A0A060YV89_ONCMY Loading...

Somatostatin/Cortistatin C-terminal domain-containing protein

Somatostatin inhibits the release of somatotropin.

AlphaFold DB , UniProt , Accession A0A060YV89, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110490058, Length 114 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
1M62.9Low86.5Confident243 Ų243108 Ų108100%1.19759%0.593SS**  0116.10-66.2175.110900107.1S3M1-S3 PolarHBondContact O-N 3.47Å
2L72.1Confident87Confident105 Ų105109.1 Ų109.155%0.5560%0.596SS.*  trans-63.4130.2179.2-137.179000108.3T4 V6 Q7 L10L2-T4 PolarHBondContact O-N 3.19Å; L2-V6 HydrophobicContact CD2-CB 4.19Å; L2-V6 HydrophobicContact CD2-CG1 3.64Å; L2-V6 HydrophobicContact CG-CB 4.26Å; L2-V6 HydrophobicContact CG-CG1 4Å; L2-Q7 HydrophobicContact CB-CG 4.17Å; L2-Q7 HydrophobicContact CD2-CG 4.14Å; L2-L10 HydrophobicContact CD2-CD1 4.06Å
3S85.8Confident87.5Confident69 Ų69108.6 Ų108.648%0.48359%0.592SS.*  trans-56.4137.8178.6174.30000110.1M1 R5 V6 Q7M1-S3 PolarHBondContact O-N 3.47Å; S3-R5 PolarHBondContact O-N 2.89Å; S3-R5 VanDerWaalsContact O-N 3.07Å; S3-V6 WeakPolarHBondContact O-CA 3.02Å; S3-V6 WeakPolarHBondContact O-CB 3.18Å; S3-V6 PolarHBondContact O-N 2.06Å; S3-Q7 PolarHBondContact O-N 3.19Å
4T89.4Confident87.6Confident101 Ų101105.9 Ų105.962%0.6259%0.585SS**Hα-helixtrans-52.5-32.7179.341.10000112.3L2 V6 Q7 C8L2-T4 PolarHBondContact O-N 3.19Å; T4-V6 PolarHBondContact O-N 2.74Å; T4-Q7 PolarHBondContact O-N 2.82Å; T4-C8 PolarHBondContact O-N 3.12Å; T4-C8 PolarHBondContact O-SG 3.48Å
5R86.4Confident87.8Confident209 Ų209105.5 Ų105.579%0.78958%0.58SS**Hα-helixtrans-63.7-38.6175.1-63.3-158.1176.2-159.20.4113.2S3 A9S3-R5 PolarHBondContact O-N 2.89Å; S3-R5 VanDerWaalsContact O-N 3.07Å; R5-A9 WeakPolarHBondContact O-CB 3.25Å; R5-A9 PolarHBondContact O-N 3.28Å
6V91.7Very high87.6Confident69 Ų69101.9 Ų101.942%0.41857%0.569SS.*Hα-helixtrans-70.8-38.5178.3-179.50000110.3L2 S3 T4 A9 L10L2-V6 HydrophobicContact CD2-CB 4.19Å; L2-V6 HydrophobicContact CD2-CG1 3.64Å; L2-V6 HydrophobicContact CG-CB 4.26Å; L2-V6 HydrophobicContact CG-CG1 4Å; S3-V6 WeakPolarHBondContact O-CA 3.02Å; S3-V6 WeakPolarHBondContact O-CB 3.18Å; S3-V6 PolarHBondContact O-N 2.06Å; T4-V6 PolarHBondContact O-N 2.74Å; V6-A9 PolarHBondContact O-N 2.81Å; V6-L10 HydrophobicContact CG1-CD1 4.04Å; V6-L10 WeakPolarHBondContact O-CB 3.46Å; V6-L10 WeakPolarHBondContact O-CG 3.47Å; V6-L10 PolarHBondContact O-N 2.67Å
7Q90.3Very high87.4Confident103 Ų103102.4 Ų102.448%0.48157%0.569SS.*Hα-helixtrans-64.1-43.8175-65.7177.5-23.400111.7L2 S3 T4 L10 A11L2-Q7 HydrophobicContact CB-CG 4.17Å; L2-Q7 HydrophobicContact CD2-CG 4.14Å; S3-Q7 PolarHBondContact O-N 3.19Å; T4-Q7 PolarHBondContact O-N 2.82Å; Q7-L10 PolarHBondContact O-N 2.77Å; Q7-A11 WeakPolarHBondContact O-CB 3.37Å; Q7-A11 PolarHBondContact O-N 2.85Å
8C92.4Very high87.1Confident77 Ų7799.3 Ų99.352%0.5256%0.56SS.*Hα-helixtrans-62.9-43174.9-690000112T4 A11 L12T4-C8 PolarHBondContact O-N 3.12Å; T4-C8 PolarHBondContact O-SG 3.48Å; C8-A11 PolarHBondContact O-N 2.73Å; C8-L12 VanDerWaalsContact O-CG 3.31Å; C8-L12 WeakPolarHBondContact O-CG 3.42Å; C8-L12 PolarHBondContact O-N 2.68Å
9A93.3Very high86.6Confident60 Ų6099.7 Ų99.750%0.49656%0.559SS.*Hα-helixtrans-62.5-44.617800000112R5 V6 L12 L13R5-A9 WeakPolarHBondContact O-CB 3.25Å; R5-A9 PolarHBondContact O-N 3.28Å; V6-A9 PolarHBondContact O-N 2.81Å; A9-L12 PolarHBondContact O-N 3.06Å; A9-L13 WeakPolarHBondContact O-CB 3.32Å; A9-L13 PolarHBondContact O-N 2.83Å
10L93.2Very high85.9Confident96 Ų9698.8 Ų98.850%0.50356%0.559SS.*Hα-helixtrans-64-40.9176.1-80.3163.7000112.3L2 V6 Q7 L13 S14L2-L10 HydrophobicContact CD2-CD1 4.06Å; V6-L10 HydrophobicContact CG1-CD1 4.04Å; V6-L10 WeakPolarHBondContact O-CB 3.46Å; V6-L10 WeakPolarHBondContact O-CG 3.47Å; V6-L10 PolarHBondContact O-N 2.67Å; Q7-L10 PolarHBondContact O-N 2.77Å; L10-L13 PolarHBondContact O-N 3.48Å; L10-S14 WeakPolarHBondContact O-CB 3.38Å; L10-S14 PolarHBondContact O-N 2.93Å; L10-S14 PolarHBondContact O-OG 2.74Å
11A93.9Very high84.9Confident56 Ų5697.8 Ų97.846%0.46356%0.559SS.*Hα-helixtrans-62.6-46.1176.800000111.5Q7 C8 L13 S14 L15Q7-A11 WeakPolarHBondContact O-CB 3.37Å; Q7-A11 PolarHBondContact O-N 2.85Å; C8-A11 PolarHBondContact O-N 2.73Å; A11-L13 PolarHBondContact O-N 3.35Å; A11-S14 PolarHBondContact O-N 2.89Å; A11-S14 PolarHBondContact O-OG 3.2Å; A11-L15 PolarHBondContact O-N 3.34Å
12L93.1Very high84.7Confident121 Ų12191.5 Ų91.563%0.63453%0.534SS*.Hα-helixtrans-63.8-41.1176.9-69.9173.5000112.1C8 A9 L15 A16C8-L12 VanDerWaalsContact O-CG 3.31Å; C8-L12 WeakPolarHBondContact O-CG 3.42Å; C8-L12 PolarHBondContact O-N 2.68Å; A9-L12 PolarHBondContact O-N 3.06Å; L12-L15 PolarHBondContact O-N 3.27Å; L12-A16 WeakPolarHBondContact O-CB 3.47Å; L12-A16 PolarHBondContact O-N 3.02Å
