A0A087Y304_POEFO Loading...

Transmembrane protein 54b

AlphaFold DB , UniProt , Accession A0A087Y304, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 356 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
1M33.7Very low57.2Low204 Ų204101.4 Ų101.4100%1.00555%0.548SS*.  0100.20-85.3-75.1165.500108.5
2C41.7Very low59.3Low100 Ų10094.2 Ų94.268%0.67651%0.509SS*.  trans-66.3155.3-169.7-51.20000112.9D4C2-D4 WeakPolarHBondContact CB-OD2 3.3Å
3C46Very low61.5Low50 Ų5094.6 Ų94.634%0.33851%0.508SS..SBendtrans-96.2-2-174.1-74.10000114.3N5 L6C3-N5 PolarHBondContact O-N 3.05Å; C3-N5 VanDerWaalsContact O-N 3.1Å; C3-L6 PolarHBondContact O-N 2.55Å
4D43.9Very low63.4Low136 Ų13699.9 Ų99.973%0.72752%0.524SS*.G310 helixtrans-67.8-16-167-51.7-79.6000114.7C2C2-D4 WeakPolarHBondContact CB-OD2 3.3Å
5N48.9Very low64.8Low136 Ų13696.5 Ų96.573%0.72751%0.505SS*.G310 helixtrans-88.1-1.9179-79-80.3000115C3 A11C3-N5 PolarHBondContact O-N 3.05Å; C3-N5 VanDerWaalsContact O-N 3.1Å; N5-A11 WeakPolarHBondContact O-CB 3.47Å
6L52.8Low66.3Low15 Ų1590.6 Ų90.68%0.07947%0.474CS..G310 helixtrans-94.7-5.1178.6-88.782.9000114.2C3 E8 M15 R172 A176C3-L6 PolarHBondContact O-N 2.55Å; L6-E8 VanDerWaalsContact C-N 3.27Å; L6-E8 PolarHBondContact O-N 3.08Å; L6-M15 HydrophobicContact CD1-CE 3.82Å; L6-M15 HydrophobicContact CD1-SD 4.25Å; L6-M15 HydrophobicContact CD2-CE 4.49Å; L6-M15 HydrophobicContact CD2-SD 3.83Å; L6-M15 HydrophobicContact CG-CE 4.03Å; L6-M15 HydrophobicContact CG-SD 3.93Å; L6-R172 HydrophobicContact CD2-CB 4.21Å; L6-A176 HydrophobicContact CB-CB 4.45Å; L6-A176 HydrophobicContact CD2-CB 3.96Å
7E57.3Low67.7Low137 Ų13791.8 Ų91.864%0.6448%0.481SS*.SBendtrans-75-18.8-175.5-162.5147.912800112.9K80E7-K80 PolarHBondContact O-NZ 3.48Å
8E70Confident68.9Low126 Ų12689.1 Ų89.159%0.58947%0.471SS*.SBendtrans-72.3133.4174.9-64.5-166.2172.700112.5L6 L10 A11 L12L6-E8 VanDerWaalsContact C-N 3.27Å; L6-E8 PolarHBondContact O-N 3.08Å; E8-L10 PolarHBondContact O-N 3.04Å; E8-A11 HydrophobicContact CB-CB 4.17Å; E8-A11 PolarHBondContact O-N 2.98Å; E8-L12 PolarHBondContact O-N 3.14Å
9P72.1Confident70Confident60 Ų6084.5 Ų84.539%0.3945%0.447SS..Hα-helixtrans-64.2-31.5-179.427.9-31.2000111.9L12 M13 S77 K80P9-L12 PolarHBondContact O-N 3.37Å; P9-M13 WeakPolarHBondContact O-CB 3.39Å; P9-M13 PolarHBondContact O-N 2.84Å; P9-S77 PolarHBondContact O-OG 3.46Å; P9-K80 HydrophobicContact CB-CD 4.26Å
10L81.2Confident71.1Confident127 Ų12781.7 Ų81.767%0.66543%0.432SS*.Hα-helixtrans-65.9-44.5178.2-174.465.4000111.6E8 M13 K14E8-L10 PolarHBondContact O-N 3.04Å; L10-M13 PolarHBondContact O-N 3.17Å; L10-K14 PolarHBondContact O-N 3Å
11A81.6Confident72.2Confident24 Ų2483.5 Ų83.520%0.19844%0.441CS..Hα-helixtrans-61.6-46.5175.300000111.2N5 E8 M13 K14 M15N5-A11 WeakPolarHBondContact O-CB 3.47Å; E8-A11 HydrophobicContact CB-CB 4.17Å; E8-A11 PolarHBondContact O-N 2.98Å; A11-M13 VanDerWaalsContact C-N 3.32Å; A11-M13 PolarHBondContact O-N 2.87Å; A11-K14 PolarHBondContact O-N 3.18Å; A11-M15 WeakPolarHBondContact O-CG 3.39Å; A11-M15 PolarHBondContact O-N 3.43Å
12L81.9Confident74.8Confident15 Ų1574.8 Ų74.88%0.07940%0.399CS..Hα-helixtrans-61-39.3177.3-158.685.8000112.3E8 P9 G16 A73 L76E8-L12 PolarHBondContact O-N 3.14Å; P9-L12 PolarHBondContact O-N 3.37Å; L12-G16 PolarHBondContact O-N 2.97Å; L12-A73 WeakPolarHBondContact CD2-O 3.43Å; L12-L76 HydrophobicContact CD2-CB 4.27Å; L12-L76 HydrophobicContact CD2-CD2 4.39Å; L12-L76 HydrophobicContact CD2-CG 4.27Å
13M88.1Confident77.1Confident100 Ų10070 Ų7049%0.49337%0.367SS..Hα-helixtrans-66.6-44.5176.4179.4175.6167.100111.9P9 L10 A11 M15 G16 L17P9-M13 WeakPolarHBondContact O-CB 3.39Å; P9-M13 PolarHBondContact O-N 2.84Å; L10-M13 PolarHBondContact O-N 3.17Å; A11-M13 VanDerWaalsContact C-N 3.32Å; A11-M13 PolarHBondContact O-N 2.87Å; M13-M15 VanDerWaalsContact C-N 3.35Å; M13-M15 PolarHBondContact O-N 2.93Å; M13-G16 PolarHBondContact O-N 3Å; M13-L17 PolarHBondContact O-N 3.2Å
14K88.2Confident79.3Confident168 Ų16871.9 Ų71.973%0.7337%0.371SS*.Hα-helixtrans-64.3-38.8177.5-170.4173.2-178.8176.80111.8L10 A11 S18L10-K14 PolarHBondContact O-N 3Å; A11-K14 PolarHBondContact O-N 3.18Å; K14-S18 WeakPolarHBondContact O-CB 3.38Å; K14-S18 PolarHBondContact O-N 3.15Å; K14-S18 VanDerWaalsContact O-N 3.09Å
15M85.1Confident81.5Confident50 Ų5068.7 Ų68.725%0.24636%0.356CS..Hα-helixtrans-66.2-45.6171.9-69.1-168-174.800111.9L6 A11 M13 L17 S18 V19 F169L6-M15 HydrophobicContact CD1-CE 3.82Å; L6-M15 HydrophobicContact CD1-SD 4.25Å; L6-M15 HydrophobicContact CD2-CE 4.49Å; L6-M15 HydrophobicContact CD2-SD 3.83Å; L6-M15 HydrophobicContact CG-CE 4.03Å; L6-M15 HydrophobicContact CG-SD 3.93Å; A11-M15 WeakPolarHBondContact O-CG 3.39Å; A11-M15 PolarHBondContact O-N 3.43Å; M13-M15 VanDerWaalsContact C-N 3.35Å; M13-M15 PolarHBondContact O-N 2.93Å; M15-L17 VanDerWaalsContact C-N 3.32Å; M15-L17 PolarHBondContact O-N 2.96Å; M15-S18 WeakPolarHBondContact O-CB 3.47Å; M15-S18 PolarHBondContact O-N 3.14Å; M15-S18 VanDerWaalsContact O-N 3.11Å; M15-V19 WeakPolarHBondContact O-CG2 3.29Å; M15-V19 PolarHBondContact O-N 3.05Å; M15-F169 HydrophobicContact CB-CE1 4.49Å; M15-F169 HydrophobicContact CG-CE1 4.21Å
16G88.5Confident83.4Confident1 Ų162.3 Ų62.31%0.0132%0.322CS..Hα-helixtrans-55.8-44.7176.800000112.8L12 M13 V19 I20L12-G16 PolarHBondContact O-N 2.97Å; M13-G16 PolarHBondContact O-N 3Å; G16-V19 PolarHBondContact O-N 3Å; G16-I20 WeakPolarHBondContact O-CG1 3.29Å; G16-I20 PolarHBondContact O-N 3.02Å
17L90Very high85.2Confident111 Ų11165.5 Ų65.558%0.58134%0.335SS*.Hα-helixtrans-63.5-42.6174.8-172.668.3000112.4M13 M15 V19 I20 L21M13-L17 PolarHBondContact O-N 3.2Å; M15-L17 VanDerWaalsContact C-N 3.32Å; M15-L17 PolarHBondContact O-N 2.96Å; L17-V19 VanDerWaalsContact C-N 3.31Å; L17-V19 PolarHBondContact O-N 3.38Å; L17-I20 PolarHBondContact O-N 3.44Å; L17-L21 PolarHBondContact O-N 3.1Å
18S88.8Confident86.7Confident44 Ų4464.3 Ų64.331%0.30833%0.333SS..Hα-helixtrans-60.9-39.4175.3-170.30000112.1K14 M15 L21 V22 F169K14-S18 WeakPolarHBondContact O-CB 3.38Å; K14-S18 PolarHBondContact O-N 3.15Å; K14-S18 VanDerWaalsContact O-N 3.09Å; M15-S18 WeakPolarHBondContact O-CB 3.47Å; M15-S18 PolarHBondContact O-N 3.14Å; M15-S18 VanDerWaalsContact O-N 3.11Å; S18-L21 PolarHBondContact O-N 3.25Å; S18-V22 VanDerWaalsContact O-CG2 3.31Å; S18-V22 WeakPolarHBondContact O-CG2 3.25Å; S18-V22 PolarHBondContact O-N 2.77Å; S18-F169 WeakPolarHBondContact OG-CZ 3.25Å
19V89.4Confident87.4Confident1 Ų160.3 Ų60.31%0.00631%0.314CS..Hα-helixtrans-69.4-38.1177.7175.10000111.6M15 G16 L17 V22 G23 G66 F169M15-V19 WeakPolarHBondContact O-CG2 3.29Å; M15-V19 PolarHBondContact O-N 3.05Å; G16-V19 PolarHBondContact O-N 3Å; L17-V19 VanDerWaalsContact C-N 3.31Å; L17-V19 PolarHBondContact O-N 3.38Å; V19-V22 PolarHBondContact O-N 3.04Å; V19-G23 PolarHBondContact O-N 3.38Å; V19-G66 VanDerWaalsContact CG1-O 3.31Å; V19-G66 WeakPolarHBondContact CG1-O 3.12Å; V19-F169 HydrophobicContact CG2-CB 3.38Å; V19-F169 HydrophobicContact CG2-CD1 4.01Å; V19-F169 HydrophobicContact CG2-CD2 4.25Å; V19-F169 HydrophobicContact CG2-CG 3.65Å
20I93.6Very high88Confident29 Ų2957.4 Ų57.415%0.14930%0.296CS..Hα-helixtrans-60-48.2173.1-70.5170000110.3G16 L17 V22 G23 H24 I71 I74G16-I20 WeakPolarHBondContact O-CG1 3.29Å; G16-I20 PolarHBondContact O-N 3.02Å; L17-I20 PolarHBondContact O-N 3.44Å; I20-V22 PolarHBondContact O-N 2.89Å; I20-G23 PolarHBondContact O-N 3.21Å; I20-H24 PolarHBondContact O-CD2 3.38Å; I20-H24 PolarHBondContact O-N 3.13Å; I20-I71 HydrophobicContact CD1-CG1 3.92Å; I20-I71 HydrophobicContact CG1-CG1 4.39Å; I20-I74 HydrophobicContact CD1-CD1 3.57Å
21L92.6Very high88.2Confident119 Ų11953.4 Ų53.462%0.62328%0.281SS*.Hα-helixtrans-60.1-47.6179.2-175.866000111.8L17 S18 G23 H24 V25L17-L21 PolarHBondContact O-N 3.1Å; S18-L21 PolarHBondContact O-N 3.25Å; L21-G23 VanDerWaalsContact C-N 3.34Å; L21-G23 PolarHBondContact O-N 3.49Å; L21-H24 PolarHBondContact O-N 2.81Å; L21-V25 WeakPolarHBondContact O-CG2 3.31Å; L21-V25 PolarHBondContact O-N 3.27Å
22V89.9Confident88.4Confident21 Ų2156.6 Ų56.613%0.12729%0.294CS..Hα-helixtrans-63.8-39.21771710000111.4S18 V19 I20 V25 N26 I165 Q166S18-V22 VanDerWaalsContact O-CG2 3.31Å; S18-V22 WeakPolarHBondContact O-CG2 3.25Å; S18-V22 PolarHBondContact O-N 2.77Å; V19-V22 PolarHBondContact O-N 3.04Å; I20-V22 PolarHBondContact O-N 2.89Å; V22-V25 PolarHBondContact O-N 3.24Å; V22-N26 WeakPolarHBondContact CG1-ND2 3.43Å; V22-N26 WeakPolarHBondContact O-CB 3.49Å; V22-N26 PolarHBondContact O-N 2.97Å; V22-N26 PolarHBondContact O-ND2 3.35Å; V22-N26 VanDerWaalsContact O-ND2 3.08Å; V22-I165 HydrophobicContact CG1-CB 4.45Å; V22-I165 HydrophobicContact CG1-CG2 4.11Å; V22-I165 HydrophobicContact CG2-CG2 3.83Å; V22-Q166 HydrophobicContact CG1-CB 4.1Å
23G89.4Confident88.2Confident0 Ų056 Ų560%029%0.291CS..Hα-helixtrans-61.2-42174.400000113V19 I20 L21 N26 F27V19-G23 PolarHBondContact O-N 3.38Å; I20-G23 PolarHBondContact O-N 3.21Å; L21-G23 VanDerWaalsContact C-N 3.34Å; L21-G23 PolarHBondContact O-N 3.49Å; G23-N26 PolarHBondContact O-N 3.39Å; G23-F27 WeakPolarHBondContact O-CB 3.44Å; G23-F27 PolarHBondContact O-N 3.01Å
24H92.2Very high87.9Confident90 Ų9053.7 Ų53.742%0.41728%0.279SS..Hα-helixtrans-66-43.5174.1-76.7-65.1000112.7I20 L21 N26 F27 L28I20-H24 PolarHBondContact O-CD2 3.38Å; I20-H24 PolarHBondContact O-N 3.13Å; L21-H24 PolarHBondContact O-N 2.81Å; H24-N26 VanDerWaalsContact C-N 3.35Å; H24-F27 PolarHBondContact O-N 3.22Å; H24-L28 WeakPolarHBondContact O-CG 3.48Å; H24-L28 PolarHBondContact O-N 3.19Å
25V90.6Very high87.3Confident69 Ų6947.5 Ų47.542%0.41826%0.263SS..Hα-helixtrans-62-44175.4174.20000110.7L21 V22 F27 L28 M29L21-V25 WeakPolarHBondContact O-CG2 3.31Å; L21-V25 PolarHBondContact O-N 3.27Å; V22-V25 PolarHBondContact O-N 3.24Å; V25-F27 PolarHBondContact O-N 3.28Å; V25-L28 PolarHBondContact O-N 3.4Å; V25-M29 HydrophobicContact CG1-CG 4.18Å; V25-M29 VanDerWaalsContact O-CB 3.3Å; V25-M29 WeakPolarHBondContact O-CB 3.29Å; V25-M29 WeakPolarHBondContact O-CG 3.3Å; V25-M29 PolarHBondContact O-N 2.89Å
26N88.7Confident86.8Confident1 Ų147.6 Ų47.61%0.00526%0.264CS..Hα-helixtrans-58.4-43.9173.9-81.7-43000112.5V22 G23 H24 G30 S162 C163V22-N26 WeakPolarHBondContact CG1-ND2 3.43Å; V22-N26 WeakPolarHBondContact O-CB 3.49Å; V22-N26 PolarHBondContact O-N 2.97Å; V22-N26 PolarHBondContact O-ND2 3.35Å; V22-N26 VanDerWaalsContact O-ND2 3.08Å; G23-N26 PolarHBondContact O-N 3.39Å; H24-N26 VanDerWaalsContact C-N 3.35Å; N26-G30 PolarHBondContact O-N 2.97Å; N26-S162 PolarHBondContact ND2-O 2.9Å; N26-S162 VanDerWaalsContact ND2-O 3.17Å; N26-S162 VanDerWaalsContact OD1-C 3.3Å; N26-S162 WeakPolarHBondContact OD1-CB 3.22Å; N26-S162 PolarHBondContact OD1-OG 3.19Å; N26-C163 PolarHBondContact OD1-N 3.44Å
27F89.6Confident85.7Confident82 Ų8248.7 Ų48.736%0.3627%0.27SS..Hα-helixtrans-64.8-47.4177.7175.4-100.7000112.2G23 H24 V25 G30 A31 L60 I64G23-F27 WeakPolarHBondContact O-CB 3.44Å; G23-F27 PolarHBondContact O-N 3.01Å; H24-F27 PolarHBondContact O-N 3.22Å; V25-F27 PolarHBondContact O-N 3.28Å; F27-G30 PolarHBondContact O-N 3.45Å; F27-A31 WeakPolarHBondContact O-CB 3.27Å; F27-A31 PolarHBondContact O-N 3.41Å; F27-L60 HydrophobicContact CD2-CD2 3.79Å; F27-L60 HydrophobicContact CE2-CD2 3.95Å; F27-L60 WeakPolarHBondContact O-CD2 3.47Å; F27-I64 HydrophobicContact CD2-CD1 4.18Å; F27-I64 HydrophobicContact CD2-CG1 3.81Å; F27-I64 HydrophobicContact CE2-CD1 4.05Å; F27-I64 HydrophobicContact CE2-CG1 4.12Å
28L89.9Confident84.4Confident113 Ų11347.8 Ų47.859%0.59227%0.266SS*.Hα-helixtrans-64.5-43.9179.2-69.9171.4000112H24 V25 A31 L32H24-L28 WeakPolarHBondContact O-CG 3.48Å; H24-L28 PolarHBondContact O-N 3.19Å; V25-L28 PolarHBondContact O-N 3.4Å; L28-A31 PolarHBondContact O-N 3.48Å; L28-L32 WeakPolarHBondContact O-CB 3.48Å; L28-L32 PolarHBondContact O-N 3.34Å
29M84.7Confident83.2Confident41 Ų4155.5 Ų55.520%0.20229%0.288CS..Hα-helixtrans-66.1-42.6176.5-70-73.3-74.300111.5V25 A31 L32 V33 L155 L159V25-M29 HydrophobicContact CG1-CG 4.18Å; V25-M29 VanDerWaalsContact O-CB 3.3Å; V25-M29 WeakPolarHBondContact O-CB 3.29Å; V25-M29 WeakPolarHBondContact O-CG 3.3Å; V25-M29 PolarHBondContact O-N 2.89Å; M29-A31 VanDerWaalsContact C-N 3.33Å; M29-A31 PolarHBondContact O-N 3.09Å; M29-L32 PolarHBondContact O-N 2.98Å; M29-V33 VanDerWaalsContact O-CG2 3.32Å; M29-V33 WeakPolarHBondContact O-CG2 3.47Å; M29-V33 PolarHBondContact O-N 2.94Å; M29-L155 HydrophobicContact CE-CB 4.19Å; M29-L155 HydrophobicContact CE-CD2 3.5Å; M29-L155 HydrophobicContact CE-CG 4.46Å; M29-L155 WeakPolarHBondContact CE-O 3.32Å; M29-L155 HydrophobicContact SD-CD2 3.78Å; M29-L159 HydrophobicContact CB-CD1 3.86Å
30G83.8Confident81.6Confident0 Ų060.3 Ų60.30%031%0.31CS..Hα-helixtrans-60.4-40.9173.800000112.6N26 F27 H34N26-G30 PolarHBondContact O-N 2.97Å; F27-G30 PolarHBondContact O-N 3.45Å; G30-H34 WeakPolarHBondContact O-CB 3.42Å; G30-H34 PolarHBondContact O-N 3.26Å
31A86.2Confident79.6Confident43 Ų4363 Ų6336%0.35532%0.324SS..Hα-helixtrans-67.9-41.9177.500000111.8F27 L28 M29 H34 G35 L60F27-A31 WeakPolarHBondContact O-CB 3.27Å; F27-A31 PolarHBondContact O-N 3.41Å; L28-A31 PolarHBondContact O-N 3.48Å; M29-A31 VanDerWaalsContact C-N 3.33Å; M29-A31 PolarHBondContact O-N 3.09Å; A31-H34 PolarHBondContact O-N 3.42Å; A31-G35 PolarHBondContact O-N 2.71Å; A31-L60 HydrophobicContact CB-CD2 3.97Å
32L84.4Confident77.6Confident91 Ų9164.2 Ų64.248%0.47633%0.331SS..Hα-helixtrans-63.3-49.1176.4-178.362.7000111.5L28 M29 H34 G35 I36 L155L28-L32 WeakPolarHBondContact O-CB 3.48Å; L28-L32 PolarHBondContact O-N 3.34Å; M29-L32 PolarHBondContact O-N 2.98Å; L32-H34 VanDerWaalsContact C-N 3.35Å; L32-H34 PolarHBondContact O-N 3.34Å; L32-G35 PolarHBondContact O-N 2.87Å; L32-I36 HydrophobicContact CD1-CD1 4.15Å; L32-I36 HydrophobicContact CG-CD1 3.98Å; L32-I36 VanDerWaalsContact O-CG1 3.28Å; L32-I36 WeakPolarHBondContact O-CG1 3.4Å; L32-I36 PolarHBondContact O-N 2.99Å; L32-L155 HydrophobicContact CD2-CD1 4.08Å; L32-L155 HydrophobicContact CD2-CD2 3.76Å; L32-L155 HydrophobicContact CG-CD1 4.25Å
