A0A096NHV7_PAPAN Loading...

BAF chromatin remodeling complex subunit BCL7C

AlphaFold DB (A0A2K6KWP2), UniProt , Accession A0A096NHV7, Species PAPAN (Papio anubis, Olive baboon), Gene BCL7C, Length 242 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
1M59.8Low67.6Low240 Ų240131.1 Ų131.1100%1.18268%0.684SS**  029.50-70.1-174.6174.400113.6
2A59.8Low68.8Low76 Ų76124.5 Ų124.563%0.62866%0.657SS**  trans-95.1-15.3-172.400000115.7R4 T5A2-R4 VanDerWaalsContact C-N 3.34Å; A2-R4 PolarHBondContact O-N 3.27Å; A2-T5 PolarHBondContact O-OG1 3.22Å
3G61.8Low70.1Confident63 Ų63126.9 Ų126.965%0.64965%0.652SS**Hα-helixtrans-76.7-12.7-175.800000115.8
4R63.8Low71.5Confident224 Ų224121.6 Ų121.685%0.84564%0.636SS**Hα-helixtrans-81.3-30.8-176.9-70.4-175.7172.5-170.3-2.2113A2 A8A2-R4 VanDerWaalsContact C-N 3.34Å; A2-R4 PolarHBondContact O-N 3.27Å; R4-A8 PolarHBondContact O-N 3.24Å
5T64.3Low72.7Confident94 Ų94120.5 Ų120.558%0.57762%0.624SS**Hα-helixtrans-79.9-39.5-176.347.90000112.8A2 R7 A8 E9A2-T5 PolarHBondContact O-OG1 3.22Å; T5-R7 PolarHBondContact O-N 3.22Å; T5-A8 WeakPolarHBondContact O-CB 3.4Å; T5-A8 PolarHBondContact O-N 3.11Å; T5-A8 VanDerWaalsContact O-N 3.11Å; T5-E9 PolarHBondContact O-N 3.31Å
6V68.2Low74Confident97 Ų97117.8 Ų117.859%0.58861%0.611SS**Hα-helixtrans-60.1-45.3179-178.80000111.3A8 E9 T10V6-A8 VanDerWaalsContact C-N 3.3Å; V6-A8 PolarHBondContact O-N 3.48Å; V6-E9 PolarHBondContact O-N 3.21Å; V6-T10 PolarHBondContact O-N 3.36Å; V6-T10 PolarHBondContact O-OG1 3.3Å; V6-T10 VanDerWaalsContact O-OG1 3.09Å
7R69.9Low75Confident211 Ų211116.6 Ų116.680%0.79661%0.606SS**Hα-helixtrans-65.5-33.1176.6-173.3174.5-178.4155.51112.8T5 R11T5-R7 PolarHBondContact O-N 3.22Å; R7-R11 WeakPolarHBondContact O-CB 3.33Å; R7-R11 PolarHBondContact O-N 3.06Å
8A72.5Confident76.1Confident62 Ų62115.7 Ų115.751%0.51260%0.601SS.*Hα-helixtrans-69.5-39.9175.200000111.3R4 T5 V6 R11 S12R4-A8 PolarHBondContact O-N 3.24Å; T5-A8 WeakPolarHBondContact O-CB 3.4Å; T5-A8 PolarHBondContact O-N 3.11Å; T5-A8 VanDerWaalsContact O-N 3.11Å; V6-A8 VanDerWaalsContact C-N 3.3Å; V6-A8 PolarHBondContact O-N 3.48Å; A8-R11 PolarHBondContact O-N 2.99Å; A8-S12 PolarHBondContact O-N 2.72Å; A8-S12 VanDerWaalsContact O-N 3.11Å
9E72.6Confident77.1Confident110 Ų110116.3 Ų116.351%0.51460%0.598SS.*Hα-helixtrans-67.5-41.9178.6-168178.1121.300112.7T5 V6 R11 S12 R13T5-E9 PolarHBondContact O-N 3.31Å; V6-E9 PolarHBondContact O-N 3.21Å; E9-R11 PolarHBondContact O-N 2.89Å; E9-S12 PolarHBondContact O-N 2.81Å; E9-S12 PolarHBondContact O-OG 3.19Å; E9-R13 PolarHBondContact O-N 2.79Å; E9-R13 IonicContact OE1-CZ 3.49Å; E9-R13 IonicContact OE1-NE 2.78Å; E9-R13 IonicContact OE1-NH2 3.18Å; E9-R13 PolarHBondContact OE1-NH2 3Å
10T76.3Confident78Confident96 Ų96117.8 Ų117.859%0.58960%0.6SS**Hα-helixtrans-63.5-34.6175.6-46.50000111.7V6 A14V6-T10 PolarHBondContact O-N 3.36Å; V6-T10 PolarHBondContact O-OG1 3.3Å; V6-T10 VanDerWaalsContact O-OG1 3.09Å; T10-A14 PolarHBondContact O-N 3.18Å
11R74.6Confident78.9Confident169 Ų169116.1 Ų116.164%0.63860%0.595SS**Hα-helixtrans-73.8-28.9178.7-168.8176.9-173.4-168.93.2113R7 A8 E9 K15R7-R11 WeakPolarHBondContact O-CB 3.33Å; R7-R11 PolarHBondContact O-N 3.06Å; A8-R11 PolarHBondContact O-N 2.99Å; E9-R11 PolarHBondContact O-N 2.89Å; R11-K15 HydrophobicContact CG-CD 4.46Å; R11-K15 VanDerWaalsContact O-CG 3.31Å; R11-K15 WeakPolarHBondContact O-CG 3.47Å; R11-K15 PolarHBondContact O-N 2.82Å
12S81.4Confident80.6Confident52 Ų52109.7 Ų109.736%0.36456%0.564SS.*Hα-helixtrans-70.6-48.8176.458.40000110.9A8 E9 A14 K15 D16A8-S12 PolarHBondContact O-N 2.72Å; A8-S12 VanDerWaalsContact O-N 3.11Å; E9-S12 PolarHBondContact O-N 2.81Å; E9-S12 PolarHBondContact O-OG 3.19Å; S12-A14 PolarHBondContact O-N 3.43Å; S12-K15 WeakPolarHBondContact O-CB 3.39Å; S12-K15 PolarHBondContact O-N 3.35Å; S12-D16 PolarHBondContact O-N 2.8Å
13R85.9Confident82.2Confident156 Ų156108 Ų10859%0.58955%0.55SS*.Hα-helixtrans-54-51.1180-66-173-166.9-161.76.2112.7E9 K15 D16 D17E9-R13 PolarHBondContact O-N 2.79Å; E9-R13 IonicContact OE1-CZ 3.49Å; E9-R13 IonicContact OE1-NE 2.78Å; E9-R13 IonicContact OE1-NH2 3.18Å; E9-R13 PolarHBondContact OE1-NH2 3Å; R13-K15 VanDerWaalsContact C-N 3.26Å; R13-K15 PolarHBondContact O-N 3.27Å; R13-D16 PolarHBondContact O-N 2.88Å; R13-D17 PolarHBondContact O-N 3.42Å
14A89.6Confident83.7Confident53 Ų53108.4 Ų108.444%0.43854%0.54SS..Hα-helixtrans-59.3-36.1178.800000113T10 S12 I18T10-A14 PolarHBondContact O-N 3.18Å; S12-A14 PolarHBondContact O-N 3.43Å; A14-I18 WeakPolarHBondContact O-CD1 3.35Å; A14-I18 VanDerWaalsContact O-CG1 3.27Å; A14-I18 WeakPolarHBondContact O-CG1 3.39Å; A14-I18 PolarHBondContact O-N 3.34Å
15K90.1Very high85.2Confident105 Ų105101.2 Ų101.246%0.45752%0.517SS..Hα-helixtrans-71.9-36.2176-74.2177.2174.4-1720112.3R11 S12 R13 K19R11-K15 HydrophobicContact CG-CD 4.46Å; R11-K15 VanDerWaalsContact O-CG 3.31Å; R11-K15 WeakPolarHBondContact O-CG 3.47Å; R11-K15 PolarHBondContact O-N 2.82Å; S12-K15 WeakPolarHBondContact O-CB 3.39Å; S12-K15 PolarHBondContact O-N 3.35Å; R13-K15 VanDerWaalsContact C-N 3.26Å; R13-K15 PolarHBondContact O-N 3.27Å; K15-K19 WeakPolarHBondContact O-CG 3.36Å; K15-K19 PolarHBondContact O-N 3.41Å; K15-K19 VanDerWaalsContact O-N 3.09Å
16D92.7Very high86.6Confident76 Ų76102 Ų10241%0.40651%0.514SS..Hα-helixtrans-72.9-34.8178.4-64.7-45.9000111.7S12 R13 K19 K20S12-D16 PolarHBondContact O-N 2.8Å; R13-D16 PolarHBondContact O-N 2.88Å; D16-K19 PolarHBondContact O-N 2.7Å; D16-K19 IonicContact OD1-NZ 2.84Å; D16-K19 PolarHBondContact OD1-NZ 3.18Å; D16-K20 WeakPolarHBondContact O-CB 3.13Å; D16-K20 PolarHBondContact O-N 3.05Å
17D92.1Very high87.7Confident98 Ų98102 Ų10252%0.52451%0.506SS..Hα-helixtrans-61.4-45171.3-70.3-29000111.3R13 K19 K20 V21R13-D17 PolarHBondContact O-N 3.42Å; D17-K19 PolarHBondContact O-N 3.41Å; D17-K20 WeakPolarHBondContact O-CB 3.39Å; D17-K20 PolarHBondContact O-N 3.02Å; D17-V21 WeakPolarHBondContact O-CG2 3.4Å; D17-V21 PolarHBondContact O-N 3.19Å
18I94.1Very high88.9Confident101 Ų10195.8 Ų95.852%0.51849%0.492SS..Hα-helixtrans-60-46.8174.8-68.8163.4000110.6A14 K20 V21 M22A14-I18 WeakPolarHBondContact O-CD1 3.35Å; A14-I18 VanDerWaalsContact O-CG1 3.27Å; A14-I18 WeakPolarHBondContact O-CG1 3.39Å; A14-I18 PolarHBondContact O-N 3.34Å; I18-K20 VanDerWaalsContact C-N 3.3Å; I18-K20 PolarHBondContact O-N 2.96Å; I18-V21 PolarHBondContact O-N 3.36Å; I18-M22 HydrophobicContact CG2-CE 4.43Å; I18-M22 HydrophobicContact CG2-CG 4.33Å; I18-M22 VanDerWaalsContact O-CG 3.28Å; I18-M22 WeakPolarHBondContact O-CG 3.11Å; I18-M22 PolarHBondContact O-N 2.95Å
19K95Very high89.9Confident126 Ų126102.9 Ų102.955%0.54851%0.505SS..Hα-helixtrans-60.6-40.4176.5-69.2172.4-161.31570111.8K15 D16 D17 M22 A23K15-K19 WeakPolarHBondContact O-CG 3.36Å; K15-K19 PolarHBondContact O-N 3.41Å; K15-K19 VanDerWaalsContact O-N 3.09Å; D16-K19 PolarHBondContact O-N 2.7Å; D16-K19 IonicContact OD1-NZ 2.84Å; D16-K19 PolarHBondContact OD1-NZ 3.18Å; D17-K19 PolarHBondContact O-N 3.41Å; K19-M22 PolarHBondContact O-N 3.34Å; K19-A23 VanDerWaalsContact O-CB 3.3Å; K19-A23 WeakPolarHBondContact O-CB 3.17Å; K19-A23 PolarHBondContact O-N 2.83Å
