.6Very low63Low157 Ų15795.7 Ų95.782%0.82254%0.538SS*.SBendtrans-174109.8134-136.154.5000109S148 K152S148-L150 PolarHBondContact O-N 3.41Å; L150-K152 PolarHBondContact O-N 2.92Å
151E45.8Very low63.3Low191 Ų19191.1 Ų91.189%0.89352%0.518SS*.SBendtrans6713.1163.9-59.5-160.5164.500121.8
152K47.4Very low63.6Low187 Ų18787.1 Ų87.181%0.81350%0.502SS*.  trans-123.170.5162.4-79-175.8179.1178.60112L150 G154L150-K152 PolarHBondContact O-N 2.92Å; K152-G154 PolarHBondContact O-N 3.36Å
153V45.9Very low64.1Low140 Ų14087.2 Ų87.285%0.84850%0.499SS*.  trans-56.2123.2159.7176.10000107.6S155V153-S155 PolarHBondContact O-N 2.9Å
154G53.3Low64.8Low28 Ų2883.5 Ų83.529%0.28948%0.476SS..  trans24.873.2150.600000116.2T144 K152 I156T144-G154 VanDerWaalsContact O-CA 3.25Å; T144-G154 WeakPolarHBondContact O-CA 2.83Å; K152-G154 PolarHBondContact O-N 3.36Å; G154-I156 VanDerWaalsContact C-N 3.35Å; G154-I156 PolarHBondContact O-N 3.35Å
155S57.9Low65.4Low75 Ų7584 Ų8452%0.52447%0.473SS..  trans-69.4100.2175.758.30000107.9V153 F157V153-S155 PolarHBondContact O-N 2.9Å; S155-F157 WeakPolarHBondContact O-CD1 3.23Å
156I65.9Low66.3Low66 Ų6683.1 Ų83.134%0.33846%0.455SS..EExtended strand (participates in β ladder)trans-76.4121.9173-61.5171.7000107.2F141 G154 L179F141-I156 HydrophobicContact CD2-CG2 4.45Å; F141-I156 HydrophobicContact CE1-CG2 4.29Å; F141-I156 HydrophobicContact CE2-CG2 3.43Å; F141-I156 VanDerWaalsContact CE2-CG2 3.43Å; F141-I156 HydrophobicContact CZ-CG2 3.33Å; G154-I156 VanDerWaalsContact C-N 3.35Å; G154-I156 PolarHBondContact O-N 3.35Å; I156-L179 HydrophobicContact CG2-CB 4.49Å; I156-L179 HydrophobicContact CG2-CD1 4.46Å
157F77.2Confident67Low54 Ų5483 Ų8324%0.23745%0.454CS..EExtended strand (participates in β ladder)trans-134.8150.7175.866.3-88.1000110.6G142 S155 E176 L177G142-F157 PolarHBondContact N-O 2.75Å; G142-F157 PolarHBondContact O-N 2.82Å; G142-F157 VanDerWaalsContact O-N 3.08Å; S155-F157 WeakPolarHBondContact O-CD1 3.23Å; F157-E176 HydrophobicContact CB-CG 4.09Å; F157-E176 HydrophobicContact CD2-CG 3.92Å; F157-E176 HydrophobicContact CG-CG 4.35Å; F157-L177 WeakPolarHBondContact CA-O 3.2Å
158L80.6Confident67.5Low12 Ų1284.9 Ų84.96%0.06345%0.454CS..EExtended strand (participates in β ladder)trans-112.6122173.8-174.778.2000108.4W139 F141 L160 E176 L177 F182W139-L158 HydrophobicContact CB-CD1 4.3Å; W139-L158 HydrophobicContact CE3-CD1 3.91Å; F141-L158 HydrophobicContact CB-CD1 4.35Å; F141-L158 HydrophobicContact CD2-CD1 4.25Å; L158-L160 HydrophobicContact CD2-CD1 4.19Å; L158-L160 HydrophobicContact CD2-CD2 4.21Å; L158-L160 HydrophobicContact CD2-CG 4Å; L158-L160 HydrophobicContact CG-CG 4.37Å; L158-E176 CarbonylContact O-C 3.59Å; L158-E176 WeakPolarHBondContact O-CA 3.47Å; L158-L177 PolarHBondContact N-O 3.27Å; L158-L177 PolarHBondContact O-N 3.35Å; L158-F182 HydrophobicContact CD2-CB 4.33Å; L158-F182 HydrophobicContact CD2-CD2 3.22Å; L158-F182 HydrophobicContact CD2-CE2 3.59Å; L158-F182 HydrophobicContact CD2-CG 3.85Å; L158-F182 HydrophobicContact CD2-CZ 4.48Å
159Q82.8Confident68.3Low73 Ų7387.2 Ų87.234%0.34145%0.453SS..EExtended strand (participates in β ladder)trans-98.8114.4171.7-167.9177.24200109.1W139 K140 I175W139-Q159 CarbonylContact C-O 3.58Å; W139-Q159 WeakPolarHBondContact CA-O 3.16Å; K140-Q159 HydrophobicContact CB-CB 4.43Å; K140-Q159 PolarHBondContact N-O 2.73Å; K140-Q159 PolarHBondContact O-N 2.81Å; Q159-I175 CarbonylContact C-O 3.55Å; Q159-I175 WeakPolarHBondContact CA-O 3.42Å
