A0A087Y7I9_POEFO Loading...

Endoplasmic reticulum junction formation protein lunapark

Plays a role in determining ER morphology.

AlphaFold DB , UniProt , Accession A0A087Y7I9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 411 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M47.6Very low54.6Low250 Ų250151.9 Ų151.9100%1.23279%0.791SS**  0112.30-68.6172.6-82.900108
2G54.1Low55.5Low57 Ų57145.9 Ų145.959%0.58877%0.769SS**  trans-152.3-26.6-173.700000116.6A4G2-A4 PolarHBondContact O-N 3.48Å; G2-A4 VanDerWaalsContact O-N 3.1Å
3A55.9Low57.6Low88 Ų88139.1 Ų139.173%0.72774%0.74SS**THydrogen-bonded Turntrans-67.3-11.4-17500000115.7
4A56.4Low59.4Low78 Ų78132.6 Ų132.665%0.64571%0.709SS**THydrogen-bonded Turntrans-78.4-30.3-177.900000113.6G2G2-A4 PolarHBondContact O-N 3.48Å; G2-A4 VanDerWaalsContact O-N 3.1Å
5I56.9Low61.2Low136 Ų136127.7 Ų127.770%0.69769%0.686SS**G310 helixtrans-79.3-25.5-166.8-60.1175.4000112.2R7 W8I5-R7 VanDerWaalsContact C-N 3.29Å; I5-R7 PolarHBondContact O-N 3.23Å; I5-W8 PolarHBondContact O-N 2.83Å
6S55.2Low62.9Low91 Ų91126.9 Ų126.964%0.63668%0.676SS**G310 helixtrans-68.3-25.5178.859.50000113.6W8S6-W8 VanDerWaalsContact C-N 3.25Å; S6-W8 PolarHBondContact O-N 3.19Å
7R54Low64.4Low221 Ų221122.1 Ų122.183%0.83465%0.652SS**G310 helixtrans-74.7-6.8-178.4-73.3-172.1169.2-162.9-3.5114.9I5I5-R7 VanDerWaalsContact C-N 3.29Å; I5-R7 PolarHBondContact O-N 3.23Å
8W53.7Low65.9Low238 Ų238115.3 Ų115.390%0.90262%0.616SS**G310 helixtrans-109.87.6179.5-77.8-11.5000114.8I5 S6 A10I5-W8 PolarHBondContact O-N 2.83Å; S6-W8 VanDerWaalsContact C-N 3.25Å; S6-W8 PolarHBondContact O-N 3.19Å; W8-A10 PolarHBondContact O-N 3.37Å; W8-A10 VanDerWaalsContact O-N 3.08Å
9R50.9Low67.2Low224 Ų224114 Ų11485%0.84561%0.606SS**  trans-74.697.1158.9-70.3-161.6-178.9-1532.2108.8
10A58.5Low68.5Low89 Ų89116.5 Ų116.574%0.73661%0.607SS**PPolyproline II helixtrans-51.2144.815900000109.1W8W8-A10 PolarHBondContact O-N 3.37Å; W8-A10 VanDerWaalsContact O-N 3.08Å
11K57.4Low69.7Low199 Ų199111.4 Ų111.487%0.86558%0.58SS**PPolyproline II helixtrans-60.3133.9170.9-63.4-177.5179.6-176.20107.7
12P65.3Low71.8Confident80 Ų80102 Ų10252%0.51953%0.533SS..PPolyproline II helixtrans-58.2146.6172.827.7-34.6000108.8E16P12-E16 WeakPolarHBondContact CA-OE2 3.22Å