20K95.1Very high90.9Very high147 Ų147102.1 Ų102.164%0.63950%0.498SS*.Hα-helixtrans-63.6-43.2177.9-173.8-178.4179-175.20111D16 D17 I18 T24D16-K20 WeakPolarHBondContact O-CB 3.13Å; D16-K20 PolarHBondContact O-N 3.05Å; D17-K20 WeakPolarHBondContact O-CB 3.39Å; D17-K20 PolarHBondContact O-N 3.02Å; I18-K20 VanDerWaalsContact C-N 3.3Å; I18-K20 PolarHBondContact O-N 2.96Å; K20-T24 WeakPolarHBondContact O-CB 3.42Å; K20-T24 PolarHBondContact O-N 3.32Å; K20-T24 PolarHBondContact O-OG1 2.88Å
21V96.6Very high91.9Very high83 Ų83102.7 Ų102.750%0.50349%0.489SS..Hα-helixtrans-62-50174.8169.50000110.3D17 I18 A23 T24 I25D17-V21 WeakPolarHBondContact O-CG2 3.4Å; D17-V21 PolarHBondContact O-N 3.19Å; I18-V21 PolarHBondContact O-N 3.36Å; V21-A23 PolarHBondContact O-N 3.26Å; V21-T24 PolarHBondContact O-N 3.49Å; V21-T24 VanDerWaalsContact O-N 3.12Å; V21-I25 HydrophobicContact CG1-CD1 3.64Å; V21-I25 HydrophobicContact CG1-CG1 4.32Å; V21-I25 WeakPolarHBondContact O-CB 3.39Å; V21-I25 VanDerWaalsContact O-CG1 3.28Å; V21-I25 WeakPolarHBondContact O-CG1 3.45Å; V21-I25 PolarHBondContact O-N 2.77Å
22M96.7Very high92.9Very high104 Ų10497.8 Ų97.851%0.51247%0.473SS..Hα-helixtrans-59-46.1178.2-67.3-60.2176.800111.9I18 K19 T24 I25 E26I18-M22 HydrophobicContact CG2-CE 4.43Å; I18-M22 HydrophobicContact CG2-CG 4.33Å; I18-M22 VanDerWaalsContact O-CG 3.28Å; I18-M22 WeakPolarHBondContact O-CG 3.11Å; I18-M22 PolarHBondContact O-N 2.95Å; K19-M22 PolarHBondContact O-N 3.34Å; M22-T24 VanDerWaalsContact C-N 3.3Å; M22-T24 PolarHBondContact O-N 3.18Å; M22-I25 PolarHBondContact O-N 3.42Å; M22-E26 WeakPolarHBondContact O-CB 3.5Å; M22-E26 WeakPolarHBondContact O-CG 3.39Å; M22-E26 PolarHBondContact O-N 3.08Å
23A93.4Very high93.6Very high41 Ų41100.9 Ų100.934%0.33948%0.48SS..Hα-helixtrans-64-34.5176.800000112.5K19 V21 K27K19-A23 VanDerWaalsContact O-CB 3.3Å; K19-A23 WeakPolarHBondContact O-CB 3.17Å; K19-A23 PolarHBondContact O-N 2.83Å; V21-A23 PolarHBondContact O-N 3.26Å; A23-K27 VanDerWaalsContact O-CG 3.26Å; A23-K27 WeakPolarHBondContact O-CG 3.16Å; A23-K27 PolarHBondContact O-N 2.65Å
24T93.6Very high94.1Very high71 Ų71100 Ų10044%0.43648%0.477SS..Hα-helixtrans-70.7-41.9176-570000110.9K20 V21 M22 K27 V28K20-T24 WeakPolarHBondContact O-CB 3.42Å; K20-T24 PolarHBondContact O-N 3.32Å; K20-T24 PolarHBondContact O-OG1 2.88Å; V21-T24 PolarHBondContact O-N 3.49Å; V21-T24 VanDerWaalsContact O-N 3.12Å; M22-T24 VanDerWaalsContact C-N 3.3Å; M22-T24 PolarHBondContact O-N 3.18Å; T24-K27 WeakPolarHBondContact O-CB 3.48Å; T24-K27 PolarHBondContact O-N 2.78Å; T24-V28 WeakPolarHBondContact O-CG2 3.32Å; T24-V28 PolarHBondContact O-N 3.44Å
25I94.9Very high94.4Very high74 Ų74103.5 Ų103.538%0.37948%0.479SS..Hα-helixtrans-60-48173.3-70.3168.4000110V21 M22 K27 V28 R29V21-I25 HydrophobicContact CG1-CD1 3.64Å; V21-I25 HydrophobicContact CG1-CG1 4.32Å; V21-I25 WeakPolarHBondContact O-CB 3.39Å; V21-I25 VanDerWaalsContact O-CG1 3.28Å; V21-I25 WeakPolarHBondContact O-CG1 3.45Å; V21-I25 PolarHBondContact O-N 2.77Å; M22-I25 PolarHBondContact O-N 3.42Å; I25-K27 VanDerWaalsContact C-N 3.29Å; I25-K27 PolarHBondContact O-N 2.95Å; I25-V28 PolarHBondContact O-N 3.1Å; I25-R29 HydrophobicContact CG2-CG 4.22Å; I25-R29 WeakPolarHBondContact O-CB 3.41Å; I25-R29 VanDerWaalsContact O-CG 3.23Å; I25-R29 WeakPolarHBondContact O-CG 3.46Å; I25-R29 PolarHBondContact O-N 3.23Å
26E92.9Very high94.6Very high109 Ų109101 Ų10151%0.50947%0.472SS..Hα-helixtrans-58-40.4176.9-76.9178-178.300112.1M22 R29 R30M22-E26 WeakPolarHBondContact O-CB 3.5Å; M22-E26 WeakPolarHBondContact O-CG 3.39Å; M22-E26 PolarHBondContact O-N 3.08Å; E26-R29 PolarHBondContact O-N 3.38Å; E26-R30 WeakPolarHBondContact O-CG 3.43Å; E26-R30 PolarHBondContact O-N 3.22Å
27K91.3Very high94.7Very high97 Ų97101.2 Ų101.242%0.42248%0.477SS..Hα-helixtrans-62.5-46.3175-74.4170.5-173.2-179.30112.4A23 T24 I25 R29 R30 W31A23-K27 VanDerWaalsContact O-CG 3.26Å; A23-K27 WeakPolarHBondContact O-CG 3.16Å; A23-K27 PolarHBondContact O-N 2.65Å; T24-K27 WeakPolarHBondContact O-CB 3.48Å; T24-K27 PolarHBondContact O-N 2.78Å; I25-K27 VanDerWaalsContact C-N 3.29Å; I25-K27 PolarHBondContact O-N 2.95Å; K27-R29 VanDerWaalsContact C-N 3.32Å; K27-R30 PolarHBondContact O-N 3.25Å; K27-W31 PolarHBondContact O-NE1 3.13Å
28V94.5Very high94.8Very high82 Ų8299.4 Ų99.450%0.49747%0.469SS..Hα-helixtrans-67.2-35.6179.61760000111.2T24 I25 R30 W31T24-V28 WeakPolarHBondContact O-CG2 3.32Å; T24-V28 PolarHBondContact O-N 3.44Å; I25-V28 PolarHBondContact O-N 3.1Å; V28-R30 PolarHBondContact O-N 2.87Å; V28-W31 WeakPolarHBondContact O-CB 3.46Å; V28-W31 PolarHBondContact O-N 3.07Å
29R94.6Very high94.6Very high210 Ų21097.8 Ų97.879%0.79248%0.478SS*.Hα-helixtrans-64.4-20.2177.3-73.1174.789.1147.110.2113.9I25 E26 K27I25-R29 HydrophobicContact CG2-CG 4.22Å; I25-R29 WeakPolarHBondContact O-CB 3.41Å; I25-R29 VanDerWaalsContact O-CG 3.23Å; I25-R29 WeakPolarHBondContact O-CG 3.46Å; I25-R29 PolarHBondContact O-N 3.23Å; E26-R29 PolarHBondContact O-N 3.38Å; K27-R29 VanDerWaalsContact C-N 3.32Å
30R94.1Very high94.2Very high95 Ų9599.8 Ų99.836%0.35849%0.494SS..THydrogen-bonded Turntrans-88.6-0.6175.6-67.3176.1-175.8170.80.2113.1E26 K27 V28 E32 V51 D53 E56E26-R30 WeakPolarHBondContact O-CG 3.43Å; E26-R30 PolarHBondContact O-N 3.22Å; K27-R30 PolarHBondContact O-N 3.25Å; V28-R30 PolarHBondContact O-N 2.87Å; R30-E32 PolarHBondContact O-N 2.79Å; R30-V51 WeakPolarHBondContact O-CB 3.45Å; R30-V51 WeakPolarHBondContact O-CG2 3.23Å; R30-D53 IonicContact CZ-OD2 3.84Å; R30-D53 IonicContact NE-OD2 3.94Å; R30-D53 IonicContact NH1-OD2 2.96Å; R30-D53 PolarHBondContact NH1-OD2 3.28Å; R30-E56 IonicContact NH1-OE2 3.69Å; R30-E56 PolarHBondContact NH1-OE2 2.91Å
31W96Very high94Very high108 Ų10896 Ų9641%0.40948%0.484SS..  trans-65135178.6-72.924000109.9K27 V28 W48 V49 P50K27-W31 PolarHBondContact O-NE1 3.13Å; V28-W31 WeakPolarHBondContact O-CB 3.46Å; V28-W31 PolarHBondContact O-N 3.07Å; W31-W48 HydrophobicContact CB-CB 4.38Å; W31-W48 HydrophobicContact CB-CE3 4.16Å; W31-W48 HydrophobicContact CD2-CB 4.5Å; W31-W48 HydrophobicContact CE3-CB 3.56Å; W31-W48 HydrophobicContact CZ3-CB 4.24Å; W31-W48 WeakPolarHBondContact O-CZ3 3.28Å; W31-V49 WeakPolarHBondContact CA-O 3.49Å; W31-P50 HydrophobicContact CZ2-CG 4.01Å
32E95.7Very high93.6Very high65 Ų6597.6 Ų97.630%0.30450%0.498SS..EExtended strand (participates in β ladder)trans-110142.7178.967.2178-171.600110.5R30 R34 W48 V49 V51R30-E32 PolarHBondContact O-N 2.79Å; E32-R34 HydrophobicContact CG-CG 3.67Å; E32-R34 PolarHBondContact O-N 2.9Å; E32-R34 WeakPolarHBondContact OE1-CG 3.46Å; E32-R34 IonicContact OE1-CZ 3.51Å; E32-R34 IonicContact OE1-NE 2.65Å; E32-R34 PolarHBondContact OE1-NE 3.27Å; E32-R34 IonicContact OE1-NH2 3.5Å; E32-R34 PolarHBondContact OE1-NH2 3.14Å; E32-R34 IonicContact OE2-CZ 3.42Å; E32-R34 IonicContact OE2-NE 3.92Å; E32-R34 PolarHBondContact OE2-NE 2.78Å; E32-R34 IonicContact OE2-NH2 3.04Å; E32-R34 PolarHBondContact OE2-NH2 3.46Å; E32-W48 WeakPolarHBondContact O-CA 3.26Å; E32-V49 PolarHBondContact N-O 2.84Å; E32-V49 PolarHBondContact O-N 3.2Å; E32-V51 HydrophobicContact CB-CG2 3.56Å; E32-V51 HydrophobicContact CG-CG2 3.18Å