33V78.2Confident75.6Confident3 Ų369.7 Ų69.72%0.01836%0.359CS..Hα-helixtrans-63.8-40.6177.4177.30000110.8M29 I36 V37 N56 L155M29-V33 VanDerWaalsContact O-CG2 3.32Å; M29-V33 WeakPolarHBondContact O-CG2 3.47Å; M29-V33 PolarHBondContact O-N 2.94Å; V33-I36 PolarHBondContact O-N 2.92Å; V33-V37 HydrophobicContact CG1-CG2 4.43Å; V33-V37 WeakPolarHBondContact O-CB 3.37Å; V33-V37 VanDerWaalsContact O-CG2 3.28Å; V33-V37 WeakPolarHBondContact O-CG2 3.41Å; V33-V37 PolarHBondContact O-N 3.22Å; V33-N56 WeakPolarHBondContact CG1-OD1 3.18Å; V33-L155 HydrophobicContact CG2-CB 3.77Å; V33-L155 HydrophobicContact CG2-CD1 4.03Å; V33-L155 HydrophobicContact CG2-CG 4.46Å
34H81.1Confident73.3Confident51 Ų5177.2 Ų77.224%0.23639%0.394CS..Hα-helixtrans-61.9-43.8174.7-173.275.2000112.2G30 A31 L32 V37 L38 N56 L60G30-H34 WeakPolarHBondContact O-CB 3.42Å; G30-H34 PolarHBondContact O-N 3.26Å; A31-H34 PolarHBondContact O-N 3.42Å; L32-H34 VanDerWaalsContact C-N 3.35Å; L32-H34 PolarHBondContact O-N 3.34Å; H34-V37 PolarHBondContact O-N 2.96Å; H34-L38 WeakPolarHBondContact O-CG 3.44Å; H34-L38 PolarHBondContact O-N 3.47Å; H34-N56 HydrophobicContact CB-CB 4.48Å; H34-L60 HydrophobicContact CB-CD1 4.21Å
35G76.4Confident71.1Confident38 Ų3881.4 Ų81.439%0.39241%0.414SS..Hα-helixtrans-64.7-40.4176.600000113.6A31 L32 L38 R39A31-G35 PolarHBondContact O-N 2.71Å; L32-G35 PolarHBondContact O-N 2.87Å; G35-L38 PolarHBondContact O-N 3.45Å; G35-R39 PolarHBondContact O-N 3Å; G35-R39 VanDerWaalsContact O-N 3.07Å
36I73.9Confident69.1Low51 Ų5188.3 Ų88.326%0.26244%0.438SS..Hα-helixtrans-63.2-44.1173.1-67.1163000110.2L32 V33 R39 Q40 L155L32-I36 HydrophobicContact CD1-CD1 4.15Å; L32-I36 HydrophobicContact CG-CD1 3.98Å; L32-I36 VanDerWaalsContact O-CG1 3.28Å; L32-I36 WeakPolarHBondContact O-CG1 3.4Å; L32-I36 PolarHBondContact O-N 2.99Å; V33-I36 PolarHBondContact O-N 2.92Å; I36-R39 PolarHBondContact O-N 3.38Å; I36-Q40 WeakPolarHBondContact O-CB 3.41Å; I36-Q40 PolarHBondContact O-N 3.47Å; I36-L155 HydrophobicContact CD1-CD1 3.47Å; I36-L155 VanDerWaalsContact CD1-CD1 3.47Å
37V66.7Low67Low24 Ų2492.2 Ų92.215%0.14547%0.471CS..Hα-helixtrans-64.1-41.7178.5165.70000111.9V33 H34 R39 Q40 I41V33-V37 HydrophobicContact CG1-CG2 4.43Å; V33-V37 WeakPolarHBondContact O-CB 3.37Å; V33-V37 VanDerWaalsContact O-CG2 3.28Å; V33-V37 WeakPolarHBondContact O-CG2 3.41Å; V33-V37 PolarHBondContact O-N 3.22Å; H34-V37 PolarHBondContact O-N 2.96Å; V37-R39 VanDerWaalsContact C-N 3.32Å; V37-R39 PolarHBondContact O-N 3.44Å; V37-Q40 PolarHBondContact O-N 3.37Å; V37-I41 HydrophobicContact CG1-CD1 3.49Å; V37-I41 VanDerWaalsContact CG1-CD1 3.49Å; V37-I41 HydrophobicContact CG1-CG1 4.15Å; V37-I41 WeakPolarHBondContact O-CB 3.44Å; V37-I41 VanDerWaalsContact O-CG1 3.23Å; V37-I41 WeakPolarHBondContact O-CG1 3.45Å; V37-I41 PolarHBondContact O-N 3.19Å
38L62.8Low65.1Low93 Ų9396.8 Ų96.849%0.48749%0.485SS..Hα-helixtrans-62.2-37.5173.4-73.2175.2000112.7H34 G35 N42H34-L38 WeakPolarHBondContact O-CG 3.44Å; H34-L38 PolarHBondContact O-N 3.47Å; G35-L38 PolarHBondContact O-N 3.45Å; L38-N42 PolarHBondContact O-ND2 3.1Å
39R63.2Low63.5Low206 Ų20692.6 Ų92.678%0.77747%0.47SS*.Hα-helixtrans-67.5-36.5174.8-167.8174.1-177.7173.40.7112G35 I36 V37G35-R39 PolarHBondContact O-N 3Å; G35-R39 VanDerWaalsContact O-N 3.07Å; I36-R39 PolarHBondContact O-N 3.38Å; V37-R39 VanDerWaalsContact C-N 3.32Å; V37-R39 PolarHBondContact O-N 3.44Å
40Q55.1Low62.3Low102 Ų10296.6 Ų96.648%0.47749%0.489SS..Hα-helixtrans-80.8-30.3-178.4-154.571.86.200113.6I36 V37 N42 L43I36-Q40 WeakPolarHBondContact O-CB 3.41Å; I36-Q40 PolarHBondContact O-N 3.47Å; V37-Q40 PolarHBondContact O-N 3.37Å; Q40-N42 PolarHBondContact O-N 3.46Å; Q40-L43 PolarHBondContact O-N 3.18Å
41I52Low61.3Low85 Ų85100.7 Ų100.744%0.43651%0.514SS..Hα-helixtrans-64.9-21.1178.6-76.9168.4000112.6V37 L43V37-I41 HydrophobicContact CG1-CD1 3.49Å; V37-I41 VanDerWaalsContact CG1-CD1 3.49Å; V37-I41 HydrophobicContact CG1-CG1 4.15Å; V37-I41 WeakPolarHBondContact O-CB 3.44Å; V37-I41 VanDerWaalsContact O-CG1 3.23Å; V37-I41 WeakPolarHBondContact O-CG1 3.45Å; V37-I41 PolarHBondContact O-N 3.19Å; I41-L43 PolarHBondContact O-N 2.87Å
42N50.7Low60.4Low145 Ų145101.4 Ų101.478%0.77551%0.508SS*.THydrogen-bonded Turntrans-69.9-8.3171-84.8-82.1000114L38 Q40L38-N42 PolarHBondContact O-ND2 3.1Å; Q40-N42 PolarHBondContact O-N 3.46Å
43L47.8Very low59.9Low136 Ų13698.4 Ų98.471%0.71250%0.496SS*.THydrogen-bonded Turntrans-125.8-8-170.4-85.2164.9000116Q40 I41Q40-L43 PolarHBondContact O-N 3.18Å; I41-L43 PolarHBondContact O-N 2.87Å
44H42.4Very low59.7Low158 Ų158103 Ų10373%0.73152%0.519SS*.SBendtrans-147.7146.6-178.8-140-76.9000114.3
45E45.9Very low59.5Low177 Ų177101.6 Ų101.683%0.82752%0.515SS*.  trans-57.9149.7-157.9-67.3-172.5120.700118.4A47E45-A47 PolarHBondContact O-N 3.28Å
46K48.7Very low59.7Low215 Ų21599.8 Ų99.894%0.93550%0.497SS*.SBendtrans-72.2103.5179.5-68.1173.7177.8172.80112.3
47A44Very low60.2Low83 Ų8399.9 Ų99.969%0.68650%0.499SS*.SBendtrans-167.9-53.8145.800000110.2E45 G49E45-A47 PolarHBondContact O-N 3.28Å; A47-G49 PolarHBondContact O-N 3.01Å
48R48.9Very low61.1Low178 Ų178100.9 Ų100.967%0.67251%0.506SS*.THydrogen-bonded Turntrans-79.1-19.5-170.2-156.8168.1-74.3160.3-2.9114.1M50 Y52R48-M50 VanDerWaalsContact C-N 3.32Å; R48-M50 PolarHBondContact O-N 2.73Å; R48-Y52 HydrophobicContact CG-CE2 4.3Å; R48-Y52 WeakPolarHBondContact O-CD2 3.47Å; R48-Y52 WeakPolarHBondContact O-CE2 3.45Å
49G56Low62.1Low25 Ų2596.5 Ų96.526%0.25848%0.483SS..Hα-helixtrans-69.4-21.3179.100000115.5A47 Y52 A53A47-G49 PolarHBondContact O-N 3.01Å; G49-Y52 PolarHBondContact O-N 3.21Å; G49-A53 PolarHBondContact O-N 3.24Å
50M59.2Low63.3Low124 Ų12488 Ų8861%0.61145%0.453SS*.Hα-helixtrans-67.9-42.3-174.2-173.5170.267.500112.7R48 Y52 A53 I54R48-M50 VanDerWaalsContact C-N 3.32Å; R48-M50 PolarHBondContact O-N 2.73Å; M50-Y52 VanDerWaalsContact C-N 3.31Å; M50-Y52 PolarHBondContact O-N 2.99Å; M50-A53 PolarHBondContact O-N 2.94Å; M50-I54 HydrophobicContact CG-CD1 3.98Å; M50-I54 VanDerWaalsContact O-CG1 3.32Å; M50-I54 WeakPolarHBondContact O-CG1 3.45Å; M50-I54 PolarHBondContact O-N 3.12Å
51V63.6Low64.9Low86 Ų8688.9 Ų88.952%0.52146%0.455SS..Hα-helixtrans-62.1-41.6178.2-178.10000110.6I54 S55V51-I54 PolarHBondContact O-N 3.1Å; V51-S55 PolarHBondContact O-N 3.08Å; V51-S55 PolarHBondContact O-OG 3.18Å; V51-S55 VanDerWaalsContact O-OG 3.09Å
52Y67.6Low66.6Low59 Ų5984.9 Ų84.923%0.23144%0.435CS..Hα-helixtrans-66-43.3176.6-50.4-36.9000112R48 G49 M50 I54 S55 N56 S110 W156R48-Y52 HydrophobicContact CG-CE2 4.3Å; R48-Y52 WeakPolarHBondContact O-CD2 3.47Å; R48-Y52 WeakPolarHBondContact O-CE2 3.45Å; G49-Y52 PolarHBondContact O-N 3.21Å; M50-Y52 VanDerWaalsContact C-N 3.31Å; M50-Y52 PolarHBondContact O-N 2.99Å; Y52-I54 VanDerWaalsContact C-N 3.32Å; Y52-I54 PolarHBondContact O-N 3.49Å; Y52-S55 PolarHBondContact O-N 3.5Å; Y52-N56 WeakPolarHBondContact O-CB 3.29Å; Y52-N56 PolarHBondContact O-N 3.23Å; Y52-N56 PolarHBondContact O-ND2 3.49Å; Y52-S110 VanDerWaalsContact CD1-OG 3.27Å; Y52-S110 WeakPolarHBondContact CD1-OG 3.5Å; Y52-S110 WeakPolarHBondContact CE1-OG 3.25Å; Y52-W156 HydrophobicContact CD1-CH2 4.01Å; Y52-W156 HydrophobicContact CE1-CH2 4.19Å; Y52-W156 HydrophobicContact CG-CH2 4.28Å
53A73.6Confident68.4Low27 Ų2778 Ų7822%0.22340%0.398CS..Hα-helixtrans-58-44175.700000111.8G49 M50 N56 V57G49-A53 PolarHBondContact O-N 3.24Å; M50-A53 PolarHBondContact O-N 2.94Å; A53-N56 PolarHBondContact O-N 3.08Å; A53-V57 WeakPolarHBondContact O-CG2 3.33Å; A53-V57 PolarHBondContact O-N 3.48Å; A53-V57 VanDerWaalsContact O-N 3.09Å
54I74.7Confident70.5Confident99 Ų9974.9 Ų74.951%0.50838%0.381SS..Hα-helixtrans-63.4-48.5176.2-65.3163.5000111M50 V51 Y52 N56 V57 V58M50-I54 HydrophobicContact CG-CD1 3.98Å; M50-I54 VanDerWaalsContact O-CG1 3.32Å; M50-I54 WeakPolarHBondContact O-CG1 3.45Å; M50-I54 PolarHBondContact O-N 3.12Å; V51-I54 PolarHBondContact O-N 3.1Å; Y52-I54 VanDerWaalsContact C-N 3.32Å; Y52-I54 PolarHBondContact O-N 3.49Å; I54-N56 VanDerWaalsContact C-N 3.29Å; I54-N56 PolarHBondContact O-N 3.49Å; I54-V57 PolarHBondContact O-N 3.25Å; I54-V58 HydrophobicContact CG2-CG2 4.34Å; I54-V58 WeakPolarHBondContact O-CG2 3.45Å; I54-V58 PolarHBondContact O-N 3.09Å
55S76.4Confident72.9Confident22 Ų2269.3 Ų69.315%0.15436%0.356CS..Hα-helixtrans-59.8-37.2178.1-600000113V51 Y52 T59V51-S55 PolarHBondContact O-N 3.08Å; V51-S55 PolarHBondContact O-OG 3.18Å; V51-S55 VanDerWaalsContact O-OG 3.09Å; Y52-S55 PolarHBondContact O-N 3.5Å; S55-T59 WeakPolarHBondContact O-CB 3.49Å; S55-T59 PolarHBondContact O-N 3.4Å; S55-T59 PolarHBondContact O-OG1 2.93Å
56N81.5Confident75Confident1 Ų160.9 Ų60.91%0.00532%0.317CS..Hα-helixtrans-67.4-42176.2-67.6-31.5000111.9V33 H34 Y52 A53 I54 T59 L60V33-N56 WeakPolarHBondContact CG1-OD1 3.18Å; H34-N56 HydrophobicContact CB-CB 4.48Å; Y52-N56 WeakPolarHBondContact O-CB 3.29Å; Y52-N56 PolarHBondContact O-N 3.23Å; Y52-N56 PolarHBondContact O-ND2 3.49Å; A53-N56 PolarHBondContact O-N 3.08Å; I54-N56 VanDerWaalsContact C-N 3.29Å; I54-N56 PolarHBondContact O-N 3.49Å; N56-T59 PolarHBondContact O-N 3.08Å; N56-L60 PolarHBondContact O-N 2.92Å
57V84.4Confident77.1Confident52 Ų5251.7 Ų51.732%0.31528%0.279SS..Hα-helixtrans-65.9-43175.6171.50000111.3A53 I54 T59 L60 F61A53-V57 WeakPolarHBondContact O-CG2 3.33Å; A53-V57 PolarHBondContact O-N 3.48Å; A53-V57 VanDerWaalsContact O-N 3.09Å; I54-V57 PolarHBondContact O-N 3.25Å; V57-T59 PolarHBondContact O-N 3.33Å; V57-L60 WeakPolarHBondContact O-CB 3.31Å; V57-L60 PolarHBondContact O-N 2.98Å; V57-F61 HydrophobicContact CG1-CD2 3.76Å; V57-F61 HydrophobicContact CG1-CE2 3.58Å; V57-F61 VanDerWaalsContact O-CD2 3.25Å; V57-F61 WeakPolarHBondContact O-CD2 3.47Å; V57-F61 PolarHBondContact O-N 3.49Å; V57-F61 VanDerWaalsContact O-N 3.08Å
58V83.8Confident79.4Confident46 Ų4651.1 Ų51.128%0.27926%0.264SS..Hα-helixtrans-57.9-38.8172.31690000110.9I54 S62 M99I54-V58 HydrophobicContact CG2-CG2 4.34Å; I54-V58 WeakPolarHBondContact O-CG2 3.45Å; I54-V58 PolarHBondContact O-N 3.09Å; V58-S62 WeakPolarHBondContact O-CB 3.28Å; V58-S62 PolarHBondContact O-N 2.97Å; V58-M99 HydrophobicContact CB-CE 4.39Å; V58-M99 HydrophobicContact CG1-CE 3.96Å; V58-M99 HydrophobicContact CG1-CG 3.84Å; V58-M99 WeakPolarHBondContact O-CE 3.32Å
59T84.7Confident81.4Confident1 Ų142.6 Ų42.61%0.00623%0.232CC..Hα-helixtrans-69.5-39.9177.9-54.30000112.8S55 N56 V57 S62 G63 S103 L159S55-T59 WeakPolarHBondContact O-CB 3.49Å; S55-T59 PolarHBondContact O-N 3.4Å; S55-T59 PolarHBondContact O-OG1 2.93Å; N56-T59 PolarHBondContact O-N 3.08Å; V57-T59 PolarHBondContact O-N 3.33Å; T59-S62 WeakPolarHBondContact O-CB 3.36Å; T59-S62 PolarHBondContact O-N 3.48Å; T59-G63 PolarHBondContact O-N 3.41Å; T59-S103 PolarHBondContact OG1-OG 3.23Å; T59-L159 HydrophobicContact CG2-CD1 3.53Å; T59-L159 HydrophobicContact CG2-CD2 3.89Å; T59-L159 HydrophobicContact CG2-CG 3.8Å
60L87.4Confident83.1Confident28 Ų2841.5 Ų41.515%0.14722%0.22CC..Hα-helixtrans-56.1-52172.5-82.5169000111.9F27 A31 H34 N56 V57 S62 G63 I64F27-L60 HydrophobicContact CD2-CD2 3.79Å; F27-L60 HydrophobicContact CE2-CD2 3.95Å; F27-L60 WeakPolarHBondContact O-CD2 3.47Å; A31-L60 HydrophobicContact CB-CD2 3.97Å; H34-L60 HydrophobicContact CB-CD1 4.21Å; N56-L60 PolarHBondContact O-N 2.92Å; V57-L60 WeakPolarHBondContact O-CB 3.31Å; V57-L60 PolarHBondContact O-N 2.98Å; L60-S62 VanDerWaalsContact C-N 3.32Å; L60-S62 PolarHBondContact O-N 3.33Å; L60-G63 PolarHBondContact O-N 3.43Å; L60-I64 WeakPolarHBondContact O-CG1 3.22Å; L60-I64 PolarHBondContact O-N 3.38Å; L60-I64 VanDerWaalsContact O-N 3.13Å
61F89.4Confident84.6Confident119 Ų11939.4 Ų39.452%0.52221%0.21SC..Hα-helixtrans-63.5-37.2176.6-76.7-67.5000112.3V57 G63 I64 L65 M99V57-F61 HydrophobicContact CG1-CD2 3.76Å; V57-F61 HydrophobicContact CG1-CE2 3.58Å; V57-F61 VanDerWaalsContact O-CD2 3.25Å; V57-F61 WeakPolarHBondContact O-CD2 3.47Å; V57-F61 PolarHBondContact O-N 3.49Å; V57-F61 VanDerWaalsContact O-N 3.08Å; F61-G63 VanDerWaalsContact C-N 3.32Å; F61-G63 PolarHBondContact O-N 3Å; F61-I64 PolarHBondContact O-N 3.28Å; F61-L65 WeakPolarHBondContact O-CB 3.36Å; F61-L65 WeakPolarHBondContact O-CG 3.32Å; F61-L65 PolarHBondContact O-N 3.39Å; F61-M99 HydrophobicContact CB-CE 3.44Å; F61-M99 VanDerWaalsContact CB-CE 3.44Å; F61-M99 HydrophobicContact CG-CE 4.45Å
62S87.7Confident85.9Confident1 Ų136.5 Ų36.51%0.00719%0.192CC..Hα-helixtrans-62.3-36.5173.8-172.90000112.7V58 T59 L60 G66V58-S62 WeakPolarHBondContact O-CB 3.28Å; V58-S62 PolarHBondContact O-N 2.97Å; T59-S62 WeakPolarHBondContact O-CB 3.36Å; T59-S62 PolarHBondContact O-N 3.48Å; L60-S62 VanDerWaalsContact C-N 3.32Å; L60-S62 PolarHBondContact O-N 3.33Å; S62-G66 PolarHBondContact O-N 3.43Å
63G88.4Confident86.9Confident0 Ų033.8 Ų33.80%018%0.182CC..Hα-helixtrans-65.4-46.6174.700000112.2T59 L60 F61 G66 V67T59-G63 PolarHBondContact O-N 3.41Å; L60-G63 PolarHBondContact O-N 3.43Å; F61-G63 VanDerWaalsContact C-N 3.32Å; F61-G63 PolarHBondContact O-N 3Å; G63-G66 WeakPolarHBondContact O-CA 3.46Å; G63-G66 PolarHBondContact O-N 3.48Å; G63-G66 VanDerWaalsContact O-N 3.13Å; G63-V67 PolarHBondContact O-N 3.09Å
64I92.4Very high87.7Confident72 Ų7234.8 Ų34.837%0.36918%0.183SC..Hα-helixtrans-60.5-46.3175.8-63.6167.5000110.9F27 L60 F61 G66 V67 I68F27-I64 HydrophobicContact CD2-CD1 4.18Å; F27-I64 HydrophobicContact CD2-CG1 3.81Å; F27-I64 HydrophobicContact CE2-CD1 4.05Å; F27-I64 HydrophobicContact CE2-CG1 4.12Å; L60-I64 WeakPolarHBondContact O-CG1 3.22Å; L60-I64 PolarHBondContact O-N 3.38Å; L60-I64 VanDerWaalsContact O-N 3.13Å; F61-I64 PolarHBondContact O-N 3.28Å; I64-G66 VanDerWaalsContact C-N 3.28Å; I64-G66 PolarHBondContact O-N 3.34Å; I64-V67 PolarHBondContact O-N 3.45Å; I64-I68 HydrophobicContact CG2-CD1 3.98Å; I64-I68 WeakPolarHBondContact O-CG1 3.35Å; I64-I68 PolarHBondContact O-N 3.26Å
65L91.8Very high88.5Confident40 Ų4033.8 Ų33.821%0.20918%0.178CC..Hα-helixtrans-59.8-38.2174.9-73.4171.8000111.8F61 I68 V69 I92 V95 M99F61-L65 WeakPolarHBondContact O-CB 3.36Å; F61-L65 WeakPolarHBondContact O-CG 3.32Å; F61-L65 PolarHBondContact O-N 3.39Å; L65-I68 PolarHBondContact O-N 3.01Å; L65-V69 VanDerWaalsContact O-CG2 3.32Å; L65-V69 WeakPolarHBondContact O-CG2 3.31Å; L65-V69 PolarHBondContact O-N 2.87Å; L65-I92 HydrophobicContact CD2-CG2 4.26Å; L65-V95 HydrophobicContact CD1-CG1 4.27Å; L65-M99 HydrophobicContact CD1-SD 3.7Å