13S82.5Confident73.8Confident57 Ų57104.7 Ų104.740%0.39953%0.529SS..PPolyproline II helixtrans-68.3156-178.964.30000111.4V15 E16 T17S13-V15 PolarHBondContact O-N 2.88Å; S13-E16 PolarHBondContact N-OE2 3.41Å; S13-E16 PolarHBondContact O-N 2.9Å; S13-E16 WeakPolarHBondContact OG-CB 3.15Å; S13-E16 PolarHBondContact OG-N 3.07Å; S13-T17 WeakPolarHBondContact O-CB 3.49Å; S13-T17 PolarHBondContact O-N 3.4Å; S13-T17 PolarHBondContact O-OG1 3.43Å
14T83.1Confident75.6Confident49 Ų49103.9 Ų103.930%0.30151%0.51SS..Hα-helixtrans-53.1-44.3171.1440000110.1T17 L18 V123 E127T14-T17 PolarHBondContact O-N 2.99Å; T14-L18 WeakPolarHBondContact O-CB 3.15Å; T14-L18 VanDerWaalsContact O-CG 3.3Å; T14-L18 WeakPolarHBondContact O-CG 3.4Å; T14-L18 PolarHBondContact O-N 2.76Å; T14-V123 HydrophobicContact CG2-CG2 4.01Å; T14-E127 PolarHBondContact OG1-OE1 2.98Å
15V87.1Confident77.4Confident59 Ų59100.9 Ų100.936%0.35848%0.483SS..Hα-helixtrans-58.8-51.2174.1175.40000113.3S13 T17 L18 E19 I135 F139S13-V15 PolarHBondContact O-N 2.88Å; V15-T17 VanDerWaalsContact C-N 3.3Å; V15-T17 PolarHBondContact O-N 3.16Å; V15-L18 PolarHBondContact O-N 2.85Å; V15-E19 WeakPolarHBondContact O-CB 3.2Å; V15-E19 PolarHBondContact O-N 3.39Å; V15-I135 HydrophobicContact CG2-CD1 3.99Å; V15-I135 HydrophobicContact CG2-CG1 3.94Å; V15-F139 HydrophobicContact CB-CE2 4.49Å; V15-F139 HydrophobicContact CG1-CE2 4.04Å; V15-F139 HydrophobicContact CG1-CZ 4.12Å
16E88Confident79.1Confident115 Ų115100.4 Ų100.454%0.53748%0.478SS..Hα-helixtrans-63-37.5179.9179.3-175.5-173.400111.8P12 S13 E19 R20P12-E16 WeakPolarHBondContact CA-OE2 3.22Å; S13-E16 PolarHBondContact N-OE2 3.41Å; S13-E16 PolarHBondContact O-N 2.9Å; S13-E16 WeakPolarHBondContact OG-CB 3.15Å; S13-E16 PolarHBondContact OG-N 3.07Å; E16-E19 PolarHBondContact O-N 3.03Å; E16-R20 WeakPolarHBondContact O-CB 3.37Å; E16-R20 PolarHBondContact O-N 3.22Å
17T88.9Confident80.9Confident44 Ų4499.4 Ų99.427%0.2747%0.468SS..Hα-helixtrans-68.2-42.9176.4-51.60000111.1S13 T14 V15 R20 L21 I119S13-T17 WeakPolarHBondContact O-CB 3.49Å; S13-T17 PolarHBondContact O-N 3.4Å; S13-T17 PolarHBondContact O-OG1 3.43Å; T14-T17 PolarHBondContact O-N 2.99Å; V15-T17 VanDerWaalsContact C-N 3.3Å; V15-T17 PolarHBondContact O-N 3.16Å; T17-R20 WeakPolarHBondContact O-CB 3.38Å; T17-R20 PolarHBondContact O-N 3Å; T17-L21 WeakPolarHBondContact O-CG 3.43Å; T17-L21 PolarHBondContact O-N 2.86Å; T17-I119 HydrophobicContact CG2-CD1 3.89Å