160L83.4Confident69.8Low6 Ų681.6 Ų81.63%0.03143%0.433CS..EExtended strand (participates in β ladder)trans-97135.8173.3-72.3163.8000109.5M137 W139 L158 Y174 I175 L177 F185M137-L160 HydrophobicContact CG-CD2 4.11Å; M137-L160 HydrophobicContact SD-CD2 3.93Å; W139-L160 HydrophobicContact CB-CD2 3.73Å; L158-L160 HydrophobicContact CD2-CD1 4.19Å; L158-L160 HydrophobicContact CD2-CD2 4.21Å; L158-L160 HydrophobicContact CD2-CG 4Å; L158-L160 HydrophobicContact CG-CG 4.37Å; L160-Y174 CarbonylContact O-C 3.54Å; L160-Y174 WeakPolarHBondContact O-CA 3.41Å; L160-I175 HydrophobicContact CB-CB 4.33Å; L160-I175 PolarHBondContact N-O 2.84Å; L160-I175 PolarHBondContact O-N 3.43Å; L160-L177 HydrophobicContact CD1-CD1 3.52Å; L160-L177 HydrophobicContact CD1-CG 4.3Å; L160-F185 HydrophobicContact CD1-CE1 4.37Å
161K88.2Confident71.4Confident39 Ų3978.3 Ų78.317%0.1741%0.413CS..EExtended strand (participates in β ladder)trans-118111.5167.9173.7-164.4170.4-156.70107.4M137 E138 N172 V173 Y174M137-K161 WeakPolarHBondContact CA-O 3.3Å; E138-K161 HydrophobicContact CB-CB 4.22Å; E138-K161 HydrophobicContact CB-CD 4.4Å; E138-K161 VanDerWaalsContact CD-NZ 3.32Å; E138-K161 PolarHBondContact N-O 3.42Å; E138-K161 PolarHBondContact O-N 2.78Å; E138-K161 IonicContact OE1-NZ 3.73Å; E138-K161 PolarHBondContact OE1-NZ 3.09Å; E138-K161 WeakPolarHBondContact OE2-CD 3.42Å; E138-K161 IonicContact OE2-NZ 3.66Å; E138-K161 PolarHBondContact OE2-NZ 2.81Å; K161-N172 HydrophobicContact CG-CB 4.42Å; K161-V173 CarbonylContact C-O 3.58Å; K161-V173 WeakPolarHBondContact CA-O 3.43Å; K161-Y174 HydrophobicContact CB-CD1 3.9Å; K161-Y174 HydrophobicContact CB-CE1 3.81Å; K161-Y174 HydrophobicContact CD-CE1 3.79Å; K161-Y174 HydrophobicContact CG-CD1 4.07Å; K161-Y174 HydrophobicContact CG-CE1 3.6Å
162L84.6Confident73.4Confident27 Ų2772.7 Ų72.714%0.14139%0.389CS..EExtended strand (participates in β ladder)trans-94.9125.6176.2-59.4177.3000108.6L134 M137 V164 N172 V173 I175L134-L162 HydrophobicContact CD1-CB 3.57Å; L134-L162 HydrophobicContact CD1-CD2 3.65Å; L134-L162 HydrophobicContact CD1-CG 4.11Å; L134-L162 HydrophobicContact CD2-CD2 4.11Å; M137-L162 HydrophobicContact CB-CD2 4.18Å; M137-L162 HydrophobicContact CG-CD2 3.76Å; M137-L162 HydrophobicContact SD-CD2 3.95Å; L162-V164 HydrophobicContact CB-CG2 4.2Å; L162-N172 CarbonylContact O-C 3.45Å; L162-N172 WeakPolarHBondContact O-CA 3.37Å; L162-V173 HydrophobicContact CB-CB 4.28Å; L162-V173 PolarHBondContact N-O 3.47Å; L162-V173 PolarHBondContact O-N 3.18Å; L162-I175 HydrophobicContact CD1-CD1 3.64Å; L162-I175 HydrophobicContact CG-CD1 4.47Å
163V86.6Confident75.2Confident16 Ų1666.3 Ų66.310%0.09737%0.365CS..EExtended strand (participates in β ladder)trans-98.7107.7176.5-176.90000107.8I135 D136 T170I135-V163 PolarHBondContact N-O 2.89Å; D136-V163 HydrophobicContact CB-CB 3.77Å; D136-V163 HydrophobicContact CB-CG1 4.45Å; D136-V163 HydrophobicContact CB-CG2 3.85Å; D136-V163 PolarHBondContact N-O 2.79Å; D136-V163 PolarHBondContact O-N 2.83Å; V163-T170 HydrophobicContact CG1-CG2 3.17Å