66G89.9Confident89Confident0 Ų033.1 Ų33.10%017%0.172CC..Hα-helixtrans-58.1-48.817300000112.7V19 S62 G63 I64 I68 V69 G70V19-G66 VanDerWaalsContact CG1-O 3.31Å; V19-G66 WeakPolarHBondContact CG1-O 3.12Å; S62-G66 PolarHBondContact O-N 3.43Å; G63-G66 WeakPolarHBondContact O-CA 3.46Å; G63-G66 PolarHBondContact O-N 3.48Å; G63-G66 VanDerWaalsContact O-N 3.13Å; I64-G66 VanDerWaalsContact C-N 3.28Å; I64-G66 PolarHBondContact O-N 3.34Å; G66-I68 VanDerWaalsContact C-N 3.34Å; G66-I68 PolarHBondContact O-N 3.42Å; G66-V69 PolarHBondContact O-N 2.86Å; G66-G70 PolarHBondContact O-N 3.02Å
67V93.1Very high89.1Confident23 Ų2333.8 Ų33.814%0.13918%0.177CC..Hα-helixtrans-59.5-43.7175.8177.70000111.3G63 I64 G70 I71G63-V67 PolarHBondContact O-N 3.09Å; I64-V67 PolarHBondContact O-N 3.45Å; V67-G70 PolarHBondContact O-N 2.99Å; V67-I71 HydrophobicContact CG1-CD1 3.9Å; V67-I71 HydrophobicContact CG1-CG1 4.48Å; V67-I71 WeakPolarHBondContact O-CG1 3.3Å; V67-I71 PolarHBondContact O-N 2.7Å
68I92.9Very high89.1Confident70 Ų7040.2 Ų40.236%0.35920%0.201SC..Hα-helixtrans-61.6-45.9177-65.8166.3000111.3I64 L65 G66 G70 I71 L72 I92I64-I68 HydrophobicContact CG2-CD1 3.98Å; I64-I68 WeakPolarHBondContact O-CG1 3.35Å; I64-I68 PolarHBondContact O-N 3.26Å; L65-I68 PolarHBondContact O-N 3.01Å; G66-I68 VanDerWaalsContact C-N 3.34Å; G66-I68 PolarHBondContact O-N 3.42Å; I68-G70 VanDerWaalsContact C-N 3.32Å; I68-G70 PolarHBondContact O-N 2.88Å; I68-I71 PolarHBondContact O-N 2.98Å; I68-L72 HydrophobicContact CG2-CD1 3.94Å; I68-L72 HydrophobicContact CG2-CG 4.45Å; I68-L72 VanDerWaalsContact O-CG 3.3Å; I68-L72 WeakPolarHBondContact O-CG 3.45Å; I68-L72 PolarHBondContact O-N 3.27Å; I68-I92 HydrophobicContact CG2-CD1 4.48Å; I68-I92 HydrophobicContact CG2-CG2 4.35Å
69V91.1Very high89.1Confident0 Ų042.1 Ų42.10%021%0.209CC..Hα-helixtrans-58.5-44.1175.51690000111L65 G66 L72 A73 I92 S93L65-V69 VanDerWaalsContact O-CG2 3.32Å; L65-V69 WeakPolarHBondContact O-CG2 3.31Å; L65-V69 PolarHBondContact O-N 2.87Å; G66-V69 PolarHBondContact O-N 2.86Å; V69-L72 PolarHBondContact O-N 3.36Å; V69-A73 WeakPolarHBondContact O-CB 3.5Å; V69-A73 PolarHBondContact O-N 2.92Å; V69-I92 HydrophobicContact CG2-CB 4.41Å; V69-I92 HydrophobicContact CG2-CG2 3.7Å; V69-S93 WeakPolarHBondContact CG1-OG 3.39Å
70G90.8Very high88.5Confident1 Ų147.1 Ų47.11%0.0123%0.231CC..Hα-helixtrans-64.3-41.8178.300000113.5G66 V67 I68 A73 I74G66-G70 PolarHBondContact O-N 3.02Å; V67-G70 PolarHBondContact O-N 2.99Å; I68-G70 VanDerWaalsContact C-N 3.32Å; I68-G70 PolarHBondContact O-N 2.88Å; G70-A73 WeakPolarHBondContact O-CB 3.46Å; G70-A73 PolarHBondContact O-N 3.33Å; G70-I74 WeakPolarHBondContact O-CG1 3.26Å; G70-I74 PolarHBondContact O-N 3.37Å; G70-I74 VanDerWaalsContact O-N 3.11Å
71I92.3Very high87.8Confident80 Ų8055.3 Ų55.341%0.4127%0.265SS..Hα-helixtrans-62.2-47.5174.1-67.9166.1000110.4I20 V67 I68 A73 I74 I75I20-I71 HydrophobicContact CD1-CG1 3.92Å; I20-I71 HydrophobicContact CG1-CG1 4.39Å; V67-I71 HydrophobicContact CG1-CD1 3.9Å; V67-I71 HydrophobicContact CG1-CG1 4.48Å; V67-I71 WeakPolarHBondContact O-CG1 3.3Å; V67-I71 PolarHBondContact O-N 2.7Å; I68-I71 PolarHBondContact O-N 2.98Å; I71-A73 VanDerWaalsContact C-N 3.26Å; I71-A73 PolarHBondContact O-N 3.33Å; I71-I74 PolarHBondContact O-N 2.85Å; I71-I75 HydrophobicContact CG2-CD1 3.9Å; I71-I75 WeakPolarHBondContact O-CG1 3.4Å; I71-I75 PolarHBondContact O-N 3.42Å
72L90.8Very high87.5Confident26 Ų2650.8 Ų50.814%0.13625%0.248CC..Hα-helixtrans-61.1-35.2177.3-68.6170.5000111.8I68 V69 I75 L76 L85 L89 I92I68-L72 HydrophobicContact CG2-CD1 3.94Å; I68-L72 HydrophobicContact CG2-CG 4.45Å; I68-L72 VanDerWaalsContact O-CG 3.3Å; I68-L72 WeakPolarHBondContact O-CG 3.45Å; I68-L72 PolarHBondContact O-N 3.27Å; V69-L72 PolarHBondContact O-N 3.36Å; L72-I75 PolarHBondContact O-N 2.86Å; L72-L76 VanDerWaalsContact O-CB 3.31Å; L72-L76 WeakPolarHBondContact O-CB 3.35Å; L72-L76 PolarHBondContact O-N 2.67Å; L72-L85 HydrophobicContact CD2-CD1 3.79Å; L72-L89 VanDerWaalsContact C-CD1 3.46Å; L72-L89 HydrophobicContact CB-CB 4.49Å; L72-L89 HydrophobicContact CB-CD1 3.85Å; L72-L89 HydrophobicContact CB-CG 4.2Å; L72-I92 HydrophobicContact CD1-CD1 3.56Å
73A88.4Confident87.3Confident2 Ų259.1 Ų59.12%0.01728%0.284CS..Hα-helixtrans-65.1-40.7175.800000112.2L12 V69 G70 I71 L76 S77 L89L12-A73 WeakPolarHBondContact CD2-O 3.43Å; V69-A73 WeakPolarHBondContact O-CB 3.5Å; V69-A73 PolarHBondContact O-N 2.92Å; G70-A73 WeakPolarHBondContact O-CB 3.46Å; G70-A73 PolarHBondContact O-N 3.33Å; I71-A73 VanDerWaalsContact C-N 3.26Å; I71-A73 PolarHBondContact O-N 3.33Å; A73-L76 PolarHBondContact O-N 3.27Å; A73-S77 PolarHBondContact O-N 2.92Å; A73-L89 VanDerWaalsContact CA-CD1 3.5Å; A73-L89 HydrophobicContact CB-CD1 4.01Å
74I89.9Confident87.2Confident47 Ų4770 Ų7024%0.24133%0.326CS..Hα-helixtrans-64.8-43174.5-65.6173000110.8I20 G70 I71 L76 S77 K78I20-I74 HydrophobicContact CD1-CD1 3.57Å; G70-I74 WeakPolarHBondContact O-CG1 3.26Å; G70-I74 PolarHBondContact O-N 3.37Å; G70-I74 VanDerWaalsContact O-N 3.11Å; I71-I74 PolarHBondContact O-N 2.85Å; I74-L76 VanDerWaalsContact C-N 3.32Å; I74-L76 PolarHBondContact O-N 2.88Å; I74-S77 WeakPolarHBondContact O-CB 3.38Å; I74-S77 PolarHBondContact O-N 3.34Å; I74-K78 PolarHBondContact O-N 3.02Å
75I90.4Very high87Confident79 Ų7967.9 Ų67.941%0.40532%0.315SS..Hα-helixtrans-64.2-39176.4-60.3168.1000110.4I71 L72 K78 N79 L85I71-I75 HydrophobicContact CG2-CD1 3.9Å; I71-I75 WeakPolarHBondContact O-CG1 3.4Å; I71-I75 PolarHBondContact O-N 3.42Å; L72-I75 PolarHBondContact O-N 2.86Å; I75-K78 PolarHBondContact O-N 2.9Å; I75-N79 WeakPolarHBondContact O-CB 3.17Å; I75-N79 PolarHBondContact O-N 3.39Å; I75-L85 HydrophobicContact CB-CD2 4.22Å; I75-L85 HydrophobicContact CG2-CD1 4.45Å; I75-L85 HydrophobicContact CG2-CD2 3.68Å
76L86.9Confident86.8Confident8 Ų866.5 Ų66.54%0.04231%0.308CS..Hα-helixtrans-68.5-35.3178-175.363.5000112.5L12 L72 A73 I74 K78 N79 K80 L85 T86 L89L12-L76 HydrophobicContact CD2-CB 4.27Å; L12-L76 HydrophobicContact CD2-CD2 4.39Å; L12-L76 HydrophobicContact CD2-CG 4.27Å; L72-L76 VanDerWaalsContact O-CB 3.31Å; L72-L76 WeakPolarHBondContact O-CB 3.35Å; L72-L76 PolarHBondContact O-N 2.67Å; A73-L76 PolarHBondContact O-N 3.27Å; I74-L76 VanDerWaalsContact C-N 3.32Å; I74-L76 PolarHBondContact O-N 2.88Å; L76-K78 VanDerWaalsContact C-N 3.28Å; L76-K78 PolarHBondContact O-N 3.26Å; L76-N79 CarbonylContact O-C 3.39Å; L76-N79 PolarHBondContact O-N 3.27Å; L76-K80 PolarHBondContact O-N 3.01Å; L76-L85 HydrophobicContact CB-CD2 3.89Å; L76-L85 HydrophobicContact CB-CG 4.35Å; L76-L85 HydrophobicContact CD1-CB 4.41Å; L76-L85 HydrophobicContact CD1-CD2 3.97Å; L76-L85 HydrophobicContact CD1-CG 4.19Å; L76-T86 HydrophobicContact CD2-CG2 4.45Å; L76-L89 HydrophobicContact CB-CD1 4.31Å; L76-L89 HydrophobicContact CD2-CD1 3.96Å
77S84.9Confident86.7Confident14 Ų1473.3 Ų73.310%0.09833%0.334CS..Hα-helixtrans-57.9-42171.8176.50000111.4P9 A73 I74 K80P9-S77 PolarHBondContact O-OG 3.46Å; A73-S77 PolarHBondContact O-N 2.92Å; I74-S77 WeakPolarHBondContact O-CB 3.38Å; I74-S77 PolarHBondContact O-N 3.34Å; S77-K80 WeakPolarHBondContact O-CG 3.41Å
78K85.1Confident86.6Confident188 Ų18874.5 Ų74.582%0.81734%0.343SS*.Hα-helixtrans-75-33.5175.2-75.8-173165.2-177.40113.8I74 I75 L76I74-K78 PolarHBondContact O-N 3.02Å; I75-K78 PolarHBondContact O-N 2.9Å; L76-K78 VanDerWaalsContact C-N 3.28Å; L76-K78 PolarHBondContact O-N 3.26Å
79N82.6Confident86.5Confident85 Ų8571.3 Ų71.346%0.45533%0.327SS..  trans-117.754.2-173.3-163.6-4.3000113.3I75 L76 K81 S82I75-N79 WeakPolarHBondContact O-CB 3.17Å; I75-N79 PolarHBondContact O-N 3.39Å; L76-N79 CarbonylContact O-C 3.39Å; L76-N79 PolarHBondContact O-N 3.27Å; N79-K81 PolarHBondContact O-N 2.89Å; N79-S82 PolarHBondContact O-N 2.96Å; N79-S82 VanDerWaalsContact O-N 3.1Å; N79-S82 PolarHBondContact O-OG 3.41Å
80K71.8Confident86.4Confident106 Ų10673.2 Ų73.246%0.46134%0.335SS..THydrogen-bonded Turntrans-54.8-15.7-173.6-67-171.4124.9-170.20116.6E7 P9 L76 S77E7-K80 PolarHBondContact O-NZ 3.48Å; P9-K80 HydrophobicContact CB-CD 4.26Å; L76-K80 PolarHBondContact O-N 3.01Å; S77-K80 WeakPolarHBondContact O-CG 3.41Å
81K72.1Confident86.4Confident200 Ų20075.7 Ų75.787%0.8735%0.353SS*.THydrogen-bonded Turntrans-92.9-5.3-178.8-65.3-174.9179.2178.40114N79 K83N79-K81 PolarHBondContact O-N 2.89Å; K81-K83 PolarHBondContact O-N 3.29Å
82S83.3Confident86.4Confident24 Ų2474 Ų7417%0.16834%0.344CS..  trans-87.389.6-169.158.90000114.2N79 R84 L85 T86N79-S82 PolarHBondContact O-N 2.96Å; N79-S82 VanDerWaalsContact O-N 3.1Å; N79-S82 PolarHBondContact O-OG 3.41Å; S82-R84 PolarHBondContact O-N 3.46Å; S82-R84 VanDerWaalsContact O-N 3.12Å; S82-L85 WeakPolarHBondContact O-CB 3.33Å; S82-L85 PolarHBondContact O-N 3.21Å; S82-L85 VanDerWaalsContact OG-CB 3.27Å; S82-L85 WeakPolarHBondContact OG-CB 3.34Å; S82-T86 PolarHBondContact O-N 3.17Å; S82-T86 PolarHBondContact O-OG1 2.72Å
83K83.8Confident86.4Confident176 Ų17672.8 Ų72.877%0.76534%0.337SS*.Hα-helixtrans-51.2-37.5178.4-66.8-176.1178.7179.90114.5K81 T86 W87K81-K83 PolarHBondContact O-N 3.29Å; K83-T86 PolarHBondContact O-N 3.32Å; K83-W87 PolarHBondContact O-N 2.93Å; K83-W87 VanDerWaalsContact O-N 3.1Å
84R87.3Confident86.5Confident230 Ų23076.3 Ų76.387%0.86836%0.356SS*.Hα-helixtrans-63.6-41.2178-67.8-174.3-177.3176.61.2112.1S82 W87 S88S82-R84 PolarHBondContact O-N 3.46Å; S82-R84 VanDerWaalsContact O-N 3.12Å; R84-W87 PolarHBondContact O-N 3.11Å; R84-S88 PolarHBondContact O-N 3.5Å
85L86.9Confident86.6Confident27 Ų2777.9 Ų77.914%0.14137%0.367CS..Hα-helixtrans-69.5-40.1179.3-174.565.4000111L72 I75 L76 S82 W87 S88 L89L72-L85 HydrophobicContact CD2-CD1 3.79Å; I75-L85 HydrophobicContact CB-CD2 4.22Å; I75-L85 HydrophobicContact CG2-CD1 4.45Å; I75-L85 HydrophobicContact CG2-CD2 3.68Å; L76-L85 HydrophobicContact CB-CD2 3.89Å; L76-L85 HydrophobicContact CB-CG 4.35Å; L76-L85 HydrophobicContact CD1-CB 4.41Å; L76-L85 HydrophobicContact CD1-CD2 3.97Å; L76-L85 HydrophobicContact CD1-CG 4.19Å; S82-L85 WeakPolarHBondContact O-CB 3.33Å; S82-L85 PolarHBondContact O-N 3.21Å; S82-L85 VanDerWaalsContact OG-CB 3.27Å; S82-L85 WeakPolarHBondContact OG-CB 3.34Å; L85-W87 VanDerWaalsContact C-N 3.33Å; L85-W87 PolarHBondContact O-N 3.09Å; L85-S88 PolarHBondContact O-N 2.89Å; L85-L89 WeakPolarHBondContact O-CB 3.31Å; L85-L89 PolarHBondContact O-N 3Å
86T87.6Confident86.6Confident11 Ų1174.1 Ų74.17%0.06735%0.348CS..Hα-helixtrans-62.3-40.3175.6-38.40000111.9L76 S82 K83 F90 C177 F180 L181L76-T86 HydrophobicContact CD2-CG2 4.45Å; S82-T86 PolarHBondContact O-N 3.17Å; S82-T86 PolarHBondContact O-OG1 2.72Å; K83-T86 PolarHBondContact O-N 3.32Å; T86-F90 VanDerWaalsContact O-CB 3.29Å; T86-F90 WeakPolarHBondContact O-CB 3.48Å; T86-F90 PolarHBondContact O-N 3.01Å; T86-C177 HydrophobicContact CG2-CB 4.16Å; T86-F180 HydrophobicContact CG2-CB 3.92Å; T86-F180 HydrophobicContact CG2-CD2 4.39Å; T86-L181 HydrophobicContact CG2-CD1 3.41Å; T86-L181 VanDerWaalsContact CG2-CD1 3.41Å
87W89.5Confident86.8Confident143 Ų14374.8 Ų74.854%0.54235%0.353SS..Hα-helixtrans-64.8-44.4173-106.1101.5000112.8K83 R84 L85 F90 S91 L181K83-W87 PolarHBondContact O-N 2.93Å; K83-W87 VanDerWaalsContact O-N 3.1Å; R84-W87 PolarHBondContact O-N 3.11Å; L85-W87 VanDerWaalsContact C-N 3.33Å; L85-W87 PolarHBondContact O-N 3.09Å; W87-F90 PolarHBondContact O-N 3.31Å; W87-S91 PolarHBondContact O-N 2.92Å; W87-S91 PolarHBondContact O-OG 3.43Å; W87-L181 HydrophobicContact CD2-CD2 3.95Å; W87-L181 HydrophobicContact CG-CD2 4.07Å; W87-L181 HydrophobicContact CZ2-CD2 4.17Å
88S91.1Very high87Confident48 Ų4879.9 Ų79.934%0.33638%0.379SS..Hα-helixtrans-60-48.2176.1-1800000111.7R84 L85 F90 S91 I92R84-S88 PolarHBondContact O-N 3.5Å; L85-S88 PolarHBondContact O-N 2.89Å; S88-F90 VanDerWaalsContact C-N 3.35Å; S88-F90 PolarHBondContact O-N 3.47Å; S88-S91 PolarHBondContact O-N 2.68Å; S88-I92 WeakPolarHBondContact O-CG1 3.38Å; S88-I92 PolarHBondContact O-N 3.35Å
89L90Very high87.2Confident3 Ų373.2 Ų73.22%0.01635%0.351CS..Hα-helixtrans-62.3-42.1177.9-163.5152.8000111.5L72 A73 L76 L85 S93 C173 C177L72-L89 VanDerWaalsContact C-CD1 3.46Å; L72-L89 HydrophobicContact CB-CB 4.49Å; L72-L89 HydrophobicContact CB-CD1 3.85Å; L72-L89 HydrophobicContact CB-CG 4.2Å; A73-L89 VanDerWaalsContact CA-CD1 3.5Å; A73-L89 HydrophobicContact CB-CD1 4.01Å; L76-L89 HydrophobicContact CB-CD1 4.31Å; L76-L89 HydrophobicContact CD2-CD1 3.96Å; L85-L89 WeakPolarHBondContact O-CB 3.31Å; L85-L89 PolarHBondContact O-N 3Å; L89-S93 WeakPolarHBondContact CD2-OG 3.33Å; L89-S93 WeakPolarHBondContact O-CB 3.49Å; L89-S93 PolarHBondContact O-N 2.85Å; L89-S93 PolarHBondContact O-OG 3.21Å; L89-C173 HydrophobicContact CD2-CB 4.03Å; L89-C177 VanDerWaalsContact CD2-SG 3.51Å
90F89.7Confident87.4Confident39 Ų3969.2 Ų69.217%0.17133%0.33CS..Hα-helixtrans-57-53.9174.9-179.6-105.2000111.7T86 W87 S88 I92 S93 L94 L174 C177 A178 L183T86-F90 VanDerWaalsContact O-CB 3.29Å; T86-F90 WeakPolarHBondContact O-CB 3.48Å; T86-F90 PolarHBondContact O-N 3.01Å; W87-F90 PolarHBondContact O-N 3.31Å; S88-F90 VanDerWaalsContact C-N 3.35Å; S88-F90 PolarHBondContact O-N 3.47Å; F90-I92 PolarHBondContact O-N 3.26Å; F90-S93 PolarHBondContact O-N 3.03Å; F90-L94 PolarHBondContact O-N 2.92Å; F90-L174 HydrophobicContact CD2-CD2 3.7Å; F90-L174 HydrophobicContact CE2-CD2 3.79Å; F90-L174 HydrophobicContact CG-CD2 4.42Å; F90-L174 VanDerWaalsContact O-CD2 3.3Å; F90-L174 WeakPolarHBondContact O-CD2 3.29Å; F90-C177 HydrophobicContact CB-CB 3.92Å; F90-C177 HydrophobicContact CD2-CB 3.95Å; F90-C177 HydrophobicContact CG-CB 4.41Å; F90-A178 HydrophobicContact CE2-CB 4.15Å; F90-L183 HydrophobicContact CE1-CD1 4.38Å; F90-L183 HydrophobicContact CE2-CD1 4.49Å; F90-L183 HydrophobicContact CZ-CD1 4.12Å
91S90.8Very high88.2Confident54 Ų5464.7 Ų64.738%0.37831%0.313SS..Hα-helixtrans-61.6-45.2-178.7-62.40000112.7W87 S88 L94 V95W87-S91 PolarHBondContact O-N 2.92Å; W87-S91 PolarHBondContact O-OG 3.43Å; S88-S91 PolarHBondContact O-N 2.68Å; S91-L94 WeakPolarHBondContact O-CB 3.23Å; S91-L94 PolarHBondContact O-N 3.33Å; S91-V95 PolarHBondContact O-N 3.31Å
92I90.9Very high88.9Confident45 Ų4557.2 Ų57.223%0.23129%0.293CS..Hα-helixtrans-70.9-37-178.7-61.6167.6000110.7L65 I68 V69 L72 S88 F90 L94 V95 S96L65-I92 HydrophobicContact CD2-CG2 4.26Å; I68-I92 HydrophobicContact CG2-CD1 4.48Å; I68-I92 HydrophobicContact CG2-CG2 4.35Å; V69-I92 HydrophobicContact CG2-CB 4.41Å; V69-I92 HydrophobicContact CG2-CG2 3.7Å; L72-I92 HydrophobicContact CD1-CD1 3.56Å; S88-I92 WeakPolarHBondContact O-CG1 3.38Å; S88-I92 PolarHBondContact O-N 3.35Å; F90-I92 PolarHBondContact O-N 3.26Å; I92-L94 VanDerWaalsContact C-N 3.28Å; I92-L94 PolarHBondContact O-N 3Å; I92-V95 PolarHBondContact O-N 2.88Å; I92-S96 VanDerWaalsContact O-CB 3.28Å; I92-S96 WeakPolarHBondContact O-CB 3.33Å; I92-S96 PolarHBondContact O-N 3Å