18L91.4Very high82.7Confident0 Ų090.7 Ų90.70%044%0.438CS..Hα-helixtrans-65.3-39.4174.1-73.6168.8000112.5T14 V15 R20 L21 E22 K116 I119 L120 I135 F139T14-L18 WeakPolarHBondContact O-CB 3.15Å; T14-L18 VanDerWaalsContact O-CG 3.3Å; T14-L18 WeakPolarHBondContact O-CG 3.4Å; T14-L18 PolarHBondContact O-N 2.76Å; V15-L18 PolarHBondContact O-N 2.85Å; L18-R20 VanDerWaalsContact C-N 3.34Å; L18-L21 PolarHBondContact O-N 2.9Å; L18-E22 WeakPolarHBondContact O-CB 3.29Å; L18-E22 PolarHBondContact O-N 3.33Å; L18-K116 HydrophobicContact CD2-CG 3.78Å; L18-I119 HydrophobicContact CD1-CG2 4.12Å; L18-I119 HydrophobicContact CD2-CB 3.99Å; L18-I119 HydrophobicContact CD2-CG2 3.8Å; L18-I119 HydrophobicContact CG-CG2 3.81Å; L18-L120 HydrophobicContact CD1-CD2 4.27Å; L18-L120 HydrophobicContact CD2-CG 4.21Å; L18-I135 HydrophobicContact CD1-CG2 3.48Å; L18-I135 VanDerWaalsContact CD1-CG2 3.48Å; L18-F139 HydrophobicContact CB-CD1 3.83Å; L18-F139 HydrophobicContact CB-CD2 4.03Å; L18-F139 HydrophobicContact CB-CE1 3.84Å; L18-F139 HydrophobicContact CB-CE2 4.03Å; L18-F139 HydrophobicContact CB-CG 3.92Å; L18-F139 HydrophobicContact CB-CZ 3.92Å; L18-F139 HydrophobicContact CD1-CB 4.36Å; L18-F139 HydrophobicContact CD1-CD2 3.82Å; L18-F139 HydrophobicContact CD1-CE2 4.28Å; L18-F139 HydrophobicContact CD1-CG 4.12Å
19E90.7Very high84.5Confident91 Ų9183.5 Ų83.543%0.42541%0.414SS..Hα-helixtrans-66.5-37.2176.2-165.4-171.8151.700111.7V15 E16 K23 F139V15-E19 WeakPolarHBondContact O-CB 3.2Å; V15-E19 PolarHBondContact O-N 3.39Å; E16-E19 PolarHBondContact O-N 3.03Å; E19-K23 VanDerWaalsContact O-CG 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.45Å; E19-K23 PolarHBondContact O-N 2.86Å; E19-K23 VanDerWaalsContact O-N 3.07Å; E19-K23 WeakPolarHBondContact OE1-CE 3.41Å; E19-K23 IonicContact OE1-NZ 3.01Å; E19-K23 PolarHBondContact OE1-NZ 3.48Å; E19-F139 HydrophobicContact CB-CE1 4.16Å; E19-F139 HydrophobicContact CB-CZ 4.19Å
20R93.1Very high86.4Confident163 Ų16376.5 Ų76.562%0.61539%0.393SS*.Hα-helixtrans-62.2-50.4171.9-176.1-177.9-169138.38.4111.7E16 T17 L18 E22 K23 E24E16-R20 WeakPolarHBondContact O-CB 3.37Å; E16-R20 PolarHBondContact O-N 3.22Å; T17-R20 WeakPolarHBondContact O-CB 3.38Å; T17-R20 PolarHBondContact O-N 3Å; L18-R20 VanDerWaalsContact C-N 3.34Å; R20-E22 VanDerWaalsContact C-N 3.33Å; R20-E22 PolarHBondContact O-N 3.01Å; R20-K23 PolarHBondContact O-N 2.66Å; R20-E24 HydrophobicContact CG-CG 4.5Å; R20-E24 VanDerWaalsContact CG-OE1 3.27Å; R20-E24 WeakPolarHBondContact CG-OE1 3.33Å; R20-E24 IonicContact CZ-OE1 2.85Å; R20-E24 IonicContact NE-OE1 2.56Å; R20-E24 PolarHBondContact NE-OE1 3.13Å; R20-E24 IonicContact NH2-OE1 2.61Å; R20-E24 WeakPolarHBondContact O-CG 3.49Å; R20-E24 PolarHBondContact O-N 3.07Å
