A0A087YDM2_POEFO Loading...

Translin

DNA-binding protein that specifically recognizes consensus sequences at the breakpoint junctions in chromosomal translocations, mostly involving immunoglobulin (Ig)/T-cell receptor gene segments. Seems to recognize single-stranded DNA ends generated by staggered breaks occurring at recombination hot spots. Exhibits both single-stranded and double-stranded endoribonuclease activity. May act as an activator of RNA-induced silencing complex (RISC) by facilitating endonucleolytic cleavage of the siRNA passenger strand.

AlphaFold DB (A0A3B3VHH6), UniProt , Accession A0A087YDM2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 227 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
1M65.3Low91.9Very high193 Ų193109.9 Ų109.995%0.95156%0.56SS**  0121.10-95.9-175.6-109.200108.4E5M1-E5 WeakPolarHBondContact CA-OE2 3.4Å; M1-E5 HydrophobicContact CG-CB 4.29Å
2S91.9Very high92.2Very high53 Ų53104.3 Ų104.337%0.37155%0.55SS.*  trans-67.9160.5167.769.80000110.2T4 E5 M6S2-T4 PolarHBondContact O-N 3.25Å; S2-E5 PolarHBondContact N-OE2 3.08Å; S2-E5 PolarHBondContact O-N 2.94Å; S2-E5 VanDerWaalsContact OG-CD 3.26Å; S2-E5 VanDerWaalsContact OG-CG 3.26Å; S2-E5 WeakPolarHBondContact OG-CG 3.01Å; S2-E5 PolarHBondContact OG-N 2.87Å; S2-E5 PolarHBondContact OG-OE1 3Å; S2-M6 PolarHBondContact O-N 3.13Å
3V93.2Very high92.3Very high104 Ų104104.5 Ų104.563%0.6354%0.544SS*.Hα-helixtrans-55.9-41.4175.5177.30000110.2M6 F7V3-M6 PolarHBondContact O-N 2.9Å; V3-F7 HydrophobicContact CG1-CD2 3.91Å; V3-F7 HydrophobicContact CG1-CE2 3.92Å; V3-F7 WeakPolarHBondContact O-CD2 3.32Å; V3-F7 PolarHBondContact O-N 2.89Å
4T93.6Very high92.5Very high101 Ų101104.2 Ų104.262%0.6254%0.542SS*.Hα-helixtrans-62.6-45.1178.1-500000112.4S2 M6 F7 S8S2-T4 PolarHBondContact O-N 3.25Å; T4-M6 VanDerWaalsContact C-N 3.3Å; T4-M6 PolarHBondContact O-N 2.77Å; T4-F7 PolarHBondContact O-N 3.32Å; T4-S8 PolarHBondContact O-N 3.02Å; T4-S8 PolarHBondContact O-OG 3.07Å
5E93.3Very high92.7Very high109 Ų109101.4 Ų101.451%0.50954%0.535SS..Hα-helixtrans-60.3-40.3176.3-74.1159-16100112.1M1 S2 S8 Y9M1-E5 WeakPolarHBondContact CA-OE2 3.4Å; M1-E5 HydrophobicContact CG-CB 4.29Å; S2-E5 PolarHBondContact N-OE2 3.08Å; S2-E5 PolarHBondContact O-N 2.94Å; S2-E5 VanDerWaalsContact OG-CD 3.26Å; S2-E5 VanDerWaalsContact OG-CG 3.26Å; S2-E5 WeakPolarHBondContact OG-CG 3.01Å; S2-E5 PolarHBondContact OG-N 2.87Å; S2-E5 PolarHBondContact OG-OE1 3Å; E5-S8 PolarHBondContact O-N 2.84Å; E5-Y9 PolarHBondContact O-N 3.09Å
6M94.9Very high92.8Very high87 Ų8798.4 Ų98.443%0.42953%0.53SS..Hα-helixtrans-63.2-45.6177-174.3179.675.100111.7S2 V3 T4 Y9 I10S2-M6 PolarHBondContact O-N 3.13Å; V3-M6 PolarHBondContact O-N 2.9Å; T4-M6 VanDerWaalsContact C-N 3.3Å; T4-M6 PolarHBondContact O-N 2.77Å; M6-Y9 PolarHBondContact O-N 2.61Å; M6-I10 HydrophobicContact CG-CD1 4.23Å; M6-I10 WeakPolarHBondContact O-CG1 3.41Å; M6-I10 PolarHBondContact O-N 3.35Å
7F95.9Very high92.8Very high125 Ų12593.7 Ų93.755%0.54850%0.504SS..Hα-helixtrans-69.3-35.2178.5-86-101.1000112.6V3 T4 I10 Q11V3-F7 HydrophobicContact CG1-CD2 3.91Å; V3-F7 HydrophobicContact CG1-CE2 3.92Å; V3-F7 WeakPolarHBondContact O-CD2 3.32Å; V3-F7 PolarHBondContact O-N 2.89Å; T4-F7 PolarHBondContact O-N 3.32Å; F7-I10 PolarHBondContact O-N 3.02Å; F7-Q11 WeakPolarHBondContact O-CB 3.28Å; F7-Q11 PolarHBondContact O-N 3.19Å
8S95.3Very high92.9Very high67 Ų6793.3 Ų93.347%0.46950%0.498SS..Hα-helixtrans-64.1-39.2172.6-650000112.1T4 E5 Q11 G12T4-S8 PolarHBondContact O-N 3.02Å; T4-S8 PolarHBondContact O-OG 3.07Å; E5-S8 PolarHBondContact O-N 2.84Å; S8-Q11 PolarHBondContact O-N 3.17Å; S8-G12 PolarHBondContact O-N 2.93Å
9Y95.1Very high93Very high171 Ų17193.9 Ų93.967%0.67150%0.502SS*.Hα-helixtrans-62.8-46.4173.5176.3-96.3000112E5 M6 Q11 G12 F13E5-Y9 PolarHBondContact O-N 3.09Å; M6-Y9 PolarHBondContact O-N 2.61Å; Y9-Q11 VanDerWaalsContact C-N 3.32Å; Y9-Q11 PolarHBondContact O-N 2.67Å; Y9-G12 PolarHBondContact O-N 3.34Å; Y9-F13 PolarHBondContact O-N 2.99Å
10I95.8Very high93.2Very high69 Ų6991.2 Ų91.235%0.35449%0.489SS..Hα-helixtrans-61-42.8176.6-66.7166000110.8M6 F7 G12 F13 L14M6-I10 HydrophobicContact CG-CD1 4.23Å; M6-I10 WeakPolarHBondContact O-CG1 3.41Å; M6-I10 PolarHBondContact O-N 3.35Å; F7-I10 PolarHBondContact O-N 3.02Å; I10-G12 VanDerWaalsContact C-N 3.35Å; I10-G12 PolarHBondContact O-N 3.39Å; I10-F13 PolarHBondContact O-N 3.46Å; I10-L14 HydrophobicContact CG2-CD1 4.02Å; I10-L14 HydrophobicContact CG2-CG 4.27Å; I10-L14 WeakPolarHBondContact O-CG 3.42Å; I10-L14 PolarHBondContact O-N 2.89Å
11Q96.3Very high93.3Very high130 Ų13090.1 Ų90.161%0.60748%0.478SS*.Hα-helixtrans-58.1-47.1176.8-176.6-178.15.200111.3F7 S8 Y9 F13 L14 S15F7-Q11 WeakPolarHBondContact O-CB 3.28Å; F7-Q11 PolarHBondContact O-N 3.19Å; S8-Q11 PolarHBondContact O-N 3.17Å; Y9-Q11 VanDerWaalsContact C-N 3.32Å; Y9-Q11 PolarHBondContact O-N 2.67Å; Q11-F13 VanDerWaalsContact C-N 3.33Å; Q11-F13 PolarHBondContact O-N 2.95Å; Q11-L14 PolarHBondContact O-N 3.24Å; Q11-S15 PolarHBondContact O-N 3.43Å; Q11-S15 PolarHBondContact O-OG 3.37Å
12G96.2Very high94.8Very high43 Ų4383.8 Ų83.844%0.44345%0.446SS..Hα-helixtrans-59.8-41.6176.900000112.9S8 Y9 I10 S15 A16S8-G12 PolarHBondContact O-N 2.93Å; Y9-G12 PolarHBondContact O-N 3.34Å; I10-G12 VanDerWaalsContact C-N 3.35Å; I10-G12 PolarHBondContact O-N 3.39Å; G12-S15 PolarHBondContact O-N 3.28Å; G12-A16 PolarHBondContact O-N 3.33Å; G12-A16 VanDerWaalsContact O-N 3.09Å
13F93.8Very high95Very high107 Ų10784.3 Ų84.347%0.46945%0.445SS..Hα-helixtrans-62.7-43.7174.9177.9-95.6000112.5Y9 I10 Q11 A16 D17Y9-F13 PolarHBondContact O-N 2.99Å; I10-F13 PolarHBondContact O-N 3.46Å; Q11-F13 VanDerWaalsContact C-N 3.33Å; Q11-F13 PolarHBondContact O-N 2.95Å; F13-A16 PolarHBondContact O-N 3.19Å; F13-D17 PolarHBondContact O-N 2.94Å
14L94.8Very high95.2Very high100 Ų10079.4 Ų79.452%0.52442%0.415SS..Hα-helixtrans-66.6-37.9178.1-69.1177000112.3I10 Q11 D17 Q18I10-L14 HydrophobicContact CG2-CD1 4.02Å; I10-L14 HydrophobicContact CG2-CG 4.27Å; I10-L14 WeakPolarHBondContact O-CG 3.42Å; I10-L14 PolarHBondContact O-N 2.89Å; Q11-L14 PolarHBondContact O-N 3.24Å; L14-D17 PolarHBondContact O-N 2.98Å; L14-Q18 WeakPolarHBondContact O-CB 3.3Å; L14-Q18 PolarHBondContact O-N 3.29Å
15S95.6Very high95.4Very high62 Ų6279.8 Ų79.843%0.43441%0.405SS..Hα-helixtrans-62.1-46.5174.5-67.70000111.7Q11 G12 D17 Q18 D19Q11-S15 PolarHBondContact O-N 3.43Å; Q11-S15 PolarHBondContact O-OG 3.37Å; G12-S15 PolarHBondContact O-N 3.28Å; S15-D17 PolarHBondContact O-N 3.11Å; S15-Q18 WeakPolarHBondContact O-CB 3.45Å; S15-Q18 PolarHBondContact O-N 3.24Å; S15-Q18 VanDerWaalsContact O-N 3.16Å; S15-D19 PolarHBondContact O-N 2.79Å
16A93.8Very high95.6Very high54 Ų5480 Ų8045%0.44640%0.404SS..Hα-helixtrans-63.7-38.7176.700000112.8G12 F13 Q18 D19 V20G12-A16 PolarHBondContact O-N 3.33Å; G12-A16 VanDerWaalsContact O-N 3.09Å; F13-A16 PolarHBondContact O-N 3.19Å; A16-Q18 VanDerWaalsContact C-N 3.3Å; A16-Q18 PolarHBondContact O-N 2.89Å; A16-D19 PolarHBondContact O-N 3.01Å; A16-V20 WeakPolarHBondContact O-CG2 3.39Å; A16-V20 PolarHBondContact O-N 3.14Å
17D92.8Very high95.7Very high18 Ų1876 Ų7610%0.09638%0.384CS..Hα-helixtrans-63.1-38.3173.8-169.980.9000111.6F13 L14 S15 V20 R21 R86F13-D17 PolarHBondContact O-N 2.94Å; L14-D17 PolarHBondContact O-N 2.98Å; S15-D17 PolarHBondContact O-N 3.11Å; D17-V20 PolarHBondContact O-N 3.35Å; D17-R21 WeakPolarHBondContact O-CG 3.4Å; D17-R21 PolarHBondContact O-N 3.18Å; D17-R21 VanDerWaalsContact O-N 3.12Å; D17-R21 IonicContact OD2-CZ 3.54Å; D17-R21 VanDerWaalsContact OD2-CZ 3.28Å; D17-R21 IonicContact OD2-NE 2.65Å; D17-R21 PolarHBondContact OD2-NE 3.27Å; D17-R21 IonicContact OD2-NH2 3.75Å; D17-R21 PolarHBondContact OD2-NH2 2.81Å; D17-R86 VanDerWaalsContact CG-NH2 3.34Å; D17-R86 IonicContact OD1-CZ 2.99Å; D17-R86 IonicContact OD1-NE 3.66Å; D17-R86 PolarHBondContact OD1-NE 3.16Å; D17-R86 IonicContact OD1-NH2 3.85Å; D17-R86 PolarHBondContact OD1-NH2 2.79Å; D17-R86 IonicContact OD2-NH2 2.7Å
18Q94.8Very high95.8Very high86 Ų8670.4 Ų70.440%0.40236%0.361SS..Hα-helixtrans-65.7-41.9176.8-172.563.326.800111.8L14 S15 A16 V20 R21 E22L14-Q18 WeakPolarHBondContact O-CB 3.3Å; L14-Q18 PolarHBondContact O-N 3.29Å; S15-Q18 WeakPolarHBondContact O-CB 3.45Å; S15-Q18 PolarHBondContact O-N 3.24Å; S15-Q18 VanDerWaalsContact O-N 3.16Å; A16-Q18 VanDerWaalsContact C-N 3.3Å; A16-Q18 PolarHBondContact O-N 2.89Å; Q18-V20 VanDerWaalsContact C-N 3.31Å; Q18-V20 PolarHBondContact O-N 3.05Å; Q18-R21 WeakPolarHBondContact O-CB 3.48Å; Q18-R21 PolarHBondContact O-N 3.5Å; Q18-R21 VanDerWaalsContact O-N 3.12Å; Q18-E22 PolarHBondContact NE2-OE1 2.75Å; Q18-E22 PolarHBondContact O-N 3.32Å
19D95.6Very high96Very high106 Ų10672.3 Ų72.357%0.56736%0.362SS*.Hα-helixtrans-59.9-43177.7-67.8-27.4000111.3S15 A16 R21 E22 D23S15-D19 PolarHBondContact O-N 2.79Å; A16-D19 PolarHBondContact O-N 3.01Å; D19-R21 VanDerWaalsContact C-N 3.34Å; D19-R21 PolarHBondContact O-N 2.85Å; D19-E22 PolarHBondContact O-N 3.47Å; D19-D23 PolarHBondContact O-N 3.42Å
20V95.8Very high96.1Very high39 Ų3967.3 Ų67.324%0.23635%0.347CS..Hα-helixtrans-59.8-43.2174.1171.70000111.5A16 D17 Q18 E22 D23 I24 F79 F87A16-V20 WeakPolarHBondContact O-CG2 3.39Å; A16-V20 PolarHBondContact O-N 3.14Å; D17-V20 PolarHBondContact O-N 3.35Å; Q18-V20 VanDerWaalsContact C-N 3.31Å; Q18-V20 PolarHBondContact O-N 3.05Å; V20-E22 PolarHBondContact O-N 2.75Å; V20-D23 PolarHBondContact O-N 3.5Å; V20-I24 HydrophobicContact CG1-CD1 3.73Å; V20-I24 HydrophobicContact CG1-CG1 4.45Å; V20-I24 WeakPolarHBondContact O-CD1 3.13Å; V20-I24 VanDerWaalsContact O-CG1 3.28Å; V20-I24 WeakPolarHBondContact O-CG1 3.5Å; V20-I24 PolarHBondContact O-N 3.19Å; V20-F79 HydrophobicContact CG1-CB 4.07Å; V20-F87 HydrophobicContact CB-CZ 4.43Å; V20-F87 HydrophobicContact CG1-CE1 4.04Å; V20-F87 HydrophobicContact CG1-CE2 4.02Å; V20-F87 HydrophobicContact CG1-CZ 3.69Å
21R96.1Very high96.2Very high68 Ų6864 Ų6426%0.25733%0.33SS..Hα-helixtrans-63.4-40.5177.6-69.1172-171.4-93.4-3.9112.4D17 Q18 D19 I24 R25 F87 H90D17-R21 WeakPolarHBondContact O-CG 3.4Å; D17-R21 PolarHBondContact O-N 3.18Å; D17-R21 VanDerWaalsContact O-N 3.12Å; D17-R21 IonicContact OD2-CZ 3.54Å; D17-R21 VanDerWaalsContact OD2-CZ 3.28Å; D17-R21 IonicContact OD2-NE 2.65Å; D17-R21 PolarHBondContact OD2-NE 3.27Å; D17-R21 IonicContact OD2-NH2 3.75Å; D17-R21 PolarHBondContact OD2-NH2 2.81Å; Q18-R21 WeakPolarHBondContact O-CB 3.48Å; Q18-R21 PolarHBondContact O-N 3.5Å; Q18-R21 VanDerWaalsContact O-N 3.12Å; D19-R21 VanDerWaalsContact C-N 3.34Å; D19-R21 PolarHBondContact O-N 2.85Å; R21-I24 PolarHBondContact O-N 3.2Å; R21-R25 WeakPolarHBondContact O-CB 3.48Å; R21-R25 PolarHBondContact O-N 2.77Å; R21-F87 HydrophobicContact CG-CD1 4.08Å; R21-F87 HydrophobicContact CG-CE1 3.91Å; R21-H90 PolarHBondContact NH1-CE1 2.96Å; R21-H90 VanDerWaalsContact NH1-CE1 3.35Å
22E96.7Very high96.3Very high60 Ų6060.3 Ų60.328%0.2831%0.313SS..Hα-helixtrans-66.3-39.7177.6-68.9-54.3140.800111.6Q18 D19 V20 R25 K26Q18-E22 PolarHBondContact NE2-OE1 2.75Å; Q18-E22 PolarHBondContact O-N 3.32Å; D19-E22 PolarHBondContact O-N 3.47Å; V20-E22 PolarHBondContact O-N 2.75Å; E22-R25 WeakPolarHBondContact O-CB 3.48Å; E22-R25 PolarHBondContact O-N 2.96Å; E22-R25 IonicContact OE1-CZ 2.7Å; E22-R25 IonicContact OE1-NH1 2.88Å; E22-R25 PolarHBondContact OE1-NH1 3.44Å; E22-R25 IonicContact OE1-NH2 4Å; E22-R25 IonicContact OE2-CZ 3.21Å; E22-R25 IonicContact OE2-NH1 3.76Å; E22-R25 PolarHBondContact OE2-NH1 2.89Å; E22-K26 WeakPolarHBondContact O-CG 3.17Å; E22-K26 PolarHBondContact O-N 3.47Å; E22-K26 VanDerWaalsContact O-N 3.09Å
23D96.6Very high96.4Very high65 Ų6562.9 Ų62.935%0.34831%0.313SS..Hα-helixtrans-68.4-40176.3-78.6-12.1000112.8D19 V20 R25 K26 V27 K78D19-D23 PolarHBondContact O-N 3.42Å; V20-D23 PolarHBondContact O-N 3.5Å; D23-R25 VanDerWaalsContact C-N 3.32Å; D23-R25 PolarHBondContact O-N 3.04Å; D23-K26 PolarHBondContact O-N 2.86Å; D23-K26 IonicContact OD1-NZ 2.68Å; D23-K26 PolarHBondContact OD1-NZ 3.32Å; D23-V27 PolarHBondContact O-N 2.64Å; D23-K78 HydrophobicContact CB-CD 4.36Å
24I97.4Very high96.6Very high0 Ų058.1 Ų58.10%029%0.293CS..Hα-helixtrans-58.1-47.1170.3-71.8163.7000110.2V20 R21 K26 V27 V28 L75 K78 F79 F87 H90 W91V20-I24 HydrophobicContact CG1-CD1 3.73Å; V20-I24 HydrophobicContact CG1-CG1 4.45Å; V20-I24 WeakPolarHBondContact O-CD1 3.13Å; V20-I24 VanDerWaalsContact O-CG1 3.28Å; V20-I24 WeakPolarHBondContact O-CG1 3.5Å; V20-I24 PolarHBondContact O-N 3.19Å; R21-I24 PolarHBondContact O-N 3.2Å; I24-K26 VanDerWaalsContact C-N 3.32Å; I24-K26 PolarHBondContact O-N 2.91Å; I24-V27 PolarHBondContact O-N 3.38Å; I24-V28 HydrophobicContact CG2-CG2 4.08Å; I24-V28 WeakPolarHBondContact O-CG2 3.43Å; I24-V28 PolarHBondContact O-N 3.34Å; I24-L75 HydrophobicContact CB-CD1 4.38Å; I24-L75 HydrophobicContact CG1-CD1 4.23Å; I24-L75 HydrophobicContact CG2-CD1 3.99Å; I24-K78 HydrophobicContact CG1-CB 4.07Å; I24-F79 HydrophobicContact CD1-CB 4.25Å; I24-F79 HydrophobicContact CD1-CD1 4.11Å; I24-F79 HydrophobicContact CD1-CG 4.43Å; I24-F79 HydrophobicContact CG1-CD1 4.27Å; I24-F87 HydrophobicContact CD1-CB 3.76Å; I24-F87 HydrophobicContact CD1-CD1 3.85Å; I24-F87 HydrophobicContact CD1-CD2 4.1Å; I24-F87 HydrophobicContact CD1-CE1 4.48Å; I24-F87 HydrophobicContact CD1-CG 3.64Å; I24-H90 HydrophobicContact CG2-CB 3.65Å; I24-W91 HydrophobicContact CD1-CZ3 4.19Å; I24-W91 HydrophobicContact CG2-CE3 3.85Å; I24-W91 HydrophobicContact CG2-CZ3 4.01Å
25R97.3Very high96.7Very high109 Ų10953.3 Ų53.341%0.41127%0.268SS..Hα-helixtrans-58.2-42.6-178.7-177.2-176.2-70.8152.40.1112R21 E22 D23 V27 V28 Q29R21-R25 WeakPolarHBondContact O-CB 3.48Å; R21-R25 PolarHBondContact O-N 2.77Å; E22-R25 WeakPolarHBondContact O-CB 3.48Å; E22-R25 PolarHBondContact O-N 2.96Å; E22-R25 IonicContact OE1-CZ 2.7Å; E22-R25 IonicContact OE1-NH1 2.88Å; E22-R25 PolarHBondContact OE1-NH1 3.44Å; E22-R25 IonicContact OE1-NH2 4Å; E22-R25 IonicContact OE2-CZ 3.21Å; E22-R25 IonicContact OE2-NH1 3.76Å; E22-R25 PolarHBondContact OE2-NH1 2.89Å; D23-R25 VanDerWaalsContact C-N 3.32Å; D23-R25 PolarHBondContact O-N 3.04Å; R25-V27 PolarHBondContact O-N 3.13Å; R25-V28 PolarHBondContact O-N 2.94Å; R25-Q29 WeakPolarHBondContact O-CG 3.41Å; R25-Q29 PolarHBondContact O-N 2.84Å
26K97.4Very high96.9Very high114 Ų11455.9 Ų55.950%0.49627%0.268SS..Hα-helixtrans-59.5-45.9177.6-68.3167.9-164.1157.30111.7E22 D23 I24 Q29 N30E22-K26 WeakPolarHBondContact O-CG 3.17Å; E22-K26 PolarHBondContact O-N 3.47Å; E22-K26 VanDerWaalsContact O-N 3.09Å; D23-K26 PolarHBondContact O-N 2.86Å; D23-K26 IonicContact OD1-NZ 2.68Å; D23-K26 PolarHBondContact OD1-NZ 3.32Å; I24-K26 VanDerWaalsContact C-N 3.32Å; I24-K26 PolarHBondContact O-N 2.91Å; K26-Q29 PolarHBondContact O-N 3.27Å; K26-N30 PolarHBondContact O-N 2.96Å
27V97.8Very high97.1Very high2 Ų257 Ų571%0.01226%0.264CS..Hα-helixtrans-67.7-40.1178.9-175.60000111.2D23 I24 R25 Q29 N30 L31 H71 E74 L75 K78D23-V27 PolarHBondContact O-N 2.64Å; I24-V27 PolarHBondContact O-N 3.38Å; R25-V27 PolarHBondContact O-N 3.13Å; V27-Q29 VanDerWaalsContact C-N 3.32Å; V27-Q29 PolarHBondContact O-N 3.09Å; V27-N30 WeakPolarHBondContact O-CB 3.15Å; V27-N30 PolarHBondContact O-N 3.2Å; V27-L31 HydrophobicContact CG1-CD1 4.47Å; V27-L31 PolarHBondContact O-N 3.03Å; V27-H71 HydrophobicContact CG1-CB 4.44Å; V27-H71 VanDerWaalsContact CG1-O 3.31Å; V27-H71 WeakPolarHBondContact CG1-O 3.4Å; V27-E74 HydrophobicContact CG1-CB 4.45Å; V27-E74 HydrophobicContact CG1-CG 4.44Å; V27-E74 HydrophobicContact CG2-CG 3.9Å; V27-L75 HydrophobicContact CB-CD1 4.34Å; V27-L75 HydrophobicContact CG1-CB 3.82Å; V27-L75 HydrophobicContact CG1-CD1 4.44Å; V27-K78 HydrophobicContact CG2-CG 4.18Å
28V97.9Very high97.3Very high9 Ų956.1 Ų56.16%0.05526%0.259CS..Hα-helixtrans-60.9-40176169.40000111.6I24 R25 N30 L31 E32 H90 W91 V94I24-V28 HydrophobicContact CG2-CG2 4.08Å; I24-V28 WeakPolarHBondContact O-CG2 3.43Å; I24-V28 PolarHBondContact O-N 3.34Å; R25-V28 PolarHBondContact O-N 2.94Å; V28-N30 VanDerWaalsContact C-N 3.31Å; V28-N30 PolarHBondContact O-N 3.11Å; V28-L31 WeakPolarHBondContact O-CB 3.33Å; V28-L31 PolarHBondContact O-N 3.38Å; V28-E32 HydrophobicContact CG1-CG 4.28Å; V28-E32 WeakPolarHBondContact O-CG 3.37Å; V28-E32 PolarHBondContact O-N 3.44Å; V28-H90 WeakPolarHBondContact CG1-O 3.47Å; V28-W91 HydrophobicContact CG2-CB 3.84Å; V28-V94 HydrophobicContact CG1-CG1 4.03Å
29Q98.1Very high97.4Very high107 Ų10753.1 Ų53.150%0.525%0.246SC..Hα-helixtrans-60.3-40.6176.1-75.4174.6-1.600112.4R25 K26 V27 E32 Q33R25-Q29 WeakPolarHBondContact O-CG 3.41Å; R25-Q29 PolarHBondContact O-N 2.84Å; K26-Q29 PolarHBondContact O-N 3.27Å; V27-Q29 VanDerWaalsContact C-N 3.32Å; V27-Q29 PolarHBondContact O-N 3.09Å; Q29-E32 PolarHBondContact O-N 3.21Å; Q29-Q33 PolarHBondContact O-N 3.43Å
30N97.7Very high97.5Very high65 Ų6552.7 Ų52.735%0.34825%0.247SC..Hα-helixtrans-64.7-45.3174.8-65-24.2000111K26 V27 V28 E32 Q33 T34K26-N30 PolarHBondContact O-N 2.96Å; V27-N30 WeakPolarHBondContact O-CB 3.15Å; V27-N30 PolarHBondContact O-N 3.2Å; V28-N30 VanDerWaalsContact C-N 3.31Å; V28-N30 PolarHBondContact O-N 3.11Å; N30-E32 VanDerWaalsContact C-N 3.31Å; N30-E32 PolarHBondContact O-N 2.88Å; N30-Q33 WeakPolarHBondContact O-CB 3.44Å; N30-Q33 PolarHBondContact O-N 3.47Å; N30-Q33 VanDerWaalsContact O-N 3.16Å; N30-T34 PolarHBondContact O-N 3.39Å; N30-T34 PolarHBondContact O-OG1 3.39Å
31L97.7Very high97.5Very high0 Ų052.2 Ų52.20%024%0.244CC..Hα-helixtrans-57.2-43.8174.5-77167.9000111.9V27 V28 Q33 T34 A35 V68 H71 M72 L75 V94 L98V27-L31 HydrophobicContact CG1-CD1 4.47Å; V27-L31 PolarHBondContact O-N 3.03Å; V28-L31 WeakPolarHBondContact O-CB 3.33Å; V28-L31 PolarHBondContact O-N 3.38Å; L31-Q33 VanDerWaalsContact C-N 3.33Å; L31-Q33 PolarHBondContact O-N 3.27Å; L31-T34 PolarHBondContact O-N 3.18Å; L31-A35 VanDerWaalsContact O-CB 3.28Å; L31-A35 WeakPolarHBondContact O-CB 3.25Å; L31-A35 PolarHBondContact O-N 2.89Å; L31-V68 HydrophobicContact CD2-CG1 3.93Å; L31-H71 HydrophobicContact CD2-CB 3.51Å; L31-H71 HydrophobicContact CG-CB 3.77Å; L31-M72 HydrophobicContact CD1-CE 3.96Å; L31-M72 HydrophobicContact CD1-SD 3.96Å; L31-M72 HydrophobicContact CD2-CE 3.85Å; L31-M72 HydrophobicContact CD2-CG 4.19Å; L31-M72 HydrophobicContact CD2-SD 4.22Å; L31-L75 HydrophobicContact CD1-CD2 4.09Å; L31-V94 HydrophobicContact CB-CG1 4.36Å; L31-V94 HydrophobicContact CB-CG2 3.86Å; L31-L98 HydrophobicContact CD2-CD1 4.24Å
32E97.9Very high97.5Very high53 Ų5349 Ų4925%0.24823%0.232CC..Hα-helixtrans-66.1-36.5178.3-74.4-174.4168.400112.4V28 Q29 N30 A35 R36 V94V28-E32 HydrophobicContact CG1-CG 4.28Å; V28-E32 WeakPolarHBondContact O-CG 3.37Å; V28-E32 PolarHBondContact O-N 3.44Å; Q29-E32 PolarHBondContact O-N 3.21Å; N30-E32 VanDerWaalsContact C-N 3.31Å; N30-E32 PolarHBondContact O-N 2.88Å; E32-A35 PolarHBondContact O-N 2.61Å; E32-R36 WeakPolarHBondContact O-CG 3.48Å; E32-R36 PolarHBondContact O-N 3.31Å; E32-R36 IonicContact OE2-NH1 3.48Å; E32-V94 HydrophobicContact CB-CG2 4.33Å; E32-V94 HydrophobicContact CG-CB 3.79Å; E32-V94 HydrophobicContact CG-CG2 3.69Å