93S91.3Very high89Confident0 Ų056.2 Ų56.20%029%0.286CS..Hα-helixtrans-65.8-31.3174.6-55.70000112.1V69 L89 F90 S97V69-S93 WeakPolarHBondContact CG1-OG 3.39Å; L89-S93 WeakPolarHBondContact CD2-OG 3.33Å; L89-S93 WeakPolarHBondContact O-CB 3.49Å; L89-S93 PolarHBondContact O-N 2.85Å; L89-S93 PolarHBondContact O-OG 3.21Å; F90-S93 PolarHBondContact O-N 3.03Å; S93-S97 VanDerWaalsContact O-CB 3.29Å; S93-S97 WeakPolarHBondContact O-CB 3.38Å; S93-S97 PolarHBondContact O-N 3.28Å
94L91Very high89.2Confident76 Ų7648.8 Ų48.840%0.39826%0.255SS..Hα-helixtrans-66.6-51.2177-176.560.8000110.6F90 S91 I92 S96 S97 L98 L174F90-L94 PolarHBondContact O-N 2.92Å; S91-L94 WeakPolarHBondContact O-CB 3.23Å; S91-L94 PolarHBondContact O-N 3.33Å; I92-L94 VanDerWaalsContact C-N 3.28Å; I92-L94 PolarHBondContact O-N 3Å; L94-S96 VanDerWaalsContact C-N 3.35Å; L94-S96 PolarHBondContact O-N 3.35Å; L94-S97 PolarHBondContact O-N 2.89Å; L94-L98 HydrophobicContact CD1-CD1 4.4Å; L94-L98 HydrophobicContact CG-CD1 4.28Å; L94-L98 WeakPolarHBondContact O-CG 3.44Å; L94-L98 PolarHBondContact O-N 3.43Å; L94-L174 HydrophobicContact CB-CD2 3.91Å; L94-L174 HydrophobicContact CD1-CD1 4.34Å
95V92.7Very high89.2Confident79 Ų7943.2 Ų43.248%0.47924%0.242SC..Hα-helixtrans-59.4-46.7175.4177.70000110.5L65 S91 I92 S97 L98 M99L65-V95 HydrophobicContact CD1-CG1 4.27Å; S91-V95 PolarHBondContact O-N 3.31Å; I92-V95 PolarHBondContact O-N 2.88Å; V95-S97 PolarHBondContact O-N 3.47Å; V95-L98 PolarHBondContact O-N 3.11Å; V95-M99 WeakPolarHBondContact O-CB 3.48Å; V95-M99 PolarHBondContact O-N 3.43Å
96S90.1Very high89.1Confident0 Ų043.3 Ų43.30%025%0.249CC..Hα-helixtrans-57.3-45.2175.9172.60000112.5I92 L94 M99 A100 S170I92-S96 VanDerWaalsContact O-CB 3.28Å; I92-S96 WeakPolarHBondContact O-CB 3.33Å; I92-S96 PolarHBondContact O-N 3Å; L94-S96 VanDerWaalsContact C-N 3.35Å; L94-S96 PolarHBondContact O-N 3.35Å; S96-M99 PolarHBondContact O-N 2.99Å; S96-A100 VanDerWaalsContact O-CB 3.23Å; S96-A100 WeakPolarHBondContact O-CB 3.34Å; S96-A100 PolarHBondContact O-N 3.03Å; S96-S170 PolarHBondContact OG-OG 3.41Å
97S89.5Confident88.8Confident23 Ų2342.9 Ų42.916%0.16125%0.247CC..Hα-helixtrans-68.1-40.3-178.9-167.80000112.6S93 L94 V95 G101S93-S97 VanDerWaalsContact O-CB 3.29Å; S93-S97 WeakPolarHBondContact O-CB 3.38Å; S93-S97 PolarHBondContact O-N 3.28Å; L94-S97 PolarHBondContact O-N 2.89Å; V95-S97 PolarHBondContact O-N 3.47Å; S97-G101 PolarHBondContact O-N 3Å
98L90.8Very high88.6Confident120 Ų12041.7 Ų41.763%0.62825%0.245SC*.Hα-helixtrans-65.6-42.8176.2-69.7171.2000111.1L94 V95 G101 G102L94-L98 HydrophobicContact CD1-CD1 4.4Å; L94-L98 HydrophobicContact CG-CD1 4.28Å; L94-L98 WeakPolarHBondContact O-CG 3.44Å; L94-L98 PolarHBondContact O-N 3.43Å; V95-L98 PolarHBondContact O-N 3.11Å; L98-G101 PolarHBondContact O-N 3.41Å; L98-G102 PolarHBondContact O-N 3.45Å
99M88.7Confident88.3Confident49 Ų4942.9 Ų42.924%0.24125%0.251CS..Hα-helixtrans-70.7-41.3-178.5-164.6162.9177.700112.3V58 F61 L65 V95 S96 S103V58-M99 HydrophobicContact CB-CE 4.39Å; V58-M99 HydrophobicContact CG1-CE 3.96Å; V58-M99 HydrophobicContact CG1-CG 3.84Å; V58-M99 WeakPolarHBondContact O-CE 3.32Å; F61-M99 HydrophobicContact CB-CE 3.44Å; F61-M99 VanDerWaalsContact CB-CE 3.44Å; F61-M99 HydrophobicContact CG-CE 4.45Å; L65-M99 HydrophobicContact CD1-SD 3.7Å; V95-M99 WeakPolarHBondContact O-CB 3.48Å; V95-M99 PolarHBondContact O-N 3.43Å; S96-M99 PolarHBondContact O-N 2.99Å; M99-S103 WeakPolarHBondContact O-CB 3.46Å; M99-S103 PolarHBondContact O-N 3.01Å
100A86.9Confident87.8Confident0 Ų043.3 Ų43.30%025%0.254CS..Hα-helixtrans-65.5-42.517300000111.9S96 S103 T104 M167S96-A100 VanDerWaalsContact O-CB 3.23Å; S96-A100 WeakPolarHBondContact O-CB 3.34Å; S96-A100 PolarHBondContact O-N 3.03Å; A100-S103 PolarHBondContact O-N 3.38Å; A100-T104 WeakPolarHBondContact O-CB 3.3Å; A100-T104 PolarHBondContact O-N 3.44Å; A100-T104 PolarHBondContact O-OG1 3.48Å; A100-M167 HydrophobicContact CB-CB 4.2Å
101G87.9Confident87.4Confident11 Ų1142.2 Ų42.211%0.11325%0.249CC..Hα-helixtrans-62.5-49.6175.700000112.2S97 L98 S103 T104 I105S97-G101 PolarHBondContact O-N 3Å; L98-G101 PolarHBondContact O-N 3.41Å; G101-S103 PolarHBondContact O-N 2.95Å; G101-T104 PolarHBondContact O-N 3.23Å; G101-I105 WeakPolarHBondContact O-CG1 3.4Å; G101-I105 PolarHBondContact O-N 2.93Å
102G87.3Confident87Confident44 Ų4442.2 Ų42.245%0.45425%0.247SC..Hα-helixtrans-59.1-43.317600000112.9L98 I105 G106L98-G102 PolarHBondContact O-N 3.45Å; G102-I105 PolarHBondContact O-N 2.88Å; G102-G106 PolarHBondContact O-N 2.88Å
103S85.8Confident86.3Confident3 Ų345.3 Ų45.32%0.02126%0.259CS..Hα-helixtrans-65.2-42.5175.3-164.50000112.3T59 M99 A100 G101 I105 G106 L107T59-S103 PolarHBondContact OG1-OG 3.23Å; M99-S103 WeakPolarHBondContact O-CB 3.46Å; M99-S103 PolarHBondContact O-N 3.01Å; A100-S103 PolarHBondContact O-N 3.38Å; G101-S103 PolarHBondContact O-N 2.95Å; S103-I105 VanDerWaalsContact C-N 3.32Å; S103-I105 PolarHBondContact O-N 3.49Å; S103-G106 PolarHBondContact O-N 3.46Å; S103-L107 WeakPolarHBondContact O-CB 3.31Å; S103-L107 VanDerWaalsContact O-CG 3.31Å; S103-L107 WeakPolarHBondContact O-CG 3.31Å; S103-L107 PolarHBondContact O-N 3.16Å
104T87.4Confident85.3Confident19 Ų1946.6 Ų46.612%0.11727%0.267CS..Hα-helixtrans-58.7-44.7177.4-54.80000111.1A100 G101 F108 I160 C163A100-T104 WeakPolarHBondContact O-CB 3.3Å; A100-T104 PolarHBondContact O-N 3.44Å; A100-T104 PolarHBondContact O-OG1 3.48Å; G101-T104 PolarHBondContact O-N 3.23Å; T104-F108 WeakPolarHBondContact O-CB 3.49Å; T104-F108 PolarHBondContact O-N 2.9Å; T104-I160 HydrophobicContact CG2-CG2 4.21Å; T104-C163 WeakPolarHBondContact OG1-CB 3.49Å
105I88.1Confident84.5Confident114 Ų11447.3 Ų47.359%0.58527%0.27SS*.Hα-helixtrans-65-46.8176.9-64.3161.3000110.8G101 G102 S103 F108 V109G101-I105 WeakPolarHBondContact O-CG1 3.4Å; G101-I105 PolarHBondContact O-N 2.93Å; G102-I105 PolarHBondContact O-N 2.88Å; S103-I105 VanDerWaalsContact C-N 3.32Å; S103-I105 PolarHBondContact O-N 3.49Å; I105-F108 PolarHBondContact O-N 3.02Å; I105-V109 HydrophobicContact CG2-CG2 4.49Å; I105-V109 WeakPolarHBondContact O-CG2 3.45Å; I105-V109 PolarHBondContact O-N 3.43Å
106G83.7Confident83.6Confident29 Ų2948.9 Ų48.930%0.29928%0.275SS..Hα-helixtrans-60-50178.500000112.7G102 S103 F108 V109 S110G102-G106 PolarHBondContact O-N 2.88Å; S103-G106 PolarHBondContact O-N 3.46Å; G106-F108 VanDerWaalsContact C-N 3.34Å; G106-F108 PolarHBondContact O-N 2.95Å; G106-V109 PolarHBondContact O-N 3.38Å; G106-S110 WeakPolarHBondContact O-CB 3.28Å; G106-S110 PolarHBondContact O-N 3.27Å
107L81.9Confident82.5Confident2 Ų253 Ų531%0.0130%0.297CS..Hα-helixtrans-63.3-36.8176.4-70.3171.3000112.1S103 S110 L111 L159 I160S103-L107 WeakPolarHBondContact O-CB 3.31Å; S103-L107 VanDerWaalsContact O-CG 3.31Å; S103-L107 WeakPolarHBondContact O-CG 3.31Å; S103-L107 PolarHBondContact O-N 3.16Å; L107-S110 WeakPolarHBondContact O-CB 3.35Å; L107-L111 VanDerWaalsContact O-CB 3.25Å; L107-L111 WeakPolarHBondContact O-CB 3.35Å; L107-L111 PolarHBondContact O-N 3.18Å; L107-L159 HydrophobicContact CD1-CB 4.42Å; L107-L159 HydrophobicContact CD1-CD2 3.72Å; L107-L159 HydrophobicContact CD1-CG 3.89Å; L107-L159 HydrophobicContact CD2-CD2 4.38Å; L107-I160 HydrophobicContact CB-CD1 4.11Å; L107-I160 HydrophobicContact CB-CG1 3.72Å; L107-I160 HydrophobicContact CD1-CG1 4.48Å
108F85.6Confident81.1Confident118 Ų11852.6 Ų52.652%0.51830%0.296SS..Hα-helixtrans-68.8-48.5177.3-177.4-98.8000112.4T104 I105 G106 S110 L111 V112T104-F108 WeakPolarHBondContact O-CB 3.49Å; T104-F108 PolarHBondContact O-N 2.9Å; I105-F108 PolarHBondContact O-N 3.02Å; G106-F108 VanDerWaalsContact C-N 3.34Å; G106-F108 PolarHBondContact O-N 2.95Å; F108-S110 VanDerWaalsContact C-N 3.26Å; F108-S110 PolarHBondContact O-N 3.26Å; F108-L111 PolarHBondContact O-N 3.11Å; F108-V112 HydrophobicContact CD1-CG2 4.29Å; F108-V112 HydrophobicContact CE1-CG2 3.89Å; F108-V112 HydrophobicContact CE2-CG2 4.24Å; F108-V112 HydrophobicContact CZ-CG2 3.87Å; F108-V112 WeakPolarHBondContact O-CG2 3.46Å; F108-V112 PolarHBondContact O-N 2.97Å
109V84.3Confident79.5Confident73 Ų7349.6 Ų49.644%0.44229%0.294SS..Hα-helixtrans-60.1-41.2174.61720000110.5I105 G106 V112 K113I105-V109 HydrophobicContact CG2-CG2 4.49Å; I105-V109 WeakPolarHBondContact O-CG2 3.45Å; I105-V109 PolarHBondContact O-N 3.43Å; G106-V109 PolarHBondContact O-N 3.38Å; V109-V112 PolarHBondContact O-N 3.42Å; V109-K113 HydrophobicContact CG1-CD 4.47Å; V109-K113 WeakPolarHBondContact O-CB 3.43Å; V109-K113 WeakPolarHBondContact O-CG 3.25Å; V109-K113 PolarHBondContact O-N 3.34Å
110S79.4Confident77.7Confident12 Ų1257.1 Ų57.18%0.08432%0.32CS..Hα-helixtrans-59.4-48.4174.6-175.20000112.1Y52 G106 L107 F108 T114 W156Y52-S110 VanDerWaalsContact CD1-OG 3.27Å; Y52-S110 WeakPolarHBondContact CD1-OG 3.5Å; Y52-S110 WeakPolarHBondContact CE1-OG 3.25Å; G106-S110 WeakPolarHBondContact O-CB 3.28Å; G106-S110 PolarHBondContact O-N 3.27Å; L107-S110 WeakPolarHBondContact O-CB 3.35Å; F108-S110 VanDerWaalsContact C-N 3.26Å; F108-S110 PolarHBondContact O-N 3.26Å; S110-T114 WeakPolarHBondContact O-CB 3.11Å; S110-T114 PolarHBondContact O-N 3.37Å; S110-T114 PolarHBondContact O-OG1 3.22Å; S110-W156 WeakPolarHBondContact OG-CH2 3.33Å; S110-W156 WeakPolarHBondContact OG-CZ3 3.45Å
111L81.8Confident75.8Confident15 Ų1561.4 Ų61.48%0.07935%0.345CS..Hα-helixtrans-62.2-45.9177178.662.2000111.6L107 F108 T114 I115 I153 W156 V157 I160L107-L111 VanDerWaalsContact O-CB 3.25Å; L107-L111 WeakPolarHBondContact O-CB 3.35Å; L107-L111 PolarHBondContact O-N 3.18Å; F108-L111 PolarHBondContact O-N 3.11Å; L111-T114 WeakPolarHBondContact O-CB 3.47Å; L111-T114 PolarHBondContact O-N 2.94Å; L111-I115 HydrophobicContact CD1-CD1 4.04Å; L111-I115 HydrophobicContact CD1-CG1 4.33Å; L111-I115 HydrophobicContact CG-CD1 3.96Å; L111-I115 WeakPolarHBondContact O-CG1 3.07Å; L111-I115 PolarHBondContact O-N 3.24Å; L111-I153 HydrophobicContact CD1-CG1 4.2Å; L111-I153 HydrophobicContact CD1-CG2 4.2Å; L111-W156 HydrophobicContact CB-CE3 4.23Å; L111-W156 HydrophobicContact CD1-CE3 4.45Å; L111-V157 HydrophobicContact CD2-CG2 3.84Å; L111-I160 HydrophobicContact CB-CD1 4.32Å; L111-I160 HydrophobicContact CD2-CD1 3.75Å
112V82.8Confident73.8Confident54 Ų5465.1 Ų65.133%0.32736%0.362SS..Hα-helixtrans-64.3-46.9179.31720000111.5F108 V109 T114 I115 I116F108-V112 HydrophobicContact CD1-CG2 4.29Å; F108-V112 HydrophobicContact CE1-CG2 3.89Å; F108-V112 HydrophobicContact CE2-CG2 4.24Å; F108-V112 HydrophobicContact CZ-CG2 3.87Å; F108-V112 WeakPolarHBondContact O-CG2 3.46Å; F108-V112 PolarHBondContact O-N 2.97Å; V109-V112 PolarHBondContact O-N 3.42Å; V112-T114 VanDerWaalsContact C-N 3.26Å; V112-T114 PolarHBondContact O-N 3.02Å; V112-I115 PolarHBondContact O-N 2.95Å; V112-I116 HydrophobicContact CG1-CD1 3.72Å; V112-I116 VanDerWaalsContact O-CG1 3.31Å; V112-I116 WeakPolarHBondContact O-CG1 3.31Å; V112-I116 PolarHBondContact O-N 2.82Å
113K74.6Confident72Confident111 Ų11170 Ų7048%0.48338%0.377SS..Hα-helixtrans-59.3-38.6172.8-76.9-169.2175-167.30111.3V109 N117 E328V109-K113 HydrophobicContact CG1-CD 4.47Å; V109-K113 WeakPolarHBondContact O-CB 3.43Å; V109-K113 WeakPolarHBondContact O-CG 3.25Å; V109-K113 PolarHBondContact O-N 3.34Å; K113-N117 VanDerWaalsContact O-CB 3.32Å; K113-N117 WeakPolarHBondContact O-CB 3.32Å; K113-N117 PolarHBondContact O-N 2.95Å; K113-N117 PolarHBondContact O-OD1 3.31Å; K113-E328 IonicContact NZ-OE1 3.82Å
114T71.6Confident70Confident26 Ų2674.4 Ų74.416%0.1640%0.404CS..Hα-helixtrans-65.9-43.4178.6-62.20000111.9S110 L111 V112 G118 Y149S110-T114 WeakPolarHBondContact O-CB 3.11Å; S110-T114 PolarHBondContact O-N 3.37Å; S110-T114 PolarHBondContact O-OG1 3.22Å; L111-T114 WeakPolarHBondContact O-CB 3.47Å; L111-T114 PolarHBondContact O-N 2.94Å; V112-T114 VanDerWaalsContact C-N 3.26Å; V112-T114 PolarHBondContact O-N 3.02Å; T114-G118 WeakPolarHBondContact O-CA 3.36Å; T114-G118 PolarHBondContact O-N 3.47Å; T114-Y149 HydrophobicContact CG2-CE2 3.62Å; T114-Y149 WeakPolarHBondContact CG2-OH 3.32Å; T114-Y149 PolarHBondContact O-OH 3.37Å
115I74.3Confident68Low92 Ų9281.5 Ų81.547%0.47244%0.435SS..Hα-helixtrans-63.8-48175.2-67.4163.8000111.4L111 V112 N117 G119L111-I115 HydrophobicContact CD1-CD1 4.04Å; L111-I115 HydrophobicContact CD1-CG1 4.33Å; L111-I115 HydrophobicContact CG-CD1 3.96Å; L111-I115 WeakPolarHBondContact O-CG1 3.07Å; L111-I115 PolarHBondContact O-N 3.24Å; V112-I115 PolarHBondContact O-N 2.95Å; I115-N117 PolarHBondContact O-N 3.45Å; I115-G119 PolarHBondContact O-N 3.15Å
116I73.4Confident66.1Low112 Ų11280.6 Ų80.657%0.57444%0.438SS*.Hα-helixtrans-63.7-42.9-177.5-67.4168.4000111.4V112V112-I116 HydrophobicContact CG1-CD1 3.72Å; V112-I116 VanDerWaalsContact O-CG1 3.31Å; V112-I116 WeakPolarHBondContact O-CG1 3.31Å; V112-I116 PolarHBondContact O-N 2.82Å
117N66.7Low64.1Low86 Ų8689.7 Ų89.746%0.4646%0.464SS..Hα-helixtrans-81.2-39.3-178.5-67.629.6000111.7K113 I115 R120 V121K113-N117 VanDerWaalsContact O-CB 3.32Å; K113-N117 WeakPolarHBondContact O-CB 3.32Å; K113-N117 PolarHBondContact O-N 2.95Å; K113-N117 PolarHBondContact O-OD1 3.31Å; I115-N117 PolarHBondContact O-N 3.45Å; N117-R120 PolarHBondContact O-N 3.2Å; N117-V121 WeakPolarHBondContact O-CG2 3.39Å; N117-V121 PolarHBondContact O-N 3.1Å
118G61.3Low62.1Low15 Ų1598.3 Ų98.316%0.15550%0.501CS..Hα-helixtrans-67.9-32.4179.700000113.6T114 R120 V121 L122T114-G118 WeakPolarHBondContact O-CA 3.36Å; T114-G118 PolarHBondContact O-N 3.47Å; G118-R120 PolarHBondContact O-N 3.42Å; G118-V121 PolarHBondContact O-N 2.89Å; G118-L122 PolarHBondContact O-N 2.93Å; G118-L122 VanDerWaalsContact O-N 3.13Å
119G56Low60Low56 Ų5697.8 Ų97.858%0.57751%0.51SS*.Hα-helixtrans-64.6-16.5176.100000114.9I115I115-G119 PolarHBondContact O-N 3.15Å
120R51.2Low57.8Low208 Ų208102 Ų10279%0.78553%0.53SS*.Hα-helixtrans-98.6-37172.6-71.7-172.7171.7-138.1-5.8113.2N117 G118 L123N117-R120 PolarHBondContact O-N 3.2Å; G118-R120 PolarHBondContact O-N 3.42Å; R120-L123 PolarHBondContact O-N 3.44Å