164V83.9Confident77Confident16 Ų1666.2 Ų66.210%0.09735%0.351CS..EExtended strand (participates in β ladder)trans-112.4125.8-168.5178.50000110.6N132 Q133 L134 L162 K166 T170 E171 V173N132-V164 HydrophobicContact CB-CG1 3.45Å; N132-V164 VanDerWaalsContact CB-CG1 3.45Å; Q133-V164 CarbonylContact O-C 3.58Å; Q133-V164 VanDerWaalsContact O-CA 3.27Å; Q133-V164 WeakPolarHBondContact O-CA 3.22Å; L134-V164 HydrophobicContact CD1-CG2 4.25Å; L162-V164 HydrophobicContact CB-CG2 4.2Å; V164-K166 PolarHBondContact O-N 2.79Å; V164-T170 CarbonylContact O-C 3.56Å; V164-T170 WeakPolarHBondContact O-CA 3.26Å; V164-E171 PolarHBondContact N-O 3.01Å; V164-E171 PolarHBondContact O-N 3.29Å; V164-V173 HydrophobicContact CG2-CG2 4.33Å
165K76.4Confident78.3Confident81 Ų8167.7 Ų67.735%0.35235%0.352SS..EExtended strand (participates in β ladder)trans-83.1112.3173.3-148.1-179.5176.2178.70110.9N132 Q133 I135 G167 Q169N132-K165 CarbonylContact C-O 3.55Å; N132-K165 WeakPolarHBondContact CA-O 3.43Å; N132-K165 PolarHBondContact N-O 2.82Å; Q133-K165 HydrophobicContact CB-CB 3.92Å; Q133-K165 PolarHBondContact N-O 2.81Å; Q133-K165 VanDerWaalsContact N-O 3.12Å; Q133-K165 PolarHBondContact O-N 2.76Å; I135-K165 HydrophobicContact CD1-CB 3.42Å; I135-K165 VanDerWaalsContact CD1-CB 3.42Å; I135-K165 HydrophobicContact CD1-CD 4.01Å; I135-K165 HydrophobicContact CD1-CG 3.71Å; I135-K165 HydrophobicContact CG1-CB 3.73Å; I135-K165 HydrophobicContact CG1-CG 4.47Å; K165-G167 VanDerWaalsContact CE-O 3.24Å; K165-G167 WeakPolarHBondContact CE-O 3.48Å; K165-Q169 CarbonylContact C-O 3.6Å
166K72Confident79.5Confident94 Ų9470.1 Ų70.141%0.40936%0.355SS..EExtended strand (participates in β ladder)trans-102.587.4168.9-83.5175.7-172.81780109.3N132 V164 N168 Q169 E171N132-K166 WeakPolarHBondContact OD1-CD 3.39Å; N132-K166 WeakPolarHBondContact OD1-CE 3.09Å; N132-K166 WeakPolarHBondContact OD1-CG 3.35Å; V164-K166 PolarHBondContact O-N 2.79Å; K166-N168 PolarHBondContact O-N 3.48Å; K166-N168 VanDerWaalsContact O-N 3.11Å; K166-Q169 CarbonylContact C-O 3.3Å; K166-Q169 PolarHBondContact N-O 3.46Å; K166-Q169 PolarHBondContact O-N 2.92Å; K166-Q169 VanDerWaalsContact O-N 3.08Å; K166-E171 WeakPolarHBondContact CD-OE2 3.26Å; K166-E171 WeakPolarHBondContact CE-OE2 3.42Å; K166-E171 IonicContact NZ-OE1 2.73Å; K166-E171 IonicContact NZ-OE2 3.27Å; K166-E171 PolarHBondContact NZ-OE2 3.19Å
167G68.6Low80.2Confident48 Ų4868.1 Ų68.150%0.49535%0.345SS..THydrogen-bonded Turntrans64.8-110.7-176.700000111.9K165K165-G167 VanDerWaalsContact CE-O 3.24Å; K165-G167 WeakPolarHBondContact CE-O 3.48Å
168N63.3Low80.5Confident168 Ų16868.8 Ų68.890%0.89835%0.353SS*.THydrogen-bonded Turntrans-94.8-2.9176.8-823.7000114.1K166K166-N168 PolarHBondContact O-N 3.48Å; K166-N168 VanDerWaalsContact O-N 3.11Å
169Q69.1Low80.5Confident152 Ų15271.3 Ų71.371%0.7137%0.366SS*.EExtended strand (participates in β ladder)trans-109.1148.5-179.6-66.9-179.3-6.900110.7K165 K166K165-Q169 CarbonylContact C-O 3.6Å; K166-Q169 CarbonylContact C-O 3.3Å; K166-Q169 PolarHBondContact N-O 3.46Å; K166-Q169 PolarHBondContact O-N 2.92Å; K166-Q169 VanDerWaalsContact O-N 3.08Å
170T82.8Confident80.4Confident84 Ų8472.2 Ų72.252%0.51538%0.378SS..EExtended strand (participates in β ladder)trans-110.2127.3174.4-54.70000108.5I135 V163 V164I135-T170 HydrophobicContact CD1-CG2 4.18Å; V163-T170 HydrophobicContact CG1-CG2 3.17Å; V164-T170 CarbonylContact O-C 3.56Å; V164-T170 WeakPolarHBondContact O-CA 3.26Å