33K96.8Very high93.4Very high117 Ų11797.9 Ų97.951%0.50950%0.501SS..EExtended strand (participates in β ladder)trans-80.4111.3175.5-172.4176.8177.5-179.80108.4F46 W48K33-F46 HydrophobicContact CD-CB 4.21Å; K33-F46 HydrophobicContact CD-CD1 4.12Å; K33-F46 HydrophobicContact CD-CG 4.14Å; K33-F46 HydrophobicContact CG-CB 3.87Å; K33-F46 HydrophobicContact CG-CD1 3.56Å; K33-F46 HydrophobicContact CG-CE1 4.2Å; K33-F46 HydrophobicContact CG-CG 3.91Å; K33-W48 HydrophobicContact CB-CD2 4.4Å; K33-W48 HydrophobicContact CB-CE3 4.09Å; K33-W48 HydrophobicContact CB-CH2 4.2Å; K33-W48 HydrophobicContact CB-CZ3 3.99Å
34R95.6Very high93.5Very high138 Ų138102.9 Ų102.952%0.52151%0.511SS..EExtended strand (participates in β ladder)trans-124.5147.4-179.8-71.4-79.6-174.8-170.2-8.5111.1E32 V36 F46 K47 V49E32-R34 HydrophobicContact CG-CG 3.67Å; E32-R34 PolarHBondContact O-N 2.9Å; E32-R34 WeakPolarHBondContact OE1-CG 3.46Å; E32-R34 IonicContact OE1-CZ 3.51Å; E32-R34 IonicContact OE1-NE 2.65Å; E32-R34 PolarHBondContact OE1-NE 3.27Å; E32-R34 IonicContact OE1-NH2 3.5Å; E32-R34 PolarHBondContact OE1-NH2 3.14Å; E32-R34 IonicContact OE2-CZ 3.42Å; E32-R34 IonicContact OE2-NE 3.92Å; E32-R34 PolarHBondContact OE2-NE 2.78Å; E32-R34 IonicContact OE2-NH2 3.04Å; E32-R34 PolarHBondContact OE2-NH2 3.46Å; R34-V36 PolarHBondContact O-N 3.04Å; R34-F46 WeakPolarHBondContact O-CA 3.3Å; R34-K47 PolarHBondContact N-O 2.96Å; R34-K47 PolarHBondContact O-N 2.88Å; R34-V49 HydrophobicContact CB-CG2 4.03Å
35W96Very high93.6Very high127 Ų127104.3 Ų104.348%0.48152%0.515SS..EExtended strand (participates in β ladder)trans-72115.4170.7-73.1116.4000110R44 F46W35-R44 HydrophobicContact CB-CB 4.32Å; W35-R44 HydrophobicContact CD2-CB 4.48Å; W35-R44 HydrophobicContact CE3-CB 3.92Å; W35-R44 WeakPolarHBondContact CZ3-O 3.34Å; W35-F46 AromaticContact CD1-CE1 3.6Å; W35-F46 AromaticContact CD1-CZ 3.92Å; W35-F46 AromaticContact CD2-CD1 3.77Å; W35-F46 HydrophobicContact CD2-CD1 3.77Å; W35-F46 HydrophobicContact CD2-CD2 4.06Å; W35-F46 AromaticContact CD2-CE1 3.66Å; W35-F46 HydrophobicContact CD2-CE1 3.66Å; W35-F46 AromaticContact CD2-CE2 3.97Å; W35-F46 HydrophobicContact CD2-CE2 3.97Å; W35-F46 AromaticContact CD2-CG 4Å; W35-F46 HydrophobicContact CD2-CG 4Å; W35-F46 AromaticContact CD2-CZ 3.78Å; W35-F46 HydrophobicContact CD2-CZ 3.78Å; W35-F46 AromaticContact CE2-CD1 3.99Å; W35-F46 AromaticContact CE2-CD2 3.86Å; W35-F46 AromaticContact CE2-CE1 3.44Å; W35-F46 VanDerWaalsContact CE2-CE1 3.44Å; W35-F46 AromaticContact CE2-CE2 3.31Å; W35-F46 AromaticContact CE2-CZ 3.08Å; W35-F46 HydrophobicContact CE3-CD1 4.1Å; W35-F46 AromaticContact CE3-CD2 3.91Å; W35-F46 HydrophobicContact CE3-CD2 3.91Å; W35-F46 HydrophobicContact CE3-CE1 4.39Å; W35-F46 HydrophobicContact CE3-CE2 4.22Å; W35-F46 AromaticContact CE3-CG 3.89Å; W35-F46 HydrophobicContact CE3-CG 3.89Å; W35-F46 HydrophobicContact CE3-CZ 4.45Å; W35-F46 HydrophobicContact CG-CD1 4.03Å; W35-F46 AromaticContact CG-CE1 3.81Å; W35-F46 HydrophobicContact CG-CE1 3.81Å; W35-F46 HydrophobicContact CG-CZ 4.28Å; W35-F46 AromaticContact CH2-CD2 3.41Å; W35-F46 HydrophobicContact CH2-CD2 3.41Å; W35-F46 VanDerWaalsContact CH2-CD2 3.41Å; W35-F46 AromaticContact CH2-CE2 3.3Å; W35-F46 HydrophobicContact CH2-CE2 3.3Å; W35-F46 HydrophobicContact CH2-CG 4.24Å; W35-F46 HydrophobicContact CH2-CZ 4.02Å; W35-F46 AromaticContact CZ2-CD2 3.58Å; W35-F46 HydrophobicContact CZ2-CD2 3.58Å; W35-F46 HydrophobicContact CZ2-CE1 4.05Å; W35-F46 AromaticContact CZ2-CE2 2.97Å; W35-F46 HydrophobicContact CZ2-CE2 2.97Å; W35-F46 HydrophobicContact CZ2-CG 4.35Å; W35-F46 AromaticContact CZ2-CZ 3.26Å; W35-F46 HydrophobicContact CZ2-CZ 3.26Å; W35-F46 AromaticContact CZ3-CD2 3.57Å; W35-F46 HydrophobicContact CZ3-CD2 3.57Å; W35-F46 AromaticContact CZ3-CE2 3.91Å; W35-F46 HydrophobicContact CZ3-CE2 3.91Å; W35-F46 AromaticContact CZ3-CG 3.99Å; W35-F46 HydrophobicContact CZ3-CG 3.99Å; W35-F46 AromaticContact NE1-CE1 3.36Å; W35-F46 AromaticContact NE1-CE2 3.91Å; W35-F46 AromaticContact NE1-CZ 3.17Å
36V95.1Very high93.7Very high52 Ų52105 Ų10532%0.31552%0.515SS..EExtended strand (participates in β ladder)trans-110.8132.3175.8-179.40000108.6R34 R44 I45 K47 V49R34-V36 PolarHBondContact O-N 3.04Å; V36-R44 CarbonylContact O-C 3.55Å; V36-R44 WeakPolarHBondContact O-CA 3.08Å; V36-I45 PolarHBondContact N-O 3.3Å; V36-I45 PolarHBondContact O-N 3.42Å; V36-K47 HydrophobicContact CB-CB 4.36Å; V36-K47 HydrophobicContact CG2-CB 3.85Å; V36-V49 HydrophobicContact CG2-CG2 3.95Å
37T95.6Very high93.8Very high81 Ų81105.8 Ų105.850%0.49752%0.517SS..EExtended strand (participates in β ladder)trans-70.6140.1177.9-50.10000110.7T41 L43T37-T41 WeakPolarHBondContact CG2-O 3.4Å; T37-L43 WeakPolarHBondContact CA-O 3.35Å
38V93.8Very high94.1Very high59 Ų59108.5 Ų108.536%0.35853%0.525SS..  trans-95.7101-177.8-173.60000109.2T41 L43 I45V38-T41 PolarHBondContact O-N 3.44Å; V38-L43 HydrophobicContact CB-CB 4.46Å; V38-L43 PolarHBondContact N-O 3.5Å; V38-I45 HydrophobicContact CG2-CB 4Å; V38-I45 HydrophobicContact CG2-CD1 3.32Å; V38-I45 HydrophobicContact CG2-CG1 3.41Å; V38-I45 VanDerWaalsContact CG2-CG1 3.41Å
39G89.9Confident94.1Very high68 Ų68106.6 Ų106.670%0.70151%0.513SS*.THydrogen-bonded Turntrans57.1-137.7172.800000113.7T41G39-T41 VanDerWaalsContact C-N 3.28Å
40D86.9Confident94.1Very high168 Ų168100.3 Ų100.390%0.89850%0.5SS*.THydrogen-bonded Turntrans-81.31.1178.757.6-56.1000113.9
41T90.1Very high94Very high68 Ų6898.2 Ų98.242%0.41750%0.497SS..SBendtrans-94.1157.8179.5-32.50000112T37 V38 G39 L43T37-T41 WeakPolarHBondContact CG2-O 3.4Å; V38-T41 PolarHBondContact O-N 3.44Å; G39-T41 VanDerWaalsContact C-N 3.28Å; T41-L43 HydrophobicContact CG2-CB 4.37Å; T41-L43 HydrophobicContact CG2-CD1 3.96Å; T41-L43 HydrophobicContact CG2-CG 3.87Å; T41-L43 PolarHBondContact O-N 3.16Å
42S87.4Confident93.4Very high115 Ų11596 Ų9680%0.80450%0.496SS*.SBendtrans-73.9-0.3171.959.70000114.3
43L94.2Very high92.4Very high110 Ų11096.4 Ų96.458%0.57650%0.5SS*.  trans-70.7142.1179.8-68171.6000111.3T37 V38 T41T37-L43 WeakPolarHBondContact CA-O 3.35Å; V38-L43 HydrophobicContact CB-CB 4.46Å; V38-L43 PolarHBondContact N-O 3.5Å; T41-L43 HydrophobicContact CG2-CB 4.37Å; T41-L43 HydrophobicContact CG2-CD1 3.96Å; T41-L43 HydrophobicContact CG2-CG 3.87Å; T41-L43 PolarHBondContact O-N 3.16Å
44R94.1Very high91.3Very high146 Ų14695.9 Ų95.955%0.55151%0.509SS*.EExtended strand (participates in β ladder)trans-124.4134.7175.6-61.3172.972.2-167.54109W35 V36W35-R44 HydrophobicContact CB-CB 4.32Å; W35-R44 HydrophobicContact CD2-CB 4.48Å; W35-R44 HydrophobicContact CE3-CB 3.92Å; W35-R44 WeakPolarHBondContact CZ3-O 3.34Å; V36-R44 CarbonylContact O-C 3.55Å; V36-R44 WeakPolarHBondContact O-CA 3.08Å
45I96.1Very high89.9Confident102 Ų10296.1 Ų96.152%0.52352%0.516SS..EExtended strand (participates in β ladder)trans-119.1142.8177.4-65.7175.8000108.7V36 V38 K47V36-I45 PolarHBondContact N-O 3.3Å; V36-I45 PolarHBondContact O-N 3.42Å; V38-I45 HydrophobicContact CG2-CB 4Å; V38-I45 HydrophobicContact CG2-CD1 3.32Å; V38-I45 HydrophobicContact CG2-CG1 3.41Å; V38-I45 VanDerWaalsContact CG2-CG1 3.41Å; I45-K47 PolarHBondContact O-N 3.42Å