121V47.3Very low56.3Low89 Ų89105.9 Ų105.954%0.53956%0.563SS.*Hα-helixtrans-72-32.1-176.51730000112.4N117 G118 L123 T124N117-V121 WeakPolarHBondContact O-CG2 3.39Å; N117-V121 PolarHBondContact O-N 3.1Å; G118-V121 PolarHBondContact O-N 2.89Å; V121-L123 VanDerWaalsContact C-N 3.26Å; V121-L123 PolarHBondContact O-N 3.24Å; V121-T124 PolarHBondContact O-N 3Å; V121-T124 PolarHBondContact O-OG1 3.4Å
122L45.6Very low54.6Low89 Ų89113.6 Ų113.647%0.46660%0.602SS.*THydrogen-bonded Turntrans-65.9-27.5176.7-127.573.7000113.3G118 T146G118-L122 PolarHBondContact O-N 2.93Å; G118-L122 VanDerWaalsContact O-N 3.13Å; L122-T146 HydrophobicContact CD2-CG2 4.2Å
123L48.7Very low52.5Low146 Ų146114.5 Ų114.576%0.76462%0.622SS**THydrogen-bonded Turntrans-84.3-15.5-177.7-129.878.3000113.6R120 V121R120-L123 PolarHBondContact O-N 3.44Å; V121-L123 VanDerWaalsContact C-N 3.26Å; V121-L123 PolarHBondContact O-N 3.24Å
124T45.4Very low51.2Low96 Ų96120.2 Ų120.259%0.58964%0.642SS**SBendtrans-96.7-2.7-174.946.90000114.8V121V121-T124 PolarHBondContact O-N 3Å; V121-T124 PolarHBondContact O-OG1 3.4Å
125H45.5Very low49.7Very low168 Ų168124.7 Ų124.778%0.77868%0.675SS**SBendtrans-110.6-9.7174.3-79.7-8.2000114.5R127H125-R127 PolarHBondContact O-N 3.35Å; H125-R127 VanDerWaalsContact O-N 3.09Å
126C46.4Very low48Very low95 Ų95125.7 Ų125.764%0.64269%0.69SS**SBendtrans-81.468.8155.2-67.10000109.7F128C126-F128 VanDerWaalsContact C-N 3.32Å; C126-F128 PolarHBondContact O-N 3.42Å
127R41.5Very low46.8Very low220 Ų220127.9 Ų127.983%0.8370%0.702SS**  trans-7290.6170.5-173.4-175.4-176.1117.23.3108.4H125 P129H125-R127 PolarHBondContact O-N 3.35Å; H125-R127 VanDerWaalsContact O-N 3.09Å; R127-P129 VanDerWaalsContact O-CD 3.32Å; R127-P129 WeakPolarHBondContact O-CD 3.46Å
128F41.3Very low45.8Very low183 Ų183128.7 Ų128.780%0.80371%0.71SS**PPolyproline II helixtrans-57.4120.7154.7-79-88.5000107.1C126C126-F128 VanDerWaalsContact C-N 3.32Å; C126-F128 PolarHBondContact O-N 3.42Å
129P40.5Very low45.1Very low107 Ų107134.7 Ų134.770%0.69574%0.738SS**PPolyproline II helixtrans-70.2132.1163.82.214.1000107.4R127R127-P129 VanDerWaalsContact O-CD 3.32Å; R127-P129 WeakPolarHBondContact O-CD 3.46Å
130D38.8Very low44.6Very low161 Ų161141.1 Ų141.186%0.86175%0.753SS**PPolyproline II helixtrans-56.8154.2170.3-72.3-65.5000111.2I132D130-I132 PolarHBondContact O-N 3.3Å
131A47.7Very low44.3Very low94 Ų94136 Ų13678%0.77775%0.748SS**SBendtrans-46.6121.9-168.300000114.8
132I47.1Very low44.2Very low177 Ų177137.7 Ų137.791%0.90876%0.761SS**  trans179.8121.2132.6-86.4145.2000106.6D130D130-I132 PolarHBondContact O-N 3.3Å
133G37.8Very low44.2Very low73 Ų73142 Ų14275%0.75378%0.776SS**  trans112.899.3177.600000113.9
134Y46.4Very low44.1Very low231 Ų231139.7 Ų139.791%0.90677%0.765SS**  trans-61.2156.9163.5-97.3-116.8000110.8
135S41.8Very low44.6Very low120 Ų120139 Ų13984%0.83976%0.762SS**  trans9062.8163.8-46.80000118.9
136S37.7Very low45.1Very low114 Ų114134.1 Ų134.180%0.79774%0.744SS**  -154.584.5129.1-1670000110.9
137I48Very low45.9Very low158 Ų158138.7 Ų138.781%0.8175%0.748SS**  trans-84.6131.1164.3-100.9172000107
138T45.4Very low47.1Very low103 Ų103131.3 Ų131.363%0.63273%0.727SS**SBendtrans77.4141.4178.673.10000118.9
139N47Very low48.3Very low140 Ų140126 Ų12675%0.74970%0.702SS**  trans73.389.4163.5-47.4-58.3000118.7
140E45.8Very low49.9Very low192 Ų192123.9 Ų123.990%0.89769%0.69SS**  trans-176.690.1130-101.6157.3-172.100113.5
141C43.7Very low51.6Low99 Ų99119.3 Ų119.367%0.66967%0.668SS**  trans-140101.7151.7-89.90000106.8F143C141-F143 PolarHBondContact O-N 2.93Å
142P47Very low53Low125 Ų125116.4 Ų116.481%0.81264%0.64SS**SBendtrans-69.5-7.7-168.325.9-34.2000114.5
143F45.3Very low54.5Low179 Ų179110 Ų11079%0.78561%0.607SS**SBendtrans-137111.2165.5-70.5-83.7000108.6C141 P145C141-F143 PolarHBondContact O-N 2.93Å; F143-P145 WeakPolarHBondContact O-CD 3.37Å; F143-P145 WeakPolarHBondContact O-CG 3.35Å; F143-P145 VanDerWaalsContact O-N 3.16Å
144D46.8Very low56.7Low99 Ų99111.6 Ų111.653%0.52960%0.598SS.*  trans-70.8103.4179.8-168.43.6000110.4T146 R147D144-T146 PolarHBondContact O-N 2.9Å; D144-T146 PolarHBondContact OD1-OG1 3Å; D144-T146 PolarHBondContact OD2-OG1 3.31Å; D144-R147 PolarHBondContact O-N 3.43Å
145P54.4Low58.5Low81 Ų81101.8 Ų101.853%0.52656%0.561SS.*Hα-helixtrans-70.3-27.2-166.2-16.331.9000111.9F143 R147 V148 Y149F143-P145 WeakPolarHBondContact O-CD 3.37Å; F143-P145 WeakPolarHBondContact O-CG 3.35Å; F143-P145 VanDerWaalsContact O-N 3.16Å; P145-R147 VanDerWaalsContact C-N 3.25Å; P145-R147 PolarHBondContact O-N 3.41Å; P145-V148 PolarHBondContact O-N 3.33Å; P145-Y149 VanDerWaalsContact O-CB 3.3Å; P145-Y149 WeakPolarHBondContact O-CB 3.42Å; P145-Y149 PolarHBondContact O-N 3.22Å
146T57.1Low60.5Low66 Ų6696.7 Ų96.741%0.40552%0.523SS..Hα-helixtrans-53.2-41.4174.558.50000111.8L122 D144 S150L122-T146 HydrophobicContact CD2-CG2 4.2Å; D144-T146 PolarHBondContact O-N 2.9Å; D144-T146 PolarHBondContact OD1-OG1 3Å; D144-T146 PolarHBondContact OD2-OG1 3.31Å; T146-S150 WeakPolarHBondContact O-CB 3.4Å; T146-S150 PolarHBondContact O-N 3.46Å
147R63Low62.9Low191 Ų19194.5 Ų94.572%0.72151%0.505SS*.Hα-helixtrans-70.4-44.3-176.1-166.1178.7-176-134.20.8112D144 P145 T151D144-R147 PolarHBondContact O-N 3.43Å; P145-R147 VanDerWaalsContact C-N 3.25Å; P145-R147 PolarHBondContact O-N 3.41Å; R147-T151 WeakPolarHBondContact O-CG2 3.35Å; R147-T151 PolarHBondContact O-N 3.23Å; R147-T151 VanDerWaalsContact O-N 3.08Å; R147-T151 PolarHBondContact O-OG1 3.5Å
148V66.3Low64.7Low65 Ų6588.3 Ų88.339%0.39448%0.48SS..Hα-helixtrans-68.8-39.1178.1-179.20000111P145 T151 T152P145-V148 PolarHBondContact O-N 3.33Å; V148-T151 PolarHBondContact O-OG1 2.93Å; V148-T152 WeakPolarHBondContact O-CB 3.36Å; V148-T152 PolarHBondContact O-N 3.39Å; V148-T152 PolarHBondContact O-OG1 3.46Å
149Y67.1Low66.7Low70 Ų7083.4 Ų83.428%0.27545%0.45SS..Hα-helixtrans-67.3-44.5177.2-175.3-103.8000111.9T114 P145 T152 I153T114-Y149 HydrophobicContact CG2-CE2 3.62Å; T114-Y149 WeakPolarHBondContact CG2-OH 3.32Å; T114-Y149 PolarHBondContact O-OH 3.37Å; P145-Y149 VanDerWaalsContact O-CB 3.3Å; P145-Y149 WeakPolarHBondContact O-CB 3.42Å; P145-Y149 PolarHBondContact O-N 3.22Å; Y149-T152 PolarHBondContact O-N 2.92Å; Y149-I153 HydrophobicContact CD1-CD1 3.9Å; Y149-I153 HydrophobicContact CE1-CD1 3.36Å; Y149-I153 HydrophobicContact CE1-CG1 4.38Å; Y149-I153 HydrophobicContact CE2-CD1 4.43Å; Y149-I153 PolarHBondContact O-N 3.32Å
150S73.2Confident68.7Low63 Ų6377.9 Ų77.944%0.44142%0.42SS..Hα-helixtrans-59.2-48.9175.5-178.70000111.9T146 T152 I153 I154T146-S150 WeakPolarHBondContact O-CB 3.4Å; T146-S150 PolarHBondContact O-N 3.46Å; S150-T152 VanDerWaalsContact C-N 3.33Å; S150-T152 PolarHBondContact O-N 2.9Å; S150-I153 PolarHBondContact O-N 3.31Å; S150-I154 VanDerWaalsContact O-CG1 3.3Å; S150-I154 WeakPolarHBondContact O-CG1 3.44Å; S150-I154 PolarHBondContact O-N 2.84Å
151T76.1Confident70.8Confident65 Ų6572.5 Ų72.540%0.39940%0.4SS..Hα-helixtrans-63.4-38176.1550000112.2R147 V148 I154 L155R147-T151 WeakPolarHBondContact O-CG2 3.35Å; R147-T151 PolarHBondContact O-N 3.23Å; R147-T151 VanDerWaalsContact O-N 3.08Å; R147-T151 PolarHBondContact O-OG1 3.5Å; V148-T151 PolarHBondContact O-OG1 2.93Å; T151-I154 PolarHBondContact O-N 3.24Å; T151-L155 VanDerWaalsContact O-CG 3.29Å; T151-L155 WeakPolarHBondContact O-CG 3.36Å; T151-L155 PolarHBondContact O-N 2.82Å
152T76Confident72.9Confident33 Ų3368.2 Ų68.220%0.20237%0.372CS..Hα-helixtrans-62.8-43.9176.3-56.60000111.9V148 Y149 S150 L155 W156V148-T152 WeakPolarHBondContact O-CB 3.36Å; V148-T152 PolarHBondContact O-N 3.39Å; V148-T152 PolarHBondContact O-OG1 3.46Å; Y149-T152 PolarHBondContact O-N 2.92Å; S150-T152 VanDerWaalsContact C-N 3.33Å; S150-T152 PolarHBondContact O-N 2.9Å; T152-L155 PolarHBondContact O-N 2.61Å; T152-W156 PolarHBondContact O-N 3.17Å
153I79Confident74.9Confident42 Ų4262.3 Ų62.322%0.21533%0.334CS..Hα-helixtrans-61-44.7174-75178.4000111.1L111 Y149 S150 L155 W156 V157L111-I153 HydrophobicContact CD1-CG1 4.2Å; L111-I153 HydrophobicContact CD1-CG2 4.2Å; Y149-I153 HydrophobicContact CD1-CD1 3.9Å; Y149-I153 HydrophobicContact CE1-CD1 3.36Å; Y149-I153 HydrophobicContact CE1-CG1 4.38Å; Y149-I153 HydrophobicContact CE2-CD1 4.43Å; Y149-I153 PolarHBondContact O-N 3.32Å; S150-I153 PolarHBondContact O-N 3.31Å; I153-L155 VanDerWaalsContact C-N 3.33Å; I153-L155 PolarHBondContact O-N 2.88Å; I153-W156 PolarHBondContact O-N 3.34Å; I153-V157 HydrophobicContact CG2-CG2 4.25Å; I153-V157 WeakPolarHBondContact O-CG2 3.21Å; I153-V157 PolarHBondContact O-N 3.48Å
154I84.1Confident77Confident107 Ų10755.7 Ų55.755%0.54931%0.309SS..Hα-helixtrans-60.5-44177.9-67.6162.9000110.7S150 T151 W156 V157 G158S150-I154 VanDerWaalsContact O-CG1 3.3Å; S150-I154 WeakPolarHBondContact O-CG1 3.44Å; S150-I154 PolarHBondContact O-N 2.84Å; T151-I154 PolarHBondContact O-N 3.24Å; I154-W156 VanDerWaalsContact C-N 3.34Å; I154-W156 PolarHBondContact O-N 3.46Å; I154-V157 PolarHBondContact O-N 3.25Å; I154-G158 PolarHBondContact O-N 2.88Å
155L83.8Confident79Confident25 Ų2554.3 Ų54.313%0.13130%0.301CS..Hα-helixtrans-61.8-41.2175.8-68.3176.3000111.8M29 L32 V33 I36 T151 T152 I153 G158 L159M29-L155 HydrophobicContact CE-CB 4.19Å; M29-L155 HydrophobicContact CE-CD2 3.5Å; M29-L155 HydrophobicContact CE-CG 4.46Å; M29-L155 WeakPolarHBondContact CE-O 3.32Å; M29-L155 HydrophobicContact SD-CD2 3.78Å; L32-L155 HydrophobicContact CD2-CD1 4.08Å; L32-L155 HydrophobicContact CD2-CD2 3.76Å; L32-L155 HydrophobicContact CG-CD1 4.25Å; V33-L155 HydrophobicContact CG2-CB 3.77Å; V33-L155 HydrophobicContact CG2-CD1 4.03Å; V33-L155 HydrophobicContact CG2-CG 4.46Å; I36-L155 HydrophobicContact CD1-CD1 3.47Å; I36-L155 VanDerWaalsContact CD1-CD1 3.47Å; T151-L155 VanDerWaalsContact O-CG 3.29Å; T151-L155 WeakPolarHBondContact O-CG 3.36Å; T151-L155 PolarHBondContact O-N 2.82Å; T152-L155 PolarHBondContact O-N 2.61Å; I153-L155 VanDerWaalsContact C-N 3.33Å; I153-L155 PolarHBondContact O-N 2.88Å; L155-G158 PolarHBondContact O-N 3.48Å; L155-L159 VanDerWaalsContact O-CB 3.29Å; L155-L159 WeakPolarHBondContact O-CB 2.94Å; L155-L159 PolarHBondContact O-N 3.04Å
156W84.1Confident80.7Confident13 Ų1350.4 Ų50.45%0.04928%0.276CS..Hα-helixtrans-69.5-41.4178.9-76.227000112.9Y52 S110 L111 T152 I153 I154 L159 I160Y52-W156 HydrophobicContact CD1-CH2 4.01Å; Y52-W156 HydrophobicContact CE1-CH2 4.19Å; Y52-W156 HydrophobicContact CG-CH2 4.28Å; S110-W156 WeakPolarHBondContact OG-CH2 3.33Å; S110-W156 WeakPolarHBondContact OG-CZ3 3.45Å; L111-W156 HydrophobicContact CB-CE3 4.23Å; L111-W156 HydrophobicContact CD1-CE3 4.45Å; T152-W156 PolarHBondContact O-N 3.17Å; I153-W156 PolarHBondContact O-N 3.34Å; I154-W156 VanDerWaalsContact C-N 3.34Å; I154-W156 PolarHBondContact O-N 3.46Å; W156-L159 PolarHBondContact O-N 3.08Å; W156-I160 WeakPolarHBondContact O-CB 3.29Å; W156-I160 VanDerWaalsContact O-CG1 3.28Å; W156-I160 WeakPolarHBondContact O-CG1 3.43Å; W156-I160 PolarHBondContact O-N 2.93Å
157V86.9Confident82.2Confident68 Ų6850.3 Ų50.341%0.41227%0.272SS..Hα-helixtrans-62.2-45.4173.4170.70000110.1L111 I153 I154 L159 I160 V161L111-V157 HydrophobicContact CD2-CG2 3.84Å; I153-V157 HydrophobicContact CG2-CG2 4.25Å; I153-V157 WeakPolarHBondContact O-CG2 3.21Å; I153-V157 PolarHBondContact O-N 3.48Å; I154-V157 PolarHBondContact O-N 3.25Å; V157-L159 VanDerWaalsContact C-N 3.31Å; V157-L159 PolarHBondContact O-N 2.82Å; V157-I160 PolarHBondContact O-N 3.37Å; V157-V161 WeakPolarHBondContact O-CG2 3.3Å; V157-V161 PolarHBondContact O-N 3.3Å
158G87.4Confident83.4Confident29 Ų2945.2 Ų45.230%0.29926%0.261SS..Hα-helixtrans-56.6-45173.600000112.3I154 L155 V161 S162I154-G158 PolarHBondContact O-N 2.88Å; L155-G158 PolarHBondContact O-N 3.48Å; G158-V161 PolarHBondContact O-N 2.9Å; G158-S162 PolarHBondContact O-N 2.74Å; G158-S162 PolarHBondContact O-OG 3.47Å; G158-S162 VanDerWaalsContact O-OG 3.06Å
159L86.9Confident84.3Confident0 Ų044.2 Ų44.20%025%0.252CS..Hα-helixtrans-65.4-41.3179-161.961.8000112.8M29 T59 L107 L155 W156 V157 V161 S162 C163M29-L159 HydrophobicContact CB-CD1 3.86Å; T59-L159 HydrophobicContact CG2-CD1 3.53Å; T59-L159 HydrophobicContact CG2-CD2 3.89Å; T59-L159 HydrophobicContact CG2-CG 3.8Å; L107-L159 HydrophobicContact CD1-CB 4.42Å; L107-L159 HydrophobicContact CD1-CD2 3.72Å; L107-L159 HydrophobicContact CD1-CG 3.89Å; L107-L159 HydrophobicContact CD2-CD2 4.38Å; L155-L159 VanDerWaalsContact O-CB 3.29Å; L155-L159 WeakPolarHBondContact O-CB 2.94Å; L155-L159 PolarHBondContact O-N 3.04Å; W156-L159 PolarHBondContact O-N 3.08Å; V157-L159 VanDerWaalsContact C-N 3.31Å; V157-L159 PolarHBondContact O-N 2.82Å; L159-V161 VanDerWaalsContact C-N 3.35Å; L159-S162 WeakPolarHBondContact CA-OG 3.35Å; L159-S162 PolarHBondContact O-N 2.77Å; L159-S162 PolarHBondContact O-OG 3.45Å; L159-C163 VanDerWaalsContact O-CB 3.25Å; L159-C163 WeakPolarHBondContact O-CB 3.1Å; L159-C163 PolarHBondContact O-N 3.07Å; L159-C163 PolarHBondContact O-SG 3.12Å; L159-C163 VanDerWaalsContact O-SG 3.34Å
160I88.6Confident85.2Confident23 Ų2340.9 Ų40.912%0.11824%0.239CC..Hα-helixtrans-61.9-43.4174.1-72.4164000110.5T104 L107 L111 W156 V157 S164T104-I160 HydrophobicContact CG2-CG2 4.21Å; L107-I160 HydrophobicContact CB-CD1 4.11Å; L107-I160 HydrophobicContact CB-CG1 3.72Å; L107-I160 HydrophobicContact CD1-CG1 4.48Å; L111-I160 HydrophobicContact CB-CD1 4.32Å; L111-I160 HydrophobicContact CD2-CD1 3.75Å; W156-I160 WeakPolarHBondContact O-CB 3.29Å; W156-I160 VanDerWaalsContact O-CG1 3.28Å; W156-I160 WeakPolarHBondContact O-CG1 3.43Å; W156-I160 PolarHBondContact O-N 2.93Å; V157-I160 PolarHBondContact O-N 3.37Å; I160-S164 VanDerWaalsContact O-CB 3.32Å; I160-S164 WeakPolarHBondContact O-CB 2.99Å; I160-S164 PolarHBondContact O-N 3.23Å; I160-S164 PolarHBondContact O-OG 3.13Å
161V90.9Very high85.8Confident79 Ų7940 Ų4048%0.47924%0.235SC..Hα-helixtrans-64.2-48177170.60000110.9V157 G158 L159 S164 I165V157-V161 WeakPolarHBondContact O-CG2 3.3Å; V157-V161 PolarHBondContact O-N 3.3Å; G158-V161 PolarHBondContact O-N 2.9Å; L159-V161 VanDerWaalsContact C-N 3.35Å; V161-S164 WeakPolarHBondContact O-CB 3.27Å; V161-S164 PolarHBondContact O-N 2.81Å; V161-I165 HydrophobicContact CG1-CD1 3.86Å; V161-I165 VanDerWaalsContact O-CG1 3.3Å; V161-I165 WeakPolarHBondContact O-CG1 3.35Å; V161-I165 PolarHBondContact O-N 2.97Å