13L92.8Very high83.8Confident103 Ų10391.2 Ų91.254%0.53954%0.541SS..Hα-helixtrans-62.4-44.2175.7-17468.5000111.4A9 L10 A11 L15 A16 L17A9-L13 WeakPolarHBondContact O-CB 3.32Å; A9-L13 PolarHBondContact O-N 2.83Å; L10-L13 PolarHBondContact O-N 3.48Å; A11-L13 PolarHBondContact O-N 3.35Å; L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 3.07Å; L13-A16 PolarHBondContact O-N 3.03Å; L13-L17 HydrophobicContact CG-CD1 4.18Å; L13-L17 VanDerWaalsContact O-CG 3.32Å; L13-L17 WeakPolarHBondContact O-CG 3.25Å; L13-L17 PolarHBondContact O-N 3.14Å
14S88.9Confident82Confident71 Ų7191.5 Ų91.550%0.49755%0.547SS..Hα-helixtrans-63.2-37.9178.373.80000112.4L10 A11 A18L10-S14 WeakPolarHBondContact O-CB 3.38Å; L10-S14 PolarHBondContact O-N 2.93Å; L10-S14 PolarHBondContact O-OG 2.74Å; A11-S14 PolarHBondContact O-N 2.89Å; A11-S14 PolarHBondContact O-OG 3.2Å; S14-A18 WeakPolarHBondContact O-CB 3.24Å; S14-A18 PolarHBondContact O-N 3.06Å
15L90.3Very high80.3Confident99 Ų9989.6 Ų89.652%0.51854%0.542SS..Hα-helixtrans-68.8-43.1176.8-176.463.3000111.2A11 L12 L13 A18 I19A11-L15 PolarHBondContact O-N 3.34Å; L12-L15 PolarHBondContact O-N 3.27Å; L13-L15 VanDerWaalsContact C-N 3.31Å; L13-L15 PolarHBondContact O-N 3.07Å; L15-A18 PolarHBondContact O-N 3.39Å; L15-I19 HydrophobicContact CD1-CD1 4.19Å; L15-I19 HydrophobicContact CG-CD1 3.94Å; L15-I19 VanDerWaalsContact O-CG1 3.28Å; L15-I19 WeakPolarHBondContact O-CG1 3.47Å; L15-I19 PolarHBondContact O-N 3.27Å
16A85.8Confident78.6Confident48 Ų4885.3 Ų85.340%0.39754%0.541SS..Hα-helixtrans-60.2-46.817600000111.3L12 L13 A18 I19 S20L12-A16 WeakPolarHBondContact O-CB 3.47Å; L12-A16 PolarHBondContact O-N 3.02Å; L13-A16 PolarHBondContact O-N 3.03Å; A16-A18 VanDerWaalsContact C-N 3.32Å; A16-A18 PolarHBondContact O-N 2.75Å; A16-I19 PolarHBondContact O-N 3.28Å; A16-S20 WeakPolarHBondContact O-CB 3.47Å; A16-S20 PolarHBondContact O-N 3.46Å; A16-S20 PolarHBondContact O-OG 3.33Å; A16-S20 VanDerWaalsContact O-OG 3.11Å
17L83.5Confident76.9Confident110 Ų11085.2 Ų85.258%0.57654%0.543SS*.Hα-helixtrans-61.4-38.4177.1-71.4169.9000112.5L13 S21L13-L17 HydrophobicContact CG-CD1 4.18Å; L13-L17 VanDerWaalsContact O-CG 3.32Å; L13-L17 WeakPolarHBondContact O-CG 3.25Å; L13-L17 PolarHBondContact O-N 3.14Å; L17-S21 WeakPolarHBondContact O-CB 3.44Å; L17-S21 PolarHBondContact O-N 3.21Å; L17-S21 PolarHBondContact O-OG 3.47Å
18A82.6Confident75.4Confident48 Ų4884.7 Ų84.740%0.39754%0.544SS..Hα-helixtrans-68-37.6176.400000112.7S14 L15 A16 S21 V22S14-A18 WeakPolarHBondContact O-CB 3.24Å; S14-A18 PolarHBondContact O-N 3.06Å; L15-A18 PolarHBondContact O-N 3.39Å; A16-A18 VanDerWaalsContact C-N 3.32Å; A16-A18 PolarHBondContact O-N 2.75Å; A18-S21 PolarHBondContact O-OG 3.2Å; A18-V22 VanDerWaalsContact O-CG2 3.31Å; A18-V22 WeakPolarHBondContact O-CG2 3.33Å; A18-V22 PolarHBondContact O-N 3.37Å
19I77.9Confident73.9Confident106 Ų10684.2 Ų84.254%0.54455%0.545SS..Hα-helixtrans-71.2-41.9177.1-65.5164.1000110.3L15 A16 V22 S23L15-I19 HydrophobicContact CD1-CD1 4.19Å; L15-I19 HydrophobicContact CG-CD1 3.94Å; L15-I19 VanDerWaalsContact O-CG1 3.28Å; L15-I19 WeakPolarHBondContact O-CG1 3.47Å; L15-I19 PolarHBondContact O-N 3.27Å; A16-I19 PolarHBondContact O-N 3.28Å; I19-V22 PolarHBondContact O-N 3.45Å; I19-S23 PolarHBondContact O-N 3.02Å
20S71.8Confident72.4Confident81 Ų8184.9 Ų84.957%0.56654%0.537SS*.Hα-helixtrans-65.4-36.4177-63.80000112.6A16 S23 A24A16-S20 WeakPolarHBondContact O-CB 3.47Å; A16-S20 PolarHBondContact O-N 3.46Å; A16-S20 PolarHBondContact O-OG 3.33Å; A16-S20 VanDerWaalsContact O-OG 3.11Å; S20-S23 PolarHBondContact O-N 3.03Å; S20-A24 PolarHBondContact O-N 3.24Å; S20-A24 VanDerWaalsContact O-N 3.08Å
21S65.4Low70.9Confident78 Ų7885.1 Ų85.155%0.54554%0.538SS..Hα-helixtrans-72.2-30.5176.864.90000113.2L17 A18 A24L17-S21 WeakPolarHBondContact O-CB 3.44Å; L17-S21 PolarHBondContact O-N 3.21Å; L17-S21 PolarHBondContact O-OG 3.47Å; A18-S21 PolarHBondContact O-OG 3.2Å; S21-A24 PolarHBondContact O-N 2.95Å
22V59.3Low69.5Low111 Ų11189.2 Ų89.267%0.67354%0.542SS*.Hα-helixtrans-71.2-33.7170.8171.20000111.4A18 I19 A24 A25A18-V22 VanDerWaalsContact O-CG2 3.31Å; A18-V22 WeakPolarHBondContact O-CG2 3.33Å; A18-V22 PolarHBondContact O-N 3.37Å; I19-V22 PolarHBondContact O-N 3.45Å; V22-A24 VanDerWaalsContact C-N 3.28Å; V22-A24 PolarHBondContact O-N 3.37Å; V22-A25 WeakPolarHBondContact O-CB 3.47Å; V22-A25 PolarHBondContact O-N 3.33Å
23S51.9Low68.3Low100 Ų10088.6 Ų88.670%0.69954%0.535SS*.Hα-helixtrans-75.8-15176-146.40000113.6I19 S20 A25I19-S23 PolarHBondContact O-N 3.02Å; S20-S23 PolarHBondContact O-N 3.03Å; S23-A25 PolarHBondContact O-N 3.41Å
