A0A087YQ27_POEFO Loading...

MID1 interacting protein 1b

AlphaFold DB , UniProt , Accession A0A087YQ27, Species POEFO (Poecilia formosa, Amazon molly), Gene MID1IP1, Length 146 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
1M35.4Very low50.7Low243 Ų243150.7 Ų150.7100%1.19776%0.758SS**  0115.80-77.7175.8-175.800107.3Q3M1-Q3 PolarHBondContact O-N 2.93Å
2M42.7Very low52.3Low188 Ų188148.9 Ų148.993%0.92675%0.752SS**  trans-80.9109.1167.5-87.5175168.500106.9I4M2-I4 PolarHBondContact O-N 3.23Å
3Q49.5Very low54.6Low191 Ų191141.2 Ų141.289%0.89372%0.72SS**  trans-64.1112.9166.4-98.8-177.3-61.100107.4M1 S5M1-Q3 PolarHBondContact O-N 2.93Å; Q3-S5 PolarHBondContact O-N 3.14Å
4I54.2Low56.8Low129 Ų129138.4 Ų138.466%0.66271%0.707SS**  trans-79.8116.9172.2-45163.2000105M2 D6M2-I4 PolarHBondContact O-N 3.23Å; I4-D6 VanDerWaalsContact CB-OD2 3.32Å; I4-D6 WeakPolarHBondContact CB-OD2 3.39Å; I4-D6 VanDerWaalsContact CG2-CG 3.44Å; I4-D6 WeakPolarHBondContact CG2-OD1 3.36Å; I4-D6 WeakPolarHBondContact CG2-OD2 3.34Å; I4-D6 PolarHBondContact O-N 3.4Å
5S48.8Very low58.6Low96 Ų96139.3 Ų139.367%0.67170%0.704SS**  trans-72.258.5176.9-58.50000110.6Q3 S7Q3-S5 PolarHBondContact O-N 3.14Å; S5-S7 PolarHBondContact O-N 3.23Å
6D51.9Low60.5Low107 Ų107132.4 Ų132.457%0.57267%0.672SS**Hα-helixtrans-67.7-22-170.4-76.4-45.9000113.4I4I4-D6 VanDerWaalsContact CB-OD2 3.32Å; I4-D6 WeakPolarHBondContact CB-OD2 3.39Å; I4-D6 VanDerWaalsContact CG2-CG 3.44Å; I4-D6 WeakPolarHBondContact CG2-OD1 3.36Å; I4-D6 WeakPolarHBondContact CG2-OD2 3.34Å; I4-D6 PolarHBondContact O-N 3.4Å
7S54.3Low62.1Low108 Ų108127.8 Ų127.876%0.75566%0.658SS**Hα-helixtrans-83.3-20.3-166.1-1530000115.4S5S5-S7 PolarHBondContact O-N 3.23Å
8Y48.4Very low63.6Low202 Ų202122.9 Ų122.979%0.79263%0.632SS**Hα-helixtrans-97.1-22.3-174.4-155.3-99.7000113.8
9N53.3Low64.9Low108 Ų108119.2 Ų119.258%0.57862%0.619SS**Hα-helixtrans-92.3-13.6-178.6-76.1-75.7000113.8K11 N12 S13N9-K11 VanDerWaalsContact C-N 3.26Å; N9-K11 PolarHBondContact O-N 3.49Å; N9-N12 PolarHBondContact O-N 3.39Å; N9-N12 VanDerWaalsContact O-N 3.1Å; N9-S13 PolarHBondContact O-N 3.04Å
10Q57.6Low66.2Low136 Ų136120.4 Ų120.464%0.63662%0.615SS**G310 helixtrans-64.9-28.8-174.6-158.6174.210.900113.2N12 S13 T16Q10-N12 PolarHBondContact O-N 3.16Å; Q10-S13 WeakPolarHBondContact O-CB 3.46Å; Q10-S13 PolarHBondContact O-N 3.01Å; Q10-T16 WeakPolarHBondContact O-CB 3.29Å; Q10-T16 PolarHBondContact O-OG1 3.03Å
11K61.5Low67.5Low150 Ų150117.2 Ų117.265%0.65260%0.596SS**G310 helixtrans-69.9-21.4177.4-67.4-177.9-179.3175.10113.7N9 R20N9-K11 VanDerWaalsContact C-N 3.26Å; N9-K11 PolarHBondContact O-N 3.49Å; K11-R20 PolarHBondContact O-NH1 2.95Å
12N70.1Confident70.2Confident129 Ų129107.4 Ų107.469%0.6955%0.549SS*.G310 helixtrans-107.55.6-179.3-56.4-21.3000112.1N9 Q10N9-N12 PolarHBondContact O-N 3.39Å; N9-N12 VanDerWaalsContact O-N 3.1Å; Q10-N12 PolarHBondContact O-N 3.16Å
13S82.8Confident72.6Confident49 Ų49100.4 Ų100.434%0.34353%0.525SS..  trans-65.6141.2176.9178.80000110.3N9 Q10 F15 T16 A17N9-S13 PolarHBondContact O-N 3.04Å; Q10-S13 WeakPolarHBondContact O-CB 3.46Å; Q10-S13 PolarHBondContact O-N 3.01Å; S13-F15 PolarHBondContact O-N 3.21Å; S13-F15 PolarHBondContact OG-N 3.38Å; S13-T16 WeakPolarHBondContact O-CA 3.48Å; S13-T16 WeakPolarHBondContact O-CB 3.4Å; S13-T16 PolarHBondContact O-N 3.41Å; S13-A17 PolarHBondContact O-N 3.3Å
14L84.7Confident74.8Confident102 Ų10294.2 Ų94.253%0.53451%0.506SS..Hα-helixtrans-50.6-41.8172.2178.263.7000111.1T16 A17 M18 L120L14-T16 VanDerWaalsContact C-N 3.29Å; L14-T16 PolarHBondContact O-N 2.94Å; L14-A17 PolarHBondContact O-N 3.43Å; L14-M18 HydrophobicContact CD1-CG 4.2Å; L14-M18 HydrophobicContact CD1-SD 4.25Å; L14-M18 HydrophobicContact CD2-SD 4.41Å; L14-M18 HydrophobicContact CG-CG 4.32Å; L14-M18 HydrophobicContact CG-SD 3.9Å; L14-M18 VanDerWaalsContact O-CG 3.27Å; L14-M18 WeakPolarHBondContact O-CG 3.46Å; L14-M18 PolarHBondContact O-N 3.47Å; L14-L120 HydrophobicContact CD2-CD2 3.64Å
15F84.4Confident76.6Confident151 Ų15188.3 Ų88.366%0.66248%0.476SS*.Hα-helixtrans-58.9-40.7177.6-178.8-96.8000112.5S13 S19S13-F15 PolarHBondContact O-N 3.21Å; S13-F15 PolarHBondContact OG-N 3.38Å; F15-S19 WeakPolarHBondContact O-CB 3.23Å; F15-S19 PolarHBondContact O-N 2.91Å; F15-S19 PolarHBondContact O-OG 3.27Å
16T87.9Confident78.7Confident30 Ų3086.2 Ų86.218%0.18446%0.457CS..Hα-helixtrans-70.7-39.4178.4-52.10000111.1Q10 S13 L14 S19 R20Q10-T16 WeakPolarHBondContact O-CB 3.29Å; Q10-T16 PolarHBondContact O-OG1 3.03Å; S13-T16 WeakPolarHBondContact O-CA 3.48Å; S13-T16 WeakPolarHBondContact O-CB 3.4Å; S13-T16 PolarHBondContact O-N 3.41Å; L14-T16 VanDerWaalsContact C-N 3.29Å; L14-T16 PolarHBondContact O-N 2.94Å; T16-S19 PolarHBondContact O-N 2.89Å; T16-R20 VanDerWaalsContact CG2-CZ 3.43Å; T16-R20 WeakPolarHBondContact O-CG 3.45Å; T16-R20 PolarHBondContact O-N 2.87Å
17A88.1Confident80.8Confident53 Ų5385.9 Ų85.944%0.43846%0.455SS..Hα-helixtrans-62.6-46.6174.400000111.5S13 L14 S19 R20 F21S13-A17 PolarHBondContact O-N 3.3Å; L14-A17 PolarHBondContact O-N 3.43Å; A17-S19 PolarHBondContact O-N 3.46Å; A17-R20 PolarHBondContact O-N 3.42Å; A17-F21 PolarHBondContact O-N 3.48Å
18M89.1Confident82.7Confident40 Ų4082.8 Ų82.820%0.19743%0.429CS..Hα-helixtrans-60.6-45.4175.7-67.9175.895.300111.6L14 R20 F21 I22 M82 F113 L117L14-M18 HydrophobicContact CD1-CG 4.2Å; L14-M18 HydrophobicContact CD1-SD 4.25Å; L14-M18 HydrophobicContact CD2-SD 4.41Å; L14-M18 HydrophobicContact CG-CG 4.32Å; L14-M18 HydrophobicContact CG-SD 3.9Å; L14-M18 VanDerWaalsContact O-CG 3.27Å; L14-M18 WeakPolarHBondContact O-CG 3.46Å; L14-M18 PolarHBondContact O-N 3.47Å; M18-R20 VanDerWaalsContact C-N 3.3Å; M18-R20 PolarHBondContact O-N 3.24Å; M18-F21 WeakPolarHBondContact O-CB 3.47Å; M18-F21 PolarHBondContact O-N 2.85Å; M18-I22 WeakPolarHBondContact O-CG1 3.49Å; M18-I22 PolarHBondContact O-N 3.45Å; M18-M82 HydrophobicContact CB-SD 4.38Å; M18-M82 HydrophobicContact CE-CB 4.38Å; M18-M82 HydrophobicContact CE-CG 3.79Å; M18-M82 HydrophobicContact CE-SD 3.97Å; M18-M82 HydrophobicContact CG-SD 4.3Å; M18-F113 HydrophobicContact CE-CZ 4.39Å; M18-L117 HydrophobicContact CE-CD1 4.41Å
19S89.2Confident84.7Confident53 Ų5375.5 Ų75.537%0.37141%0.405SS..Hα-helixtrans-61.1-39178.2-60.20000112.4F15 T16 A17 G23F15-S19 WeakPolarHBondContact O-CB 3.23Å; F15-S19 PolarHBondContact O-N 2.91Å; F15-S19 PolarHBondContact O-OG 3.27Å; T16-S19 PolarHBondContact O-N 2.89Å; A17-S19 PolarHBondContact O-N 3.46Å; S19-G23 PolarHBondContact O-N 2.8Å
20R91.1Very high86.5Confident143 Ų14377.7 Ų77.754%0.5441%0.411SS..Hα-helixtrans-67-43.7175.3-73.8175.9-178.1129.70.6111.8K11 T16 A17 M18 G23 A24K11-R20 PolarHBondContact O-NH1 2.95Å; T16-R20 VanDerWaalsContact CG2-CZ 3.43Å; T16-R20 WeakPolarHBondContact O-CG 3.45Å; T16-R20 PolarHBondContact O-N 2.87Å; A17-R20 PolarHBondContact O-N 3.42Å; M18-R20 VanDerWaalsContact C-N 3.3Å; M18-R20 PolarHBondContact O-N 3.24Å; R20-G23 PolarHBondContact O-N 3.2Å; R20-A24 PolarHBondContact O-N 3.32Å
21F92.4Very high88.2Confident53 Ų5375.9 Ų75.923%0.23241%0.409CS..Hα-helixtrans-59.1-51.7175.9170.4-98.7000111.5A17 M18 G23 A24 V25 L75 I78 R79 M82A17-F21 PolarHBondContact O-N 3.48Å; M18-F21 WeakPolarHBondContact O-CB 3.47Å; M18-F21 PolarHBondContact O-N 2.85Å; F21-G23 VanDerWaalsContact C-N 3.28Å; F21-G23 PolarHBondContact O-N 3.44Å; F21-A24 PolarHBondContact O-N 3.3Å; F21-V25 HydrophobicContact CD1-CG2 4.41Å; F21-V25 HydrophobicContact CD2-CG2 4.1Å; F21-V25 HydrophobicContact CE1-CG2 3.99Å; F21-V25 HydrophobicContact CE2-CG2 3.64Å; F21-V25 HydrophobicContact CG-CG2 4.47Å; F21-V25 HydrophobicContact CZ-CG2 3.58Å; F21-V25 WeakPolarHBondContact O-CG2 3.49Å; F21-V25 PolarHBondContact O-N 2.95Å; F21-L75 HydrophobicContact CE2-CD2 3.81Å; F21-L75 HydrophobicContact CZ-CD2 4.33Å; F21-I78 HydrophobicContact CE1-CB 4.47Å; F21-I78 HydrophobicContact CE1-CG2 3.79Å; F21-I78 HydrophobicContact CZ-CB 4.09Å; F21-I78 HydrophobicContact CZ-CG2 3.64Å; F21-R79 HydrophobicContact CE1-CB 4.08Å; F21-M82 HydrophobicContact CD1-CE 3.59Å; F21-M82 HydrophobicContact CD1-SD 3.4Å; F21-M82 WeakPolarHBondContact CD1-SD 3.4Å; F21-M82 HydrophobicContact CE1-CE 3.71Å; F21-M82 HydrophobicContact CE1-SD 3.72Å; F21-M82 HydrophobicContact CG-CE 4.3Å; F21-M82 HydrophobicContact CG-SD 4.44Å