162S87.8Confident86.3Confident10 Ų1040.5 Ų40.57%0.0723%0.23CC..Hα-helixtrans-71.8-30-178.7600000113.5N26 G158 L159 Q166N26-S162 PolarHBondContact ND2-O 2.9Å; N26-S162 VanDerWaalsContact ND2-O 3.17Å; N26-S162 VanDerWaalsContact OD1-C 3.3Å; N26-S162 WeakPolarHBondContact OD1-CB 3.22Å; N26-S162 PolarHBondContact OD1-OG 3.19Å; G158-S162 PolarHBondContact O-N 2.74Å; G158-S162 PolarHBondContact O-OG 3.47Å; G158-S162 VanDerWaalsContact O-OG 3.06Å; L159-S162 WeakPolarHBondContact CA-OG 3.35Å; L159-S162 PolarHBondContact O-N 2.77Å; L159-S162 PolarHBondContact O-OG 3.45Å; S162-Q166 WeakPolarHBondContact O-CB 3.48Å; S162-Q166 PolarHBondContact O-N 3.38Å
163C87.9Confident86.7Confident1 Ų139.2 Ų39.21%0.00722%0.222CC..Hα-helixtrans-68.5-39.4167.4-75.70000112.1N26 T104 L159 Q166 M167N26-C163 PolarHBondContact OD1-N 3.44Å; T104-C163 WeakPolarHBondContact OG1-CB 3.49Å; L159-C163 VanDerWaalsContact O-CB 3.25Å; L159-C163 WeakPolarHBondContact O-CB 3.1Å; L159-C163 PolarHBondContact O-N 3.07Å; L159-C163 PolarHBondContact O-SG 3.12Å; L159-C163 VanDerWaalsContact O-SG 3.34Å; C163-Q166 PolarHBondContact O-N 3.05Å; C163-M167 WeakPolarHBondContact O-CB 3.48Å; C163-M167 PolarHBondContact O-N 3.09Å
164S89.4Confident86.9Confident39 Ų3938.3 Ų38.327%0.27322%0.217SC..Hα-helixtrans-63.5-43.8175.8-61.40000111.6I160 V161 M167 V168I160-S164 VanDerWaalsContact O-CB 3.32Å; I160-S164 WeakPolarHBondContact O-CB 2.99Å; I160-S164 PolarHBondContact O-N 3.23Å; I160-S164 PolarHBondContact O-OG 3.13Å; V161-S164 WeakPolarHBondContact O-CB 3.27Å; V161-S164 PolarHBondContact O-N 2.81Å; S164-M167 PolarHBondContact O-N 3.33Å; S164-V168 WeakPolarHBondContact O-CG2 3.36Å; S164-V168 PolarHBondContact O-N 2.92Å
165I89.6Confident86.9Confident70 Ų7034.4 Ų34.436%0.35920%0.201SC..Hα-helixtrans-61.7-46.9174.4-67165.4000110.4V22 V161 M167 V168 F169V22-I165 HydrophobicContact CG1-CB 4.45Å; V22-I165 HydrophobicContact CG1-CG2 4.11Å; V22-I165 HydrophobicContact CG2-CG2 3.83Å; V161-I165 HydrophobicContact CG1-CD1 3.86Å; V161-I165 VanDerWaalsContact O-CG1 3.3Å; V161-I165 WeakPolarHBondContact O-CG1 3.35Å; V161-I165 PolarHBondContact O-N 2.97Å; I165-M167 VanDerWaalsContact C-N 3.34Å; I165-M167 PolarHBondContact O-N 3.22Å; I165-V168 PolarHBondContact O-N 3.35Å; I165-F169 HydrophobicContact CG2-CD2 3.7Å; I165-F169 HydrophobicContact CG2-CE2 3.6Å; I165-F169 VanDerWaalsContact O-CD2 3.31Å; I165-F169 WeakPolarHBondContact O-CD2 3.46Å; I165-F169 PolarHBondContact O-N 3.01Å
166Q88.9Confident86.8Confident0 Ų033.7 Ų33.70%020%0.199CC..Hα-helixtrans-57.7-45176.1-178.262.652.900112V22 S162 C163 F169 S170V22-Q166 HydrophobicContact CG1-CB 4.1Å; S162-Q166 WeakPolarHBondContact O-CB 3.48Å; S162-Q166 PolarHBondContact O-N 3.38Å; C163-Q166 PolarHBondContact O-N 3.05Å; Q166-F169 PolarHBondContact O-N 3.13Å; Q166-S170 PolarHBondContact NE2-OG 2.95Å; Q166-S170 VanDerWaalsContact NE2-OG 3.16Å; Q166-S170 WeakPolarHBondContact O-CB 3.42Å; Q166-S170 PolarHBondContact O-N 3.23Å; Q166-S170 PolarHBondContact O-OG 3.2Å
167M88.9Confident86.7Confident64 Ų6433.1 Ų33.132%0.31520%0.197SC..Hα-helixtrans-60.9-45.1177.1-179-178.563.800111.6A100 C163 S164 I165 F169 S170 A171A100-M167 HydrophobicContact CB-CB 4.2Å; C163-M167 WeakPolarHBondContact O-CB 3.48Å; C163-M167 PolarHBondContact O-N 3.09Å; S164-M167 PolarHBondContact O-N 3.33Å; I165-M167 VanDerWaalsContact C-N 3.34Å; I165-M167 PolarHBondContact O-N 3.22Å; M167-F169 PolarHBondContact O-N 2.96Å; M167-S170 PolarHBondContact O-N 2.9Å; M167-A171 VanDerWaalsContact O-CB 3.25Å; M167-A171 WeakPolarHBondContact O-CB 3.42Å; M167-A171 PolarHBondContact O-N 3.45Å
168V88.9Confident86.5Confident83 Ų8331 Ų3150%0.50319%0.186SC..Hα-helixtrans-60.8-45.7177.2170.90000111.1S164 I165 A171 R172S164-V168 WeakPolarHBondContact O-CG2 3.36Å; S164-V168 PolarHBondContact O-N 2.92Å; I165-V168 PolarHBondContact O-N 3.35Å; V168-A171 PolarHBondContact O-N 3.46Å; V168-R172 VanDerWaalsContact O-CG 3.29Å; V168-R172 WeakPolarHBondContact O-CG 3.32Å; V168-R172 PolarHBondContact O-N 2.85Å
169F85.3Confident86.1Confident45 Ų4532.6 Ų32.620%0.19719%0.193CC..Hα-helixtrans-67.6-44.4177.5-79-70000112.9M15 S18 V19 I165 Q166 M167 A171 R172 C173M15-F169 HydrophobicContact CB-CE1 4.49Å; M15-F169 HydrophobicContact CG-CE1 4.21Å; S18-F169 WeakPolarHBondContact OG-CZ 3.25Å; V19-F169 HydrophobicContact CG2-CB 3.38Å; V19-F169 HydrophobicContact CG2-CD1 4.01Å; V19-F169 HydrophobicContact CG2-CD2 4.25Å; V19-F169 HydrophobicContact CG2-CG 3.65Å; I165-F169 HydrophobicContact CG2-CD2 3.7Å; I165-F169 HydrophobicContact CG2-CE2 3.6Å; I165-F169 VanDerWaalsContact O-CD2 3.31Å; I165-F169 WeakPolarHBondContact O-CD2 3.46Å; I165-F169 PolarHBondContact O-N 3.01Å; Q166-F169 PolarHBondContact O-N 3.13Å; M167-F169 PolarHBondContact O-N 2.96Å; F169-A171 VanDerWaalsContact C-N 3.27Å; F169-A171 PolarHBondContact O-N 3.01Å; F169-R172 PolarHBondContact O-N 3.47Å; F169-R172 VanDerWaalsContact O-N 3.09Å; F169-C173 PolarHBondContact O-N 3.06Å; F169-C173 PolarHBondContact O-SG 3.16Å
170S85Confident85.5Confident0 Ų037.2 Ų37.20%021%0.213CC..Hα-helixtrans-58.5-39.2174.7-68.40000111.3S96 Q166 M167 C173 L174S96-S170 PolarHBondContact OG-OG 3.41Å; Q166-S170 PolarHBondContact NE2-OG 2.95Å; Q166-S170 VanDerWaalsContact NE2-OG 3.16Å; Q166-S170 WeakPolarHBondContact O-CB 3.42Å; Q166-S170 PolarHBondContact O-N 3.23Å; Q166-S170 PolarHBondContact O-OG 3.2Å; M167-S170 PolarHBondContact O-N 2.9Å; S170-C173 PolarHBondContact O-N 2.92Å; S170-L174 WeakPolarHBondContact O-CB 3.3Å; S170-L174 VanDerWaalsContact O-CG 3.31Å; S170-L174 WeakPolarHBondContact O-CG 3.33Å; S170-L174 PolarHBondContact O-N 3.47Å
171A86.8Confident85Confident43 Ų4338.4 Ų38.436%0.35522%0.219SC..Hα-helixtrans-66.2-37.217400000113.3M167 V168 F169 L174 A175M167-A171 VanDerWaalsContact O-CB 3.25Å; M167-A171 WeakPolarHBondContact O-CB 3.42Å; M167-A171 PolarHBondContact O-N 3.45Å; V168-A171 PolarHBondContact O-N 3.46Å; F169-A171 VanDerWaalsContact C-N 3.27Å; F169-A171 PolarHBondContact O-N 3.01Å; A171-L174 WeakPolarHBondContact O-CB 3.49Å; A171-L174 PolarHBondContact O-N 2.99Å; A171-A175 WeakPolarHBondContact O-CB 3.46Å; A171-A175 PolarHBondContact O-N 3.48Å
172R86.6Confident84Confident77 Ų7736.4 Ų36.429%0.29122%0.215SC..Hα-helixtrans-66.5-42.6172.9-68.9-68.4-171.7153.59.6111.8L6 V168 F169 A175 A176L6-R172 HydrophobicContact CD2-CB 4.21Å; V168-R172 VanDerWaalsContact O-CG 3.29Å; V168-R172 WeakPolarHBondContact O-CG 3.32Å; V168-R172 PolarHBondContact O-N 2.85Å; F169-R172 PolarHBondContact O-N 3.47Å; F169-R172 VanDerWaalsContact O-N 3.09Å; R172-A175 PolarHBondContact O-N 3.18Å; R172-A176 PolarHBondContact O-N 3.44Å
173C83.2Confident83.2Confident6 Ų639.3 Ų39.34%0.04123%0.229CC..Hα-helixtrans-61.1-43.3173.3-71.10000111.8L89 F169 S170 A176 C177L89-C173 HydrophobicContact CD2-CB 4.03Å; F169-C173 PolarHBondContact O-N 3.06Å; F169-C173 PolarHBondContact O-SG 3.16Å; S170-C173 PolarHBondContact O-N 2.92Å; C173-A176 PolarHBondContact O-N 2.98Å; C173-C177 WeakPolarHBondContact O-CB 3.32Å; C173-C177 PolarHBondContact O-N 2.69Å
174L84Confident81.6Confident22 Ų2244.4 Ų44.412%0.11526%0.263CS..Hα-helixtrans-58.1-48.7173.3-80.8168.9000112.7F90 L94 S170 A171 A176 C177 A178F90-L174 HydrophobicContact CD2-CD2 3.7Å; F90-L174 HydrophobicContact CE2-CD2 3.79Å; F90-L174 HydrophobicContact CG-CD2 4.42Å; F90-L174 VanDerWaalsContact O-CD2 3.3Å; F90-L174 WeakPolarHBondContact O-CD2 3.29Å; L94-L174 HydrophobicContact CB-CD2 3.91Å; L94-L174 HydrophobicContact CD1-CD1 4.34Å; S170-L174 WeakPolarHBondContact O-CB 3.3Å; S170-L174 VanDerWaalsContact O-CG 3.31Å; S170-L174 WeakPolarHBondContact O-CG 3.33Å; S170-L174 PolarHBondContact O-N 3.47Å; A171-L174 WeakPolarHBondContact O-CB 3.49Å; A171-L174 PolarHBondContact O-N 2.99Å; L174-A176 PolarHBondContact O-N 2.86Å; L174-C177 PolarHBondContact O-N 3.47Å; L174-A178 VanDerWaalsContact O-CB 3.29Å; L174-A178 WeakPolarHBondContact O-CB 3.37Å; L174-A178 PolarHBondContact O-N 2.79Å
175A84.9Confident79.9Confident26 Ų2646.1 Ų46.122%0.21529%0.286CS..Hα-helixtrans-62.9-40.5179.600000112.3A171 R172 S179A171-A175 WeakPolarHBondContact O-CB 3.46Å; A171-A175 PolarHBondContact O-N 3.48Å; R172-A175 PolarHBondContact O-N 3.18Å; A175-S179 WeakPolarHBondContact O-CB 3.19Å; A175-S179 PolarHBondContact O-N 3.27Å; A175-S179 PolarHBondContact O-OG 2.9Å
176A81.8Confident77.8Confident9 Ų945.8 Ų45.87%0.07429%0.289CS..Hα-helixtrans-63.8-48.4174.400000111.6L6 R172 C173 L174 A178 S179 F180L6-A176 HydrophobicContact CB-CB 4.45Å; L6-A176 HydrophobicContact CD2-CB 3.96Å; R172-A176 PolarHBondContact O-N 3.44Å; C173-A176 PolarHBondContact O-N 2.98Å; L174-A176 PolarHBondContact O-N 2.86Å; A176-A178 PolarHBondContact O-N 3.19Å; A176-S179 WeakPolarHBondContact O-CB 3.33Å; A176-S179 PolarHBondContact O-N 2.96Å; A176-F180 HydrophobicContact CB-CE2 4.35Å; A176-F180 WeakPolarHBondContact O-CD2 3.38Å; A176-F180 PolarHBondContact O-N 3.4Å
177C80.3Confident75.7Confident2 Ų252.1 Ų52.11%0.01433%0.331CS..Hα-helixtrans-63.5-41.3176.9-80.30000113.2T86 L89 F90 C173 L174 S179 F180 L181T86-C177 HydrophobicContact CG2-CB 4.16Å; L89-C177 VanDerWaalsContact CD2-SG 3.51Å; F90-C177 HydrophobicContact CB-CB 3.92Å; F90-C177 HydrophobicContact CD2-CB 3.95Å; F90-C177 HydrophobicContact CG-CB 4.41Å; C173-C177 WeakPolarHBondContact O-CB 3.32Å; C173-C177 PolarHBondContact O-N 2.69Å; L174-C177 PolarHBondContact O-N 3.47Å; C177-S179 VanDerWaalsContact C-N 3.26Å; C177-S179 PolarHBondContact O-N 2.9Å; C177-F180 PolarHBondContact O-N 3.45Å; C177-L181 WeakPolarHBondContact O-CB 3.49Å; C177-L181 WeakPolarHBondContact O-CD1 3.28Å; C177-L181 PolarHBondContact O-N 3.03Å
178A82.7Confident73.6Confident22 Ų2254.5 Ų54.518%0.18234%0.339CS..Hα-helixtrans-60.6-37.517500000111.8F90 L174 A176 L181 G182 L183F90-A178 HydrophobicContact CE2-CB 4.15Å; L174-A178 VanDerWaalsContact O-CB 3.29Å; L174-A178 WeakPolarHBondContact O-CB 3.37Å; L174-A178 PolarHBondContact O-N 2.79Å; A176-A178 PolarHBondContact O-N 3.19Å; A178-L181 PolarHBondContact O-N 2.9Å; A178-G182 PolarHBondContact O-N 2.91Å; A178-L183 PolarHBondContact O-N 3.28Å; A178-L183 VanDerWaalsContact O-N 3.13Å
179S79.9Confident71.5Confident64 Ų6456.2 Ų56.245%0.44836%0.355SS..Hα-helixtrans-65.2-47.3174-57.20000111.7A175 A176 C177 L181 G182A175-S179 WeakPolarHBondContact O-CB 3.19Å; A175-S179 PolarHBondContact O-N 3.27Å; A175-S179 PolarHBondContact O-OG 2.9Å; A176-S179 WeakPolarHBondContact O-CB 3.33Å; A176-S179 PolarHBondContact O-N 2.96Å; C177-S179 VanDerWaalsContact C-N 3.26Å; C177-S179 PolarHBondContact O-N 2.9Å; S179-L181 VanDerWaalsContact C-N 3.31Å; S179-L181 PolarHBondContact O-N 3.46Å; S179-G182 PolarHBondContact O-N 3.26Å
180F74.8Confident69.4Low96 Ų9665.3 Ų65.342%0.42139%0.388SS..Hα-helixtrans-63.7-31.3175.2-67.1-51.7000113.6T86 A176 C177 G182T86-F180 HydrophobicContact CG2-CB 3.92Å; T86-F180 HydrophobicContact CG2-CD2 4.39Å; A176-F180 HydrophobicContact CB-CE2 4.35Å; A176-F180 WeakPolarHBondContact O-CD2 3.38Å; A176-F180 PolarHBondContact O-N 3.4Å; C177-F180 PolarHBondContact O-N 3.45Å; F180-G182 VanDerWaalsContact C-N 3.35Å
181L78.1Confident67.4Low48 Ų4874.3 Ų74.325%0.25142%0.422SS..Hα-helixtrans-80.2-13.4173.4-91.462.4000113.1T86 W87 C177 A178 S179 L183T86-L181 HydrophobicContact CG2-CD1 3.41Å; T86-L181 VanDerWaalsContact CG2-CD1 3.41Å; W87-L181 HydrophobicContact CD2-CD2 3.95Å; W87-L181 HydrophobicContact CG-CD2 4.07Å; W87-L181 HydrophobicContact CZ2-CD2 4.17Å; C177-L181 WeakPolarHBondContact O-CB 3.49Å; C177-L181 WeakPolarHBondContact O-CD1 3.28Å; C177-L181 PolarHBondContact O-N 3.03Å; A178-L181 PolarHBondContact O-N 2.9Å; S179-L181 VanDerWaalsContact C-N 3.31Å; S179-L181 PolarHBondContact O-N 3.46Å; L181-L183 VanDerWaalsContact C-N 3.25Å; L181-L183 HydrophobicContact CB-CD1 3.84Å; L181-L183 HydrophobicContact CB-CG 4.17Å; L181-L183 HydrophobicContact CD2-CD1 3.8Å; L181-L183 HydrophobicContact CG-CD1 4.49Å; L181-L183 PolarHBondContact O-N 3.31Å
182G70.1Confident65.3Low37 Ų3780.4 Ų80.438%0.38144%0.443SS..THydrogen-bonded Turntrans69.318.3-178.500000115A178 S179 F180 K188A178-G182 PolarHBondContact O-N 2.91Å; S179-G182 PolarHBondContact O-N 3.26Å; F180-G182 VanDerWaalsContact C-N 3.35Å; G182-K188 PolarHBondContact O-NZ 3.42Å
183L70.1Confident63.1Low71 Ų7184.7 Ų84.737%0.37246%0.464SS..  trans-59.5153.7-177.6-85154.5000111.6F90 A178 L181 G185F90-L183 HydrophobicContact CE1-CD1 4.38Å; F90-L183 HydrophobicContact CE2-CD1 4.49Å; F90-L183 HydrophobicContact CZ-CD1 4.12Å; A178-L183 PolarHBondContact O-N 3.28Å; A178-L183 VanDerWaalsContact O-N 3.13Å; L181-L183 VanDerWaalsContact C-N 3.25Å; L181-L183 HydrophobicContact CB-CD1 3.84Å; L181-L183 HydrophobicContact CB-CG 4.17Å; L181-L183 HydrophobicContact CD2-CD1 3.8Å; L181-L183 HydrophobicContact CG-CD1 4.49Å; L181-L183 PolarHBondContact O-N 3.31Å; L183-G185 PolarHBondContact O-N 3.41Å; L183-G185 VanDerWaalsContact O-N 3.14Å
184P55.2Low61.1Low109 Ų10993 Ų9371%0.70850%0.499SS*.THydrogen-bonded Turntrans-71.9-4.8-169.6-19.733.8000116.5C186P184-C186 VanDerWaalsContact C-N 3.28Å; P184-C186 PolarHBondContact O-N 2.88Å; P184-C186 VanDerWaalsContact O-N 3.15Å
185G52Low59Low75 Ų7597.5 Ų97.577%0.77353%0.528SS*.THydrogen-bonded Turntrans-74.52.3-165.800000117.8L183L183-G185 PolarHBondContact O-N 3.41Å; L183-G185 VanDerWaalsContact O-N 3.14Å
186C46.9Very low56.9Low62 Ų62107 Ų10742%0.41956%0.559SS.*SBendtrans-128.1139.4172.7-74.30000110P184 K188P184-C186 VanDerWaalsContact C-N 3.28Å; P184-C186 PolarHBondContact O-N 2.88Å; P184-C186 VanDerWaalsContact O-N 3.15Å; C186-K188 PolarHBondContact O-N 3.42Å
187P44Very low54.9Low134 Ų134112.7 Ų112.787%0.8759%0.593SS**  trans-61.7110.6172.925.3-32.3000109.2S189P187-S189 PolarHBondContact O-N 2.92Å
188K44.7Very low53Low113 Ų113122.9 Ų122.949%0.49163%0.632SS.*  trans-69.3101.2-170.9-75.1163.3176.8162.20110.7G182 C186 R190G182-K188 PolarHBondContact O-NZ 3.42Å; C186-K188 PolarHBondContact O-N 3.42Å; K188-R190 PolarHBondContact O-N 3.41Å
189S45.9Very low51Low120 Ų120126.6 Ų126.684%0.83965%0.654SS**  trans-57.2136.3153.5-168.30000108.4P187 R191P187-S189 PolarHBondContact O-N 2.92Å; S189-R191 PolarHBondContact O-N 3.43Å
190R41.5Very low49.4Very low235 Ų235130.6 Ų130.689%0.88767%0.669SS**  trans-53.8126.9-154-62.7173.5-177.3-176.10.2112.6K188 H192K188-R190 PolarHBondContact O-N 3.41Å; R190-H192 PolarHBondContact O-N 3.33Å
191R42.9Very low47.9Very low190 Ų190133 Ų13372%0.71769%0.686SS**  trans-49.6109.3166-74.2173.2168.8164.2-6.7109.6S189 K193S189-R191 PolarHBondContact O-N 3.43Å; R191-K193 PolarHBondContact O-N 2.95Å