171E84.4Confident80.2Confident87 Ų8776.8 Ų76.841%0.40740%0.4SS..EExtended strand (participates in β ladder)trans-116.2139179.5-172.9178.9169.200110.3V164 K166V164-E171 PolarHBondContact N-O 3.01Å; V164-E171 PolarHBondContact O-N 3.29Å; K166-E171 WeakPolarHBondContact CD-OE2 3.26Å; K166-E171 WeakPolarHBondContact CE-OE2 3.42Å; K166-E171 IonicContact NZ-OE1 2.73Å; K166-E171 IonicContact NZ-OE2 3.27Å; K166-E171 PolarHBondContact NZ-OE2 3.19Å
172N87.9Confident79.9Confident73 Ų7377.7 Ų77.739%0.3940%0.404SS..EExtended strand (participates in β ladder)trans-99.2116.2175.4-63.2-27.2000109.3K161 L162 Y174K161-N172 HydrophobicContact CG-CB 4.42Å; L162-N172 CarbonylContact O-C 3.45Å; L162-N172 WeakPolarHBondContact O-CA 3.37Å; N172-Y174 HydrophobicContact CB-CE2 3.77Å
173V83.6Confident79.8Confident53 Ų5383.2 Ų83.232%0.32142%0.424SS..EExtended strand (participates in β ladder)trans-101.8123.9175.1-179.50000108.8K161 L162 V164 I175K161-V173 CarbonylContact C-O 3.58Å; K161-V173 WeakPolarHBondContact CA-O 3.43Å; L162-V173 HydrophobicContact CB-CB 4.28Å; L162-V173 PolarHBondContact N-O 3.47Å; L162-V173 PolarHBondContact O-N 3.18Å; V164-V173 HydrophobicContact CG2-CG2 4.33Å; V173-I175 HydrophobicContact CG1-CG1 4.22Å
174Y83.6Confident79.7Confident138 Ų13886.1 Ų86.154%0.54145%0.445SS..EExtended strand (participates in β ladder)trans-103.7129.5179.3-63-91.2000110.2L160 K161 N172L160-Y174 CarbonylContact O-C 3.54Å; L160-Y174 WeakPolarHBondContact O-CA 3.41Å; K161-Y174 HydrophobicContact CB-CD1 3.9Å; K161-Y174 HydrophobicContact CB-CE1 3.81Å; K161-Y174 HydrophobicContact CD-CE1 3.79Å; K161-Y174 HydrophobicContact CG-CD1 4.07Å; K161-Y174 HydrophobicContact CG-CE1 3.6Å; N172-Y174 HydrophobicContact CB-CE2 3.77Å
175I82.4Confident79.5Confident60 Ų6089 Ų8931%0.30846%0.456SS..EExtended strand (participates in β ladder)trans-128.7130.5179.8-53.2176.3000107.8Q159 L160 L162 V173 L177Q159-I175 CarbonylContact C-O 3.55Å; Q159-I175 WeakPolarHBondContact CA-O 3.42Å; L160-I175 HydrophobicContact CB-CB 4.33Å; L160-I175 PolarHBondContact N-O 2.84Å; L160-I175 PolarHBondContact O-N 3.43Å; L162-I175 HydrophobicContact CD1-CD1 3.64Å; L162-I175 HydrophobicContact CG-CD1 4.47Å; V173-I175 HydrophobicContact CG1-CG1 4.22Å; I175-L177 HydrophobicContact CG2-CD2 3.69Å; I175-L177 HydrophobicContact CG2-CG 3.95Å
176E83Confident79.7Confident125 Ų12588.7 Ų88.758%0.58446%0.458SS*.EExtended strand (participates in β ladder)trans-104.9124.9169.4-168.4173105.100108.9F157 L158F157-E176 HydrophobicContact CB-CG 4.09Å; F157-E176 HydrophobicContact CD2-CG 3.92Å; F157-E176 HydrophobicContact CG-CG 4.35Å; L158-E176 CarbonylContact O-C 3.59Å; L158-E176 WeakPolarHBondContact O-CA 3.47Å
177L79.7Confident80.2Confident25 Ų2589 Ų8913%0.13146%0.461CS..EExtended strand (participates in β ladder)trans-117138.2178.9-60.5179000109.8F157 L158 L160 I175 Q181 F185F157-L177 WeakPolarHBondContact CA-O 3.2Å; L158-L177 PolarHBondContact N-O 3.27Å; L158-L177 PolarHBondContact O-N 3.35Å; L160-L177 HydrophobicContact CD1-CD1 3.52Å; L160-L177 HydrophobicContact CD1-CG 4.3Å; I175-L177 HydrophobicContact CG2-CD2 3.69Å; I175-L177 HydrophobicContact CG2-CG 3.95Å; L177-Q181 HydrophobicContact CB-CB 4.22Å; L177-Q181 HydrophobicContact CD2-CB 4.13Å; L177-F185 HydrophobicContact CD1-CB 4.33Å; L177-F185 HydrophobicContact CD1-CG 4.43Å