22I91.9Very high89.6Confident38 Ų3870.1 Ų70.120%0.19539%0.387CS..Hα-helixtrans-57-44.1177.7-66.7165.8000110.5M18 A24 V25 N26 R79 M82 E83M18-I22 WeakPolarHBondContact O-CG1 3.49Å; M18-I22 PolarHBondContact O-N 3.45Å; I22-A24 PolarHBondContact O-N 2.88Å; I22-V25 PolarHBondContact O-N 3.4Å; I22-N26 WeakPolarHBondContact CG2-ND2 3.49Å; I22-N26 VanDerWaalsContact O-CB 3.26Å; I22-N26 WeakPolarHBondContact O-CB 3.39Å; I22-N26 PolarHBondContact O-N 3.45Å; I22-N26 PolarHBondContact O-ND2 2.91Å; I22-R79 HydrophobicContact CG1-CG 4.47Å; I22-M82 HydrophobicContact CD1-CB 4.39Å; I22-M82 HydrophobicContact CG1-SD 4.34Å; I22-E83 HydrophobicContact CD1-CG 4.42Å; I22-E83 WeakPolarHBondContact CG2-OE1 3.42Å
23G93.5Very high90.6Very high41 Ų4172 Ų7242%0.42339%0.394SS..Hα-helixtrans-59.6-42.7175.900000113.3S19 R20 F21 N27S19-G23 PolarHBondContact O-N 2.8Å; R20-G23 PolarHBondContact O-N 3.2Å; F21-G23 VanDerWaalsContact C-N 3.28Å; F21-G23 PolarHBondContact O-N 3.44Å; G23-N27 WeakPolarHBondContact O-CB 3.45Å; G23-N27 PolarHBondContact O-N 3.47Å
24A95Very high90.9Very high61 Ų6173.1 Ų73.150%0.50440%0.398SS..Hα-helixtrans-67.4-46.5178.100000112.2R20 F21 I22 N26 N27 M28R20-A24 PolarHBondContact O-N 3.32Å; F21-A24 PolarHBondContact O-N 3.3Å; I22-A24 PolarHBondContact O-N 2.88Å; A24-N26 VanDerWaalsContact C-N 3.32Å; A24-N26 PolarHBondContact O-N 3.08Å; A24-N27 PolarHBondContact O-N 3.3Å; A24-M28 PolarHBondContact O-N 2.96Å
25V93.5Very high91Very high5 Ų570.2 Ų70.23%0.0339%0.385CS..Hα-helixtrans-65-37.5177.4178.70000111.1F21 I22 M28 D29 L75 K76 R79F21-V25 HydrophobicContact CD1-CG2 4.41Å; F21-V25 HydrophobicContact CD2-CG2 4.1Å; F21-V25 HydrophobicContact CE1-CG2 3.99Å; F21-V25 HydrophobicContact CE2-CG2 3.64Å; F21-V25 HydrophobicContact CG-CG2 4.47Å; F21-V25 HydrophobicContact CZ-CG2 3.58Å; F21-V25 WeakPolarHBondContact O-CG2 3.49Å; F21-V25 PolarHBondContact O-N 2.95Å; I22-V25 PolarHBondContact O-N 3.4Å; V25-M28 HydrophobicContact CG1-CE 3.94Å; V25-M28 WeakPolarHBondContact O-CB 3.32Å; V25-M28 PolarHBondContact O-N 3.36Å; V25-D29 WeakPolarHBondContact O-CB 3.31Å; V25-D29 PolarHBondContact O-N 2.9Å; V25-L75 HydrophobicContact CG2-CB 4.21Å; V25-K76 HydrophobicContact CG1-CG 4.32Å; V25-R79 HydrophobicContact CB-CB 4.29Å; V25-R79 HydrophobicContact CB-CG 4.41Å; V25-R79 HydrophobicContact CG1-CB 3.84Å; V25-R79 HydrophobicContact CG1-CG 4.18Å
26N92.6Very high91.1Very high52 Ų5266.2 Ų66.228%0.27838%0.376SS..Hα-helixtrans-66.1-39.6174.7-75.6-18000112.3I22 A24 M28 D29 Q30 R79I22-N26 WeakPolarHBondContact CG2-ND2 3.49Å; I22-N26 VanDerWaalsContact O-CB 3.26Å; I22-N26 WeakPolarHBondContact O-CB 3.39Å; I22-N26 PolarHBondContact O-N 3.45Å; I22-N26 PolarHBondContact O-ND2 2.91Å; A24-N26 VanDerWaalsContact C-N 3.32Å; A24-N26 PolarHBondContact O-N 3.08Å; N26-M28 VanDerWaalsContact C-N 3.34Å; N26-D29 PolarHBondContact O-N 3.27Å; N26-Q30 WeakPolarHBondContact O-CB 3.46Å; N26-Q30 VanDerWaalsContact O-CG 3.31Å; N26-Q30 WeakPolarHBondContact O-CG 3.39Å; N26-Q30 PolarHBondContact O-N 3.5Å; N26-R79 WeakPolarHBondContact OD1-CD 3.07Å; N26-R79 PolarHBondContact OD1-NH1 2.86Å
27N94.8Very high91.1Very high99 Ų9970.8 Ų70.853%0.52940%0.399SS..Hα-helixtrans-63.9-40.6172.9178.5-107.2000111.9G23 A24 Q30 T31G23-N27 WeakPolarHBondContact O-CB 3.45Å; G23-N27 PolarHBondContact O-N 3.47Å; A24-N27 PolarHBondContact O-N 3.3Å; N27-Q30 PolarHBondContact O-N 2.84Å; N27-T31 WeakPolarHBondContact O-CB 3.42Å; N27-T31 PolarHBondContact O-N 3.05Å; N27-T31 VanDerWaalsContact O-N 3.07Å; N27-T31 PolarHBondContact O-OG1 3.46Å
28M93.9Very high91Very high43 Ų4369.4 Ų69.421%0.21238%0.384CS..Hα-helixtrans-58.8-51.7173-179.5-173.27000111.2A24 V25 N26 Q30 T31 V32 Y72 L75 K76A24-M28 PolarHBondContact O-N 2.96Å; V25-M28 HydrophobicContact CG1-CE 3.94Å; V25-M28 WeakPolarHBondContact O-CB 3.32Å; V25-M28 PolarHBondContact O-N 3.36Å; N26-M28 VanDerWaalsContact C-N 3.34Å; M28-Q30 VanDerWaalsContact C-N 3.3Å; M28-Q30 PolarHBondContact O-N 3.35Å; M28-T31 PolarHBondContact O-N 3.23Å; M28-V32 HydrophobicContact CG-CG2 4.15Å; M28-V32 WeakPolarHBondContact O-CG2 3.47Å; M28-V32 PolarHBondContact O-N 3.01Å; M28-Y72 HydrophobicContact CE-CD2 3.48Å; M28-Y72 VanDerWaalsContact CE-CD2 3.48Å; M28-Y72 HydrophobicContact CE-CE2 3.87Å; M28-Y72 HydrophobicContact CE-CG 4.37Å; M28-Y72 HydrophobicContact CG-CD2 4.07Å; M28-Y72 HydrophobicContact CG-CE2 4.28Å; M28-Y72 HydrophobicContact SD-CD2 3.76Å; M28-Y72 HydrophobicContact SD-CE2 4.44Å; M28-L75 HydrophobicContact CE-CB 3.91Å; M28-L75 HydrophobicContact CE-CD1 4.14Å; M28-L75 HydrophobicContact SD-CD1 3.94Å; M28-K76 HydrophobicContact CE-CG 4.32Å
29D90.4Very high90.8Very high50 Ų5073.8 Ų73.827%0.26740%0.398SS..Hα-helixtrans-61.7-34.8-179.2-162.933.7000112.4V25 N26 Y72 K76 R79V25-D29 WeakPolarHBondContact O-CB 3.31Å; V25-D29 PolarHBondContact O-N 2.9Å; N26-D29 PolarHBondContact O-N 3.27Å; D29-Y72 PolarHBondContact OD1-OH 2.82Å; D29-K76 IonicContact OD1-NZ 3.37Å; D29-K76 PolarHBondContact OD1-NZ 3.48Å; D29-K76 IonicContact OD2-NZ 2.88Å; D29-K76 PolarHBondContact OD2-NZ 2.74Å; D29-R79 IonicContact OD2-CZ 2.88Å; D29-R79 IonicContact OD2-NH1 3.63Å; D29-R79 PolarHBondContact OD2-NH1 3.04Å; D29-R79 IonicContact OD2-NH2 3.84Å; D29-R79 PolarHBondContact OD2-NH2 3.19Å
30Q91.4Very high90.4Very high154 Ų15478.3 Ų78.372%0.7242%0.418SS*.Hα-helixtrans-71.3-31.2173.6-75.1179.1-1500113.2N26 N27 M28N26-Q30 WeakPolarHBondContact O-CB 3.46Å; N26-Q30 VanDerWaalsContact O-CG 3.31Å; N26-Q30 WeakPolarHBondContact O-CG 3.39Å; N26-Q30 PolarHBondContact O-N 3.5Å; N27-Q30 PolarHBondContact O-N 2.84Å; M28-Q30 VanDerWaalsContact C-N 3.3Å; M28-Q30 PolarHBondContact O-N 3.35Å
31T93.5Very high89.9Confident97 Ų9774.1 Ų74.160%0.59541%0.408SS*.Hα-helixtrans-84.9-38.9-176.6-55.40000111.3N27 M28 M33N27-T31 WeakPolarHBondContact O-CB 3.42Å; N27-T31 PolarHBondContact O-N 3.05Å; N27-T31 VanDerWaalsContact O-N 3.07Å; N27-T31 PolarHBondContact O-OG1 3.46Å; M28-T31 PolarHBondContact O-N 3.23Å; T31-M33 PolarHBondContact O-N 3.49Å
32V91.8Very high89.1Confident30 Ų3076.6 Ų76.618%0.18243%0.43CS..  trans-79.284.2179.1-178.20000109.6M28 V34 P35 L38 Y72M28-V32 HydrophobicContact CG-CG2 4.15Å; M28-V32 WeakPolarHBondContact O-CG2 3.47Å; M28-V32 PolarHBondContact O-N 3.01Å; V32-V34 VanDerWaalsContact C-N 3.34Å; V32-V34 PolarHBondContact O-N 3.41Å; V32-P35 HydrophobicContact CG1-CB 4.2Å; V32-P35 HydrophobicContact CG1-CG 4.03Å; V32-L38 HydrophobicContact CG1-CD1 3.71Å; V32-L38 HydrophobicContact CG1-CG 4.32Å; V32-L38 HydrophobicContact CG2-CD1 4.2Å; V32-Y72 HydrophobicContact CB-CD2 4.47Å; V32-Y72 HydrophobicContact CB-CE2 3.89Å; V32-Y72 HydrophobicContact CG1-CD2 4.4Å; V32-Y72 HydrophobicContact CG1-CE2 3.99Å; V32-Y72 HydrophobicContact CG2-CD2 4.29Å; V32-Y72 HydrophobicContact CG2-CE2 4.13Å
33M89.9Confident87.9Confident168 Ų16877.4 Ų77.483%0.82843%0.434SS*.SBendtrans-74.8-23.1-178.9-58.5-154.177.600113.8T31T31-M33 PolarHBondContact O-N 3.49Å
34V89.9Confident86.1Confident73 Ų7384.3 Ų84.344%0.44246%0.456SS..  trans-135.984.8-179.4-171.90000109.1V32 S36 L37V32-V34 VanDerWaalsContact C-N 3.34Å; V32-V34 PolarHBondContact O-N 3.41Å; V34-S36 WeakPolarHBondContact CG1-OG 3.31Å; V34-S36 PolarHBondContact O-N 3.38Å; V34-S36 VanDerWaalsContact O-N 3.13Å; V34-L37 HydrophobicContact CB-CD1 3.95Å; V34-L37 HydrophobicContact CB-CG 4.08Å; V34-L37 HydrophobicContact CG1-CD1 4.19Å; V34-L37 HydrophobicContact CG1-CG 3.86Å; V34-L37 WeakPolarHBondContact O-CB 3.48Å; V34-L37 PolarHBondContact O-N 2.93Å; V34-L37 VanDerWaalsContact O-N 3.12Å