192H42.1Very low46.2Very low171 Ų171136.7 Ų136.779%0.79271%0.71SS**  trans-75.776.2166.4-155.512000108.8R190 K194R190-H192 PolarHBondContact O-N 3.33Å; H192-K194 PolarHBondContact O-N 3.3Å
193K40.6Very low44.6Very low167 Ų167139.5 Ų139.573%0.72673%0.73SS**  trans-60103.7161.3-90.9-172.3172.3-173.60106.4R191 T195R191-K193 PolarHBondContact O-N 2.95Å; K193-T195 PolarHBondContact O-N 2.97Å
194K40.7Very low42.9Very low180 Ų180145.8 Ų145.878%0.78375%0.754SS**  trans-64.394.7156.7-80.7-174.3175-179.30106.8H192 Y196H192-K194 PolarHBondContact O-N 3.3Å; K194-Y196 PolarHBondContact O-N 3.09Å
195T40.6Very low41.9Very low117 Ų117146 Ų14672%0.71876%0.758SS**  trans-57.9117.7165.9-53.20000106.8K193 T197K193-T195 PolarHBondContact O-N 2.97Å; T195-T197 PolarHBondContact O-N 3.27Å
196Y39.6Very low41.1Very low224 Ų224146.8 Ų146.888%0.87876%0.757SS**  trans-63.9105.4164.5-95.3-99.2000106.8K194 R198K194-Y196 PolarHBondContact O-N 3.09Å; Y196-R198 VanDerWaalsContact C-N 3.29Å; Y196-R198 PolarHBondContact O-N 3.01Å
197T41.1Very low40.4Very low129 Ų129154 Ų15479%0.79178%0.782SS**  trans-64.895.2170.6-55.40000107.8T195 P199T195-T197 PolarHBondContact O-N 3.27Å; T197-P199 VanDerWaalsContact O-CD 3.3Å; T197-P199 WeakPolarHBondContact O-CD 3.4Å
198R39.8Very low39.7Very low217 Ų217155.9 Ų155.982%0.81978%0.779SS**  trans-60.6115.4169.4-179.8-177-172.7-179.92.7107.3Y196 I200Y196-R198 VanDerWaalsContact C-N 3.29Å; Y196-R198 PolarHBondContact O-N 3.01Å; R198-I200 PolarHBondContact O-N 3.02Å
199P40.6Very low38.9Very low100 Ų100156.4 Ų156.465%0.64979%0.792SS**  trans-63.1121.9170.426.3-31.7000107.9T197 N201T197-P199 VanDerWaalsContact O-CD 3.3Å; T197-P199 WeakPolarHBondContact O-CD 3.4Å; P199-N201 PolarHBondContact O-N 3.41Å; P199-N201 VanDerWaalsContact O-N 3.14Å
200I46.6Very low38Very low147 Ų147156 Ų15675%0.75479%0.789SS**  trans-75.6101.4172-63.6174.3000106.1R198 V202R198-I200 PolarHBondContact O-N 3.02Å; I200-V202 HydrophobicContact CG2-CG2 4.27Å; I200-V202 PolarHBondContact O-N 3.39Å
201N43Very low37.4Very low148 Ų148153.5 Ų153.579%0.79179%0.787SS**  trans-65.999.7165.1-71.2-20.2000107.5P199 A203P199-N201 PolarHBondContact O-N 3.41Å; P199-N201 VanDerWaalsContact O-N 3.14Å; N201-A203 PolarHBondContact O-N 2.88Å; N201-A203 VanDerWaalsContact O-N 3.08Å
202V41.7Very low37.1Very low125 Ų125149.1 Ų149.176%0.75878%0.783SS**  trans-67.4106.7169.8176.40000107.3I200 K204I200-V202 HydrophobicContact CG2-CG2 4.27Å; I200-V202 PolarHBondContact O-N 3.39Å; V202-K204 PolarHBondContact O-N 3.08Å
203A37.1Very low36.4Very low96 Ų96148.3 Ų148.379%0.79378%0.779SS**  trans-64.5105.4170.400000108.6N201 S205N201-A203 PolarHBondContact O-N 2.88Å; N201-A203 VanDerWaalsContact O-N 3.08Å; A203-S205 PolarHBondContact O-N 3.23Å
204K34.9Very low35.7Very low203 Ų203147.9 Ų147.988%0.88378%0.78SS**  trans-74.195.7170.3-169.2176-175.3-179.70107.6V202V202-K204 PolarHBondContact O-N 3.08Å
205S33.1Very low35.1Very low113 Ų113145.9 Ų145.979%0.7978%0.783SS**  trans-61.3137.1175.4-163.50000110A203A203-S205 PolarHBondContact O-N 3.23Å
206A36.2Very low34.4Very low91 Ų91148.7 Ų148.775%0.75279%0.788SS**  trans-75.6145.7177.400000110.9
207K32.4Very low35Very low215 Ų215142.6 Ų142.694%0.93578%0.775SS**  trans-138.2136147.3-157.1173.2-175.6-177.50107.9
208E28.9Very low35Very low173 Ų173141.6 Ų141.681%0.80877%0.771SS**  trans-106.4164.7-160.3-156.3175.9173.400111.4
209T27.1Very low34.4Very low124 Ų124142.1 Ų142.176%0.76177%0.773SS**  trans71119.3161.9-46.70000114.9
210S28.3Very low33.7Very low112 Ų112145.9 Ų145.978%0.78378%0.775SS**  cis-168.5159.838.236.30000112.8
211Q28.2Very low32.8Very low182 Ų182148.2 Ų148.285%0.8578%0.782SS**  trans-92.8172.5157.7-114.3-170.9-22.200109.2
212P37.6Very low32.2Very low97 Ų97148.2 Ų148.263%0.6378%0.777SS**  cis-147.7-171.733.936.7-12000118.5
213H27.4Very low31.6Very low154 Ų154149.5 Ų149.571%0.71378%0.78SS**  trans95.7134.3152.6-71.2-47.8000124.2
214H25.2Very low31.2Very low159 Ų159148.8 Ų148.874%0.73677%0.766SS**  trans0.6152.3157.9-54.3-66.8000120.8
215T28Very low30.9Very low138 Ų138144.6 Ų144.685%0.84776%0.762SS**  cis-161.116548.3-47.70000112.8
216E25.8Very low30.7Very low176 Ų176149.1 Ų149.182%0.82276%0.762SS**  trans-89.7-168.4178.2-140.4-154.5122.200112.7
217P51.4Low30.4Very low95 Ų95152 Ų15262%0.61777%0.77SS**  -112.1-163.9-127.739.1-18.3000113.7
218P41.6Very low30.2Very low109 Ų109150.4 Ų150.471%0.70876%0.759SS**  -153.81599839.9-22.1000118.1
219R27.4Very low30.4Very low227 Ų227149 Ų14986%0.85776%0.763SS**  trans37.1151.6133.2-62.4179.4172.3156.4-1.7120.9
220R25.5Very low30.7Very low180 Ų180150.4 Ų150.468%0.67976%0.761SS**  cis-175.5142.8-8.6-108-113-122.6-141-1.6105.3H222R220-H222 PolarHBondContact NH1-NE2 3.19Å
221Q28.5Very low31.6Very low195 Ų195149.4 Ų149.491%0.91175%0.751SS**  trans-155.4141.5130.5-151.3138.50.600111.4
222H29.3Very low32.1Very low149 Ų149146.6 Ų146.669%0.6975%0.749SS**  trans-73.7160.9167.8-83.9-77.4000108.9R220R220-H222 PolarHBondContact NH1-NE2 3.19Å
223D29.1Very low31.9Very low152 Ų152153 Ų15381%0.81376%0.76SS**  -156.3-170.456.5-140.9-25000116.6
224T29.1Very low31.9Very low81 Ų81152.3 Ų152.350%0.49777%0.767SS.*  trans-130.3132.1-138.3-45.10000113.1
225S28.5Very low32Very low115 Ų115155.8 Ų155.880%0.80477%0.773SS**  trans175.4102.7140.3-82.70000109.5
226R29.7Very low32.2Very low208 Ų208156.1 Ų156.179%0.78577%0.77SS**  60.896.577.6-76.2-166.5169.7-164.6-1.3115.3
227V29.9Very low32.4Very low152 Ų152154.6 Ų154.692%0.92177%0.773SS**  -129.8128.8126.2179.10000107.2
228Y27.6Very low31.5Very low181 Ų181155.4 Ų155.471%0.7178%0.781SS**  trans-106.3147.2177.2-111.8-94.5000109.3
229T34.1Very low31.4Very low144 Ų144155.7 Ų155.788%0.88378%0.783SS**  -164.2143.2121.3-66.20000108.9
230E32.6Very low31.5Very low153 Ų153155.4 Ų155.472%0.71578%0.782SS**  trans-82.9170-169.8-108.5-163.5102.400115.8
231P46.9Very low31.6Very low91 Ų91156.7 Ų156.759%0.59179%0.786SS**  trans-102.6171.717841.1-33.9000114.1
232P39.9Very low31.5Very low123 Ų123156.9 Ų156.980%0.79979%0.787SS**  trans-103.2113.7154.431.9-21.3000110.3
233R31.6Very low31.6Very low231 Ų231155.2 Ų155.287%0.87279%0.787SS**  80108.879.2-76.9-172.1-177.9-1662.2115.4
234V28.9Very low31.5Very low139 Ų139157.1 Ų157.184%0.84279%0.791SS**  trans-55.5140163.41740000111.7
235R26.7Very low31.6Very low232 Ų232160 Ų16088%0.87580%0.799SS**  175144.8103.5-154.8164.3-166.4164.23.1114.6
236N32Very low31.7Very low145 Ų145160.9 Ų160.978%0.77580%0.802SS**  trans-59.7144.2169.1-49-26.2000113
237T29Very low31.6Very low144 Ų144161.1 Ų161.188%0.88380%0.803SS**  -166.9146.1128.519.60000111.8
238S34.3Very low31.3Very low112 Ų112158.8 Ų158.878%0.78379%0.793SS**  trans-100.1150.5164.6172.80000109.6
239P39.6Very low31.2Very low115 Ų115159.8 Ų159.875%0.74780%0.803SS**  trans-134.1134.6148.333.4-18.7000115.3
240R29.3Very low31.1Very low222 Ų222159.6 Ų159.684%0.83879%0.792SS**  trans26.5129.3144.6-80.2-179.1168.8-171.5-2.9121.8
241R26.6Very low30.8Very low207 Ų207161.9 Ų161.978%0.78180%0.803SS**  26.6120.9128.1-85.8-167.9-89.8-158.5-7.2118.4
242H27.3Very low29.9Very low198 Ų198166.5 Ų166.592%0.91781%0.808SS**  -140.1160.3116.8-112.764.3000111.7
243T30.2Very low29.3Very low114 Ų114166.5 Ų166.570%0.69981%0.811SS**  trans-115.7129.4-175.4-56.60000108.4
244E28.6Very low29.4Very low192 Ų192162 Ų16290%0.89780%0.8SS**  trans-138.7138.3158.1-80.4-160.5108.700112
245Q29.1Very low29.4Very low141 Ų141164.8 Ų164.866%0.65980%0.802SS**PPolyproline II helixtrans-92.1163.1164.3-66.9-178.4-4100109.1
246P31.6Very low29.4Very low134 Ų134164 Ų16487%0.8780%0.8SS**PPolyproline II helixtrans-96129.1140.5-8.727.4000109.8
247R27.9Very low29.5Very low213 Ų213162 Ų16280%0.80479%0.794SS**PPolyproline II helixtrans-99.2133.8171.1-109.6-177178.4158.7-1.8110.9
248C23.7Very low29.6Very low104 Ų104162 Ų16270%0.70379%0.788SS**  trans25.2136.3146.2-49.30000121.1
249H24.3Very low29.9Very low202 Ų202161.9 Ų161.994%0.93579%0.785SS**  -104.5139.3125.3-127.6-66.5000108.8
250E32.2Very low30.5Very low140 Ų140162.2 Ų162.265%0.65479%0.787SS**  trans-121.3126.1-172.1177.2179.9163.300108.9
251E26.6Very low30.6Very low200 Ų200163.9 Ų163.994%0.93579%0.793SS**  trans-104.581.6162.5-162.4174.113700110.3
252R28.6Very low30.7Very low188 Ų188160.4 Ų160.471%0.70979%0.79SS**  trans5.4114.8145.1-167.7178.2-141.8159.55.6117.7
253S27.5Very low30.9Very low123 Ų123158.3 Ų158.386%0.8678%0.78SS**  -156.1113.3118.5-84.70000111.1
254Q32.8Very low30.9Very low137 Ų137158.8 Ų158.864%0.6479%0.788SS**  trans-85.9152.4176-62.7164.8-25.700109.6
255F29Very low31.2Very low198 Ų198158.9 Ų158.987%0.86879%0.785SS**  -166.8111.2119.6-105.9-69.2000112.9
256Y27.8Very low31.8Very low215 Ų215157.8 Ų157.884%0.84379%0.791SS**  trans34120.9152-99.7-100.9000123.2
257T33.3Very low31.9Very low104 Ų104156.3 Ų156.364%0.63878%0.779SS**  trans-85.1148.8152.948.30000110.4
258N30.7Very low32Very low142 Ų142158.1 Ų158.176%0.75979%0.786SS**  153.2172.587-104.5-33.4000108
259P41.7Very low32.4Very low111 Ų111161.2 Ų161.272%0.72179%0.79SS**  -130.8-148.2-64.842.9-20.7000110
260P51.5Low32.7Very low121 Ų121159 Ų15979%0.78678%0.78SS**  trans-89.9160.6-152.537.4-40000117.3
261R31.3Very low32.7Very low258 Ų258160.6 Ų160.697%0.97478%0.784SS**  trans-151.1158.9156.4-120.3177.7-169.4-179.73.5113.8
262D29.3Very low33Very low134 Ų134158.5 Ų158.572%0.71778%0.78SS**  trans-114.4167.7-164.3-164.8-5.1000112
263H32.1Very low34Very low154 Ų154155.1 Ų155.171%0.71378%0.782SS**  trans90.4135.7158.8-68.3-2.6000122.7
264S29.8Very low35Very low123 Ų123154.5 Ų154.586%0.8678%0.775SS**  trans97.9120.3147.773.60000120.4
265K34.8Very low34.9Very low194 Ų194159.5 Ų159.584%0.84379%0.788SS**  trans-90.4167.6162.7-57.7179.7175.2179.20109.2
266P42Very low34.9Very low119 Ų119153.9 Ų153.977%0.77377%0.773SS**  -146.5142.289.434-15.6000117.6
267T32.1Very low35.1Very low102 Ų102151.1 Ų151.163%0.62677%0.773SS**  trans21.3127.9137-36.50000122.3
268R31Very low35.1Very low252 Ų252154.6 Ų154.695%0.95178%0.782SS**  trans-145148131.6-75.3-156.4178.3-172.10.4112
269H32.8Very low35.3Very low168 Ų168156.4 Ų156.478%0.77878%0.783SS**  trans-107.6141.1-174.9-71.2-102.9000113.7
270H30.4Very low35.4Very low156 Ų156156.5 Ų156.572%0.72278%0.784SS**  trans-170.7116.1135.6-113.356.5000109.8
271K32.6Very low34.3Very low173 Ų173155.4 Ų155.475%0.75278%0.778SS**  79.9121.393.5-77.1-158.1-169.7165.80116
272D31.7Very low34.3Very low157 Ų157155.2 Ų155.284%0.8478%0.778SS**  trans-81.7-164.9172.4-48.4-80.2000113
273P49.5Very low34.5Very low116 Ų116157.6 Ų157.675%0.75378%0.784SS**  -123.1-141.7-74.739.5-20.2000109.5
274P49.7Very low34.8Very low110 Ų110155.9 Ų155.971%0.71479%0.787SS**  cis-133.4-150.5-19.842.5-22.6000113.4
275R30.4Very low35Very low242 Ų242156.6 Ų156.691%0.91379%0.786SS**  trans74.9148.7171.5-87.1-178.9177.6176.9-0.3116.3
276S28.4Very low35Very low80 Ų80151.8 Ų151.856%0.55978%0.783SS**  cis-154.1153.75.9177.20000110.3
277N31.1Very low35.2Very low158 Ų158151.8 Ų151.885%0.84578%0.782SS**  -172160.1127.4-93.6-28.7000113.6
278H33.5Very low35.7Very low177 Ų177153.1 Ų153.182%0.81979%0.793SS**  trans-85.1157.2-151.6-78-92.9000118.5
279K35.9Very low35.6Very low180 Ų180151.1 Ų151.178%0.78379%0.785SS**  trans-115.9170.9151.7-123.4-161.8176.2-179.90107.3
280P43.5Very low35.5Very low113 Ų113151.3 Ų151.373%0.73479%0.791SS**  cis-149169.738.840.3-18000120
281S29.4Very low35.4Very low97 Ų97150.3 Ų150.368%0.67879%0.787SS**  trans29.2141.9146.3-57.10000125
282R29.9Very low35.2Very low255 Ų255152.4 Ų152.496%0.96279%0.79SS**  -153.5161.2125.4-105.6164.8-157.9-170.35.6112.6
283H34Very low35.1Very low184 Ų184152.8 Ų152.885%0.85279%0.786SS**  trans-96.4172.7-161.2-108.5-40.7000114.5
284P38.8Very low34.1Very low117 Ų117152.6 Ų152.676%0.7679%0.788SS**  trans-86.8167.8179.937.7-35.9000113.5
285T32.9Very low33.8Very low139 Ų139152.5 Ų152.585%0.85379%0.787SS**  trans-122.4133.4-175.3-46.50000112.6
286A35.5Very low33.7Very low93 Ų93149.9 Ų149.977%0.76979%0.785SS**  trans-132.6148.9156.100000107
287P45.2Very low34Very low118 Ų118156.1 Ų156.177%0.76680%0.796SS**  -155-162.9104.143-23.5000111.5
288P43.6Very low34.3Very low130 Ų130154.4 Ų154.484%0.84479%0.794SS**  cis-127.7-172.2-4.340.9-22.8000115.8
289R28.2Very low34.4Very low211 Ų211152.5 Ų152.580%0.79679%0.789SS**  trans-113.7150.5-167.4-169.4-167.7-153-152.315.5110.8E291R289-E291 IonicContact NH1-OE1 3.16Å; R289-E291 PolarHBondContact NH1-OE1 2.96Å; R289-E291 VanDerWaalsContact NH1-OE1 3.16Å
290L30.6Very low34.8Very low172 Ų172149.4 Ų149.490%0.90179%0.787SS**  trans-124.8144.5163.4-150.779.5000110.5
291E30Very low34.1Very low134 Ų134149.7 Ų149.763%0.62679%0.792SS**  trans-87.2141.3-171.4-76.6-81.912800113.6R289R289-E291 IonicContact NH1-OE1 3.16Å; R289-E291 PolarHBondContact NH1-OE1 2.96Å; R289-E291 VanDerWaalsContact NH1-OE1 3.16Å
292R27.8Very low34.3Very low217 Ų217151.8 Ų151.882%0.81979%0.79SS**  171.3141.8109.7-93-176.6-162.5-155.44.7115.4
293H28.3Very low34.2Very low166 Ų166147.2 Ų147.277%0.76979%0.785SS**  trans70.6115.5146-76.655.6000121.3
294S30Very low34Very low111 Ų111145.7 Ų145.778%0.77678%0.779SS**  trans-102167.6147.1-53.60000109.6
295P42.3Very low33.6Very low109 Ų109146.3 Ų146.371%0.70879%0.785SS**  -134.7142.3127.58.313.9000116.3
296H28.5Very low33.7Very low187 Ų187147.7 Ų147.787%0.86679%0.787SS**  trans59.9119.1144.9-60.2-62.6000124.4
297R34.9Very low34.2Very low210 Ų210148.8 Ų148.879%0.79279%0.786SS**  trans-75.6167154.9-141.8-168.5-169.2-179.34.6109.9
298P36.7Very low33.5Very low123 Ų123150 Ų15080%0.79979%0.791SS**  -147.3159.978.932.7-11.7000117.7
299L35.7Very low33Very low136 Ų136148.9 Ų148.971%0.71279%0.787SS**  trans-99.6168.4156.1-131.583.1000107.2
300P45.2Very low33.2Very low116 Ų116148 Ų14875%0.75379%0.792SS**  cis-138.6-175.248.933.8-9.1000112.7
301S28.4Very low33.5Very low118 Ų118150.9 Ų150.983%0.82579%0.791SS**  -167.1-176.851.8-163.70000113.5
302H33.2Very low34.2Very low141 Ų141151.8 Ų151.865%0.65380%0.795SS**  trans-111.5151.2-154.5-168.858.3000112.9
303N27.7Very low34.9Very low160 Ų160147.2 Ų147.286%0.85679%0.793SS**  trans-165.8158.9143-103-22.9000113.4
304Q31.7Very low35.4Very low152 Ų152146.7 Ų146.771%0.7180%0.795SS**  trans-106151.5-161.5-57.9165.8-7.600113.6
305S30.4Very low35.9Very low129 Ų129152.7 Ų152.790%0.90280%0.801SS**  trans-171.8157.2137.713.80000112.8