24A49Very low67.1Low75 Ų7586.1 Ų86.162%0.6252%0.522SS*.THydrogen-bonded Turntrans-78.6-3.4171.500000113.5S20 S21 V22 P26S20-A24 PolarHBondContact O-N 3.24Å; S20-A24 VanDerWaalsContact O-N 3.08Å; S21-A24 PolarHBondContact O-N 2.95Å; V22-A24 VanDerWaalsContact C-N 3.28Å; V22-A24 PolarHBondContact O-N 3.37Å; A24-P26 WeakPolarHBondContact O-CD 3.49Å
25A52.7Low65.9Low61 Ų6187.1 Ų87.150%0.50452%0.522SS..SBendtrans-61.2122.116400000108.1V22 S23 S27V22-A25 WeakPolarHBondContact O-CB 3.47Å; V22-A25 PolarHBondContact O-N 3.33Å; S23-A25 PolarHBondContact O-N 3.41Å; A25-S27 PolarHBondContact O-N 3.41Å
26P51.3Low64.8Low118 Ų11888.7 Ų88.777%0.76653%0.527SS*.PPolyproline II helixtrans-50.3119.1-176.9-25.332.5000109.3A24 D28A24-P26 WeakPolarHBondContact O-CD 3.49Å; P26-D28 PolarHBondContact O-N 3.41Å
27S55.5Low63.9Low67 Ų6794 Ų9447%0.46954%0.536SS..PPolyproline II helixtrans-53.1137-160.255.50000112.5A25 A29 K30 L31A25-S27 PolarHBondContact O-N 3.41Å; S27-A29 PolarHBondContact O-N 2.89Å; S27-K30 PolarHBondContact O-N 3.38Å; S27-L31 PolarHBondContact O-N 3.16Å
28D58.6Low62.9Low93 Ų9390.8 Ų90.850%0.49752%0.523SS..Hα-helixtrans-43.4-23.6169.7-166.93000113.4P26 R32P26-D28 PolarHBondContact O-N 3.41Å; D28-R32 VanDerWaalsContact O-CB 3.27Å; D28-R32 WeakPolarHBondContact O-CB 3.35Å; D28-R32 VanDerWaalsContact O-CG 3.28Å; D28-R32 WeakPolarHBondContact O-CG 3.49Å; D28-R32 PolarHBondContact O-N 3.05Å; D28-R32 IonicContact OD1-CZ 2.62Å; D28-R32 IonicContact OD1-NH1 3.67Å; D28-R32 PolarHBondContact OD1-NH1 3.45Å; D28-R32 IonicContact OD2-CZ 3.77Å; D28-R32 IonicContact OD2-NH1 3.31Å; D28-R32 PolarHBondContact OD2-NH1 3.23Å
29A62.1Low61.9Low66 Ų6695.5 Ų95.555%0.54554%0.541SS..Hα-helixtrans-65.7-43.8172.200000113.6S27 R32 Q33S27-A29 PolarHBondContact O-N 2.89Å; A29-R32 PolarHBondContact O-N 3.36Å; A29-Q33 VanDerWaalsContact O-CB 3.31Å; A29-Q33 WeakPolarHBondContact O-CB 3.45Å; A29-Q33 PolarHBondContact O-N 3.02Å
30K61.4Low61.3Low75 Ų7598.2 Ų98.233%0.32655%0.553SS.*Hα-helixtrans-68.4-41.6175.4-81.8-164.5-178.6178.20111.2S27 R32 Q33 L34 E59S27-K30 PolarHBondContact O-N 3.38Å; K30-R32 VanDerWaalsContact C-N 3.32Å; K30-R32 PolarHBondContact O-N 3.44Å; K30-Q33 PolarHBondContact O-N 3.32Å; K30-L34 WeakPolarHBondContact O-CB 3.26Å; K30-L34 VanDerWaalsContact O-CG 3.28Å; K30-L34 WeakPolarHBondContact O-CG 3.28Å; K30-L34 PolarHBondContact O-N 2.93Å; K30-E59 IonicContact NZ-OE1 2.87Å; K30-E59 PolarHBondContact NZ-OE1 3.01Å; K30-E59 IonicContact NZ-OE2 2.74Å; K30-E59 PolarHBondContact NZ-OE2 3.48Å
31L60.9Low60.8Low101 Ų10196.4 Ų96.453%0.52954%0.543SS..Hα-helixtrans-60-44.9174.8-17764.3000110.9S27 L34 L35S27-L31 PolarHBondContact O-N 3.16Å; L31-L34 PolarHBondContact O-N 3.39Å; L31-L35 HydrophobicContact CD1-CD1 4.46Å; L31-L35 HydrophobicContact CG-CD1 4.12Å; L31-L35 WeakPolarHBondContact O-CB 3.43Å; L31-L35 VanDerWaalsContact O-CG 3.23Å; L31-L35 WeakPolarHBondContact O-CG 3.31Å; L31-L35 PolarHBondContact O-N 3Å
32R64.8Low60.4Low141 Ų14199.5 Ų99.553%0.53256%0.561SS.*Hα-helixtrans-62.2-41.6173.8-81.5-172.3165.692.2-1.9112.8D28 A29 K30 L35 Q36D28-R32 VanDerWaalsContact O-CB 3.27Å; D28-R32 WeakPolarHBondContact O-CB 3.35Å; D28-R32 VanDerWaalsContact O-CG 3.28Å; D28-R32 WeakPolarHBondContact O-CG 3.49Å; D28-R32 PolarHBondContact O-N 3.05Å; D28-R32 IonicContact OD1-CZ 2.62Å; D28-R32 IonicContact OD1-NH1 3.67Å; D28-R32 PolarHBondContact OD1-NH1 3.45Å; D28-R32 IonicContact OD2-CZ 3.77Å; D28-R32 IonicContact OD2-NH1 3.31Å; D28-R32 PolarHBondContact OD2-NH1 3.23Å; A29-R32 PolarHBondContact O-N 3.36Å; K30-R32 VanDerWaalsContact C-N 3.32Å; K30-R32 PolarHBondContact O-N 3.44Å; R32-L35 PolarHBondContact O-N 3.19Å; R32-Q36 WeakPolarHBondContact O-CB 3.45Å; R32-Q36 WeakPolarHBondContact O-CG 3.29Å; R32-Q36 PolarHBondContact O-N 3.07Å
33Q67.9Low60.3Low108 Ų10896.8 Ų96.851%0.50555%0.55SS.*Hα-helixtrans-64.2-42.7177.3-178.6174.7-36.700111.7A29 K30 Q36 R37A29-Q33 VanDerWaalsContact O-CB 3.31Å; A29-Q33 WeakPolarHBondContact O-CB 3.45Å; A29-Q33 PolarHBondContact O-N 3.02Å; K30-Q33 PolarHBondContact O-N 3.32Å; Q33-Q36 PolarHBondContact O-N 2.67Å; Q33-R37 WeakPolarHBondContact O-CB 3.22Å; Q33-R37 PolarHBondContact O-N 3.17Å
34L67.1Low60.7Low51 Ų5194.7 Ų94.727%0.26754%0.544SS..Hα-helixtrans-66-40.9175.6-70.1179.6000111.6K30 L31 R37 S38 T52K30-L34 WeakPolarHBondContact O-CB 3.26Å; K30-L34 VanDerWaalsContact O-CG 3.28Å; K30-L34 WeakPolarHBondContact O-CG 3.28Å; K30-L34 PolarHBondContact O-N 2.93Å; L31-L34 PolarHBondContact O-N 3.39Å; L34-R37 PolarHBondContact O-N 3.08Å; L34-S38 WeakPolarHBondContact O-CB 3.26Å; L34-S38 PolarHBondContact O-N 3.36Å; L34-T52 HydrophobicContact CD1-CG2 4Å; L34-T52 HydrophobicContact CD2-CG2 3.69Å; L34-T52 HydrophobicContact CG-CG2 4.35Å