178T83.3Confident80.8Confident68 Ų6890.8 Ų90.842%0.41746%0.456SS..EExtended strand (participates in β ladder)trans-70.9160.7161.961.80000110.2Q181 F182T178-Q181 PolarHBondContact O-N 2.99Å; T178-Q181 VanDerWaalsContact O-N 3.1Å; T178-Q181 VanDerWaalsContact OG1-CG 3.28Å; T178-Q181 WeakPolarHBondContact OG1-CG 3.24Å; T178-Q181 PolarHBondContact OG1-OE1 3.09Å; T178-F182 PolarHBondContact O-N 2.95Å
179L80.2Confident81.3Confident64 Ų6487.2 Ų87.234%0.33544%0.435SS..Hα-helixtrans-55.4-43.2179.9-169.468.8000113.7I156 Q181 F182 Y183I156-L179 HydrophobicContact CG2-CB 4.49Å; I156-L179 HydrophobicContact CG2-CD1 4.46Å; L179-Q181 PolarHBondContact O-N 3.31Å; L179-F182 PolarHBondContact O-N 3.44Å; L179-Y183 HydrophobicContact CD1-CE2 3.91Å; L179-Y183 HydrophobicContact CD2-CE2 4.33Å; L179-Y183 HydrophobicContact CG-CD2 4.25Å; L179-Y183 HydrophobicContact CG-CE2 3.78Å; L179-Y183 VanDerWaalsContact O-CD2 3.23Å; L179-Y183 WeakPolarHBondContact O-CD2 3.34Å; L179-Y183 PolarHBondContact O-N 3.49Å
180P82.3Confident81.7Confident92 Ų9284.1 Ų84.160%0.59742%0.421SS*.Hα-helixtrans-62.7-41.7174.6-22.934.8000113.2F182 Y183 S184P180-F182 VanDerWaalsContact C-N 3.28Å; P180-F182 PolarHBondContact O-N 3.17Å; P180-Y183 PolarHBondContact O-N 3.2Å; P180-S184 PolarHBondContact O-N 3.36Å; P180-S184 VanDerWaalsContact O-N 3.09Å; P180-S184 PolarHBondContact O-OG 3.11Å
181Q78.8Confident81.3Confident102 Ų10286.5 Ų86.548%0.47742%0.42SS..Hα-helixtrans-64.4-34.2178.5-70.6167.8-38.300112L177 T178 L179 S184 F185L177-Q181 HydrophobicContact CB-CB 4.22Å; L177-Q181 HydrophobicContact CD2-CB 4.13Å; T178-Q181 PolarHBondContact O-N 2.99Å; T178-Q181 VanDerWaalsContact O-N 3.1Å; T178-Q181 VanDerWaalsContact OG1-CG 3.28Å; T178-Q181 WeakPolarHBondContact OG1-CG 3.24Å; T178-Q181 PolarHBondContact OG1-OE1 3.09Å; L179-Q181 PolarHBondContact O-N 3.31Å; Q181-S184 PolarHBondContact O-N 3.02Å; Q181-F185 WeakPolarHBondContact O-CB 3.49Å; Q181-F185 PolarHBondContact O-N 2.95Å
182F81.4Confident80.7Confident59 Ų5986.2 Ų86.226%0.25942%0.424SS..Hα-helixtrans-63.5-45.8174.1172.1-110.9000112.4L158 T178 L179 P180 S184 F185 L186L158-F182 HydrophobicContact CD2-CB 4.33Å; L158-F182 HydrophobicContact CD2-CD2 3.22Å; L158-F182 HydrophobicContact CD2-CE2 3.59Å; L158-F182 HydrophobicContact CD2-CG 3.85Å; L158-F182 HydrophobicContact CD2-CZ 4.48Å; T178-F182 PolarHBondContact O-N 2.95Å; L179-F182 PolarHBondContact O-N 3.44Å; P180-F182 VanDerWaalsContact C-N 3.28Å; P180-F182 PolarHBondContact O-N 3.17Å; F182-S184 VanDerWaalsContact C-N 3.33Å; F182-S184 PolarHBondContact O-N 3.17Å; F182-F185 WeakPolarHBondContact O-CB 3.32Å; F182-F185 PolarHBondContact O-N 2.95Å; F182-L186 HydrophobicContact CZ-CD1 4.21Å; F182-L186 PolarHBondContact O-N 2.88Å
183Y82.1Confident79.8Confident142 Ų14288.7 Ų88.756%0.55743%0.428SS*.Hα-helixtrans-64-39.2177.2-75.6-66.4000112.4L179 P180 F185 L186 H187L179-Y183 HydrophobicContact CD1-CE2 3.91Å; L179-Y183 HydrophobicContact CD2-CE2 4.33Å; L179-Y183 HydrophobicContact CG-CD2 4.25Å; L179-Y183 HydrophobicContact CG-CE2 3.78Å; L179-Y183 VanDerWaalsContact O-CD2 3.23Å; L179-Y183 WeakPolarHBondContact O-CD2 3.34Å; L179-Y183 PolarHBondContact O-N 3.49Å; P180-Y183 PolarHBondContact O-N 3.2Å; Y183-F185 VanDerWaalsContact C-N 3.34Å; Y183-L186 PolarHBondContact O-N 2.84Å; Y183-H187 WeakPolarHBondContact O-CB 3.47Å; Y183-H187 PolarHBondContact O-N 3.39Å; Y183-H187 VanDerWaalsContact O-N 3.09Å