21L93.6Very high87.8Confident10 Ų1078.7 Ų78.75%0.05238%0.384CS..Hα-helixtrans-60.3-41.8177.8-71.4173.4000111.6T17 L18 K23 E24 I25 L112 Q115 K116 I119T17-L21 WeakPolarHBondContact O-CG 3.43Å; T17-L21 PolarHBondContact O-N 2.86Å; L18-L21 PolarHBondContact O-N 2.9Å; L21-K23 VanDerWaalsContact C-N 3.35Å; L21-K23 PolarHBondContact O-N 3.29Å; L21-E24 PolarHBondContact O-N 2.95Å; L21-I25 VanDerWaalsContact O-CB 3.28Å; L21-I25 WeakPolarHBondContact O-CB 3.48Å; L21-I25 WeakPolarHBondContact O-CD1 3.46Å; L21-I25 WeakPolarHBondContact O-CG1 3.37Å; L21-I25 PolarHBondContact O-N 2.89Å; L21-L112 HydrophobicContact CD2-CD2 3.5Å; L21-L112 VanDerWaalsContact CD2-CD2 3.5Å; L21-Q115 HydrophobicContact CD1-CB 4.27Å; L21-K116 HydrophobicContact CD1-CB 4.23Å; L21-I119 HydrophobicContact CD1-CD1 3.7Å
22E91.7Very high89.3Confident54 Ų5470.8 Ų70.825%0.25236%0.359SS..Hα-helixtrans-62.2-39.2176.7-171.7124.3-90.300111.8L18 R20 Q26 K116 K144L18-E22 WeakPolarHBondContact O-CB 3.29Å; L18-E22 PolarHBondContact O-N 3.33Å; R20-E22 VanDerWaalsContact C-N 3.33Å; R20-E22 PolarHBondContact O-N 3.01Å; E22-Q26 VanDerWaalsContact O-CB 3.26Å; E22-Q26 WeakPolarHBondContact O-CB 3.3Å; E22-Q26 PolarHBondContact O-N 3.02Å; E22-K116 IonicContact OE1-NZ 2.74Å; E22-K116 PolarHBondContact OE1-NZ 3.42Å; E22-K116 IonicContact OE2-NZ 2.7Å; E22-K144 IonicContact OE2-NZ 3.75Å
23K94.7Very high90.3Very high113 Ų11372.5 Ų72.549%0.49136%0.36SS..Hα-helixtrans-67.6-43173.3-71.6166.5-175.7166.60113.1E19 R20 L21 Q26 T27E19-K23 VanDerWaalsContact O-CG 3.32Å; E19-K23 WeakPolarHBondContact O-CG 3.45Å; E19-K23 PolarHBondContact O-N 2.86Å; E19-K23 VanDerWaalsContact O-N 3.07Å; E19-K23 WeakPolarHBondContact OE1-CE 3.41Å; E19-K23 IonicContact OE1-NZ 3.01Å; E19-K23 PolarHBondContact OE1-NZ 3.48Å; R20-K23 PolarHBondContact O-N 2.66Å; L21-K23 VanDerWaalsContact C-N 3.35Å; L21-K23 PolarHBondContact O-N 3.29Å; K23-Q26 PolarHBondContact O-N 2.89Å; K23-T27 WeakPolarHBondContact O-CB 3.39Å; K23-T27 WeakPolarHBondContact O-CG2 3.36Å; K23-T27 PolarHBondContact O-N 3.36Å; K23-T27 PolarHBondContact O-OG1 2.68Å