35L63.8Low61.1Low93 Ų93100.5 Ų100.549%0.48756%0.556SS.*Hα-helixtrans-65.4-45.5174.9-73.3173000111.8L31 R32 R37 S38 L39L31-L35 HydrophobicContact CD1-CD1 4.46Å; L31-L35 HydrophobicContact CG-CD1 4.12Å; L31-L35 WeakPolarHBondContact O-CB 3.43Å; L31-L35 VanDerWaalsContact O-CG 3.23Å; L31-L35 WeakPolarHBondContact O-CG 3.31Å; L31-L35 PolarHBondContact O-N 3Å; R32-L35 PolarHBondContact O-N 3.19Å; L35-R37 VanDerWaalsContact C-N 3.33Å; L35-R37 PolarHBondContact O-N 3.06Å; L35-S38 PolarHBondContact O-N 3.45Å; L35-S38 PolarHBondContact O-OG 3.27Å; L35-L39 WeakPolarHBondContact O-CG 3.39Å; L35-L39 PolarHBondContact O-N 3.09Å
36Q68.1Low61.5Low132 Ų132105.3 Ų105.362%0.61757%0.568SS**Hα-helixtrans-61.3-42174.7-78.1-178.1-75.800111.6R32 Q33 S38 L39 M40R32-Q36 WeakPolarHBondContact O-CB 3.45Å; R32-Q36 WeakPolarHBondContact O-CG 3.29Å; R32-Q36 PolarHBondContact O-N 3.07Å; Q33-Q36 PolarHBondContact O-N 2.67Å; Q36-S38 VanDerWaalsContact C-N 3.3Å; Q36-S38 PolarHBondContact O-N 3.47Å; Q36-L39 PolarHBondContact O-N 3.38Å; Q36-M40 WeakPolarHBondContact O-CB 3.21Å; Q36-M40 WeakPolarHBondContact O-CG 3.47Å; Q36-M40 PolarHBondContact O-N 3.1Å
37R65.4Low61.9Low159 Ų159103.6 Ų103.660%0.655%0.55SS*.Hα-helixtrans-65.6-33.9176.2-166.9168.6-179.386.8-2.2111.9Q33 L34 L35 A41Q33-R37 WeakPolarHBondContact O-CB 3.22Å; Q33-R37 PolarHBondContact O-N 3.17Å; L34-R37 PolarHBondContact O-N 3.08Å; L35-R37 VanDerWaalsContact C-N 3.33Å; L35-R37 PolarHBondContact O-N 3.06Å; R37-A41 VanDerWaalsContact O-CB 3.26Å; R37-A41 WeakPolarHBondContact O-CB 3.44Å; R37-A41 PolarHBondContact O-N 2.9Å; R37-A41 VanDerWaalsContact O-N 3.17Å
38S62.5Low62.3Low42 Ų42103.1 Ų103.129%0.29454%0.541SS..Hα-helixtrans-69.8-34.5173.980.50000113.8L34 L35 Q36L34-S38 WeakPolarHBondContact O-CB 3.26Å; L34-S38 PolarHBondContact O-N 3.36Å; L35-S38 PolarHBondContact O-N 3.45Å; L35-S38 PolarHBondContact O-OG 3.27Å; Q36-S38 VanDerWaalsContact C-N 3.3Å; Q36-S38 PolarHBondContact O-N 3.47Å
39L63.4Low62.7Low147 Ų147101.1 Ų101.177%0.7754%0.538SS*.Hα-helixtrans-76.1-27.8178.5-72.5167.1000112.3L35 Q36L35-L39 WeakPolarHBondContact O-CG 3.39Å; L35-L39 PolarHBondContact O-N 3.09Å; Q36-L39 PolarHBondContact O-N 3.38Å
40M63.8Low62.9Low164 Ų164105.7 Ų105.781%0.80854%0.541SS*.Hα-helixtrans-94.6-13.2-177.7-63.2-109.777.400114Q36Q36-M40 WeakPolarHBondContact O-CB 3.21Å; Q36-M40 WeakPolarHBondContact O-CG 3.47Å; Q36-M40 PolarHBondContact O-N 3.1Å
41A62.5Low63.3Low43 Ų43106.1 Ų106.136%0.35555%0.547SS..  trans-94.2125.6-178.300000111.9R37 A43R37-A41 VanDerWaalsContact O-CB 3.26Å; R37-A41 WeakPolarHBondContact O-CB 3.44Å; R37-A41 PolarHBondContact O-N 2.9Å; R37-A41 VanDerWaalsContact O-N 3.17Å; A41-A43 PolarHBondContact O-N 3.44Å; A41-A43 VanDerWaalsContact O-N 3.11Å
42P56.7Low63.8Low143 Ų143103 Ų10393%0.92953%0.532SS*.  trans-76.812.7174.231.6-33.9000113.3
43A56.9Low64.2Low53 Ų53100.9 Ų100.944%0.43853%0.531SS..SBendtrans-95.7131.4-172.100000110.9A41 E47A41-A43 PolarHBondContact O-N 3.44Å; A41-A43 VanDerWaalsContact O-N 3.11Å; A43-E47 HydrophobicContact CB-CB 3.96Å; A43-E47 HydrophobicContact CB-CG 4.42Å
44G60.2Low64.6Low56 Ų5699.8 Ų99.858%0.57753%0.532SS*.  trans-51.5152.2-178.400000112.8Q46 E47G44-Q46 PolarHBondContact O-N 3.43Å; G44-E47 PolarHBondContact O-N 3.3Å
45K58.6Low65Low197 Ų197100.4 Ų100.486%0.85753%0.533SS*.Hα-helixtrans-41.5-27.5-175.1-62.7174.1180176.30115.2A49K45-A49 WeakPolarHBondContact O-CB 3.37Å; K45-A49 PolarHBondContact O-N 3.07Å
46Q59.1Low65.5Low162 Ų162100.9 Ų100.976%0.75754%0.536SS*.Hα-helixtrans-69.7-40.6178.4-172.316517.300114.4G44 A49 R50G44-Q46 PolarHBondContact O-N 3.43Å; Q46-A49 PolarHBondContact O-N 2.99Å; Q46-R50 WeakPolarHBondContact O-CB 3.23Å; Q46-R50 PolarHBondContact O-N 3.21Å
47E60.8Low65.8Low83 Ų8399.4 Ų99.439%0.38853%0.531SS..Hα-helixtrans-73.6-33.4-180-69.1-58.1139.300111.5A43 G44 N51A43-E47 HydrophobicContact CB-CB 3.96Å; A43-E47 HydrophobicContact CB-CG 4.42Å; G44-E47 PolarHBondContact O-N 3.3Å; E47-N51 VanDerWaalsContact O-CG 3.23Å; E47-N51 PolarHBondContact O-N 3.31Å; E47-N51 VanDerWaalsContact O-N 3.07Å; E47-N51 PolarHBondContact O-ND2 3.46Å
48L64.4Low66.2Low56 Ų5695 Ų9529%0.29353%0.525SS..Hα-helixtrans-62-49.9171-171.583.9000110.8R50 N51 T52L48-R50 VanDerWaalsContact C-N 3.28Å; L48-R50 PolarHBondContact O-N 2.76Å; L48-N51 PolarHBondContact O-N 2.97Å; L48-T52 PolarHBondContact O-N 2.6Å; L48-T52 PolarHBondContact O-OG1 3.04Å; L48-T52 VanDerWaalsContact O-OG1 3.08Å
49A65.4Low66.5Low52 Ų5296.1 Ų96.143%0.4353%0.526SS..Hα-helixtrans-60.4-38.6-179.700000112.1K45 Q46 T52 L53K45-A49 WeakPolarHBondContact O-CB 3.37Å; K45-A49 PolarHBondContact O-N 3.07Å; Q46-A49 PolarHBondContact O-N 2.99Å; A49-T52 VanDerWaalsContact C-OG1 3.29Å; A49-T52 VanDerWaalsContact CA-OG1 3.26Å; A49-T52 WeakPolarHBondContact CA-OG1 3.36Å; A49-T52 PolarHBondContact O-OG1 2.8Å; A49-L53 VanDerWaalsContact O-CB 3.24Å; A49-L53 WeakPolarHBondContact O-CB 3.38Å; A49-L53 PolarHBondContact O-N 3.01Å