306L35.1Very low35.9Very low169 Ų169156 Ų15689%0.88581%0.807SS**  trans-101.2178.7-176.7-96.6157.5000111.1
307P45.6Very low36.2Very low116 Ų116156.4 Ų156.475%0.75381%0.807SS**  trans-94.8164.8-137.339.4-38.8000115.4
308T30.6Very low36.3Very low142 Ų142154.1 Ų154.187%0.87181%0.805SS**  trans-113.9131.7171.5-38.30000111.4
309S32.6Very low36.4Very low107 Ų107158.2 Ų158.275%0.74880%0.804SS**  trans-82136.1172.4157.80000110.5
310E32.5Very low36.6Very low194 Ų194157.3 Ų157.391%0.90780%0.8SS**  trans-138.1151.3156.9-134.7-165.5138.100113.3
311R37.4Very low36.1Very low231 Ų231159.4 Ų159.487%0.87279%0.793SS**  trans-96156.2-175.7-70.3176.9176.4166.7-1.3111.1
312Q43.4Very low36.7Very low153 Ų153157.2 Ų157.272%0.71578%0.778SS**  trans-56.1163.2177.2-138173.1-7.200114
313P42.7Very low37.1Very low121 Ų121155.9 Ų155.979%0.78678%0.775SS**  -140.6152.596.537.6-25000116.5R315P313-R315 PolarHBondContact O-N 3Å
314L38.9Very low38.1Very low156 Ų156151.8 Ų151.882%0.81776%0.756SS**  trans-9286.3-177.6-17187.9000111
315R40.8Very low38.7Very low236 Ų236149.7 Ų149.789%0.89175%0.746SS**  trans-156.277.8179.2-167.1-178.2-90.6-161.1-5.9115.2P313P313-R315 PolarHBondContact O-N 3Å
316E42.8Very low39.3Very low178 Ų178145.1 Ų145.183%0.83272%0.72SS**SBendtrans-148.4-34.1167.8-125.3157-157.400115.1H318 R319E316-H318 PolarHBondContact O-N 3.42Å; E316-R319 PolarHBondContact O-N 3.19Å
317F34.4Very low39.8Very low196 Ų196143.9 Ų143.986%0.8671%0.709SS**Hα-helixtrans-60.7-15.2-172.1-156.5-97.7000116.9
318H36.1Very low39.9Very low162 Ų162143.5 Ų143.575%0.7570%0.697SS**Hα-helixtrans-93.5-17.6-173.7-162.250.3000114.8E316 S322E316-H318 PolarHBondContact O-N 3.42Å; H318-S322 PolarHBondContact O-OG 2.97Å
319R39.2Very low40.3Very low209 Ų209143.5 Ų143.579%0.78969%0.689SS**Hα-helixtrans-78.4-47.1176.8-82.3-177.4170163.5-5.1111.8E316 W321 S322 D323E316-R319 PolarHBondContact O-N 3.19Å; R319-W321 VanDerWaalsContact C-N 3.3Å; R319-W321 PolarHBondContact O-N 3.35Å; R319-S322 WeakPolarHBondContact O-CB 3.17Å; R319-S322 PolarHBondContact O-N 3.13Å; R319-D323 PolarHBondContact O-N 3.24Å
320D39.8Very low40.8Very low118 Ų118147.3 Ų147.363%0.63169%0.687SS**Hα-helixtrans-55.9-40.4-175.4-162.542.9000113.2S322 D323 V324D320-S322 VanDerWaalsContact C-N 3.28Å; D320-S322 PolarHBondContact O-N 3.34Å; D320-D323 PolarHBondContact O-N 2.93Å; D320-V324 WeakPolarHBondContact O-CG2 3.44Å; D320-V324 PolarHBondContact O-N 3.28Å; D320-V324 VanDerWaalsContact O-N 3.16Å
321W34.5Very low41.3Very low159 Ų159141 Ų14160%0.60267%0.665SS**Hα-helixtrans-60.8-35.4176-170-83.9000113.3R319 E325R319-W321 VanDerWaalsContact C-N 3.3Å; R319-W321 PolarHBondContact O-N 3.35Å; W321-E325 PolarHBondContact NE1-OE2 3.3Å; W321-E325 PolarHBondContact O-N 2.99Å
322S41.3Very low41.2Very low73 Ų73137.9 Ų137.951%0.5165%0.653SS.*Hα-helixtrans-74.7-36.4-176.2-57.50000111.9H318 R319 D320 G326H318-S322 PolarHBondContact O-OG 2.97Å; R319-S322 WeakPolarHBondContact O-CB 3.17Å; R319-S322 PolarHBondContact O-N 3.13Å; D320-S322 VanDerWaalsContact C-N 3.28Å; D320-S322 PolarHBondContact O-N 3.34Å; S322-G326 PolarHBondContact O-N 2.91Å; S322-G326 VanDerWaalsContact O-N 3.1Å
323D42.1Very low41.4Very low112 Ų112134.2 Ų134.260%0.59964%0.644SS**Hα-helixtrans-73.8-35.1177.6-73.2-48.3000112.1R319 D320 G326 Q327R319-D323 PolarHBondContact O-N 3.24Å; D320-D323 PolarHBondContact O-N 2.93Å; D323-G326 PolarHBondContact O-N 3.4Å; D323-Q327 WeakPolarHBondContact O-CG 3.3Å; D323-Q327 PolarHBondContact O-N 3.33Å
324V47.7Very low41.5Very low74 Ų74135.5 Ų135.545%0.44864%0.64SS.*Hα-helixtrans-62.3-47.1172.6171.40000111.5D320 G326 Q327 E328D320-V324 WeakPolarHBondContact O-CG2 3.44Å; D320-V324 PolarHBondContact O-N 3.28Å; D320-V324 VanDerWaalsContact O-N 3.16Å; V324-G326 VanDerWaalsContact C-N 3.31Å; V324-G326 PolarHBondContact O-N 3.33Å; V324-Q327 PolarHBondContact O-N 2.91Å; V324-E328 PolarHBondContact O-N 3.48Å
325E46Very low41.8Very low109 Ų109133.9 Ų133.951%0.50963%0.628SS.*Hα-helixtrans-69.1-31.5-179.9-159.7156170.100111.7W321 M329W321-E325 PolarHBondContact NE1-OE2 3.3Å; W321-E325 PolarHBondContact O-N 2.99Å; E325-M329 PolarHBondContact O-N 3.43Å; E325-M329 VanDerWaalsContact O-N 3.15Å
326G43.1Very low41.9Very low33 Ų33129.4 Ų129.434%0.3461%0.611SS.*Hα-helixtrans-65.9-37.9169.400000114.2S322 D323 V324 R330S322-G326 PolarHBondContact O-N 2.91Å; S322-G326 VanDerWaalsContact O-N 3.1Å; D323-G326 PolarHBondContact O-N 3.4Å; V324-G326 VanDerWaalsContact C-N 3.31Å; V324-G326 PolarHBondContact O-N 3.33Å; G326-R330 WeakPolarHBondContact O-CG 3.37Å; G326-R330 PolarHBondContact O-N 2.91Å
327Q45.5Very low42Very low142 Ų142122.4 Ų122.466%0.66459%0.586SS**Hα-helixtrans-70.1-40.6173-76.8-171.5-7.100112.3D323 V324 M329 R330 S331D323-Q327 WeakPolarHBondContact O-CG 3.3Å; D323-Q327 PolarHBondContact O-N 3.33Å; V324-Q327 PolarHBondContact O-N 2.91Å; Q327-M329 PolarHBondContact O-N 2.93Å; Q327-R330 PolarHBondContact O-N 3.35Å; Q327-S331 PolarHBondContact O-N 2.92Å
328E46.4Very low42.8Very low108 Ų108119.8 Ų119.851%0.50558%0.577SS.*Hα-helixtrans-62.3-42.7178.5-157.8172.7153.500110.7K113 V324 R330 S331 W332K113-E328 IonicContact NZ-OE1 3.82Å; V324-E328 PolarHBondContact O-N 3.48Å; E328-R330 PolarHBondContact O-N 3.45Å; E328-S331 PolarHBondContact O-N 3.36Å; E328-S331 PolarHBondContact O-OG 3.44Å; E328-W332 WeakPolarHBondContact O-CB 3.45Å; E328-W332 PolarHBondContact O-N 2.88Å
329M40.2Very low43.2Very low142 Ų142120.8 Ų120.870%0.757%0.574SS**Hα-helixtrans-62.3-38.4173.1-79.2-115-132.900114.3E325 Q327 S333E325-M329 PolarHBondContact O-N 3.43Å; E325-M329 VanDerWaalsContact O-N 3.15Å; Q327-M329 PolarHBondContact O-N 2.93Å; M329-S333 PolarHBondContact O-N 3.41Å; M329-S333 VanDerWaalsContact O-N 3.11Å; M329-S333 PolarHBondContact O-OG 2.89Å
330R41.9Very low43.7Very low188 Ų188116.1 Ų116.171%0.70956%0.561SS**Hα-helixtrans-68.2-43.2176-75.3-179.9-174.6165.35.2111.5G326 Q327 E328 W332 S333 Q334G326-R330 WeakPolarHBondContact O-CG 3.37Å; G326-R330 PolarHBondContact O-N 2.91Å; Q327-R330 PolarHBondContact O-N 3.35Å; E328-R330 PolarHBondContact O-N 3.45Å; R330-W332 VanDerWaalsContact C-N 3.33Å; R330-W332 PolarHBondContact O-N 3.47Å; R330-S333 PolarHBondContact O-N 3.35Å; R330-S333 PolarHBondContact O-OG 3Å; R330-Q334 WeakPolarHBondContact O-CB 3.28Å; R330-Q334 PolarHBondContact O-N 3.39Å
331S44.2Very low43.9Very low62 Ų62117.3 Ų117.343%0.43456%0.563SS.*Hα-helixtrans-61.9-40.417673.10000112.3Q327 E328 Q334 Q335Q327-S331 PolarHBondContact O-N 2.92Å; E328-S331 PolarHBondContact O-N 3.36Å; E328-S331 PolarHBondContact O-OG 3.44Å; S331-Q334 PolarHBondContact O-N 3.32Å; S331-Q335 VanDerWaalsContact O-CB 3.26Å; S331-Q335 WeakPolarHBondContact O-CB 3.23Å; S331-Q335 PolarHBondContact O-N 3.16Å
332W33.9Very low44.4Very low165 Ų165115.5 Ų115.563%0.62556%0.561SS**Hα-helixtrans-67.2-40.8179.9-170.1-88000113.2E328 R330 R336E328-W332 WeakPolarHBondContact O-CB 3.45Å; E328-W332 PolarHBondContact O-N 2.88Å; R330-W332 VanDerWaalsContact C-N 3.33Å; R330-W332 PolarHBondContact O-N 3.47Å; W332-R336 WeakPolarHBondContact O-CB 3.42Å; W332-R336 PolarHBondContact O-N 3.03Å
333S47.4Very low44.6Very low75 Ų75117.1 Ų117.152%0.52456%0.564SS.*Hα-helixtrans-69.8-41.2176.449.50000111.9M329 R330 R336 G337M329-S333 PolarHBondContact O-N 3.41Å; M329-S333 VanDerWaalsContact O-N 3.11Å; M329-S333 PolarHBondContact O-OG 2.89Å; R330-S333 PolarHBondContact O-N 3.35Å; R330-S333 PolarHBondContact O-OG 3Å; S333-R336 PolarHBondContact O-N 3.08Å; S333-G337 PolarHBondContact O-N 3.29Å
334Q46Very low45Very low148 Ų148117.7 Ų117.769%0.69257%0.566SS**Hα-helixtrans-63.7-41.7175.1-166.6164.8-5.300112R330 S331 R336 G337 Q338R330-Q334 WeakPolarHBondContact O-CB 3.28Å; R330-Q334 PolarHBondContact O-N 3.39Å; S331-Q334 PolarHBondContact O-N 3.32Å; Q334-R336 VanDerWaalsContact C-N 3.34Å; Q334-R336 PolarHBondContact O-N 3.04Å; Q334-G337 PolarHBondContact O-N 2.92Å; Q334-Q338 WeakPolarHBondContact O-CB 3.44Å; Q334-Q338 PolarHBondContact O-N 2.93Å
335Q44.1Very low44.7Very low122 Ų122123.7 Ų123.757%0.5758%0.581SS**Hα-helixtrans-69.1-28.7176-169.3172.10.600113S331 R339S331-Q335 VanDerWaalsContact O-CB 3.26Å; S331-Q335 WeakPolarHBondContact O-CB 3.23Å; S331-Q335 PolarHBondContact O-N 3.16Å; Q335-R339 PolarHBondContact O-N 3.28Å
336R44Very low44.7Very low142 Ų142126.7 Ų126.754%0.53659%0.587SS.*Hα-helixtrans-70.5-48.5172-173.1177.4-72.2177.3-6111.4W332 S333 Q334 Q338 R339 E340W332-R336 WeakPolarHBondContact O-CB 3.42Å; W332-R336 PolarHBondContact O-N 3.03Å; S333-R336 PolarHBondContact O-N 3.08Å; Q334-R336 VanDerWaalsContact C-N 3.34Å; Q334-R336 PolarHBondContact O-N 3.04Å; R336-Q338 VanDerWaalsContact C-N 3.32Å; R336-Q338 PolarHBondContact O-N 2.72Å; R336-R339 WeakPolarHBondContact O-CB 3.06Å; R336-R339 PolarHBondContact O-N 2.99Å; R336-R339 VanDerWaalsContact O-N 3.09Å; R336-E340 PolarHBondContact O-N 2.87Å; R336-E340 VanDerWaalsContact O-N 3.08Å
337G45Very low44.5Very low31 Ų31127.7 Ų127.732%0.3260%0.598SS.*Hα-helixtrans-60.9-38.4177.100000113.2S333 Q334 R339 E340 H341S333-G337 PolarHBondContact O-N 3.29Å; Q334-G337 PolarHBondContact O-N 2.92Å; G337-R339 VanDerWaalsContact C-N 3.3Å; G337-R339 PolarHBondContact O-N 3.21Å; G337-E340 PolarHBondContact O-N 3.25Å; G337-H341 PolarHBondContact O-N 3.47Å; G337-H341 VanDerWaalsContact O-N 3.09Å
338Q50.5Low44.3Very low141 Ų141126.1 Ų126.166%0.65960%0.598SS**Hα-helixtrans-65.9-32.6175.6-142.8176.113.200112.5Q334 R336 H342Q334-Q338 WeakPolarHBondContact O-CB 3.44Å; Q334-Q338 PolarHBondContact O-N 2.93Å; R336-Q338 VanDerWaalsContact C-N 3.32Å; R336-Q338 PolarHBondContact O-N 2.72Å; Q338-H342 PolarHBondContact O-N 2.9Å
339R43.6Very low44.1Very low184 Ų184125.6 Ų125.669%0.69461%0.607SS**Hα-helixtrans-69.7-40.9174.3-117.4179.7-174.5-179.72.4112.6Q335 R336 G337 H342 N343Q335-R339 PolarHBondContact O-N 3.28Å; R336-R339 WeakPolarHBondContact O-CB 3.06Å; R336-R339 PolarHBondContact O-N 2.99Å; R336-R339 VanDerWaalsContact O-N 3.09Å; G337-R339 VanDerWaalsContact C-N 3.3Å; G337-R339 PolarHBondContact O-N 3.21Å; R339-H342 PolarHBondContact O-N 3.21Å; R339-N343 PolarHBondContact O-N 3.43Å; R339-N343 PolarHBondContact O-ND2 2.97Å
340E49.3Very low44Very low111 Ų111125.6 Ų125.652%0.51961%0.609SS.*Hα-helixtrans-66.9-43.3179-73.2171.5-170.700111.3R336 G337 H342 N343 L344R336-E340 PolarHBondContact O-N 2.87Å; R336-E340 VanDerWaalsContact O-N 3.08Å; G337-E340 PolarHBondContact O-N 3.25Å; E340-H342 VanDerWaalsContact C-N 3.33Å; E340-H342 PolarHBondContact O-N 2.88Å; E340-N343 PolarHBondContact O-N 3.07Å; E340-L344 WeakPolarHBondContact O-CB 3.46Å; E340-L344 PolarHBondContact O-N 3.27Å
341H44.6Very low43.9Very low143 Ų143127 Ų12766%0.66262%0.615SS**Hα-helixtrans-61.3-36.9171.7-90.7-82000113.5G337 R345G337-H341 PolarHBondContact O-N 3.47Å; G337-H341 VanDerWaalsContact O-N 3.09Å; H341-R345 WeakPolarHBondContact O-CB 3.32Å; H341-R345 PolarHBondContact O-N 3.09Å; H341-R345 VanDerWaalsContact O-N 3.08Å
342H45.3Very low43.7Very low121 Ų121133.6 Ų133.656%0.5664%0.636SS**Hα-helixtrans-69.2-37.1175.7-112.852.9000113Q338 R339 E340 R346Q338-H342 PolarHBondContact O-N 2.9Å; R339-H342 PolarHBondContact O-N 3.21Å; E340-H342 VanDerWaalsContact C-N 3.33Å; E340-H342 PolarHBondContact O-N 2.88Å; H342-R346 PolarHBondContact O-N 2.69Å
343N45.2Very low44Very low107 Ų107131.2 Ų131.257%0.57264%0.644SS**Hα-helixtrans-72.2-40.1177.3-72.1-19.4000111.9R339 E340 R345 R346 G347R339-N343 PolarHBondContact O-N 3.43Å; R339-N343 PolarHBondContact O-ND2 2.97Å; E340-N343 PolarHBondContact O-N 3.07Å; N343-R345 VanDerWaalsContact C-N 3.35Å; N343-R345 PolarHBondContact O-N 3.27Å; N343-R346 PolarHBondContact O-N 3.2Å; N343-G347 PolarHBondContact O-N 3.27Å
344L49.9Very low43.6Very low123 Ų123134 Ų13464%0.64466%0.658SS**Hα-helixtrans-63.7-37.5174-79.1163000112.5E340 R346 T348E340-L344 WeakPolarHBondContact O-CB 3.46Å; E340-L344 PolarHBondContact O-N 3.27Å; L344-R346 VanDerWaalsContact C-N 3.32Å; L344-R346 PolarHBondContact O-N 2.99Å; L344-T348 PolarHBondContact O-OG1 3.29Å; L344-T348 VanDerWaalsContact O-OG1 3.08Å
345R42.8Very low43Very low200 Ų200138.8 Ų138.876%0.75567%0.67SS**Hα-helixtrans-72.8-21.6176-165176.1-175.4-151.51113.5H341 N343 T348H341-R345 WeakPolarHBondContact O-CB 3.32Å; H341-R345 PolarHBondContact O-N 3.09Å; H341-R345 VanDerWaalsContact O-N 3.08Å; N343-R345 VanDerWaalsContact C-N 3.35Å; N343-R345 PolarHBondContact O-N 3.27Å; R345-T348 PolarHBondContact O-OG1 3.29Å
346R44.7Very low42.6Very low172 Ų172144.4 Ų144.465%0.64970%0.701SS**Hα-helixtrans-87.8-35.3175.4-160.1175-70.8177.7-4.9112H342 N343 L344 T348 S349H342-R346 PolarHBondContact O-N 2.69Å; N343-R346 PolarHBondContact O-N 3.2Å; L344-R346 VanDerWaalsContact C-N 3.32Å; L344-R346 PolarHBondContact O-N 2.99Å; R346-T348 PolarHBondContact O-N 3.25Å; R346-S349 PolarHBondContact O-N 3.06Å
347G39.4Very low42.6Very low55 Ų55144.5 Ų144.557%0.56771%0.709SS**THydrogen-bonded Turntrans-69.8-9.5176.900000116N343N343-G347 PolarHBondContact O-N 3.27Å
348T42.5Very low42.4Very low109 Ų109150.5 Ų150.567%0.66973%0.73SS**THydrogen-bonded Turntrans-102.8-8.1179.744.40000114.6L344 R345 R346L344-T348 PolarHBondContact O-OG1 3.29Å; L344-T348 VanDerWaalsContact O-OG1 3.08Å; R345-T348 PolarHBondContact O-OG1 3.29Å; R346-T348 PolarHBondContact O-N 3.25Å
349S40.6Very low42Very low97 Ų97151 Ų15168%0.67873%0.734SS**THydrogen-bonded Turntrans-94-22.7-179.6-158.70000114.1R346 R351R346-S349 PolarHBondContact O-N 3.06Å; S349-R351 PolarHBondContact O-N 3.16Å
350D39.2Very low41.9Very low141 Ų141149.1 Ų149.175%0.75474%0.736SS**SBendtrans-98.929.3-173.3-64-25.6000113.2
351R39.7Very low41.4Very low218 Ų218151.4 Ų151.482%0.82375%0.75SS**SBendtrans-125.812.3-174.3-125.3-174.9-159-164.36.5116.8S349S349-R351 PolarHBondContact O-N 3.16Å
352F40.8Very low41.2Very low201 Ų201152 Ų15288%0.88276%0.756SS**SBendtrans-141.376.2176.1-81.1-77.9000112.5
353S39.2Very low40.9Very low115 Ų115154.2 Ų154.280%0.80477%0.769SS**  trans-175.8160.3148.320.10000109.7
354V38.4Very low40.6Very low133 Ų133157.8 Ų157.881%0.80679%0.785SS**  trans72.972.9-174.5-164.40000114.3
355W35.3Very low39.8Very low248 Ų248160.8 Ų160.894%0.93980%0.796SS**  -158.4140.4128.8-10096.7000108.1
356I35.6Very low39.6Very low240 Ų240157.2 Ų157.2100%1.23180%0.8SS**  trans75.20-166.6-48.9174.8000112.5

Retrieved 356 of 356 residues in 261 ms (Link to these results)