33Q98.2Very high97.3Very high97 Ų9749.5 Ų49.545%0.45323%0.234SC..Hα-helixtrans-62.5-52.1173.9179.3175.3-14.900110.7Q29 N30 L31 A35 R36 E37Q29-Q33 PolarHBondContact O-N 3.43Å; N30-Q33 WeakPolarHBondContact O-CB 3.44Å; N30-Q33 PolarHBondContact O-N 3.47Å; N30-Q33 VanDerWaalsContact O-N 3.16Å; L31-Q33 VanDerWaalsContact C-N 3.33Å; L31-Q33 PolarHBondContact O-N 3.27Å; Q33-A35 VanDerWaalsContact C-N 3.27Å; Q33-A35 PolarHBondContact O-N 3.15Å; Q33-R36 WeakPolarHBondContact O-CB 3.44Å; Q33-R36 PolarHBondContact O-N 2.85Å; Q33-E37 WeakPolarHBondContact CG-OE1 3.45Å; Q33-E37 PolarHBondContact NE2-OE1 3.32Å; Q33-E37 WeakPolarHBondContact O-CG 3.37Å; Q33-E37 PolarHBondContact O-N 3.01Å
34T97.9Very high97Very high6 Ų647.2 Ų47.24%0.03722%0.224CC..Hα-helixtrans-60.6-38.3176.9-47.50000111.3N30 L31 R36 E37 I38 L64 T67 V68N30-T34 PolarHBondContact O-N 3.39Å; N30-T34 PolarHBondContact O-OG1 3.39Å; L31-T34 PolarHBondContact O-N 3.18Å; T34-R36 VanDerWaalsContact C-N 3.33Å; T34-R36 PolarHBondContact O-N 3.43Å; T34-E37 WeakPolarHBondContact O-CB 3.38Å; T34-E37 PolarHBondContact O-N 3.37Å; T34-I38 HydrophobicContact CG2-CD1 4.21Å; T34-I38 VanDerWaalsContact O-CG1 3.31Å; T34-I38 WeakPolarHBondContact O-CG1 3.48Å; T34-I38 PolarHBondContact O-N 3.32Å; T34-L64 HydrophobicContact CG2-CB 4.38Å; T34-T67 HydrophobicContact CG2-CG2 4.38Å; T34-V68 HydrophobicContact CG2-CG2 3.63Å
35A98.2Very high96.8Very high0 Ų047.3 Ų47.30%022%0.224CC..Hα-helixtrans-64.3-34.5175.100000112.9L31 E32 Q33 L39 V94 L98 L101L31-A35 VanDerWaalsContact O-CB 3.28Å; L31-A35 WeakPolarHBondContact O-CB 3.25Å; L31-A35 PolarHBondContact O-N 2.89Å; E32-A35 PolarHBondContact O-N 2.61Å; Q33-A35 VanDerWaalsContact C-N 3.27Å; Q33-A35 PolarHBondContact O-N 3.15Å; A35-L39 WeakPolarHBondContact O-CB 3.44Å; A35-L39 PolarHBondContact O-N 3.46Å; A35-V94 HydrophobicContact CB-CG2 4.31Å; A35-L98 HydrophobicContact CB-CD2 3.88Å; A35-L98 HydrophobicContact CB-CG 4.33Å; A35-L101 HydrophobicContact CB-CD1 4.11Å; A35-L101 WeakPolarHBondContact O-CD1 3.43Å
36R98.3Very high96.4Very high115 Ų11543.2 Ų43.243%0.43421%0.21SC..Hα-helixtrans-68.8-38.7172.4-75.9-175.6-64.4-92.71.6111.9E32 Q33 T34 L39 T40E32-R36 WeakPolarHBondContact O-CG 3.48Å; E32-R36 PolarHBondContact O-N 3.31Å; E32-R36 IonicContact OE2-NH1 3.48Å; Q33-R36 WeakPolarHBondContact O-CB 3.44Å; Q33-R36 PolarHBondContact O-N 2.85Å; T34-R36 VanDerWaalsContact C-N 3.33Å; T34-R36 PolarHBondContact O-N 3.43Å; R36-L39 PolarHBondContact O-N 3.16Å; R36-T40 WeakPolarHBondContact O-CB 3.14Å; R36-T40 PolarHBondContact O-N 2.61Å; R36-T40 PolarHBondContact O-OG1 3.36Å
37E98.1Very high95.9Very high78 Ų7843 Ų4336%0.36421%0.211SC..Hα-helixtrans-63.7-48.9175.6-68.8170.8-162.100111.3Q33 T34 L39 T40 V41 L64Q33-E37 WeakPolarHBondContact CG-OE1 3.45Å; Q33-E37 PolarHBondContact NE2-OE1 3.32Å; Q33-E37 WeakPolarHBondContact O-CG 3.37Å; Q33-E37 PolarHBondContact O-N 3.01Å; T34-E37 WeakPolarHBondContact O-CB 3.38Å; T34-E37 PolarHBondContact O-N 3.37Å; E37-L39 VanDerWaalsContact C-N 3.33Å; E37-L39 PolarHBondContact O-N 3.27Å; E37-T40 WeakPolarHBondContact O-CB 3.3Å; E37-T40 PolarHBondContact O-N 3.32Å; E37-T40 VanDerWaalsContact O-N 3.13Å; E37-V41 WeakPolarHBondContact O-CG2 3.47Å; E37-V41 PolarHBondContact O-N 3.2Å; E37-L64 HydrophobicContact CB-CD1 4.26Å
38I98.1Very high94.7Very high0 Ų048.9 Ų48.90%025%0.249CC..Hα-helixtrans-58.1-46.9174.7-64.3166.2000110.3T34 T40 V41 L42 A61 L64 F65 V68 L98 L101T34-I38 HydrophobicContact CG2-CD1 4.21Å; T34-I38 VanDerWaalsContact O-CG1 3.31Å; T34-I38 WeakPolarHBondContact O-CG1 3.48Å; T34-I38 PolarHBondContact O-N 3.32Å; I38-T40 VanDerWaalsContact C-N 3.27Å; I38-T40 PolarHBondContact O-N 2.76Å; I38-V41 PolarHBondContact O-N 3.08Å; I38-L42 HydrophobicContact CG2-CD1 3.86Å; I38-L42 HydrophobicContact CG2-CG 4.3Å; I38-L42 WeakPolarHBondContact O-CG 3.42Å; I38-L42 PolarHBondContact O-N 3.31Å; I38-A61 HydrophobicContact CG2-CB 4.09Å; I38-L64 HydrophobicContact CB-CD1 4.49Å; I38-L64 HydrophobicContact CD1-CB 3.94Å; I38-L64 HydrophobicContact CG1-CB 3.44Å; I38-L64 VanDerWaalsContact CG1-CB 3.44Å; I38-L64 HydrophobicContact CG1-CD1 3.75Å; I38-L64 HydrophobicContact CG1-CG 4.25Å; I38-F65 HydrophobicContact CD1-CD1 4.06Å; I38-F65 HydrophobicContact CD1-CD2 4.37Å; I38-F65 HydrophobicContact CD1-CE1 4Å; I38-F65 HydrophobicContact CD1-CE2 4.31Å; I38-F65 HydrophobicContact CD1-CG 4.24Å; I38-F65 HydrophobicContact CD1-CZ 4.13Å; I38-F65 HydrophobicContact CG2-CE2 4.16Å; I38-F65 HydrophobicContact CG2-CZ 4.27Å; I38-V68 HydrophobicContact CD1-CG2 3.88Å; I38-L98 HydrophobicContact CD1-CD2 4.49Å; I38-L101 HydrophobicContact CB-CD1 4.04Å; I38-L101 HydrophobicContact CG2-CB 4.03Å; I38-L101 HydrophobicContact CG2-CD1 3.97Å; I38-L101 HydrophobicContact CG2-CD2 4.12Å; I38-L101 HydrophobicContact CG2-CG 4.25Å
39L97.5Very high93.5Very high22 Ų2251.4 Ų51.412%0.11527%0.267CS..Hα-helixtrans-57.7-42.6177.6-179.262.8000111.5A35 R36 E37 V41 L42 Q43 F100 L101A35-L39 WeakPolarHBondContact O-CB 3.44Å; A35-L39 PolarHBondContact O-N 3.46Å; R36-L39 PolarHBondContact O-N 3.16Å; E37-L39 VanDerWaalsContact C-N 3.33Å; E37-L39 PolarHBondContact O-N 3.27Å; L39-V41 VanDerWaalsContact C-N 3.34Å; L39-V41 PolarHBondContact O-N 2.83Å; L39-L42 PolarHBondContact O-N 2.99Å; L39-Q43 HydrophobicContact CD1-CG 3.72Å; L39-Q43 HydrophobicContact CG-CG 3.97Å; L39-Q43 VanDerWaalsContact O-CB 3.29Å; L39-Q43 WeakPolarHBondContact O-CB 3.42Å; L39-Q43 VanDerWaalsContact O-CG 3.3Å; L39-Q43 WeakPolarHBondContact O-CG 3.44Å; L39-Q43 PolarHBondContact O-N 2.98Å; L39-F100 HydrophobicContact CD1-CE1 3.83Å; L39-F100 HydrophobicContact CD1-CZ 4.11Å; L39-L101 HydrophobicContact CB-CD2 3.94Å; L39-L101 HydrophobicContact CD1-CD2 3.83Å
40T96.6Very high92.4Very high97 Ų9746.4 Ų46.460%0.59524%0.244SC*.Hα-helixtrans-63-42.7-179.7-580000111.1R36 E37 I38 S44R36-T40 WeakPolarHBondContact O-CB 3.14Å; R36-T40 PolarHBondContact O-N 2.61Å; R36-T40 PolarHBondContact O-OG1 3.36Å; E37-T40 WeakPolarHBondContact O-CB 3.3Å; E37-T40 PolarHBondContact O-N 3.32Å; E37-T40 VanDerWaalsContact O-N 3.13Å; I38-T40 VanDerWaalsContact C-N 3.27Å; I38-T40 PolarHBondContact O-N 2.76Å; T40-S44 PolarHBondContact O-N 3.26Å
41V96.1Very high91.5Very high30 Ų3044.8 Ų44.818%0.18223%0.234CC..Hα-helixtrans-60.2-49.8174.9172.60000110.4E37 I38 L39 S44 K57 R60 L64E37-V41 WeakPolarHBondContact O-CG2 3.47Å; E37-V41 PolarHBondContact O-N 3.2Å; I38-V41 PolarHBondContact O-N 3.08Å; L39-V41 VanDerWaalsContact C-N 3.34Å; L39-V41 PolarHBondContact O-N 2.83Å; V41-S44 WeakPolarHBondContact O-CB 3.48Å; V41-S44 PolarHBondContact O-N 3.09Å; V41-S44 PolarHBondContact O-OG 2.99Å; V41-K57 HydrophobicContact CG1-CB 4.08Å; V41-K57 HydrophobicContact CG1-CD 4.26Å; V41-K57 WeakPolarHBondContact CG1-O 3.36Å; V41-R60 HydrophobicContact CG1-CB 4.14Å; V41-R60 HydrophobicContact CG1-CG 4.12Å; V41-R60 HydrophobicContact CG2-CG 4.16Å; V41-L64 HydrophobicContact CG2-CD1 4.16Å
42L95.3Very high90.7Very high0 Ų054 Ų540%027%0.274CS..Hα-helixtrans-71.5-36-176.2-64.1178.7000112.6I38 L39 S44 V45 A61 L101 F104 V105 L108I38-L42 HydrophobicContact CG2-CD1 3.86Å; I38-L42 HydrophobicContact CG2-CG 4.3Å; I38-L42 WeakPolarHBondContact O-CG 3.42Å; I38-L42 PolarHBondContact O-N 3.31Å; L39-L42 PolarHBondContact O-N 2.99Å; L42-S44 PolarHBondContact O-N 3.37Å; L42-V45 VanDerWaalsContact O-CB 3.31Å; L42-V45 WeakPolarHBondContact O-CB 3.41Å; L42-V45 WeakPolarHBondContact O-CG1 3.47Å; L42-V45 PolarHBondContact O-N 3.36Å; L42-A61 HydrophobicContact CD1-CB 4.43Å; L42-A61 HydrophobicContact CD2-CB 3.79Å; L42-A61 HydrophobicContact CG-CB 4.16Å; L42-L101 HydrophobicContact CD1-CB 4.46Å; L42-L101 HydrophobicContact CD1-CD2 4Å; L42-F104 HydrophobicContact CB-CD1 3.91Å; L42-F104 HydrophobicContact CB-CE1 3.92Å; L42-F104 HydrophobicContact CD1-CD1 3.92Å; L42-F104 HydrophobicContact CG-CD1 4.43Å; L42-V105 HydrophobicContact CD1-CG2 3.72Å; L42-V105 HydrophobicContact CD2-CG2 3.89Å; L42-V105 HydrophobicContact CG-CG2 4.43Å; L42-L108 HydrophobicContact CD2-CD1 4.34Å
43Q92.6Very high90.2Very high70 Ų7055.2 Ų55.233%0.32728%0.279SS..Hα-helixtrans-63.6-21.9176.9-80.1-173.5-8.600113.2L39 V45 H46L39-Q43 HydrophobicContact CD1-CG 3.72Å; L39-Q43 HydrophobicContact CG-CG 3.97Å; L39-Q43 VanDerWaalsContact O-CB 3.29Å; L39-Q43 WeakPolarHBondContact O-CB 3.42Å; L39-Q43 VanDerWaalsContact O-CG 3.3Å; L39-Q43 WeakPolarHBondContact O-CG 3.44Å; L39-Q43 PolarHBondContact O-N 2.98Å; Q43-V45 PolarHBondContact O-N 3.36Å; Q43-V45 VanDerWaalsContact O-N 3.16Å; Q43-H46 WeakPolarHBondContact O-CB 3.31Å; Q43-H46 PolarHBondContact O-CD2 2.92Å; Q43-H46 VanDerWaalsContact O-CD2 3.31Å; Q43-H46 PolarHBondContact O-N 3.19Å; Q43-H46 VanDerWaalsContact O-N 3.16Å
44S91.6Very high89.9Confident17 Ų1751.1 Ų51.112%0.11926%0.261CS..G310 helixtrans-63.2-16.1173.874.20000113.3T40 V41 L42 H46 Q47 K57T40-S44 PolarHBondContact O-N 3.26Å; V41-S44 WeakPolarHBondContact O-CB 3.48Å; V41-S44 PolarHBondContact O-N 3.09Å; V41-S44 PolarHBondContact O-OG 2.99Å; L42-S44 PolarHBondContact O-N 3.37Å; S44-H46 PolarHBondContact O-N 3.3Å; S44-Q47 WeakPolarHBondContact O-CB 3.47Å; S44-Q47 WeakPolarHBondContact O-CG 3.45Å; S44-Q47 PolarHBondContact O-N 3.05Å; S44-Q47 VanDerWaalsContact O-N 3.08Å; S44-K57 WeakPolarHBondContact OG-CD 3.43Å; S44-K57 WeakPolarHBondContact OG-CE 3.47Å
45V91.8Very high89.7Confident2 Ų255.4 Ų55.41%0.01229%0.288CS..G310 helixtrans-59.1-28.1172.975.90000112.9L42 Q43 Q47 F51 I54 F104 L108 L154L42-V45 VanDerWaalsContact O-CB 3.31Å; L42-V45 WeakPolarHBondContact O-CB 3.41Å; L42-V45 WeakPolarHBondContact O-CG1 3.47Å; L42-V45 PolarHBondContact O-N 3.36Å; Q43-V45 PolarHBondContact O-N 3.36Å; Q43-V45 VanDerWaalsContact O-N 3.16Å; V45-Q47 PolarHBondContact O-N 3.26Å; V45-F51 HydrophobicContact CG2-CD1 4.42Å; V45-I54 HydrophobicContact CG2-CD1 3.81Å; V45-I54 HydrophobicContact CG2-CG1 3.46Å; V45-I54 VanDerWaalsContact CG2-CG1 3.46Å; V45-F104 HydrophobicContact CG1-CE1 4.38Å; V45-F104 HydrophobicContact CG1-CZ 4.05Å; V45-L108 HydrophobicContact CG2-CD2 4.34Å; V45-L154 HydrophobicContact CG1-CD1 3.89Å; V45-L154 HydrophobicContact CG2-CD1 4.41Å
46H90.6Very high89.5Confident23 Ų2359.1 Ų59.111%0.10631%0.314CS..G310 helixtrans-75-7.9179.8-65.2-69.1000113.5Q43 S44 E150 N157Q43-H46 WeakPolarHBondContact O-CB 3.31Å; Q43-H46 PolarHBondContact O-CD2 2.92Å; Q43-H46 VanDerWaalsContact O-CD2 3.31Å; Q43-H46 PolarHBondContact O-N 3.19Å; Q43-H46 VanDerWaalsContact O-N 3.16Å; S44-H46 PolarHBondContact O-N 3.3Å; H46-E150 IonicContact CD2-OE1 2.75Å; H46-E150 IonicContact CE1-OE1 3.17Å; H46-E150 IonicContact NE2-OE1 2.84Å; H46-E150 PolarHBondContact NE2-OE1 3.4Å; H46-N157 HydrophobicContact CB-CB 4.47Å; H46-N157 WeakPolarHBondContact CB-ND2 3.3Å; H46-N157 PolarHBondContact ND1-ND2 3.39Å
47Q86.1Confident89.4Confident111 Ų11155.9 Ų55.952%0.51930%0.303SS..SBendtrans-76.6156.9176.9-63.4-178.4-18.200110.9S44 V45 S49 G50S44-Q47 WeakPolarHBondContact O-CB 3.47Å; S44-Q47 WeakPolarHBondContact O-CG 3.45Å; S44-Q47 PolarHBondContact O-N 3.05Å; S44-Q47 VanDerWaalsContact O-N 3.08Å; V45-Q47 PolarHBondContact O-N 3.26Å; Q47-S49 PolarHBondContact O-N 3.03Å; Q47-S49 VanDerWaalsContact O-N 3.09Å; Q47-G50 WeakPolarHBondContact O-CA 3.32Å; Q47-G50 PolarHBondContact O-N 3.49Å
48P72.6Confident89.3Confident125 Ų12552.1 Ų52.181%0.81229%0.286SS*.THydrogen-bonded Turntrans-55-32.6-175.3-28.135.3000115.4
49S73.6Confident89.2Confident62 Ų6254.5 Ų54.543%0.43431%0.306SS..THydrogen-bonded Turntrans-94.6-7.8174.456.50000113.9Q47 F51 K52Q47-S49 PolarHBondContact O-N 3.03Å; Q47-S49 VanDerWaalsContact O-N 3.09Å; S49-F51 VanDerWaalsContact C-N 3.28Å; S49-F51 PolarHBondContact O-N 3.09Å; S49-K52 PolarHBondContact O-N 2.9Å
50G73.7Confident89.1Confident1 Ų159.5 Ų59.51%0.0132%0.323CS..G310 helixtrans-61.4-33-170.600000113.7Q47 K52 E53 I54Q47-G50 WeakPolarHBondContact O-CA 3.32Å; Q47-G50 PolarHBondContact O-N 3.49Å; G50-K52 VanDerWaalsContact C-N 3.31Å; G50-K52 PolarHBondContact O-N 3.38Å; G50-E53 PolarHBondContact O-N 3.38Å; G50-E53 VanDerWaalsContact O-N 3.11Å; G50-I54 PolarHBondContact O-N 2.94Å
51F78.3Confident89.2Confident32 Ų3254.9 Ų54.914%0.1430%0.295CS..G310 helixtrans-63.1-32.9178.8-66-77.4000113.8V45 S49 E53 I54 L154 S158 A161V45-F51 HydrophobicContact CG2-CD1 4.42Å; S49-F51 VanDerWaalsContact C-N 3.28Å; S49-F51 PolarHBondContact O-N 3.09Å; F51-E53 VanDerWaalsContact C-N 3.31Å; F51-I54 HydrophobicContact CD1-CD1 4.18Å; F51-I54 WeakPolarHBondContact O-CD1 3.5Å; F51-I54 WeakPolarHBondContact O-CG1 3.32Å; F51-L154 HydrophobicContact CE1-CD1 3.73Å; F51-L154 HydrophobicContact CE1-CG 4.47Å; F51-L154 HydrophobicContact CZ-CD1 4.05Å; F51-S158 WeakPolarHBondContact CE1-OG 3.12Å; F51-S158 WeakPolarHBondContact CZ-OG 3.35Å; F51-A161 HydrophobicContact CD2-CB 3.6Å; F51-A161 HydrophobicContact CE2-CB 3.4Å; F51-A161 VanDerWaalsContact CE2-CB 3.4Å; F51-A161 HydrophobicContact CZ-CB 4.47Å
52K81.6Confident89.2Confident194 Ų19457.9 Ų57.984%0.84330%0.303SS*.G310 helixtrans-76-23.3176.9-65.1-177.7-178.6178.40112.3S49 G50S49-K52 PolarHBondContact O-N 2.9Å; G50-K52 VanDerWaalsContact C-N 3.31Å; G50-K52 PolarHBondContact O-N 3.38Å
53E88.1Confident89.2Confident78 Ų7863 Ų6336%0.36433%0.327SS..G310 helixtrans-951.9-176.8-64.4179.3-160.300113G50 F51 P55 S56 K57G50-E53 PolarHBondContact O-N 3.38Å; G50-E53 VanDerWaalsContact O-N 3.11Å; F51-E53 VanDerWaalsContact C-N 3.31Å; E53-P55 VanDerWaalsContact C-N 3.34Å; E53-S56 WeakPolarHBondContact O-CB 3.46Å; E53-S56 PolarHBondContact O-N 3.25Å; E53-K57 HydrophobicContact CB-CG 4.32Å; E53-K57 WeakPolarHBondContact O-CG 3.01Å; E53-K57 PolarHBondContact O-N 2.87Å; E53-K57 WeakPolarHBondContact OE2-CE 3.42Å; E53-K57 IonicContact OE2-NZ 2.69Å; E53-K57 PolarHBondContact OE2-NZ 3.37Å
54I91.6Very high89.5Confident11 Ų1160.5 Ų60.56%0.05632%0.315CS..Hα-helixtrans-45.9-50.8-177.9-72.7170.7000112.6V45 G50 F51 S56 K57 C58 L108V45-I54 HydrophobicContact CG2-CD1 3.81Å; V45-I54 HydrophobicContact CG2-CG1 3.46Å; V45-I54 VanDerWaalsContact CG2-CG1 3.46Å; G50-I54 PolarHBondContact O-N 2.94Å; F51-I54 HydrophobicContact CD1-CD1 4.18Å; F51-I54 WeakPolarHBondContact O-CD1 3.5Å; F51-I54 WeakPolarHBondContact O-CG1 3.32Å; I54-S56 VanDerWaalsContact C-N 3.31Å; I54-S56 PolarHBondContact O-N 3.35Å; I54-K57 PolarHBondContact O-N 2.86Å; I54-C58 WeakPolarHBondContact O-CB 3.49Å; I54-C58 PolarHBondContact O-N 3.13Å; I54-C58 PolarHBondContact O-SG 3.2Å; I54-L108 HydrophobicContact CD1-CD2 4.33Å; I54-L108 HydrophobicContact CG2-CB 3.89Å
55P93.9Very high89.8Confident95 Ų9560 Ų6062%0.61731%0.311SS*.Hα-helixtrans-60.6-40.3-178.5-24.435.1000112.9E53 C58 A59E53-P55 VanDerWaalsContact C-N 3.34Å; P55-C58 PolarHBondContact O-N 2.72Å; P55-A59 WeakPolarHBondContact O-CB 3.45Å; P55-A59 PolarHBondContact O-N 3.35Å
56S94.4Very high90Very high79 Ų7963.3 Ų63.355%0.55233%0.333SS*.Hα-helixtrans-68.8-41.3178.5-179.80000111.9E53 I54 A59 R60E53-S56 WeakPolarHBondContact O-CB 3.46Å; E53-S56 PolarHBondContact O-N 3.25Å; I54-S56 VanDerWaalsContact C-N 3.31Å; I54-S56 PolarHBondContact O-N 3.35Å; S56-A59 PolarHBondContact O-N 2.92Å; S56-R60 WeakPolarHBondContact O-CB 3.36Å; S56-R60 PolarHBondContact O-N 3.35Å
57K94.7Very high90.3Very high46 Ų4665 Ų6520%0.235%0.346CS..Hα-helixtrans-64.7-40.7175.3-57.2-54.2178.2-172.30111.7V41 S44 E53 I54 R60 A61V41-K57 HydrophobicContact CG1-CB 4.08Å; V41-K57 HydrophobicContact CG1-CD 4.26Å; V41-K57 WeakPolarHBondContact CG1-O 3.36Å; S44-K57 WeakPolarHBondContact OG-CD 3.43Å; S44-K57 WeakPolarHBondContact OG-CE 3.47Å; E53-K57 HydrophobicContact CB-CG 4.32Å; E53-K57 WeakPolarHBondContact O-CG 3.01Å; E53-K57 PolarHBondContact O-N 2.87Å; E53-K57 WeakPolarHBondContact OE2-CE 3.42Å; E53-K57 IonicContact OE2-NZ 2.69Å; E53-K57 PolarHBondContact OE2-NZ 3.37Å; I54-K57 PolarHBondContact O-N 2.86Å; K57-R60 PolarHBondContact O-N 3.33Å; K57-A61 WeakPolarHBondContact O-CB 3.48Å; K57-A61 PolarHBondContact O-N 3.46Å
58C95.8Very high90.9Very high0 Ų059.7 Ų59.70%032%0.321CS..Hα-helixtrans-66.1-43.4177.3-65.70000111.4I54 P55 R60 A61 R62 V105 E109I54-C58 WeakPolarHBondContact O-CB 3.49Å; I54-C58 PolarHBondContact O-N 3.13Å; I54-C58 PolarHBondContact O-SG 3.2Å; P55-C58 PolarHBondContact O-N 2.72Å; C58-R60 VanDerWaalsContact C-N 3.34Å; C58-R60 PolarHBondContact O-N 3.35Å; C58-A61 PolarHBondContact O-N 3.15Å; C58-R62 WeakPolarHBondContact O-CG 3.38Å; C58-R62 PolarHBondContact O-N 2.8Å; C58-V105 HydrophobicContact CB-CG1 4.19Å; C58-E109 HydrophobicContact CB-CG 3.96Å; C58-E109 WeakPolarHBondContact CB-OE1 3.36Å
59A96.3Very high92Very high50 Ų5059.1 Ų59.141%0.41330%0.302SS..Hα-helixtrans-57.5-47.2173.500000111.6P55 S56 A61 R62 E63P55-A59 WeakPolarHBondContact O-CB 3.45Å; P55-A59 PolarHBondContact O-N 3.35Å; S56-A59 PolarHBondContact O-N 2.92Å; A59-A61 PolarHBondContact O-N 2.95Å; A59-R62 WeakPolarHBondContact O-CB 3.44Å; A59-R62 PolarHBondContact O-N 3.46Å; A59-E63 PolarHBondContact O-N 3.02Å
60R96.6Very high93.2Very high127 Ų12760.7 Ų60.748%0.47931%0.31SS..Hα-helixtrans-63-39.4176.7-177.356.9175.5175.90.6112.8V41 S56 K57 C58 R62 E63 L64V41-R60 HydrophobicContact CG1-CB 4.14Å; V41-R60 HydrophobicContact CG1-CG 4.12Å; V41-R60 HydrophobicContact CG2-CG 4.16Å; S56-R60 WeakPolarHBondContact O-CB 3.36Å; S56-R60 PolarHBondContact O-N 3.35Å; K57-R60 PolarHBondContact O-N 3.33Å; C58-R60 VanDerWaalsContact C-N 3.34Å; C58-R60 PolarHBondContact O-N 3.35Å; R60-R62 VanDerWaalsContact C-N 3.34Å; R60-E63 VanDerWaalsContact CD-OE2 3.3Å; R60-E63 WeakPolarHBondContact CD-OE2 3.39Å; R60-E63 IonicContact CZ-OE2 3.89Å; R60-E63 IonicContact NE-OE2 3.81Å; R60-E63 IonicContact NH1-OE2 3.47Å; R60-E63 PolarHBondContact NH1-OE2 2.84Å; R60-E63 PolarHBondContact O-N 3.44Å; R60-L64 PolarHBondContact O-N 3.43Å
61A97.1Very high94.3Very high0 Ų062.3 Ų62.30%032%0.317CS..Hα-helixtrans-62.9-41.4174.500000111.5I38 L42 K57 C58 A59 E63 L64 F65 V105I38-A61 HydrophobicContact CG2-CB 4.09Å; L42-A61 HydrophobicContact CD1-CB 4.43Å; L42-A61 HydrophobicContact CD2-CB 3.79Å; L42-A61 HydrophobicContact CG-CB 4.16Å; K57-A61 WeakPolarHBondContact O-CB 3.48Å; K57-A61 PolarHBondContact O-N 3.46Å; C58-A61 PolarHBondContact O-N 3.15Å; A59-A61 PolarHBondContact O-N 2.95Å; A61-E63 PolarHBondContact O-N 3.39Å; A61-L64 PolarHBondContact O-N 2.92Å; A61-F65 WeakPolarHBondContact O-CD2 3.38Å; A61-F65 PolarHBondContact O-N 3.44Å; A61-V105 HydrophobicContact CB-CG2 3.8Å
62R96.3Very high95.1Very high93 Ų9360.9 Ų60.935%0.35131%0.31SS..Hα-helixtrans-62.4-37.9175.9-72.5-179.5175.2-75.11.7112.8C58 A59 R60 F65 C66 V105 E109C58-R62 WeakPolarHBondContact O-CG 3.38Å; C58-R62 PolarHBondContact O-N 2.8Å; A59-R62 WeakPolarHBondContact O-CB 3.44Å; A59-R62 PolarHBondContact O-N 3.46Å; R60-R62 VanDerWaalsContact C-N 3.34Å; R62-F65 WeakPolarHBondContact O-CB 3.31Å; R62-F65 PolarHBondContact O-N 3.25Å; R62-C66 PolarHBondContact O-N 3.44Å; R62-V105 HydrophobicContact CG-CG1 4.21Å; R62-E109 IonicContact CZ-OE1 3.22Å; R62-E109 IonicContact CZ-OE2 3.8Å; R62-E109 IonicContact NE-OE1 3.81Å; R62-E109 PolarHBondContact NE-OE1 3.34Å; R62-E109 IonicContact NE-OE2 3.65Å; R62-E109 PolarHBondContact NE-OE2 2.82Å; R62-E109 IonicContact NH2-OE1 2.74Å; R62-E109 IonicContact NH2-OE2 3.67Å; R62-E109 PolarHBondContact NH2-OE2 3.33Å
63E96.9Very high95.8Very high108 Ų10854.3 Ų54.351%0.50529%0.292SS..Hα-helixtrans-60.4-45171.8-69172.9179.700111.8A59 R60 A61 F65 C66A59-E63 PolarHBondContact O-N 3.02Å; R60-E63 VanDerWaalsContact CD-OE2 3.3Å; R60-E63 WeakPolarHBondContact CD-OE2 3.39Å; R60-E63 IonicContact CZ-OE2 3.89Å; R60-E63 IonicContact NE-OE2 3.81Å; R60-E63 IonicContact NH1-OE2 3.47Å; R60-E63 PolarHBondContact NH1-OE2 2.84Å; R60-E63 PolarHBondContact O-N 3.44Å; A61-E63 PolarHBondContact O-N 3.39Å; E63-F65 VanDerWaalsContact C-N 3.28Å; E63-F65 PolarHBondContact O-N 3.37Å; E63-C66 VanDerWaalsContact O-CB 3.22Å; E63-C66 WeakPolarHBondContact O-CB 3.43Å; E63-C66 PolarHBondContact O-N 2.81Å