50R67Low66.6Low162 Ų16294.6 Ų94.661%0.61152%0.518SS*.Hα-helixtrans-64.5-45.9175.9-172.2-178.7179.2-175.2-0111.6Q46 L48 L53 V54Q46-R50 WeakPolarHBondContact O-CB 3.23Å; Q46-R50 PolarHBondContact O-N 3.21Å; L48-R50 VanDerWaalsContact C-N 3.28Å; L48-R50 PolarHBondContact O-N 2.76Å; R50-L53 PolarHBondContact O-N 3.08Å; R50-V54 WeakPolarHBondContact O-CG2 3.27Å; R50-V54 PolarHBondContact O-N 2.87Å
51N69.9Low66.7Low83 Ų8389.8 Ų89.844%0.44450%0.504SS..Hα-helixtrans-66.8-40.6179.6-68.5-29.7000112.1E47 L48 L53 V54 E55E47-N51 VanDerWaalsContact O-CG 3.23Å; E47-N51 PolarHBondContact O-N 3.31Å; E47-N51 VanDerWaalsContact O-N 3.07Å; E47-N51 PolarHBondContact O-ND2 3.46Å; L48-N51 PolarHBondContact O-N 2.97Å; N51-L53 VanDerWaalsContact C-N 3.31Å; N51-L53 PolarHBondContact O-N 2.93Å; N51-V54 PolarHBondContact O-N 3.41Å; N51-E55 PolarHBondContact O-N 3.41Å; N51-E55 VanDerWaalsContact O-N 3.08Å
52T71.9Confident66.5Low35 Ų3593.3 Ų93.322%0.21551%0.513CS..Hα-helixtrans-63.1-38.4173.846.30000112.3L34 L48 A49 E55 L56L34-T52 HydrophobicContact CD1-CG2 4Å; L34-T52 HydrophobicContact CD2-CG2 3.69Å; L34-T52 HydrophobicContact CG-CG2 4.35Å; L48-T52 PolarHBondContact O-N 2.6Å; L48-T52 PolarHBondContact O-OG1 3.04Å; L48-T52 VanDerWaalsContact O-OG1 3.08Å; A49-T52 VanDerWaalsContact C-OG1 3.29Å; A49-T52 VanDerWaalsContact CA-OG1 3.26Å; A49-T52 WeakPolarHBondContact CA-OG1 3.36Å; A49-T52 PolarHBondContact O-OG1 2.8Å; T52-E55 PolarHBondContact O-N 2.83Å; T52-L56 VanDerWaalsContact O-CG 3.29Å; T52-L56 WeakPolarHBondContact O-CG 3.37Å; T52-L56 PolarHBondContact O-N 3.47Å
53L73.1Confident66.7Low98 Ų9891.1 Ų91.151%0.51350%0.497SS..Hα-helixtrans-66.6-42.7178.7-169.3161.1000110.6A49 R50 N51 E55 L56 L57A49-L53 VanDerWaalsContact O-CB 3.24Å; A49-L53 WeakPolarHBondContact O-CB 3.38Å; A49-L53 PolarHBondContact O-N 3.01Å; R50-L53 PolarHBondContact O-N 3.08Å; N51-L53 VanDerWaalsContact C-N 3.31Å; N51-L53 PolarHBondContact O-N 2.93Å; L53-E55 VanDerWaalsContact C-N 3.32Å; L53-E55 PolarHBondContact O-N 3.11Å; L53-L56 PolarHBondContact O-N 2.87Å; L53-L57 HydrophobicContact CD2-CD1 3.33Å; L53-L57 HydrophobicContact CD2-CG 3.77Å; L53-L57 WeakPolarHBondContact O-CB 3.37Å; L53-L57 WeakPolarHBondContact O-CG 3.45Å; L53-L57 PolarHBondContact O-N 2.98Å
54V75.7Confident66.6Low85 Ų8594.9 Ų94.952%0.51551%0.505SS..Hα-helixtrans-60.3-42.4175.71710000111.5R50 N51 L57 S58R50-V54 WeakPolarHBondContact O-CG2 3.27Å; R50-V54 PolarHBondContact O-N 2.87Å; N51-V54 PolarHBondContact O-N 3.41Å; V54-L57 PolarHBondContact O-N 3.27Å; V54-S58 WeakPolarHBondContact O-CB 3.43Å; V54-S58 PolarHBondContact O-N 3.45Å
55E74.9Confident66.4Low63 Ų6395.9 Ų95.929%0.29450%0.497SS..Hα-helixtrans-64.4-46.9178.3-163.6168-17500111.3N51 T52 L53 L57 S58 E59N51-E55 PolarHBondContact O-N 3.41Å; N51-E55 VanDerWaalsContact O-N 3.08Å; T52-E55 PolarHBondContact O-N 2.83Å; L53-E55 VanDerWaalsContact C-N 3.32Å; L53-E55 PolarHBondContact O-N 3.11Å; E55-L57 PolarHBondContact O-N 2.67Å; E55-S58 PolarHBondContact O-N 3.17Å; E55-S58 VanDerWaalsContact O-N 3.17Å; E55-S58 PolarHBondContact O-OG 3.45Å; E55-E59 PolarHBondContact O-N 3.06Å
56L75.4Confident66.3Low104 Ų10490.8 Ų90.855%0.54548%0.476SS..Hα-helixtrans-61.8-39.8175.6-68.8172.4000113T52 L53 E59 L60T52-L56 VanDerWaalsContact O-CG 3.29Å; T52-L56 WeakPolarHBondContact O-CG 3.37Å; T52-L56 PolarHBondContact O-N 3.47Å; L53-L56 PolarHBondContact O-N 2.87Å; L56-E59 PolarHBondContact O-N 2.87Å; L56-L60 WeakPolarHBondContact O-CG 3.28Å; L56-L60 PolarHBondContact O-N 3.48Å
57L73.6Confident66Low100 Ų10085.9 Ų85.952%0.52446%0.464SS..Hα-helixtrans-66.5-37.6175.3-74.9-177.6000112.1L53 V54 E55 E59 L60 A61L53-L57 HydrophobicContact CD2-CD1 3.33Å; L53-L57 HydrophobicContact CD2-CG 3.77Å; L53-L57 WeakPolarHBondContact O-CB 3.37Å; L53-L57 WeakPolarHBondContact O-CG 3.45Å; L53-L57 PolarHBondContact O-N 2.98Å; V54-L57 PolarHBondContact O-N 3.27Å; E55-L57 PolarHBondContact O-N 2.67Å; L57-E59 VanDerWaalsContact C-N 3.32Å; L57-L60 PolarHBondContact O-N 3.19Å; L57-A61 WeakPolarHBondContact O-CB 3.43Å; L57-A61 PolarHBondContact O-N 3.2Å
58S73.6Confident65.7Low67 Ų6787 Ų8747%0.46947%0.471SS..Hα-helixtrans-65.9-36.6176.8730000112.2V54 E55 H62V54-S58 WeakPolarHBondContact O-CB 3.43Å; V54-S58 PolarHBondContact O-N 3.45Å; E55-S58 PolarHBondContact O-N 3.17Å; E55-S58 VanDerWaalsContact O-N 3.17Å; E55-S58 PolarHBondContact O-OG 3.45Å; S58-H62 WeakPolarHBondContact O-CB 3.37Å; S58-H62 PolarHBondContact O-N 3.44Å
59E69.2Low65Low66 Ų6689.1 Ų89.131%0.30848%0.48SS..Hα-helixtrans-67.1-44.3174.7-73.2173.5-138.500111.8K30 E55 L56 L57 H62 V63K30-E59 IonicContact NZ-OE1 2.87Å; K30-E59 PolarHBondContact NZ-OE1 3.01Å; K30-E59 IonicContact NZ-OE2 2.74Å; K30-E59 PolarHBondContact NZ-OE2 3.48Å; E55-E59 PolarHBondContact O-N 3.06Å; L56-E59 PolarHBondContact O-N 2.87Å; L57-E59 VanDerWaalsContact C-N 3.32Å; E59-H62 PolarHBondContact O-N 2.85Å; E59-V63 WeakPolarHBondContact O-CG2 3.47Å; E59-V63 PolarHBondContact O-N 3.43Å