46F96.5Very high88.7Confident87 Ų8792.3 Ų92.338%0.38250%0.503SS..EExtended strand (participates in β ladder)trans-70.6119.8169.9-80.5-64.5000111.1K33 R34 W35K33-F46 HydrophobicContact CD-CB 4.21Å; K33-F46 HydrophobicContact CD-CD1 4.12Å; K33-F46 HydrophobicContact CD-CG 4.14Å; K33-F46 HydrophobicContact CG-CB 3.87Å; K33-F46 HydrophobicContact CG-CD1 3.56Å; K33-F46 HydrophobicContact CG-CE1 4.2Å; K33-F46 HydrophobicContact CG-CG 3.91Å; R34-F46 WeakPolarHBondContact O-CA 3.3Å; W35-F46 AromaticContact CD1-CE1 3.6Å; W35-F46 AromaticContact CD1-CZ 3.92Å; W35-F46 AromaticContact CD2-CD1 3.77Å; W35-F46 HydrophobicContact CD2-CD1 3.77Å; W35-F46 HydrophobicContact CD2-CD2 4.06Å; W35-F46 AromaticContact CD2-CE1 3.66Å; W35-F46 HydrophobicContact CD2-CE1 3.66Å; W35-F46 AromaticContact CD2-CE2 3.97Å; W35-F46 HydrophobicContact CD2-CE2 3.97Å; W35-F46 AromaticContact CD2-CG 4Å; W35-F46 HydrophobicContact CD2-CG 4Å; W35-F46 AromaticContact CD2-CZ 3.78Å; W35-F46 HydrophobicContact CD2-CZ 3.78Å; W35-F46 AromaticContact CE2-CD1 3.99Å; W35-F46 AromaticContact CE2-CD2 3.86Å; W35-F46 AromaticContact CE2-CE1 3.44Å; W35-F46 VanDerWaalsContact CE2-CE1 3.44Å; W35-F46 AromaticContact CE2-CE2 3.31Å; W35-F46 AromaticContact CE2-CZ 3.08Å; W35-F46 HydrophobicContact CE3-CD1 4.1Å; W35-F46 AromaticContact CE3-CD2 3.91Å; W35-F46 HydrophobicContact CE3-CD2 3.91Å; W35-F46 HydrophobicContact CE3-CE1 4.39Å; W35-F46 HydrophobicContact CE3-CE2 4.22Å; W35-F46 AromaticContact CE3-CG 3.89Å; W35-F46 HydrophobicContact CE3-CG 3.89Å; W35-F46 HydrophobicContact CE3-CZ 4.45Å; W35-F46 HydrophobicContact CG-CD1 4.03Å; W35-F46 AromaticContact CG-CE1 3.81Å; W35-F46 HydrophobicContact CG-CE1 3.81Å; W35-F46 HydrophobicContact CG-CZ 4.28Å; W35-F46 AromaticContact CH2-CD2 3.41Å; W35-F46 HydrophobicContact CH2-CD2 3.41Å; W35-F46 VanDerWaalsContact CH2-CD2 3.41Å; W35-F46 AromaticContact CH2-CE2 3.3Å; W35-F46 HydrophobicContact CH2-CE2 3.3Å; W35-F46 HydrophobicContact CH2-CG 4.24Å; W35-F46 HydrophobicContact CH2-CZ 4.02Å; W35-F46 AromaticContact CZ2-CD2 3.58Å; W35-F46 HydrophobicContact CZ2-CD2 3.58Å; W35-F46 HydrophobicContact CZ2-CE1 4.05Å; W35-F46 AromaticContact CZ2-CE2 2.97Å; W35-F46 HydrophobicContact CZ2-CE2 2.97Å; W35-F46 HydrophobicContact CZ2-CG 4.35Å; W35-F46 AromaticContact CZ2-CZ 3.26Å; W35-F46 HydrophobicContact CZ2-CZ 3.26Å; W35-F46 AromaticContact CZ3-CD2 3.57Å; W35-F46 HydrophobicContact CZ3-CD2 3.57Å; W35-F46 AromaticContact CZ3-CE2 3.91Å; W35-F46 HydrophobicContact CZ3-CE2 3.91Å; W35-F46 AromaticContact CZ3-CG 3.99Å; W35-F46 HydrophobicContact CZ3-CG 3.99Å; W35-F46 AromaticContact NE1-CE1 3.36Å; W35-F46 AromaticContact NE1-CE2 3.91Å; W35-F46 AromaticContact NE1-CZ 3.17Å
47K96.2Very high87.4Confident126 Ų12693.7 Ų93.755%0.54851%0.506SS..EExtended strand (participates in β ladder)trans-119.6145.5170.5-162.416976.5-177.80109.4R34 V36 I45 V49R34-K47 PolarHBondContact N-O 2.96Å; R34-K47 PolarHBondContact O-N 2.88Å; V36-K47 HydrophobicContact CB-CB 4.36Å; V36-K47 HydrophobicContact CG2-CB 3.85Å; I45-K47 PolarHBondContact O-N 3.42Å; K47-V49 PolarHBondContact O-N 2.66Å
48W96.8Very high86Confident154 Ų15496.1 Ų96.158%0.58351%0.512SS*.EExtended strand (participates in β ladder)trans-74115.9167.1-66102.2000108.8W31 E32 K33W31-W48 HydrophobicContact CB-CB 4.38Å; W31-W48 HydrophobicContact CB-CE3 4.16Å; W31-W48 HydrophobicContact CD2-CB 4.5Å; W31-W48 HydrophobicContact CE3-CB 3.56Å; W31-W48 HydrophobicContact CZ3-CB 4.24Å; W31-W48 WeakPolarHBondContact O-CZ3 3.28Å; E32-W48 WeakPolarHBondContact O-CA 3.26Å; K33-W48 HydrophobicContact CB-CD2 4.4Å; K33-W48 HydrophobicContact CB-CE3 4.09Å; K33-W48 HydrophobicContact CB-CH2 4.2Å; K33-W48 HydrophobicContact CB-CZ3 3.99Å
49V94.8Very high84.7Confident42 Ų42102.4 Ų102.426%0.25553%0.529SS..EExtended strand (participates in β ladder)trans-107.7134.2-178-177.70000108.3W31 E32 R34 V36 K47 V51W31-V49 WeakPolarHBondContact CA-O 3.49Å; E32-V49 PolarHBondContact N-O 2.84Å; E32-V49 PolarHBondContact O-N 3.2Å; R34-V49 HydrophobicContact CB-CG2 4.03Å; V36-V49 HydrophobicContact CG2-CG2 3.95Å; K47-V49 PolarHBondContact O-N 2.66Å; V49-V51 PolarHBondContact O-N 3.27Å
50P95Very high83.6Confident79 Ų79104.9 Ų104.951%0.51352%0.517SS..PPolyproline II helixtrans-61.5127.7176.2-20.331.2000111.3W31W31-P50 HydrophobicContact CZ2-CG 4.01Å
51V91.6Very high82.8Confident50 Ų50106.1 Ų106.130%0.30351%0.51SS..PPolyproline II helixtrans-100.1120.3167.9-171.20000108.4R30 E32 V49R30-V51 WeakPolarHBondContact O-CB 3.45Å; R30-V51 WeakPolarHBondContact O-CG2 3.23Å; E32-V51 HydrophobicContact CB-CG2 3.56Å; E32-V51 HydrophobicContact CG-CG2 3.18Å; V49-V51 PolarHBondContact O-N 3.27Å
52V82.6Confident81.6Confident62 Ų62107 Ų10738%0.37652%0.524SS..PPolyproline II helixtrans-103.5122.8169.3-175.70000107.1E56 E57V52-E56 HydrophobicContact CG1-CB 4.33Å; V52-E57 HydrophobicContact CG1-CB 4.18Å
53D76.4Confident80.1Confident74 Ų74103.6 Ų103.640%0.39651%0.507SS..PPolyproline II helixtrans-60.4133.6172.4-82.5-55.5000109.2R30 Q55 E56 E57R30-D53 IonicContact CZ-OD2 3.84Å; R30-D53 IonicContact NE-OD2 3.94Å; R30-D53 IonicContact NH1-OD2 2.96Å; R30-D53 PolarHBondContact NH1-OD2 3.28Å; D53-Q55 PolarHBondContact O-N 2.84Å; D53-Q55 VanDerWaalsContact O-N 3.07Å; D53-E56 HydrophobicContact CB-CB 4.39Å; D53-E56 WeakPolarHBondContact O-CA 3.46Å; D53-E56 WeakPolarHBondContact O-CB 3.39Å; D53-E56 PolarHBondContact O-N 2.71Å; D53-E57 PolarHBondContact O-N 3.4Å; D53-E57 VanDerWaalsContact O-N 3.1Å
54P72.5Confident78.2Confident105 Ų105100.8 Ų100.868%0.68250%0.504SS*.Hα-helixtrans-57.9-28.5-178.819.8-30.5000112.4E57 E58P54-E57 PolarHBondContact O-N 3.38Å; P54-E58 PolarHBondContact O-N 3.12Å
55Q66.2Low76.1Confident143 Ų14396.3 Ų96.367%0.66850%0.504SS*.Hα-helixtrans-70-32.5174.6-170.6-179.663.300113.3D53 R59D53-Q55 PolarHBondContact O-N 2.84Å; D53-Q55 VanDerWaalsContact O-N 3.07Å; Q55-R59 WeakPolarHBondContact O-CG 3.44Å; Q55-R59 PolarHBondContact O-N 3.06Å
56E70.8Confident73.9Confident48 Ų4894.4 Ų94.422%0.22450%0.503CS..Hα-helixtrans-74.3-37.9174.3-171.2-177.2175.200110.7R30 V52 D53 E58 R59 R60R30-E56 IonicContact NH1-OE2 3.69Å; R30-E56 PolarHBondContact NH1-OE2 2.91Å; V52-E56 HydrophobicContact CG1-CB 4.33Å; D53-E56 HydrophobicContact CB-CB 4.39Å; D53-E56 WeakPolarHBondContact O-CA 3.46Å; D53-E56 WeakPolarHBondContact O-CB 3.39Å; D53-E56 PolarHBondContact O-N 2.71Å; E56-E58 VanDerWaalsContact C-N 3.35Å; E56-R59 PolarHBondContact O-N 3.41Å; E56-R60 WeakPolarHBondContact O-CG 3.34Å; E56-R60 PolarHBondContact O-N 2.89Å; E56-R60 IonicContact OE1-CZ 3.36Å; E56-R60 IonicContact OE1-NE 3.35Å; E56-R60 PolarHBondContact OE1-NE 3.42Å; E56-R60 IonicContact OE1-NH2 3.57Å; E56-R60 PolarHBondContact OE1-NH2 3.2Å; E56-R60 IonicContact OE2-NH2 2.72Å
57E69Low71.7Confident81 Ų8198.7 Ų98.738%0.37952%0.524SS..Hα-helixtrans-62.3-42.8174.6-176.4164.1-139.500111.6V52 D53 P54 R59 R60 R61V52-E57 HydrophobicContact CG1-CB 4.18Å; D53-E57 PolarHBondContact O-N 3.4Å; D53-E57 VanDerWaalsContact O-N 3.1Å; P54-E57 PolarHBondContact O-N 3.38Å; E57-R59 VanDerWaalsContact C-N 3.33Å; E57-R59 PolarHBondContact O-N 2.85Å; E57-R60 PolarHBondContact O-N 2.83Å; E57-R61 VanDerWaalsContact CD-CZ 3.5Å; E57-R61 HydrophobicContact CG-CG 4.4Å; E57-R61 WeakPolarHBondContact O-CB 3.47Å; E57-R61 WeakPolarHBondContact O-CG 3.45Å; E57-R61 PolarHBondContact O-N 3.04Å; E57-R61 IonicContact OE1-CZ 3.39Å; E57-R61 IonicContact OE1-NE 3.52Å; E57-R61 IonicContact OE1-NH2 2.77Å; E57-R61 PolarHBondContact OE1-NH2 3.27Å; E57-R61 IonicContact OE2-CZ 3.89Å; E57-R61 IonicContact OE2-NH2 3.52Å
