A0A060W5G0_ONCMY Loading...

Homeodomain-only protein

AlphaFold DB , UniProt , Accession A0A060W5G0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 75 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M38.5Very low67.2Low240 Ų24094 Ų94100%1.18253%0.534SS*.  0108.10-55.8-137.5-141.600106.7S3M1-S3 PolarHBondContact O-N 2.89Å; M1-S3 VanDerWaalsContact O-N 3.08Å
2A40.2Very low69.4Low87 Ų8790.7 Ų90.772%0.71953%0.526SS*.  trans-70.5103.4173.700000106.4N4A2-N4 PolarHBondContact O-N 3.34Å; A2-N4 VanDerWaalsContact O-N 3.1Å
3S47.7Very low71.2Confident114 Ų11497.2 Ų97.280%0.79755%0.549SS*.  trans-52.8117.5170.727.70000107.4M1 G5M1-S3 PolarHBondContact O-N 2.89Å; M1-S3 VanDerWaalsContact O-N 3.08Å; S3-G5 VanDerWaalsContact C-N 3.32Å; S3-G5 PolarHBondContact O-N 3.5Å
4N62.3Low72.9Confident71 Ų7198.2 Ų98.238%0.3855%0.552SS.*  trans-70.294.6-176.4-130.537.9000106A2 M6 E7 Q59A2-N4 PolarHBondContact O-N 3.34Å; A2-N4 VanDerWaalsContact O-N 3.1Å; N4-M6 PolarHBondContact O-N 3.49Å; N4-E7 HydrophobicContact CB-CG 3.93Å; N4-E7 WeakPolarHBondContact CB-OE2 2.92Å; N4-E7 WeakPolarHBondContact O-CB 3.4Å; N4-E7 PolarHBondContact O-N 3.4Å; N4-Q59 PolarHBondContact OD1-NE2 2.94Å
5G66.1Low74.4Confident24 Ų2494.6 Ų94.625%0.24753%0.529CS..THydrogen-bonded Turntrans-54.7-19.2-173.900000113.9S3 S8S3-G5 VanDerWaalsContact C-N 3.32Å; S3-G5 PolarHBondContact O-N 3.5Å; G5-S8 PolarHBondContact O-N 2.83Å; G5-S8 PolarHBondContact O-OG 2.82Å
6M72.6Confident75.7Confident32 Ų3293 Ų9316%0.15852%0.518CS..THydrogen-bonded Turntrans-67.7-33.7171.9-67.1174.5-158.900114.2N4 S8 M9 L55 R56 Q59N4-M6 PolarHBondContact O-N 3.49Å; M6-S8 PolarHBondContact O-N 3.35Å; M6-M9 PolarHBondContact O-N 3.17Å; M6-L55 HydrophobicContact CE-CB 4.08Å; M6-L55 HydrophobicContact CG-CB 4.14Å; M6-L55 HydrophobicContact CG-CD1 4.48Å; M6-R56 HydrophobicContact CE-CB 3.52Å; M6-R56 VanDerWaalsContact CE-CD 3.44Å; M6-R56 HydrophobicContact CE-CG 4.09Å; M6-R56 VanDerWaalsContact CE-N 3.25Å; M6-Q59 HydrophobicContact CE-CG 4.18Å
7E69.4Low76.9Confident148 Ų14895.6 Ų95.669%0.69252%0.523SS*.G310 helixtrans-61.7-25.9178.8-71.8175.4102.400111.4N4 M9N4-E7 HydrophobicContact CB-CG 3.93Å; N4-E7 WeakPolarHBondContact CB-OE2 2.92Å; N4-E7 WeakPolarHBondContact O-CB 3.4Å; N4-E7 PolarHBondContact O-N 3.4Å; E7-M9 VanDerWaalsContact C-N 3.27Å; E7-M9 PolarHBondContact O-N 3.03Å
8S77Confident78Confident82 Ų8292.4 Ų92.457%0.57351%0.505SS*.G310 helixtrans-74-12.9176.974.70000114.6G5 M6G5-S8 PolarHBondContact O-N 2.83Å; G5-S8 PolarHBondContact O-OG 2.82Å; M6-S8 PolarHBondContact O-N 3.35Å
9M86.2Confident78.9Confident22 Ų2287.6 Ų87.611%0.10848%0.478CS..G310 helixtrans-89.7-8.6-176.3-63.8-174.172.700113.6M6 E7 L11 E48 K51 W52 L55M6-M9 PolarHBondContact O-N 3.17Å; E7-M9 VanDerWaalsContact C-N 3.27Å; E7-M9 PolarHBondContact O-N 3.03Å; M9-L11 HydrophobicContact CB-CD1 4.22Å; M9-L11 HydrophobicContact CB-CD2 4.28Å; M9-L11 HydrophobicContact CB-CG 3.83Å; M9-L11 PolarHBondContact O-N 3.09Å; M9-E48 HydrophobicContact CE-CB 3.97Å; M9-E48 HydrophobicContact CE-CG 4.4Å; M9-E48 WeakPolarHBondContact CE-O 3.39Å; M9-K51 HydrophobicContact CE-CB 4.16Å; M9-K51 HydrophobicContact CE-CD 4.17Å; M9-K51 HydrophobicContact CE-CG 4.25Å; M9-K51 HydrophobicContact SD-CD 4.2Å; M9-K51 HydrophobicContact SD-CG 4.08Å; M9-W52 HydrophobicContact CE-CB 4.15Å; M9-W52 HydrophobicContact SD-CB 4.07Å; M9-L55 HydrophobicContact SD-CD1 4.07Å
10Q87.5Confident79.8Confident188 Ų18885.9 Ų85.988%0.87947%0.467SS*.  trans45.340.4177.3-56.2-168.3-68.900114.4
11L91.3Very high80.6Confident26 Ų2686.2 Ų86.214%0.13647%0.465CS..  trans-74.3145.1-177.5-59.9177.1000111.4M9 I16 L19 L44 W52M9-L11 HydrophobicContact CB-CD1 4.22Å; M9-L11 HydrophobicContact CB-CD2 4.28Å; M9-L11 HydrophobicContact CB-CG 3.83Å; M9-L11 PolarHBondContact O-N 3.09Å; L11-I16 HydrophobicContact CB-CD1 4.15Å; L11-I16 HydrophobicContact CB-CG1 3.74Å; L11-I16 HydrophobicContact CD1-CG1 4.41Å; L11-L19 HydrophobicContact CD1-CD1 3.74Å; L11-L44 HydrophobicContact CD1-CD1 4.5Å; L11-L44 HydrophobicContact CD2-CD1 3.89Å; L11-L44 HydrophobicContact CD2-CD2 3.68Å; L11-L44 HydrophobicContact CD2-CG 4.46Å; L11-W52 HydrophobicContact CD1-CG 4.25Å
12A93.9Very high83.3Confident54 Ų5475.8 Ų75.845%0.44642%0.415SS..  trans-71.2154.6172.600000111.3D14 Q15 I16A12-D14 VanDerWaalsContact C-N 3.26Å; A12-D14 PolarHBondContact O-N 2.99Å; A12-Q15 HydrophobicContact CB-CG 4.12Å; A12-Q15 WeakPolarHBondContact O-CB 3.43Å; A12-Q15 PolarHBondContact O-N 3.24Å; A12-Q15 VanDerWaalsContact O-N 3.09Å; A12-I16 WeakPolarHBondContact O-CG1 3.22Å; A12-I16 PolarHBondContact O-N 3.05Å
13E92.9Very high85.9Confident175 Ų17571.8 Ų71.882%0.81838%0.381SS*.Hα-helixtrans-57.6-38.6-177.4-172.1174.392.800112.6Q15 I16 K17E13-Q15 PolarHBondContact O-N 2.9Å; E13-I16 PolarHBondContact O-N 3.31Å; E13-K17 WeakPolarHBondContact O-CB 3.43Å; E13-K17 PolarHBondContact O-N 3.03Å
14D95.2Very high88.1Confident112 Ų11270.8 Ų70.860%0.59937%0.366SS*.Hα-helixtrans-65.1-40.6178.4-154.5-99.5000111.8A12 K17 I18A12-D14 VanDerWaalsContact C-N 3.26Å; A12-D14 PolarHBondContact O-N 2.99Å; D14-K17 WeakPolarHBondContact O-CB 3.35Å; D14-K17 PolarHBondContact O-N 3.36Å; D14-I18 WeakPolarHBondContact O-CG1 3.33Å; D14-I18 PolarHBondContact O-N 3.43Å