64L97.6Very high96.1Very high17 Ų1754 Ų549%0.08929%0.291CS..Hα-helixtrans-66.5-30.1177.7-68.4172000112.2T34 E37 I38 V41 R60 A61 C66 T67 V68T34-L64 HydrophobicContact CG2-CB 4.38Å; E37-L64 HydrophobicContact CB-CD1 4.26Å; I38-L64 HydrophobicContact CB-CD1 4.49Å; I38-L64 HydrophobicContact CD1-CB 3.94Å; I38-L64 HydrophobicContact CG1-CB 3.44Å; I38-L64 VanDerWaalsContact CG1-CB 3.44Å; I38-L64 HydrophobicContact CG1-CD1 3.75Å; I38-L64 HydrophobicContact CG1-CG 4.25Å; V41-L64 HydrophobicContact CG2-CD1 4.16Å; R60-L64 PolarHBondContact O-N 3.43Å; A61-L64 PolarHBondContact O-N 2.92Å; L64-C66 PolarHBondContact O-N 3.35Å; L64-T67 WeakPolarHBondContact O-CB 3.21Å; L64-T67 PolarHBondContact O-N 3.07Å; L64-V68 PolarHBondContact O-N 2.87Å; L64-V68 VanDerWaalsContact O-N 3.11Å
65F97.8Very high96.3Very high5 Ų553.5 Ų53.52%0.02229%0.288CS..Hα-helixtrans-63.9-25.3171.2-80.3-67.1000113I38 A61 R62 E63 T67 V68 R69 L98 L101 A102 V105 I122 L123I38-F65 HydrophobicContact CD1-CD1 4.06Å; I38-F65 HydrophobicContact CD1-CD2 4.37Å; I38-F65 HydrophobicContact CD1-CE1 4Å; I38-F65 HydrophobicContact CD1-CE2 4.31Å; I38-F65 HydrophobicContact CD1-CG 4.24Å; I38-F65 HydrophobicContact CD1-CZ 4.13Å; I38-F65 HydrophobicContact CG2-CE2 4.16Å; I38-F65 HydrophobicContact CG2-CZ 4.27Å; A61-F65 WeakPolarHBondContact O-CD2 3.38Å; A61-F65 PolarHBondContact O-N 3.44Å; R62-F65 WeakPolarHBondContact O-CB 3.31Å; R62-F65 PolarHBondContact O-N 3.25Å; E63-F65 VanDerWaalsContact C-N 3.28Å; E63-F65 PolarHBondContact O-N 3.37Å; F65-T67 VanDerWaalsContact C-N 3.31Å; F65-T67 PolarHBondContact O-N 3.3Å; F65-V68 HydrophobicContact CD1-CB 4.33Å; F65-V68 HydrophobicContact CD1-CG2 4.23Å; F65-V68 WeakPolarHBondContact O-CB 3.32Å; F65-V68 PolarHBondContact O-N 3.12Å; F65-R69 WeakPolarHBondContact O-CG 3.42Å; F65-R69 PolarHBondContact O-N 3.15Å; F65-L98 HydrophobicContact CE1-CD2 4.16Å; F65-L101 HydrophobicContact CZ-CB 3.82Å; F65-A102 HydrophobicContact CE1-CB 4.33Å; F65-A102 HydrophobicContact CZ-CB 4.01Å; F65-V105 HydrophobicContact CE2-CG2 4.16Å; F65-I122 HydrophobicContact CB-CG2 4.12Å; F65-I122 HydrophobicContact CD1-CG2 3.77Å; F65-I122 HydrophobicContact CD2-CG2 4.12Å; F65-I122 HydrophobicContact CE1-CG2 4.17Å; F65-I122 HydrophobicContact CG-CG2 3.75Å; F65-L123 HydrophobicContact CD1-CD2 3.96Å; F65-L123 HydrophobicContact CE1-CD2 3.87Å
66C96.7Very high96.3Very high72 Ų7252.1 Ų52.149%0.48627%0.273SS..Hα-helixtrans-63-39.3170-630000111.5R62 E63 L64 R69 T70R62-C66 PolarHBondContact O-N 3.44Å; E63-C66 VanDerWaalsContact O-CB 3.22Å; E63-C66 WeakPolarHBondContact O-CB 3.43Å; E63-C66 PolarHBondContact O-N 2.81Å; L64-C66 PolarHBondContact O-N 3.35Å; C66-R69 WeakPolarHBondContact O-CB 3.29Å; C66-R69 PolarHBondContact O-N 2.97Å; C66-T70 PolarHBondContact O-N 3.22Å; C66-T70 PolarHBondContact O-OG1 3.48Å
67T97.2Very high96.3Very high59 Ų5953.5 Ų53.536%0.36228%0.278SS..Hα-helixtrans-65.2-41173.7-520000111.3T34 L64 F65 R69 T70 H71T34-T67 HydrophobicContact CG2-CG2 4.38Å; L64-T67 WeakPolarHBondContact O-CB 3.21Å; L64-T67 PolarHBondContact O-N 3.07Å; F65-T67 VanDerWaalsContact C-N 3.31Å; F65-T67 PolarHBondContact O-N 3.3Å; T67-R69 VanDerWaalsContact C-N 3.31Å; T67-R69 PolarHBondContact O-N 3.3Å; T67-T70 WeakPolarHBondContact O-CB 3.44Å; T67-T70 PolarHBondContact O-N 2.94Å; T67-T70 VanDerWaalsContact O-N 3.16Å; T67-H71 PolarHBondContact O-CD2 3.24Å; T67-H71 PolarHBondContact O-N 2.97Å
68V97.6Very high96.2Very high0 Ų054.1 Ų54.10%028%0.281CS..Hα-helixtrans-57.3-44173.5174.50000111.1L31 T34 I38 L64 F65 T70 H71 M72 L98 L123L31-V68 HydrophobicContact CD2-CG1 3.93Å; T34-V68 HydrophobicContact CG2-CG2 3.63Å; I38-V68 HydrophobicContact CD1-CG2 3.88Å; L64-V68 PolarHBondContact O-N 2.87Å; L64-V68 VanDerWaalsContact O-N 3.11Å; F65-V68 HydrophobicContact CD1-CB 4.33Å; F65-V68 HydrophobicContact CD1-CG2 4.23Å; F65-V68 WeakPolarHBondContact O-CB 3.32Å; F65-V68 PolarHBondContact O-N 3.12Å; V68-T70 VanDerWaalsContact C-N 3.3Å; V68-T70 PolarHBondContact O-N 3.4Å; V68-H71 PolarHBondContact O-N 3.11Å; V68-M72 HydrophobicContact CG1-CE 4.31Å; V68-M72 HydrophobicContact CG1-CG 4.12Å; V68-M72 WeakPolarHBondContact O-CB 3.12Å; V68-M72 WeakPolarHBondContact O-CG 3.41Å; V68-M72 PolarHBondContact O-N 3.21Å; V68-L98 HydrophobicContact CG1-CD1 3.77Å; V68-L98 HydrophobicContact CG1-CD2 4.02Å; V68-L98 HydrophobicContact CG2-CD2 3.86Å; V68-L123 HydrophobicContact CG1-CD2 4Å
69R97.2Very high96Very high112 Ų11254.9 Ų54.942%0.42328%0.284SS..Hα-helixtrans-58.2-41.8176.9-72.3176.8175.1-175.3-2112.1F65 C66 T67 M72 A73 Q121 I122F65-R69 WeakPolarHBondContact O-CG 3.42Å; F65-R69 PolarHBondContact O-N 3.15Å; C66-R69 WeakPolarHBondContact O-CB 3.29Å; C66-R69 PolarHBondContact O-N 2.97Å; T67-R69 VanDerWaalsContact C-N 3.31Å; T67-R69 PolarHBondContact O-N 3.3Å; R69-M72 PolarHBondContact O-N 3.34Å; R69-A73 WeakPolarHBondContact O-CB 3.34Å; R69-A73 PolarHBondContact O-N 3.05Å; R69-Q121 VanDerWaalsContact CZ-O 3.32Å; R69-Q121 PolarHBondContact NE-O 3.16Å; R69-Q121 PolarHBondContact NH2-O 3.4Å; R69-I122 WeakPolarHBondContact CG-O 3.39Å; R69-I122 PolarHBondContact NE-O 3.25Å
70T97.1Very high95.7Very high96 Ų9655.7 Ų55.759%0.58929%0.285SS*.Hα-helixtrans-62.5-46.4176.7-54.90000111.2C66 T67 V68 A73 E74C66-T70 PolarHBondContact O-N 3.22Å; C66-T70 PolarHBondContact O-OG1 3.48Å; T67-T70 WeakPolarHBondContact O-CB 3.44Å; T67-T70 PolarHBondContact O-N 2.94Å; T67-T70 VanDerWaalsContact O-N 3.16Å; V68-T70 VanDerWaalsContact C-N 3.3Å; V68-T70 PolarHBondContact O-N 3.4Å; T70-A73 PolarHBondContact O-N 3.18Å; T70-E74 PolarHBondContact O-N 3.18Å
71H96.9Very high95.3Very high34 Ų3453 Ų5316%0.15729%0.289CS..Hα-helixtrans-67.4-35.6177.2-64.6-37.6000112.9V27 L31 T67 V68 E74 L75V27-H71 HydrophobicContact CG1-CB 4.44Å; V27-H71 VanDerWaalsContact CG1-O 3.31Å; V27-H71 WeakPolarHBondContact CG1-O 3.4Å; L31-H71 HydrophobicContact CD2-CB 3.51Å; L31-H71 HydrophobicContact CG-CB 3.77Å; T67-H71 PolarHBondContact O-CD2 3.24Å; T67-H71 PolarHBondContact O-N 2.97Å; V68-H71 PolarHBondContact O-N 3.11Å; H71-E74 PolarHBondContact O-N 3.05Å; H71-L75 WeakPolarHBondContact O-CB 3.4Å; H71-L75 PolarHBondContact O-N 3.31Å
72M95.8Very high94.9Very high2 Ų261.5 Ų61.51%0.0133%0.33CS..Hα-helixtrans-64.1-43.3172.6-73.2-61.9179.400111.1L31 V68 R69 E74 L75 K76 L95 L98 I125 F133L31-M72 HydrophobicContact CD1-CE 3.96Å; L31-M72 HydrophobicContact CD1-SD 3.96Å; L31-M72 HydrophobicContact CD2-CE 3.85Å; L31-M72 HydrophobicContact CD2-CG 4.19Å; L31-M72 HydrophobicContact CD2-SD 4.22Å; V68-M72 HydrophobicContact CG1-CE 4.31Å; V68-M72 HydrophobicContact CG1-CG 4.12Å; V68-M72 WeakPolarHBondContact O-CB 3.12Å; V68-M72 WeakPolarHBondContact O-CG 3.41Å; V68-M72 PolarHBondContact O-N 3.21Å; R69-M72 PolarHBondContact O-N 3.34Å; M72-E74 VanDerWaalsContact C-N 3.3Å; M72-E74 PolarHBondContact O-N 2.68Å; M72-L75 PolarHBondContact O-N 3.49Å; M72-L75 HydrophobicContact SD-CD2 4.4Å; M72-K76 VanDerWaalsContact O-CG 3.31Å; M72-K76 WeakPolarHBondContact O-CG 3.44Å; M72-K76 PolarHBondContact O-N 3.22Å; M72-K76 VanDerWaalsContact O-N 3.11Å; M72-L95 HydrophobicContact CE-CD1 4.16Å; M72-L98 HydrophobicContact CE-CD1 3.35Å; M72-I125 HydrophobicContact CB-CG2 4.17Å; M72-I125 HydrophobicContact CG-CG2 4.24Å; M72-I125 HydrophobicContact SD-CG2 4.4Å; M72-F133 HydrophobicContact SD-CE1 4.33Å; M72-F133 HydrophobicContact SD-CZ 4.46Å
73A95.6Very high94.6Very high56 Ų5660.4 Ų60.446%0.46333%0.328SS..Hα-helixtrans-60.7-40175.200000111.7R69 T70R69-A73 WeakPolarHBondContact O-CB 3.34Å; R69-A73 PolarHBondContact O-N 3.05Å; T70-A73 PolarHBondContact O-N 3.18Å
74E95.9Very high94.5Very high72 Ų7255.5 Ų55.534%0.33631%0.305SS..Hα-helixtrans-64.8-43.4173.2-179.5178.3-172.200112.3V27 T70 H71 M72 K76 T77 K78V27-E74 HydrophobicContact CG1-CB 4.45Å; V27-E74 HydrophobicContact CG1-CG 4.44Å; V27-E74 HydrophobicContact CG2-CG 3.9Å; T70-E74 PolarHBondContact O-N 3.18Å; H71-E74 PolarHBondContact O-N 3.05Å; M72-E74 VanDerWaalsContact C-N 3.3Å; M72-E74 PolarHBondContact O-N 2.68Å; E74-K76 VanDerWaalsContact C-N 3.25Å; E74-K76 PolarHBondContact O-N 3.14Å; E74-T77 PolarHBondContact O-N 3.4Å; E74-T77 VanDerWaalsContact O-N 3.08Å; E74-T77 PolarHBondContact O-OG1 3.42Å; E74-K78 VanDerWaalsContact CG-CE 3.41Å; E74-K78 WeakPolarHBondContact OE1-CE 3.48Å; E74-K78 IonicContact OE1-NZ 3.92Å; E74-K78 PolarHBondContact OE1-NZ 2.93Å
75L95.3Very high94.3Very high0 Ų059.8 Ų59.80%032%0.321CS..Hα-helixtrans-58.8-39.9180-179.358.8000111.5I24 V27 L31 H71 M72 T77 K78 F79 W91 F133I24-L75 HydrophobicContact CB-CD1 4.38Å; I24-L75 HydrophobicContact CG1-CD1 4.23Å; I24-L75 HydrophobicContact CG2-CD1 3.99Å; V27-L75 HydrophobicContact CB-CD1 4.34Å; V27-L75 HydrophobicContact CG1-CB 3.82Å; V27-L75 HydrophobicContact CG1-CD1 4.44Å; L31-L75 HydrophobicContact CD1-CD2 4.09Å; H71-L75 WeakPolarHBondContact O-CB 3.4Å; H71-L75 PolarHBondContact O-N 3.31Å; M72-L75 PolarHBondContact O-N 3.49Å; M72-L75 HydrophobicContact SD-CD2 4.4Å; L75-T77 PolarHBondContact O-N 3.34Å; L75-T77 VanDerWaalsContact O-N 3.17Å; L75-K78 PolarHBondContact O-N 3.29Å; L75-K78 VanDerWaalsContact O-N 3.12Å; L75-F79 HydrophobicContact CD1-CE1 4.39Å; L75-F79 HydrophobicContact CG-CE1 4.27Å; L75-F79 WeakPolarHBondContact O-CD1 3.35Å; L75-F79 WeakPolarHBondContact O-CE1 3.3Å; L75-W91 HydrophobicContact CD1-CE3 4.26Å; L75-W91 HydrophobicContact CD2-CB 4.21Å; L75-W91 HydrophobicContact CD2-CD2 4.17Å; L75-W91 HydrophobicContact CD2-CE3 4.18Å; L75-W91 HydrophobicContact CD2-CG 4.21Å; L75-F133 HydrophobicContact CD2-CE2 3.74Å; L75-F133 HydrophobicContact CD2-CZ 3.84Å; L75-F133 HydrophobicContact CG-CE2 4.07Å
76K93.3Very high94.2Very high67 Ų6764.7 Ų64.729%0.29134%0.339SS..Hα-helixtrans-58.8-25.7177.9-68.3179.9-162-174.60113.5M72 E74 G124 F133M72-K76 VanDerWaalsContact O-CG 3.31Å; M72-K76 WeakPolarHBondContact O-CG 3.44Å; M72-K76 PolarHBondContact O-N 3.22Å; M72-K76 VanDerWaalsContact O-N 3.11Å; E74-K76 VanDerWaalsContact C-N 3.25Å; E74-K76 PolarHBondContact O-N 3.14Å; K76-G124 PolarHBondContact NZ-O 3.44Å; K76-F133 HydrophobicContact CD-CB 3.85Å; K76-F133 HydrophobicContact CG-CB 3.55Å; K76-F133 HydrophobicContact CG-CD2 4.03Å; K76-F133 HydrophobicContact CG-CG 3.89Å
77T94.4Very high94.1Very high108 Ų10861.3 Ų61.366%0.66332%0.316SS*.THydrogen-bonded Turntrans-89.7-6.6-178.674.20000113.3E74 L75E74-T77 PolarHBondContact O-N 3.4Å; E74-T77 VanDerWaalsContact O-N 3.08Å; E74-T77 PolarHBondContact O-OG1 3.42Å; L75-T77 PolarHBondContact O-N 3.34Å; L75-T77 VanDerWaalsContact O-N 3.17Å
78K93.6Very high94Very high59 Ų5959.2 Ų59.226%0.25730%0.302SS..SBendtrans-85.2-15.8-175.7-54.5-55.3178.3173.80113.7D23 I24 V27 E74 L75D23-K78 HydrophobicContact CB-CD 4.36Å; I24-K78 HydrophobicContact CG1-CB 4.07Å; V27-K78 HydrophobicContact CG2-CG 4.18Å; E74-K78 VanDerWaalsContact CG-CE 3.41Å; E74-K78 WeakPolarHBondContact OE1-CE 3.48Å; E74-K78 IonicContact OE1-NZ 3.92Å; E74-K78 PolarHBondContact OE1-NZ 2.93Å; L75-K78 PolarHBondContact O-N 3.29Å; L75-K78 VanDerWaalsContact O-N 3.12Å
79F91.8Very high93.9Very high16 Ų1665.1 Ų65.17%0.0733%0.33CS..SBendtrans-145.7156-178.366-85.9000111.8V20 I24 L75 Y84 F87 W91 F133V20-F79 HydrophobicContact CG1-CB 4.07Å; I24-F79 HydrophobicContact CD1-CB 4.25Å; I24-F79 HydrophobicContact CD1-CD1 4.11Å; I24-F79 HydrophobicContact CD1-CG 4.43Å; I24-F79 HydrophobicContact CG1-CD1 4.27Å; L75-F79 HydrophobicContact CD1-CE1 4.39Å; L75-F79 HydrophobicContact CG-CE1 4.27Å; L75-F79 WeakPolarHBondContact O-CD1 3.35Å; L75-F79 WeakPolarHBondContact O-CE1 3.3Å; F79-Y84 HydrophobicContact CZ-CD2 4.41Å; F79-F87 HydrophobicContact CB-CD2 3.9Å; F79-F87 HydrophobicContact CB-CE2 3.96Å; F79-F87 HydrophobicContact CD2-CD2 4.2Å; F79-F87 HydrophobicContact CG-CD2 4.14Å; F79-W91 HydrophobicContact CD1-CH2 4.17Å; F79-W91 HydrophobicContact CD1-CZ3 4.19Å; F79-W91 HydrophobicContact CD2-CH2 4.48Å; F79-W91 AromaticContact CE1-CH2 3.48Å; F79-W91 HydrophobicContact CE1-CH2 3.48Å; F79-W91 VanDerWaalsContact CE1-CH2 3.48Å; F79-W91 HydrophobicContact CE1-CZ2 4.26Å; F79-W91 AromaticContact CE1-CZ3 3.69Å; F79-W91 HydrophobicContact CE1-CZ3 3.69Å; F79-W91 AromaticContact CE2-CH2 3.88Å; F79-W91 HydrophobicContact CE2-CH2 3.88Å; F79-W91 HydrophobicContact CE2-CZ2 4.45Å; F79-W91 AromaticContact CZ-CH2 3.29Å; F79-W91 HydrophobicContact CZ-CH2 3.29Å; F79-W91 AromaticContact CZ-CZ2 3.79Å; F79-W91 HydrophobicContact CZ-CZ2 3.79Å; F79-W91 HydrophobicContact CZ-CZ3 4.02Å; F79-F133 HydrophobicContact CE1-CD2 4.13Å; F79-F133 HydrophobicContact CE1-CE2 4.11Å; F79-F133 AromaticContact CZ-CD2 3.61Å; F79-F133 HydrophobicContact CZ-CD2 3.61Å; F79-F133 AromaticContact CZ-CE2 3.84Å; F79-F133 HydrophobicContact CZ-CE2 3.84Å
80P90Very high93.9Very high67 Ų6762.1 Ų62.144%0.43532%0.321SS..  trans-64.9135.1175.2-19.732.6000111.5E82 Q83P80-E82 PolarHBondContact O-N 3.35Å; P80-Q83 HydrophobicContact CB-CG 4.31Å; P80-Q83 HydrophobicContact CG-CG 4.47Å; P80-Q83 WeakPolarHBondContact O-CB 3.22Å; P80-Q83 PolarHBondContact O-N 3.21Å
81A86.6Confident93.9Very high69 Ų6957.6 Ų57.657%0.5729%0.293SS*.G310 helixtrans-54.3-32.8-175.700000114Q83 Y84A81-Q83 PolarHBondContact O-N 2.95Å; A81-Y84 PolarHBondContact O-N 3.3Å
82E88.7Confident93.9Very high180 Ų18058.1 Ų58.184%0.84129%0.294SS*.G310 helixtrans-65.7-23.2177.9-58.4-172.7-175.100113.4P80 Y84P80-E82 PolarHBondContact O-N 3.35Å; E82-Y84 VanDerWaalsContact C-N 3.32Å; E82-Y84 PolarHBondContact O-N 3.03Å
83Q91.8Very high93.9Very high70 Ų7063.4 Ų63.433%0.32732%0.317SS..G310 helixtrans-93.518-177.5-59.8-173.712.100113P80 A81 Y85 R86 F87P80-Q83 HydrophobicContact CB-CG 4.31Å; P80-Q83 HydrophobicContact CG-CG 4.47Å; P80-Q83 WeakPolarHBondContact O-CB 3.22Å; P80-Q83 PolarHBondContact O-N 3.21Å; A81-Q83 PolarHBondContact O-N 2.95Å; Q83-Y85 PolarHBondContact O-N 3.32Å; Q83-R86 HydrophobicContact CB-CB 4.12Å; Q83-R86 VanDerWaalsContact O-CB 3.27Å; Q83-R86 WeakPolarHBondContact O-CB 3.42Å; Q83-R86 PolarHBondContact O-N 3.42Å; Q83-F87 HydrophobicContact CB-CD2 4.13Å; Q83-F87 HydrophobicContact CB-CE2 3.88Å; Q83-F87 WeakPolarHBondContact O-CD2 3.31Å; Q83-F87 PolarHBondContact O-N 3.41Å; Q83-F87 VanDerWaalsContact OE1-CE2 3.27Å
84Y93.4Very high94.1Very high4 Ų460.8 Ų60.82%0.01630%0.295CS..Hα-helixtrans-46.1-56.7177.6179.5-90.3000112.8F79 A81 E82 R86 F87 H88 W91 F133 H134F79-Y84 HydrophobicContact CZ-CD2 4.41Å; A81-Y84 PolarHBondContact O-N 3.3Å; E82-Y84 VanDerWaalsContact C-N 3.32Å; E82-Y84 PolarHBondContact O-N 3.03Å; Y84-R86 VanDerWaalsContact C-N 3.26Å; Y84-R86 PolarHBondContact O-N 3.41Å; Y84-F87 PolarHBondContact O-N 3.32Å; Y84-H88 HydrophobicContact CE1-CB 4.38Å; Y84-H88 AromaticContact CE1-CD2 3.94Å; Y84-H88 AromaticContact CZ-CD2 3.98Å; Y84-H88 WeakPolarHBondContact O-CB 3.32Å; Y84-H88 PolarHBondContact O-N 3.48Å; Y84-W91 AromaticContact CD2-CZ2 3.83Å; Y84-W91 HydrophobicContact CD2-CZ2 3.83Å; Y84-W91 AromaticContact CE2-CZ2 3.76Å; Y84-W91 HydrophobicContact CE2-CZ2 3.76Å; Y84-W91 AromaticContact CE2-NE1 3.8Å; Y84-W91 HydrophobicContact CG-CZ2 4.37Å; Y84-W91 AromaticContact CZ-NE1 3.82Å; Y84-W91 WeakPolarHBondContact O-CZ2 3.45Å; Y84-F133 HydrophobicContact CD2-CD2 4.1Å; Y84-F133 HydrophobicContact CD2-CE2 4.36Å; Y84-F133 HydrophobicContact CD2-CG 4.36Å; Y84-F133 HydrophobicContact CE2-CD1 4.19Å; Y84-F133 AromaticContact CE2-CD2 3.97Å; Y84-F133 HydrophobicContact CE2-CD2 3.97Å; Y84-F133 HydrophobicContact CE2-CE1 4.19Å; Y84-F133 AromaticContact CE2-CE2 3.94Å; Y84-F133 HydrophobicContact CE2-CE2 3.94Å; Y84-F133 HydrophobicContact CE2-CG 4.07Å; Y84-F133 HydrophobicContact CE2-CZ 4.05Å; Y84-H134 AromaticContact CD1-CE1 3.42Å; Y84-H134 VanDerWaalsContact CD1-CE1 3.42Å; Y84-H134 WeakPolarHBondContact CD1-CE1 2.91Å; Y84-H134 AromaticContact CE1-CE1 3.59Å; Y84-H134 AromaticContact CE1-NE2 3.81Å; Y84-H134 AromaticContact CG-CE1 3.78Å; Y84-H134 PolarHBondContact OH-O 3.12Å; Y84-H134 VanDerWaalsContact OH-O 3.06Å
85Y93.9Very high94.2Very high107 Ų10757.4 Ų57.442%0.4228%0.279SS..Hα-helixtrans-71-17.3-178.3-73.1-69.8000114.2Q83 F87 H88 H134 D136Q83-Y85 PolarHBondContact O-N 3.32Å; Y85-F87 VanDerWaalsContact C-N 3.32Å; Y85-H88 HydrophobicContact CD1-CB 4.47Å; Y85-H134 AromaticContact CZ-NE2 3.84Å; Y85-H134 PolarHBondContact OH-NE2 3.28Å; Y85-D136 WeakPolarHBondContact CE1-OD2 3.4Å; Y85-D136 PolarHBondContact OH-OD2 3.13Å
86R94.8Very high94.3Very high109 Ų10958 Ų5841%0.41128%0.282SS..Hα-helixtrans-67.8-36.5174.5-176.3-176.1178.3112.4-3.2111.1D17 Q83 Y84D17-R86 VanDerWaalsContact CG-NH2 3.34Å; D17-R86 IonicContact OD1-CZ 2.99Å; D17-R86 IonicContact OD1-NE 3.66Å; D17-R86 PolarHBondContact OD1-NE 3.16Å; D17-R86 IonicContact OD1-NH2 3.85Å; D17-R86 PolarHBondContact OD1-NH2 2.79Å; D17-R86 IonicContact OD2-NH2 2.7Å; Q83-R86 HydrophobicContact CB-CB 4.12Å; Q83-R86 VanDerWaalsContact O-CB 3.27Å; Q83-R86 WeakPolarHBondContact O-CB 3.42Å; Q83-R86 PolarHBondContact O-N 3.42Å; Y84-R86 VanDerWaalsContact C-N 3.26Å; Y84-R86 PolarHBondContact O-N 3.41Å
87F95.3Very high94.5Very high1 Ų157.5 Ų57.50%0.00428%0.278CS..Hα-helixtrans-110.6-3.8-176.5-55.5-71.7000114.1V20 R21 I24 F79 Q83 Y84 Y85 E89 H90 W91V20-F87 HydrophobicContact CB-CZ 4.43Å; V20-F87 HydrophobicContact CG1-CE1 4.04Å; V20-F87 HydrophobicContact CG1-CE2 4.02Å; V20-F87 HydrophobicContact CG1-CZ 3.69Å; R21-F87 HydrophobicContact CG-CD1 4.08Å; R21-F87 HydrophobicContact CG-CE1 3.91Å; I24-F87 HydrophobicContact CD1-CB 3.76Å; I24-F87 HydrophobicContact CD1-CD1 3.85Å; I24-F87 HydrophobicContact CD1-CD2 4.1Å; I24-F87 HydrophobicContact CD1-CE1 4.48Å; I24-F87 HydrophobicContact CD1-CG 3.64Å; F79-F87 HydrophobicContact CB-CD2 3.9Å; F79-F87 HydrophobicContact CB-CE2 3.96Å; F79-F87 HydrophobicContact CD2-CD2 4.2Å; F79-F87 HydrophobicContact CG-CD2 4.14Å; Q83-F87 HydrophobicContact CB-CD2 4.13Å; Q83-F87 HydrophobicContact CB-CE2 3.88Å; Q83-F87 WeakPolarHBondContact O-CD2 3.31Å; Q83-F87 PolarHBondContact O-N 3.41Å; Q83-F87 VanDerWaalsContact OE1-CE2 3.27Å; Y84-F87 PolarHBondContact O-N 3.32Å; Y85-F87 VanDerWaalsContact C-N 3.32Å; F87-E89 VanDerWaalsContact C-N 3.25Å; F87-E89 PolarHBondContact O-N 3.08Å; F87-E89 VanDerWaalsContact O-N 3.08Å; F87-H90 WeakPolarHBondContact O-CB 3.07Å; F87-H90 PolarHBondContact O-N 3.35Å; F87-H90 PolarHBondContact O-ND1 3.34Å; F87-W91 HydrophobicContact CB-CH2 3.54Å; F87-W91 HydrophobicContact CB-CZ3 3.46Å; F87-W91 VanDerWaalsContact CB-CZ3 3.46Å; F87-W91 WeakPolarHBondContact O-CZ3 3.45Å
88H95.4Very high94.7Very high14 Ų1452.4 Ų52.47%0.06525%0.247CC..G310 helixtrans-45.5-43.2-177.1175.1-132.2000114.7Y84 Y85 H90 W91 R92 D139Y84-H88 HydrophobicContact CE1-CB 4.38Å; Y84-H88 AromaticContact CE1-CD2 3.94Å; Y84-H88 AromaticContact CZ-CD2 3.98Å; Y84-H88 WeakPolarHBondContact O-CB 3.32Å; Y84-H88 PolarHBondContact O-N 3.48Å; Y85-H88 HydrophobicContact CD1-CB 4.47Å; H88-H90 PolarHBondContact O-N 3.46Å; H88-W91 HydrophobicContact CB-CZ2 4.34Å; H88-W91 AromaticContact CD2-NE1 3.61Å; H88-W91 PolarHBondContact O-N 3.41Å; H88-W91 VanDerWaalsContact O-N 3.09Å; H88-R92 WeakPolarHBondContact O-CB 3.43Å; H88-R92 PolarHBondContact O-N 2.87Å; H88-D139 IonicContact CD2-OD2 3.15Å; H88-D139 IonicContact CE1-OD2 2.93Å; H88-D139 PolarHBondContact CE1-OD2 3.06Å; H88-D139 IonicContact NE2-OD1 3.28Å; H88-D139 IonicContact NE2-OD2 2.83Å; H88-D139 PolarHBondContact NE2-OD2 3.31Å