60L65.3Low64.5Low115 Ų11592.8 Ų92.860%0.60249%0.491SS*.Hα-helixtrans-61.7-44.6176.3-76168000112L56 L57 H62 V63 E64L56-L60 WeakPolarHBondContact O-CG 3.28Å; L56-L60 PolarHBondContact O-N 3.48Å; L57-L60 PolarHBondContact O-N 3.19Å; L60-H62 VanDerWaalsContact C-N 3.26Å; L60-H62 PolarHBondContact O-N 2.84Å; L60-V63 PolarHBondContact O-N 2.87Å; L60-E64 PolarHBondContact O-N 3.36Å
61A66.1Low63.7Low63 Ų6390.3 Ų90.352%0.52149%0.49SS..Hα-helixtrans-62.4-34.3176.800000112.2L57 N65L57-A61 WeakPolarHBondContact O-CB 3.43Å; L57-A61 PolarHBondContact O-N 3.2Å; A61-N65 PolarHBondContact O-N 2.89Å
62H59Low62.7Low117 Ų11791.6 Ų91.654%0.54250%0.497SS..Hα-helixtrans-72.7-42.4177.2-170.734000112.1S58 E59 L60 E64 N65 E66S58-H62 WeakPolarHBondContact O-CB 3.37Å; S58-H62 PolarHBondContact O-N 3.44Å; E59-H62 PolarHBondContact O-N 2.85Å; L60-H62 VanDerWaalsContact C-N 3.26Å; L60-H62 PolarHBondContact O-N 2.84Å; H62-E64 VanDerWaalsContact C-N 3.33Å; H62-E64 PolarHBondContact O-N 2.89Å; H62-N65 WeakPolarHBondContact O-CB 3.31Å; H62-N65 PolarHBondContact O-N 2.96Å; H62-E66 IonicContact CE1-OE1 2.6Å; H62-E66 PolarHBondContact CE1-OE1 3.34Å; H62-E66 VanDerWaalsContact CE1-OE1 3.31Å; H62-E66 IonicContact ND1-OE1 3.89Å; H62-E66 WeakPolarHBondContact O-CG 3.32Å; H62-E66 PolarHBondContact O-N 3.31Å; H62-E66 VanDerWaalsContact O-N 3.16Å
63V60.3Low61.4Low97 Ų9796.6 Ų96.659%0.58852%0.519SS*.Hα-helixtrans-63.8-37.8177.21720000112E59 L60 N65 E66 A67E59-V63 WeakPolarHBondContact O-CG2 3.47Å; E59-V63 PolarHBondContact O-N 3.43Å; L60-V63 PolarHBondContact O-N 2.87Å; V63-N65 VanDerWaalsContact C-N 3.3Å; V63-N65 PolarHBondContact O-N 3.08Å; V63-E66 PolarHBondContact O-N 2.8Å; V63-A67 WeakPolarHBondContact O-CB 3.49Å; V63-A67 PolarHBondContact O-N 3.48Å; V63-A67 VanDerWaalsContact O-N 3.1Å
64E55.1Low60Low132 Ų13295.8 Ų95.862%0.61752%0.522SS*.Hα-helixtrans-62.3-38.3175.2-170.5172.4-176.200111.5L60 H62 I68L60-E64 PolarHBondContact O-N 3.36Å; H62-E64 VanDerWaalsContact C-N 3.33Å; H62-E64 PolarHBondContact O-N 2.89Å; E64-I68 HydrophobicContact CG-CD1 4.22Å; E64-I68 WeakPolarHBondContact O-CD1 3.4Å; E64-I68 VanDerWaalsContact O-CG1 3.25Å; E64-I68 WeakPolarHBondContact O-CG1 3.46Å; E64-I68 PolarHBondContact O-N 3.44Å
65N55.8Low58.7Low76 Ų7698.5 Ų98.541%0.40653%0.529SS..Hα-helixtrans-66.7-45.4176.8-16676000112.5A61 H62 V63 A67 I68 E69A61-N65 PolarHBondContact O-N 2.89Å; H62-N65 WeakPolarHBondContact O-CB 3.31Å; H62-N65 PolarHBondContact O-N 2.96Å; V63-N65 VanDerWaalsContact C-N 3.3Å; V63-N65 PolarHBondContact O-N 3.08Å; N65-A67 VanDerWaalsContact C-N 3.29Å; N65-A67 PolarHBondContact O-N 3.47Å; N65-I68 PolarHBondContact O-N 3.03Å; N65-E69 PolarHBondContact ND2-OE1 2.62Å; N65-E69 PolarHBondContact O-N 2.74Å
66E56.3Low57.1Low91 Ų9198.5 Ų98.543%0.42555%0.546SS..Hα-helixtrans-65.3-32.6179-61.3-65.2133.700112.4H62 V63 L70H62-E66 IonicContact CE1-OE1 2.6Å; H62-E66 PolarHBondContact CE1-OE1 3.34Å; H62-E66 VanDerWaalsContact CE1-OE1 3.31Å; H62-E66 IonicContact ND1-OE1 3.89Å; H62-E66 WeakPolarHBondContact O-CG 3.32Å; H62-E66 PolarHBondContact O-N 3.31Å; H62-E66 VanDerWaalsContact O-N 3.16Å; V63-E66 PolarHBondContact O-N 2.8Å; E66-L70 WeakPolarHBondContact O-CB 3.42Å; E66-L70 PolarHBondContact O-N 3.03Å; E66-L70 VanDerWaalsContact O-N 3.09Å
67A54.3Low55.7Low59 Ų5999.9 Ų99.949%0.48856%0.559SS.*Hα-helixtrans-70.2-35.2176.100000112.4V63 N65 D71V63-A67 WeakPolarHBondContact O-CB 3.49Å; V63-A67 PolarHBondContact O-N 3.48Å; V63-A67 VanDerWaalsContact O-N 3.1Å; N65-A67 VanDerWaalsContact C-N 3.29Å; N65-A67 PolarHBondContact O-N 3.47Å; A67-D71 PolarHBondContact O-N 3.15Å
68I53.1Low54.2Low107 Ų107103.2 Ų103.255%0.54957%0.571SS.*Hα-helixtrans-70-41.7175.3-66.8163.3000110.4E64 N65 L70 D71 D72E64-I68 HydrophobicContact CG-CD1 4.22Å; E64-I68 WeakPolarHBondContact O-CD1 3.4Å; E64-I68 VanDerWaalsContact O-CG1 3.25Å; E64-I68 WeakPolarHBondContact O-CG1 3.46Å; E64-I68 PolarHBondContact O-N 3.44Å; N65-I68 PolarHBondContact O-N 3.03Å; I68-L70 VanDerWaalsContact C-N 3.34Å; I68-L70 PolarHBondContact O-N 3.37Å; I68-D71 PolarHBondContact O-N 3.21Å; I68-D72 PolarHBondContact O-N 3.43Å; I68-D72 VanDerWaalsContact O-N 3.14Å
69E51.1Low52.5Low100 Ų100107.8 Ų107.847%0.46759%0.585SS.*Hα-helixtrans-65.2-36.7176.7-70.4-166.7-169.900112.2N65 D71 D72 M73N65-E69 PolarHBondContact ND2-OE1 2.62Å; N65-E69 PolarHBondContact O-N 2.74Å; E69-D71 VanDerWaalsContact C-N 3.34Å; E69-D71 PolarHBondContact O-N 3.01Å; E69-D72 PolarHBondContact O-N 2.91Å; E69-M73 VanDerWaalsContact O-CG 3.25Å; E69-M73 WeakPolarHBondContact O-CG 3.28Å; E69-M73 PolarHBondContact O-N 2.99Å