15Q95.6Very high89.7Confident44 Ų4476.5 Ų76.521%0.20638%0.383CS..Hα-helixtrans-64.6-45.2175.6-55.5-179.8-58.100110.9A12 E13 K17 I18 L19 S42 L44A12-Q15 HydrophobicContact CB-CG 4.12Å; A12-Q15 WeakPolarHBondContact O-CB 3.43Å; A12-Q15 PolarHBondContact O-N 3.24Å; A12-Q15 VanDerWaalsContact O-N 3.09Å; E13-Q15 PolarHBondContact O-N 2.9Å; Q15-K17 VanDerWaalsContact C-N 3.27Å; Q15-K17 PolarHBondContact O-N 3.09Å; Q15-I18 PolarHBondContact O-N 3.08Å; Q15-L19 WeakPolarHBondContact O-CB 3.43Å; Q15-L19 WeakPolarHBondContact O-CD1 3.5Å; Q15-L19 VanDerWaalsContact O-CG 3.22Å; Q15-L19 WeakPolarHBondContact O-CG 3.26Å; Q15-L19 PolarHBondContact O-N 3.39Å; Q15-S42 WeakPolarHBondContact CG-O 3.45Å; Q15-S42 PolarHBondContact NE2-O 2.89Å; Q15-S42 VanDerWaalsContact NE2-O 3.09Å; Q15-L44 HydrophobicContact CB-CD1 4.48Å
16I94.8Very high91Very high69 Ų6979.4 Ų79.435%0.35440%0.395SS..Hα-helixtrans-59.5-42.1176.5-65.8168.1000110.2L11 A12 E13 L19 E20L11-I16 HydrophobicContact CB-CD1 4.15Å; L11-I16 HydrophobicContact CB-CG1 3.74Å; L11-I16 HydrophobicContact CD1-CG1 4.41Å; A12-I16 WeakPolarHBondContact O-CG1 3.22Å; A12-I16 PolarHBondContact O-N 3.05Å; E13-I16 PolarHBondContact O-N 3.31Å; I16-L19 PolarHBondContact O-N 3.27Å; I16-E20 HydrophobicContact CG2-CG 4.16Å; I16-E20 WeakPolarHBondContact O-CB 3.46Å; I16-E20 WeakPolarHBondContact O-CG 3.46Å; I16-E20 PolarHBondContact O-N 2.98Å
17K95.9Very high91.9Very high138 Ų13880 Ų8060%0.640%0.403SS*.Hα-helixtrans-62.5-45.4179.2-172.3-177.9177.8-170.70111.8E13 D14 Q15 E21E13-K17 WeakPolarHBondContact O-CB 3.43Å; E13-K17 PolarHBondContact O-N 3.03Å; D14-K17 WeakPolarHBondContact O-CB 3.35Å; D14-K17 PolarHBondContact O-N 3.36Å; Q15-K17 VanDerWaalsContact C-N 3.27Å; Q15-K17 PolarHBondContact O-N 3.09Å; K17-E21 VanDerWaalsContact O-CB 3.26Å; K17-E21 WeakPolarHBondContact O-CB 3.37Å; K17-E21 PolarHBondContact O-N 2.99Å
18I96.3Very high93Very high38 Ų3874.9 Ų74.920%0.19538%0.378CS..Hα-helixtrans-61.6-45.4176.7-66.4164.1000110.6D14 Q15 E21 N22 E41D14-I18 WeakPolarHBondContact O-CG1 3.33Å; D14-I18 PolarHBondContact O-N 3.43Å; Q15-I18 PolarHBondContact O-N 3.08Å; I18-E21 PolarHBondContact O-N 2.65Å; I18-N22 WeakPolarHBondContact O-CB 3.4Å; I18-N22 PolarHBondContact O-N 3.44Å; I18-N22 PolarHBondContact O-ND2 3.1Å; I18-E41 HydrophobicContact CG2-CB 4.14Å
19L96.1Very high93.7Very high0 Ų076.2 Ų76.20%038%0.375CS..Hα-helixtrans-64.1-48179.1-69.5167000112.2L11 Q15 I16 E21 N22 F23 I38 L44 T49 W52 F53L11-L19 HydrophobicContact CD1-CD1 3.74Å; Q15-L19 WeakPolarHBondContact O-CB 3.43Å; Q15-L19 WeakPolarHBondContact O-CD1 3.5Å; Q15-L19 VanDerWaalsContact O-CG 3.22Å; Q15-L19 WeakPolarHBondContact O-CG 3.26Å; Q15-L19 PolarHBondContact O-N 3.39Å; I16-L19 PolarHBondContact O-N 3.27Å; L19-E21 PolarHBondContact O-N 2.99Å; L19-N22 PolarHBondContact O-N 3.03Å; L19-F23 VanDerWaalsContact O-CB 3.23Å; L19-F23 WeakPolarHBondContact O-CB 3.35Å; L19-F23 PolarHBondContact O-N 2.84Å; L19-I38 HydrophobicContact CD2-CG2 3.86Å; L19-L44 HydrophobicContact CD1-CD1 3.74Å; L19-L44 HydrophobicContact CD2-CD1 4.46Å; L19-L44 HydrophobicContact CG-CD1 4.43Å; L19-T49 HydrophobicContact CD2-CG2 3.86Å; L19-W52 HydrophobicContact CB-CD2 3.88Å; L19-W52 HydrophobicContact CB-CE3 3.79Å; L19-W52 HydrophobicContact CB-CH2 3.82Å; L19-W52 HydrophobicContact CB-CZ2 3.89Å; L19-W52 HydrophobicContact CB-CZ3 3.78Å; L19-W52 HydrophobicContact CD1-CB 4.29Å; L19-W52 HydrophobicContact CD1-CD2 3.82Å; L19-W52 HydrophobicContact CD1-CE3 4.4Å; L19-W52 HydrophobicContact CD1-CG 3.73Å; L19-W52 HydrophobicContact CD2-CD2 4.44Å; L19-W52 HydrophobicContact CD2-CE3 4.25Å; L19-W52 HydrophobicContact CG-CD2 4.28Å; L19-W52 HydrophobicContact CG-CE3 4.39Å; L19-F53 HydrophobicContact CD2-CD2 4.36Å; L19-F53 HydrophobicContact CD2-CE2 3.89Å
20E96Very high94Very high53 Ų5376.4 Ų76.425%0.24838%0.378CS..Hα-helixtrans-61.4-42176.2-81.2-80.279.700111.7I16 F23 N24 W52 R56I16-E20 HydrophobicContact CG2-CG 4.16Å; I16-E20 WeakPolarHBondContact O-CB 3.46Å; I16-E20 WeakPolarHBondContact O-CG 3.46Å; I16-E20 PolarHBondContact O-N 2.98Å; E20-F23 PolarHBondContact O-N 2.89Å; E20-N24 WeakPolarHBondContact O-CB 3.34Å; E20-N24 PolarHBondContact O-N 2.86Å; E20-N24 PolarHBondContact O-ND2 2.86Å; E20-W52 HydrophobicContact CG-CH2 4.04Å; E20-W52 HydrophobicContact CG-CZ2 3.95Å; E20-W52 WeakPolarHBondContact OE1-CH2 3.49Å; E20-R56 IonicContact OE1-CZ 3.4Å; E20-R56 IonicContact OE1-NE 2.69Å; E20-R56 PolarHBondContact OE1-NE 3.3Å; E20-R56 IonicContact OE1-NH2 3.24Å; E20-R56 PolarHBondContact OE1-NH2 3.1Å; E20-R56 IonicContact OE2-CZ 3.76Å; E20-R56 IonicContact OE2-NE 3.78Å; E20-R56 IonicContact OE2-NH2 2.99Å; E20-R56 PolarHBondContact OE2-NH2 3.45Å
21E96.4Very high94.3Very high93 Ų9371.6 Ų71.644%0.43536%0.359SS..Hα-helixtrans-62.9-48.9179-174.3170.4139.700110.8K17 I18 L19 F23 N24 R25K17-E21 VanDerWaalsContact O-CB 3.26Å; K17-E21 WeakPolarHBondContact O-CB 3.37Å; K17-E21 PolarHBondContact O-N 2.99Å; I18-E21 PolarHBondContact O-N 2.65Å; L19-E21 PolarHBondContact O-N 2.99Å; E21-F23 PolarHBondContact O-N 3.24Å; E21-N24 PolarHBondContact O-N 2.69Å; E21-R25 VanDerWaalsContact CG-CD 3.42Å; E21-R25 HydrophobicContact CG-CG 4.24Å; E21-R25 VanDerWaalsContact O-CB 3.31Å; E21-R25 WeakPolarHBondContact O-CB 3.24Å; E21-R25 WeakPolarHBondContact O-CG 3.31Å; E21-R25 PolarHBondContact O-N 2.87Å; E21-R25 IonicContact OE1-CZ 3.84Å; E21-R25 IonicContact OE1-NH1 2.79Å; E21-R25 PolarHBondContact OE1-NH1 3.46Å