89E95.6Very high94.9Very high124 Ų12449.6 Ų49.658%0.57923%0.234SC*.G310 helixtrans-57.2-22.8179-71.3-64.8132.600114.1F87 R92F87-E89 VanDerWaalsContact C-N 3.25Å; F87-E89 PolarHBondContact O-N 3.08Å; F87-E89 VanDerWaalsContact O-N 3.08Å; E89-R92 VanDerWaalsContact OE1-CD 3.29Å; E89-R92 WeakPolarHBondContact OE1-CD 3.47Å; E89-R92 IonicContact OE1-CZ 2.89Å; E89-R92 IonicContact OE1-NE 2.71Å; E89-R92 IonicContact OE1-NH1 3.49Å; E89-R92 PolarHBondContact OE1-NH1 2.88Å; E89-R92 IonicContact OE2-NH1 3.79Å
90H97.1Very high95.3Very high50 Ų5049.2 Ų49.223%0.23123%0.233CC..G310 helixtrans-70.9-35.8178.2-60.677.1000112.4R21 I24 V28 F87 H88R21-H90 PolarHBondContact NH1-CE1 2.96Å; R21-H90 VanDerWaalsContact NH1-CE1 3.35Å; I24-H90 HydrophobicContact CG2-CB 3.65Å; V28-H90 WeakPolarHBondContact CG1-O 3.47Å; F87-H90 WeakPolarHBondContact O-CB 3.07Å; F87-H90 PolarHBondContact O-N 3.35Å; F87-H90 PolarHBondContact O-ND1 3.34Å; H88-H90 PolarHBondContact O-N 3.46Å
91W96.9Very high95.7Very high1 Ų146 Ų460%0.00421%0.212CC..THydrogen-bonded Turntrans-110.6-5.8-178.958.881.3000113.6I24 V28 L75 F79 Y84 F87 H88 F93 V94 L95 F133I24-W91 HydrophobicContact CD1-CZ3 4.19Å; I24-W91 HydrophobicContact CG2-CE3 3.85Å; I24-W91 HydrophobicContact CG2-CZ3 4.01Å; V28-W91 HydrophobicContact CG2-CB 3.84Å; L75-W91 HydrophobicContact CD1-CE3 4.26Å; L75-W91 HydrophobicContact CD2-CB 4.21Å; L75-W91 HydrophobicContact CD2-CD2 4.17Å; L75-W91 HydrophobicContact CD2-CE3 4.18Å; L75-W91 HydrophobicContact CD2-CG 4.21Å; F79-W91 HydrophobicContact CD1-CH2 4.17Å; F79-W91 HydrophobicContact CD1-CZ3 4.19Å; F79-W91 HydrophobicContact CD2-CH2 4.48Å; F79-W91 AromaticContact CE1-CH2 3.48Å; F79-W91 HydrophobicContact CE1-CH2 3.48Å; F79-W91 VanDerWaalsContact CE1-CH2 3.48Å; F79-W91 HydrophobicContact CE1-CZ2 4.26Å; F79-W91 AromaticContact CE1-CZ3 3.69Å; F79-W91 HydrophobicContact CE1-CZ3 3.69Å; F79-W91 AromaticContact CE2-CH2 3.88Å; F79-W91 HydrophobicContact CE2-CH2 3.88Å; F79-W91 HydrophobicContact CE2-CZ2 4.45Å; F79-W91 AromaticContact CZ-CH2 3.29Å; F79-W91 HydrophobicContact CZ-CH2 3.29Å; F79-W91 AromaticContact CZ-CZ2 3.79Å; F79-W91 HydrophobicContact CZ-CZ2 3.79Å; F79-W91 HydrophobicContact CZ-CZ3 4.02Å; Y84-W91 AromaticContact CD2-CZ2 3.83Å; Y84-W91 HydrophobicContact CD2-CZ2 3.83Å; Y84-W91 AromaticContact CE2-CZ2 3.76Å; Y84-W91 HydrophobicContact CE2-CZ2 3.76Å; Y84-W91 AromaticContact CE2-NE1 3.8Å; Y84-W91 HydrophobicContact CG-CZ2 4.37Å; Y84-W91 AromaticContact CZ-NE1 3.82Å; Y84-W91 WeakPolarHBondContact O-CZ2 3.45Å; F87-W91 HydrophobicContact CB-CH2 3.54Å; F87-W91 HydrophobicContact CB-CZ3 3.46Å; F87-W91 VanDerWaalsContact CB-CZ3 3.46Å; F87-W91 WeakPolarHBondContact O-CZ3 3.45Å; H88-W91 HydrophobicContact CB-CZ2 4.34Å; H88-W91 AromaticContact CD2-NE1 3.61Å; H88-W91 PolarHBondContact O-N 3.41Å; H88-W91 VanDerWaalsContact O-N 3.09Å; W91-F93 VanDerWaalsContact C-N 3.28Å; W91-F93 PolarHBondContact O-N 2.94Å; W91-V94 HydrophobicContact CB-CG1 4.03Å; W91-V94 WeakPolarHBondContact O-CG1 3.39Å; W91-V94 PolarHBondContact O-N 2.65Å; W91-V94 VanDerWaalsContact O-N 3.15Å; W91-L95 VanDerWaalsContact O-CB 3.32Å; W91-L95 WeakPolarHBondContact O-CB 3.42Å; W91-L95 PolarHBondContact O-N 2.7Å; W91-F133 AromaticContact CD1-CZ 3.82Å; W91-F133 HydrophobicContact CD2-CE2 4.22Å; W91-F133 HydrophobicContact CD2-CZ 4.28Å; W91-F133 AromaticContact CE2-CE2 3.7Å; W91-F133 AromaticContact CE2-CZ 3.82Å; W91-F133 HydrophobicContact CG-CZ 4.27Å; W91-F133 HydrophobicContact CH2-CE2 4.41Å; W91-F133 AromaticContact CZ2-CE2 3.83Å; W91-F133 HydrophobicContact CZ2-CE2 3.83Å; W91-F133 HydrophobicContact CZ2-CZ 4.37Å; W91-F133 AromaticContact NE1-CE2 3.86Å; W91-F133 AromaticContact NE1-CZ 3.5Å
92R96.6Very high96.2Very high45 Ų4542.7 Ų42.717%0.1719%0.185CC..Hα-helixtrans-47.7-49.4-179.5-174.8178.1-177.2-178.14.1112.5H88 E89 L95 Q96 E138 D139H88-R92 WeakPolarHBondContact O-CB 3.43Å; H88-R92 PolarHBondContact O-N 2.87Å; E89-R92 VanDerWaalsContact OE1-CD 3.29Å; E89-R92 WeakPolarHBondContact OE1-CD 3.47Å; E89-R92 IonicContact OE1-CZ 2.89Å; E89-R92 IonicContact OE1-NE 2.71Å; E89-R92 IonicContact OE1-NH1 3.49Å; E89-R92 PolarHBondContact OE1-NH1 2.88Å; E89-R92 IonicContact OE2-NH1 3.79Å; R92-L95 PolarHBondContact O-N 3.45Å; R92-Q96 VanDerWaalsContact O-CG 3.28Å; R92-Q96 WeakPolarHBondContact O-CG 3.49Å; R92-Q96 PolarHBondContact O-N 3.44Å; R92-E138 IonicContact NH2-OE2 3.8Å; R92-D139 WeakPolarHBondContact CG-OD1 3.44Å; R92-D139 IonicContact NE-OD1 2.77Å
93F97Very high96.6Very high113 Ų11334.1 Ų34.150%0.49615%0.145SC..Hα-helixtrans-62.3-49.3-179.8176.6-102.3000112.9W91 L95 R97W91-F93 VanDerWaalsContact C-N 3.28Å; W91-F93 PolarHBondContact O-N 2.94Å; F93-L95 VanDerWaalsContact C-N 3.33Å; F93-L95 PolarHBondContact O-N 2.91Å; F93-R97 PolarHBondContact O-N 2.96Å; F93-R97 VanDerWaalsContact O-N 3.14Å
94V98.1Very high97Very high1 Ų130.8 Ų30.81%0.00613%0.129CC..Hα-helixtrans-68.6-34.5-179.169.60000111.5V28 L31 E32 A35 W91 R97 L98V28-V94 HydrophobicContact CG1-CG1 4.03Å; L31-V94 HydrophobicContact CB-CG1 4.36Å; L31-V94 HydrophobicContact CB-CG2 3.86Å; E32-V94 HydrophobicContact CB-CG2 4.33Å; E32-V94 HydrophobicContact CG-CB 3.79Å; E32-V94 HydrophobicContact CG-CG2 3.69Å; A35-V94 HydrophobicContact CB-CG2 4.31Å; W91-V94 HydrophobicContact CB-CG1 4.03Å; W91-V94 WeakPolarHBondContact O-CG1 3.39Å; W91-V94 PolarHBondContact O-N 2.65Å; W91-V94 VanDerWaalsContact O-N 3.15Å; V94-R97 PolarHBondContact O-N 2.83Å; V94-L98 HydrophobicContact CG2-CD1 4.17Å; V94-L98 HydrophobicContact CG2-CG 4.38Å; V94-L98 WeakPolarHBondContact O-CB 3.33Å; V94-L98 VanDerWaalsContact O-CG 3.28Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 2.89Å
95L97.9Very high97.1Very high0 Ų030.7 Ų30.70%013%0.129CC..Hα-helixtrans-64.7-48.9177.3-175.259.9000111.2M72 W91 R92 F93 R97 L98 V99 L123 I125 L135 D139M72-L95 HydrophobicContact CE-CD1 4.16Å; W91-L95 VanDerWaalsContact O-CB 3.32Å; W91-L95 WeakPolarHBondContact O-CB 3.42Å; W91-L95 PolarHBondContact O-N 2.7Å; R92-L95 PolarHBondContact O-N 3.45Å; F93-L95 VanDerWaalsContact C-N 3.33Å; F93-L95 PolarHBondContact O-N 2.91Å; L95-R97 PolarHBondContact O-N 2.86Å; L95-L98 PolarHBondContact O-N 2.91Å; L95-L98 VanDerWaalsContact O-N 3.1Å; L95-V99 WeakPolarHBondContact O-CG2 3.47Å; L95-V99 PolarHBondContact O-N 2.91Å; L95-L123 HydrophobicContact CD1-CD1 3.87Å; L95-I125 HydrophobicContact CD1-CD1 4.06Å; L95-L135 HydrophobicContact CD1-CD1 4.25Å; L95-L135 HydrophobicContact CD2-CD1 4.15Å; L95-L135 HydrophobicContact CG-CD1 4.15Å; L95-D139 HydrophobicContact CD2-CB 4.36Å
96Q98Very high97.3Very high12 Ų1226.5 Ų26.56%0.05611%0.114CC..Hα-helixtrans-56.7-39.8174.7-71176.27.700111.9R92 F100 D139 A142 G143 I146R92-Q96 VanDerWaalsContact O-CG 3.28Å; R92-Q96 WeakPolarHBondContact O-CG 3.49Å; R92-Q96 PolarHBondContact O-N 3.44Å; Q96-F100 PolarHBondContact O-N 3.48Å; Q96-D139 HydrophobicContact CG-CB 3.9Å; Q96-D139 WeakPolarHBondContact CG-OD1 3.33Å; Q96-D139 PolarHBondContact NE2-OD1 3.1Å; Q96-A142 HydrophobicContact CG-CB 3.88Å; Q96-G143 WeakPolarHBondContact O-CA 3.31Å; Q96-I146 HydrophobicContact CB-CD1 4.46Å
97R98.1Very high97.4Very high58 Ų5821.3 Ų21.322%0.21910%0.095CC..Hα-helixtrans-67.1-41176.3-174.3170.3178.6153.7-4.3112.3F93 V94 L95 F100 L101F93-R97 PolarHBondContact O-N 2.96Å; F93-R97 VanDerWaalsContact O-N 3.14Å; V94-R97 PolarHBondContact O-N 2.83Å; L95-R97 PolarHBondContact O-N 2.86Å; R97-F100 HydrophobicContact CG-CD1 4.45Å; R97-F100 WeakPolarHBondContact O-CB 3.09Å; R97-F100 PolarHBondContact O-N 3.21Å; R97-L101 HydrophobicContact CG-CD1 4.25Å; R97-L101 VanDerWaalsContact O-CG 3.23Å; R97-L101 WeakPolarHBondContact O-CG 3.4Å; R97-L101 PolarHBondContact O-N 3.02Å
98L98.4Very high97.4Very high0 Ų022 Ų220%010%0.098CC..Hα-helixtrans-67.1-38.3177-74.1169.7000112.2L31 A35 I38 F65 V68 M72 V94 L95 L101 A102 L123L31-L98 HydrophobicContact CD2-CD1 4.24Å; A35-L98 HydrophobicContact CB-CD2 3.88Å; A35-L98 HydrophobicContact CB-CG 4.33Å; I38-L98 HydrophobicContact CD1-CD2 4.49Å; F65-L98 HydrophobicContact CE1-CD2 4.16Å; V68-L98 HydrophobicContact CG1-CD1 3.77Å; V68-L98 HydrophobicContact CG1-CD2 4.02Å; V68-L98 HydrophobicContact CG2-CD2 3.86Å; M72-L98 HydrophobicContact CE-CD1 3.35Å; V94-L98 HydrophobicContact CG2-CD1 4.17Å; V94-L98 HydrophobicContact CG2-CG 4.38Å; V94-L98 WeakPolarHBondContact O-CB 3.33Å; V94-L98 VanDerWaalsContact O-CG 3.28Å; V94-L98 WeakPolarHBondContact O-CG 3.47Å; V94-L98 PolarHBondContact O-N 2.89Å; L95-L98 PolarHBondContact O-N 2.91Å; L95-L98 VanDerWaalsContact O-N 3.1Å; L98-L101 HydrophobicContact CD2-CD1 4.46Å; L98-L101 PolarHBondContact O-N 2.75Å; L98-A102 WeakPolarHBondContact O-CB 3.43Å; L98-A102 PolarHBondContact O-N 3.25Å; L98-L123 HydrophobicContact CB-CD1 4.31Å; L98-L123 HydrophobicContact CB-CD2 3.86Å; L98-L123 HydrophobicContact CD1-CD2 4.49Å
99V98.4Very high97.3Very high0 Ų025.8 Ų25.80%012%0.116CC..Hα-helixtrans-57.7-50.9170.7171.70000110.1L95 L101 A102 A103 V119 L135 F140L95-V99 WeakPolarHBondContact O-CG2 3.47Å; L95-V99 PolarHBondContact O-N 2.91Å; V99-L101 VanDerWaalsContact C-N 3.32Å; V99-L101 PolarHBondContact O-N 3.37Å; V99-A102 PolarHBondContact O-N 3.22Å; V99-A103 WeakPolarHBondContact O-CB 3.48Å; V99-A103 PolarHBondContact O-N 3.02Å; V99-V119 HydrophobicContact CB-CG1 4.34Å; V99-V119 HydrophobicContact CG1-CG1 4.37Å; V99-V119 HydrophobicContact CG2-CG1 3.98Å; V99-L135 HydrophobicContact CG2-CD1 3.66Å; V99-L135 HydrophobicContact CG2-CD2 4.27Å; V99-F140 HydrophobicContact CG1-CD2 3.89Å
100F98.4Very high97.2Very high8 Ų823.1 Ų23.14%0.03511%0.111CC..Hα-helixtrans-52.5-50.6176.3149.1-122.2000111.4L39 Q96 R97 A102 A103 F104 G143 I146 M147 E150L39-F100 HydrophobicContact CD1-CE1 3.83Å; L39-F100 HydrophobicContact CD1-CZ 4.11Å; Q96-F100 PolarHBondContact O-N 3.48Å; R97-F100 HydrophobicContact CG-CD1 4.45Å; R97-F100 WeakPolarHBondContact O-CB 3.09Å; R97-F100 PolarHBondContact O-N 3.21Å; F100-A102 VanDerWaalsContact C-N 3.33Å; F100-A102 PolarHBondContact O-N 3.48Å; F100-A103 PolarHBondContact O-N 3.29Å; F100-F104 HydrophobicContact CD2-CB 4.41Å; F100-F104 HydrophobicContact CE2-CB 4.09Å; F100-F104 HydrophobicContact CE2-CG 4.33Å; F100-F104 WeakPolarHBondContact O-CB 3.4Å; F100-F104 PolarHBondContact O-N 2.91Å; F100-G143 WeakPolarHBondContact CB-O 3.33Å; F100-I146 HydrophobicContact CB-CB 4.02Å; F100-I146 HydrophobicContact CB-CG2 3.91Å; F100-I146 HydrophobicContact CD1-CG2 3.7Å; F100-I146 HydrophobicContact CD2-CB 4.42Å; F100-I146 HydrophobicContact CD2-CG2 3.89Å; F100-I146 HydrophobicContact CE1-CG2 4.16Å; F100-I146 HydrophobicContact CE2-CG2 4.36Å; F100-I146 HydrophobicContact CG-CB 4.14Å; F100-I146 HydrophobicContact CG-CG2 3.53Å; F100-I146 HydrophobicContact CZ-CG2 4.48Å; F100-M147 VanDerWaalsContact CD2-CA 3.48Å; F100-M147 HydrophobicContact CD2-CB 3.83Å; F100-M147 HydrophobicContact CD2-CG 4.47Å; F100-M147 HydrophobicContact CE2-CB 4.41Å; F100-E150 HydrophobicContact CE2-CB 3.71Å; F100-E150 HydrophobicContact CE2-CG 4.03Å; F100-E150 HydrophobicContact CZ-CB 4.02Å; F100-E150 HydrophobicContact CZ-CG 3.97Å
101L98.4Very high97.1Very high0 Ų023.7 Ų23.70%011%0.114CC..Hα-helixtrans-63.7-39.6-178.1-66.2166.9000111.8A35 I38 L39 L42 F65 R97 L98 V99 F104 V105A35-L101 HydrophobicContact CB-CD1 4.11Å; A35-L101 WeakPolarHBondContact O-CD1 3.43Å; I38-L101 HydrophobicContact CB-CD1 4.04Å; I38-L101 HydrophobicContact CG2-CB 4.03Å; I38-L101 HydrophobicContact CG2-CD1 3.97Å; I38-L101 HydrophobicContact CG2-CD2 4.12Å; I38-L101 HydrophobicContact CG2-CG 4.25Å; L39-L101 HydrophobicContact CB-CD2 3.94Å; L39-L101 HydrophobicContact CD1-CD2 3.83Å; L42-L101 HydrophobicContact CD1-CB 4.46Å; L42-L101 HydrophobicContact CD1-CD2 4Å; F65-L101 HydrophobicContact CZ-CB 3.82Å; R97-L101 HydrophobicContact CG-CD1 4.25Å; R97-L101 VanDerWaalsContact O-CG 3.23Å; R97-L101 WeakPolarHBondContact O-CG 3.4Å; R97-L101 PolarHBondContact O-N 3.02Å; L98-L101 HydrophobicContact CD2-CD1 4.46Å; L98-L101 PolarHBondContact O-N 2.75Å; V99-L101 VanDerWaalsContact C-N 3.32Å; V99-L101 PolarHBondContact O-N 3.37Å; L101-F104 PolarHBondContact O-N 3.01Å; L101-V105 WeakPolarHBondContact O-CG2 3.35Å; L101-V105 PolarHBondContact O-N 3.46Å
102A98.3Very high96.9Very high0 Ų025.8 Ų25.80%013%0.132CC..Hα-helixtrans-65.6-45.4177.100000111.3F65 L98 V99 F100 F104 V105 V106 V119 I122F65-A102 HydrophobicContact CE1-CB 4.33Å; F65-A102 HydrophobicContact CZ-CB 4.01Å; L98-A102 WeakPolarHBondContact O-CB 3.43Å; L98-A102 PolarHBondContact O-N 3.25Å; V99-A102 PolarHBondContact O-N 3.22Å; F100-A102 VanDerWaalsContact C-N 3.33Å; F100-A102 PolarHBondContact O-N 3.48Å; A102-F104 VanDerWaalsContact C-N 3.3Å; A102-F104 PolarHBondContact O-N 3.3Å; A102-V105 PolarHBondContact O-N 3.1Å; A102-V106 WeakPolarHBondContact O-CG2 3.34Å; A102-V106 PolarHBondContact O-N 2.93Å; A102-V106 VanDerWaalsContact O-N 3.13Å; A102-V119 HydrophobicContact CB-CG1 4.22Å; A102-V119 HydrophobicContact CB-CG2 4.37Å; A102-I122 HydrophobicContact CB-CD1 4.19Å; A102-I122 HydrophobicContact CB-CG2 4.17Å
103A97.9Very high96.9Very high0 Ų027.1 Ų27.10%014%0.142CC..Hα-helixtrans-61.4-39.9175.200000111.7V99 F100 V106 Y107 V114 M147V99-A103 WeakPolarHBondContact O-CB 3.48Å; V99-A103 PolarHBondContact O-N 3.02Å; F100-A103 PolarHBondContact O-N 3.29Å; A103-V106 PolarHBondContact O-N 3.47Å; A103-Y107 WeakPolarHBondContact O-CB 3.37Å; A103-Y107 PolarHBondContact O-N 2.88Å; A103-V114 VanDerWaalsContact CA-CG1 3.44Å; A103-V114 HydrophobicContact CB-CG1 3.5Å; A103-V114 VanDerWaalsContact CB-CG1 3.5Å; A103-M147 VanDerWaalsContact C-SD 3.56Å; A103-M147 HydrophobicContact CB-CE 4.38Å; A103-M147 HydrophobicContact CB-SD 3.51Å; A103-M147 VanDerWaalsContact CB-SD 3.51Å
104F98.1Very high96.8Very high0 Ų021.8 Ų21.80%012%0.118CC..Hα-helixtrans-66.7-39.7178.5-169.7-138.8000112.5L42 V45 F100 L101 A102 Y107 L108 M147 E150 L151 L154L42-F104 HydrophobicContact CB-CD1 3.91Å; L42-F104 HydrophobicContact CB-CE1 3.92Å; L42-F104 HydrophobicContact CD1-CD1 3.92Å; L42-F104 HydrophobicContact CG-CD1 4.43Å; V45-F104 HydrophobicContact CG1-CE1 4.38Å; V45-F104 HydrophobicContact CG1-CZ 4.05Å; F100-F104 HydrophobicContact CD2-CB 4.41Å; F100-F104 HydrophobicContact CE2-CB 4.09Å; F100-F104 HydrophobicContact CE2-CG 4.33Å; F100-F104 WeakPolarHBondContact O-CB 3.4Å; F100-F104 PolarHBondContact O-N 2.91Å; L101-F104 PolarHBondContact O-N 3.01Å; A102-F104 VanDerWaalsContact C-N 3.3Å; A102-F104 PolarHBondContact O-N 3.3Å; F104-Y107 PolarHBondContact O-N 3.38Å; F104-L108 HydrophobicContact CD1-CD1 4.18Å; F104-L108 HydrophobicContact CD2-CD1 4.37Å; F104-L108 HydrophobicContact CD2-CG 4.16Å; F104-L108 HydrophobicContact CE1-CD1 3.92Å; F104-L108 HydrophobicContact CE2-CD1 4.1Å; F104-L108 HydrophobicContact CE2-CD2 3.99Å; F104-L108 HydrophobicContact CE2-CG 3.92Å; F104-L108 HydrophobicContact CG-CD1 4.4Å; F104-L108 HydrophobicContact CZ-CD1 3.87Å; F104-L108 HydrophobicContact CZ-CD2 4.18Å; F104-L108 HydrophobicContact CZ-CG 4.17Å; F104-L108 WeakPolarHBondContact O-CB 3.47Å; F104-L108 VanDerWaalsContact O-CG 3.25Å; F104-L108 WeakPolarHBondContact O-CG 3.4Å; F104-L108 PolarHBondContact O-N 2.99Å; F104-M147 HydrophobicContact CB-CG 4.44Å; F104-E150 HydrophobicContact CE1-CG 4.17Å; F104-E150 HydrophobicContact CE2-CG 4.37Å; F104-E150 HydrophobicContact CZ-CG 4.06Å; F104-L151 HydrophobicContact CD2-CD2 4.18Å; F104-L151 HydrophobicContact CE2-CD2 3.88Å; F104-L154 HydrophobicContact CE2-CD2 4.17Å
105V97.5Very high96.8Very high2 Ų224.8 Ų24.81%0.01214%0.137CC..Hα-helixtrans-58.9-50.3172.7168.50000111L42 C58 A61 R62 F65 L101 A102 Y107 L108 E109L42-V105 HydrophobicContact CD1-CG2 3.72Å; L42-V105 HydrophobicContact CD2-CG2 3.89Å; L42-V105 HydrophobicContact CG-CG2 4.43Å; C58-V105 HydrophobicContact CB-CG1 4.19Å; A61-V105 HydrophobicContact CB-CG2 3.8Å; R62-V105 HydrophobicContact CG-CG1 4.21Å; F65-V105 HydrophobicContact CE2-CG2 4.16Å; L101-V105 WeakPolarHBondContact O-CG2 3.35Å; L101-V105 PolarHBondContact O-N 3.46Å; A102-V105 PolarHBondContact O-N 3.1Å; V105-Y107 VanDerWaalsContact C-N 3.32Å; V105-Y107 PolarHBondContact O-N 2.9Å; V105-L108 PolarHBondContact O-N 3.27Å; V105-E109 WeakPolarHBondContact O-CG 3.46Å; V105-E109 PolarHBondContact O-N 3.02Å; V105-E109 VanDerWaalsContact O-N 3.09Å
106V97Very high96.7Very high18 Ų1827.3 Ų27.311%0.10915%0.146CC..Hα-helixtrans-63.8-40.1-178.3173.60000111.3A102 A103 E109 S110 V114 I122A102-V106 WeakPolarHBondContact O-CG2 3.34Å; A102-V106 PolarHBondContact O-N 2.93Å; A102-V106 VanDerWaalsContact O-N 3.13Å; A103-V106 PolarHBondContact O-N 3.47Å; V106-E109 PolarHBondContact O-N 3.09Å; V106-S110 PolarHBondContact O-N 3.04Å; V106-S110 PolarHBondContact O-OG 3.35Å; V106-V114 HydrophobicContact CB-CB 3.93Å; V106-V114 HydrophobicContact CB-CG2 4.3Å; V106-V114 HydrophobicContact CG1-CB 3.93Å; V106-V114 HydrophobicContact CG1-CG2 4.35Å; V106-V114 HydrophobicContact CG2-CB 4Å; V106-V114 HydrophobicContact CG2-CG2 3.81Å; V106-I122 HydrophobicContact CG2-CD1 4.26Å
107Y97Very high96.7Very high1 Ų130.8 Ų30.80%0.00416%0.163CC..Hα-helixtrans-62-43.7174.6-178.1-91.6000112A103 F104 V105 E109 E111 L151 I170 F173A103-Y107 WeakPolarHBondContact O-CB 3.37Å; A103-Y107 PolarHBondContact O-N 2.88Å; F104-Y107 PolarHBondContact O-N 3.38Å; V105-Y107 VanDerWaalsContact C-N 3.32Å; V105-Y107 PolarHBondContact O-N 2.9Å; Y107-E109 PolarHBondContact O-N 3.32Å; Y107-E111 HydrophobicContact CE2-CB 4.38Å; Y107-E111 WeakPolarHBondContact O-CA 2.91Å; Y107-E111 PolarHBondContact O-N 2.89Å; Y107-L151 HydrophobicContact CD1-CD1 4.22Å; Y107-L151 HydrophobicContact CD1-CD2 3.41Å; Y107-L151 VanDerWaalsContact CD1-CD2 3.41Å; Y107-L151 HydrophobicContact CD1-CG 4.46Å; Y107-L151 HydrophobicContact CD2-CD1 4.18Å; Y107-L151 HydrophobicContact CE1-CD1 4.11Å; Y107-L151 HydrophobicContact CE1-CD2 3.33Å; Y107-L151 HydrophobicContact CE1-CG 4.37Å; Y107-L151 HydrophobicContact CE2-CD1 4.08Å; Y107-L151 HydrophobicContact CG-CD1 4.24Å; Y107-L151 HydrophobicContact CG-CD2 4.16Å; Y107-I170 HydrophobicContact CE1-CG1 4.34Å; Y107-I170 WeakPolarHBondContact OH-CG1 3.44Å; Y107-F173 AromaticContact CD2-CD1 3.93Å; Y107-F173 HydrophobicContact CD2-CD1 3.93Å; Y107-F173 HydrophobicContact CD2-CD2 4.31Å; Y107-F173 AromaticContact CD2-CE1 3.68Å; Y107-F173 HydrophobicContact CD2-CE1 3.68Å; Y107-F173 HydrophobicContact CD2-CE2 4.11Å; Y107-F173 HydrophobicContact CD2-CG 4.23Å; Y107-F173 AromaticContact CD2-CZ 3.78Å; Y107-F173 HydrophobicContact CD2-CZ 3.78Å; Y107-F173 HydrophobicContact CE2-CB 4.13Å; Y107-F173 AromaticContact CE2-CD1 3.48Å; Y107-F173 HydrophobicContact CE2-CD1 3.48Å; Y107-F173 VanDerWaalsContact CE2-CD1 3.48Å; Y107-F173 AromaticContact CE2-CD2 3.96Å; Y107-F173 HydrophobicContact CE2-CD2 3.96Å; Y107-F173 AromaticContact CE2-CE1 3.76Å; Y107-F173 HydrophobicContact CE2-CE1 3.76Å; Y107-F173 HydrophobicContact CE2-CE2 4.22Å; Y107-F173 AromaticContact CE2-CG 3.57Å; Y107-F173 HydrophobicContact CE2-CG 3.57Å; Y107-F173 HydrophobicContact CE2-CZ 4.12Å