35P86.5Confident84.2Confident40 Ų4087 Ų8726%0.2646%0.461SS..G310 helixtrans-58.4-28.2-175.3-27.435.4000114.4V32 L37 L38 Y69 Y72V32-P35 HydrophobicContact CG1-CB 4.2Å; V32-P35 HydrophobicContact CG1-CG 4.03Å; P35-L37 PolarHBondContact O-N 2.79Å; P35-L37 VanDerWaalsContact O-N 3.13Å; P35-L38 WeakPolarHBondContact O-CB 3.41Å; P35-L38 PolarHBondContact O-N 2.68Å; P35-Y69 HydrophobicContact CB-CD2 4.16Å; P35-Y69 HydrophobicContact CB-CE2 3.85Å; P35-Y69 VanDerWaalsContact O-CD2 3.25Å; P35-Y69 WeakPolarHBondContact O-CD2 3.44Å; P35-Y72 HydrophobicContact CB-CD1 4.24Å; P35-Y72 HydrophobicContact CB-CE1 3.72Å; P35-Y72 HydrophobicContact CG-CE1 3.86Å
36S86.3Confident81.9Confident68 Ų6889.2 Ų89.248%0.47649%0.485SS..G310 helixtrans-62.9-19.6179.258.80000113.9V34 L38 R39V34-S36 WeakPolarHBondContact CG1-OG 3.31Å; V34-S36 PolarHBondContact O-N 3.38Å; V34-S36 VanDerWaalsContact O-N 3.13Å; S36-L38 PolarHBondContact O-N 3.24Å; S36-R39 PolarHBondContact O-N 3.37Å
37L87.5Confident79.7Confident126 Ų12696.2 Ų96.266%0.6652%0.516SS*.G310 helixtrans-72.2-14174.8-64.3179.4000113.1V34 P35 R39 V41V34-L37 HydrophobicContact CB-CD1 3.95Å; V34-L37 HydrophobicContact CB-CG 4.08Å; V34-L37 HydrophobicContact CG1-CD1 4.19Å; V34-L37 HydrophobicContact CG1-CG 3.86Å; V34-L37 WeakPolarHBondContact O-CB 3.48Å; V34-L37 PolarHBondContact O-N 2.93Å; V34-L37 VanDerWaalsContact O-N 3.12Å; P35-L37 PolarHBondContact O-N 2.79Å; P35-L37 VanDerWaalsContact O-N 3.13Å; L37-R39 VanDerWaalsContact C-N 3.32Å; L37-V41 VanDerWaalsContact O-CG2 3.26Å; L37-V41 WeakPolarHBondContact O-CG2 3.26Å
38L86.6Confident77.2Confident24 Ų2498.3 Ų98.313%0.12653%0.528CS..G310 helixtrans-86.3-7.6177-55.2-177.3000112.3V32 P35 S36 M68 Y69 Y72V32-L38 HydrophobicContact CG1-CD1 3.71Å; V32-L38 HydrophobicContact CG1-CG 4.32Å; V32-L38 HydrophobicContact CG2-CD1 4.2Å; P35-L38 WeakPolarHBondContact O-CB 3.41Å; P35-L38 PolarHBondContact O-N 2.68Å; S36-L38 PolarHBondContact O-N 3.24Å; L38-M68 HydrophobicContact CB-CB 4.12Å; L38-M68 HydrophobicContact CB-CG 4.29Å; L38-M68 HydrophobicContact CD1-CG 4.35Å; L38-M68 HydrophobicContact CD2-CE 4.1Å; L38-M68 HydrophobicContact CD2-CG 4.07Å; L38-M68 HydrophobicContact CD2-SD 3.74Å; L38-M68 HydrophobicContact CG-CG 4.47Å; L38-Y69 PolarHBondContact O-N 3.2Å; L38-Y69 VanDerWaalsContact O-N 3.08Å; L38-Y72 HydrophobicContact CD1-CD2 4.28Å; L38-Y72 HydrophobicContact CD1-CG 4.13Å
39R85.4Confident75.1Confident132 Ų132103.6 Ų103.650%0.49856%0.556SS.*THydrogen-bonded Turntrans-71.2141.1177.4-69.8-172.9-173.7175.51.9110.1S36 L37 V41 D67 Y69S36-R39 PolarHBondContact O-N 3.37Å; L37-R39 VanDerWaalsContact C-N 3.32Å; R39-V41 PolarHBondContact O-N 3.37Å; R39-D67 WeakPolarHBondContact CA-OD2 3.33Å; R39-Y69 HydrophobicContact CG-CD1 3.9Å; R39-Y69 HydrophobicContact CG-CD2 4.19Å; R39-Y69 HydrophobicContact CG-CG 3.69Å
40D80.6Confident72.6Confident148 Ų148110.9 Ų110.979%0.79159%0.585SS**THydrogen-bonded Turntrans58.716.5-179.7-48-62.1000113.7P42 D67D40-P42 WeakPolarHBondContact O-CD 3.34Å; D40-D67 PolarHBondContact N-OD2 3.26Å
41V79.8Confident70.5Confident54 Ų54108.7 Ų108.733%0.32758%0.582SS.*  trans-90.6113.8172.2179.20000107.8L37 R39 L43 M68L37-V41 VanDerWaalsContact O-CG2 3.26Å; L37-V41 WeakPolarHBondContact O-CG2 3.26Å; R39-V41 PolarHBondContact O-N 3.37Å; V41-L43 PolarHBondContact O-N 3.1Å; V41-M68 HydrophobicContact CB-CB 4.21Å; V41-M68 HydrophobicContact CG1-CB 4.4Å; V41-M68 HydrophobicContact CG1-SD 4.45Å; V41-M68 PolarHBondContact O-N 2.89Å; V41-M68 VanDerWaalsContact O-N 3.08Å
42P75.5Confident68Low106 Ų106109 Ų10969%0.68859%0.586SS**  trans-62.2137.6173.4-15.728.9000109.2D40 E44D40-P42 WeakPolarHBondContact O-CD 3.34Å; P42-E44 VanDerWaalsContact C-N 3.25Å; P42-E44 PolarHBondContact O-N 2.93Å
43L67.2Low65.6Low55 Ų55117.1 Ų117.129%0.28862%0.622SS.*  trans-71.392.7164.2-73.3161.3000106.1V41 D45 P64 M68V41-L43 PolarHBondContact O-N 3.1Å; L43-D45 PolarHBondContact O-N 3.36Å; L43-P64 HydrophobicContact CB-CG 3.72Å; L43-P64 HydrophobicContact CD1-CB 3.42Å; L43-P64 VanDerWaalsContact CD1-CB 3.42Å; L43-P64 HydrophobicContact CD1-CG 3.42Å; L43-P64 VanDerWaalsContact CD1-CG 3.42Å; L43-P64 HydrophobicContact CG-CG 4.18Å; L43-M68 HydrophobicContact CD2-CB 4.13Å; L43-M68 HydrophobicContact CD2-CG 4.06Å; L43-M68 HydrophobicContact CG-CB 4.42Å
44E56.3Low63.3Low186 Ų186114.6 Ų114.687%0.86962%0.621SS**  trans-53.7128.6177.8-150.4-173.9172.500108P42 G46P42-E44 VanDerWaalsContact C-N 3.25Å; P42-E44 PolarHBondContact O-N 2.93Å; E44-G46 PolarHBondContact O-N 2.77Å
45D54.2Low61Low116 Ų116114.1 Ų114.162%0.6262%0.624SS**  trans-62.579.7-179.2-74.1-41.5000109.7L43 E47L43-D45 PolarHBondContact O-N 3.36Å; D45-E47 WeakPolarHBondContact O-CG 3.43Å; D45-E47 PolarHBondContact O-N 2.93Å; D45-E47 VanDerWaalsContact O-N 3.13Å
46G45.4Very low58.7Low52 Ų52117.6 Ų117.654%0.53665%0.647SS.*  trans-80.296.9-176.300000109.5E44 D48E44-G46 PolarHBondContact O-N 2.77Å; G46-D48 PolarHBondContact O-N 3.37Å
47E46Very low56.5Low199 Ų199119.4 Ų119.493%0.9366%0.66SS**THydrogen-bonded Turntrans-55.813.8172.9-37-170.9-157.500114.6D45D45-E47 WeakPolarHBondContact O-CG 3.43Å; D45-E47 PolarHBondContact O-N 2.93Å; D45-E47 VanDerWaalsContact O-N 3.13Å
48D42.7Very low54.5Low144 Ų144118.2 Ų118.277%0.7766%0.658SS**THydrogen-bonded Turntrans-124.310-167.6-14718.3000114.1G46 K50G46-D48 PolarHBondContact O-N 3.37Å; D48-K50 VanDerWaalsContact C-N 3.25Å; D48-K50 PolarHBondContact O-N 3.05Å
49L49.3Very low52.3Low154 Ų154124.5 Ų124.581%0.80669%0.692SS**  trans-77.779164.2-75.6167.6000109.5V51L49-V51 VanDerWaalsContact C-N 3.26Å; L49-V51 PolarHBondContact O-N 3.24Å
50K38.7Very low50Low202 Ų202121.3 Ų121.388%0.87870%0.7SS**  trans-61.389.3164.7-90.1-167.4176.5-176.70110.1D48D48-K50 VanDerWaalsContact C-N 3.25Å; D48-K50 PolarHBondContact O-N 3.05Å
51V47Very low48.4Very low109 Ų109122.9 Ų122.966%0.66170%0.696SS**  trans-62.9133.9162.1-1780000107.8L49 E53L49-V51 VanDerWaalsContact C-N 3.26Å; L49-V51 PolarHBondContact O-N 3.24Å; V51-E53 PolarHBondContact O-N 3.48Å
52P40.7Very low46.6Very low102 Ų102128.6 Ų128.666%0.66272%0.717SS**  trans-60.6134.3174.322.9-30.3000110.3S54P52-S54 PolarHBondContact O-N 3.19Å
53E41.6Very low45.3Very low201 Ų201130.8 Ų130.894%0.93972%0.718SS**THydrogen-bonded Turntrans-62.942.2-172.7-160.6-174.6136.400114.7V51V51-E53 PolarHBondContact O-N 3.48Å
54S41.9Very low44.7Very low115 Ų115129.7 Ų129.780%0.80471%0.714SS**THydrogen-bonded Turntrans-132.4-1.2-174.7-47.60000114P52P52-S54 PolarHBondContact O-N 3.19Å
55A41.2Very low44.4Very low63 Ų63125.8 Ų125.852%0.52170%0.699SS.*SBendtrans-104.8137.517200000109.4S57A55-S57 PolarHBondContact O-N 3.18Å
56P37.7Very low44.8Very low114 Ų114121.3 Ų121.374%0.7468%0.68SS**  trans-58.4125.1171.625.6-31.1000108.1T58P56-T58 PolarHBondContact O-N 3.31Å; P56-T58 PolarHBondContact O-OG1 3.35Å
57S42Very low46.4Very low106 Ų106120.4 Ų120.474%0.74166%0.663SS**  trans-34.997.3179.1-74.10000112.9A55 N59A55-S57 PolarHBondContact O-N 3.18Å; S57-N59 PolarHBondContact O-N 3.04Å; S57-N59 VanDerWaalsContact O-N 3.16Å
58T43.5Very low48.3Very low100 Ų100114.8 Ų114.861%0.61364%0.638SS**  trans-86.557.7161.7-51.20000107.1P56 G60 Y61P56-T58 PolarHBondContact O-N 3.31Å; P56-T58 PolarHBondContact O-OG1 3.35Å; T58-G60 PolarHBondContact O-N 3.35Å; T58-Y61 HydrophobicContact CG2-CD2 3.62Å; T58-Y61 HydrophobicContact CG2-CG 4.22Å
59N41.6Very low50.4Low157 Ų157111 Ų11184%0.8461%0.613SS**THydrogen-bonded Turntrans-84.950.1-172.8-12268.1000111.4S57S57-N59 PolarHBondContact O-N 3.04Å; S57-N59 VanDerWaalsContact O-N 3.16Å
60G37.4Very low52.1Low65 Ų65106.3 Ų106.367%0.6759%0.593SS**THydrogen-bonded Turntrans-178.811.4-179.100000118.1T58T58-G60 PolarHBondContact O-N 3.35Å
61Y45.8Very low54.4Low181 Ų18197.8 Ų97.871%0.7156%0.559SS**SBendtrans-1110.3179.1-78.7-87.5000114.1T58T58-Y61 HydrophobicContact CG2-CD2 3.62Å; T58-Y61 HydrophobicContact CG2-CG 4.22Å
62F43.8Very low56.4Low174 Ų17493.4 Ų93.476%0.76353%0.531SS*.  trans-108.274.1172.3-92.1-92.7000108P64F62-P64 VanDerWaalsContact C-CD 3.43Å