22N96.2Very high94.4Very high22 Ų2277.9 Ų77.912%0.11839%0.387CS..Hα-helixtrans-63.7-41.5177.4-82.8-74.8000112.3I18 L19 N24 V26 S27 I38 F53I18-N22 WeakPolarHBondContact O-CB 3.4Å; I18-N22 PolarHBondContact O-N 3.44Å; I18-N22 PolarHBondContact O-ND2 3.1Å; L19-N22 PolarHBondContact O-N 3.03Å; N22-N24 VanDerWaalsContact C-N 3.28Å; N22-N24 PolarHBondContact O-N 3.49Å; N22-V26 HydrophobicContact CB-CG2 4.5Å; N22-V26 WeakPolarHBondContact O-CA 3.45Å; N22-V26 VanDerWaalsContact O-CB 3.28Å; N22-V26 WeakPolarHBondContact O-CB 3.14Å; N22-V26 PolarHBondContact O-N 2.98Å; N22-V26 WeakPolarHBondContact OD1-CG2 3.45Å; N22-S27 PolarHBondContact O-N 3.24Å; N22-I38 HydrophobicContact CB-CD1 3.74Å; N22-I38 HydrophobicContact CB-CG1 3.96Å; N22-I38 HydrophobicContact CB-CG2 4.31Å; N22-F53 HydrophobicContact CB-CZ 4.23Å
23F95.6Very high94.5Very high2 Ų279.2 Ų79.21%0.00939%0.393CS..Hα-helixtrans-60-38.9175.8-175.8-100.5000112.3L19 E20 E21 K28 W52 F53 R56 N57 W60L19-F23 VanDerWaalsContact O-CB 3.23Å; L19-F23 WeakPolarHBondContact O-CB 3.35Å; L19-F23 PolarHBondContact O-N 2.84Å; E20-F23 PolarHBondContact O-N 2.89Å; E21-F23 PolarHBondContact O-N 3.24Å; F23-K28 HydrophobicContact CD1-CD 3.66Å; F23-K28 HydrophobicContact CD2-CD 3.99Å; F23-K28 HydrophobicContact CE1-CD 3.18Å; F23-K28 VanDerWaalsContact CE1-NZ 3.34Å; F23-K28 HydrophobicContact CE2-CB 4.08Å; F23-K28 HydrophobicContact CE2-CD 3.57Å; F23-K28 HydrophobicContact CE2-CG 4.45Å; F23-K28 HydrophobicContact CG-CD 4.04Å; F23-K28 HydrophobicContact CZ-CB 4.32Å; F23-K28 HydrophobicContact CZ-CD 3.14Å; F23-K28 HydrophobicContact CZ-CG 4.3Å; F23-K28 WeakPolarHBondContact O-CD 3.39Å; F23-K28 PolarHBondContact O-NZ 2.87Å; F23-W52 HydrophobicContact CB-CH2 4.18Å; F23-W52 HydrophobicContact CB-CZ3 3.91Å; F23-W52 HydrophobicContact CD2-CZ3 4.22Å; F23-W52 HydrophobicContact CG-CH2 4.47Å; F23-W52 HydrophobicContact CG-CZ3 4.18Å; F23-F53 HydrophobicContact CB-CE1 3.98Å; F23-F53 HydrophobicContact CB-CZ 4.24Å; F23-F53 AromaticContact CD2-CD1 3.68Å; F23-F53 HydrophobicContact CD2-CD1 3.68Å; F23-F53 AromaticContact CD2-CE1 3.74Å; F23-F53 HydrophobicContact CD2-CE1 3.74Å; F23-F53 HydrophobicContact CE2-CD1 4.4Å; F23-F53 HydrophobicContact CG-CE1 4.37Å; F23-R56 HydrophobicContact CD1-CG 3.74Å; F23-R56 HydrophobicContact CD2-CB 4.32Å; F23-R56 HydrophobicContact CD2-CG 4.02Å; F23-R56 HydrophobicContact CE1-CG 3.53Å; F23-R56 HydrophobicContact CE2-CB 4.02Å; F23-R56 HydrophobicContact CE2-CG 3.83Å; F23-R56 HydrophobicContact CG-CG 3.98Å; F23-R56 HydrophobicContact CZ-CB 4.14Å; F23-R56 HydrophobicContact CZ-CG 3.57Å; F23-N57 HydrophobicContact CE2-CB 4.12Å; F23-N57 HydrophobicContact CZ-CB 4.38Å; F23-W60 HydrophobicContact CE1-CB 4.18Å; F23-W60 HydrophobicContact CE1-CG 4.36Å; F23-W60 HydrophobicContact CZ-CB 4.01Å; F23-W60 HydrophobicContact CZ-CG 4.38Å
24N93.8Very high94.6Very high93 Ų9372.4 Ų72.450%0.49736%0.363SS..Hα-helixtrans-83.5-33.7-177.7-70.6-45.3000114.3E20 E21 N22 K28E20-N24 WeakPolarHBondContact O-CB 3.34Å; E20-N24 PolarHBondContact O-N 2.86Å; E20-N24 PolarHBondContact O-ND2 2.86Å; E21-N24 PolarHBondContact O-N 2.69Å; N22-N24 VanDerWaalsContact C-N 3.28Å; N22-N24 PolarHBondContact O-N 3.49Å; N24-K28 PolarHBondContact OD1-NZ 3.49Å
25R94.4Very high94.7Very high191 Ų19168 Ų6872%0.72134%0.34SS*.Hα-helixtrans-103.6-30.4-171.8-59.8178.672.4-179.23.5114E21E21-R25 VanDerWaalsContact CG-CD 3.42Å; E21-R25 HydrophobicContact CG-CG 4.24Å; E21-R25 VanDerWaalsContact O-CB 3.31Å; E21-R25 WeakPolarHBondContact O-CB 3.24Å; E21-R25 WeakPolarHBondContact O-CG 3.31Å; E21-R25 PolarHBondContact O-N 2.87Å; E21-R25 IonicContact OE1-CZ 3.84Å; E21-R25 IonicContact OE1-NH1 2.79Å; E21-R25 PolarHBondContact OE1-NH1 3.46Å
26V93.3Very high94.7Very high85 Ų8571.3 Ų71.352%0.51536%0.357SS..THydrogen-bonded Turntrans-99.2-68.7-174.5-176.60000110.4N22 T34N22-V26 HydrophobicContact CB-CG2 4.5Å; N22-V26 WeakPolarHBondContact O-CA 3.45Å; N22-V26 VanDerWaalsContact O-CB 3.28Å; N22-V26 WeakPolarHBondContact O-CB 3.14Å; N22-V26 PolarHBondContact O-N 2.98Å; N22-V26 WeakPolarHBondContact OD1-CG2 3.45Å; V26-T34 HydrophobicContact CG1-CG2 3.87Å
27S91.9Very high94.9Very high44 Ų4473.4 Ų73.431%0.30837%0.368SS..  trans-164.6145.6-179.6-177.40000111.8N22 H29 F53N22-S27 PolarHBondContact O-N 3.24Å; S27-H29 PolarHBondContact O-N 2.89Å; S27-H29 PolarHBondContact OG-N 2.74Å; S27-H29 PolarHBondContact OG-O 3.45Å; S27-F53 WeakPolarHBondContact O-CE1 3.38Å
28K92Very high94.9Very high42 Ų4267 Ų6718%0.18334%0.34CS..SBendtrans-74.1-15.8167.6-54.2-70.1179-1320112.3F23 N24 W60F23-K28 HydrophobicContact CD1-CD 3.66Å; F23-K28 HydrophobicContact CD2-CD 3.99Å; F23-K28 HydrophobicContact CE1-CD 3.18Å; F23-K28 VanDerWaalsContact CE1-NZ 3.34Å; F23-K28 HydrophobicContact CE2-CB 4.08Å; F23-K28 HydrophobicContact CE2-CD 3.57Å; F23-K28 HydrophobicContact CE2-CG 4.45Å; F23-K28 HydrophobicContact CG-CD 4.04Å; F23-K28 HydrophobicContact CZ-CB 4.32Å; F23-K28 HydrophobicContact CZ-CD 3.14Å; F23-K28 HydrophobicContact CZ-CG 4.3Å; F23-K28 WeakPolarHBondContact O-CD 3.39Å; F23-K28 PolarHBondContact O-NZ 2.87Å; N24-K28 PolarHBondContact OD1-NZ 3.49Å; K28-W60 HydrophobicContact CD-CD2 4.39Å