58E65.5Low69.7Low131 Ų131103.5 Ų103.561%0.61254%0.539SS*.Hα-helixtrans-58.8-43.3173.3-174.1178.1-145.700111.7P54 E56 R60 R61 A62P54-E58 PolarHBondContact O-N 3.12Å; E56-E58 VanDerWaalsContact C-N 3.35Å; E58-R60 VanDerWaalsContact C-N 3.34Å; E58-R60 PolarHBondContact O-N 3.38Å; E58-R61 PolarHBondContact O-N 3.35Å; E58-A62 WeakPolarHBondContact O-CB 3.49Å; E58-A62 PolarHBondContact O-N 3.26Å
59R66.4Low67.4Low192 Ų19298.7 Ų98.773%0.72553%0.529SS*.Hα-helixtrans-64.7-34.9176-75-179.3162.2-117.7-5.6113.5Q55 E56 E57 G63Q55-R59 WeakPolarHBondContact O-CG 3.44Å; Q55-R59 PolarHBondContact O-N 3.06Å; E56-R59 PolarHBondContact O-N 3.41Å; E57-R59 VanDerWaalsContact C-N 3.33Å; E57-R59 PolarHBondContact O-N 2.85Å; R59-G63 PolarHBondContact O-N 3.2Å
60R66.4Low65.4Low120 Ų120106.4 Ų106.445%0.45355%0.553SS.*Hα-helixtrans-69.9-41.5174.4-72.1179.3-175167.83.7111.4E56 E57 E58E56-R60 WeakPolarHBondContact O-CG 3.34Å; E56-R60 PolarHBondContact O-N 2.89Å; E56-R60 IonicContact OE1-CZ 3.36Å; E56-R60 IonicContact OE1-NE 3.35Å; E56-R60 PolarHBondContact OE1-NE 3.42Å; E56-R60 IonicContact OE1-NH2 3.57Å; E56-R60 PolarHBondContact OE1-NH2 3.2Å; E56-R60 IonicContact OE2-NH2 2.72Å; E57-R60 PolarHBondContact O-N 2.83Å; E58-R60 VanDerWaalsContact C-N 3.34Å; E58-R60 PolarHBondContact O-N 3.38Å
61R69.9Low63.1Low194 Ų194106 Ų10673%0.73256%0.563SS**Hα-helixtrans-70.7-33.7177.6-70.6-179.7-178.8173.73.7112.8E57 E58E57-R61 VanDerWaalsContact CD-CZ 3.5Å; E57-R61 HydrophobicContact CG-CG 4.4Å; E57-R61 WeakPolarHBondContact O-CB 3.47Å; E57-R61 WeakPolarHBondContact O-CG 3.45Å; E57-R61 PolarHBondContact O-N 3.04Å; E57-R61 IonicContact OE1-CZ 3.39Å; E57-R61 IonicContact OE1-NE 3.52Å; E57-R61 IonicContact OE1-NH2 2.77Å; E57-R61 PolarHBondContact OE1-NH2 3.27Å; E57-R61 IonicContact OE2-CZ 3.89Å; E57-R61 IonicContact OE2-NH2 3.52Å; E58-R61 PolarHBondContact O-N 3.35Å
62A64.9Low61.1Low86 Ų86113.5 Ų113.571%0.71159%0.586SS**Hα-helixtrans-90.2-11.7-173.700000115.4E58E58-A62 WeakPolarHBondContact O-CB 3.49Å; E58-A62 PolarHBondContact O-N 3.26Å
63G56.6Low59.4Low44 Ų44118.2 Ų118.245%0.45460%0.604SS.*Hα-helixtrans-175.411.1-173.100000120.1R59 G65 A66R59-G63 PolarHBondContact O-N 3.2Å; G63-G65 PolarHBondContact O-N 3.03Å; G63-A66 PolarHBondContact O-N 3.25Å
64G53.3Low58.2Low50 Ų50126.1 Ų126.152%0.51563%0.628SS.*THydrogen-bonded Turntrans-61.7-11.1178.900000115.4
65G50.9Low57.4Low53 Ų53132.4 Ų132.455%0.54664%0.638SS.*Hα-helixtrans-79.8-15.4178.500000115.5G63 S69G63-G65 PolarHBondContact O-N 3.03Å; G65-S69 WeakPolarHBondContact O-CB 3.35Å; G65-S69 PolarHBondContact O-N 2.84Å; G65-S69 PolarHBondContact O-OG 3.37Å; G65-S69 VanDerWaalsContact O-OG 3.06Å
66A50.3Low56.3Low61 Ų61129 Ų12950%0.50464%0.641SS.*Hα-helixtrans-78.3-23.9-17300000114.2G63 S69G63-A66 PolarHBondContact O-N 3.25Å; A66-S69 WeakPolarHBondContact CA-OG 3.39Å; A66-S69 PolarHBondContact O-OG 3.11Å; A66-S69 VanDerWaalsContact O-OG 3.08Å
67E50.3Low55.3Low178 Ų178139.2 Ų139.283%0.83268%0.678SS**Hα-helixtrans-84.6-34.1178.6-141.2-160.7152.300112.2
68R54.3Low54.1Low226 Ų226138.6 Ų138.685%0.85369%0.693SS**Hα-helixtrans-75.1-24.1175.8-68.5-172.9-179.2-144.80.8113.2
69S48.9Very low52.6Low53 Ų53137.1 Ų137.137%0.37170%0.703SS.*Hα-helixtrans-76.6-30.2-177.353.70000114G65 A66 G71 R72 E73G65-S69 WeakPolarHBondContact O-CB 3.35Å; G65-S69 PolarHBondContact O-N 2.84Å; G65-S69 PolarHBondContact O-OG 3.37Å; G65-S69 VanDerWaalsContact O-OG 3.06Å; A66-S69 WeakPolarHBondContact CA-OG 3.39Å; A66-S69 PolarHBondContact O-OG 3.11Å; A66-S69 VanDerWaalsContact O-OG 3.08Å; S69-G71 PolarHBondContact O-N 3.41Å; S69-R72 PolarHBondContact O-N 2.93Å; S69-E73 PolarHBondContact O-N 3.34Å
70R52Low51.4Low205 Ų205133.6 Ų133.677%0.77471%0.708SS**THydrogen-bonded Turntrans-66.1-20.2-180-69.1-173.8178.9175.41.3114.1
71G45.8Very low50.6Low69 Ų69133 Ų13371%0.71172%0.72SS**THydrogen-bonded Turntrans-82.9-18.8173.200000114.2S69S69-G71 PolarHBondContact O-N 3.41Å
72R51.4Low49.5Very low208 Ų208135.4 Ų135.479%0.78573%0.729SS**THydrogen-bonded Turntrans-91.7-26.4-177-166.7171.6-178.9-112.31.5113S69 R74 R75S69-R72 PolarHBondContact O-N 2.93Å; R72-R74 VanDerWaalsContact C-N 3.25Å; R72-R74 PolarHBondContact O-N 3.05Å; R72-R75 PolarHBondContact O-N 2.86Å
73E46.2Very low48.2Very low162 Ų162135.2 Ų135.276%0.75774%0.735SS**THydrogen-bonded Turntrans-70-11.1-175.8-86.9-177.2118.700115.5S69S69-E73 PolarHBondContact O-N 3.34Å
74R51.5Low47.5Very low240 Ų240137.1 Ų137.191%0.90676%0.755SS**THydrogen-bonded Turntrans-89.1-0.2172.3-68.7-149.2-176.1-95.11.9114.8R72R72-R74 VanDerWaalsContact C-N 3.25Å; R72-R74 PolarHBondContact O-N 3.05Å
75R54.3Low46.8Very low236 Ų236138 Ų13889%0.89176%0.763SS**SBendtrans-132.472.9174.5-68.5-166.3-170.8-118.86.2112R72R72-R75 PolarHBondContact O-N 2.86Å
76G43.6Very low46.8Very low71 Ų71141.4 Ų141.473%0.73278%0.776SS**  trans156.557.7165.700000115.8
77R51.1Low47.1Very low264 Ų264146.7 Ų146.7100%0.99680%0.795SS**  trans-94.591152.5-171.6-171.2-94.2-110.94.9106.3
78G42.3Very low47.6Very low67 Ų67145.1 Ų145.169%0.69179%0.791SS**  trans172.4112.5177.100000113.2
79A35.5Very low47.9Very low101 Ų101141.3 Ų141.384%0.83579%0.786SS**  trans64.497.8159.900000118.5
80S40.6Very low48.7Very low117 Ų117146.2 Ų146.282%0.81881%0.808SS**  -92134.2126.6-173.60000105.8
81P48.6Very low48.9Very low109 Ų109142.7 Ų142.771%0.70880%0.804SS**  -145.6147.587.635.1-16.7000115.4
82R47.4Very low49.4Very low244 Ų244146.5 Ų146.592%0.92181%0.808SS**  trans42.5117.1144.7-73.7178133.8142-3.7119.1
83G38.4Very low49.8Very low81 Ų81144.1 Ų144.184%0.83581%0.81SS**  trans147.1109.5146.700000114.9
84G41.5Very low50.3Low84 Ų84141.5 Ų141.587%0.86680%0.802SS**  trans78.8112.114400000119.5
85G38.7Very low50.3Low68 Ų68139.9 Ų139.970%0.70180%0.804SS**  trans105.4127.8144.100000116.9L87G85-L87 PolarHBondContact O-N 3.33Å
86P51.3Low50.4Low125 Ų125135.6 Ų135.681%0.81280%0.799SS**  trans-83.494.916833.6-25.9000108.3I88P86-I88 PolarHBondContact O-N 3.27Å
87L55.8Low50.6Low173 Ų173136 Ų13691%0.90679%0.79SS**  trans-78.2103.3161-68.7-176.9000108.2G85 L89G85-L87 PolarHBondContact O-N 3.33Å; L87-L89 PolarHBondContact O-N 3.23Å; L87-L89 VanDerWaalsContact O-N 3.11Å
88I60.6Low50.5Low145 Ų145130.6 Ų130.674%0.74478%0.781SS**  trans-45105.7164.6-62.7-174.4000109.2P86 L90P86-I88 PolarHBondContact O-N 3.27Å; I88-L90 VanDerWaalsContact C-N 3.32Å; I88-L90 HydrophobicContact CG2-CB 3.51Å
89L60.7Low50.9Low145 Ų145135.8 Ų135.876%0.75979%0.788SS**  trans-99.256.5165.2-173.160.9000109.2L87 D91 L92L87-L89 PolarHBondContact O-N 3.23Å; L87-L89 VanDerWaalsContact O-N 3.11Å; L89-D91 VanDerWaalsContact C-N 3.25Å; L89-D91 PolarHBondContact O-N 3.48Å; L89-L92 HydrophobicContact CD1-CD1 4.13Å
90L64.7Low51.6Low156 Ų156134.3 Ų134.382%0.81777%0.772SS**  trans-89.833.9-176.6-148.181.5000113.1I88I88-L90 VanDerWaalsContact C-N 3.32Å; I88-L90 HydrophobicContact CG2-CB 3.51Å
91D58.2Low51.8Low131 Ų131137.8 Ų137.870%0.70177%0.772SS**  trans-154.290.2173.8-162.631.4000112.4L89L89-D91 VanDerWaalsContact C-N 3.25Å; L89-D91 PolarHBondContact O-N 3.48Å
92L56Low51.4Low150 Ų150140.3 Ų140.379%0.78577%0.774SS**  trans-162.523.6166.1-99.5145000111.4L89L89-L92 HydrophobicContact CD1-CD1 4.13Å
93N59.7Low51.7Low157 Ų157133.8 Ų133.884%0.8477%0.766SS**  trans-124.249.9178.3-164.982000111.2