63Q47.1Very low58.8Low152 Ų15291.7 Ų91.771%0.7152%0.518SS*.  trans-11382.1153.4-167.1160.223.500105D65Q63-D65 VanDerWaalsContact C-N 3.26Å; Q63-D65 PolarHBondContact O-N 3.27Å
64P53.8Low61Low31 Ų3183.2 Ų83.220%0.20148%0.479CS..  trans-76.491.9-176.933.8-32000106.7L43 F62 G66L43-P64 HydrophobicContact CB-CG 3.72Å; L43-P64 HydrophobicContact CD1-CB 3.42Å; L43-P64 VanDerWaalsContact CD1-CB 3.42Å; L43-P64 HydrophobicContact CD1-CG 3.42Å; L43-P64 VanDerWaalsContact CD1-CG 3.42Å; L43-P64 HydrophobicContact CG-CG 4.18Å; F62-P64 VanDerWaalsContact C-CD 3.43Å; P64-G66 PolarHBondContact O-N 3.05Å; P64-G66 VanDerWaalsContact O-N 3.13Å
65D51.1Low63.4Low105 Ų10580.7 Ų80.756%0.56146%0.456SS*.  trans-71.67.3170.8-142.36.3000111.4Q63 E102Q63-D65 VanDerWaalsContact C-N 3.26Å; Q63-D65 PolarHBondContact O-N 3.27Å; D65-E102 HydrophobicContact CB-CB 4.08Å; D65-E102 WeakPolarHBondContact OD2-CB 3.4Å; D65-E102 WeakPolarHBondContact OD2-CG 3.32Å
66G61.4Low65.8Low21 Ų2180.5 Ų80.522%0.21644%0.444CS..SBendtrans-91.9149.7170.500000112.4P64P64-G66 PolarHBondContact O-N 3.05Å; P64-G66 VanDerWaalsContact O-N 3.13Å
67D80.4Confident68.2Low34 Ų3477 Ų7718%0.18242%0.421CS..  trans-67.1158.7171.267.16.3000111.5R39 D40 Y69 S70 S71R39-D67 WeakPolarHBondContact CA-OD2 3.33Å; D40-D67 PolarHBondContact N-OD2 3.26Å; D67-Y69 PolarHBondContact O-N 2.92Å; D67-Y69 PolarHBondContact OD1-N 3.49Å; D67-S70 WeakPolarHBondContact O-CB 3.45Å; D67-S70 PolarHBondContact O-N 2.86Å; D67-S70 WeakPolarHBondContact OD1-CB 3.37Å; D67-S70 PolarHBondContact OD1-N 2.88Å; D67-S70 PolarHBondContact OD1-OG 3.19Å; D67-S71 PolarHBondContact O-N 3.02Å
68M84.9Confident70.4Confident81 Ų8172.7 Ų72.740%0.39939%0.39SS..Hα-helixtrans-57.1-23.7179.3-170.2172.1178.500112.9L38 V41 L43 Y72L38-M68 HydrophobicContact CB-CB 4.12Å; L38-M68 HydrophobicContact CB-CG 4.29Å; L38-M68 HydrophobicContact CD1-CG 4.35Å; L38-M68 HydrophobicContact CD2-CE 4.1Å; L38-M68 HydrophobicContact CD2-CG 4.07Å; L38-M68 HydrophobicContact CD2-SD 3.74Å; L38-M68 HydrophobicContact CG-CG 4.47Å; V41-M68 HydrophobicContact CB-CB 4.21Å; V41-M68 HydrophobicContact CG1-CB 4.4Å; V41-M68 HydrophobicContact CG1-SD 4.45Å; V41-M68 PolarHBondContact O-N 2.89Å; V41-M68 VanDerWaalsContact O-N 3.08Å; L43-M68 HydrophobicContact CD2-CB 4.13Å; L43-M68 HydrophobicContact CD2-CG 4.06Å; L43-M68 HydrophobicContact CG-CB 4.42Å; M68-Y72 WeakPolarHBondContact O-CB 3.49Å; M68-Y72 PolarHBondContact O-N 3.22Å; M68-Y72 VanDerWaalsContact O-N 3.14Å
69Y87.3Confident72.7Confident64 Ų6469.2 Ų69.225%0.25137%0.366SS..Hα-helixtrans-68.9-40.2173.6-178.6-103.8000112.9P35 L38 R39 D67 Y72 V73P35-Y69 HydrophobicContact CB-CD2 4.16Å; P35-Y69 HydrophobicContact CB-CE2 3.85Å; P35-Y69 VanDerWaalsContact O-CD2 3.25Å; P35-Y69 WeakPolarHBondContact O-CD2 3.44Å; L38-Y69 PolarHBondContact O-N 3.2Å; L38-Y69 VanDerWaalsContact O-N 3.08Å; R39-Y69 HydrophobicContact CG-CD1 3.9Å; R39-Y69 HydrophobicContact CG-CD2 4.19Å; R39-Y69 HydrophobicContact CG-CG 3.69Å; D67-Y69 PolarHBondContact O-N 2.92Å; D67-Y69 PolarHBondContact OD1-N 3.49Å; Y69-Y72 HydrophobicContact CD2-CD1 4.47Å; Y69-Y72 WeakPolarHBondContact O-CB 3.42Å; Y69-Y72 PolarHBondContact O-N 3.47Å; Y69-V73 HydrophobicContact CD1-CG2 4.23Å; Y69-V73 HydrophobicContact CE1-CG2 3.79Å; Y69-V73 HydrophobicContact CE2-CG2 4.14Å; Y69-V73 WeakPolarHBondContact O-CG2 3.32Å; Y69-V73 PolarHBondContact O-N 3.09Å
70S85.8Confident74.8Confident55 Ų5564.9 Ų64.939%0.38534%0.343SS..Hα-helixtrans-61.8-48.8178.8-61.30000111D67 Y72 V73 L74D67-S70 WeakPolarHBondContact O-CB 3.45Å; D67-S70 PolarHBondContact O-N 2.86Å; D67-S70 WeakPolarHBondContact OD1-CB 3.37Å; D67-S70 PolarHBondContact OD1-N 2.88Å; D67-S70 PolarHBondContact OD1-OG 3.19Å; S70-Y72 VanDerWaalsContact C-N 3.32Å; S70-Y72 PolarHBondContact O-N 2.92Å; S70-V73 PolarHBondContact O-N 3.35Å; S70-L74 PolarHBondContact O-N 3.37Å
71S86.2Confident77.1Confident24 Ų2462.3 Ų62.317%0.16831%0.313CS..Hα-helixtrans-64.5-35.4175.2-49.60000112.5D67 L74 L75D67-S71 PolarHBondContact O-N 3.02Å; S71-L74 PolarHBondContact O-N 3.33Å; S71-L75 WeakPolarHBondContact O-CB 3.32Å; S71-L75 VanDerWaalsContact O-CG 3.25Å; S71-L75 WeakPolarHBondContact O-CG 3.5Å; S71-L75 PolarHBondContact O-N 2.95Å
72Y89.6Confident78.9Confident17 Ų1755.4 Ų55.47%0.06729%0.288CS..Hα-helixtrans-60.9-44173.6169.8-95.4000112.1M28 D29 V32 P35 L38 M68 Y69 S70 K76M28-Y72 HydrophobicContact CE-CD2 3.48Å; M28-Y72 VanDerWaalsContact CE-CD2 3.48Å; M28-Y72 HydrophobicContact CE-CE2 3.87Å; M28-Y72 HydrophobicContact CE-CG 4.37Å; M28-Y72 HydrophobicContact CG-CD2 4.07Å; M28-Y72 HydrophobicContact CG-CE2 4.28Å; M28-Y72 HydrophobicContact SD-CD2 3.76Å; M28-Y72 HydrophobicContact SD-CE2 4.44Å; D29-Y72 PolarHBondContact OD1-OH 2.82Å; V32-Y72 HydrophobicContact CB-CD2 4.47Å; V32-Y72 HydrophobicContact CB-CE2 3.89Å; V32-Y72 HydrophobicContact CG1-CD2 4.4Å; V32-Y72 HydrophobicContact CG1-CE2 3.99Å; V32-Y72 HydrophobicContact CG2-CD2 4.29Å; V32-Y72 HydrophobicContact CG2-CE2 4.13Å; P35-Y72 HydrophobicContact CB-CD1 4.24Å; P35-Y72 HydrophobicContact CB-CE1 3.72Å; P35-Y72 HydrophobicContact CG-CE1 3.86Å; L38-Y72 HydrophobicContact CD1-CD2 4.28Å; L38-Y72 HydrophobicContact CD1-CG 4.13Å; M68-Y72 WeakPolarHBondContact O-CB 3.49Å; M68-Y72 PolarHBondContact O-N 3.22Å; M68-Y72 VanDerWaalsContact O-N 3.14Å; Y69-Y72 HydrophobicContact CD2-CD1 4.47Å; Y69-Y72 WeakPolarHBondContact O-CB 3.42Å; Y69-Y72 PolarHBondContact O-N 3.47Å; S70-Y72 VanDerWaalsContact C-N 3.32Å; S70-Y72 PolarHBondContact O-N 2.92Å; Y72-K76 HydrophobicContact CD1-CD 4.37Å; Y72-K76 HydrophobicContact CE1-CD 3.65Å; Y72-K76 HydrophobicContact CE2-CD 3.96Å; Y72-K76 HydrophobicContact CE2-CG 4.47Å; Y72-K76 VanDerWaalsContact CZ-CD 3.42Å; Y72-K76 WeakPolarHBondContact O-CG 3.47Å; Y72-K76 PolarHBondContact O-N 2.92Å; Y72-K76 WeakPolarHBondContact OH-CD 3.27Å
73V89.9Confident80.6Confident66 Ų6651.2 Ų51.240%0.427%0.271SS..Hα-helixtrans-66.1-45.6177.4172.50000110.9Y69 S70 L75 K76 S77Y69-V73 HydrophobicContact CD1-CG2 4.23Å; Y69-V73 HydrophobicContact CE1-CG2 3.79Å; Y69-V73 HydrophobicContact CE2-CG2 4.14Å; Y69-V73 WeakPolarHBondContact O-CG2 3.32Å; Y69-V73 PolarHBondContact O-N 3.09Å; S70-V73 PolarHBondContact O-N 3.35Å; V73-L75 PolarHBondContact O-N 3.46Å; V73-K76 PolarHBondContact O-N 3Å; V73-S77 PolarHBondContact O-N 3.24Å
74L89.4Confident82Confident23 Ų2352.8 Ų52.812%0.1227%0.271CS..Hα-helixtrans-55.2-52.4177175.866.6000111.9S70 S71 K76 S77 I78 D106 E110S70-L74 PolarHBondContact O-N 3.37Å; S71-L74 PolarHBondContact O-N 3.33Å; L74-K76 VanDerWaalsContact C-N 3.25Å; L74-K76 PolarHBondContact O-N 2.81Å; L74-S77 WeakPolarHBondContact O-CB 3.38Å; L74-S77 PolarHBondContact O-N 3.01Å; L74-S77 VanDerWaalsContact O-N 3.11Å; L74-I78 HydrophobicContact CD1-CD1 3.92Å; L74-I78 HydrophobicContact CD1-CG1 4.37Å; L74-I78 HydrophobicContact CG-CD1 4.01Å; L74-I78 WeakPolarHBondContact O-CG1 3.18Å; L74-I78 PolarHBondContact O-N 3.01Å; L74-D106 HydrophobicContact CD2-CB 3.85Å; L74-E110 HydrophobicContact CD1-CB 3.76Å; L74-E110 HydrophobicContact CD1-CG 4.44Å
75L92.1Very high82.8Confident61 Ų6152.1 Ų52.132%0.31927%0.269SS..Hα-helixtrans-60.5-36.6179.7-70.6171000112.1F21 V25 M28 S71 V73 R79F21-L75 HydrophobicContact CE2-CD2 3.81Å; F21-L75 HydrophobicContact CZ-CD2 4.33Å; V25-L75 HydrophobicContact CG2-CB 4.21Å; M28-L75 HydrophobicContact CE-CB 3.91Å; M28-L75 HydrophobicContact CE-CD1 4.14Å; M28-L75 HydrophobicContact SD-CD1 3.94Å; S71-L75 WeakPolarHBondContact O-CB 3.32Å; S71-L75 VanDerWaalsContact O-CG 3.25Å; S71-L75 WeakPolarHBondContact O-CG 3.5Å; S71-L75 PolarHBondContact O-N 2.95Å; V73-L75 PolarHBondContact O-N 3.46Å; L75-R79 WeakPolarHBondContact O-CB 3.26Å; L75-R79 PolarHBondContact O-N 3.42Å