29H91.4Very high94.9Very high109 Ų10965.3 Ų65.351%0.50533%0.332SS..SBendtrans-136.671.4-176-70.3-81000109.2S27 N57 R61S27-H29 PolarHBondContact O-N 2.89Å; S27-H29 PolarHBondContact OG-N 2.74Å; S27-H29 PolarHBondContact OG-O 3.45Å; H29-N57 PolarHBondContact CE1-ND2 3.2Å; H29-N57 PolarHBondContact NE2-ND2 3.49Å; H29-N57 VanDerWaalsContact NE2-ND2 3.11Å; H29-R61 PolarHBondContact CE1-NH2 3Å; H29-R61 PolarHBondContact NE2-NH2 2.74Å
30P92.5Very high94.9Very high26 Ų2669 Ų6917%0.16936%0.363CS..  trans-62.6139.3175.427.9-35000110T34 L35 I38 F53P30-T34 HydrophobicContact CB-CG2 3.7Å; P30-L35 HydrophobicContact CG-CD1 3.95Å; P30-I38 HydrophobicContact CB-CD1 4.39Å; P30-F53 HydrophobicContact CG-CD1 3.53Å; P30-F53 HydrophobicContact CG-CD2 4.43Å; P30-F53 HydrophobicContact CG-CE1 3.64Å; P30-F53 HydrophobicContact CG-CG 3.96Å; P30-F53 HydrophobicContact CG-CZ 4.16Å
31D94.8Very high94.9Very high88 Ų8872.3 Ų72.347%0.47138%0.378SS..  trans-70.9170.9165.163.4-83.7000110.7S33 T34 L35D31-S33 VanDerWaalsContact C-N 3.26Å; D31-S33 PolarHBondContact O-N 3.32Å; D31-S33 WeakPolarHBondContact OD2-CA 3.35Å; D31-S33 VanDerWaalsContact OD2-CB 3.29Å; D31-S33 WeakPolarHBondContact OD2-CB 3.47Å; D31-S33 PolarHBondContact OD2-N 3.13Å; D31-T34 PolarHBondContact O-N 2.76Å; D31-T34 WeakPolarHBondContact OD1-CB 3.41Å; D31-T34 PolarHBondContact OD1-OG1 2.9Å; D31-T34 PolarHBondContact OD2-N 2.94Å; D31-T34 VanDerWaalsContact OD2-N 3.15Å; D31-L35 WeakPolarHBondContact O-CB 3.31Å; D31-L35 PolarHBondContact O-N 3.45Å
32E94.2Very high94.8Very high158 Ų15868.2 Ų68.274%0.73836%0.36SS*.Hα-helixtrans-55.2-39.6-177.3-171.5173.291.900113L35 M36E32-L35 PolarHBondContact O-N 3.33Å; E32-M36 WeakPolarHBondContact O-CB 3.49Å; E32-M36 PolarHBondContact O-N 3.18Å
33S95.8Very high94.8Very high82 Ų8270.2 Ų70.257%0.57339%0.386SS*.Hα-helixtrans-70.5-44.5-177.5-46.30000110.7D31 L35 M36 L37D31-S33 VanDerWaalsContact C-N 3.26Å; D31-S33 PolarHBondContact O-N 3.32Å; D31-S33 WeakPolarHBondContact OD2-CA 3.35Å; D31-S33 VanDerWaalsContact OD2-CB 3.29Å; D31-S33 WeakPolarHBondContact OD2-CB 3.47Å; D31-S33 PolarHBondContact OD2-N 3.13Å; S33-L35 VanDerWaalsContact C-N 3.32Å; S33-L35 PolarHBondContact O-N 2.91Å; S33-M36 PolarHBondContact O-N 3.07Å; S33-L37 WeakPolarHBondContact O-CG 3.41Å; S33-L37 PolarHBondContact O-N 3.23Å
34T95.1Very high94.8Very high31 Ų3171.1 Ų71.119%0.1939%0.391CS..Hα-helixtrans-62.2-41.9175.3-59.50000111V26 P30 D31 M36 L37 I38V26-T34 HydrophobicContact CG1-CG2 3.87Å; P30-T34 HydrophobicContact CB-CG2 3.7Å; D31-T34 PolarHBondContact O-N 2.76Å; D31-T34 WeakPolarHBondContact OD1-CB 3.41Å; D31-T34 PolarHBondContact OD1-OG1 2.9Å; D31-T34 PolarHBondContact OD2-N 2.94Å; D31-T34 VanDerWaalsContact OD2-N 3.15Å; T34-M36 PolarHBondContact O-N 2.79Å; T34-L37 PolarHBondContact O-N 3.31Å; T34-I38 HydrophobicContact CG2-CD1 3.83Å; T34-I38 WeakPolarHBondContact O-CD1 3.43Å; T34-I38 VanDerWaalsContact O-CG1 3.25Å; T34-I38 WeakPolarHBondContact O-CG1 3.28Å; T34-I38 PolarHBondContact O-N 3.32Å; T34-I38 VanDerWaalsContact O-N 3.1Å
35L96.6Very high94.9Very high21 Ų2170.3 Ų70.311%0.1139%0.389CS..Hα-helixtrans-62.5-43178.5-168.7107.2000112P30 D31 E32 S33 L37 I38 A39 E46 T49 A50P30-L35 HydrophobicContact CG-CD1 3.95Å; D31-L35 WeakPolarHBondContact O-CB 3.31Å; D31-L35 PolarHBondContact O-N 3.45Å; E32-L35 PolarHBondContact O-N 3.33Å; S33-L35 VanDerWaalsContact C-N 3.32Å; S33-L35 PolarHBondContact O-N 2.91Å; L35-L37 VanDerWaalsContact C-N 3.33Å; L35-L37 PolarHBondContact O-N 2.94Å; L35-I38 PolarHBondContact O-N 3.45Å; L35-A39 WeakPolarHBondContact O-CB 3.23Å; L35-A39 PolarHBondContact O-N 3.14Å; L35-E46 HydrophobicContact CD2-CB 3.94Å; L35-E46 HydrophobicContact CD2-CG 4.46Å; L35-E46 WeakPolarHBondContact CD2-O 3.43Å; L35-T49 HydrophobicContact CD1-CG2 4.02Å; L35-T49 HydrophobicContact CG-CG2 4.03Å; L35-A50 HydrophobicContact CD1-CB 3.99Å; L35-A50 HydrophobicContact CD2-CB 4.04Å
36M96.6Very high94.9Very high113 Ų11365.6 Ų65.656%0.55738%0.375SS*.Hα-helixtrans-59.3-42.6176.5-174.2-170.2-177.400111.9E32 S33 T34 A39 A40E32-M36 WeakPolarHBondContact O-CB 3.49Å; E32-M36 PolarHBondContact O-N 3.18Å; S33-M36 PolarHBondContact O-N 3.07Å; T34-M36 PolarHBondContact O-N 2.79Å; M36-A39 PolarHBondContact O-N 2.97Å; M36-A40 PolarHBondContact O-N 3.26Å
37L97.1Very high95Very high113 Ų11369.3 Ų69.359%0.59239%0.387SS*.Hα-helixtrans-62.8-47.8176.8-67.9171.4000111.3S33 T34 L35 A39 A40 E41S33-L37 WeakPolarHBondContact O-CG 3.41Å; S33-L37 PolarHBondContact O-N 3.23Å; T34-L37 PolarHBondContact O-N 3.31Å; L35-L37 VanDerWaalsContact C-N 3.33Å; L35-L37 PolarHBondContact O-N 2.94Å; L37-A39 VanDerWaalsContact C-N 3.32Å; L37-A39 PolarHBondContact O-N 3.4Å; L37-A40 WeakPolarHBondContact O-CB 3.34Å; L37-A40 PolarHBondContact O-N 3.47Å; L37-E41 WeakPolarHBondContact O-CG 3.33Å; L37-E41 PolarHBondContact O-N 3.29Å