24E94Very high90.5Very high71 Ų7174.3 Ų74.333%0.33236%0.361SS..Hα-helixtrans-68.1-40179.4-70.4178.9-161.300111.1R20 L21 T27 L28 L112R20-E24 HydrophobicContact CG-CG 4.5Å; R20-E24 VanDerWaalsContact CG-OE1 3.27Å; R20-E24 WeakPolarHBondContact CG-OE1 3.33Å; R20-E24 IonicContact CZ-OE1 2.85Å; R20-E24 IonicContact NE-OE1 2.56Å; R20-E24 PolarHBondContact NE-OE1 3.13Å; R20-E24 IonicContact NH2-OE1 2.61Å; R20-E24 WeakPolarHBondContact O-CG 3.49Å; R20-E24 PolarHBondContact O-N 3.07Å; L21-E24 PolarHBondContact O-N 2.95Å; E24-T27 PolarHBondContact O-OG1 2.79Å; E24-T27 VanDerWaalsContact O-OG1 3.06Å; E24-L28 WeakPolarHBondContact O-CB 3.36Å; E24-L28 WeakPolarHBondContact O-CG 3.25Å; E24-L28 PolarHBondContact O-N 3.3Å; E24-L28 VanDerWaalsContact O-N 3.13Å; E24-L112 HydrophobicContact CB-CD1 4.22Å
25I94.2Very high90.6Very high14 Ų1475.3 Ų75.37%0.07236%0.36CS..Hα-helixtrans-58.9-54.3169.4-72.8164.8000110.9L21 T27 L28 E29 L109 L112 K113 K116L21-I25 VanDerWaalsContact O-CB 3.28Å; L21-I25 WeakPolarHBondContact O-CB 3.48Å; L21-I25 WeakPolarHBondContact O-CD1 3.46Å; L21-I25 WeakPolarHBondContact O-CG1 3.37Å; L21-I25 PolarHBondContact O-N 2.89Å; I25-T27 VanDerWaalsContact C-N 3.34Å; I25-T27 PolarHBondContact O-N 2.92Å; I25-L28 PolarHBondContact O-N 2.93Å; I25-E29 PolarHBondContact O-N 3.19Å; I25-L109 HydrophobicContact CB-CD1 4.28Å; I25-L109 HydrophobicContact CG1-CD1 4.38Å; I25-L109 HydrophobicContact CG2-CD1 3.9Å; I25-L112 HydrophobicContact CD1-CB 4.3Å; I25-L112 HydrophobicContact CG1-CB 3.78Å; I25-K113 HydrophobicContact CD1-CG 3.86Å; I25-K113 HydrophobicContact CG1-CG 4.2Å; I25-K113 HydrophobicContact CG2-CG 4.44Å; I25-K116 HydrophobicContact CD1-CB 4.33Å; I25-K116 HydrophobicContact CD1-CD 4.06Å
26Q93.6Very high90.4Very high126 Ų12676.5 Ų76.559%0.58936%0.361SS*.Hα-helixtrans-63.8-39.4-174.5-171.5172.313.800111.8E22 K23 E29 D30E22-Q26 VanDerWaalsContact O-CB 3.26Å; E22-Q26 WeakPolarHBondContact O-CB 3.3Å; E22-Q26 PolarHBondContact O-N 3.02Å; K23-Q26 PolarHBondContact O-N 2.89Å; Q26-E29 PolarHBondContact O-N 3.42Å; Q26-D30 WeakPolarHBondContact O-CB 3.5Å; Q26-D30 PolarHBondContact O-N 2.88Å
27T92.9Very high90.3Very high71 Ų7176.7 Ų76.744%0.43636%0.36SS..Hα-helixtrans-65.8-39.3175.649.80000112.5K23 E24 I25 D30 Y31K23-T27 WeakPolarHBondContact O-CB 3.39Å; K23-T27 WeakPolarHBondContact O-CG2 3.36Å; K23-T27 PolarHBondContact O-N 3.36Å; K23-T27 PolarHBondContact O-OG1 2.68Å; E24-T27 PolarHBondContact O-OG1 2.79Å; E24-T27 VanDerWaalsContact O-OG1 3.06Å; I25-T27 VanDerWaalsContact C-N 3.34Å; I25-T27 PolarHBondContact O-N 2.92Å; T27-D30 PolarHBondContact O-N 2.82Å; T27-Y31 WeakPolarHBondContact O-CB 3.35Å; T27-Y31 WeakPolarHBondContact O-CD2 3.11Å; T27-Y31 PolarHBondContact O-N 2.92Å