94D55.6Low51.9Low108 Ų108139.2 Ų139.258%0.57877%0.77SS**  trans-113.831.6168.1-159.7-117.1000112.6N96 S97D94-N96 PolarHBondContact O-N 2.89Å; D94-S97 WeakPolarHBondContact OD1-CB 3.27Å; D94-S97 PolarHBondContact OD1-OG 3.33Å
95E52.3Low52.3Low205 Ų205139 Ų13996%0.95877%0.767SS**THydrogen-bonded Turntrans-80.839.2167.9-80.2-131.498.700112.3
96N55.7Low52.4Low147 Ų147141 Ų14179%0.78677%0.771SS**THydrogen-bonded Turntrans-134.811.7167.6-173.157.9000112.4D94 N98D94-N96 PolarHBondContact O-N 2.89Å; N96-N98 PolarHBondContact O-N 3.05Å; N96-N98 VanDerWaalsContact O-N 3.14Å
97S49.2Very low52.3Low78 Ų78143.1 Ų143.155%0.54577%0.774SS.*  trans-69.6112.9169.7-86.80000109.6D94 Q99D94-S97 WeakPolarHBondContact OD1-CB 3.27Å; D94-S97 PolarHBondContact OD1-OG 3.33Å; S97-Q99 PolarHBondContact O-N 3.23Å; S97-Q99 VanDerWaalsContact O-N 3.13Å
98N48.8Very low51.7Low151 Ų151143.5 Ų143.581%0.80777%0.771SS**  trans-39.8118.3165-80.1-43.7000109.5N96 S100N96-N98 PolarHBondContact O-N 3.05Å; N96-N98 VanDerWaalsContact O-N 3.14Å; N98-S100 PolarHBondContact O-N 3.46Å
99Q50.7Low51Low176 Ų176147 Ų14782%0.82278%0.781SS**  trans-68.972165.9-76.4-100.81.800108.8S97 F101S97-Q99 PolarHBondContact O-N 3.23Å; S97-Q99 VanDerWaalsContact O-N 3.13Å; Q99-F101 PolarHBondContact O-N 2.87Å
100S48.3Very low50.1Low71 Ų71143.6 Ų143.650%0.49778%0.781SS.*  trans-78108.3157.848.20000107.3N98 H102N98-S100 PolarHBondContact O-N 3.46Å; S100-H102 VanDerWaalsContact C-N 3.29Å; S100-H102 PolarHBondContact O-CD2 2.93Å; S100-H102 PolarHBondContact O-N 3.19Å; S100-H102 PolarHBondContact OG-NE2 3.01Å
101F45.2Very low48.7Very low190 Ų190142.8 Ų142.883%0.83378%0.783SS**  trans-5797.2160.6-98.5-100.3000107.9Q99 S103Q99-F101 PolarHBondContact O-N 2.87Å; F101-S103 PolarHBondContact O-N 3.11Å; F101-S103 VanDerWaalsContact O-N 3.16Å
102H40.3Very low47.8Very low162 Ų162144.9 Ų144.975%0.7579%0.788SS**  trans-73.597.8159.5-70.2-83.8000106.6S100 E104S100-H102 VanDerWaalsContact C-N 3.29Å; S100-H102 PolarHBondContact O-CD2 2.93Å; S100-H102 PolarHBondContact O-N 3.19Å; S100-H102 PolarHBondContact OG-NE2 3.01Å; H102-E104 PolarHBondContact O-N 3.23Å
103S54.3Low47.6Very low107 Ų107142.4 Ų142.475%0.74878%0.781SS**  trans-53.9129.3146.5-58.20000107.2F101F101-S103 PolarHBondContact O-N 3.11Å; F101-S103 VanDerWaalsContact O-N 3.16Å
104E43.4Very low46.5Very low195 Ų195140.7 Ų140.791%0.91178%0.782SS**  trans-175.9146.1138.6-81.4-117.890.700109H102H102-E104 PolarHBondContact O-N 3.23Å
105G49.9Very low46.2Very low78 Ų78141.8 Ų141.880%0.80480%0.795SS**  trans-81.5163.8-159.200000115.6
106S40.3Very low45.8Very low112 Ų112136.1 Ų136.178%0.78379%0.791SS**  trans-134.7111.5156.1-164.20000109.6
107L48.5Very low44.9Very low169 Ų169132.5 Ų132.589%0.88579%0.789SS**  trans-58.3124.3173.9-70.2145.8000110.9
108Q43Very low44.7Very low181 Ų181135 Ų13585%0.84680%0.801SS**  trans-141.491.3152.9-64.3-168.816.400111.1
109K46.9Very low44.4Very low217 Ų217133.4 Ų133.494%0.94380%0.799SS**  trans42.597.5130.7-158.2175.3-175.9-168.20117.7
110G40.2Very low44Very low74 Ų74133 Ų13376%0.76380%0.797SS**  trans-145.6101.1157.500000110.1
111T37.2Very low43.6Very low140 Ų140135.1 Ų135.186%0.85981%0.809SS**  trans6.1118.7162-58.40000120.3
112E38.3Very low43.4Very low174 Ų174131.7 Ų131.781%0.81381%0.809SS**  trans-10.7172.2154.8-86.3-163.586.800122.8
113P52.5Low44Very low98 Ų98135 Ų13564%0.63682%0.815SS**  cis-138.5158.4-34.735.8-18.2000113.8
114S36Very low43.3Very low121 Ų121136 Ų13685%0.84682%0.819SS**  trans-166.8138.1144.5-89.90000111.9
115P49.8Very low43.1Very low132 Ų132133.3 Ų133.386%0.85782%0.815SS**  trans-95.9146.5-167.837.4-30.8000111.7
116G42.4Very low42.8Very low85 Ų85134.9 Ų134.988%0.87681%0.813SS**  trans127.296.7162.200000113.5
117G37.2Very low43.4Very low71 Ų71135.4 Ų135.473%0.73282%0.815SS**  trans17258.4173.100000112.7P119G117-P119 WeakPolarHBondContact O-CD 3.28Å
118T45.3Very low42.8Very low130 Ų130132.3 Ų132.380%0.79881%0.813SS**  trans-62.3121.9166.7-44.40000108.7Q120T118-Q120 PolarHBondContact O-N 3.09Å
119P41.9Very low42.4Very low119 Ų119127.1 Ų127.177%0.77381%0.808SS**  trans-78.5101.8165.930-27.9000107.7G117G117-P119 WeakPolarHBondContact O-CD 3.28Å
120Q42.6Very low42.3Very low166 Ų166122.5 Ų122.578%0.77680%0.8SS**  trans-62.9135167.6-103.8-162.8-14.500109.8T118 S122T118-Q120 PolarHBondContact O-N 3.09Å; Q120-S122 PolarHBondContact O-N 3.46Å
121P39.8Very low42.6Very low117 Ų117124.9 Ų124.976%0.7680%0.803SS**  trans-73.2109.2163.228.5-29.6000108.8R123P121-R123 PolarHBondContact O-N 2.87Å; P121-R123 VanDerWaalsContact O-N 3.14Å
122S41.1Very low43.1Very low118 Ų118127.9 Ų127.983%0.82581%0.807SS**  trans-61.3113.6176-53.10000110.6Q120Q120-S122 PolarHBondContact O-N 3.46Å
123R52.3Low43.1Very low232 Ų232123.2 Ų123.288%0.87581%0.805SS**PPolyproline II helixtrans-68.1145.6165.9-72.1174.9154.5-164.8-6.6109.9P121 V125P121-R123 PolarHBondContact O-N 2.87Å; P121-R123 VanDerWaalsContact O-N 3.14Å; R123-V125 PolarHBondContact O-N 3.32Å
124P39.7Very low42.6Very low128 Ų128125.3 Ų125.383%0.83182%0.816SS**PPolyproline II helixtrans-69.9125.4171.628.3-31000109.7
125V39.9Very low43Very low138 Ų138124.7 Ų124.784%0.83681%0.809SS**PPolyproline II helixtrans-81.8122.4174.599.80000108.6R123R123-V125 PolarHBondContact O-N 3.32Å
126S43.5Very low42.6Very low110 Ų110126.3 Ų126.377%0.76981%0.805SS**PPolyproline II helixtrans-77134.1165.3-59.20000109
127P52.9Low42.9Very low124 Ų124130.4 Ų130.481%0.80580%0.801SS**PPolyproline II helixtrans-84.8123.7170.531.4-27.8000110.1
128A35.4Very low43.8Very low103 Ų103132 Ų13285%0.85181%0.807SS**PPolyproline II helixtrans-70135.3162.400000109.9
129G34.3Very low43.8Very low72 Ų72133 Ų13374%0.74280%0.803SS**  trans-103.8-171.6165.200000111.4
130P45.5Very low44.1Very low121 Ų121132.2 Ų132.279%0.78680%0.798SS**  cis-126.6-175.9-13.937.9-19.7000112.7
131P47.2Very low44.5Very low124 Ų124130.4 Ų130.481%0.80580%0.801SS**  -134.3141.5118.436.2-27.4000115.1
132E46.4Very low44.8Very low203 Ų203134.8 Ų134.895%0.94980%0.802SS**  trans16.1113.6153.4-102.7152.887.500120.2
133G39.8Very low45.2Very low76 Ų76137.1 Ų137.178%0.78480%0.804SS**  trans164.387.3168.400000112.4
134V40.4Very low45.4Very low141 Ų141130 Ų13086%0.85580%0.803SS**  trans-51.6161.9172.1-105.10000114
135P44.6Very low45.5Very low109 Ų109133.1 Ų133.171%0.70881%0.807SS**  cis-131.1177.9-26.833.1-12.9000112.9
136E42.7Very low45.8Very low165 Ų165134.4 Ų134.477%0.77180%0.804SS**  trans75.8115.2154.5-105.4-174.272.900120.9
137E48.7Very low46Very low171 Ų171141.3 Ų141.380%0.79981%0.813SS**  77.778124.8-153163116.300119.2
138A54.7Low45.4Very low104 Ų104142.1 Ų142.186%0.8681%0.811SS**  trans-145.251.814500000110.6
139Q46.5Very low46.2Very low152 Ų152142.9 Ų142.971%0.7181%0.807SS**SBendtrans-70.6146.7159.5-110.6-175.6-24.500108.5
140P48.7Very low46.3Very low103 Ų103143.2 Ų143.267%0.66981%0.81SS**  trans-58.3138.9166.627.8-32.9000107.7R142P140-R142 PolarHBondContact O-N 3.2Å
141P50.8Low45.8Very low127 Ų127140.6 Ų140.683%0.82581%0.806SS**  trans-60.3109.9-172.923.8-32.1000108.9L143P141-L143 PolarHBondContact O-N 3.18Å
142R46.1Very low45.3Very low209 Ų209142.4 Ų142.479%0.78981%0.807SS**  trans-73.9119.4165.4-63.7-16576.6-1661.5106.1P140 G144P140-R142 PolarHBondContact O-N 3.2Å; R142-G144 PolarHBondContact O-N 3.26Å