108L94.8Very high96.6Very high15 Ų1532.2 Ų32.28%0.07917%0.172CC..Hα-helixtrans-65.3-27178.5-73.2175.9000113.3L42 V45 I54 F104 V105 L154L42-L108 HydrophobicContact CD2-CD1 4.34Å; V45-L108 HydrophobicContact CG2-CD2 4.34Å; I54-L108 HydrophobicContact CD1-CD2 4.33Å; I54-L108 HydrophobicContact CG2-CB 3.89Å; F104-L108 HydrophobicContact CD1-CD1 4.18Å; F104-L108 HydrophobicContact CD2-CD1 4.37Å; F104-L108 HydrophobicContact CD2-CG 4.16Å; F104-L108 HydrophobicContact CE1-CD1 3.92Å; F104-L108 HydrophobicContact CE2-CD1 4.1Å; F104-L108 HydrophobicContact CE2-CD2 3.99Å; F104-L108 HydrophobicContact CE2-CG 3.92Å; F104-L108 HydrophobicContact CG-CD1 4.4Å; F104-L108 HydrophobicContact CZ-CD1 3.87Å; F104-L108 HydrophobicContact CZ-CD2 4.18Å; F104-L108 HydrophobicContact CZ-CG 4.17Å; F104-L108 WeakPolarHBondContact O-CB 3.47Å; F104-L108 VanDerWaalsContact O-CG 3.25Å; F104-L108 WeakPolarHBondContact O-CG 3.4Å; F104-L108 PolarHBondContact O-N 2.99Å; V105-L108 PolarHBondContact O-N 3.27Å; L108-L154 HydrophobicContact CD2-CD2 4.03Å
109E94.3Very high96.6Very high93 Ų9332.2 Ų32.244%0.43517%0.172SC..Hα-helixtrans-88.3-36.8179.8-71.1173.9167.200113.7C58 R62 V105 V106 Y107C58-E109 HydrophobicContact CB-CG 3.96Å; C58-E109 WeakPolarHBondContact CB-OE1 3.36Å; R62-E109 IonicContact CZ-OE1 3.22Å; R62-E109 IonicContact CZ-OE2 3.8Å; R62-E109 IonicContact NE-OE1 3.81Å; R62-E109 PolarHBondContact NE-OE1 3.34Å; R62-E109 IonicContact NE-OE2 3.65Å; R62-E109 PolarHBondContact NE-OE2 2.82Å; R62-E109 IonicContact NH2-OE1 2.74Å; R62-E109 IonicContact NH2-OE2 3.67Å; R62-E109 PolarHBondContact NH2-OE2 3.33Å; V105-E109 WeakPolarHBondContact O-CG 3.46Å; V105-E109 PolarHBondContact O-N 3.02Å; V105-E109 VanDerWaalsContact O-N 3.09Å; V106-E109 PolarHBondContact O-N 3.09Å; Y107-E109 PolarHBondContact O-N 3.32Å
110S93.9Very high96.5Very high68 Ų6832.2 Ų32.248%0.47617%0.172SC..Hα-helixtrans-130.9-8.4-167.866.10000114.9V106 A112V106-S110 PolarHBondContact O-N 3.04Å; V106-S110 PolarHBondContact O-OG 3.35Å; S110-A112 PolarHBondContact O-N 3.21Å; S110-A112 VanDerWaalsContact O-N 3.13Å; S110-A112 PolarHBondContact OG-N 3.28Å
111E93.4Very high96.4Very high62 Ų6238.2 Ų38.229%0.2920%0.2SC..SBendtrans57.121.3-174.9-57.9-176.3168.400114Y107 R169Y107-E111 HydrophobicContact CE2-CB 4.38Å; Y107-E111 WeakPolarHBondContact O-CA 2.91Å; Y107-E111 PolarHBondContact O-N 2.89Å; E111-R169 IonicContact OE1-CZ 3.27Å; E111-R169 VanDerWaalsContact OE1-CZ 3.27Å; E111-R169 IonicContact OE1-NH1 2.61Å; E111-R169 PolarHBondContact OE1-NH1 3.47Å; E111-R169 IonicContact OE1-NH2 2.9Å; E111-R169 WeakPolarHBondContact OE2-CD 3.42Å; E111-R169 IonicContact OE2-CZ 3.56Å; E111-R169 IonicContact OE2-NE 3.3Å; E111-R169 IonicContact OE2-NH1 2.77Å; E111-R169 PolarHBondContact OE2-NH1 2.8Å
112A94.3Very high96.3Very high46 Ų4639.1 Ų39.138%0.3820%0.204SC..SBendtrans-109.2160.2177.300000112S110S110-A112 PolarHBondContact O-N 3.21Å; S110-A112 VanDerWaalsContact O-N 3.13Å; S110-A112 PolarHBondContact OG-N 3.28Å
113L94.9Very high96.2Very high72 Ų7239.1 Ų39.138%0.37720%0.204SC..PPolyproline II helixtrans-78.7124.5171179.864.3000109.1V144 M147 F173 L177L113-V144 HydrophobicContact CD1-CG1 4Å; L113-V144 HydrophobicContact CD1-CG2 4.02Å; L113-M147 HydrophobicContact CD1-CE 3.95Å; L113-F173 HydrophobicContact CB-CE2 3.83Å; L113-F173 HydrophobicContact CB-CZ 3.94Å; L113-F173 HydrophobicContact CD1-CZ 4.25Å; L113-L177 HydrophobicContact CD1-CD2 4.11Å; L113-L177 HydrophobicContact CD2-CD2 3.72Å; L113-L177 HydrophobicContact CG-CD2 4.41Å
114V96.5Very high96.1Very high1 Ų140.6 Ų40.61%0.00622%0.22CC..PPolyproline II helixtrans-63.1139171.768.60000111A103 V106 E118 V119 F140A103-V114 VanDerWaalsContact CA-CG1 3.44Å; A103-V114 HydrophobicContact CB-CG1 3.5Å; A103-V114 VanDerWaalsContact CB-CG1 3.5Å; V106-V114 HydrophobicContact CB-CB 3.93Å; V106-V114 HydrophobicContact CB-CG2 4.3Å; V106-V114 HydrophobicContact CG1-CB 3.93Å; V106-V114 HydrophobicContact CG1-CG2 4.35Å; V106-V114 HydrophobicContact CG2-CB 4Å; V106-V114 HydrophobicContact CG2-CG2 3.81Å; V114-E118 HydrophobicContact CG2-CB 3.56Å; V114-V119 HydrophobicContact CB-CG2 4.15Å; V114-V119 HydrophobicContact CG1-CG2 3.35Å; V114-V119 HydrophobicContact CG2-CG2 3.66Å; V114-F140 HydrophobicContact CG1-CE2 4.47Å; V114-F140 WeakPolarHBondContact O-CZ 3.47Å
115T97.2Very high95.9Very high64 Ų6441 Ų4139%0.39322%0.222SC..PPolyproline II helixtrans-74.9157.2172.963.10000111.2E117 E118 V119T115-E117 PolarHBondContact O-N 3.39Å; T115-E118 WeakPolarHBondContact CB-OE2 3.36Å; T115-E118 PolarHBondContact N-OE2 2.79Å; T115-E118 PolarHBondContact O-N 3.32Å; T115-E118 WeakPolarHBondContact OG1-CB 3.23Å; T115-E118 WeakPolarHBondContact OG1-CG 3.49Å; T115-E118 PolarHBondContact OG1-N 3.04Å; T115-E118 PolarHBondContact OG1-OE2 3.2Å; T115-V119 WeakPolarHBondContact O-CG2 3.37Å; T115-V119 PolarHBondContact O-N 2.9Å
116R96.9Very high95.7Very high54 Ų5444.3 Ų44.320%0.20424%0.237CC..Hα-helixtrans-62.1-34.5177.5-173.1175.657.698.512.7111.4V119 A120 V127 L135 F140R116-V119 PolarHBondContact O-N 3.26Å; R116-A120 WeakPolarHBondContact O-CB 3.39Å; R116-A120 PolarHBondContact O-N 3.49Å; R116-V127 PolarHBondContact NH1-O 2.78Å; R116-V127 VanDerWaalsContact NH1-O 3.13Å; R116-L135 HydrophobicContact CG-CD2 3.76Å; R116-L135 HydrophobicContact CG-CG 4.13Å; R116-L135 PolarHBondContact NH1-O 3.02Å; R116-F140 HydrophobicContact CB-CD1 4.28Å; R116-F140 HydrophobicContact CB-CD2 3.98Å; R116-F140 HydrophobicContact CB-CE1 4.36Å; R116-F140 HydrophobicContact CB-CE2 4.07Å; R116-F140 HydrophobicContact CB-CG 4.08Å; R116-F140 HydrophobicContact CB-CZ 4.26Å; R116-F140 HydrophobicContact CG-CB 4.13Å; R116-F140 HydrophobicContact CG-CD1 4.46Å; R116-F140 HydrophobicContact CG-CD2 4.01Å; R116-F140 HydrophobicContact CG-CG 3.93Å
117E96.8Very high95.5Very high85 Ų8545 Ų4540%0.39724%0.241SC..Hα-helixtrans-65.4-44.4177.6-65.962.8-143.200111.4T115 A120 Q121 V127T115-E117 PolarHBondContact O-N 3.39Å; E117-A120 PolarHBondContact O-N 2.97Å; E117-Q121 WeakPolarHBondContact O-CG 3.48Å; E117-Q121 PolarHBondContact O-N 3.47Å; E117-V127 HydrophobicContact CB-CG2 4.33Å; E117-V127 HydrophobicContact CG-CG1 4.28Å; E117-V127 HydrophobicContact CG-CG2 4.12Å
118E96.6Very high95.2Very high87 Ų8747.8 Ų47.841%0.40726%0.258SS..Hα-helixtrans-65.2-40.4174.8-74164.1149.800112.1V114 T115 Q121 I122V114-E118 HydrophobicContact CG2-CB 3.56Å; T115-E118 WeakPolarHBondContact CB-OE2 3.36Å; T115-E118 PolarHBondContact N-OE2 2.79Å; T115-E118 PolarHBondContact O-N 3.32Å; T115-E118 WeakPolarHBondContact OG1-CB 3.23Å; T115-E118 WeakPolarHBondContact OG1-CG 3.49Å; T115-E118 PolarHBondContact OG1-N 3.04Å; T115-E118 PolarHBondContact OG1-OE2 3.2Å; E118-Q121 WeakPolarHBondContact O-CB 3.34Å; E118-Q121 PolarHBondContact O-N 3.07Å; E118-I122 VanDerWaalsContact O-CG1 3.31Å; E118-I122 WeakPolarHBondContact O-CG1 3.42Å; E118-I122 PolarHBondContact O-N 2.99Å
119V97.6Very high94.8Very high0 Ų054 Ų540%028%0.281CS..Hα-helixtrans-62.3-45.2174.81780000110.8V99 A102 V114 T115 R116 Q121 I122 L123 L135 F140V99-V119 HydrophobicContact CB-CG1 4.34Å; V99-V119 HydrophobicContact CG1-CG1 4.37Å; V99-V119 HydrophobicContact CG2-CG1 3.98Å; A102-V119 HydrophobicContact CB-CG1 4.22Å; A102-V119 HydrophobicContact CB-CG2 4.37Å; V114-V119 HydrophobicContact CB-CG2 4.15Å; V114-V119 HydrophobicContact CG1-CG2 3.35Å; V114-V119 HydrophobicContact CG2-CG2 3.66Å; T115-V119 WeakPolarHBondContact O-CG2 3.37Å; T115-V119 PolarHBondContact O-N 2.9Å; R116-V119 PolarHBondContact O-N 3.26Å; V119-Q121 VanDerWaalsContact C-N 3.27Å; V119-Q121 PolarHBondContact O-N 3.37Å; V119-I122 PolarHBondContact O-N 3.18Å; V119-I122 VanDerWaalsContact O-N 3.13Å; V119-L123 HydrophobicContact CG1-CD1 3.85Å; V119-L123 HydrophobicContact CG1-CG 4.2Å; V119-L123 WeakPolarHBondContact O-CG 3.43Å; V119-L123 PolarHBondContact O-N 2.91Å; V119-L135 HydrophobicContact CB-CD2 3.95Å; V119-L135 HydrophobicContact CG1-CD2 3.75Å; V119-F140 HydrophobicContact CG2-CD2 4.35Å; V119-F140 HydrophobicContact CG2-CE2 3.98Å
120A96.6Very high94.3Very high1 Ų157.3 Ų57.31%0.00830%0.296CS..Hα-helixtrans-58.4-41.7176.700000111.2R116 E117 L123 G124 I125 V127 L135R116-A120 WeakPolarHBondContact O-CB 3.39Å; R116-A120 PolarHBondContact O-N 3.49Å; E117-A120 PolarHBondContact O-N 2.97Å; A120-L123 PolarHBondContact O-N 3.22Å; A120-G124 PolarHBondContact O-N 3.33Å; A120-I125 CarbonylContact C-O 3.46Å; A120-I125 HydrophobicContact CB-CG1 4.07Å; A120-I125 WeakPolarHBondContact CB-O 3.48Å; A120-I125 PolarHBondContact O-N 3.43Å; A120-V127 HydrophobicContact CB-CG2 3.46Å; A120-V127 VanDerWaalsContact CB-CG2 3.46Å; A120-L135 HydrophobicContact CB-CB 4.49Å
121Q96.4Very high93.9Very high133 Ų13361 Ų6162%0.62130%0.304SS*.Hα-helixtrans-62.4-45.7172.9-71.8177.81.700112.5R69 E117 E118 V119 L123 G124R69-Q121 VanDerWaalsContact CZ-O 3.32Å; R69-Q121 PolarHBondContact NE-O 3.16Å; R69-Q121 PolarHBondContact NH2-O 3.4Å; E117-Q121 WeakPolarHBondContact O-CG 3.48Å; E117-Q121 PolarHBondContact O-N 3.47Å; E118-Q121 WeakPolarHBondContact O-CB 3.34Å; E118-Q121 PolarHBondContact O-N 3.07Å; V119-Q121 VanDerWaalsContact C-N 3.27Å; V119-Q121 PolarHBondContact O-N 3.37Å; Q121-L123 VanDerWaalsContact C-N 3.29Å; Q121-L123 PolarHBondContact O-N 2.99Å; Q121-G124 PolarHBondContact O-N 3.43Å
122I96.1Very high93.5Very high19 Ų1958.8 Ų58.810%0.09730%0.298CS..Hα-helixtrans-58-43.2177.5-69.9165.7000110.6F65 R69 A102 V106 E118 V119F65-I122 HydrophobicContact CB-CG2 4.12Å; F65-I122 HydrophobicContact CD1-CG2 3.77Å; F65-I122 HydrophobicContact CD2-CG2 4.12Å; F65-I122 HydrophobicContact CE1-CG2 4.17Å; F65-I122 HydrophobicContact CG-CG2 3.75Å; R69-I122 WeakPolarHBondContact CG-O 3.39Å; R69-I122 PolarHBondContact NE-O 3.25Å; A102-I122 HydrophobicContact CB-CD1 4.19Å; A102-I122 HydrophobicContact CB-CG2 4.17Å; V106-I122 HydrophobicContact CG2-CD1 4.26Å; E118-I122 VanDerWaalsContact O-CG1 3.31Å; E118-I122 WeakPolarHBondContact O-CG1 3.42Å; E118-I122 PolarHBondContact O-N 2.99Å; V119-I122 PolarHBondContact O-N 3.18Å; V119-I122 VanDerWaalsContact O-N 3.13Å
123L96.3Very high93.3Very high0 Ų057.1 Ų57.10%028%0.282CS..Hα-helixtrans-81.5-11.5-179.1-58.4-179.3000114F65 V68 L95 L98 V119 A120 Q121 I125F65-L123 HydrophobicContact CD1-CD2 3.96Å; F65-L123 HydrophobicContact CE1-CD2 3.87Å; V68-L123 HydrophobicContact CG1-CD2 4Å; L95-L123 HydrophobicContact CD1-CD1 3.87Å; L98-L123 HydrophobicContact CB-CD1 4.31Å; L98-L123 HydrophobicContact CB-CD2 3.86Å; L98-L123 HydrophobicContact CD1-CD2 4.49Å; V119-L123 HydrophobicContact CG1-CD1 3.85Å; V119-L123 HydrophobicContact CG1-CG 4.2Å; V119-L123 WeakPolarHBondContact O-CG 3.43Å; V119-L123 PolarHBondContact O-N 2.91Å; A120-L123 PolarHBondContact O-N 3.22Å; Q121-L123 VanDerWaalsContact C-N 3.29Å; Q121-L123 PolarHBondContact O-N 2.99Å; L123-I125 HydrophobicContact CB-CD1 4.15Å; L123-I125 HydrophobicContact CB-CG1 4.05Å; L123-I125 HydrophobicContact CB-CG2 4.46Å; L123-I125 HydrophobicContact CD1-CD1 4.05Å
124G95.3Very high93.3Very high31 Ų3154.1 Ų54.132%0.3227%0.266SS..THydrogen-bonded Turntrans71.433.8-177.300000112.9K76 A120 Q121K76-G124 PolarHBondContact NZ-O 3.44Å; A120-G124 PolarHBondContact O-N 3.33Å; Q121-G124 PolarHBondContact O-N 3.43Å
125I94.4Very high93.3Very high8 Ų854.1 Ų54.14%0.04127%0.266CS..  trans-120.8169179.466.8-179.1000110.8M72 L95 A120 L123 F133 L135M72-I125 HydrophobicContact CB-CG2 4.17Å; M72-I125 HydrophobicContact CG-CG2 4.24Å; M72-I125 HydrophobicContact SD-CG2 4.4Å; L95-I125 HydrophobicContact CD1-CD1 4.06Å; A120-I125 CarbonylContact C-O 3.46Å; A120-I125 HydrophobicContact CB-CG1 4.07Å; A120-I125 WeakPolarHBondContact CB-O 3.48Å; A120-I125 PolarHBondContact O-N 3.43Å; L123-I125 HydrophobicContact CB-CD1 4.15Å; L123-I125 HydrophobicContact CB-CG1 4.05Å; L123-I125 HydrophobicContact CB-CG2 4.46Å; L123-I125 HydrophobicContact CD1-CD1 4.05Å; I125-F133 HydrophobicContact CB-CD1 4.02Å; I125-F133 HydrophobicContact CD1-CE1 4.44Å; I125-F133 HydrophobicContact CG2-CD1 3.64Å; I125-F133 HydrophobicContact CG2-CE1 3.97Å; I125-L135 HydrophobicContact CD1-CB 3.82Å; I125-L135 HydrophobicContact CG1-CB 4.44Å
126E93.9Very high93.2Very high73 Ų7352.1 Ų52.134%0.34125%0.253SS..BIsolated β-bridgetrans-88.4167.7-179.5-62.2-62.514900111.5K131 F133 H134 L135E126-K131 HydrophobicContact CB-CB 4.01Å; E126-K131 HydrophobicContact CG-CB 3.67Å; E126-K131 WeakPolarHBondContact OE2-CD 3.41Å; E126-F133 WeakPolarHBondContact CB-O 3.3Å; E126-F133 PolarHBondContact N-O 2.94Å; E126-H134 HydrophobicContact CB-CB 4.39Å; E126-H134 CarbonylContact O-C 3.43Å; E126-H134 WeakPolarHBondContact O-CA 3.29Å; E126-L135 PolarHBondContact O-N 3.43Å
127V92.1Very high93.1Very high31 Ų3153.1 Ų53.119%0.18827%0.265CS..SBendtrans-102.8-26.9175.1177.10000110.8R116 E117 A120R116-V127 PolarHBondContact NH1-O 2.78Å; R116-V127 VanDerWaalsContact NH1-O 3.13Å; E117-V127 HydrophobicContact CB-CG2 4.33Å; E117-V127 HydrophobicContact CG-CG1 4.28Å; E117-V127 HydrophobicContact CG-CG2 4.12Å; A120-V127 HydrophobicContact CB-CG2 3.46Å; A120-V127 VanDerWaalsContact CB-CG2 3.46Å
128V90.3Very high92.9Very high61 Ų6152.9 Ų52.937%0.3726%0.264SS..SBendtrans-109.9128.5-169.7175.60000108.1E130 K131V128-E130 VanDerWaalsContact C-N 3.27Å; V128-E130 HydrophobicContact CG1-CB 4.29Å; V128-E130 WeakPolarHBondContact CG1-OE2 3.47Å; V128-E130 PolarHBondContact O-N 3.05Å; V128-K131 HydrophobicContact CB-CD 4.32Å; V128-K131 HydrophobicContact CB-CG 4.28Å; V128-K131 HydrophobicContact CG1-CG 4.4Å; V128-K131 PolarHBondContact O-N 3.42Å; V128-K131 VanDerWaalsContact O-N 3.12Å
129R87Confident92.9Very high145 Ų14548.8 Ų48.855%0.54725%0.245SC..G310 helixtrans-59.5-37.8-173.7178.4178.1176.9-173.2-1.4112.7K131 G132R129-K131 PolarHBondContact O-N 3.33Å; R129-G132 PolarHBondContact O-N 3.3Å; R129-G132 VanDerWaalsContact O-N 3.07Å
130E84.4Confident92.9Very high163 Ų16349.8 Ų49.876%0.76225%0.249SC*.G310 helixtrans-65.1-22.2-178.2-6475.9-168.900112.7V128 G132V128-E130 VanDerWaalsContact C-N 3.27Å; V128-E130 HydrophobicContact CG1-CB 4.29Å; V128-E130 WeakPolarHBondContact CG1-OE2 3.47Å; V128-E130 PolarHBondContact O-N 3.05Å; E130-G132 VanDerWaalsContact C-N 3.32Å
131K84.1Confident92.9Very high144 Ų14451.1 Ų51.163%0.62626%0.256SS*.G310 helixtrans-85.9-5.6177.4-62.2-174.1177.8-177.70113E126 V128 R129E126-K131 HydrophobicContact CB-CB 4.01Å; E126-K131 HydrophobicContact CG-CB 3.67Å; E126-K131 WeakPolarHBondContact OE2-CD 3.41Å; V128-K131 HydrophobicContact CB-CD 4.32Å; V128-K131 HydrophobicContact CB-CG 4.28Å; V128-K131 HydrophobicContact CG1-CG 4.4Å; V128-K131 PolarHBondContact O-N 3.42Å; V128-K131 VanDerWaalsContact O-N 3.12Å; R129-K131 PolarHBondContact O-N 3.33Å
132G86.4Confident93Very high17 Ų1744.9 Ų44.918%0.17523%0.227CC..SBendtrans120.2-134.8173.900000113.4R129 E130 H134R129-G132 PolarHBondContact O-N 3.3Å; R129-G132 VanDerWaalsContact O-N 3.07Å; E130-G132 VanDerWaalsContact C-N 3.32Å; G132-H134 PolarHBondContact O-N 3.23Å; G132-H134 VanDerWaalsContact O-N 3.15Å; G132-H134 PolarHBondContact O-ND1 3.23Å; G132-H134 VanDerWaalsContact O-ND1 3.1Å
133F90.7Very high93Very high11 Ų1144 Ų445%0.04822%0.223CC..SBendtrans-65115.4-179.1-169.4-69.7000110.1M72 L75 K76 F79 Y84 W91 I125 E126M72-F133 HydrophobicContact SD-CE1 4.33Å; M72-F133 HydrophobicContact SD-CZ 4.46Å; L75-F133 HydrophobicContact CD2-CE2 3.74Å; L75-F133 HydrophobicContact CD2-CZ 3.84Å; L75-F133 HydrophobicContact CG-CE2 4.07Å; K76-F133 HydrophobicContact CD-CB 3.85Å; K76-F133 HydrophobicContact CG-CB 3.55Å; K76-F133 HydrophobicContact CG-CD2 4.03Å; K76-F133 HydrophobicContact CG-CG 3.89Å; F79-F133 HydrophobicContact CE1-CD2 4.13Å; F79-F133 HydrophobicContact CE1-CE2 4.11Å; F79-F133 AromaticContact CZ-CD2 3.61Å; F79-F133 HydrophobicContact CZ-CD2 3.61Å; F79-F133 AromaticContact CZ-CE2 3.84Å; F79-F133 HydrophobicContact CZ-CE2 3.84Å; Y84-F133 HydrophobicContact CD2-CD2 4.1Å; Y84-F133 HydrophobicContact CD2-CE2 4.36Å; Y84-F133 HydrophobicContact CD2-CG 4.36Å; Y84-F133 HydrophobicContact CE2-CD1 4.19Å; Y84-F133 AromaticContact CE2-CD2 3.97Å; Y84-F133 HydrophobicContact CE2-CD2 3.97Å; Y84-F133 HydrophobicContact CE2-CE1 4.19Å; Y84-F133 AromaticContact CE2-CE2 3.94Å; Y84-F133 HydrophobicContact CE2-CE2 3.94Å; Y84-F133 HydrophobicContact CE2-CG 4.07Å; Y84-F133 HydrophobicContact CE2-CZ 4.05Å; W91-F133 AromaticContact CD1-CZ 3.82Å; W91-F133 HydrophobicContact CD2-CE2 4.22Å; W91-F133 HydrophobicContact CD2-CZ 4.28Å; W91-F133 AromaticContact CE2-CE2 3.7Å; W91-F133 AromaticContact CE2-CZ 3.82Å; W91-F133 HydrophobicContact CG-CZ 4.27Å; W91-F133 HydrophobicContact CH2-CE2 4.41Å; W91-F133 AromaticContact CZ2-CE2 3.83Å; W91-F133 HydrophobicContact CZ2-CE2 3.83Å; W91-F133 HydrophobicContact CZ2-CZ 4.37Å; W91-F133 AromaticContact NE1-CE2 3.86Å; W91-F133 AromaticContact NE1-CZ 3.5Å; I125-F133 HydrophobicContact CB-CD1 4.02Å; I125-F133 HydrophobicContact CD1-CE1 4.44Å; I125-F133 HydrophobicContact CG2-CD1 3.64Å; I125-F133 HydrophobicContact CG2-CE1 3.97Å; E126-F133 WeakPolarHBondContact CB-O 3.3Å; E126-F133 PolarHBondContact N-O 2.94Å
134H94.9Very high93.1Very high8 Ų844.1 Ų44.14%0.03722%0.224CC..BIsolated β-bridgetrans-125.1159.9-167.962.2-77.7000112.6Y84 Y85 E126 G132Y84-H134 AromaticContact CD1-CE1 3.42Å; Y84-H134 VanDerWaalsContact CD1-CE1 3.42Å; Y84-H134 WeakPolarHBondContact CD1-CE1 2.91Å; Y84-H134 AromaticContact CE1-CE1 3.59Å; Y84-H134 AromaticContact CE1-NE2 3.81Å; Y84-H134 AromaticContact CG-CE1 3.78Å; Y84-H134 PolarHBondContact OH-O 3.12Å; Y84-H134 VanDerWaalsContact OH-O 3.06Å; Y85-H134 AromaticContact CZ-NE2 3.84Å; Y85-H134 PolarHBondContact OH-NE2 3.28Å; E126-H134 HydrophobicContact CB-CB 4.39Å; E126-H134 CarbonylContact O-C 3.43Å; E126-H134 WeakPolarHBondContact O-CA 3.29Å; G132-H134 PolarHBondContact O-N 3.23Å; G132-H134 VanDerWaalsContact O-N 3.15Å; G132-H134 PolarHBondContact O-ND1 3.23Å; G132-H134 VanDerWaalsContact O-ND1 3.1Å
135L96.1Very high93.2Very high1 Ų143.1 Ų43.11%0.00521%0.211CC..  trans-84.1109.5171.6-177.953.3000110.6L95 V99 R116 V119 A120 I125 E126 D139 F140L95-L135 HydrophobicContact CD1-CD1 4.25Å; L95-L135 HydrophobicContact CD2-CD1 4.15Å; L95-L135 HydrophobicContact CG-CD1 4.15Å; V99-L135 HydrophobicContact CG2-CD1 3.66Å; V99-L135 HydrophobicContact CG2-CD2 4.27Å; R116-L135 HydrophobicContact CG-CD2 3.76Å; R116-L135 HydrophobicContact CG-CG 4.13Å; R116-L135 PolarHBondContact NH1-O 3.02Å; V119-L135 HydrophobicContact CB-CD2 3.95Å; V119-L135 HydrophobicContact CG1-CD2 3.75Å; A120-L135 HydrophobicContact CB-CB 4.49Å; I125-L135 HydrophobicContact CD1-CB 3.82Å; I125-L135 HydrophobicContact CG1-CB 4.44Å; E126-L135 PolarHBondContact O-N 3.43Å; L135-D139 HydrophobicContact CD1-CB 4.33Å; L135-F140 HydrophobicContact CD2-CB 4.33Å; L135-F140 HydrophobicContact CD2-CD2 4.22Å; L135-F140 HydrophobicContact CG-CB 4.32Å
136D94.6Very high93.3Very high22 Ų2244.9 Ų44.912%0.11822%0.22CC..  trans-63142.6173.1-156.9-51.4000110.7Y85 E138 D139 F140Y85-D136 WeakPolarHBondContact CE1-OD2 3.4Å; Y85-D136 PolarHBondContact OH-OD2 3.13Å; D136-E138 VanDerWaalsContact C-N 3.29Å; D136-E138 PolarHBondContact O-N 3.13Å; D136-E138 PolarHBondContact OD1-N 3.3Å; D136-D139 HydrophobicContact CB-CB 4.36Å; D136-D139 PolarHBondContact O-N 3.5Å; D136-F140 PolarHBondContact O-N 2.77Å
137V94.4Very high93.5Very high75 Ų7541.4 Ų41.446%0.45520%0.203SC..Hα-helixtrans-62.8-39.1177.7178.40000110.5D139 F140 L141V137-D139 VanDerWaalsContact C-N 3.31Å; V137-D139 PolarHBondContact O-N 3.15Å; V137-F140 PolarHBondContact O-N 3.47Å; V137-L141 HydrophobicContact CG1-CD1 4.02Å; V137-L141 HydrophobicContact CG1-CG 4.35Å; V137-L141 WeakPolarHBondContact O-CG 3.43Å; V137-L141 PolarHBondContact O-N 2.93Å