28L92.1Very high90.2Very high38 Ų3879.4 Ų79.420%0.19937%0.37CS..Hα-helixtrans-62.8-41.3174.4-84.4163.4000112.8E24 I25 Y31 G32 N105 L109 L112E24-L28 WeakPolarHBondContact O-CB 3.36Å; E24-L28 WeakPolarHBondContact O-CG 3.25Å; E24-L28 PolarHBondContact O-N 3.3Å; E24-L28 VanDerWaalsContact O-N 3.13Å; I25-L28 PolarHBondContact O-N 2.93Å; L28-Y31 PolarHBondContact O-N 3.28Å; L28-G32 PolarHBondContact O-N 3.46Å; L28-N105 HydrophobicContact CD2-CB 4.45Å; L28-L109 HydrophobicContact CB-CD1 4.06Å; L28-L112 HydrophobicContact CD1-CD1 3.45Å; L28-L112 VanDerWaalsContact CD1-CD1 3.45Å
29E91.1Very high89.9Confident86 Ų8681.2 Ų81.240%0.40238%0.379SS..Hα-helixtrans-64.3-46.7175.1-70179.7154.600111.4I25 Q26 Y31 G32 E33 L109 K113I25-E29 PolarHBondContact O-N 3.19Å; Q26-E29 PolarHBondContact O-N 3.42Å; E29-Y31 VanDerWaalsContact C-N 3.32Å; E29-Y31 PolarHBondContact O-N 2.86Å; E29-G32 PolarHBondContact O-N 3.29Å; E29-G32 VanDerWaalsContact O-N 3.09Å; E29-E33 PolarHBondContact O-N 2.93Å; E29-L109 HydrophobicContact CG-CD1 3.85Å; E29-L109 HydrophobicContact CG-CD2 3.72Å; E29-L109 HydrophobicContact CG-CG 4.44Å; E29-K113 VanDerWaalsContact OE1-CE 3.27Å; E29-K113 WeakPolarHBondContact OE1-CE 3.17Å; E29-K113 IonicContact OE1-NZ 2.91Å; E29-K113 PolarHBondContact OE1-NZ 2.85Å
30D90.2Very high89.7Confident77 Ų7784.1 Ų84.141%0.41239%0.391SS..Hα-helixtrans-57.8-43174.8-118.526.3000111.9Q26 T27 K34Q26-D30 WeakPolarHBondContact O-CB 3.5Å; Q26-D30 PolarHBondContact O-N 2.88Å; T27-D30 PolarHBondContact O-N 2.82Å; D30-K34 VanDerWaalsContact CG-NZ 3.31Å; D30-K34 WeakPolarHBondContact O-CB 3.49Å; D30-K34 WeakPolarHBondContact O-CD 3.41Å; D30-K34 WeakPolarHBondContact O-CE 3.2Å; D30-K34 WeakPolarHBondContact O-CG 3.31Å; D30-K34 PolarHBondContact O-N 3.42Å; D30-K34 VanDerWaalsContact O-N 3.09Å; D30-K34 WeakPolarHBondContact OD2-CE 3.38Å; D30-K34 IonicContact OD2-NZ 2.93Å; D30-K34 PolarHBondContact OD2-NZ 2.97Å
31Y89.1Confident89.5Confident135 Ų13584.3 Ų84.353%0.52940%0.396SS..Hα-helixtrans-65.4-41.3174.5-79.6-57.3000111.5T27 L28 E29 E33 K34 Y35T27-Y31 WeakPolarHBondContact O-CB 3.35Å; T27-Y31 WeakPolarHBondContact O-CD2 3.11Å; T27-Y31 PolarHBondContact O-N 2.92Å; L28-Y31 PolarHBondContact O-N 3.28Å; E29-Y31 VanDerWaalsContact C-N 3.32Å; E29-Y31 PolarHBondContact O-N 2.86Å; Y31-E33 PolarHBondContact O-N 3.36Å; Y31-K34 PolarHBondContact O-N 2.96Å; Y31-Y35 WeakPolarHBondContact O-CB 3.36Å; Y31-Y35 WeakPolarHBondContact O-CD2 3.41Å; Y31-Y35 PolarHBondContact O-N 3.34Å