38I96.8Very high95.1Very high2 Ų270.6 Ų70.61%0.0139%0.388CS..Hα-helixtrans-63.4-39.9-179.8-61.4162.9000111.3L19 N22 P30 T34 L35 A40 E41 S42 T49 F53L19-I38 HydrophobicContact CD2-CG2 3.86Å; N22-I38 HydrophobicContact CB-CD1 3.74Å; N22-I38 HydrophobicContact CB-CG1 3.96Å; N22-I38 HydrophobicContact CB-CG2 4.31Å; P30-I38 HydrophobicContact CB-CD1 4.39Å; T34-I38 HydrophobicContact CG2-CD1 3.83Å; T34-I38 WeakPolarHBondContact O-CD1 3.43Å; T34-I38 VanDerWaalsContact O-CG1 3.25Å; T34-I38 WeakPolarHBondContact O-CG1 3.28Å; T34-I38 PolarHBondContact O-N 3.32Å; T34-I38 VanDerWaalsContact O-N 3.1Å; L35-I38 PolarHBondContact O-N 3.45Å; I38-A40 VanDerWaalsContact C-N 3.34Å; I38-E41 PolarHBondContact O-N 3.1Å; I38-S42 WeakPolarHBondContact O-CB 3.41Å; I38-S42 PolarHBondContact O-N 3.39Å; I38-S42 PolarHBondContact O-OG 3.45Å; I38-T49 HydrophobicContact CB-CG2 4.25Å; I38-T49 HydrophobicContact CG2-CG2 3.95Å; I38-F53 HydrophobicContact CD1-CE2 4.15Å; I38-F53 HydrophobicContact CD1-CZ 3.81Å; I38-F53 HydrophobicContact CG2-CE2 4.2Å
39A96.4Very high95.3Very high3 Ų368.6 Ų68.63%0.02538%0.38CS..Hα-helixtrans-59.9-46.2175.900000110.7L35 M36 L37 S42 G43 L44 E46 T49L35-A39 WeakPolarHBondContact O-CB 3.23Å; L35-A39 PolarHBondContact O-N 3.14Å; M36-A39 PolarHBondContact O-N 2.97Å; L37-A39 VanDerWaalsContact C-N 3.32Å; L37-A39 PolarHBondContact O-N 3.4Å; A39-S42 PolarHBondContact O-N 2.87Å; A39-S42 PolarHBondContact O-OG 2.83Å; A39-G43 PolarHBondContact O-N 3.3Å; A39-L44 CarbonylContact C-O 3.45Å; A39-L44 WeakPolarHBondContact CB-O 3.4Å; A39-L44 PolarHBondContact O-N 3.06Å; A39-L44 VanDerWaalsContact O-O 3.09Å; A39-E46 HydrophobicContact CB-CG 4.09Å; A39-T49 WeakPolarHBondContact CA-OG1 3.39Å; A39-T49 WeakPolarHBondContact CB-OG1 3.48Å
40A96.8Very high95.5Very high79 Ų7964.4 Ų64.465%0.65336%0.363SS*.Hα-helixtrans-63.2-41.817600000112.8M36 L37 I38 G43M36-A40 PolarHBondContact O-N 3.26Å; L37-A40 WeakPolarHBondContact O-CB 3.34Å; L37-A40 PolarHBondContact O-N 3.47Å; I38-A40 VanDerWaalsContact C-N 3.34Å; A40-G43 PolarHBondContact O-N 3.18Å
41E95.5Very high95.6Very high121 Ų12168 Ų6857%0.56538%0.377SS*.Hα-helixtrans-65.9-41.4178.2-72.11799300112.6I18 L37 I38 G43I18-E41 HydrophobicContact CG2-CB 4.14Å; L37-E41 WeakPolarHBondContact O-CG 3.33Å; L37-E41 PolarHBondContact O-N 3.29Å; I38-E41 PolarHBondContact O-N 3.1Å; E41-G43 VanDerWaalsContact C-N 3.31Å
42S95.1Very high95.6Very high7 Ų764.1 Ų64.15%0.04936%0.355CS..Hα-helixtrans-83.1-5.2179.759.40000114Q15 I38 A39 L44Q15-S42 WeakPolarHBondContact CG-O 3.45Å; Q15-S42 PolarHBondContact NE2-O 2.89Å; Q15-S42 VanDerWaalsContact NE2-O 3.09Å; I38-S42 WeakPolarHBondContact O-CB 3.41Å; I38-S42 PolarHBondContact O-N 3.39Å; I38-S42 PolarHBondContact O-OG 3.45Å; A39-S42 PolarHBondContact O-N 2.87Å; A39-S42 PolarHBondContact O-OG 2.83Å; S42-L44 PolarHBondContact O-N 3.45Å
43G95.7Very high95.6Very high64 Ų6457 Ų5766%0.6632%0.322SS*.THydrogen-bonded Turntrans63.527.4-174.900000113.3A39 A40 E41A39-G43 PolarHBondContact O-N 3.3Å; A40-G43 PolarHBondContact O-N 3.18Å; E41-G43 VanDerWaalsContact C-N 3.31Å
44L95.7Very high95.4Very high22 Ų2262.3 Ų62.312%0.11533%0.329CS..  trans-105.3166.1177.9-67.2176.6000110.9L11 Q15 L19 A39 S42 E48L11-L44 HydrophobicContact CD1-CD1 4.5Å; L11-L44 HydrophobicContact CD2-CD1 3.89Å; L11-L44 HydrophobicContact CD2-CD2 3.68Å; L11-L44 HydrophobicContact CD2-CG 4.46Å; Q15-L44 HydrophobicContact CB-CD1 4.48Å; L19-L44 HydrophobicContact CD1-CD1 3.74Å; L19-L44 HydrophobicContact CD2-CD1 4.46Å; L19-L44 HydrophobicContact CG-CD1 4.43Å; A39-L44 CarbonylContact C-O 3.45Å; A39-L44 WeakPolarHBondContact CB-O 3.4Å; A39-L44 PolarHBondContact O-N 3.06Å; A39-L44 VanDerWaalsContact O-O 3.09Å; S42-L44 PolarHBondContact O-N 3.45Å; L44-E48 HydrophobicContact CB-CB 4.41Å
45T95.6Very high95.2Very high76 Ų7663.3 Ų63.347%0.46633%0.333SS..  trans-76.5157.3166.862.60000111.2E47 E48 T49T45-E47 PolarHBondContact O-N 3.35Å; T45-E48 PolarHBondContact N-OE2 2.74Å; T45-E48 VanDerWaalsContact N-OE2 3.13Å; T45-E48 PolarHBondContact O-N 3.39Å; T45-E48 WeakPolarHBondContact OG1-CB 3.44Å; T45-E48 VanDerWaalsContact OG1-CG 3.24Å; T45-E48 WeakPolarHBondContact OG1-CG 3.42Å; T45-E48 PolarHBondContact OG1-N 2.86Å; T45-E48 PolarHBondContact OG1-OE2 2.99Å; T45-T49 WeakPolarHBondContact O-CB 3.45Å; T45-T49 PolarHBondContact O-N 3.42Å; T45-T49 PolarHBondContact O-OG1 2.87Å
46E95.3Very high95.1Very high91 Ų9165.1 Ų65.143%0.42534%0.338SS..Hα-helixtrans-58.1-38.6173-67.8175.883.700111.3L35 A39 T49 A50L35-E46 HydrophobicContact CD2-CB 3.94Å; L35-E46 HydrophobicContact CD2-CG 4.46Å; L35-E46 WeakPolarHBondContact CD2-O 3.43Å; A39-E46 HydrophobicContact CB-CG 4.09Å; E46-T49 PolarHBondContact O-N 2.95Å; E46-A50 VanDerWaalsContact O-CB 3.29Å; E46-A50 WeakPolarHBondContact O-CB 3.37Å; E46-A50 PolarHBondContact O-N 2.82Å
47E94.6Very high94.8Very high163 Ų16360.2 Ų60.276%0.76232%0.315SS*.Hα-helixtrans-63.9-45.9178.4-173.2175.194.300112.2T45 A50 K51T45-E47 PolarHBondContact O-N 3.35Å; E47-A50 PolarHBondContact O-N 3.47Å; E47-K51 WeakPolarHBondContact O-CB 3.37Å; E47-K51 PolarHBondContact O-N 3.4Å