138E93.8Very high93.7Very high81 Ų8140 Ų4038%0.37920%0.195SC..Hα-helixtrans-63.4-39.5178.4-70.3-172.3-169.800111.9R92 D136 A142R92-E138 IonicContact NH2-OE2 3.8Å; D136-E138 VanDerWaalsContact C-N 3.29Å; D136-E138 PolarHBondContact O-N 3.13Å; D136-E138 PolarHBondContact OD1-N 3.3Å; E138-A142 VanDerWaalsContact O-CB 3.28Å; E138-A142 WeakPolarHBondContact O-CB 3.39Å; E138-A142 PolarHBondContact O-N 3.32Å
139D96.4Very high94Very high0 Ų039.7 Ų39.70%020%0.196CC..Hα-helixtrans-71.4-36.5178.8-68.8-32.2000111.9H88 R92 L95 Q96 L135 D136 V137 G143H88-D139 IonicContact CD2-OD2 3.15Å; H88-D139 IonicContact CE1-OD2 2.93Å; H88-D139 PolarHBondContact CE1-OD2 3.06Å; H88-D139 IonicContact NE2-OD1 3.28Å; H88-D139 IonicContact NE2-OD2 2.83Å; H88-D139 PolarHBondContact NE2-OD2 3.31Å; R92-D139 WeakPolarHBondContact CG-OD1 3.44Å; R92-D139 IonicContact NE-OD1 2.77Å; L95-D139 HydrophobicContact CD2-CB 4.36Å; Q96-D139 HydrophobicContact CG-CB 3.9Å; Q96-D139 WeakPolarHBondContact CG-OD1 3.33Å; Q96-D139 PolarHBondContact NE2-OD1 3.1Å; L135-D139 HydrophobicContact CD1-CB 4.33Å; D136-D139 HydrophobicContact CB-CB 4.36Å; D136-D139 PolarHBondContact O-N 3.5Å; V137-D139 VanDerWaalsContact C-N 3.31Å; V137-D139 PolarHBondContact O-N 3.15Å; D139-G143 PolarHBondContact O-N 3.04Å
140F97.4Very high94.5Very high22 Ų2233.9 Ų33.910%0.09618%0.175CC..Hα-helixtrans-59.4-53.5172.5175.3-102.2000110.9V99 V114 R116 V119 L135 D136 V137 A142 G143 V144V99-F140 HydrophobicContact CG1-CD2 3.89Å; V114-F140 HydrophobicContact CG1-CE2 4.47Å; V114-F140 WeakPolarHBondContact O-CZ 3.47Å; R116-F140 HydrophobicContact CB-CD1 4.28Å; R116-F140 HydrophobicContact CB-CD2 3.98Å; R116-F140 HydrophobicContact CB-CE1 4.36Å; R116-F140 HydrophobicContact CB-CE2 4.07Å; R116-F140 HydrophobicContact CB-CG 4.08Å; R116-F140 HydrophobicContact CB-CZ 4.26Å; R116-F140 HydrophobicContact CG-CB 4.13Å; R116-F140 HydrophobicContact CG-CD1 4.46Å; R116-F140 HydrophobicContact CG-CD2 4.01Å; R116-F140 HydrophobicContact CG-CG 3.93Å; V119-F140 HydrophobicContact CG2-CD2 4.35Å; V119-F140 HydrophobicContact CG2-CE2 3.98Å; L135-F140 HydrophobicContact CD2-CB 4.33Å; L135-F140 HydrophobicContact CD2-CD2 4.22Å; L135-F140 HydrophobicContact CG-CB 4.32Å; D136-F140 PolarHBondContact O-N 2.77Å; V137-F140 PolarHBondContact O-N 3.47Å; F140-A142 VanDerWaalsContact C-N 3.33Å; F140-A142 PolarHBondContact O-N 3.43Å; F140-G143 PolarHBondContact O-N 3.02Å; F140-G143 VanDerWaalsContact O-N 3.15Å; F140-V144 HydrophobicContact CD1-CG2 4.43Å; F140-V144 HydrophobicContact CE1-CG2 4Å; F140-V144 HydrophobicContact CE2-CG2 4.18Å; F140-V144 HydrophobicContact CZ-CG2 3.86Å; F140-V144 WeakPolarHBondContact O-CG2 3.37Å; F140-V144 PolarHBondContact O-N 3.4Å
141L96.7Very high95Very high28 Ų2826.1 Ų26.115%0.14714%0.138CC..Hα-helixtrans-62.3-39.8-179.7-67.8175.2000112.1V137 G143 V144 L145 F181 L184 L191V137-L141 HydrophobicContact CG1-CD1 4.02Å; V137-L141 HydrophobicContact CG1-CG 4.35Å; V137-L141 WeakPolarHBondContact O-CG 3.43Å; V137-L141 PolarHBondContact O-N 2.93Å; L141-G143 VanDerWaalsContact C-N 3.34Å; L141-G143 PolarHBondContact O-N 2.97Å; L141-V144 PolarHBondContact O-N 3.15Å; L141-L145 WeakPolarHBondContact O-CG 3.32Å; L141-L145 PolarHBondContact O-N 3Å; L141-F181 HydrophobicContact CB-CE1 4.04Å; L141-F181 HydrophobicContact CB-CZ 4.17Å; L141-F181 HydrophobicContact CD2-CE1 3.95Å; L141-F181 HydrophobicContact CD2-CZ 3.88Å; L141-F181 HydrophobicContact CG-CE1 4.43Å; L141-L184 HydrophobicContact CD1-CD1 3.8Å; L141-L184 HydrophobicContact CD2-CD1 4.09Å; L141-L191 HydrophobicContact CB-CD1 3.88Å; L141-L191 HydrophobicContact CB-CD2 3.96Å; L141-L191 HydrophobicContact CD1-CD2 3.85Å
142A96.7Very high95.6Very high3 Ų319.4 Ų19.43%0.02511%0.11CC..Hα-helixtrans-62.6-40.7175.200000112Q96 E138 F140 L145 I146 L191Q96-A142 HydrophobicContact CG-CB 3.88Å; E138-A142 VanDerWaalsContact O-CB 3.28Å; E138-A142 WeakPolarHBondContact O-CB 3.39Å; E138-A142 PolarHBondContact O-N 3.32Å; F140-A142 VanDerWaalsContact C-N 3.33Å; F140-A142 PolarHBondContact O-N 3.43Å; A142-L145 PolarHBondContact O-N 3.36Å; A142-I146 WeakPolarHBondContact O-CG1 3.2Å; A142-I146 PolarHBondContact O-N 3.01Å; A142-I146 VanDerWaalsContact O-N 3.14Å; A142-L191 HydrophobicContact CB-CD1 4.09Å
143G97.7Very high96Very high0 Ų023.8 Ų23.80%012%0.121CC..Hα-helixtrans-63.2-40.7174.200000113.1Q96 F100 D139 F140 L141 L145 I146 M147Q96-G143 WeakPolarHBondContact O-CA 3.31Å; F100-G143 WeakPolarHBondContact CB-O 3.33Å; D139-G143 PolarHBondContact O-N 3.04Å; F140-G143 PolarHBondContact O-N 3.02Å; F140-G143 VanDerWaalsContact O-N 3.15Å; L141-G143 VanDerWaalsContact C-N 3.34Å; L141-G143 PolarHBondContact O-N 2.97Å; G143-L145 PolarHBondContact O-N 3.3Å; G143-I146 PolarHBondContact O-N 3.48Å; G143-M147 PolarHBondContact O-N 3.17Å
144V97.6Very high96.2Very high3 Ų323.2 Ų23.22%0.01812%0.119CC..Hα-helixtrans-63.2-39.8175.61740000111.7L113 F140 L141 I146 M147 A148 L177 F181L113-V144 HydrophobicContact CD1-CG1 4Å; L113-V144 HydrophobicContact CD1-CG2 4.02Å; F140-V144 HydrophobicContact CD1-CG2 4.43Å; F140-V144 HydrophobicContact CE1-CG2 4Å; F140-V144 HydrophobicContact CE2-CG2 4.18Å; F140-V144 HydrophobicContact CZ-CG2 3.86Å; F140-V144 WeakPolarHBondContact O-CG2 3.37Å; F140-V144 PolarHBondContact O-N 3.4Å; L141-V144 PolarHBondContact O-N 3.15Å; V144-I146 VanDerWaalsContact C-N 3.34Å; V144-I146 PolarHBondContact O-N 2.98Å; V144-M147 HydrophobicContact CG1-CE 4.24Å; V144-M147 WeakPolarHBondContact O-CB 3.42Å; V144-M147 PolarHBondContact O-N 3.14Å; V144-A148 PolarHBondContact O-N 3.39Å; V144-L177 HydrophobicContact CG1-CD1 4.22Å; V144-L177 HydrophobicContact CG1-CD2 3.83Å; V144-F181 HydrophobicContact CG1-CE2 4.06Å; V144-F181 HydrophobicContact CG1-CZ 4.41Å
145L97.2Very high96.2Very high9 Ų922.9 Ų22.95%0.04712%0.117CC..Hα-helixtrans-65.9-36.5175.6-69.6169.4000112.4L141 A142 G143 M147 A148 S149 F181 L191 R194 Y195 L198L141-L145 WeakPolarHBondContact O-CG 3.32Å; L141-L145 PolarHBondContact O-N 3Å; A142-L145 PolarHBondContact O-N 3.36Å; G143-L145 PolarHBondContact O-N 3.3Å; L145-M147 VanDerWaalsContact C-N 3.31Å; L145-A148 WeakPolarHBondContact O-CB 3.36Å; L145-A148 PolarHBondContact O-N 3.31Å; L145-S149 PolarHBondContact O-N 2.67Å; L145-F181 HydrophobicContact CD1-CE1 3.91Å; L145-F181 HydrophobicContact CD1-CZ 4.09Å; L145-F181 HydrophobicContact CD2-CD1 4.42Å; L145-F181 HydrophobicContact CD2-CD2 4.22Å; L145-F181 HydrophobicContact CD2-CE1 3.99Å; L145-F181 HydrophobicContact CD2-CE2 3.79Å; L145-F181 HydrophobicContact CD2-CZ 3.67Å; L145-F181 HydrophobicContact CG-CE1 3.9Å; L145-F181 HydrophobicContact CG-CE2 4.14Å; L145-F181 HydrophobicContact CG-CZ 3.56Å; L145-L191 HydrophobicContact CD1-CD1 3.8Å; L145-R194 HydrophobicContact CD1-CB 3.77Å; L145-Y195 HydrophobicContact CD2-CD2 4.24Å; L145-L198 HydrophobicContact CD2-CB 4.23Å; L145-L198 HydrophobicContact CD2-CD1 4.45Å; L145-L198 HydrophobicContact CD2-CD2 4.17Å
146I97.5Very high96.1Very high45 Ų4525.2 Ų25.223%0.23113%0.131CC..Hα-helixtrans-64.5-39.6173.7-64.2163.2000110.4Q96 F100 A142 G143 V144 A148 S149 E150Q96-I146 HydrophobicContact CB-CD1 4.46Å; F100-I146 HydrophobicContact CB-CB 4.02Å; F100-I146 HydrophobicContact CB-CG2 3.91Å; F100-I146 HydrophobicContact CD1-CG2 3.7Å; F100-I146 HydrophobicContact CD2-CB 4.42Å; F100-I146 HydrophobicContact CD2-CG2 3.89Å; F100-I146 HydrophobicContact CE1-CG2 4.16Å; F100-I146 HydrophobicContact CE2-CG2 4.36Å; F100-I146 HydrophobicContact CG-CB 4.14Å; F100-I146 HydrophobicContact CG-CG2 3.53Å; F100-I146 HydrophobicContact CZ-CG2 4.48Å; A142-I146 WeakPolarHBondContact O-CG1 3.2Å; A142-I146 PolarHBondContact O-N 3.01Å; A142-I146 VanDerWaalsContact O-N 3.14Å; G143-I146 PolarHBondContact O-N 3.48Å; V144-I146 VanDerWaalsContact C-N 3.34Å; V144-I146 PolarHBondContact O-N 2.98Å; I146-A148 VanDerWaalsContact C-N 3.33Å; I146-A148 PolarHBondContact O-N 3.11Å; I146-S149 PolarHBondContact O-N 3.16Å; I146-E150 PolarHBondContact O-N 3Å
147M97Very high96Very high0 Ų026 Ų260%014%0.136CC..Hα-helixtrans-60.1-42.8174.2-175.9-169.859.900111.7F100 A103 F104 L113 G143 V144 L145 S149 E150 L151 F173 L177F100-M147 VanDerWaalsContact CD2-CA 3.48Å; F100-M147 HydrophobicContact CD2-CB 3.83Å; F100-M147 HydrophobicContact CD2-CG 4.47Å; F100-M147 HydrophobicContact CE2-CB 4.41Å; A103-M147 VanDerWaalsContact C-SD 3.56Å; A103-M147 HydrophobicContact CB-CE 4.38Å; A103-M147 HydrophobicContact CB-SD 3.51Å; A103-M147 VanDerWaalsContact CB-SD 3.51Å; F104-M147 HydrophobicContact CB-CG 4.44Å; L113-M147 HydrophobicContact CD1-CE 3.95Å; G143-M147 PolarHBondContact O-N 3.17Å; V144-M147 HydrophobicContact CG1-CE 4.24Å; V144-M147 WeakPolarHBondContact O-CB 3.42Å; V144-M147 PolarHBondContact O-N 3.14Å; L145-M147 VanDerWaalsContact C-N 3.31Å; M147-S149 VanDerWaalsContact C-N 3.28Å; M147-S149 PolarHBondContact O-N 2.99Å; M147-E150 PolarHBondContact O-N 3.29Å; M147-L151 HydrophobicContact CE-CD1 4.46Å; M147-L151 HydrophobicContact CG-CD1 4.25Å; M147-L151 HydrophobicContact CG-CG 4.27Å; M147-L151 WeakPolarHBondContact O-CG 3.34Å; M147-L151 PolarHBondContact O-N 3.04Å; M147-F173 HydrophobicContact CE-CE1 3.66Å; M147-F173 HydrophobicContact CE-CZ 3.83Å; M147-L177 HydrophobicContact CE-CD1 4.15Å
148A96.4Very high95.9Very high1 Ų122.5 Ų22.51%0.00811%0.114CC..Hα-helixtrans-56.7-42.2179.100000112.5V144 L145 I146 E150 L151 S152 I174 L198V144-A148 PolarHBondContact O-N 3.39Å; L145-A148 WeakPolarHBondContact O-CB 3.36Å; L145-A148 PolarHBondContact O-N 3.31Å; I146-A148 VanDerWaalsContact C-N 3.33Å; I146-A148 PolarHBondContact O-N 3.11Å; A148-E150 PolarHBondContact O-N 2.81Å; A148-L151 PolarHBondContact O-N 3.29Å; A148-S152 PolarHBondContact O-N 3.34Å; A148-I174 HydrophobicContact CB-CD1 3.55Å; A148-L198 HydrophobicContact CB-CD1 3.47Å; A148-L198 VanDerWaalsContact CB-CD1 3.47Å
149S96.6Very high95.7Very high55 Ų5520.6 Ų20.639%0.38511%0.108SC..Hα-helixtrans-66.4-34.4174.7-53.40000113.3L145 I146 M147 S152 R153 D201L145-S149 PolarHBondContact O-N 2.67Å; I146-S149 PolarHBondContact O-N 3.16Å; M147-S149 VanDerWaalsContact C-N 3.28Å; M147-S149 PolarHBondContact O-N 2.99Å; S149-S152 PolarHBondContact O-N 3.43Å; S149-S152 PolarHBondContact O-OG 3.22Å; S149-R153 PolarHBondContact O-N 2.87Å; S149-D201 WeakPolarHBondContact CA-OD1 3.38Å; S149-D201 WeakPolarHBondContact CA-OD2 3.44Å; S149-D201 WeakPolarHBondContact CB-OD2 3.29Å; S149-D201 PolarHBondContact OG-OD2 3.12Å
150E96.9Very high95.4Very high23 Ų2326.3 Ų26.311%0.10714%0.143CC..Hα-helixtrans-70.2-34.7174.6-16765-163.400111.7H46 F100 F104 I146 M147 A148 R153 L154H46-E150 IonicContact CD2-OE1 2.75Å; H46-E150 IonicContact CE1-OE1 3.17Å; H46-E150 IonicContact NE2-OE1 2.84Å; H46-E150 PolarHBondContact NE2-OE1 3.4Å; F100-E150 HydrophobicContact CE2-CB 3.71Å; F100-E150 HydrophobicContact CE2-CG 4.03Å; F100-E150 HydrophobicContact CZ-CB 4.02Å; F100-E150 HydrophobicContact CZ-CG 3.97Å; F104-E150 HydrophobicContact CE1-CG 4.17Å; F104-E150 HydrophobicContact CE2-CG 4.37Å; F104-E150 HydrophobicContact CZ-CG 4.06Å; I146-E150 PolarHBondContact O-N 3Å; M147-E150 PolarHBondContact O-N 3.29Å; A148-E150 PolarHBondContact O-N 2.81Å; E150-R153 WeakPolarHBondContact O-CB 3.46Å; E150-R153 PolarHBondContact O-N 3.1Å; E150-L154 PolarHBondContact O-N 2.88Å
151L96.6Very high94.9Very high0 Ų027.4 Ų27.40%016%0.156CC..Hα-helixtrans-68-34.7174.8-67.2-178.3000112.4F104 Y107 M147 A148 R153 L154 A155 I170 F173 I174F104-L151 HydrophobicContact CD2-CD2 4.18Å; F104-L151 HydrophobicContact CE2-CD2 3.88Å; Y107-L151 HydrophobicContact CD1-CD1 4.22Å; Y107-L151 HydrophobicContact CD1-CD2 3.41Å; Y107-L151 VanDerWaalsContact CD1-CD2 3.41Å; Y107-L151 HydrophobicContact CD1-CG 4.46Å; Y107-L151 HydrophobicContact CD2-CD1 4.18Å; Y107-L151 HydrophobicContact CE1-CD1 4.11Å; Y107-L151 HydrophobicContact CE1-CD2 3.33Å; Y107-L151 HydrophobicContact CE1-CG 4.37Å; Y107-L151 HydrophobicContact CE2-CD1 4.08Å; Y107-L151 HydrophobicContact CG-CD1 4.24Å; Y107-L151 HydrophobicContact CG-CD2 4.16Å; M147-L151 HydrophobicContact CE-CD1 4.46Å; M147-L151 HydrophobicContact CG-CD1 4.25Å; M147-L151 HydrophobicContact CG-CG 4.27Å; M147-L151 WeakPolarHBondContact O-CG 3.34Å; M147-L151 PolarHBondContact O-N 3.04Å; A148-L151 PolarHBondContact O-N 3.29Å; L151-R153 PolarHBondContact O-N 3.44Å; L151-L154 HydrophobicContact CD2-CD2 3.94Å; L151-L154 WeakPolarHBondContact O-CB 3.48Å; L151-L154 PolarHBondContact O-N 2.83Å; L151-L154 VanDerWaalsContact O-N 3.12Å; L151-A155 PolarHBondContact O-N 3.14Å; L151-I170 HydrophobicContact CB-CG2 3.97Å; L151-F173 HydrophobicContact CD1-CD1 3.64Å; L151-F173 HydrophobicContact CD1-CE1 3.58Å; L151-I174 HydrophobicContact CB-CD1 4.26Å; L151-I174 HydrophobicContact CD1-CD1 4.14Å
152S95.8Very high94.5Very high3 Ų328 Ų282%0.02117%0.169CC..Hα-helixtrans-62.9-34.6173.487.50000111.9A148 S149 D201A148-S152 PolarHBondContact O-N 3.34Å; S149-S152 PolarHBondContact O-N 3.43Å; S149-S152 PolarHBondContact O-OG 3.22Å; S152-D201 WeakPolarHBondContact CB-OD1 3.28Å; S152-D201 PolarHBondContact OG-OD1 3.48Å
153R95.4Very high94.1Very high109 Ų10929.7 Ų29.741%0.41118%0.178SC..Hα-helixtrans-70.4-42.6170.5-174.9-177.5-176.8-167.5-0.2111.9S149 E150 L151 A155 V156 N157S149-R153 PolarHBondContact O-N 2.87Å; E150-R153 WeakPolarHBondContact O-CB 3.46Å; E150-R153 PolarHBondContact O-N 3.1Å; L151-R153 PolarHBondContact O-N 3.44Å; R153-A155 VanDerWaalsContact C-N 3.32Å; R153-A155 PolarHBondContact O-N 2.9Å; R153-V156 PolarHBondContact O-N 3.2Å; R153-N157 PolarHBondContact O-N 3.37Å; R153-N157 VanDerWaalsContact O-N 3.14Å; R153-N157 PolarHBondContact O-ND2 3.31Å
154L94.6Very high93.8Very high0 Ų033.9 Ų33.90%019%0.194CC..Hα-helixtrans-59.9-43179-17265000111.2V45 F51 F104 L108 E150 L151 V156 N157 S158 I170V45-L154 HydrophobicContact CG1-CD1 3.89Å; V45-L154 HydrophobicContact CG2-CD1 4.41Å; F51-L154 HydrophobicContact CE1-CD1 3.73Å; F51-L154 HydrophobicContact CE1-CG 4.47Å; F51-L154 HydrophobicContact CZ-CD1 4.05Å; F104-L154 HydrophobicContact CE2-CD2 4.17Å; L108-L154 HydrophobicContact CD2-CD2 4.03Å; E150-L154 PolarHBondContact O-N 2.88Å; L151-L154 HydrophobicContact CD2-CD2 3.94Å; L151-L154 WeakPolarHBondContact O-CB 3.48Å; L151-L154 PolarHBondContact O-N 2.83Å; L151-L154 VanDerWaalsContact O-N 3.12Å; L154-V156 PolarHBondContact O-N 3Å; L154-N157 PolarHBondContact O-N 3.38Å; L154-S158 WeakPolarHBondContact O-CB 3.28Å; L154-S158 PolarHBondContact O-N 2.97Å; L154-S158 PolarHBondContact O-OG 3.45Å; L154-I170 HydrophobicContact CB-CD1 4.21Å; L154-I170 HydrophobicContact CD2-CD1 4.18Å; L154-I170 HydrophobicContact CG-CD1 4.18Å
155A94.7Very high93.5Very high0 Ų036.5 Ų36.50%021%0.213CC..Hα-helixtrans-55.6-48.3178.300000111.9L151 R153 N157 S158 V159 P167 I170 I205L151-A155 PolarHBondContact O-N 3.14Å; R153-A155 VanDerWaalsContact C-N 3.32Å; R153-A155 PolarHBondContact O-N 2.9Å; A155-N157 PolarHBondContact O-N 3.41Å; A155-S158 WeakPolarHBondContact O-CB 3.32Å; A155-S158 PolarHBondContact O-N 3.16Å; A155-V159 PolarHBondContact O-N 2.94Å; A155-P167 HydrophobicContact CB-CB 4.37Å; A155-I170 HydrophobicContact CB-CD1 3.86Å; A155-I170 HydrophobicContact CB-CG2 4.25Å; A155-I205 HydrophobicContact CB-CG1 4.3Å
156V94.1Very high93.3Very high51 Ų5137.3 Ų37.331%0.30922%0.215SC..Hα-helixtrans-61.4-47177.3177.20000111.5R153 L154 S158 V159 T160 V208R153-V156 PolarHBondContact O-N 3.2Å; L154-V156 PolarHBondContact O-N 3Å; V156-S158 VanDerWaalsContact C-N 3.25Å; V156-S158 PolarHBondContact O-N 3.05Å; V156-V159 PolarHBondContact O-N 3.07Å; V156-T160 PolarHBondContact O-N 3.28Å; V156-T160 PolarHBondContact O-OG1 2.84Å; V156-V208 HydrophobicContact CG2-CG2 3.79Å
157N93Very high93.1Very high39 Ų3935.1 Ų35.121%0.20920%0.204CC..Hα-helixtrans-68.4-27.5-178.3-67.8-24.1000112.6H46 R153 L154 A155 T160 A161H46-N157 HydrophobicContact CB-CB 4.47Å; H46-N157 WeakPolarHBondContact CB-ND2 3.3Å; H46-N157 PolarHBondContact ND1-ND2 3.39Å; R153-N157 PolarHBondContact O-N 3.37Å; R153-N157 VanDerWaalsContact O-N 3.14Å; R153-N157 PolarHBondContact O-ND2 3.31Å; L154-N157 PolarHBondContact O-N 3.38Å; A155-N157 PolarHBondContact O-N 3.41Å; N157-T160 PolarHBondContact O-N 3.5Å; N157-A161 WeakPolarHBondContact O-CB 3.33Å; N157-A161 PolarHBondContact O-N 2.85Å
158S91.1Very high93Very high0 Ų037.6 Ų37.60%022%0.217CC..Hα-helixtrans-65.2-43.8176-53.70000111.1F51 L154 A155 V156 T160 A161 G162 D163 R166F51-S158 WeakPolarHBondContact CE1-OG 3.12Å; F51-S158 WeakPolarHBondContact CZ-OG 3.35Å; L154-S158 WeakPolarHBondContact O-CB 3.28Å; L154-S158 PolarHBondContact O-N 2.97Å; L154-S158 PolarHBondContact O-OG 3.45Å; A155-S158 WeakPolarHBondContact O-CB 3.32Å; A155-S158 PolarHBondContact O-N 3.16Å; V156-S158 VanDerWaalsContact C-N 3.25Å; V156-S158 PolarHBondContact O-N 3.05Å; S158-T160 VanDerWaalsContact C-N 3.34Å; S158-T160 PolarHBondContact O-N 2.93Å; S158-A161 CarbonylContact O-C 3.53Å; S158-A161 PolarHBondContact O-N 2.97Å; S158-A161 VanDerWaalsContact O-N 3.15Å; S158-G162 PolarHBondContact O-N 3.37Å; S158-G162 VanDerWaalsContact O-N 3.14Å; S158-D163 CarbonylContact C-O 3.39Å; S158-D163 PolarHBondContact O-N 2.81Å; S158-R166 WeakPolarHBondContact OG-CD 3.46Å
159V91.2Very high92.9Very high41 Ų4141.9 Ų41.925%0.24823%0.233CC..Hα-helixtrans-61-44.4174.9177.70000111.1A155 V156 A161 G162 Y164 P167 V208 L212A155-V159 PolarHBondContact O-N 2.94Å; V156-V159 PolarHBondContact O-N 3.07Å; V159-A161 PolarHBondContact O-N 2.74Å; V159-G162 PolarHBondContact O-N 3.31Å; V159-Y164 HydrophobicContact CG1-CD1 4.21Å; V159-Y164 HydrophobicContact CG1-CE1 4.04Å; V159-P167 HydrophobicContact CG2-CB 4.46Å; V159-P167 HydrophobicContact CG2-CG 3.55Å; V159-V208 HydrophobicContact CG2-CG1 3.64Å; V159-L212 HydrophobicContact CG1-CD2 3.97Å; V159-L212 HydrophobicContact CG2-CD1 3.95Å; V159-L212 HydrophobicContact CG2-CD2 4.03Å; V159-L212 HydrophobicContact CG2-CG 4.28Å
160T89.1Confident92.9Very high121 Ų12139.3 Ų39.374%0.74222%0.215SC*.Hα-helixtrans-61.8-32.2177.2-54.70000112.3V156 N157 S158 G162V156-T160 PolarHBondContact O-N 3.28Å; V156-T160 PolarHBondContact O-OG1 2.84Å; N157-T160 PolarHBondContact O-N 3.5Å; S158-T160 VanDerWaalsContact C-N 3.34Å; S158-T160 PolarHBondContact O-N 2.93Å; T160-G162 VanDerWaalsContact C-N 3.3Å
161A87.9Confident92.8Very high44 Ų4438.9 Ų38.936%0.36421%0.214SC..THydrogen-bonded Turntrans-84.2-0.1175.600000114.1F51 N157 S158 V159F51-A161 HydrophobicContact CD2-CB 3.6Å; F51-A161 HydrophobicContact CE2-CB 3.4Å; F51-A161 VanDerWaalsContact CE2-CB 3.4Å; F51-A161 HydrophobicContact CZ-CB 4.47Å; N157-A161 WeakPolarHBondContact O-CB 3.33Å; N157-A161 PolarHBondContact O-N 2.85Å; S158-A161 CarbonylContact O-C 3.53Å; S158-A161 PolarHBondContact O-N 2.97Å; S158-A161 VanDerWaalsContact O-N 3.15Å; V159-A161 PolarHBondContact O-N 2.74Å
162G87.9Confident92.8Very high42 Ų4243.7 Ų43.743%0.43324%0.24SC..THydrogen-bonded Turntrans83.98179.600000115.2S158 V159 T160 Y164S158-G162 PolarHBondContact O-N 3.37Å; S158-G162 VanDerWaalsContact O-N 3.14Å; V159-G162 PolarHBondContact O-N 3.31Å; T160-G162 VanDerWaalsContact C-N 3.3Å; G162-Y164 PolarHBondContact O-N 3.43Å