32G87.4Confident89.2Confident34 Ų3492.5 Ų92.535%0.35143%0.426SS..Hα-helixtrans-56.5-48.8176.200000112.7L28 E29 Y35 Q36L28-G32 PolarHBondContact O-N 3.46Å; E29-G32 PolarHBondContact O-N 3.29Å; E29-G32 VanDerWaalsContact O-N 3.09Å; G32-Y35 PolarHBondContact O-N 3Å; G32-Q36 WeakPolarHBondContact O-CG 3.35Å; G32-Q36 PolarHBondContact O-N 3.16Å
33E86.9Confident89.1Confident115 Ų11591 Ų9154%0.53742%0.42SS..Hα-helixtrans-60.7-46.9174.7-81.6-142.1177.100112.8E29 Y31 Y35 Q36 K37E29-E33 PolarHBondContact O-N 2.93Å; Y31-E33 PolarHBondContact O-N 3.36Å; E33-Y35 PolarHBondContact O-N 3.18Å; E33-Q36 PolarHBondContact O-N 2.71Å; E33-K37 WeakPolarHBondContact O-CD 3.47Å; E33-K37 VanDerWaalsContact O-CG 3.31Å; E33-K37 WeakPolarHBondContact O-CG 3.44Å; E33-K37 PolarHBondContact O-N 3.42Å; E33-K37 WeakPolarHBondContact OE2-CE 3.27Å; E33-K37 IonicContact OE2-NZ 3.65Å; E33-K37 PolarHBondContact OE2-NZ 3.5Å
34K87.4Confident88.8Confident95 Ų9587 Ų8741%0.41341%0.412SS..Hα-helixtrans-63.6-41.6-178.7-69.3161.9-160173.10110.8D30 Y31 K37 Q38D30-K34 VanDerWaalsContact CG-NZ 3.31Å; D30-K34 WeakPolarHBondContact O-CB 3.49Å; D30-K34 WeakPolarHBondContact O-CD 3.41Å; D30-K34 WeakPolarHBondContact O-CE 3.2Å; D30-K34 WeakPolarHBondContact O-CG 3.31Å; D30-K34 PolarHBondContact O-N 3.42Å; D30-K34 VanDerWaalsContact O-N 3.09Å; D30-K34 WeakPolarHBondContact OD2-CE 3.38Å; D30-K34 IonicContact OD2-NZ 2.93Å; D30-K34 PolarHBondContact OD2-NZ 2.97Å; Y31-K34 PolarHBondContact O-N 2.96Å; K34-K37 PolarHBondContact O-N 3.13Å; K34-Q38 WeakPolarHBondContact O-CB 3.41Å; K34-Q38 WeakPolarHBondContact O-CG 2.81Å; K34-Q38 PolarHBondContact O-N 3.26Å
35Y84.3Confident88.6Confident71 Ų7184.5 Ų84.528%0.27841%0.405SS..Hα-helixtrans-63.9-43.7174.4-95.2-104.7000112.5Y31 G32 E33 K37 Q38 L39 F98Y31-Y35 WeakPolarHBondContact O-CB 3.36Å; Y31-Y35 WeakPolarHBondContact O-CD2 3.41Å; Y31-Y35 PolarHBondContact O-N 3.34Å; G32-Y35 PolarHBondContact O-N 3Å; E33-Y35 PolarHBondContact O-N 3.18Å; Y35-K37 VanDerWaalsContact C-N 3.31Å; Y35-K37 PolarHBondContact O-N 3.3Å; Y35-Q38 PolarHBondContact O-N 3.45Å; Y35-L39 WeakPolarHBondContact O-CB 3.44Å; Y35-L39 PolarHBondContact O-N 2.85Å; Y35-F98 HydrophobicContact CD1-CD1 4.34Å; Y35-F98 HydrophobicContact CD1-CE1 4.44Å; Y35-F98 HydrophobicContact CE1-CD1 4.31Å; Y35-F98 HydrophobicContact CE1-CE1 4.11Å