48E94.6Very high94.4Very high72 Ų7256.5 Ų56.534%0.33630%0.301SS..Hα-helixtrans-62.9-44.9176.1-73.6170.9118.500111.3M9 L44 T45 A50 K51 W52M9-E48 HydrophobicContact CE-CB 3.97Å; M9-E48 HydrophobicContact CE-CG 4.4Å; M9-E48 WeakPolarHBondContact CE-O 3.39Å; L44-E48 HydrophobicContact CB-CB 4.41Å; T45-E48 PolarHBondContact N-OE2 2.74Å; T45-E48 VanDerWaalsContact N-OE2 3.13Å; T45-E48 PolarHBondContact O-N 3.39Å; T45-E48 WeakPolarHBondContact OG1-CB 3.44Å; T45-E48 VanDerWaalsContact OG1-CG 3.24Å; T45-E48 WeakPolarHBondContact OG1-CG 3.42Å; T45-E48 PolarHBondContact OG1-N 2.86Å; T45-E48 PolarHBondContact OG1-OE2 2.99Å; E48-A50 PolarHBondContact O-N 3.42Å; E48-K51 PolarHBondContact O-N 3.24Å; E48-W52 WeakPolarHBondContact O-CB 3.47Å; E48-W52 PolarHBondContact O-N 3.32Å
49T95.8Very high93.9Very high0 Ų058.5 Ų58.50%031%0.31CS..Hα-helixtrans-59.5-48.6177.4-56.40000110.4L19 L35 I38 A39 T45 E46 K51 W52 F53L19-T49 HydrophobicContact CD2-CG2 3.86Å; L35-T49 HydrophobicContact CD1-CG2 4.02Å; L35-T49 HydrophobicContact CG-CG2 4.03Å; I38-T49 HydrophobicContact CB-CG2 4.25Å; I38-T49 HydrophobicContact CG2-CG2 3.95Å; A39-T49 WeakPolarHBondContact CA-OG1 3.39Å; A39-T49 WeakPolarHBondContact CB-OG1 3.48Å; T45-T49 WeakPolarHBondContact O-CB 3.45Å; T45-T49 PolarHBondContact O-N 3.42Å; T45-T49 PolarHBondContact O-OG1 2.87Å; E46-T49 PolarHBondContact O-N 2.95Å; T49-K51 VanDerWaalsContact C-N 3.35Å; T49-K51 PolarHBondContact O-N 3.22Å; T49-W52 PolarHBondContact O-N 3.24Å; T49-F53 HydrophobicContact CG2-CD2 3.98Å; T49-F53 HydrophobicContact CG2-CE2 4.02Å; T49-F53 WeakPolarHBondContact O-CD2 3.25Å; T49-F53 PolarHBondContact O-N 3.35Å
50A94.9Very high93.6Very high20 Ų2062 Ų6217%0.16532%0.322CS..Hα-helixtrans-61.1-42.117700000112.4L35 E46 E47 E48 F53 R54L35-A50 HydrophobicContact CD1-CB 3.99Å; L35-A50 HydrophobicContact CD2-CB 4.04Å; E46-A50 VanDerWaalsContact O-CB 3.29Å; E46-A50 WeakPolarHBondContact O-CB 3.37Å; E46-A50 PolarHBondContact O-N 2.82Å; E47-A50 PolarHBondContact O-N 3.47Å; E48-A50 PolarHBondContact O-N 3.42Å; A50-F53 PolarHBondContact O-N 3.27Å; A50-R54 WeakPolarHBondContact O-CB 3.19Å; A50-R54 VanDerWaalsContact O-CG 3.24Å; A50-R54 WeakPolarHBondContact O-CG 3.24Å; A50-R54 PolarHBondContact O-N 2.86Å
51K94.3Very high93.1Very high103 Ų10359.7 Ų59.745%0.44830%0.297SS..Hα-helixtrans-61.1-45.1176-179177.6175.7-174.20111M9 E47 E48 T49 R54 L55M9-K51 HydrophobicContact CE-CB 4.16Å; M9-K51 HydrophobicContact CE-CD 4.17Å; M9-K51 HydrophobicContact CE-CG 4.25Å; M9-K51 HydrophobicContact SD-CD 4.2Å; M9-K51 HydrophobicContact SD-CG 4.08Å; E47-K51 WeakPolarHBondContact O-CB 3.37Å; E47-K51 PolarHBondContact O-N 3.4Å; E48-K51 PolarHBondContact O-N 3.24Å; T49-K51 VanDerWaalsContact C-N 3.35Å; T49-K51 PolarHBondContact O-N 3.22Å; K51-R54 PolarHBondContact O-N 2.89Å; K51-L55 HydrophobicContact CG-CD1 4.1Å; K51-L55 VanDerWaalsContact O-CG 3.31Å; K51-L55 WeakPolarHBondContact O-CG 3.48Å; K51-L55 PolarHBondContact O-N 3.38Å
52W95.1Very high92.6Very high5 Ų559.8 Ų59.82%0.01930%0.297CS..Hα-helixtrans-61.4-48.2177.3-172.195.8000111.6M9 L11 L19 E20 F23 E48 T49 R54 L55 R56M9-W52 HydrophobicContact CE-CB 4.15Å; M9-W52 HydrophobicContact SD-CB 4.07Å; L11-W52 HydrophobicContact CD1-CG 4.25Å; L19-W52 HydrophobicContact CB-CD2 3.88Å; L19-W52 HydrophobicContact CB-CE3 3.79Å; L19-W52 HydrophobicContact CB-CH2 3.82Å; L19-W52 HydrophobicContact CB-CZ2 3.89Å; L19-W52 HydrophobicContact CB-CZ3 3.78Å; L19-W52 HydrophobicContact CD1-CB 4.29Å; L19-W52 HydrophobicContact CD1-CD2 3.82Å; L19-W52 HydrophobicContact CD1-CE3 4.4Å; L19-W52 HydrophobicContact CD1-CG 3.73Å; L19-W52 HydrophobicContact CD2-CD2 4.44Å; L19-W52 HydrophobicContact CD2-CE3 4.25Å; L19-W52 HydrophobicContact CG-CD2 4.28Å; L19-W52 HydrophobicContact CG-CE3 4.39Å; E20-W52 HydrophobicContact CG-CH2 4.04Å; E20-W52 HydrophobicContact CG-CZ2 3.95Å; E20-W52 WeakPolarHBondContact OE1-CH2 3.49Å; F23-W52 HydrophobicContact CB-CH2 4.18Å; F23-W52 HydrophobicContact CB-CZ3 3.91Å; F23-W52 HydrophobicContact CD2-CZ3 4.22Å; F23-W52 HydrophobicContact CG-CH2 4.47Å; F23-W52 HydrophobicContact CG-CZ3 4.18Å; E48-W52 WeakPolarHBondContact O-CB 3.47Å; E48-W52 PolarHBondContact O-N 3.32Å; T49-W52 PolarHBondContact O-N 3.24Å; W52-R54 VanDerWaalsContact C-N 3.32Å; W52-R54 PolarHBondContact O-N 2.89Å; W52-L55 PolarHBondContact O-N 2.96Å; W52-R56 HydrophobicContact CD2-CB 4.4Å; W52-R56 HydrophobicContact CE3-CB 4.02Å; W52-R56 HydrophobicContact CH2-CB 3.87Å; W52-R56 HydrophobicContact CH2-CG 3.58Å; W52-R56 HydrophobicContact CZ2-CB 4.27Å; W52-R56 HydrophobicContact CZ2-CG 4.14Å; W52-R56 HydrophobicContact CZ3-CB 3.73Å; W52-R56 HydrophobicContact CZ3-CG 3.84Å; W52-R56 WeakPolarHBondContact O-CB 3.46Å; W52-R56 PolarHBondContact O-N 3.4Å