143L49.5Very low45Very low167 Ų167139 Ų13987%0.87480%0.8SS**SBendtrans-38.1129.8162.8-97.377.3000110.8P141P141-L143 PolarHBondContact O-N 3.18Å
144G55.1Low45.3Very low83 Ų83140.5 Ų140.586%0.85681%0.805SS**  trans92.463151.700000118.2R142R142-G144 PolarHBondContact O-N 3.26Å
145Q43.8Very low45.1Very low194 Ų194137.4 Ų137.491%0.90780%0.801SS**  trans-136.6102161.2-151.7164.13.700111
146E45.3Very low45.2Very low165 Ų165136.1 Ų136.177%0.77180%0.795SS**  trans-67137.9173.8-67.5-163.592.900111.1
147R47.6Very low45.1Very low254 Ų254132.8 Ų132.896%0.95879%0.786SS**  trans-131.4103.9166.6-156.1-179.8-178.5-162.80.9108.4
148D40.4Very low45.3Very low141 Ų141132.3 Ų132.375%0.75479%0.789SS**  trans-96156.4169.7-160.1-112.4000107.7
149P51.8Low44.8Very low119 Ų119132.6 Ų132.677%0.77377%0.773SS**  cis-138.6147.131.238.6-18000117.7
150G36.7Very low45.3Very low79 Ų79129.9 Ų129.981%0.81477%0.768SS**SBendtrans120.388.4152.900000115.6
151G36Very low45.8Very low67 Ų67131.3 Ų131.369%0.69178%0.778SS**SBendtrans142.582.9159.200000114.9
152I36.6Very low45.5Very low162 Ų162131.2 Ų131.283%0.83177%0.768SS**SBendtrans70.8111.7154.367163.4000120
153T39.1Very low45.7Very low131 Ų131129.3 Ų129.380%0.80477%0.772SS**  trans7483.2148.763.30000119.1
154A45.5Very low45.3Very low107 Ų107127.7 Ų127.788%0.88477%0.77SS**  56.4113.511700000118.7
155G37Very low45.1Very low76 Ų76133.1 Ų133.178%0.78477%0.77SS**  trans117.170.6137.900000115.3T157G155-T157 PolarHBondContact O-N 3.14Å
156S46.8Very low45.6Very low83 Ų83133 Ų13358%0.5877%0.769SS**  trans-51.7123.4146129.80000108.9
157T40.3Very low45.8Very low95 Ų95133 Ų13358%0.58377%0.769SS**  trans-179108.3130.5-67.60000107.4G155 E159G155-T157 PolarHBondContact O-N 3.14Å; T157-E159 HydrophobicContact CG2-CB 3.69Å; T157-E159 HydrophobicContact CG2-CG 4.04Å; T157-E159 PolarHBondContact O-N 3.38Å
158D53Low46.5Very low160 Ų160125.5 Ų125.586%0.85675%0.753SS**  trans-63.689152177.165.9000106.8
159E45.1Very low46.3Very low111 Ų111125.2 Ų125.252%0.51976%0.756SS.*  trans-105.6121.8169.2-138.1-174.18900106.1T157 M162T157-E159 HydrophobicContact CG2-CB 3.69Å; T157-E159 HydrophobicContact CG2-CG 4.04Å; T157-E159 PolarHBondContact O-N 3.38Å; E159-M162 VanDerWaalsContact CD-SD 3.51Å; E159-M162 HydrophobicContact CG-CG 4.14Å; E159-M162 HydrophobicContact CG-SD 4.07Å; E159-M162 WeakPolarHBondContact OE1-CB 3.35Å; E159-M162 WeakPolarHBondContact OE1-CG 3.49Å
160P57.2Low46.1Very low94 Ų94124.3 Ų124.361%0.6175%0.75SS**  trans-56.2145.3162.128.6-33.1000106.6M162P160-M162 VanDerWaalsContact C-N 3.33Å; P160-M162 PolarHBondContact O-N 3.4Å
161P59.1Low46.4Very low134 Ų134127.3 Ų127.387%0.8774%0.743SS**  trans-54.6101.7-179.822.2-32.6000108.9L163P161-L163 PolarHBondContact O-N 3.47Å
162M44.4Very low46.6Very low125 Ų125132.5 Ų132.562%0.61675%0.754SS**  trans-65121.9176.5-82.3-174.145.100105.6E159 P160 T164E159-M162 VanDerWaalsContact CD-SD 3.51Å; E159-M162 HydrophobicContact CG-CG 4.14Å; E159-M162 HydrophobicContact CG-SD 4.07Å; E159-M162 WeakPolarHBondContact OE1-CB 3.35Å; E159-M162 WeakPolarHBondContact OE1-CG 3.49Å; P160-M162 VanDerWaalsContact C-N 3.33Å; P160-M162 PolarHBondContact O-N 3.4Å; M162-T164 VanDerWaalsContact C-N 3.26Å; M162-T164 PolarHBondContact O-N 3.35Å
163L48.5Very low46.6Very low168 Ų168130.3 Ų130.388%0.8874%0.744SS**  trans-53.192.7168.6-172.671.4000107.8P161 K165P161-L163 PolarHBondContact O-N 3.47Å; L163-K165 VanDerWaalsContact C-N 3.32Å; L163-K165 PolarHBondContact O-N 3.09Å
164T41.5Very low46.6Very low134 Ų134133 Ų13382%0.82275%0.747SS**  trans-70.496.1175.645.20000107.8M162 E166M162-T164 VanDerWaalsContact C-N 3.26Å; M162-T164 PolarHBondContact O-N 3.35Å; T164-E166 PolarHBondContact O-N 3.34Å
165K51.9Low46.3Very low197 Ų197132.4 Ų132.486%0.85774%0.742SS**  trans-73.996.1163-156.3-178.2-172.8-173.80105.9L163L163-K165 VanDerWaalsContact C-N 3.32Å; L163-K165 PolarHBondContact O-N 3.09Å
166E54.5Low46.3Very low192 Ų192138 Ų13890%0.89775%0.748SS**  trans-105.2120161.5-160.4-175.3105.800108.4T164T164-E166 PolarHBondContact O-N 3.34Å
167E48.9Very low46.1Very low163 Ų163141.8 Ų141.876%0.76276%0.762SS**  trans-86.4177.7179.9-138.5-162.193.200110
168P61.6Low46Very low98 Ų98142.3 Ų142.364%0.63677%0.769SS**  trans-100.6-172.6-130.230.1-5.8000112.4
169V37.2Very low45.1Very low135 Ų135137.5 Ų137.582%0.81876%0.757SS**  trans150140.5149160.50000111
170P46.6Very low44.7Very low99 Ų99137.8 Ų137.864%0.64377%0.766SS**  -132.5167.6-53.741.8-22.5000112.2
171E43.2Very low44.5Very low142 Ų142144.6 Ų144.666%0.66478%0.78SS**  trans35.496.5131.2-155.3169.7177.600119.7L173E171-L173 HydrophobicContact CG-CD1 4.25Å; E171-L173 HydrophobicContact CG-CD2 3.31Å; E171-L173 HydrophobicContact CG-CG 3.65Å; E171-L173 WeakPolarHBondContact OE1-CD2 3.31Å
172L40Very low43.6Very low177 Ų177145.9 Ų145.993%0.92778%0.776SS**  trans-12586.7141.1-75.7-173.1000109.2E174L172-E174 PolarHBondContact O-N 3.03Å
173L38.3Very low43.6Very low116 Ų116145.5 Ų145.561%0.60778%0.781SS**  trans-24.7118.6151.4-41.5176.5000111.5E171E171-L173 HydrophobicContact CG-CD1 4.25Å; E171-L173 HydrophobicContact CG-CD2 3.31Å; E171-L173 HydrophobicContact CG-CG 3.65Å; E171-L173 WeakPolarHBondContact OE1-CD2 3.31Å
174E37.7Very low43.5Very low186 Ų186149.8 Ų149.887%0.86979%0.785SS**  72.9141.295.2-65.4-140.1105.400115.8L172L172-E174 PolarHBondContact O-N 3.03Å
175A38.8Very low43.7Very low95 Ų95154.4 Ų154.479%0.78579%0.788SS**  trans74.6126.1-174.700000113.9
176E37.9Very low43.3Very low193 Ų193149.7 Ų149.790%0.90279%0.786SS**  cis-144.7134.546.9-62.9-175.395.200113
177D42.1Very low42.4Very low164 Ų164148.6 Ų148.688%0.87779%0.785SS**  trans-64.8122.9157.6174.552.6000109.5
178S38.4Very low41.9Very low106 Ų106149.6 Ų149.674%0.74179%0.789SS**  trans179.8102.6159.7159.10000111.2
179G34.7Very low41.1Very low58 Ų58151.6 Ų151.660%0.59879%0.79SS**  69.7119.2120.800000120.3
180V36.6Very low41.1Very low117 Ų117153.7 Ų153.771%0.70979%0.788SS**  trans80.2104.1132.1-168.50000117.5M182V180-M182 PolarHBondContact O-N 3.36Å
181R51.8Low41.3Very low237 Ų237152.5 Ų152.589%0.89479%0.794SS**  11.396.9129.5-64.9174.6163.8-175.4-4.1115
182M41.4Very low41.4Very low162 Ų162153.1 Ų153.180%0.79880%0.801SS**  trans-133.7103.4155.3-76.7-59.2170.100111.1V180 R184V180-M182 PolarHBondContact O-N 3.36Å; M182-R184 PolarHBondContact O-N 3.38Å
183T44.3Very low41.8Very low117 Ų117155 Ų15572%0.71880%0.802SS**  trans-7.6113.1151.849.50000115.5R185T183-R185 PolarHBondContact O-N 3.28Å
184R45.6Very low42.2Very low257 Ų257155.7 Ų155.797%0.9781%0.811SS**SBendtrans-68.377163.7-168.6-177.4-173.5-168.33.5110.1M182M182-R184 PolarHBondContact O-N 3.38Å
185R45.5Very low42.6Very low231 Ų231155.7 Ų155.787%0.87281%0.811SS**  trans-146.281164.3-75.4-168.2-178.5-1761.7109.4T183T183-R185 PolarHBondContact O-N 3.28Å
186A43.8Very low43.1Very low99 Ų99156.2 Ų156.282%0.81881%0.807SS**  trans-179.385.9152.400000110.4
187L36Very low43.7Very low169 Ų169155.5 Ų155.589%0.88581%0.808SS**  trans-16092.6136.8-126.1-179.9000107.3
188H38.1Very low44.3Very low183 Ų183158.7 Ų158.785%0.84781%0.808SS**  trans-77.7159.7158.9-106.179.6000108.6
189E45.2Very low44.7Very low140 Ų140164.9 Ų164.965%0.65482%0.815SS**  trans87.281.6159.1-156.4-149.3102.100115.1