184S84.2Confident79.1Confident77 Ų7790.2 Ų90.254%0.53844%0.437SS..Hα-helixtrans-61.1-44.2172.2-59.50000111.7P180 Q181 F182 H187 E188P180-S184 PolarHBondContact O-N 3.36Å; P180-S184 VanDerWaalsContact O-N 3.09Å; P180-S184 PolarHBondContact O-OG 3.11Å; Q181-S184 PolarHBondContact O-N 3.02Å; F182-S184 VanDerWaalsContact C-N 3.33Å; F182-S184 PolarHBondContact O-N 3.17Å; S184-H187 PolarHBondContact O-N 3.27Å; S184-E188 WeakPolarHBondContact O-CG 3.49Å; S184-E188 PolarHBondContact O-N 3.42Å; S184-E188 VanDerWaalsContact O-N 3.11Å
185F80.4Confident77.9Confident77 Ų7786.9 Ų86.934%0.33843%0.434SS..Hα-helixtrans-62.1-45.5178177.5-103.4000112.4L160 L177 Q181 F182 Y183 H187 E188 M189L160-F185 HydrophobicContact CD1-CE1 4.37Å; L177-F185 HydrophobicContact CD1-CB 4.33Å; L177-F185 HydrophobicContact CD1-CG 4.43Å; Q181-F185 WeakPolarHBondContact O-CB 3.49Å; Q181-F185 PolarHBondContact O-N 2.95Å; F182-F185 WeakPolarHBondContact O-CB 3.32Å; F182-F185 PolarHBondContact O-N 2.95Å; Y183-F185 VanDerWaalsContact C-N 3.34Å; F185-H187 PolarHBondContact O-N 2.78Å; F185-E188 PolarHBondContact O-N 2.84Å; F185-M189 HydrophobicContact CD1-CG 4.49Å; F185-M189 HydrophobicContact CD1-SD 3.99Å; F185-M189 HydrophobicContact CE1-CG 4.1Å; F185-M189 HydrophobicContact CE1-SD 3.24Å; F185-M189 WeakPolarHBondContact CE1-SD 3.28Å; F185-M189 HydrophobicContact CE2-CG 4.38Å; F185-M189 HydrophobicContact CE2-SD 4.37Å; F185-M189 HydrophobicContact CZ-CG 4.03Å; F185-M189 HydrophobicContact CZ-SD 3.47Å; F185-M189 WeakPolarHBondContact CZ-SD 3.45Å; F185-M189 WeakPolarHBondContact O-CG 3.39Å; F185-M189 PolarHBondContact O-N 3.04Å
186L81.3Confident76.6Confident74 Ų7489.7 Ų89.739%0.38745%0.448SS..Hα-helixtrans-58.3-47.7177.2-169.8100.1000111.4F182 Y183 E188 M189 E190F182-L186 HydrophobicContact CZ-CD1 4.21Å; F182-L186 PolarHBondContact O-N 2.88Å; Y183-L186 PolarHBondContact O-N 2.84Å; L186-E188 VanDerWaalsContact C-N 3.33Å; L186-E188 PolarHBondContact O-N 3.08Å; L186-M189 WeakPolarHBondContact O-CB 3.48Å; L186-M189 PolarHBondContact O-N 2.98Å; L186-E190 WeakPolarHBondContact O-CG 3.46Å; L186-E190 PolarHBondContact O-N 3.27Å
187H82.8Confident75.3Confident101 Ų10189.4 Ų89.447%0.46845%0.446SS..Hα-helixtrans-59.4-43178.8177.6-95.1000112.3Y183 S184 F185 E190 R191Y183-H187 WeakPolarHBondContact O-CB 3.47Å; Y183-H187 PolarHBondContact O-N 3.39Å; Y183-H187 VanDerWaalsContact O-N 3.09Å; S184-H187 PolarHBondContact O-N 3.27Å; F185-H187 PolarHBondContact O-N 2.78Å; H187-E190 PolarHBondContact O-N 3.33Å; H187-R191 WeakPolarHBondContact CE1-CD 3.23Å; H187-R191 WeakPolarHBondContact O-CG 3.34Å; H187-R191 PolarHBondContact O-N 2.84Å