163D88.9Confident92.8Very high37 Ų3744.2 Ų44.220%0.19824%0.242CC..  trans-89.995.4171.1-176.3-5.3000109.8S158 S165 R166 P167S158-D163 CarbonylContact C-O 3.39Å; S158-D163 PolarHBondContact O-N 2.81Å; D163-S165 PolarHBondContact OD1-N 3.05Å; D163-S165 PolarHBondContact OD1-OG 2.87Å; D163-R166 PolarHBondContact OD1-N 3.44Å; D163-R166 VanDerWaalsContact OD1-N 3.09Å; D163-R166 VanDerWaalsContact OD2-CB 3.28Å; D163-R166 WeakPolarHBondContact OD2-CB 3.42Å; D163-R166 IonicContact OD2-NE 3.76Å; D163-R166 PolarHBondContact OD2-NE 2.89Å; D163-P167 VanDerWaalsContact O-CD 3.3Å; D163-P167 WeakPolarHBondContact O-CD 3.31Å
164Y91Very high92.9Very high89 Ų8939.1 Ų39.135%0.34922%0.223SC..  trans-84.8-9.6178-50.6-45.9000113.4V159 G162 L168 L212 L217V159-Y164 HydrophobicContact CG1-CD1 4.21Å; V159-Y164 HydrophobicContact CG1-CE1 4.04Å; G162-Y164 PolarHBondContact O-N 3.43Å; Y164-L168 WeakPolarHBondContact O-CD1 3.36Å; Y164-L212 HydrophobicContact CD1-CD2 3.55Å; Y164-L212 HydrophobicContact CE1-CD2 4.24Å; Y164-L212 HydrophobicContact CG-CD2 4.1Å; Y164-L217 HydrophobicContact CD2-CB 4.12Å; Y164-L217 HydrophobicContact CD2-CD2 4.35Å; Y164-L217 HydrophobicContact CE1-CD1 4.32Å; Y164-L217 HydrophobicContact CE2-CD1 4.32Å; Y164-L217 HydrophobicContact CE2-CD2 4.03Å; Y164-L217 HydrophobicContact CG-CB 4.24Å
165S91.3Very high92.9Very high58 Ų5841.4 Ų41.441%0.40624%0.235SC..SBendtrans-82.5-37.4-178.673.30000112.4D163 L168 R169D163-S165 PolarHBondContact OD1-N 3.05Å; D163-S165 PolarHBondContact OD1-OG 2.87Å; S165-L168 PolarHBondContact O-N 3.14Å; S165-R169 PolarHBondContact O-N 2.88Å; S165-R169 PolarHBondContact OG-NH2 2.98Å
166R91.9Very high92.9Very high25 Ų2547.8 Ų47.89%0.09427%0.265CS..Hα-helixtrans-65.1-39.2-174.8-178178.7-67.4-113.61.6113.7S158 D163 L168 R169 I170S158-R166 WeakPolarHBondContact OG-CD 3.46Å; D163-R166 PolarHBondContact OD1-N 3.44Å; D163-R166 VanDerWaalsContact OD1-N 3.09Å; D163-R166 VanDerWaalsContact OD2-CB 3.28Å; D163-R166 WeakPolarHBondContact OD2-CB 3.42Å; D163-R166 IonicContact OD2-NE 3.76Å; D163-R166 PolarHBondContact OD2-NE 2.89Å; R166-L168 VanDerWaalsContact C-N 3.3Å; R166-L168 PolarHBondContact O-N 3.05Å; R166-R169 PolarHBondContact O-N 2.69Å; R166-I170 HydrophobicContact CG-CD1 3.77Å; R166-I170 HydrophobicContact CG-CG1 4.26Å; R166-I170 WeakPolarHBondContact O-CG1 3.28Å; R166-I170 PolarHBondContact O-N 3.21Å
167P94.9Very high93Very high0 Ų046.1 Ų46.10%025%0.254CS..Hα-helixtrans-57.9-37.5174.3-26.936.3000113.9A155 V159 D163 I170 S171 V208 V209 L212A155-P167 HydrophobicContact CB-CB 4.37Å; V159-P167 HydrophobicContact CG2-CB 4.46Å; V159-P167 HydrophobicContact CG2-CG 3.55Å; D163-P167 VanDerWaalsContact O-CD 3.3Å; D163-P167 WeakPolarHBondContact O-CD 3.31Å; P167-I170 PolarHBondContact O-N 3.12Å; P167-S171 WeakPolarHBondContact O-CB 3.48Å; P167-S171 PolarHBondContact O-N 3.16Å; P167-V208 HydrophobicContact CB-CG1 3.97Å; P167-V208 HydrophobicContact CG-CG1 4.32Å; P167-V209 HydrophobicContact CB-CG2 4.29Å; P167-L212 HydrophobicContact CB-CD1 3.93Å; P167-L212 HydrophobicContact CG-CD1 3.97Å
168L93.9Very high93Very high51 Ų5144.9 Ų44.927%0.26725%0.247SC..Hα-helixtrans-65.7-44.4176-70.797.2000111.3Y164 S165 R166 S171 N172 V209 A218Y164-L168 WeakPolarHBondContact O-CD1 3.36Å; S165-L168 PolarHBondContact O-N 3.14Å; R166-L168 VanDerWaalsContact C-N 3.3Å; R166-L168 PolarHBondContact O-N 3.05Å; L168-S171 WeakPolarHBondContact O-CB 3.44Å; L168-S171 PolarHBondContact O-N 3.37Å; L168-N172 PolarHBondContact O-N 3.17Å; L168-V209 HydrophobicContact CG-CG1 4.25Å; L168-A218 HydrophobicContact CD1-CB 4.39Å; L168-A218 HydrophobicContact CD2-CB 4.35Å
169R94.8Very high93.2Very high92 Ų9247.8 Ų47.835%0.34727%0.268SS..Hα-helixtrans-64.2-41.2177.7-66.2-178-74.8158.3-2.4112.1E111 S165 R166 S171 N172 F173E111-R169 IonicContact OE1-CZ 3.27Å; E111-R169 VanDerWaalsContact OE1-CZ 3.27Å; E111-R169 IonicContact OE1-NH1 2.61Å; E111-R169 PolarHBondContact OE1-NH1 3.47Å; E111-R169 IonicContact OE1-NH2 2.9Å; E111-R169 WeakPolarHBondContact OE2-CD 3.42Å; E111-R169 IonicContact OE2-CZ 3.56Å; E111-R169 IonicContact OE2-NE 3.3Å; E111-R169 IonicContact OE2-NH1 2.77Å; E111-R169 PolarHBondContact OE2-NH1 2.8Å; S165-R169 PolarHBondContact O-N 2.88Å; S165-R169 PolarHBondContact OG-NH2 2.98Å; R166-R169 PolarHBondContact O-N 2.69Å; R169-S171 VanDerWaalsContact C-N 3.34Å; R169-N172 PolarHBondContact O-N 3.08Å; R169-F173 WeakPolarHBondContact O-CB 3.42Å; R169-F173 PolarHBondContact O-N 3.15Å; R169-F173 VanDerWaalsContact O-N 3.09Å
170I96.1Very high93.4Very high0 Ų047.4 Ų47.40%027%0.272CS..Hα-helixtrans-61.6-42.6172.8-69.2167.2000110.7Y107 L151 L154 A155 R166 P167 F173 I174 I205Y107-I170 HydrophobicContact CE1-CG1 4.34Å; Y107-I170 WeakPolarHBondContact OH-CG1 3.44Å; L151-I170 HydrophobicContact CB-CG2 3.97Å; L154-I170 HydrophobicContact CB-CD1 4.21Å; L154-I170 HydrophobicContact CD2-CD1 4.18Å; L154-I170 HydrophobicContact CG-CD1 4.18Å; A155-I170 HydrophobicContact CB-CD1 3.86Å; A155-I170 HydrophobicContact CB-CG2 4.25Å; R166-I170 HydrophobicContact CG-CD1 3.77Å; R166-I170 HydrophobicContact CG-CG1 4.26Å; R166-I170 WeakPolarHBondContact O-CG1 3.28Å; R166-I170 PolarHBondContact O-N 3.21Å; P167-I170 PolarHBondContact O-N 3.12Å; I170-F173 PolarHBondContact O-N 3.21Å; I170-I174 HydrophobicContact CG2-CG1 4.05Å; I170-I174 WeakPolarHBondContact O-CB 3.28Å; I170-I174 WeakPolarHBondContact O-CG1 3.49Å; I170-I174 PolarHBondContact O-N 3.35Å; I170-I205 HydrophobicContact CG2-CD1 3.79Å; I170-I205 HydrophobicContact CG2-CG1 4.27Å; I170-I205 HydrophobicContact CG2-CG2 4.25Å
171S95.8Very high93.6Very high14 Ų1442 Ų4210%0.09824%0.239CC..Hα-helixtrans-59.7-48178.5-170.50000112.2P167 L168 R169 F173 I174 N175P167-S171 WeakPolarHBondContact O-CB 3.48Å; P167-S171 PolarHBondContact O-N 3.16Å; L168-S171 WeakPolarHBondContact O-CB 3.44Å; L168-S171 PolarHBondContact O-N 3.37Å; R169-S171 VanDerWaalsContact C-N 3.34Å; S171-F173 PolarHBondContact O-N 3.2Å; S171-I174 PolarHBondContact O-N 3.48Å; S171-N175 WeakPolarHBondContact O-CB 3.33Å; S171-N175 PolarHBondContact O-N 2.92Å; S171-N175 PolarHBondContact O-ND2 2.97Å
172N95.4Very high93.8Very high102 Ų10247.1 Ų47.155%0.54525%0.248SC..Hα-helixtrans-60.4-48.6177.9-68.5-12.8000111L168 R169 I174 N175 E176L168-N172 PolarHBondContact O-N 3.17Å; R169-N172 PolarHBondContact O-N 3.08Å; N172-I174 PolarHBondContact O-N 3.35Å; N172-N175 PolarHBondContact O-N 3.39Å; N172-E176 WeakPolarHBondContact O-CG 3.43Å; N172-E176 PolarHBondContact O-N 3.21Å
173F96.6Very high94.1Very high14 Ų1452.3 Ų52.36%0.06127%0.265CS..Hα-helixtrans-59.3-43.3179.3179.9-104.6000113.2Y107 L113 M147 L151 R169 I170 S171 E176 L177Y107-F173 AromaticContact CD2-CD1 3.93Å; Y107-F173 HydrophobicContact CD2-CD1 3.93Å; Y107-F173 HydrophobicContact CD2-CD2 4.31Å; Y107-F173 AromaticContact CD2-CE1 3.68Å; Y107-F173 HydrophobicContact CD2-CE1 3.68Å; Y107-F173 HydrophobicContact CD2-CE2 4.11Å; Y107-F173 HydrophobicContact CD2-CG 4.23Å; Y107-F173 AromaticContact CD2-CZ 3.78Å; Y107-F173 HydrophobicContact CD2-CZ 3.78Å; Y107-F173 HydrophobicContact CE2-CB 4.13Å; Y107-F173 AromaticContact CE2-CD1 3.48Å; Y107-F173 HydrophobicContact CE2-CD1 3.48Å; Y107-F173 VanDerWaalsContact CE2-CD1 3.48Å; Y107-F173 AromaticContact CE2-CD2 3.96Å; Y107-F173 HydrophobicContact CE2-CD2 3.96Å; Y107-F173 AromaticContact CE2-CE1 3.76Å; Y107-F173 HydrophobicContact CE2-CE1 3.76Å; Y107-F173 HydrophobicContact CE2-CE2 4.22Å; Y107-F173 AromaticContact CE2-CG 3.57Å; Y107-F173 HydrophobicContact CE2-CG 3.57Å; Y107-F173 HydrophobicContact CE2-CZ 4.12Å; L113-F173 HydrophobicContact CB-CE2 3.83Å; L113-F173 HydrophobicContact CB-CZ 3.94Å; L113-F173 HydrophobicContact CD1-CZ 4.25Å; M147-F173 HydrophobicContact CE-CE1 3.66Å; M147-F173 HydrophobicContact CE-CZ 3.83Å; L151-F173 HydrophobicContact CD1-CD1 3.64Å; L151-F173 HydrophobicContact CD1-CE1 3.58Å; R169-F173 WeakPolarHBondContact O-CB 3.42Å; R169-F173 PolarHBondContact O-N 3.15Å; R169-F173 VanDerWaalsContact O-N 3.09Å; I170-F173 PolarHBondContact O-N 3.21Å; S171-F173 PolarHBondContact O-N 3.2Å; F173-E176 PolarHBondContact O-N 3.43Å; F173-L177 HydrophobicContact CD1-CD1 3.95Å; F173-L177 HydrophobicContact CE1-CD1 3.42Å; F173-L177 VanDerWaalsContact CE1-CD1 3.42Å; F173-L177 HydrophobicContact CE1-CG 4.14Å; F173-L177 HydrophobicContact CZ-CD1 3.89Å; F173-L177 HydrophobicContact CZ-CG 4.25Å; F173-L177 WeakPolarHBondContact O-CG 3.21Å; F173-L177 PolarHBondContact O-N 3.36Å
174I96.1Very high94.2Very high1 Ų154 Ų541%0.00528%0.275CS..Hα-helixtrans-71.2-33.6-178.9-68.7-78.9000111.5A148 L151 I170 S171 N172 L177 D178 L198 V202 I205A148-I174 HydrophobicContact CB-CD1 3.55Å; L151-I174 HydrophobicContact CB-CD1 4.26Å; L151-I174 HydrophobicContact CD1-CD1 4.14Å; I170-I174 HydrophobicContact CG2-CG1 4.05Å; I170-I174 WeakPolarHBondContact O-CB 3.28Å; I170-I174 WeakPolarHBondContact O-CG1 3.49Å; I170-I174 PolarHBondContact O-N 3.35Å; S171-I174 PolarHBondContact O-N 3.48Å; N172-I174 PolarHBondContact O-N 3.35Å; I174-L177 HydrophobicContact CD1-CD1 4.17Å; I174-L177 WeakPolarHBondContact O-CB 3.21Å; I174-L177 PolarHBondContact O-N 3.38Å; I174-D178 PolarHBondContact O-N 2.94Å; I174-L198 HydrophobicContact CG2-CD1 4.45Å; I174-V202 HydrophobicContact CG2-CB 4.48Å; I174-V202 HydrophobicContact CG2-CG2 3.65Å; I174-I205 HydrophobicContact CB-CD1 4.12Å; I174-I205 HydrophobicContact CD1-CD1 4.41Å; I174-I205 HydrophobicContact CG1-CD1 3.73Å; I174-I205 HydrophobicContact CG2-CD1 4.05Å
175N95Very high94.1Very high48 Ų4857.5 Ų57.526%0.25730%0.299SS..Hα-helixtrans-68.2-37.6173.2-83.4-61.6000112.6S171 N172 D178 S179S171-N175 WeakPolarHBondContact O-CB 3.33Å; S171-N175 PolarHBondContact O-N 2.92Å; S171-N175 PolarHBondContact O-ND2 2.97Å; N172-N175 PolarHBondContact O-N 3.39Å; N175-D178 PolarHBondContact O-N 3.33Å; N175-S179 WeakPolarHBondContact O-CB 3.42Å; N175-S179 PolarHBondContact O-N 2.87Å; N175-S179 PolarHBondContact O-OG 3.28Å
176E95.6Very high93.8Very high135 Ų13556 Ų5663%0.63129%0.287SS*.Hα-helixtrans-62.2-43.8171-73175-159.500111.1N172 F173 S179 G180N172-E176 WeakPolarHBondContact O-CG 3.43Å; N172-E176 PolarHBondContact O-N 3.21Å; F173-E176 PolarHBondContact O-N 3.43Å; E176-S179 PolarHBondContact O-N 3.04Å; E176-G180 PolarHBondContact O-N 3.02Å
177L95Very high93.4Very high16 Ų1663 Ų638%0.08432%0.317CS..Hα-helixtrans-59.6-50173.9-75.5178.5000112L113 V144 M147 F173 I174 S179 G180 F181L113-L177 HydrophobicContact CD1-CD2 4.11Å; L113-L177 HydrophobicContact CD2-CD2 3.72Å; L113-L177 HydrophobicContact CG-CD2 4.41Å; V144-L177 HydrophobicContact CG1-CD1 4.22Å; V144-L177 HydrophobicContact CG1-CD2 3.83Å; M147-L177 HydrophobicContact CE-CD1 4.15Å; F173-L177 HydrophobicContact CD1-CD1 3.95Å; F173-L177 HydrophobicContact CE1-CD1 3.42Å; F173-L177 VanDerWaalsContact CE1-CD1 3.42Å; F173-L177 HydrophobicContact CE1-CG 4.14Å; F173-L177 HydrophobicContact CZ-CD1 3.89Å; F173-L177 HydrophobicContact CZ-CG 4.25Å; F173-L177 WeakPolarHBondContact O-CG 3.21Å; F173-L177 PolarHBondContact O-N 3.36Å; I174-L177 HydrophobicContact CD1-CD1 4.17Å; I174-L177 WeakPolarHBondContact O-CB 3.21Å; I174-L177 PolarHBondContact O-N 3.38Å; L177-S179 VanDerWaalsContact C-N 3.27Å; L177-S179 PolarHBondContact O-N 3.31Å; L177-G180 WeakPolarHBondContact O-CA 3.5Å; L177-G180 PolarHBondContact O-N 3.26Å; L177-G180 VanDerWaalsContact O-N 3.08Å; L177-F181 WeakPolarHBondContact O-CD2 3.36Å; L177-F181 PolarHBondContact O-N 3.47Å
178D94.5Very high92.3Very high12 Ų1271 Ų716%0.06436%0.361CS..Hα-helixtrans-60.6-38.3179-173.629.9000111.9I174 N175 F181 R182 Y195 L198 V202I174-D178 PolarHBondContact O-N 2.94Å; N175-D178 PolarHBondContact O-N 3.33Å; D178-F181 PolarHBondContact O-N 3.25Å; D178-R182 VanDerWaalsContact CG-CZ 3.49Å; D178-R182 VanDerWaalsContact CG-NH1 3.28Å; D178-R182 VanDerWaalsContact CG-NH2 3.33Å; D178-R182 PolarHBondContact O-N 2.77Å; D178-R182 IonicContact OD1-CZ 3.38Å; D178-R182 IonicContact OD1-NH1 2.76Å; D178-R182 PolarHBondContact OD1-NH1 3.41Å; D178-R182 IonicContact OD1-NH2 2.64Å; D178-R182 IonicContact OD2-CZ 3.86Å; D178-R182 IonicContact OD2-NH1 3.73Å; D178-R182 PolarHBondContact OD2-NH1 3.14Å; D178-R182 IonicContact OD2-NH2 3.41Å; D178-R182 PolarHBondContact OD2-NH2 3.28Å; D178-Y195 WeakPolarHBondContact OD1-CE2 3.34Å; D178-Y195 PolarHBondContact OD1-OH 3.22Å; D178-L198 HydrophobicContact CB-CD2 3.84Å; D178-V202 HydrophobicContact CB-CG2 4.34Å
179S94.8Very high91.9Very high61 Ų6170.3 Ų70.343%0.42736%0.357SS..Hα-helixtrans-63.2-43172.7-58.50000111.9N175 E176 L177 R182 L183N175-S179 WeakPolarHBondContact O-CB 3.42Å; N175-S179 PolarHBondContact O-N 2.87Å; N175-S179 PolarHBondContact O-OG 3.28Å; E176-S179 PolarHBondContact O-N 3.04Å; L177-S179 VanDerWaalsContact C-N 3.27Å; L177-S179 PolarHBondContact O-N 3.31Å; S179-R182 PolarHBondContact O-N 3.48Å; S179-L183 PolarHBondContact O-N 2.8Å
180G94.7Very high91.5Very high34 Ų3469.6 Ų69.635%0.35136%0.364SS..Hα-helixtrans-61.5-45174.700000112.7E176 L177 R182 L183E176-G180 PolarHBondContact O-N 3.02Å; L177-G180 WeakPolarHBondContact O-CA 3.5Å; L177-G180 PolarHBondContact O-N 3.26Å; L177-G180 VanDerWaalsContact O-N 3.08Å; G180-R182 VanDerWaalsContact C-N 3.34Å; G180-R182 PolarHBondContact O-N 3.35Å; G180-L183 WeakPolarHBondContact O-CB 3.4Å; G180-L183 PolarHBondContact O-N 3Å
181F94.4Very high91.2Very high8 Ų870 Ų704%0.03537%0.366CS..Hα-helixtrans-67-31.9176.7-86.3-85.1000113L141 V144 L145 L177 D178 L183 L184 L186 Y195 L198L141-F181 HydrophobicContact CB-CE1 4.04Å; L141-F181 HydrophobicContact CB-CZ 4.17Å; L141-F181 HydrophobicContact CD2-CE1 3.95Å; L141-F181 HydrophobicContact CD2-CZ 3.88Å; L141-F181 HydrophobicContact CG-CE1 4.43Å; V144-F181 HydrophobicContact CG1-CE2 4.06Å; V144-F181 HydrophobicContact CG1-CZ 4.41Å; L145-F181 HydrophobicContact CD1-CE1 3.91Å; L145-F181 HydrophobicContact CD1-CZ 4.09Å; L145-F181 HydrophobicContact CD2-CD1 4.42Å; L145-F181 HydrophobicContact CD2-CD2 4.22Å; L145-F181 HydrophobicContact CD2-CE1 3.99Å; L145-F181 HydrophobicContact CD2-CE2 3.79Å; L145-F181 HydrophobicContact CD2-CZ 3.67Å; L145-F181 HydrophobicContact CG-CE1 3.9Å; L145-F181 HydrophobicContact CG-CE2 4.14Å; L145-F181 HydrophobicContact CG-CZ 3.56Å; L177-F181 WeakPolarHBondContact O-CD2 3.36Å; L177-F181 PolarHBondContact O-N 3.47Å; D178-F181 PolarHBondContact O-N 3.25Å; F181-L183 PolarHBondContact O-N 2.91Å; F181-L184 HydrophobicContact CD1-CD1 4.13Å; F181-L184 WeakPolarHBondContact O-CB 3.45Å; F181-L184 PolarHBondContact O-N 3.08Å; F181-L186 HydrophobicContact CD1-CD1 4.37Å; F181-Y195 HydrophobicContact CB-CD2 3.53Å; F181-Y195 HydrophobicContact CB-CE2 3.21Å; F181-Y195 HydrophobicContact CB-CG 4.47Å; F181-Y195 AromaticContact CD1-CD2 3.83Å; F181-Y195 HydrophobicContact CD1-CD2 3.83Å; F181-Y195 HydrophobicContact CD1-CE2 4.41Å; F181-Y195 HydrophobicContact CD1-CG 4.37Å; F181-Y195 AromaticContact CG-CD2 3.73Å; F181-Y195 HydrophobicContact CG-CD2 3.73Å; F181-Y195 AromaticContact CG-CE2 3.92Å; F181-Y195 HydrophobicContact CG-CE2 3.92Å; F181-L198 HydrophobicContact CD2-CD2 4.48Å
182R92.2Very high91Very high150 Ų15073 Ų7357%0.56638%0.375SS*.Hα-helixtrans-61.9-28.5173.3-88.2-168.5-91.1-85.33113.6D178 S179 G180 L184 Y195D178-R182 VanDerWaalsContact CG-CZ 3.49Å; D178-R182 VanDerWaalsContact CG-NH1 3.28Å; D178-R182 VanDerWaalsContact CG-NH2 3.33Å; D178-R182 PolarHBondContact O-N 2.77Å; D178-R182 IonicContact OD1-CZ 3.38Å; D178-R182 IonicContact OD1-NH1 2.76Å; D178-R182 PolarHBondContact OD1-NH1 3.41Å; D178-R182 IonicContact OD1-NH2 2.64Å; D178-R182 IonicContact OD2-CZ 3.86Å; D178-R182 IonicContact OD2-NH1 3.73Å; D178-R182 PolarHBondContact OD2-NH1 3.14Å; D178-R182 IonicContact OD2-NH2 3.41Å; D178-R182 PolarHBondContact OD2-NH2 3.28Å; S179-R182 PolarHBondContact O-N 3.48Å; G180-R182 VanDerWaalsContact C-N 3.34Å; G180-R182 PolarHBondContact O-N 3.35Å; R182-L184 PolarHBondContact O-N 3.09Å; R182-Y195 WeakPolarHBondContact CG-OH 3.33Å
183L93.4Very high90.8Very high151 Ų15176 Ų7679%0.79138%0.384SS*.THydrogen-bonded Turntrans-70-21175-61.4174.2000112.3S179 G180 F181S179-L183 PolarHBondContact O-N 2.8Å; G180-L183 WeakPolarHBondContact O-CB 3.4Å; G180-L183 PolarHBondContact O-N 3Å; F181-L183 PolarHBondContact O-N 2.91Å
184L91.8Very high90.6Very high74 Ų7480.6 Ų80.639%0.38740%0.4SS..SBendtrans-85.9123.5-178-53.3179.9000110.2L141 F181 R182 L186L141-L184 HydrophobicContact CD1-CD1 3.8Å; L141-L184 HydrophobicContact CD2-CD1 4.09Å; F181-L184 HydrophobicContact CD1-CD1 4.13Å; F181-L184 WeakPolarHBondContact O-CB 3.45Å; F181-L184 PolarHBondContact O-N 3.08Å; R182-L184 PolarHBondContact O-N 3.09Å; L184-L186 HydrophobicContact CB-CD2 4.07Å; L184-L186 HydrophobicContact CB-CG 4.16Å; L184-L186 PolarHBondContact O-N 3.03Å
185N88.3Confident90.5Very high161 Ų16181.6 Ų81.686%0.86140%0.404SS*.  trans-79.873.8171.8-170.217.3000110.5K187N185-K187 PolarHBondContact O-N 2.9Å
186L85.6Confident90.4Very high28 Ų2882.1 Ų82.115%0.14741%0.407CS..  trans-66.7126.9179.3-61.3-179.9000110.6F181 L184 L191 R192 Y195F181-L186 HydrophobicContact CD1-CD1 4.37Å; L184-L186 HydrophobicContact CB-CD2 4.07Å; L184-L186 HydrophobicContact CB-CG 4.16Å; L184-L186 PolarHBondContact O-N 3.03Å; L186-L191 HydrophobicContact CD2-CD2 3.82Å; L186-L191 HydrophobicContact CD2-CG 4.35Å; L186-R192 HydrophobicContact CB-CB 4.27Å; L186-Y195 HydrophobicContact CD1-CD1 4.06Å; L186-Y195 HydrophobicContact CD1-CG 3.99Å
187K82.8Confident90.3Very high170 Ų17076.9 Ų76.974%0.73939%0.389SS*.  trans-74170.2173.2-66.7-178.6-180175.70110N185 D189 R192N185-K187 PolarHBondContact O-N 2.9Å; K187-D189 PolarHBondContact O-N 2.82Å; K187-R192 WeakPolarHBondContact O-CB 3.28Å
188N71.6Confident90.2Very high170 Ų17076.2 Ų76.291%0.90939%0.386SS*.SBendtrans-71.868.5177.3-78.5-25.3000112.3
189D84.7Confident90.2Very high36 Ų3681.1 Ų81.119%0.19341%0.407CS..SBendtrans-117.7176.8-177.664.620.1000111.1K187 L191 R192 K193K187-D189 PolarHBondContact O-N 2.82Å; D189-L191 PolarHBondContact O-N 2.9Å; D189-L191 WeakPolarHBondContact OD1-CA 3.4Å; D189-L191 WeakPolarHBondContact OD1-CB 3.47Å; D189-L191 PolarHBondContact OD1-N 3.49Å; D189-R192 PolarHBondContact O-N 2.95Å; D189-R192 PolarHBondContact OD1-N 3.41Å; D189-K193 PolarHBondContact O-N 2.82Å
190P86.3Confident90.2Very high76 Ų7685.5 Ų85.549%0.49442%0.415SS..Hα-helixtrans-59.4-27.7176.3-25.936.4000114.1K193 R194P190-K193 PolarHBondContact O-N 2.83Å; P190-R194 PolarHBondContact O-N 3.09Å
191L90.9Very high90.3Very high8 Ų884.9 Ų84.94%0.04240%0.403CS..Hα-helixtrans-69.1-41.9178.5179.963.8000110.7L141 A142 L145 L186 D189 K193 R194 Y195L141-L191 HydrophobicContact CB-CD1 3.88Å; L141-L191 HydrophobicContact CB-CD2 3.96Å; L141-L191 HydrophobicContact CD1-CD2 3.85Å; A142-L191 HydrophobicContact CB-CD1 4.09Å; L145-L191 HydrophobicContact CD1-CD1 3.8Å; L186-L191 HydrophobicContact CD2-CD2 3.82Å; L186-L191 HydrophobicContact CD2-CG 4.35Å; D189-L191 PolarHBondContact O-N 2.9Å; D189-L191 WeakPolarHBondContact OD1-CA 3.4Å; D189-L191 WeakPolarHBondContact OD1-CB 3.47Å; D189-L191 PolarHBondContact OD1-N 3.49Å; L191-K193 VanDerWaalsContact C-N 3.34Å; L191-K193 PolarHBondContact O-N 2.92Å; L191-R194 WeakPolarHBondContact O-CB 3.45Å; L191-R194 PolarHBondContact O-N 3.3Å; L191-R194 VanDerWaalsContact O-N 3.14Å; L191-Y195 PolarHBondContact O-N 3.49Å