190K38.1Very low45.2Very low179 Ų179170.2 Ų170.278%0.77883%0.829SS**  -141112.4116.5-58.3-56.4153.5-154.40107.3L192K190-L192 PolarHBondContact O-N 3.03Å
191G50.5Low46.4Very low74 Ų74171.9 Ų171.976%0.76383%0.833SS**  trans-69.7109.2-17900000111.1
192L44.1Very low46.4Very low156 Ų156166.6 Ų166.682%0.81783%0.829SS**  trans-133.7101.5150.2-73.6174.5000106.6K190 T194K190-L192 PolarHBondContact O-N 3.03Å; L192-T194 PolarHBondContact O-N 2.67Å
193K49.5Very low46.9Very low216 Ų216170.3 Ų170.394%0.93983%0.834SS**  trans-6197.3174.7-66.6167179171.80107.9
194T45.2Very low47Very low130 Ų130176.8 Ų176.880%0.79885%0.846SS**  trans-111.1102.9161.546.40000106.9L192L192-T194 PolarHBondContact O-N 2.67Å
195E47Very low46.9Very low186 Ų186167.8 Ų167.887%0.86983%0.833SS**  trans-55.9127.5178.4-162.5161.3107.700109.6L197E195-L197 PolarHBondContact O-N 3.13Å; E195-L197 VanDerWaalsContact O-N 3.13Å
196P49.5Very low47.3Very low107 Ų107165.3 Ų165.370%0.69584%0.836SS**  trans-67.7118.4174.726.4-30.7000107.6R198P196-R198 PolarHBondContact O-N 2.93Å
197L50.4Low47.4Very low177 Ų177171.6 Ų171.693%0.92784%0.838SS**  trans-53.883176.7-165.572.2000110.6E195 R199E195-L197 PolarHBondContact O-N 3.13Å; E195-L197 VanDerWaalsContact O-N 3.13Å; L197-R199 PolarHBondContact O-N 3.4Å
198R53.8Low48.3Very low231 Ų231169 Ų16987%0.87283%0.83SS**  trans-74.896.9170.9-74.8-168.6127172.3-0.3107.2P196 L200P196-R198 PolarHBondContact O-N 2.93Å; R198-L200 PolarHBondContact O-N 3.37Å
199R48.1Very low48.6Very low237 Ų237168 Ų16889%0.89483%0.831SS**  trans-36.2116.8165.4-156.6177.4-65.9-168.1-0.9110L197 L201L197-R199 PolarHBondContact O-N 3.4Å; R199-L201 PolarHBondContact O-N 3.4Å
200L45.8Very low48.3Very low170 Ų170165.9 Ų165.989%0.8984%0.837SS**  trans-50.4116.7-179.2-66.7154.2000111.5R198R198-L200 PolarHBondContact O-N 3.37Å
201L60.5Low48.7Very low151 Ų151167.9 Ų167.979%0.79184%0.84SS**  trans-96.3130.3155.8-72.1169.9000107.4R199 R203R199-L201 PolarHBondContact O-N 3.4Å; L201-R203 PolarHBondContact O-N 3.17Å
202P52.3Low48.5Very low126 Ų126170.2 Ų170.282%0.81884%0.841SS**  trans-65.4103.1169.1-1629.5000108.9R204P202-R204 PolarHBondContact O-N 3.06Å
203R51.3Low48.4Very low241 Ų241166.8 Ų166.891%0.90983%0.831SS**  trans-68.8102.7170.2-65-176.174.9137.31107.5L201 G205L201-R203 PolarHBondContact O-N 3.17Å; R203-G205 PolarHBondContact O-N 2.93Å
204R46.1Very low48.2Very low252 Ų252161.8 Ų161.895%0.95182%0.823SS**  trans-59.9101.1159.9-95.1-179.7157-178-5.8107.7P202 L206P202-R204 PolarHBondContact O-N 3.06Å; R204-L206 PolarHBondContact O-N 2.88Å
205G45.2Very low47.8Very low68 Ų68162.4 Ų162.470%0.70183%0.827SS**  trans-71.8119171.400000110.2R203 R207R203-G205 PolarHBondContact O-N 2.93Å; G205-R207 PolarHBondContact O-N 3.46Å
206L52.7Low47.8Very low179 Ų179157.8 Ų157.894%0.93782%0.82SS**  trans-63.7113.4151.9-86.7149.8000107.5R204R204-L206 PolarHBondContact O-N 2.88Å
207R46.7Very low47.6Very low231 Ų231159.3 Ų159.387%0.87283%0.827SS**  trans-134.5129.1158.9-73.1-171.772.5-108.33.3110.1G205G205-R207 PolarHBondContact O-N 3.46Å
208T54.6Low47.4Very low116 Ų116156.8 Ų156.871%0.71282%0.821SS**  trans-70.2150.8179.950.50000112.5
209N44Very low46.6Very low161 Ų161152.8 Ų152.886%0.86182%0.818SS**  trans51.3117.5150.5-65.7-34.2000119.2
210A39.9Very low46.3Very low96 Ų96148.3 Ų148.379%0.79382%0.817SS**  166.5129.5110.500000110.5
211R46Very low46.1Very low221 Ų221150.8 Ų150.883%0.83481%0.814SS**  trans-60146.1169.1-169.2177.7-179.7-137.83.1110.1
212P47.1Very low45.3Very low122 Ų122147.9 Ų147.979%0.79281%0.812SS**  -131.8152.9124.233.8-22.8000113.5
213S41.7Very low45.3Very low84 Ų84148 Ų14859%0.58781%0.812SS**  trans-64.8150.1-175.6-39.30000113.7
214S44.2Very low44.8Very low111 Ų111140.5 Ų140.578%0.77681%0.811SS**  trans64104.4139-162.10000118.8
215T38Very low44.3Very low144 Ų144132.2 Ų132.288%0.88380%0.803SS**  -146.5121.7128.2-73.90000108
216A46.3Very low44.5Very low88 Ų88132.7 Ų132.773%0.72781%0.808SS**  trans-78.4142.6-174.200000111.7
217V44.2Very low44.1Very low139 Ų139130 Ų13084%0.84280%0.804SS**  trans-142.9134.3148.6-88.40000108
218P46.7Very low44.2Very low124 Ų124129 Ų12981%0.80581%0.807SS**  trans-81.7124.5-16130.7-34.3000113
219D38.2Very low44.1Very low148 Ų148128 Ų12879%0.79181%0.809SS**  trans-81.1116.9163.3-168.13.9000108.5R221D219-R221 PolarHBondContact O-N 3.36Å; D219-R221 VanDerWaalsContact O-N 3.12Å
220T42.2Very low44.7Very low143 Ų143126.4 Ų126.488%0.87781%0.808SS**  trans-82.286.6176.9-2.30000108.2
221R40.7Very low45.4Very low222 Ų222133.5 Ų133.584%0.83881%0.814SS**  trans-113.2104.2167-167.7171.2-177.1177.31.1110.6D219D219-R221 PolarHBondContact O-N 3.36Å; D219-R221 VanDerWaalsContact O-N 3.12Å
222A42.6Very low45.9Very low89 Ų89127.3 Ų127.374%0.73681%0.81SS**  trans-72.6149.7161.700000110.5
223P53.2Low46.4Very low128 Ų128127.5 Ų127.583%0.83181%0.811SS**  trans-99.8160-172.938.1-32.1000112.8
224G40.2Very low47Very low85 Ų85134.9 Ų134.988%0.87683%0.826SS**  trans111.5126.2150.500000115.4
225G37.1Very low47.7Very low77 Ų77136.3 Ų136.379%0.79483%0.831SS**  trans146.775.9167.900000112.5
226G48.5Very low48.8Very low78 Ų78136.4 Ų136.480%0.80482%0.824SS**  trans-62.8145.5170.700000111.6
227S43.6Very low49.4Very low123 Ų123138 Ų13886%0.8683%0.827SS**  trans-151.8100.4159.2-81.50000109.2A229S227-A229 PolarHBondContact O-N 2.97Å
228K49.5Very low49.8Very low211 Ų211139 Ų13992%0.91782%0.823SS**PPolyproline II helixtrans-63.4120163.2-84.9-179.8166.6-169.10108
229A52.3Low50.1Low93 Ų93136.8 Ų136.877%0.76982%0.822SS**PPolyproline II helixtrans-83.912416200000109.1S227S227-A229 PolarHBondContact O-N 2.97Å
230P57Low50.9Low128 Ų128138.8 Ų138.883%0.83182%0.824SS**PPolyproline II helixtrans-76.7124.9172.728.4-30.3000110.7
231R53.6Low51.4Low246 Ų246135.7 Ų135.793%0.92882%0.82SS**PPolyproline II helixtrans-63.2132.4168-87.5178.5162.8-138.2-1.5110.2
232A56.7Low51.7Low90 Ų90140.6 Ų140.674%0.74484%0.838SS**PPolyproline II helixtrans-64.7142.4171.300000112.1
233P59Low52.1Low126 Ų126143.2 Ų143.282%0.81884%0.844SS**PPolyproline II helixtrans-77.5138.2177.229.1-32000112.5
234R52.3Low52.1Low240 Ų240144 Ų14491%0.90684%0.844SS**PPolyproline II helixtrans-71123.9174.9-67.1168.577.21552109.8
235T58.8Low52.7Low141 Ų141147.3 Ų147.387%0.86584%0.842SS**PPolyproline II helixtrans-72.4124.8169.810000110.2
236I61.6Low53.7Low145 Ų145151.4 Ų151.474%0.74485%0.845SS**PPolyproline II helixtrans-95.9126.4170.9-60177.3000107.4Q238I236-Q238 PolarHBondContact O-N 3.43Å
237P60.1Low54Low123 Ų123156 Ų15680%0.79985%0.848SS**  trans-78.6115.1173.329.3-30.1000110.4G239P237-G239 PolarHBondContact O-N 3.12Å
238Q52.6Low54.7Low160 Ų160158.2 Ų158.275%0.74885%0.847SS**  trans-74.1105.6167.3-81-88.6-19.100109.1I236I236-Q238 PolarHBondContact O-N 3.43Å
239G51.6Low55.1Low76 Ų76154.4 Ų154.478%0.78484%0.842SS**  trans-84.3117.9159.500000109.2P237P237-G239 PolarHBondContact O-N 3.12Å
240K55.2Low55.3Low191 Ų191159.2 Ų159.283%0.8385%0.848SS**  trans-117.1107.6163.7-94176.9174.11790108.1
241G52.5Low55.1Low77 Ų77161.8 Ų161.879%0.79485%0.849SS**  trans-90129.7155.800000109.3
242R47.5Very low55.2Low326 Ų326154.1 Ų154.1100%1.2384%0.842SS**  trans-174.50131.6-110.4-178.4-180-103.92108.5

Retrieved 242 of 242 residues in 46.8 ms (Link to these results)