70L53.3Low51.2Low129 Ų129113.2 Ų113.268%0.67561%0.611SS**Hα-helixtrans-65.7-33.3174.9-102150.8000113.7E66 I68 S74E66-L70 WeakPolarHBondContact O-CB 3.42Å; E66-L70 PolarHBondContact O-N 3.03Å; E66-L70 VanDerWaalsContact O-N 3.09Å; I68-L70 VanDerWaalsContact C-N 3.34Å; I68-L70 PolarHBondContact O-N 3.37Å; L70-S74 PolarHBondContact O-N 3.39Å
71D50.5Low50.1Low109 Ų109115 Ų11558%0.58362%0.621SS**Hα-helixtrans-71.6-38.8177.1-150.843.8000110.8A67 I68 E69 S74A67-D71 PolarHBondContact O-N 3.15Å; I68-D71 PolarHBondContact O-N 3.21Å; E69-D71 VanDerWaalsContact C-N 3.34Å; E69-D71 PolarHBondContact O-N 3.01Å; D71-S74 PolarHBondContact O-N 2.96Å; D71-S74 PolarHBondContact O-OG 3.31Å
72D48.6Very low49Very low111 Ų111116 Ų11659%0.59462%0.621SS**Hα-helixtrans-71.4-35.2178.7-14824.8000112.4I68 E69 S74 H75 G76I68-D72 PolarHBondContact O-N 3.43Å; I68-D72 VanDerWaalsContact O-N 3.14Å; E69-D72 PolarHBondContact O-N 2.91Å; D72-S74 PolarHBondContact O-N 3.22Å; D72-H75 PolarHBondContact O-N 3.29Å; D72-G76 PolarHBondContact O-N 3.11Å
73M44.7Very low48.5Very low139 Ų139117.2 Ų117.269%0.68563%0.631SS**Hα-helixtrans-71.1-15.9173.6-64.4-52.6122.200113.7E69E69-M73 VanDerWaalsContact O-CG 3.25Å; E69-M73 WeakPolarHBondContact O-CG 3.28Å; E69-M73 PolarHBondContact O-N 2.99Å
74S45.4Very low48Very low81 Ų81120 Ų12057%0.56664%0.641SS**Hα-helixtrans-82.6-20.8174.582.90000113L70 D71 D72L70-S74 PolarHBondContact O-N 3.39Å; D71-S74 PolarHBondContact O-N 2.96Å; D71-S74 PolarHBondContact O-OG 3.31Å; D72-S74 PolarHBondContact O-N 3.22Å
75H47.3Very low47.6Very low142 Ų142121.1 Ų121.166%0.65765%0.647SS**Hα-helixtrans-98.4-14.4177.9-81.9-73.5000113.6D72 V77D72-H75 PolarHBondContact O-N 3.29Å; H75-V77 VanDerWaalsContact C-N 3.3Å; H75-V77 PolarHBondContact O-N 3.38Å
76G41.3Very low47.5Very low64 Ų64125.5 Ų125.566%0.6667%0.67SS**THydrogen-bonded Turntrans-7828.1-17300000118.3D72D72-G76 PolarHBondContact O-N 3.11Å
77V46.2Very low47.2Very low133 Ų133128.9 Ų128.981%0.80669%0.685SS**THydrogen-bonded Turntrans-110.7-11.2172.4-177.20000113.4H75H75-V77 VanDerWaalsContact C-N 3.3Å; H75-V77 PolarHBondContact O-N 3.38Å
78E41.1Very low47.2Very low169 Ų169136.5 Ų136.579%0.7970%0.701SS**SBendtrans-142.265.4179.6-63.4-159.2162.500114.2
79Q38.9Very low47.3Very low164 Ų164135.1 Ų135.177%0.76671%0.706SS**  trans-163.294.2143.1-133.4142.585.300112.6V82Q79-V82 HydrophobicContact CG-CG2 4.23Å
80E40.8Very low47.1Very low179 Ų179135.7 Ų135.784%0.83672%0.718SS**  trans-56.3133151.1-145.2164.4166.800108.3
81D43.8Very low47.3Very low152 Ų152132 Ų13281%0.81371%0.711SS**  trans54.685.1167.1-64.6-39000118.7
82V42.3Very low47.6Very low86 Ų86132 Ų13252%0.52172%0.717SS.*  trans-137.7107148-171.10000109.3Q79 L84Q79-V82 HydrophobicContact CG-CG2 4.23Å; V82-L84 VanDerWaalsContact C-N 3.31Å; V82-L84 HydrophobicContact CG1-CG 4.38Å; V82-L84 PolarHBondContact O-N 2.96Å
83D47.8Very low48.1Very low142 Ų142133.1 Ų133.176%0.75973%0.728SS**  trans-48.995.8157.1-176.630.2000108.8E85D83-E85 PolarHBondContact O-N 2.95Å
84L50.6Low48.8Very low154 Ų154132.3 Ų132.381%0.80673%0.726SS**  trans-83.774.9176.4-80.3150000107.6V82 L86V82-L84 VanDerWaalsContact C-N 3.31Å; V82-L84 HydrophobicContact CG1-CG 4.38Å; V82-L84 PolarHBondContact O-N 2.96Å; L84-L86 PolarHBondContact O-N 3.35Å
85E46.4Very low49.2Very low157 Ų157131.7 Ų131.773%0.73473%0.726SS**  trans-49.3114.7160.9-142.4174.5131.200107.1D83 E87D83-E85 PolarHBondContact O-N 2.95Å; E85-E87 PolarHBondContact O-N 3.39Å
86L53.2Low49.5Very low168 Ų168131 Ų13188%0.8873%0.733SS**  trans-66.878.9179.3-176.471.8000108.8L84 R88L84-L86 PolarHBondContact O-N 3.35Å; L86-R88 VanDerWaalsContact C-N 3.27Å; L86-R88 PolarHBondContact O-N 3.44Å
87E51.1Low50.4Low162 Ų162135.9 Ų135.976%0.75773%0.732SS**  trans-62.494.9165.8-96.6-83.989.300106.8E85 A89E85-E87 PolarHBondContact O-N 3.39Å; E87-A89 VanDerWaalsContact C-N 3.3Å; E87-A89 PolarHBondContact O-N 2.89Å
88R53.8Low50.8Low219 Ų219138.6 Ų138.683%0.82674%0.736SS**  trans-55.4101.2165.8-179.8-175.8-172.982.50.3105.9L86 P90L86-R88 VanDerWaalsContact C-N 3.27Å; L86-R88 PolarHBondContact O-N 3.44Å; R88-P90 VanDerWaalsContact O-N 3.08Å
89A55.3Low51.6Low78 Ų78140 Ų14065%0.64573%0.734SS**  trans-42.8123.5175.300000108.4E87 G91E87-A89 VanDerWaalsContact C-N 3.3Å; E87-A89 PolarHBondContact O-N 2.89Å; A89-G91 PolarHBondContact O-N 3.46Å
90P46.5Very low52.3Low112 Ų112139.9 Ų139.973%0.72773%0.731SS**  trans-65.698.1174.925.5-29.5000105.2R88R88-P90 VanDerWaalsContact O-N 3.08Å
91G57.6Low53.1Low51 Ų51136.4 Ų136.453%0.52673%0.733SS.*  trans-47.6141.6167.300000107.1A89 V93A89-G91 PolarHBondContact O-N 3.46Å; G91-V93 PolarHBondContact O-N 2.72Å