192R92.1Very high90.3Very high78 Ų7885 Ų8529%0.29441%0.405SS..Hα-helixtrans-58.4-43.7173.5177.767.1-156.9-179.45.8112.3L186 K187 D189 R194 Y195 D196L186-R192 HydrophobicContact CB-CB 4.27Å; K187-R192 WeakPolarHBondContact O-CB 3.28Å; D189-R192 PolarHBondContact O-N 2.95Å; D189-R192 PolarHBondContact OD1-N 3.41Å; R192-R194 VanDerWaalsContact C-N 3.29Å; R192-R194 PolarHBondContact O-N 3.36Å; R192-Y195 PolarHBondContact O-N 3.46Å; R192-Y195 VanDerWaalsContact O-N 3.16Å; R192-D196 IonicContact CZ-OD1 3.74Å; R192-D196 VanDerWaalsContact CZ-OD1 3.22Å; R192-D196 IonicContact NE-OD1 3.94Å; R192-D196 PolarHBondContact NE-OD1 3.04Å; R192-D196 VanDerWaalsContact NE-OD1 3.14Å; R192-D196 IonicContact NE-OD2 2.81Å; R192-D196 IonicContact NH2-OD1 3.96Å; R192-D196 PolarHBondContact NH2-OD1 3.5Å; R192-D196 PolarHBondContact O-N 3.38Å
193K91.1Very high90.5Very high166 Ų16683.6 Ų83.672%0.72240%0.403SS*.Hα-helixtrans-60.8-37.6176.1-69.9-176.8-179.9178.60112.5D189 P190 L191D189-K193 PolarHBondContact O-N 2.82Å; P190-K193 PolarHBondContact O-N 2.83Å; L191-K193 VanDerWaalsContact C-N 3.34Å; L191-K193 PolarHBondContact O-N 2.92Å
194R91.6Very high90.6Very high109 Ų10980.3 Ų80.341%0.41138%0.382SS..Hα-helixtrans-68.9-42.6174.2-70.8-178.2-179.4-85.34.7111.3L145 P190 L191 R192 D196 G197L145-R194 HydrophobicContact CD1-CB 3.77Å; P190-R194 PolarHBondContact O-N 3.09Å; L191-R194 WeakPolarHBondContact O-CB 3.45Å; L191-R194 PolarHBondContact O-N 3.3Å; L191-R194 VanDerWaalsContact O-N 3.14Å; R192-R194 VanDerWaalsContact C-N 3.29Å; R192-R194 PolarHBondContact O-N 3.36Å; R194-D196 VanDerWaalsContact C-N 3.31Å; R194-D196 PolarHBondContact O-N 2.77Å; R194-G197 WeakPolarHBondContact O-CA 3.22Å; R194-G197 PolarHBondContact O-N 2.93Å
195Y94.2Very high90.7Very high22 Ų2276.9 Ų76.99%0.08636%0.364CS..Hα-helixtrans-61.8-38.9177172.6-112.5000112L145 D178 F181 R182 L186 L191 R192 G197 L198L145-Y195 HydrophobicContact CD2-CD2 4.24Å; D178-Y195 WeakPolarHBondContact OD1-CE2 3.34Å; D178-Y195 PolarHBondContact OD1-OH 3.22Å; F181-Y195 HydrophobicContact CB-CD2 3.53Å; F181-Y195 HydrophobicContact CB-CE2 3.21Å; F181-Y195 HydrophobicContact CB-CG 4.47Å; F181-Y195 AromaticContact CD1-CD2 3.83Å; F181-Y195 HydrophobicContact CD1-CD2 3.83Å; F181-Y195 HydrophobicContact CD1-CE2 4.41Å; F181-Y195 HydrophobicContact CD1-CG 4.37Å; F181-Y195 AromaticContact CG-CD2 3.73Å; F181-Y195 HydrophobicContact CG-CD2 3.73Å; F181-Y195 AromaticContact CG-CE2 3.92Å; F181-Y195 HydrophobicContact CG-CE2 3.92Å; R182-Y195 WeakPolarHBondContact CG-OH 3.33Å; L186-Y195 HydrophobicContact CD1-CD1 4.06Å; L186-Y195 HydrophobicContact CD1-CG 3.99Å; L191-Y195 PolarHBondContact O-N 3.49Å; R192-Y195 PolarHBondContact O-N 3.46Å; R192-Y195 VanDerWaalsContact O-N 3.16Å; Y195-G197 PolarHBondContact O-N 3.12Å; Y195-L198 HydrophobicContact CD2-CB 4.28Å; Y195-L198 HydrophobicContact CD2-CD2 4.03Å; Y195-L198 HydrophobicContact CE2-CB 4.47Å; Y195-L198 HydrophobicContact CE2-CD2 3.78Å; Y195-L198 WeakPolarHBondContact O-CB 3.48Å; Y195-L198 PolarHBondContact O-N 3.48Å
196D92.6Very high91Very high59 Ų5973.5 Ų73.532%0.31634%0.343SS..Hα-helixtrans-59.9-19.9173.8-70.1-35.1000112.9R192 R194 K199R192-D196 IonicContact CZ-OD1 3.74Å; R192-D196 VanDerWaalsContact CZ-OD1 3.22Å; R192-D196 IonicContact NE-OD1 3.94Å; R192-D196 PolarHBondContact NE-OD1 3.04Å; R192-D196 VanDerWaalsContact NE-OD1 3.14Å; R192-D196 IonicContact NE-OD2 2.81Å; R192-D196 IonicContact NH2-OD1 3.96Å; R192-D196 PolarHBondContact NH2-OD1 3.5Å; R192-D196 PolarHBondContact O-N 3.38Å; R194-D196 VanDerWaalsContact C-N 3.31Å; R194-D196 PolarHBondContact O-N 2.77Å; D196-K199 WeakPolarHBondContact O-CD 3.48Å; D196-K199 WeakPolarHBondContact O-CE 3.35Å; D196-K199 WeakPolarHBondContact O-CG 3.38Å
197G93.2Very high91.5Very high25 Ų2577.1 Ų77.126%0.25836%0.36SS..Hα-helixtrans-74.6-28.417200000114.1R194 Y195 K199 Y200R194-G197 WeakPolarHBondContact O-CA 3.22Å; R194-G197 PolarHBondContact O-N 2.93Å; Y195-G197 PolarHBondContact O-N 3.12Å; G197-K199 PolarHBondContact O-N 3.35Å; G197-Y200 WeakPolarHBondContact O-CB 3.15Å; G197-Y200 WeakPolarHBondContact O-CD2 3.49Å; G197-Y200 PolarHBondContact O-N 3.41Å
198L94.6Very high92Very high3 Ų370.2 Ų70.22%0.01633%0.332CS..Hα-helixtrans-58.5-34.6-175.1-176.663.6000112.3L145 A148 I174 D178 F181 Y195 Y200 D201 V202L145-L198 HydrophobicContact CD2-CB 4.23Å; L145-L198 HydrophobicContact CD2-CD1 4.45Å; L145-L198 HydrophobicContact CD2-CD2 4.17Å; A148-L198 HydrophobicContact CB-CD1 3.47Å; A148-L198 VanDerWaalsContact CB-CD1 3.47Å; I174-L198 HydrophobicContact CG2-CD1 4.45Å; D178-L198 HydrophobicContact CB-CD2 3.84Å; F181-L198 HydrophobicContact CD2-CD2 4.48Å; Y195-L198 HydrophobicContact CD2-CB 4.28Å; Y195-L198 HydrophobicContact CD2-CD2 4.03Å; Y195-L198 HydrophobicContact CE2-CB 4.47Å; Y195-L198 HydrophobicContact CE2-CD2 3.78Å; Y195-L198 WeakPolarHBondContact O-CB 3.48Å; Y195-L198 PolarHBondContact O-N 3.48Å; L198-Y200 PolarHBondContact O-N 3.27Å; L198-Y200 VanDerWaalsContact O-N 3.16Å; L198-D201 WeakPolarHBondContact O-CB 3.27Å; L198-D201 PolarHBondContact O-N 3.43Å; L198-V202 HydrophobicContact CG-CG2 4.2Å; L198-V202 WeakPolarHBondContact O-CG2 3.38Å; L198-V202 PolarHBondContact O-N 2.89Å
199K93.2Very high93.1Very high114 Ų11463.3 Ų63.350%0.49630%0.295SS..Hα-helixtrans-57.5-30.3177.674.2-168.2178.3-175.40113.3D196 G197 K203D196-K199 WeakPolarHBondContact O-CD 3.48Å; D196-K199 WeakPolarHBondContact O-CE 3.35Å; D196-K199 WeakPolarHBondContact O-CG 3.38Å; G197-K199 PolarHBondContact O-N 3.35Å; K199-K203 WeakPolarHBondContact O-CB 3.49Å; K199-K203 PolarHBondContact O-N 2.71Å; K199-K203 VanDerWaalsContact O-N 3.09Å
200Y95.7Very high93.5Very high154 Ų15468.6 Ų68.660%0.60431%0.314SS*.Hα-helixtrans-75.5-36.4177.4-59.1-69.7000111.1G197 L198 K204G197-Y200 WeakPolarHBondContact O-CB 3.15Å; G197-Y200 WeakPolarHBondContact O-CD2 3.49Å; G197-Y200 PolarHBondContact O-N 3.41Å; L198-Y200 PolarHBondContact O-N 3.27Å; L198-Y200 VanDerWaalsContact O-N 3.16Å; Y200-K204 VanDerWaalsContact O-CB 3.28Å; Y200-K204 WeakPolarHBondContact O-CB 3.46Å; Y200-K204 PolarHBondContact O-N 3.09Å
201D95.1Very high93.9Very high20 Ų2068 Ų6811%0.10731%0.307CS..Hα-helixtrans-67.4-45.2174.4-71-48.5000111.3S149 S152 L198 K204 I205S149-D201 WeakPolarHBondContact CA-OD1 3.38Å; S149-D201 WeakPolarHBondContact CA-OD2 3.44Å; S149-D201 WeakPolarHBondContact CB-OD2 3.29Å; S149-D201 PolarHBondContact OG-OD2 3.12Å; S152-D201 WeakPolarHBondContact CB-OD1 3.28Å; S152-D201 PolarHBondContact OG-OD1 3.48Å; L198-D201 WeakPolarHBondContact O-CB 3.27Å; L198-D201 PolarHBondContact O-N 3.43Å; D201-K204 PolarHBondContact O-N 3Å; D201-I205 WeakPolarHBondContact O-CD1 3.37Å; D201-I205 VanDerWaalsContact O-CG1 3.32Å; D201-I205 WeakPolarHBondContact O-CG1 3.37Å; D201-I205 PolarHBondContact O-N 2.96Å
202V94.9Very high94Very high12 Ų1267.9 Ų67.97%0.07331%0.306CS..Hα-helixtrans-54-56.9173.8173.50000109.9I174 D178 L198 K204 I205 E206I174-V202 HydrophobicContact CG2-CB 4.48Å; I174-V202 HydrophobicContact CG2-CG2 3.65Å; D178-V202 HydrophobicContact CB-CG2 4.34Å; L198-V202 HydrophobicContact CG-CG2 4.2Å; L198-V202 WeakPolarHBondContact O-CG2 3.38Å; L198-V202 PolarHBondContact O-N 2.89Å; V202-K204 VanDerWaalsContact C-N 3.29Å; V202-K204 PolarHBondContact O-N 3.43Å; V202-I205 PolarHBondContact O-N 3.41Å; V202-I205 VanDerWaalsContact O-N 3.1Å; V202-E206 HydrophobicContact CG1-CG 4.33Å; V202-E206 WeakPolarHBondContact O-CG 3.49Å; V202-E206 PolarHBondContact O-N 2.88Å
203K96.1Very high93.9Very high119 Ų11967.1 Ų67.152%0.51731%0.312SS..Hα-helixtrans-56.1-43.9-179.5178.2175.8172.4177.70112.2K199 I205 E206 E207K199-K203 WeakPolarHBondContact O-CB 3.49Å; K199-K203 PolarHBondContact O-N 2.71Å; K199-K203 VanDerWaalsContact O-N 3.09Å; K203-I205 VanDerWaalsContact C-N 3.34Å; K203-I205 PolarHBondContact O-N 3.01Å; K203-E206 PolarHBondContact O-N 3.16Å; K203-E207 WeakPolarHBondContact CE-OE1 3.4Å; K203-E207 IonicContact NZ-OE1 2.82Å; K203-E207 WeakPolarHBondContact O-CG 3.28Å; K203-E207 PolarHBondContact O-N 2.7Å
204K95.9Very high94Very high83 Ų8363.7 Ų63.736%0.36130%0.301SS..Hα-helixtrans-62.6-40.2179.5-178.8-178.7173.3-167.50112Y200 D201 V202 V208Y200-K204 VanDerWaalsContact O-CB 3.28Å; Y200-K204 WeakPolarHBondContact O-CB 3.46Å; Y200-K204 PolarHBondContact O-N 3.09Å; D201-K204 PolarHBondContact O-N 3Å; V202-K204 VanDerWaalsContact C-N 3.29Å; V202-K204 PolarHBondContact O-N 3.43Å; K204-V208 WeakPolarHBondContact O-CG2 3.48Å; K204-V208 PolarHBondContact O-N 3.07Å
205I94.8Very high94Very high1 Ų165.6 Ų65.61%0.00531%0.308CS..Hα-helixtrans-70.7-41.1177.9-66158000110.6A155 I170 I174 D201 V202 K203 E207 V208 V209A155-I205 HydrophobicContact CB-CG1 4.3Å; I170-I205 HydrophobicContact CG2-CD1 3.79Å; I170-I205 HydrophobicContact CG2-CG1 4.27Å; I170-I205 HydrophobicContact CG2-CG2 4.25Å; I174-I205 HydrophobicContact CB-CD1 4.12Å; I174-I205 HydrophobicContact CD1-CD1 4.41Å; I174-I205 HydrophobicContact CG1-CD1 3.73Å; I174-I205 HydrophobicContact CG2-CD1 4.05Å; D201-I205 WeakPolarHBondContact O-CD1 3.37Å; D201-I205 VanDerWaalsContact O-CG1 3.32Å; D201-I205 WeakPolarHBondContact O-CG1 3.37Å; D201-I205 PolarHBondContact O-N 2.96Å; V202-I205 PolarHBondContact O-N 3.41Å; V202-I205 VanDerWaalsContact O-N 3.1Å; K203-I205 VanDerWaalsContact C-N 3.34Å; K203-I205 PolarHBondContact O-N 3.01Å; I205-E207 VanDerWaalsContact C-N 3.33Å; I205-E207 PolarHBondContact O-N 3.45Å; I205-V208 WeakPolarHBondContact O-CB 3.49Å; I205-V208 PolarHBondContact O-N 2.96Å; I205-V208 VanDerWaalsContact O-N 3.15Å; I205-V209 WeakPolarHBondContact O-CG2 3.34Å; I205-V209 PolarHBondContact O-N 3.43Å
206E94.2Very high93.7Very high91 Ų9166.9 Ų66.943%0.42533%0.328SS..Hα-helixtrans-60.2-42.1175.3-72.1177.4159.800111.9V202 K203 V208 V209 Y210V202-E206 HydrophobicContact CG1-CG 4.33Å; V202-E206 WeakPolarHBondContact O-CG 3.49Å; V202-E206 PolarHBondContact O-N 2.88Å; K203-E206 PolarHBondContact O-N 3.16Å; E206-V208 VanDerWaalsContact C-N 3.32Å; E206-V208 PolarHBondContact O-N 3Å; E206-V209 PolarHBondContact O-N 3.42Å; E206-Y210 VanDerWaalsContact O-CB 3.29Å; E206-Y210 WeakPolarHBondContact O-CB 3.44Å; E206-Y210 PolarHBondContact O-N 3.06Å
207E95.5Very high93.3Very high104 Ų10467.2 Ų67.249%0.48633%0.33SS..Hα-helixtrans-59.6-42173.9-76.3174.4-179.200111.4K203 I205 Y210 D211K203-E207 WeakPolarHBondContact CE-OE1 3.4Å; K203-E207 IonicContact NZ-OE1 2.82Å; K203-E207 WeakPolarHBondContact O-CG 3.28Å; K203-E207 PolarHBondContact O-N 2.7Å; I205-E207 VanDerWaalsContact C-N 3.33Å; I205-E207 PolarHBondContact O-N 3.45Å; E207-Y210 PolarHBondContact O-N 3.45Å; E207-D211 VanDerWaalsContact O-CB 3.3Å; E207-D211 WeakPolarHBondContact O-CB 3.47Å; E207-D211 PolarHBondContact O-N 3.23Å
208V94.5Very high92.2Very high25 Ų2567.5 Ų67.515%0.15233%0.33CS..Hα-helixtrans-62.6-45.5175.2173.50000111.3V156 V159 P167 K204 I205 E206 D211 L212V156-V208 HydrophobicContact CG2-CG2 3.79Å; V159-V208 HydrophobicContact CG2-CG1 3.64Å; P167-V208 HydrophobicContact CB-CG1 3.97Å; P167-V208 HydrophobicContact CG-CG1 4.32Å; K204-V208 WeakPolarHBondContact O-CG2 3.48Å; K204-V208 PolarHBondContact O-N 3.07Å; I205-V208 WeakPolarHBondContact O-CB 3.49Å; I205-V208 PolarHBondContact O-N 2.96Å; I205-V208 VanDerWaalsContact O-N 3.15Å; E206-V208 VanDerWaalsContact C-N 3.32Å; E206-V208 PolarHBondContact O-N 3Å; V208-D211 WeakPolarHBondContact O-CB 3.43Å; V208-D211 PolarHBondContact O-N 2.93Å; V208-L212 WeakPolarHBondContact O-CG 3.34Å; V208-L212 PolarHBondContact O-N 3.35Å; V208-L212 VanDerWaalsContact O-N 3.11Å
209V93.4Very high90.5Very high24 Ų2475.8 Ų75.815%0.14537%0.365CS..Hα-helixtrans-67.2-40179.5173.30000111.6P167 L168 I205 E206 D211 L212 S213P167-V209 HydrophobicContact CB-CG2 4.29Å; L168-V209 HydrophobicContact CG-CG1 4.25Å; I205-V209 WeakPolarHBondContact O-CG2 3.34Å; I205-V209 PolarHBondContact O-N 3.43Å; E206-V209 PolarHBondContact O-N 3.42Å; V209-D211 VanDerWaalsContact C-N 3.32Å; V209-D211 PolarHBondContact O-N 3.24Å; V209-L212 PolarHBondContact O-N 3.27Å; V209-S213 WeakPolarHBondContact O-CB 3.4Å; V209-S213 PolarHBondContact O-N 3.14Å; V209-S213 PolarHBondContact O-OG 2.88Å
210Y94.6Very high88.7Confident148 Ų14878.2 Ų78.258%0.5838%0.379SS*.Hα-helixtrans-57.2-48173.3174.1-98.1000110.8E206 E207 L212 S213 I214E206-Y210 VanDerWaalsContact O-CB 3.29Å; E206-Y210 WeakPolarHBondContact O-CB 3.44Å; E206-Y210 PolarHBondContact O-N 3.06Å; E207-Y210 PolarHBondContact O-N 3.45Å; Y210-L212 VanDerWaalsContact C-N 3.29Å; Y210-L212 PolarHBondContact O-N 3.44Å; Y210-S213 WeakPolarHBondContact O-CB 3.09Å; Y210-S213 PolarHBondContact O-N 3.41Å; Y210-I214 HydrophobicContact CD1-CD1 4.42Å; Y210-I214 HydrophobicContact CD1-CG2 4.36Å; Y210-I214 HydrophobicContact CD2-CG2 4.25Å; Y210-I214 HydrophobicContact CE1-CD1 4Å; Y210-I214 HydrophobicContact CE1-CG2 3.92Å; Y210-I214 HydrophobicContact CE2-CG2 3.78Å; Y210-I214 PolarHBondContact O-N 2.85Å
211D94.2Very high86.2Confident64 Ų6476.6 Ų76.634%0.34239%0.387SS..Hα-helixtrans-60.6-34.1178.7-105.433.3000113.7E207 V208 V209 I214 R215E207-D211 VanDerWaalsContact O-CB 3.3Å; E207-D211 WeakPolarHBondContact O-CB 3.47Å; E207-D211 PolarHBondContact O-N 3.23Å; V208-D211 WeakPolarHBondContact O-CB 3.43Å; V208-D211 PolarHBondContact O-N 2.93Å; V209-D211 VanDerWaalsContact C-N 3.32Å; V209-D211 PolarHBondContact O-N 3.24Å; D211-I214 WeakPolarHBondContact O-CG1 3.33Å; D211-R215 WeakPolarHBondContact O-CD 3.37Å; D211-R215 VanDerWaalsContact O-CG 3.3Å; D211-R215 WeakPolarHBondContact O-CG 3.26Å; D211-R215 PolarHBondContact O-NH1 3.23Å; D211-R215 IonicContact OD1-NH1 3.75Å; D211-R215 IonicContact OD2-CZ 3.71Å; D211-R215 IonicContact OD2-NH1 3.14Å; D211-R215 PolarHBondContact OD2-NH1 2.92Å; D211-R215 IonicContact OD2-NH2 3.69Å; D211-R215 PolarHBondContact OD2-NH2 3.05Å; D211-R215 VanDerWaalsContact OD2-NH2 3.15Å
212L92.8Very high83.5Confident4 Ų484.3 Ų84.32%0.02142%0.423CS..Hα-helixtrans-73-38.6173-67.4173.4000111.8V159 Y164 P167 V208 V209 Y210 R215 G216 L217 A218V159-L212 HydrophobicContact CG1-CD2 3.97Å; V159-L212 HydrophobicContact CG2-CD1 3.95Å; V159-L212 HydrophobicContact CG2-CD2 4.03Å; V159-L212 HydrophobicContact CG2-CG 4.28Å; Y164-L212 HydrophobicContact CD1-CD2 3.55Å; Y164-L212 HydrophobicContact CE1-CD2 4.24Å; Y164-L212 HydrophobicContact CG-CD2 4.1Å; P167-L212 HydrophobicContact CB-CD1 3.93Å; P167-L212 HydrophobicContact CG-CD1 3.97Å; V208-L212 WeakPolarHBondContact O-CG 3.34Å; V208-L212 PolarHBondContact O-N 3.35Å; V208-L212 VanDerWaalsContact O-N 3.11Å; V209-L212 PolarHBondContact O-N 3.27Å; Y210-L212 VanDerWaalsContact C-N 3.29Å; Y210-L212 PolarHBondContact O-N 3.44Å; L212-R215 PolarHBondContact O-N 3.37Å; L212-G216 PolarHBondContact O-N 2.99Å; L212-L217 HydrophobicContact CB-CB 4.47Å; L212-L217 HydrophobicContact CD2-CB 4.11Å; L212-L217 HydrophobicContact CD2-CD1 4.17Å; L212-L217 PolarHBondContact O-N 3.28Å; L212-A218 HydrophobicContact CB-CB 4.37Å; L212-A218 PolarHBondContact O-N 3.39Å
213S90.4Very high80.8Confident62 Ų6289.2 Ų89.243%0.43446%0.457SS..Hα-helixtrans-67.7-47.5-176.9-57.50000111.6V209 Y210 R215 G216V209-S213 WeakPolarHBondContact O-CB 3.4Å; V209-S213 PolarHBondContact O-N 3.14Å; V209-S213 PolarHBondContact O-OG 2.88Å; Y210-S213 WeakPolarHBondContact O-CB 3.09Å; Y210-S213 PolarHBondContact O-N 3.41Å; S213-R215 PolarHBondContact O-N 3.45Å; S213-G216 PolarHBondContact O-N 2.91Å
214I92.8Very high78Confident95 Ų9587 Ų8749%0.48747%0.468SS..Hα-helixtrans-64.2-24178.565.6177.1000113Y210 D211Y210-I214 HydrophobicContact CD1-CD1 4.42Å; Y210-I214 HydrophobicContact CD1-CG2 4.36Å; Y210-I214 HydrophobicContact CD2-CG2 4.25Å; Y210-I214 HydrophobicContact CE1-CD1 4Å; Y210-I214 HydrophobicContact CE1-CG2 3.92Å; Y210-I214 HydrophobicContact CE2-CG2 3.78Å; Y210-I214 PolarHBondContact O-N 2.85Å; D211-I214 WeakPolarHBondContact O-CG1 3.33Å
215R92Very high75.2Confident148 Ų14886.5 Ų86.556%0.55849%0.487SS*.THydrogen-bonded Turntrans-90.9-0.4177.7-65.3-178.9-174.5101.9-3.1112.9D211 L212 S213 L217D211-R215 WeakPolarHBondContact O-CD 3.37Å; D211-R215 VanDerWaalsContact O-CG 3.3Å; D211-R215 WeakPolarHBondContact O-CG 3.26Å; D211-R215 PolarHBondContact O-NH1 3.23Å; D211-R215 IonicContact OD1-NH1 3.75Å; D211-R215 IonicContact OD2-CZ 3.71Å; D211-R215 IonicContact OD2-NH1 3.14Å; D211-R215 PolarHBondContact OD2-NH1 2.92Å; D211-R215 IonicContact OD2-NH2 3.69Å; D211-R215 PolarHBondContact OD2-NH2 3.05Å; D211-R215 VanDerWaalsContact OD2-NH2 3.15Å; L212-R215 PolarHBondContact O-N 3.37Å; S213-R215 PolarHBondContact O-N 3.45Å; R215-L217 HydrophobicContact CB-CD1 4.02Å; R215-L217 HydrophobicContact CB-CG 4Å; R215-L217 PolarHBondContact O-N 3.06Å
216G87.4Confident72.5Confident50 Ų5094.6 Ų94.652%0.51553%0.53SS..THydrogen-bonded Turntrans66.921.2-177.600000114.1L212 S213L212-G216 PolarHBondContact O-N 2.99Å; S213-G216 PolarHBondContact O-N 2.91Å
217L83.6Confident69.7Low65 Ų65103.3 Ų103.334%0.3457%0.567SS.*  trans-90.4-19179.2-62.3175.5000112.2Y164 L212 R215 K219Y164-L217 HydrophobicContact CD2-CB 4.12Å; Y164-L217 HydrophobicContact CD2-CD2 4.35Å; Y164-L217 HydrophobicContact CE1-CD1 4.32Å; Y164-L217 HydrophobicContact CE2-CD1 4.32Å; Y164-L217 HydrophobicContact CE2-CD2 4.03Å; Y164-L217 HydrophobicContact CG-CB 4.24Å; L212-L217 HydrophobicContact CB-CB 4.47Å; L212-L217 HydrophobicContact CD2-CB 4.11Å; L212-L217 HydrophobicContact CD2-CD1 4.17Å; L212-L217 PolarHBondContact O-N 3.28Å; R215-L217 HydrophobicContact CB-CD1 4.02Å; R215-L217 HydrophobicContact CB-CG 4Å; R215-L217 PolarHBondContact O-N 3.06Å; L217-K219 VanDerWaalsContact C-N 3.3Å; L217-K219 PolarHBondContact O-N 3.06Å; L217-K219 VanDerWaalsContact O-N 3.08Å
218A70.6Confident68.4Low31 Ų31103.3 Ų103.326%0.25657%0.571SS.*  trans-78.878.1168.500000109.5L168 L212L168-A218 HydrophobicContact CD1-CB 4.39Å; L168-A218 HydrophobicContact CD2-CB 4.35Å; L212-A218 HydrophobicContact CB-CB 4.37Å; L212-A218 PolarHBondContact O-N 3.39Å
219K59.3Low67Low177 Ų177107.4 Ų107.477%0.7759%0.593SS**PPolyproline II helixtrans-88116.2165.7-71.3-169-179.5-169.30108.4L217L217-K219 VanDerWaalsContact C-N 3.3Å; L217-K219 PolarHBondContact O-N 3.06Å; L217-K219 VanDerWaalsContact O-N 3.08Å
220E54.9Low65.5Low165 Ų165112 Ų11277%0.77162%0.617SS**PPolyproline II helixtrans-58.8144.7156.4-74-174.8161.900108.2E222E220-E222 PolarHBondContact O-N 3.3Å
221P42.6Very low63.8Low121 Ų121109.9 Ų109.979%0.78662%0.62SS**PPolyproline II helixtrans-57.3116.1168.224.4-29.7000107S223P221-S223 PolarHBondContact O-N 3.2Å
222E38.2Very low61.9Low182 Ų182112.8 Ų112.885%0.8564%0.637SS**  trans-50.1107.9171.8-73.5178.8167.900107.6E220 G224E220-E222 PolarHBondContact O-N 3.3Å; E222-G224 VanDerWaalsContact C-N 3.28Å; E222-G224 PolarHBondContact O-N 3.42Å
223S38.4Very low59.8Low114 Ų114120 Ų12080%0.79768%0.678SS**  trans-60.3101.2162.1530000105.6P221 G225P221-S223 PolarHBondContact O-N 3.2Å; S223-G225 PolarHBondContact O-N 3.18Å
224G37.8Very low57.7Low73 Ų73124.1 Ų124.175%0.75370%0.696SS**  trans-48.1110.1177.400000109.3E222 D226E222-G224 VanDerWaalsContact C-N 3.28Å; E222-G224 PolarHBondContact O-N 3.42Å; G224-D226 PolarHBondContact O-N 3.27Å
225G36.5Very low55Low73 Ų73126.4 Ų126.475%0.75371%0.712SS**  trans-71.3109.3168.400000108S223S223-G225 PolarHBondContact O-N 3.18Å
226D38.7Very low51.9Low170 Ų170124.6 Ų124.691%0.90972%0.724SS**  trans-83.7112.3156.5-95.2-12.2000107.8G224G224-D226 PolarHBondContact O-N 3.27Å
227K34.6Very low48.6Very low274 Ų274131.4 Ų131.4100%1.19174%0.743SS**  trans-79.80156.5-84.2-176.7174.5177.90109.5

Retrieved 227 of 227 residues in 99.6 ms (Link to these results)

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