76K91.1Very high83.5Confident60 Ų6049 Ų4926%0.26125%0.254SS..Hα-helixtrans-69.6-38.3175.1-79.6-166.364.1157.60112.9V25 M28 D29 Y72 V73 L74 N80V25-K76 HydrophobicContact CG1-CG 4.32Å; M28-K76 HydrophobicContact CE-CG 4.32Å; D29-K76 IonicContact OD1-NZ 3.37Å; D29-K76 PolarHBondContact OD1-NZ 3.48Å; D29-K76 IonicContact OD2-NZ 2.88Å; D29-K76 PolarHBondContact OD2-NZ 2.74Å; Y72-K76 HydrophobicContact CD1-CD 4.37Å; Y72-K76 HydrophobicContact CE1-CD 3.65Å; Y72-K76 HydrophobicContact CE2-CD 3.96Å; Y72-K76 HydrophobicContact CE2-CG 4.47Å; Y72-K76 VanDerWaalsContact CZ-CD 3.42Å; Y72-K76 WeakPolarHBondContact O-CG 3.47Å; Y72-K76 PolarHBondContact O-N 2.92Å; Y72-K76 WeakPolarHBondContact OH-CD 3.27Å; V73-K76 PolarHBondContact O-N 3Å; L74-K76 VanDerWaalsContact C-N 3.25Å; L74-K76 PolarHBondContact O-N 2.81Å; K76-N80 WeakPolarHBondContact O-CB 3.43Å; K76-N80 PolarHBondContact O-N 3Å
77S88.2Confident83.2Confident39 Ų3953.9 Ų53.927%0.27328%0.275SS..Hα-helixtrans-59.8-56.8175.2-162.40000109.9V73 L74 R79 N80 D81 E110V73-S77 PolarHBondContact O-N 3.24Å; L74-S77 WeakPolarHBondContact O-CB 3.38Å; L74-S77 PolarHBondContact O-N 3.01Å; L74-S77 VanDerWaalsContact O-N 3.11Å; S77-R79 VanDerWaalsContact C-N 3.3Å; S77-R79 PolarHBondContact O-N 3.47Å; S77-N80 WeakPolarHBondContact O-CA 3.39Å; S77-N80 VanDerWaalsContact O-CB 3.26Å; S77-N80 WeakPolarHBondContact O-CB 3.01Å; S77-N80 PolarHBondContact O-N 2.74Å; S77-D81 PolarHBondContact O-N 3.03Å; S77-E110 VanDerWaalsContact CB-OE1 3.25Å; S77-E110 WeakPolarHBondContact CB-OE1 3.39Å; S77-E110 PolarHBondContact OG-OE1 3.49Å
78I89Confident81.7Confident16 Ų1655.7 Ų55.78%0.08230%0.301CS..Hα-helixtrans-56.1-41.4178.9-65.9171.4000112F21 L74 D81 M82 E110 F113F21-I78 HydrophobicContact CE1-CB 4.47Å; F21-I78 HydrophobicContact CE1-CG2 3.79Å; F21-I78 HydrophobicContact CZ-CB 4.09Å; F21-I78 HydrophobicContact CZ-CG2 3.64Å; L74-I78 HydrophobicContact CD1-CD1 3.92Å; L74-I78 HydrophobicContact CD1-CG1 4.37Å; L74-I78 HydrophobicContact CG-CD1 4.01Å; L74-I78 WeakPolarHBondContact O-CG1 3.18Å; L74-I78 PolarHBondContact O-N 3.01Å; I78-D81 PolarHBondContact O-N 3.42Å; I78-M82 HydrophobicContact CG2-CE 3.78Å; I78-M82 WeakPolarHBondContact O-CG 3.4Å; I78-M82 PolarHBondContact O-N 3.24Å; I78-M82 VanDerWaalsContact O-N 3.07Å; I78-E110 HydrophobicContact CG1-CG 4.46Å; I78-F113 HydrophobicContact CG2-CD1 3.79Å; I78-F113 HydrophobicContact CG2-CE1 4Å; I78-F113 HydrophobicContact CG2-CG 4.15Å
79R90.6Very high79.8Confident27 Ų2758.6 Ų58.610%0.10232%0.318CS..Hα-helixtrans-60.5-45.1174179.5-160.860.6-173.71.4111.5F21 I22 V25 N26 D29 L75 S77 D81 M82 E83F21-R79 HydrophobicContact CE1-CB 4.08Å; I22-R79 HydrophobicContact CG1-CG 4.47Å; V25-R79 HydrophobicContact CB-CB 4.29Å; V25-R79 HydrophobicContact CB-CG 4.41Å; V25-R79 HydrophobicContact CG1-CB 3.84Å; V25-R79 HydrophobicContact CG1-CG 4.18Å; N26-R79 WeakPolarHBondContact OD1-CD 3.07Å; N26-R79 PolarHBondContact OD1-NH1 2.86Å; D29-R79 IonicContact OD2-CZ 2.88Å; D29-R79 IonicContact OD2-NH1 3.63Å; D29-R79 PolarHBondContact OD2-NH1 3.04Å; D29-R79 IonicContact OD2-NH2 3.84Å; D29-R79 PolarHBondContact OD2-NH2 3.19Å; L75-R79 WeakPolarHBondContact O-CB 3.26Å; L75-R79 PolarHBondContact O-N 3.42Å; S77-R79 VanDerWaalsContact C-N 3.3Å; S77-R79 PolarHBondContact O-N 3.47Å; R79-D81 VanDerWaalsContact C-N 3.32Å; R79-D81 PolarHBondContact O-N 2.87Å; R79-M82 WeakPolarHBondContact O-CB 3.47Å; R79-M82 PolarHBondContact O-N 3.37Å; R79-E83 PolarHBondContact O-N 2.99Å
80N87.1Confident77.3Confident66 Ų6663.5 Ų63.535%0.35334%0.343SS..Hα-helixtrans-61-42.9179.9-174.168.7000111.3K76 S77 M82 E83 W84K76-N80 WeakPolarHBondContact O-CB 3.43Å; K76-N80 PolarHBondContact O-N 3Å; S77-N80 WeakPolarHBondContact O-CA 3.39Å; S77-N80 VanDerWaalsContact O-CB 3.26Å; S77-N80 WeakPolarHBondContact O-CB 3.01Å; S77-N80 PolarHBondContact O-N 2.74Å; N80-M82 VanDerWaalsContact C-N 3.27Å; N80-M82 PolarHBondContact O-N 3.07Å; N80-E83 PolarHBondContact O-N 2.88Å; N80-W84 PolarHBondContact O-N 3.45Å
81D85.6Confident75.2Confident11 Ų1165.5 Ų65.56%0.05936%0.355CS..Hα-helixtrans-66.1-29.1176.7-62-51.1000113S77 I78 R79 G85 V86 H114S77-D81 PolarHBondContact O-N 3.03Å; I78-D81 PolarHBondContact O-N 3.42Å; R79-D81 VanDerWaalsContact C-N 3.32Å; R79-D81 PolarHBondContact O-N 2.87Å; D81-G85 CarbonylContact O-C 3.24Å; D81-G85 VanDerWaalsContact O-C 3.24Å; D81-G85 WeakPolarHBondContact O-CA 3.4Å; D81-G85 PolarHBondContact O-N 3.45Å; D81-V86 HydrophobicContact CB-CG2 4.28Å; D81-H114 IonicContact OD2-CE1 2.83Å; D81-H114 PolarHBondContact OD2-CE1 2.9Å; D81-H114 IonicContact OD2-NE2 3.41Å; D81-H114 PolarHBondContact OD2-NE2 3.3Å
82M83.6Confident73.1Confident37 Ų3769.8 Ų69.818%0.18238%0.382CS..Hα-helixtrans-71.1-43.5171.8-74.9-173.8-167.300113.2M18 F21 I22 I78 R79 N80 F113M18-M82 HydrophobicContact CB-SD 4.38Å; M18-M82 HydrophobicContact CE-CB 4.38Å; M18-M82 HydrophobicContact CE-CG 3.79Å; M18-M82 HydrophobicContact CE-SD 3.97Å; M18-M82 HydrophobicContact CG-SD 4.3Å; F21-M82 HydrophobicContact CD1-CE 3.59Å; F21-M82 HydrophobicContact CD1-SD 3.4Å; F21-M82 WeakPolarHBondContact CD1-SD 3.4Å; F21-M82 HydrophobicContact CE1-CE 3.71Å; F21-M82 HydrophobicContact CE1-SD 3.72Å; F21-M82 HydrophobicContact CG-CE 4.3Å; F21-M82 HydrophobicContact CG-SD 4.44Å; I22-M82 HydrophobicContact CD1-CB 4.39Å; I22-M82 HydrophobicContact CG1-SD 4.34Å; I78-M82 HydrophobicContact CG2-CE 3.78Å; I78-M82 WeakPolarHBondContact O-CG 3.4Å; I78-M82 PolarHBondContact O-N 3.24Å; I78-M82 VanDerWaalsContact O-N 3.07Å; R79-M82 WeakPolarHBondContact O-CB 3.47Å; R79-M82 PolarHBondContact O-N 3.37Å; N80-M82 VanDerWaalsContact C-N 3.27Å; N80-M82 PolarHBondContact O-N 3.07Å; M82-F113 HydrophobicContact CE-CD2 4.15Å; M82-F113 HydrophobicContact CE-CE1 3.92Å; M82-F113 HydrophobicContact CE-CE2 3.31Å; M82-F113 HydrophobicContact CE-CZ 3.19Å; M82-F113 HydrophobicContact CG-CE1 3.71Å; M82-F113 HydrophobicContact CG-CE2 4.42Å; M82-F113 HydrophobicContact CG-CZ 3.38Å; M82-F113 HydrophobicContact SD-CZ 4.07Å
83E79.3Confident70.6Confident86 Ų8678.6 Ų78.640%0.40242%0.421SS..Hα-helixtrans-75.8-39.1-175.7-75.3-174.7169.600112.4I22 R79 N80I22-E83 HydrophobicContact CD1-CG 4.42Å; I22-E83 WeakPolarHBondContact CG2-OE1 3.42Å; R79-E83 PolarHBondContact O-N 2.99Å; N80-E83 PolarHBondContact O-N 2.88Å
84W75.9Confident68.6Low185 Ų18580 Ų8070%0.70144%0.439SS*.Hα-helixtrans-114.3-2.8-171.8-60.5105.3000113.9N80 L87N80-W84 PolarHBondContact O-N 3.45Å; W84-L87 HydrophobicContact CB-CD1 4.11Å
85G70.4Confident66.3Low17 Ų1788.1 Ų88.118%0.17548%0.477CS..  trans78.3163.1-168.500000111.2D81 L87D81-G85 CarbonylContact O-C 3.24Å; D81-G85 VanDerWaalsContact O-C 3.24Å; D81-G85 WeakPolarHBondContact O-CA 3.4Å; D81-G85 PolarHBondContact O-N 3.45Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 3.45Å
86V66.3Low63.7Low39 Ų3990.1 Ų90.124%0.23650%0.502CS..  trans-64.393.3173.4-175.20000108D81 G88 H114 L117D81-V86 HydrophobicContact CB-CG2 4.28Å; V86-G88 PolarHBondContact O-N 2.91Å; V86-G88 VanDerWaalsContact O-N 3.09Å; V86-H114 HydrophobicContact CG2-CB 4.44Å; V86-L117 HydrophobicContact CG2-CD2 4.11Å
87L55.4Low61.4Low124 Ų12496.8 Ų96.865%0.64953%0.534SS*.  trans-68.2105.7169.7-88.8146.7000105.8W84 G85 D89W84-L87 HydrophobicContact CB-CD1 4.11Å; G85-L87 VanDerWaalsContact C-N 3.31Å; G85-L87 PolarHBondContact O-N 3.45Å; L87-D89 PolarHBondContact O-N 3.07Å
88G48.2Very low59.3Low72 Ų7299.4 Ų99.474%0.74256%0.558SS**  trans-39120.2-172.200000113.2V86 E90V86-G88 PolarHBondContact O-N 2.91Å; V86-G88 VanDerWaalsContact O-N 3.09Å; G88-E90 PolarHBondContact O-N 2.92Å
89D44.1Very low56.9Low141 Ų141109 Ų10975%0.75460%0.599SS**PPolyproline II helixtrans-52.9116.4176.4-155.339.7000109.9L87L87-D89 PolarHBondContact O-N 3.07Å
90E35.5Very low54.9Low167 Ų167119.1 Ų119.178%0.7864%0.637SS**PPolyproline II helixtrans-76.8120156.8-177.4174110.500105.7G88G88-E90 PolarHBondContact O-N 2.92Å
91P42.7Very low52.6Low97 Ų97120.3 Ų120.363%0.6365%0.651SS**PPolyproline II helixtrans-61.6129.9-176.624.1-32.6000109.5K93P91-K93 PolarHBondContact O-N 3.41Å; P91-K93 VanDerWaalsContact O-N 3.1Å
92P41.3Very low50.5Low114 Ų114126 Ų12674%0.7468%0.678SS**PPolyproline II helixtrans-62.2119.717424.2-30.7000108.3A94P92-A94 PolarHBondContact O-N 3.3Å; P92-A94 VanDerWaalsContact O-N 3.15Å