53F94.8Very high92.1Very high9 Ų963.4 Ų63.44%0.03933%0.328CS..Hα-helixtrans-60.2-40.5178.6-92.9-97.4000112.4L19 N22 F23 S27 P30 I38 T49 A50 R56 N57L19-F53 HydrophobicContact CD2-CD2 4.36Å; L19-F53 HydrophobicContact CD2-CE2 3.89Å; N22-F53 HydrophobicContact CB-CZ 4.23Å; F23-F53 HydrophobicContact CB-CE1 3.98Å; F23-F53 HydrophobicContact CB-CZ 4.24Å; F23-F53 AromaticContact CD2-CD1 3.68Å; F23-F53 HydrophobicContact CD2-CD1 3.68Å; F23-F53 AromaticContact CD2-CE1 3.74Å; F23-F53 HydrophobicContact CD2-CE1 3.74Å; F23-F53 HydrophobicContact CE2-CD1 4.4Å; F23-F53 HydrophobicContact CG-CE1 4.37Å; S27-F53 WeakPolarHBondContact O-CE1 3.38Å; P30-F53 HydrophobicContact CG-CD1 3.53Å; P30-F53 HydrophobicContact CG-CD2 4.43Å; P30-F53 HydrophobicContact CG-CE1 3.64Å; P30-F53 HydrophobicContact CG-CG 3.96Å; P30-F53 HydrophobicContact CG-CZ 4.16Å; I38-F53 HydrophobicContact CD1-CE2 4.15Å; I38-F53 HydrophobicContact CD1-CZ 3.81Å; I38-F53 HydrophobicContact CG2-CE2 4.2Å; T49-F53 HydrophobicContact CG2-CD2 3.98Å; T49-F53 HydrophobicContact CG2-CE2 4.02Å; T49-F53 WeakPolarHBondContact O-CD2 3.25Å; T49-F53 PolarHBondContact O-N 3.35Å; A50-F53 PolarHBondContact O-N 3.27Å; F53-R56 PolarHBondContact O-N 3.48Å; F53-N57 WeakPolarHBondContact O-CB 3.29Å; F53-N57 PolarHBondContact O-N 3.32Å
54R91.6Very high91.5Very high194 Ų19466.1 Ų66.173%0.73232%0.323SS*.Hα-helixtrans-61.7-47.1175.3-73.5170.3-177.4177.33.4111.8A50 K51 W52 A58A50-R54 WeakPolarHBondContact O-CB 3.19Å; A50-R54 VanDerWaalsContact O-CG 3.24Å; A50-R54 WeakPolarHBondContact O-CG 3.24Å; A50-R54 PolarHBondContact O-N 2.86Å; K51-R54 PolarHBondContact O-N 2.89Å; W52-R54 VanDerWaalsContact C-N 3.32Å; W52-R54 PolarHBondContact O-N 2.89Å; R54-A58 PolarHBondContact O-N 3.24Å; R54-A58 VanDerWaalsContact O-N 3.09Å
55L91.6Very high90.9Very high51 Ų5168.3 Ų68.327%0.26735%0.351SS..Hα-helixtrans-64.6-42.8178.5-69.8168.8000111.5M6 M9 K51 W52 A58 Q59M6-L55 HydrophobicContact CE-CB 4.08Å; M6-L55 HydrophobicContact CG-CB 4.14Å; M6-L55 HydrophobicContact CG-CD1 4.48Å; M9-L55 HydrophobicContact SD-CD1 4.07Å; K51-L55 HydrophobicContact CG-CD1 4.1Å; K51-L55 VanDerWaalsContact O-CG 3.31Å; K51-L55 WeakPolarHBondContact O-CG 3.48Å; K51-L55 PolarHBondContact O-N 3.38Å; W52-L55 PolarHBondContact O-N 2.96Å; L55-A58 PolarHBondContact O-N 3.36Å; L55-Q59 PolarHBondContact O-N 3.13Å; L55-Q59 VanDerWaalsContact O-N 3.1Å
56R92.8Very high89.9Confident59 Ų5968.7 Ų68.722%0.22335%0.35CS..Hα-helixtrans-67.3-41.7-179.7-171.561.2174.9140-6112.6M6 E20 F23 W52 F53 A58 Q59 W60M6-R56 HydrophobicContact CE-CB 3.52Å; M6-R56 VanDerWaalsContact CE-CD 3.44Å; M6-R56 HydrophobicContact CE-CG 4.09Å; M6-R56 VanDerWaalsContact CE-N 3.25Å; E20-R56 IonicContact OE1-CZ 3.4Å; E20-R56 IonicContact OE1-NE 2.69Å; E20-R56 PolarHBondContact OE1-NE 3.3Å; E20-R56 IonicContact OE1-NH2 3.24Å; E20-R56 PolarHBondContact OE1-NH2 3.1Å; E20-R56 IonicContact OE2-CZ 3.76Å; E20-R56 IonicContact OE2-NE 3.78Å; E20-R56 IonicContact OE2-NH2 2.99Å; E20-R56 PolarHBondContact OE2-NH2 3.45Å; F23-R56 HydrophobicContact CD1-CG 3.74Å; F23-R56 HydrophobicContact CD2-CB 4.32Å; F23-R56 HydrophobicContact CD2-CG 4.02Å; F23-R56 HydrophobicContact CE1-CG 3.53Å; F23-R56 HydrophobicContact CE2-CB 4.02Å; F23-R56 HydrophobicContact CE2-CG 3.83Å; F23-R56 HydrophobicContact CG-CG 3.98Å; F23-R56 HydrophobicContact CZ-CB 4.14Å; F23-R56 HydrophobicContact CZ-CG 3.57Å; W52-R56 HydrophobicContact CD2-CB 4.4Å; W52-R56 HydrophobicContact CE3-CB 4.02Å; W52-R56 HydrophobicContact CH2-CB 3.87Å; W52-R56 HydrophobicContact CH2-CG 3.58Å; W52-R56 HydrophobicContact CZ2-CB 4.27Å; W52-R56 HydrophobicContact CZ2-CG 4.14Å; W52-R56 HydrophobicContact CZ3-CB 3.73Å; W52-R56 HydrophobicContact CZ3-CG 3.84Å; W52-R56 WeakPolarHBondContact O-CB 3.46Å; W52-R56 PolarHBondContact O-N 3.4Å; F53-R56 PolarHBondContact O-N 3.48Å; R56-A58 VanDerWaalsContact C-N 3.31Å; R56-A58 PolarHBondContact O-N 2.91Å; R56-Q59 PolarHBondContact O-N 2.89Å; R56-W60 WeakPolarHBondContact O-CB 3.34Å; R56-W60 PolarHBondContact O-N 3.43Å
57N90.9Very high88.6Confident10 Ų1067.3 Ų67.35%0.05335%0.349CS..Hα-helixtrans-63.3-38.5174.7-16932.4000112.3F23 H29 F53 W60 R61F23-N57 HydrophobicContact CE2-CB 4.12Å; F23-N57 HydrophobicContact CZ-CB 4.38Å; H29-N57 PolarHBondContact CE1-ND2 3.2Å; H29-N57 PolarHBondContact NE2-ND2 3.49Å; H29-N57 VanDerWaalsContact NE2-ND2 3.11Å; F53-N57 WeakPolarHBondContact O-CB 3.29Å; F53-N57 PolarHBondContact O-N 3.32Å; N57-W60 PolarHBondContact O-N 3.11Å; N57-R61 PolarHBondContact ND2-NH1 3.37Å; N57-R61 PolarHBondContact ND2-NH2 2.86Å; N57-R61 WeakPolarHBondContact O-CB 3.44Å; N57-R61 WeakPolarHBondContact O-CG 3.49Å; N57-R61 PolarHBondContact O-N 3.49Å
58A87.9Confident87Confident36 Ų3662.7 Ų62.730%0.29834%0.338SS..Hα-helixtrans-62.7-43.6175.200000112.1R54 L55 R56 Q62R54-A58 PolarHBondContact O-N 3.24Å; R54-A58 VanDerWaalsContact O-N 3.09Å; L55-A58 PolarHBondContact O-N 3.36Å; R56-A58 VanDerWaalsContact C-N 3.31Å; R56-A58 PolarHBondContact O-N 2.91Å; A58-Q62 WeakPolarHBondContact O-CG 3.47Å; A58-Q62 PolarHBondContact O-N 3.39Å; A58-Q62 VanDerWaalsContact O-N 3.13Å
59Q88.1Confident85.4Confident44 Ų4466.2 Ų66.221%0.20636%0.355CS..Hα-helixtrans-64.1-45.1174.4-72.7179.2-1.700112.3N4 M6 L55 R56 R61 Q62 A63N4-Q59 PolarHBondContact OD1-NE2 2.94Å; M6-Q59 HydrophobicContact CE-CG 4.18Å; L55-Q59 PolarHBondContact O-N 3.13Å; L55-Q59 VanDerWaalsContact O-N 3.1Å; R56-Q59 PolarHBondContact O-N 2.89Å; Q59-R61 VanDerWaalsContact C-N 3.35Å; Q59-R61 PolarHBondContact O-N 3.09Å; Q59-Q62 PolarHBondContact O-N 3.46Å; Q59-A63 PolarHBondContact O-N 3.49Å