188E79.4Confident73.7Confident86 Ų8693.4 Ų93.440%0.40248%0.475SS..Hα-helixtrans-66.3-38176.6-67.2-53.8111.900112.2S184 F185 L186 E190 R191 V192S184-E188 WeakPolarHBondContact O-CG 3.49Å; S184-E188 PolarHBondContact O-N 3.42Å; S184-E188 VanDerWaalsContact O-N 3.11Å; F185-E188 PolarHBondContact O-N 2.84Å; L186-E188 VanDerWaalsContact C-N 3.33Å; L186-E188 PolarHBondContact O-N 3.08Å; E188-E190 VanDerWaalsContact C-N 3.35Å; E188-E190 PolarHBondContact O-N 3.27Å; E188-R191 VanDerWaalsContact CD-NH1 3.26Å; E188-R191 PolarHBondContact O-N 3.32Å; E188-R191 IonicContact OE1-CZ 3.78Å; E188-R191 IonicContact OE1-NH1 2.78Å; E188-R191 PolarHBondContact OE1-NH1 2.87Å; E188-R191 IonicContact OE2-CZ 3.75Å; E188-R191 IonicContact OE2-NH1 2.95Å; E188-R191 PolarHBondContact OE2-NH1 3.1Å; E188-V192 VanDerWaalsContact O-CG2 3.32Å; E188-V192 WeakPolarHBondContact O-CG2 3.43Å; E188-V192 PolarHBondContact O-N 3.01Å
189M75.6Confident71.6Confident93 Ų9398.8 Ų98.846%0.45849%0.493SS..Hα-helixtrans-62-40.8173.4-71.7-171.473.600112.4F185 L186 V192 R193F185-M189 HydrophobicContact CD1-CG 4.49Å; F185-M189 HydrophobicContact CD1-SD 3.99Å; F185-M189 HydrophobicContact CE1-CG 4.1Å; F185-M189 HydrophobicContact CE1-SD 3.24Å; F185-M189 WeakPolarHBondContact CE1-SD 3.28Å; F185-M189 HydrophobicContact CE2-CG 4.38Å; F185-M189 HydrophobicContact CE2-SD 4.37Å; F185-M189 HydrophobicContact CZ-CG 4.03Å; F185-M189 HydrophobicContact CZ-SD 3.47Å; F185-M189 WeakPolarHBondContact CZ-SD 3.45Å; F185-M189 WeakPolarHBondContact O-CG 3.39Å; F185-M189 PolarHBondContact O-N 3.04Å; L186-M189 WeakPolarHBondContact O-CB 3.48Å; L186-M189 PolarHBondContact O-N 2.98Å; M189-V192 PolarHBondContact O-N 3.26Å; M189-R193 PolarHBondContact O-N 3.49Å
190E76.8Confident69.6Low86 Ų86104.1 Ų104.140%0.40253%0.534SS..Hα-helixtrans-65.4-40.8176.9-69.7-167.9132.100112.2L186 H187 E188 V192 R193 T194L186-E190 WeakPolarHBondContact O-CG 3.46Å; L186-E190 PolarHBondContact O-N 3.27Å; H187-E190 PolarHBondContact O-N 3.33Å; E188-E190 VanDerWaalsContact C-N 3.35Å; E188-E190 PolarHBondContact O-N 3.27Å; E190-V192 VanDerWaalsContact C-N 3.35Å; E190-V192 PolarHBondContact O-N 3.39Å; E190-R193 WeakPolarHBondContact O-CB 3.47Å; E190-R193 PolarHBondContact O-N 3.2Å; E190-R193 IonicContact OE1-NH2 3.38Å; E190-R193 PolarHBondContact OE1-NH2 3.47Å; E190-T194 PolarHBondContact O-N 3.49Å; E190-T194 PolarHBondContact O-OG1 2.9Å
191R74.6Confident69Low135 Ų135104.7 Ų104.751%0.50953%0.53SS..Hα-helixtrans-61.5-42.1174.1-73.7177.261.8-157.40.1112.4H187 E188 T194 S195H187-R191 WeakPolarHBondContact CE1-CD 3.23Å; H187-R191 WeakPolarHBondContact O-CG 3.34Å; H187-R191 PolarHBondContact O-N 2.84Å; E188-R191 VanDerWaalsContact CD-NH1 3.26Å; E188-R191 PolarHBondContact O-N 3.32Å; E188-R191 IonicContact OE1-CZ 3.78Å; E188-R191 IonicContact OE1-NH1 2.78Å; E188-R191 PolarHBondContact OE1-NH1 2.87Å; E188-R191 IonicContact OE2-CZ 3.75Å; E188-R191 IonicContact OE2-NH1 2.95Å; E188-R191 PolarHBondContact OE2-NH1 3.1Å; R191-T194 PolarHBondContact O-N 3.47Å; R191-S195 PolarHBondContact O-N 3.46Å; R191-S195 PolarHBondContact O-OG 2.98Å
192V71.9Confident68.4Low81 Ų81104.8 Ų104.849%0.49153%0.533SS..Hα-helixtrans-63.8-44.5176172.20000110.6E188 M189 E190 T194 S195 M196E188-V192 VanDerWaalsContact O-CG2 3.32Å; E188-V192 WeakPolarHBondContact O-CG2 3.43Å; E188-V192 PolarHBondContact O-N 3.01Å; M189-V192 PolarHBondContact O-N 3.26Å; E190-V192 VanDerWaalsContact C-N 3.35Å; E190-V192 PolarHBondContact O-N 3.39Å; V192-T194 PolarHBondContact O-N 3.32Å; V192-S195 PolarHBondContact O-N 3.41Å; V192-S195 VanDerWaalsContact O-N 3.17Å; V192-M196 HydrophobicContact CG1-CG 4.38Å; V192-M196 HydrophobicContact CG1-SD 4.05Å; V192-M196 WeakPolarHBondContact O-CG 3.48Å; V192-M196 PolarHBondContact O-N 3.32Å