93K37.9Very low48.8Very low203 Ų203127.7 Ų127.788%0.88370%0.697SS**PPolyproline II helixtrans-52.4121.3173.9-77.1-179.8175.9172.90109.3P91 E95P91-K93 PolarHBondContact O-N 3.41Å; P91-K93 VanDerWaalsContact O-N 3.1Å; K93-E95 PolarHBondContact O-N 2.98Å
94A45.9Very low47.4Very low95 Ų95130.7 Ų130.779%0.78571%0.711SS**  trans-57.3113.8176.600000111.7P92P92-A94 PolarHBondContact O-N 3.3Å; P92-A94 VanDerWaalsContact O-N 3.15Å
95E41.2Very low46.1Very low194 Ų194126.8 Ų126.891%0.90770%0.704SS**  trans-16081.3147.3-63-163.518000110.1K93K93-E95 PolarHBondContact O-N 2.98Å
96A38.2Very low45.3Very low103 Ų103128 Ų12885%0.85171%0.707SS**  trans-169.584.315500000110.1
97E43.3Very low45Very low199 Ų199129.6 Ų129.693%0.9371%0.713SS**  trans-67.6148.9160.4-71-174.1135.800110.2
98A44.6Very low46.1Very low94 Ų94127.9 Ų127.978%0.77771%0.705SS**  trans97.172.1169.400000118
99K37Very low47.5Very low217 Ų217128.4 Ų128.494%0.94369%0.691SS**  -179.699121.5-93.9166.2-175-170.10108.4
100R48.5Very low49.2Very low240 Ų240123.8 Ų123.891%0.90666%0.664SS**  trans-107.7104.3-179.4-107.1-176178.8-1281.4108.9
101S39.8Very low51.4Low92 Ų92121.5 Ų121.564%0.64365%0.652SS**SBendtrans173.1139.7149.7470000105.8
102E41.7Very low53.5Low131 Ų131121.4 Ų121.461%0.61264%0.643SS**SBendtrans100.16164.6-55158.5-168.900118.9D65D65-E102 HydrophobicContact CB-CB 4.08Å; D65-E102 WeakPolarHBondContact OD2-CB 3.4Å; D65-E102 WeakPolarHBondContact OD2-CG 3.32Å
103A47.6Very low55.5Low71 Ų71118.1 Ų118.159%0.58762%0.617SS**  trans-115.220.8171.500000114.1D107A103-D107 WeakPolarHBondContact O-CB 3.48Å
104E49.5Very low57.8Low149 Ų149110.3 Ų110.370%0.69658%0.584SS**Hα-helixtrans-81.8-26.3-174.7-70.6-172.1167.500113.7D108E104-D108 PolarHBondContact O-N 3.38Å
105D49.8Very low59.8Low104 Ų104113.1 Ų113.156%0.55658%0.578SS**Hα-helixtrans-82.4-40.3-172.1-67.9-32000113.5D107 D108D105-D107 VanDerWaalsContact C-N 3.32Å; D105-D108 WeakPolarHBondContact O-CB 3.3Å; D105-D108 PolarHBondContact O-N 3.4Å
106D53Low62.1Low43 Ų43109 Ų10923%0.2356%0.559CS.*Hα-helixtrans-65.9-38.2175.4-918.8000111.5L74 D108 L109L74-D106 HydrophobicContact CD2-CB 3.85Å; D106-D108 PolarHBondContact O-N 3.46Å; D106-L109 PolarHBondContact O-N 2.94Å
107D60.5Low64.5Low71 Ų71105 Ų10538%0.3852%0.523SS..Hα-helixtrans-61.1-29.7173.1-109.431000112.7A103 D105 K111A103-D107 WeakPolarHBondContact O-CB 3.48Å; D105-D107 VanDerWaalsContact C-N 3.32Å; D107-K111 WeakPolarHBondContact O-CB 3.38Å; D107-K111 VanDerWaalsContact O-CD 3.24Å; D107-K111 WeakPolarHBondContact O-CD 3.46Å; D107-K111 WeakPolarHBondContact O-CG 3.36Å; D107-K111 PolarHBondContact O-N 3.07Å; D107-K111 IonicContact OD2-NZ 2.92Å; D107-K111 PolarHBondContact OD2-NZ 2.97Å
108D77.8Confident66.5Low89 Ų8998.9 Ų98.948%0.47650%0.497SS..Hα-helixtrans-73.7-38.4-179.5-170.250000111.5E104 D105 D106 K111 Q112E104-D108 PolarHBondContact O-N 3.38Å; D105-D108 WeakPolarHBondContact O-CB 3.3Å; D105-D108 PolarHBondContact O-N 3.4Å; D106-D108 PolarHBondContact O-N 3.46Å; D108-K111 PolarHBondContact O-N 2.95Å; D108-Q112 WeakPolarHBondContact O-CB 3.43Å; D108-Q112 PolarHBondContact O-N 2.88Å
109L78.1Confident68.6Low83 Ų8396.2 Ų96.244%0.43548%0.478SS..Hα-helixtrans-65.2-42.3179.4-70.9176.9000112.3D106 F113D106-L109 PolarHBondContact O-N 2.94Å; L109-F113 VanDerWaalsContact O-CB 3.24Å; L109-F113 WeakPolarHBondContact O-CB 3.25Å; L109-F113 PolarHBondContact O-N 2.99Å
110E78.9Confident71.2Confident43 Ų4389.3 Ų89.320%0.20145%0.451CS..Hα-helixtrans-62.9-49.8175.4-172171.5-148.300111L74 S77 I78 Q112 F113 H114L74-E110 HydrophobicContact CD1-CB 3.76Å; L74-E110 HydrophobicContact CD1-CG 4.44Å; S77-E110 VanDerWaalsContact CB-OE1 3.25Å; S77-E110 WeakPolarHBondContact CB-OE1 3.39Å; S77-E110 PolarHBondContact OG-OE1 3.49Å; I78-E110 HydrophobicContact CG1-CG 4.46Å; E110-Q112 VanDerWaalsContact C-N 3.34Å; E110-Q112 PolarHBondContact O-N 2.96Å; E110-F113 PolarHBondContact O-N 3.34Å; E110-H114 WeakPolarHBondContact O-CB 3.46Å; E110-H114 PolarHBondContact O-CD2 3.18Å; E110-H114 VanDerWaalsContact O-CG 3.3Å; E110-H114 PolarHBondContact O-N 2.88Å
111K82.6Confident73Confident119 Ų11981.8 Ų81.852%0.51743%0.427SS..Hα-helixtrans-60-43.7178.6-72.1167.1-164.8150.70111.6D107 D108 H114 F115D107-K111 WeakPolarHBondContact O-CB 3.38Å; D107-K111 VanDerWaalsContact O-CD 3.24Å; D107-K111 WeakPolarHBondContact O-CD 3.46Å; D107-K111 WeakPolarHBondContact O-CG 3.36Å; D107-K111 PolarHBondContact O-N 3.07Å; D107-K111 IonicContact OD2-NZ 2.92Å; D107-K111 PolarHBondContact OD2-NZ 2.97Å; D108-K111 PolarHBondContact O-N 2.95Å; K111-H114 PolarHBondContact O-N 3.11Å; K111-F115 WeakPolarHBondContact O-CB 3.47Å; K111-F115 PolarHBondContact O-N 2.92Å
112Q85.3Confident75.4Confident96 Ų9679.7 Ų79.745%0.44942%0.415SS..Hα-helixtrans-64.5-44177.2-175.7178.799.500111.1D108 E110 H114 F115 H116D108-Q112 WeakPolarHBondContact O-CB 3.43Å; D108-Q112 PolarHBondContact O-N 2.88Å; E110-Q112 VanDerWaalsContact C-N 3.34Å; E110-Q112 PolarHBondContact O-N 2.96Å; Q112-H114 PolarHBondContact O-N 2.88Å; Q112-F115 PolarHBondContact O-N 3.06Å; Q112-H116 WeakPolarHBondContact CG-NE2 3.36Å; Q112-H116 PolarHBondContact O-CD2 3.5Å; Q112-H116 PolarHBondContact O-N 3.17Å
113F84.9Confident78Confident45 Ų4577.3 Ų77.320%0.19741%0.409CS..Hα-helixtrans-60.1-46.2176.1-176.3-105.4000111.4M18 I78 M82 L109 E110 F115 H116 L117M18-F113 HydrophobicContact CE-CZ 4.39Å; I78-F113 HydrophobicContact CG2-CD1 3.79Å; I78-F113 HydrophobicContact CG2-CE1 4Å; I78-F113 HydrophobicContact CG2-CG 4.15Å; M82-F113 HydrophobicContact CE-CD2 4.15Å; M82-F113 HydrophobicContact CE-CE1 3.92Å; M82-F113 HydrophobicContact CE-CE2 3.31Å; M82-F113 HydrophobicContact CE-CZ 3.19Å; M82-F113 HydrophobicContact CG-CE1 3.71Å; M82-F113 HydrophobicContact CG-CE2 4.42Å; M82-F113 HydrophobicContact CG-CZ 3.38Å; M82-F113 HydrophobicContact SD-CZ 4.07Å; L109-F113 VanDerWaalsContact O-CB 3.24Å; L109-F113 WeakPolarHBondContact O-CB 3.25Å; L109-F113 PolarHBondContact O-N 2.99Å; E110-F113 PolarHBondContact O-N 3.34Å; F113-F115 VanDerWaalsContact C-N 3.34Å; F113-F115 PolarHBondContact O-N 2.85Å; F113-H116 PolarHBondContact O-N 2.98Å; F113-L117 HydrophobicContact CE1-CB 4.41Å; F113-L117 HydrophobicContact CE1-CD2 3.8Å; F113-L117 HydrophobicContact CZ-CB 4.37Å; F113-L117 HydrophobicContact CZ-CD2 4.04Å; F113-L117 VanDerWaalsContact O-CB 3.32Å; F113-L117 WeakPolarHBondContact O-CB 3.46Å; F113-L117 PolarHBondContact O-N 2.72Å
114H85.5Confident80.1Confident39 Ų3978.2 Ų78.218%0.18140%0.403CS..Hα-helixtrans-61.9-43.9178.6-72-165.6000111.3D81 V86 E110 K111 Q112 H116 L117 N118D81-H114 IonicContact OD2-CE1 2.83Å; D81-H114 PolarHBondContact OD2-CE1 2.9Å; D81-H114 IonicContact OD2-NE2 3.41Å; D81-H114 PolarHBondContact OD2-NE2 3.3Å; V86-H114 HydrophobicContact CG2-CB 4.44Å; E110-H114 WeakPolarHBondContact O-CB 3.46Å; E110-H114 PolarHBondContact O-CD2 3.18Å; E110-H114 VanDerWaalsContact O-CG 3.3Å; E110-H114 PolarHBondContact O-N 2.88Å; K111-H114 PolarHBondContact O-N 3.11Å; Q112-H114 PolarHBondContact O-N 2.88Å; H114-H116 PolarHBondContact O-N 3.41Å; H114-L117 PolarHBondContact O-N 3.29Å; H114-N118 VanDerWaalsContact O-CB 3.26Å; H114-N118 WeakPolarHBondContact O-CB 3.5Å; H114-N118 VanDerWaalsContact O-CG 3.29Å; H114-N118 PolarHBondContact O-N 3.16Å; H114-N118 PolarHBondContact O-ND2 3.48Å
115F88.1Confident82.1Confident153 Ų15374.8 Ų74.867%0.67140%0.396SS*.Hα-helixtrans-59.1-48.6177178.9-97.3000111.6K111 Q112 F113 G119K111-F115 WeakPolarHBondContact O-CB 3.47Å; K111-F115 PolarHBondContact O-N 2.92Å; Q112-F115 PolarHBondContact O-N 3.06Å; F113-F115 VanDerWaalsContact C-N 3.34Å; F113-F115 PolarHBondContact O-N 2.85Å; F115-G119 PolarHBondContact O-N 3.41Å