92P56Low53.8Low109 Ų109133.2 Ų133.271%0.70874%0.736SS**  trans-47.9120-172.118.1-30.6000107.9L94P92-L94 HydrophobicContact CB-CD2 4.46Å; P92-L94 WeakPolarHBondContact O-CG 3.41Å; P92-L94 PolarHBondContact O-N 3.32Å
93V60.6Low54.6Low135 Ų135131.7 Ų131.782%0.81873%0.728SS**  trans-6191.2178.8177.60000105.3G91 A95G91-V93 PolarHBondContact O-N 2.72Å; V93-A95 PolarHBondContact O-N 3.01Å
94L58.1Low55.3Low122 Ų122133.8 Ų133.864%0.63973%0.731SS**  trans-69.694.6176.5-65.8-176000104.1P92P92-L94 HydrophobicContact CB-CD2 4.46Å; P92-L94 WeakPolarHBondContact O-CG 3.41Å; P92-L94 PolarHBondContact O-N 3.32Å
95A54.1Low55.6Low68 Ų68131.4 Ų131.456%0.56272%0.719SS**  trans-41138.6170.900000108.4V93 R97V93-A95 PolarHBondContact O-N 3.01Å; A95-R97 PolarHBondContact O-N 3.5Å
96P54.9Low56Low126 Ų126130.7 Ų130.782%0.81871%0.714SS**  trans-47.8103.8-179.3-27.734.3000109.5E98P96-E98 VanDerWaalsContact C-N 3.33Å; P96-E98 PolarHBondContact O-N 2.93Å
97R59.4Low56.1Low167 Ų167130.5 Ų130.563%0.6371%0.706SS**  trans-71.398.7179.8-92.7-175.3161.7104.3-3.2106A95 R99 F107A95-R97 PolarHBondContact O-N 3.5Å; R97-R99 PolarHBondContact O-N 3.42Å; R97-F107 HydrophobicContact CB-CZ 4.32Å
98E54.8Low56.2Low190 Ų190133.9 Ų133.989%0.88871%0.712SS**PPolyproline II helixtrans-54.2127.1176-73.3-165.6160.200109.7P96 K100P96-E98 VanDerWaalsContact C-N 3.33Å; P96-E98 PolarHBondContact O-N 2.93Å; E98-K100 PolarHBondContact O-N 2.95Å
99R57.2Low56.3Low199 Ų199131 Ų13175%0.75171%0.705SS**PPolyproline II helixtrans-78.6118.4171.8-66.6-177.1175.1166-0.6107.5R97 A101R97-R99 PolarHBondContact O-N 3.42Å; R99-A101 PolarHBondContact O-N 2.97Å
100K54.7Low56.4Low161 Ų161132.5 Ų132.570%0.771%0.707SS**PPolyproline II helixtrans-60.2121165.1-158.2175.1-174.4-172.50107.5E98 G102 C103E98-K100 PolarHBondContact O-N 2.95Å; K100-G102 PolarHBondContact O-N 3.42Å; K100-G102 VanDerWaalsContact O-N 3.12Å; K100-C103 PolarHBondContact O-N 3.35Å
101A56.3Low56.8Low106 Ų106137.4 Ų137.488%0.87672%0.717SS**THydrogen-bonded Turntrans-54.7119.4-176.900000110.1R99R99-A101 PolarHBondContact O-N 2.97Å
102G59.4Low56.5Low86 Ų86137.8 Ų137.889%0.88771%0.709SS**THydrogen-bonded Turntrans116.2-6.4175.100000117.2K100K100-G102 PolarHBondContact O-N 3.42Å; K100-G102 VanDerWaalsContact O-N 3.12Å
103C58.6Low56.4Low53 Ų53137.9 Ų137.936%0.35871%0.713SS.*  trans-100.5114.3-178-138.10000111.5K100 C114K100-C103 PolarHBondContact O-N 3.35Å; C103-C114 HydrophobicContact CB-CB 4.23Å; C103-C114 WeakPolarHBondContact CB-SG 3.31Å; C103-C114 WeakPolarHBondContact SG-CB 3.37Å; C103-C114 CovalentContact SG-SG 2.06Å; C103-C114 PolarHBondContact SG-SG 2.98Å
104K63.8Low56Low186 Ų186137.2 Ų137.281%0.80971%0.713SS**  trans-100.810-168.6-157.4173.8177.5178.60114.6F106K104-F106 PolarHBondContact O-N 3.34Å
105N55.8Low55.9Low105 Ų105138 Ų13856%0.56172%0.716SS**  trans-86.7115.7179.5-68.2-36.5000110.5T112N105-T112 WeakPolarHBondContact CB-OG1 3.48Å; N105-T112 PolarHBondContact ND2-OG1 3.46Å
106F55.3Low56Low141 Ų141141.7 Ų141.762%0.61872%0.724SS**  trans-67.9143.1176.7-85-101.5000110.7K104 W108 K109K104-F106 PolarHBondContact O-N 3.34Å; F106-W108 PolarHBondContact O-N 3.17Å; F106-K109 PolarHBondContact O-N 3.47Å
107F55.5Low56Low164 Ų164142.6 Ų142.672%0.71972%0.719SS**THydrogen-bonded Turntrans-46.8-12.8-171-92-91.5000118.7R97R97-F107 HydrophobicContact CB-CZ 4.32Å
108W51.9Low55.8Low233 Ų233141.1 Ų141.188%0.88373%0.725SS**THydrogen-bonded Turntrans-99.2-10.5-177.169.4-53.4000113.8F106F106-W108 PolarHBondContact O-N 3.17Å
109K57Low55.9Low158 Ų158138.1 Ų138.169%0.68771%0.714SS**SBendtrans-118.474.6178.8-152.1172.8-162.4173.30110.8F106F106-K109 PolarHBondContact O-N 3.47Å
110T57Low55.8Low110 Ų110134 Ų13468%0.67571%0.712SS**  trans56.5144.7165.656.90000117.1T112T110-T112 PolarHBondContact O-N 2.86Å; T110-T112 PolarHBondContact O-OG1 3.07Å
111F54.5Low55.9Low215 Ų215132.1 Ų132.194%0.94371%0.713SS**  trans-6273.1175.1-147.4-90.2000109.3S113F111-S113 PolarHBondContact O-N 3.28Å
112T52.5Low55.9Low60 Ų60134.1 Ų134.137%0.36870%0.7SS.*  trans-86.8107.8-179.543.30000106.4N105 T110 C114N105-T112 WeakPolarHBondContact CB-OG1 3.48Å; N105-T112 PolarHBondContact ND2-OG1 3.46Å; T110-T112 PolarHBondContact O-N 2.86Å; T110-T112 PolarHBondContact O-OG1 3.07Å; T112-C114 PolarHBondContact O-N 2.95Å
113S52.9Low55.6Low111 Ų111138.1 Ų138.178%0.77669%0.685SS**  trans-46.5118.8173.952.20000110.6F111F111-S113 PolarHBondContact O-N 3.28Å
114C52.1Low55.3Low121 Ų121145.8 Ų145.882%0.81871%0.714SS**  trans-85.60137.512.70000107.3C103 T112C103-C114 HydrophobicContact CB-CB 4.23Å; C103-C114 WeakPolarHBondContact CB-SG 3.31Å; C103-C114 WeakPolarHBondContact SG-CB 3.37Å; C103-C114 CovalentContact SG-SG 2.06Å; C103-C114 PolarHBondContact SG-SG 2.98Å; T112-C114 PolarHBondContact O-N 2.95Å

Retrieved 114 of 114 residues in 58.1 ms (Link to these results)