193R69.7Low67.7Low125 Ų125107.4 Ų107.447%0.47255%0.548SS..Hα-helixtrans-54.2-52174.6176-172.961.4-163.4-8.3111.5M189 E190 S195 M196 E197M189-R193 PolarHBondContact O-N 3.49Å; E190-R193 WeakPolarHBondContact O-CB 3.47Å; E190-R193 PolarHBondContact O-N 3.2Å; E190-R193 IonicContact OE1-NH2 3.38Å; E190-R193 PolarHBondContact OE1-NH2 3.47Å; R193-S195 VanDerWaalsContact C-N 3.26Å; R193-S195 PolarHBondContact O-N 3.05Å; R193-M196 PolarHBondContact O-N 3.09Å; R193-M196 VanDerWaalsContact O-N 3.09Å; R193-E197 WeakPolarHBondContact CG-OE1 3.46Å; R193-E197 WeakPolarHBondContact O-CG 3.46Å; R193-E197 PolarHBondContact O-N 3.09Å
194T67.7Low66.9Low84 Ų84105.4 Ų105.452%0.51555%0.548SS..Hα-helixtrans-62.7-34.2-179.8-57.10000112.3E190 R191 V192E190-T194 PolarHBondContact O-N 3.49Å; E190-T194 PolarHBondContact O-OG1 2.9Å; R191-T194 PolarHBondContact O-N 3.47Å; V192-T194 PolarHBondContact O-N 3.32Å
195S58.5Low65.8Low68 Ų68107.1 Ų107.148%0.47655%0.549SS..Hα-helixtrans-68.7-37.1175.1-54.70000111.9R191 V192 R193 C198 F199R191-S195 PolarHBondContact O-N 3.46Å; R191-S195 PolarHBondContact O-OG 2.98Å; V192-S195 PolarHBondContact O-N 3.41Å; V192-S195 VanDerWaalsContact O-N 3.17Å; R193-S195 VanDerWaalsContact C-N 3.26Å; R193-S195 PolarHBondContact O-N 3.05Å; S195-C198 WeakPolarHBondContact O-CB 3.47Å; S195-C198 PolarHBondContact O-N 3.03Å; S195-F199 WeakPolarHBondContact O-CD2 3.41Å; S195-F199 VanDerWaalsContact O-CE2 3.26Å; S195-F199 WeakPolarHBondContact O-CE2 3.25Å
196M55.1Low64.8Low119 Ų119109.1 Ų109.159%0.58656%0.563SS**Hα-helixtrans-71.1-36.7178.9-72.2-177.169.800113.1V192 R193 C198 F199V192-M196 HydrophobicContact CG1-CG 4.38Å; V192-M196 HydrophobicContact CG1-SD 4.05Å; V192-M196 WeakPolarHBondContact O-CG 3.48Å; V192-M196 PolarHBondContact O-N 3.32Å; R193-M196 PolarHBondContact O-N 3.09Å; R193-M196 VanDerWaalsContact O-N 3.09Å; M196-C198 PolarHBondContact O-N 3.31Å; M196-F199 PolarHBondContact O-N 2.99Å
197E56Low63.6Low120 Ų120111.6 Ų111.656%0.56158%0.575SS**Hα-helixtrans-62.5-20.8174.8-72.3168.4178.600112.8R193 F199R193-E197 WeakPolarHBondContact CG-OE1 3.46Å; R193-E197 WeakPolarHBondContact O-CG 3.46Å; R193-E197 PolarHBondContact O-N 3.09Å; E197-F199 VanDerWaalsContact C-N 3.31Å; E197-F199 PolarHBondContact O-N 3.38Å
198C45Very low62.2Low109 Ų109112.5 Ų112.574%0.73658%0.583SS**THydrogen-bonded Turntrans-80.7-7.3178.7-144.60000113.9S195 M196S195-C198 WeakPolarHBondContact O-CB 3.47Å; S195-C198 PolarHBondContact O-N 3.03Å; M196-C198 PolarHBondContact O-N 3.31Å
199F39.5Very low60.7Low181 Ų181114.7 Ų114.779%0.79460%0.599SS**THydrogen-bonded Turntrans-99.31.1179.1-68.7-77.9000114.3S195 M196 E197S195-F199 WeakPolarHBondContact O-CD2 3.41Å; S195-F199 VanDerWaalsContact O-CE2 3.26Å; S195-F199 WeakPolarHBondContact O-CE2 3.25Å; M196-F199 PolarHBondContact O-N 2.99Å; E197-F199 VanDerWaalsContact C-N 3.31Å; E197-F199 PolarHBondContact O-N 3.38Å
200C38.4Very low59.4Low175 Ų175116.6 Ų116.6100%1.18261%0.611SS**  trans-97.50173.9-68.50000110.7

Retrieved 200 of 200 residues in 425.1 ms (Link to these results)

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