116H89.8Confident84.3Confident107 Ų10776.8 Ų76.850%0.49540%0.4SS..Hα-helixtrans-68.5-41.3-179.6-69.9-49.2000113Q112 F113 H114 G119 L120Q112-H116 WeakPolarHBondContact CG-NE2 3.36Å; Q112-H116 PolarHBondContact O-CD2 3.5Å; Q112-H116 PolarHBondContact O-N 3.17Å; F113-H116 PolarHBondContact O-N 2.98Å; H114-H116 PolarHBondContact O-N 3.41Å; H116-G119 PolarHBondContact O-N 3.28Å; H116-L120 WeakPolarHBondContact O-CB 3.26Å; H116-L120 PolarHBondContact O-N 2.86Å
117L87.3Confident86.4Confident21 Ų2179.4 Ų79.411%0.1141%0.413CS..Hα-helixtrans-63-47.6178.7-175.661.1000110.9M18 V86 F113 H114 G119 L120 Q121M18-L117 HydrophobicContact CE-CD1 4.41Å; V86-L117 HydrophobicContact CG2-CD2 4.11Å; F113-L117 HydrophobicContact CE1-CB 4.41Å; F113-L117 HydrophobicContact CE1-CD2 3.8Å; F113-L117 HydrophobicContact CZ-CB 4.37Å; F113-L117 HydrophobicContact CZ-CD2 4.04Å; F113-L117 VanDerWaalsContact O-CB 3.32Å; F113-L117 WeakPolarHBondContact O-CB 3.46Å; F113-L117 PolarHBondContact O-N 2.72Å; H114-L117 PolarHBondContact O-N 3.29Å; L117-G119 VanDerWaalsContact C-N 3.35Å; L117-G119 PolarHBondContact O-N 3.18Å; L117-L120 PolarHBondContact O-N 2.99Å; L117-Q121 WeakPolarHBondContact O-CB 3.24Å; L117-Q121 VanDerWaalsContact O-CG 3.3Å; L117-Q121 WeakPolarHBondContact O-CG 3.41Å; L117-Q121 PolarHBondContact O-N 3.44Å
118N87Confident88Confident70 Ų7079.7 Ų79.737%0.37442%0.418SS..Hα-helixtrans-61.9-42.5175.9-75.6-44.5000111.9H114 L120 Q121 A122H114-N118 VanDerWaalsContact O-CB 3.26Å; H114-N118 WeakPolarHBondContact O-CB 3.5Å; H114-N118 VanDerWaalsContact O-CG 3.29Å; H114-N118 PolarHBondContact O-N 3.16Å; H114-N118 PolarHBondContact O-ND2 3.48Å; N118-L120 PolarHBondContact O-N 2.86Å; N118-Q121 PolarHBondContact O-N 3.5Å; N118-A122 WeakPolarHBondContact O-CB 3.48Å; N118-A122 PolarHBondContact O-N 3.35Å
119G88.9Confident88.8Confident37 Ų3781 Ų8138%0.38142%0.424SS..Hα-helixtrans-59.8-46175.900000112.3F115 H116 L117 A122 V123F115-G119 PolarHBondContact O-N 3.41Å; H116-G119 PolarHBondContact O-N 3.28Å; L117-G119 VanDerWaalsContact C-N 3.35Å; L117-G119 PolarHBondContact O-N 3.18Å; G119-A122 PolarHBondContact O-N 3.49Å; G119-V123 WeakPolarHBondContact O-CG2 3.25Å; G119-V123 PolarHBondContact O-N 3.01Å
120L90.4Very high89.7Confident73 Ų7384 Ų8438%0.38243%0.433SS..Hα-helixtrans-63.4-46.9177.6-177.562.8000111.5L14 H116 L117 N118 A122 V123 L124L14-L120 HydrophobicContact CD2-CD2 3.64Å; H116-L120 WeakPolarHBondContact O-CB 3.26Å; H116-L120 PolarHBondContact O-N 2.86Å; L117-L120 PolarHBondContact O-N 2.99Å; N118-L120 PolarHBondContact O-N 2.86Å; L120-A122 VanDerWaalsContact C-N 3.32Å; L120-A122 PolarHBondContact O-N 3.09Å; L120-V123 PolarHBondContact O-N 3.4Å; L120-L124 HydrophobicContact CD1-CD1 4.15Å; L120-L124 HydrophobicContact CD1-CG 4.17Å; L120-L124 HydrophobicContact CG-CD1 3.91Å; L120-L124 HydrophobicContact CG-CG 4.34Å; L120-L124 WeakPolarHBondContact O-CB 3.34Å; L120-L124 VanDerWaalsContact O-CG 3.32Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 2.72Å
121Q87.4Confident90.5Very high82 Ų8284.3 Ų84.338%0.38344%0.443SS..Hα-helixtrans-58.3-42.9176.6-73.7178.31.700111.9L117 N118 L124 S125L117-Q121 WeakPolarHBondContact O-CB 3.24Å; L117-Q121 VanDerWaalsContact O-CG 3.3Å; L117-Q121 WeakPolarHBondContact O-CG 3.41Å; L117-Q121 PolarHBondContact O-N 3.44Å; N118-Q121 PolarHBondContact O-N 3.5Å; Q121-L124 PolarHBondContact O-N 2.94Å; Q121-S125 WeakPolarHBondContact O-CB 3.25Å; Q121-S125 PolarHBondContact O-N 3Å; Q121-S125 PolarHBondContact O-OG 2.94Å
122A90Very high91.1Very high48 Ų4882.7 Ų82.740%0.39744%0.441SS..Hα-helixtrans-63.7-42.7177.700000112.3N118 G119 L120 K126N118-A122 WeakPolarHBondContact O-CB 3.48Å; N118-A122 PolarHBondContact O-N 3.35Å; G119-A122 PolarHBondContact O-N 3.49Å; L120-A122 VanDerWaalsContact C-N 3.32Å; L120-A122 PolarHBondContact O-N 3.09Å; A122-K126 WeakPolarHBondContact O-CG 3.36Å; A122-K126 PolarHBondContact O-N 3.19Å
123V94.8Very high91.6Very high80 Ų8081.7 Ų81.749%0.48544%0.441SS..Hα-helixtrans-66.4-48177.5172.40000110.9G119 L120 S125 K126 L127G119-V123 WeakPolarHBondContact O-CG2 3.25Å; G119-V123 PolarHBondContact O-N 3.01Å; L120-V123 PolarHBondContact O-N 3.4Å; V123-S125 VanDerWaalsContact C-N 3.29Å; V123-S125 PolarHBondContact O-N 3.13Å; V123-K126 PolarHBondContact O-N 3.47Å; V123-L127 HydrophobicContact CG1-CD1 3.86Å; V123-L127 HydrophobicContact CG1-CG 4.3Å; V123-L127 WeakPolarHBondContact O-CG 3.39Å; V123-L127 PolarHBondContact O-N 3.19Å
124L91.8Very high92.1Very high90 Ų9085.4 Ų85.447%0.47146%0.462SS..Hα-helixtrans-60.2-39.3178.5-71.6175.7000111.8L120 Q121 K126 L127 T128L120-L124 HydrophobicContact CD1-CD1 4.15Å; L120-L124 HydrophobicContact CD1-CG 4.17Å; L120-L124 HydrophobicContact CG-CD1 3.91Å; L120-L124 HydrophobicContact CG-CG 4.34Å; L120-L124 WeakPolarHBondContact O-CB 3.34Å; L120-L124 VanDerWaalsContact O-CG 3.32Å; L120-L124 WeakPolarHBondContact O-CG 3.38Å; L120-L124 PolarHBondContact O-N 2.72Å; Q121-L124 PolarHBondContact O-N 2.94Å; L124-K126 PolarHBondContact O-N 3.23Å; L124-L127 PolarHBondContact O-N 3.13Å; L124-T128 VanDerWaalsContact O-CB 3.31Å; L124-T128 WeakPolarHBondContact O-CB 3.48Å; L124-T128 PolarHBondContact O-N 3.12Å; L124-T128 PolarHBondContact O-OG1 3.01Å
125S93.1Very high92.4Very high78 Ų7886.8 Ų86.855%0.54547%0.473SS..Hα-helixtrans-60.5-46.3175.3-62.40000111.9Q121 V123 T128 L129Q121-S125 WeakPolarHBondContact O-CB 3.25Å; Q121-S125 PolarHBondContact O-N 3Å; Q121-S125 PolarHBondContact O-OG 2.94Å; V123-S125 VanDerWaalsContact C-N 3.29Å; V123-S125 PolarHBondContact O-N 3.13Å; S125-T128 PolarHBondContact O-N 2.61Å; S125-L129 PolarHBondContact O-N 3.45Å
126K95.3Very high92.7Very high146 Ų14683.5 Ų83.564%0.63546%0.463SS*.Hα-helixtrans-64.3-42.1177-71.6173.9-177.9174.90112.2A122 V123 L124 L129 K130A122-K126 WeakPolarHBondContact O-CG 3.36Å; A122-K126 PolarHBondContact O-N 3.19Å; V123-K126 PolarHBondContact O-N 3.47Å; L124-K126 PolarHBondContact O-N 3.23Å; K126-L129 PolarHBondContact O-N 2.96Å; K126-K130 WeakPolarHBondContact O-CG 3.38Å; K126-K130 PolarHBondContact O-N 2.87Å
127L96Very high92.7Very high97 Ų9784.9 Ų84.951%0.50846%0.464SS..Hα-helixtrans-65.7-41.5177.8-70.7174.6000111.5V123 L124 L129 K130 A131V123-L127 HydrophobicContact CG1-CD1 3.86Å; V123-L127 HydrophobicContact CG1-CG 4.3Å; V123-L127 WeakPolarHBondContact O-CG 3.39Å; V123-L127 PolarHBondContact O-N 3.19Å; L124-L127 PolarHBondContact O-N 3.13Å; L127-L129 PolarHBondContact O-N 3.31Å; L127-K130 PolarHBondContact O-N 2.82Å; L127-A131 WeakPolarHBondContact O-CB 3.26Å; L127-A131 PolarHBondContact O-N 2.99Å
128T94.4Very high93Very high78 Ų7891.2 Ų91.248%0.47949%0.487SS..Hα-helixtrans-60.7-45.1175.9-58.60000111L124 S125 K130 A131 N132L124-T128 VanDerWaalsContact O-CB 3.31Å; L124-T128 WeakPolarHBondContact O-CB 3.48Å; L124-T128 PolarHBondContact O-N 3.12Å; L124-T128 PolarHBondContact O-OG1 3.01Å; S125-T128 PolarHBondContact O-N 2.61Å; T128-K130 PolarHBondContact O-N 3.14Å; T128-A131 PolarHBondContact O-N 3.39Å; T128-N132 WeakPolarHBondContact O-CB 3.32Å; T128-N132 VanDerWaalsContact O-CG 3.3Å; T128-N132 PolarHBondContact O-N 2.8Å; T128-N132 PolarHBondContact O-ND2 3.17Å
129L95.3Very high93.2Very high116 Ų11692.9 Ų92.961%0.60749%0.491SS*.Hα-helixtrans-59.9-46.4175-177.664.2000111.6S125 K126 L127 A131 N132 T133S125-L129 PolarHBondContact O-N 3.45Å; K126-L129 PolarHBondContact O-N 2.96Å; L127-L129 PolarHBondContact O-N 3.31Å; L129-A131 VanDerWaalsContact C-N 3.35Å; L129-A131 PolarHBondContact O-N 3.41Å; L129-N132 PolarHBondContact O-N 3.35Å; L129-T133 PolarHBondContact O-N 3.2Å; L129-T133 PolarHBondContact O-OG1 3.39Å; L129-T133 VanDerWaalsContact O-OG1 3.08Å
130K96.6Very high93.2Very high145 Ų14596.6 Ų96.663%0.6350%0.499SS*.Hα-helixtrans-59.5-44176.8-75.7-177.5178.3-175.80112.2K126 L127 T128 T133 L134K126-K130 WeakPolarHBondContact O-CG 3.38Å; K126-K130 PolarHBondContact O-N 2.87Å; L127-K130 PolarHBondContact O-N 2.82Å; T128-K130 PolarHBondContact O-N 3.14Å; K130-T133 PolarHBondContact O-N 3.1Å; K130-L134 WeakPolarHBondContact O-CG 3.17Å; K130-L134 PolarHBondContact O-N 3.36Å