60W89.4Confident83.6Confident76 Ų7673.6 Ų73.629%0.28839%0.394SS..Hα-helixtrans-60-45.1178.3175.773.2000111.1F23 K28 R56 N57 Q62 A63 E64 L66F23-W60 HydrophobicContact CE1-CB 4.18Å; F23-W60 HydrophobicContact CE1-CG 4.36Å; F23-W60 HydrophobicContact CZ-CB 4.01Å; F23-W60 HydrophobicContact CZ-CG 4.38Å; K28-W60 HydrophobicContact CD-CD2 4.39Å; R56-W60 WeakPolarHBondContact O-CB 3.34Å; R56-W60 PolarHBondContact O-N 3.43Å; N57-W60 PolarHBondContact O-N 3.11Å; W60-Q62 PolarHBondContact O-N 2.96Å; W60-A63 WeakPolarHBondContact O-CB 3.29Å; W60-A63 PolarHBondContact O-N 3.38Å; W60-A63 VanDerWaalsContact O-N 3.14Å; W60-E64 HydrophobicContact CD2-CG 4.06Å; W60-E64 HydrophobicContact CG-CG 4.46Å; W60-E64 HydrophobicContact CH2-CG 4.31Å; W60-E64 HydrophobicContact CZ2-CG 3.67Å; W60-E64 WeakPolarHBondContact O-CG 3.49Å; W60-E64 PolarHBondContact O-N 3.15Å; W60-L66 HydrophobicContact CH2-CD1 4.32Å; W60-L66 HydrophobicContact CZ3-CD1 4.3Å
61R86.6Confident81.8Confident30 Ų3075.8 Ų75.811%0.11342%0.418CS..Hα-helixtrans-59.2-43.9175.3-76.9-175.4178.6144.31.4113H29 N57 Q59 A63 E64 G65 L66H29-R61 PolarHBondContact CE1-NH2 3Å; H29-R61 PolarHBondContact NE2-NH2 2.74Å; N57-R61 PolarHBondContact ND2-NH1 3.37Å; N57-R61 PolarHBondContact ND2-NH2 2.86Å; N57-R61 WeakPolarHBondContact O-CB 3.44Å; N57-R61 WeakPolarHBondContact O-CG 3.49Å; N57-R61 PolarHBondContact O-N 3.49Å; Q59-R61 VanDerWaalsContact C-N 3.35Å; Q59-R61 PolarHBondContact O-N 3.09Å; R61-A63 VanDerWaalsContact C-N 3.3Å; R61-A63 PolarHBondContact O-N 2.86Å; R61-E64 PolarHBondContact O-N 3.25Å; R61-G65 PolarHBondContact O-N 2.96Å; R61-L66 HydrophobicContact CB-CB 4.16Å; R61-L66 HydrophobicContact CG-CB 4.35Å; R61-L66 HydrophobicContact CG-CD1 4.49Å; R61-L66 PolarHBondContact O-N 3.22Å
62Q84.4Confident79.9Confident124 Ų12474.1 Ų74.158%0.57942%0.419SS*.Hα-helixtrans-61.6-40.1176.1-71.8176.522.100111.8A58 Q59 W60 G65A58-Q62 WeakPolarHBondContact O-CG 3.47Å; A58-Q62 PolarHBondContact O-N 3.39Å; A58-Q62 VanDerWaalsContact O-N 3.13Å; Q59-Q62 PolarHBondContact O-N 3.46Å; W60-Q62 PolarHBondContact O-N 2.96Å; Q62-G65 PolarHBondContact O-N 2.96Å
63A84.5Confident77.9Confident83 Ų8380.2 Ų80.269%0.68646%0.457SS*.Hα-helixtrans-67.1-36.4177.700000112.7Q59 W60 R61 G65Q59-A63 PolarHBondContact O-N 3.49Å; W60-A63 WeakPolarHBondContact O-CB 3.29Å; W60-A63 PolarHBondContact O-N 3.38Å; W60-A63 VanDerWaalsContact O-N 3.14Å; R61-A63 VanDerWaalsContact C-N 3.3Å; R61-A63 PolarHBondContact O-N 2.86Å; A63-G65 PolarHBondContact O-N 3.25Å
64E83.9Confident75.8Confident121 Ų12189.2 Ų89.257%0.56550%0.496SS*.THydrogen-bonded Turntrans-76-2.9175.5-64.9-68.1110.700113.3W60 R61 L66W60-E64 HydrophobicContact CD2-CG 4.06Å; W60-E64 HydrophobicContact CG-CG 4.46Å; W60-E64 HydrophobicContact CH2-CG 4.31Å; W60-E64 HydrophobicContact CZ2-CG 3.67Å; W60-E64 WeakPolarHBondContact O-CG 3.49Å; W60-E64 PolarHBondContact O-N 3.15Å; R61-E64 PolarHBondContact O-N 3.25Å; E64-L66 HydrophobicContact CB-CD1 3.99Å; E64-L66 HydrophobicContact CB-CG 3.98Å; E64-L66 PolarHBondContact O-N 3.09Å
65G81.9Confident73.8Confident68 Ų6891.1 Ų91.170%0.70152%0.52SS*.THydrogen-bonded Turntrans71.115.1-173.800000113.8R61 Q62 A63R61-G65 PolarHBondContact O-N 2.96Å; Q62-G65 PolarHBondContact O-N 2.96Å; A63-G65 PolarHBondContact O-N 3.25Å
66L75.7Confident72.9Confident84 Ų8493.1 Ų93.144%0.4453%0.533SS..  trans-82144.5177.1-66.6171.5000110.6W60 R61 E64W60-L66 HydrophobicContact CH2-CD1 4.32Å; W60-L66 HydrophobicContact CZ3-CD1 4.3Å; R61-L66 HydrophobicContact CB-CB 4.16Å; R61-L66 HydrophobicContact CG-CB 4.35Å; R61-L66 HydrophobicContact CG-CD1 4.49Å; R61-L66 PolarHBondContact O-N 3.22Å; E64-L66 HydrophobicContact CB-CD1 3.99Å; E64-L66 HydrophobicContact CB-CG 3.98Å; E64-L66 PolarHBondContact O-N 3.09Å
67P67.8Low71.8Confident62 Ų6294.9 Ų94.940%0.40355%0.549SS..  trans-60.2146.5173.225.1-32.5000110.5Q69P67-Q69 PolarHBondContact O-N 2.99Å
68A61Low70.8Confident66 Ų6699.6 Ų99.655%0.54558%0.577SS.*SBendtrans-58.7-20.8-17600000113.8
69Q61.2Low69.8Low145 Ų145103.4 Ų103.468%0.67859%0.593SS**SBendtrans-115.6130.1177.3-63.1-168.6-10.500111.6P67 G71 S72P67-Q69 PolarHBondContact O-N 2.99Å; Q69-G71 PolarHBondContact O-N 2.99Å; Q69-G71 VanDerWaalsContact O-N 3.09Å; Q69-S72 PolarHBondContact O-N 3.23Å
70L56.8Low68.6Low156 Ų156107.1 Ų107.182%0.81762%0.618SS**THydrogen-bonded Turntrans-61.1109.9172.5-16874.9000108.5
71G58.6Low67.3Low66 Ų66109.1 Ų109.168%0.6864%0.64SS**THydrogen-bonded Turntrans107.30.6179.300000116.3Q69 V73Q69-G71 PolarHBondContact O-N 2.99Å; Q69-G71 VanDerWaalsContact O-N 3.09Å; G71-V73 PolarHBondContact O-N 3.28Å
72S52.9Low65.9Low67 Ų67114.8 Ų114.847%0.46968%0.677SS.*  trans-80.657.3167.5-155.90000110.7Q69 K74Q69-S72 PolarHBondContact O-N 3.23Å; S72-K74 PolarHBondContact O-N 2.96Å
73V52.7Low64.4Low133 Ų133114.1 Ų114.181%0.80669%0.685SS**  trans-79.794.3159.4-93.90000105.9G71G71-V73 PolarHBondContact O-N 3.28Å
74K50.9Low62.8Low199 Ų199116.7 Ų116.787%0.86569%0.685SS**  trans-12578.7166.1-123.6-173.5174.2-170.40107.7S72S72-K74 PolarHBondContact O-N 2.96Å
75D49.9Very low60.9Low233 Ų233116.3 Ų116.3100%1.24670%0.695SS**  -145.10122.9-164-115.2000108

Retrieved 75 of 75 residues in 218.1 ms (Link to these results)