131A96.6Very high93Very high50 Ų5099.9 Ų99.941%0.41351%0.512SS..Hα-helixtrans-62.9-41.8177.900000112.1L127 T128 L129 L134 T135L127-A131 WeakPolarHBondContact O-CB 3.26Å; L127-A131 PolarHBondContact O-N 2.99Å; T128-A131 PolarHBondContact O-N 3.39Å; L129-A131 VanDerWaalsContact C-N 3.35Å; L129-A131 PolarHBondContact O-N 3.41Å; A131-L134 PolarHBondContact O-N 2.74Å; A131-T135 WeakPolarHBondContact O-CB 3.43Å; A131-T135 PolarHBondContact O-N 3.41Å; A131-T135 PolarHBondContact O-OG1 3.08Å
132N94.5Very high93Very high86 Ų8699.7 Ų99.746%0.4651%0.513SS..Hα-helixtrans-64.7-43.6175.5-71.8-25.2000111.8T128 L129 L134 T135 N136T128-N132 WeakPolarHBondContact O-CB 3.32Å; T128-N132 VanDerWaalsContact O-CG 3.3Å; T128-N132 PolarHBondContact O-N 2.8Å; T128-N132 PolarHBondContact O-ND2 3.17Å; L129-N132 PolarHBondContact O-N 3.35Å; N132-L134 PolarHBondContact O-N 2.83Å; N132-T135 PolarHBondContact O-N 2.63Å; N132-N136 WeakPolarHBondContact O-CB 3.47Å; N132-N136 VanDerWaalsContact O-CG 3.26Å; N132-N136 PolarHBondContact O-N 3.49Å; N132-N136 PolarHBondContact O-ND2 2.83Å
133T95.3Very high92Very high74 Ų74100.2 Ų100.245%0.45452%0.523SS..Hα-helixtrans-59.7-46.6175-61.10000111.4L129 K130 T135 N136 R137L129-T133 PolarHBondContact O-N 3.2Å; L129-T133 PolarHBondContact O-OG1 3.39Å; L129-T133 VanDerWaalsContact O-OG1 3.08Å; K130-T133 PolarHBondContact O-N 3.1Å; T133-T135 VanDerWaalsContact C-N 3.31Å; T133-T135 PolarHBondContact O-N 3.25Å; T133-N136 PolarHBondContact O-N 3.01Å; T133-R137 HydrophobicContact CG2-CG 4.27Å; T133-R137 WeakPolarHBondContact O-CB 3.41Å; T133-R137 VanDerWaalsContact O-CG 3.23Å; T133-R137 WeakPolarHBondContact O-CG 3.34Å; T133-R137 PolarHBondContact O-N 2.94Å
134L95.2Very high90.4Very high124 Ų124100.4 Ų100.465%0.64953%0.527SS*.Hα-helixtrans-59-43.6176.1-74.8170000111.9K130 A131 N132 R137 Y138K130-L134 WeakPolarHBondContact O-CG 3.17Å; K130-L134 PolarHBondContact O-N 3.36Å; A131-L134 PolarHBondContact O-N 2.74Å; N132-L134 PolarHBondContact O-N 2.83Å; L134-R137 PolarHBondContact O-N 3.37Å; L134-Y138 WeakPolarHBondContact O-CB 3.19Å; L134-Y138 PolarHBondContact O-N 3.36Å
135T93.6Very high88.8Confident67 Ų67107 Ų10741%0.41155%0.546SS..Hα-helixtrans-62.9-43.1177.9-58.50000111.6A131 N132 T133 Y138 K139A131-T135 WeakPolarHBondContact O-CB 3.43Å; A131-T135 PolarHBondContact O-N 3.41Å; A131-T135 PolarHBondContact O-OG1 3.08Å; N132-T135 PolarHBondContact O-N 2.63Å; T133-T135 VanDerWaalsContact C-N 3.31Å; T133-T135 PolarHBondContact O-N 3.25Å; T135-Y138 PolarHBondContact O-N 2.83Å; T135-K139 HydrophobicContact CG2-CD 4.47Å; T135-K139 WeakPolarHBondContact O-CG 3.42Å; T135-K139 PolarHBondContact O-N 2.67Å
136N92.7Very high86.8Confident85 Ų85114.4 Ų114.446%0.45558%0.579SS.*Hα-helixtrans-67.4-44.9178.5-70.2-16.3000111.6N132 T133 Y138 K139 E140N132-N136 WeakPolarHBondContact O-CB 3.47Å; N132-N136 VanDerWaalsContact O-CG 3.26Å; N132-N136 PolarHBondContact O-N 3.49Å; N132-N136 PolarHBondContact O-ND2 2.83Å; T133-N136 PolarHBondContact O-N 3.01Å; N136-Y138 VanDerWaalsContact C-N 3.3Å; N136-Y138 PolarHBondContact O-N 3.08Å; N136-K139 WeakPolarHBondContact O-CB 3.47Å; N136-K139 PolarHBondContact O-N 3.13Å; N136-K139 VanDerWaalsContact O-N 3.16Å; N136-E140 WeakPolarHBondContact O-CG 3.49Å; N136-E140 PolarHBondContact O-N 3.48Å
137R91.6Very high86.4Confident135 Ų135112.9 Ų112.951%0.50958%0.577SS.*Hα-helixtrans-59.7-42.5175.2-68.4-67.6-68.2157.5-0.6111.3T133 L134 K139 E140 E141T133-R137 HydrophobicContact CG2-CG 4.27Å; T133-R137 WeakPolarHBondContact O-CB 3.41Å; T133-R137 VanDerWaalsContact O-CG 3.23Å; T133-R137 WeakPolarHBondContact O-CG 3.34Å; T133-R137 PolarHBondContact O-N 2.94Å; L134-R137 PolarHBondContact O-N 3.37Å; R137-K139 PolarHBondContact O-N 3.07Å; R137-E140 WeakPolarHBondContact CD-OE2 3.45Å; R137-E140 IonicContact CZ-OE2 3.48Å; R137-E140 IonicContact NH1-OE2 2.72Å; R137-E140 PolarHBondContact NH1-OE2 3.15Å; R137-E140 WeakPolarHBondContact O-CB 3.43Å; R137-E140 PolarHBondContact O-N 3.16Å; R137-E141 IonicContact NH2-OE1 3.8Å; R137-E141 VanDerWaalsContact O-CG 3.29Å; R137-E141 WeakPolarHBondContact O-CG 3.24Å; R137-E141 PolarHBondContact O-N 3.25Å
138Y93.1Very high85.9Confident154 Ų154113.7 Ų113.760%0.60458%0.58SS**Hα-helixtrans-60.6-46.1174.8-179.2-105.9000111.9L134 T135 N136 E140 E141 I142L134-Y138 WeakPolarHBondContact O-CB 3.19Å; L134-Y138 PolarHBondContact O-N 3.36Å; T135-Y138 PolarHBondContact O-N 2.83Å; N136-Y138 VanDerWaalsContact C-N 3.3Å; N136-Y138 PolarHBondContact O-N 3.08Å; Y138-E140 VanDerWaalsContact C-N 3.3Å; Y138-E140 PolarHBondContact O-N 3.34Å; Y138-E141 PolarHBondContact O-N 3.18Å; Y138-I142 HydrophobicContact CD1-CD1 4.03Å; Y138-I142 HydrophobicContact CD2-CG2 4.24Å; Y138-I142 HydrophobicContact CE1-CD1 3.63Å; Y138-I142 HydrophobicContact CE1-CG2 4.09Å; Y138-I142 HydrophobicContact CE2-CG2 3.73Å; Y138-I142 WeakPolarHBondContact O-CG1 3.18Å; Y138-I142 PolarHBondContact O-N 3.06Å
139K90.3Very high85.4Confident105 Ų105115.7 Ų115.746%0.45759%0.586SS.*Hα-helixtrans-58.8-38.9176.3-74174178.2179.10113T135 N136 R137 G143 C144T135-K139 HydrophobicContact CG2-CD 4.47Å; T135-K139 WeakPolarHBondContact O-CG 3.42Å; T135-K139 PolarHBondContact O-N 2.67Å; N136-K139 WeakPolarHBondContact O-CB 3.47Å; N136-K139 PolarHBondContact O-N 3.13Å; N136-K139 VanDerWaalsContact O-N 3.16Å; R137-K139 PolarHBondContact O-N 3.07Å; K139-G143 PolarHBondContact O-N 3.07Å; K139-C144 PolarHBondContact O-N 3.13Å; K139-C144 VanDerWaalsContact O-N 3.14Å
140E88.4Confident84.8Confident116 Ų116115.6 Ų115.654%0.54259%0.585SS.*Hα-helixtrans-63.3-46.8174.8-71.5169.8-175.700111.7N136 R137 Y138 G143N136-E140 WeakPolarHBondContact O-CG 3.49Å; N136-E140 PolarHBondContact O-N 3.48Å; R137-E140 WeakPolarHBondContact CD-OE2 3.45Å; R137-E140 IonicContact CZ-OE2 3.48Å; R137-E140 IonicContact NH1-OE2 2.72Å; R137-E140 PolarHBondContact NH1-OE2 3.15Å; R137-E140 WeakPolarHBondContact O-CB 3.43Å; R137-E140 PolarHBondContact O-N 3.16Å; Y138-E140 VanDerWaalsContact C-N 3.3Å; Y138-E140 PolarHBondContact O-N 3.34Å; E140-G143 PolarHBondContact O-N 3.48Å
141E86.9Confident84.1Confident141 Ų141113.8 Ų113.866%0.65958%0.582SS**Hα-helixtrans-67.4-36-178-67.5-68.616300112.8R137 Y138 G143R137-E141 IonicContact NH2-OE1 3.8Å; R137-E141 VanDerWaalsContact O-CG 3.29Å; R137-E141 WeakPolarHBondContact O-CG 3.24Å; R137-E141 PolarHBondContact O-N 3.25Å; Y138-E141 PolarHBondContact O-N 3.18Å; E141-G143 PolarHBondContact O-N 2.94Å
142I88.3Confident83.2Confident78 Ų78118.1 Ų118.140%0.459%0.593SS.*THydrogen-bonded Turntrans-82.81.7177.468.1176.4000113.4Y138 C144Y138-I142 HydrophobicContact CD1-CD1 4.03Å; Y138-I142 HydrophobicContact CD2-CG2 4.24Å; Y138-I142 HydrophobicContact CE1-CD1 3.63Å; Y138-I142 HydrophobicContact CE1-CG2 4.09Å; Y138-I142 HydrophobicContact CE2-CG2 3.73Å; Y138-I142 WeakPolarHBondContact O-CG1 3.18Å; Y138-I142 PolarHBondContact O-N 3.06Å; I142-C144 HydrophobicContact CD1-CB 3.97Å; I142-C144 VanDerWaalsContact CD1-SG 3.51Å; I142-C144 HydrophobicContact CG1-CB 3.87Å; I142-C144 PolarHBondContact O-N 2.89Å
143G68.9Low82.4Confident60 Ų60120.4 Ų120.462%0.61960%0.603SS**THydrogen-bonded Turntrans68.713.1178.900000114.6K139 E140 E141 R145K139-G143 PolarHBondContact O-N 3.07Å; E140-G143 PolarHBondContact O-N 3.48Å; E141-G143 PolarHBondContact O-N 2.94Å; G143-R145 PolarHBondContact O-N 3.23Å
144C61.1Low81.5Confident83 Ų83123.9 Ų123.956%0.56161%0.614SS**  trans-80.562.4175.2-670000110.4K139 I142K139-C144 PolarHBondContact O-N 3.13Å; K139-C144 VanDerWaalsContact O-N 3.14Å; I142-C144 HydrophobicContact CD1-CB 3.97Å; I142-C144 VanDerWaalsContact CD1-SG 3.51Å; I142-C144 HydrophobicContact CG1-CB 3.87Å; I142-C144 PolarHBondContact O-N 2.89Å
145R57.1Low80.3Confident228 Ų228123.9 Ų123.986%0.8661%0.611SS**  trans-93.5107.3167.8-168.8156.770.9166.53.5107.8G143G143-R145 PolarHBondContact O-N 3.23Å
146N51.7Low79.1Confident235 Ų235129.1 Ų129.1100%1.25763%0.629SS**  trans-73.30157.9-84.20.3000108.9

Retrieved 146 of 146 residues in 193.5 ms (Link to these results)