36Q82.7Confident88.4Confident83 Ų8385.8 Ų85.839%0.38841%0.411SS..Hα-helixtrans-61.1-39.4175.9-79.7-69-2400112.5G32 E33 K40G32-Q36 WeakPolarHBondContact O-CG 3.35Å; G32-Q36 PolarHBondContact O-N 3.16Å; E33-Q36 PolarHBondContact O-N 2.71Å; Q36-K40 WeakPolarHBondContact O-CG 3.41Å; Q36-K40 PolarHBondContact O-N 3.05Å
37K87.3Confident88.2Confident120 Ų12083.1 Ų83.152%0.52240%0.401SS..Hα-helixtrans-68.7-38.3175.5-68.4162.8-171.8169.30111.6E33 K34 Y35 K41E33-K37 WeakPolarHBondContact O-CD 3.47Å; E33-K37 VanDerWaalsContact O-CG 3.31Å; E33-K37 WeakPolarHBondContact O-CG 3.44Å; E33-K37 PolarHBondContact O-N 3.42Å; E33-K37 WeakPolarHBondContact OE2-CE 3.27Å; E33-K37 IonicContact OE2-NZ 3.65Å; E33-K37 PolarHBondContact OE2-NZ 3.5Å; K34-K37 PolarHBondContact O-N 3.13Å; Y35-K37 VanDerWaalsContact C-N 3.31Å; Y35-K37 PolarHBondContact O-N 3.3Å; K37-K41 WeakPolarHBondContact O-CG 3.43Å; K37-K41 PolarHBondContact O-N 3.02Å
38Q85.4Confident88.1Confident101 Ų10185.8 Ų85.847%0.47241%0.412SS..Hα-helixtrans-69.4-48.1174.9-75178.3-1.600112.6K34 Y35 K40 K41 W42K34-Q38 WeakPolarHBondContact O-CB 3.41Å; K34-Q38 WeakPolarHBondContact O-CG 2.81Å; K34-Q38 PolarHBondContact O-N 3.26Å; Y35-Q38 PolarHBondContact O-N 3.45Å; Q38-K40 VanDerWaalsContact C-N 3.27Å; Q38-K40 PolarHBondContact O-N 2.87Å; Q38-K41 CarbonylContact O-C 3.59Å; Q38-K41 WeakPolarHBondContact O-CA 3.35Å; Q38-K41 WeakPolarHBondContact O-CB 3.4Å; Q38-K41 PolarHBondContact O-N 2.82Å; Q38-W42 PolarHBondContact O-N 3.37Å
39L85.5Confident88.1Confident38 Ų3892.3 Ų92.320%0.19944%0.435CS..Hα-helixtrans-55.8-42.3-178.5-177.463.3000111.8Y35 W42 V43 F98Y35-L39 WeakPolarHBondContact O-CB 3.44Å; Y35-L39 PolarHBondContact O-N 2.85Å; L39-W42 PolarHBondContact O-N 2.83Å; L39-V43 HydrophobicContact CD1-CG2 3.92Å; L39-V43 HydrophobicContact CG-CG2 4.37Å; L39-V43 WeakPolarHBondContact O-CB 3.35Å; L39-V43 WeakPolarHBondContact O-CG2 3.02Å; L39-V43 PolarHBondContact O-N 2.85Å; L39-F98 HydrophobicContact CD1-CB 4.01Å; L39-F98 HydrophobicContact CD1-CD2 3.58Å; L39-F98 HydrophobicContact CD1-CE2 4.3Å; L39-F98 HydrophobicContact CD1-CG 3.92Å; L39-F98 HydrophobicContact CD2-CB 4.34Å
40K86Confident88.2Confident152 Ų15289.1 Ų89.166%0.66142%0.422SS*.Hα-helixtrans-63.2-40.6175.7-69.6172.9-175.2178.30112.3Q36 Q38 G44Q36-K40 WeakPolarHBondContact O-CG 3.41Å; Q36-K40 PolarHBondContact O-N 3.05Å; Q38-K40 VanDerWaalsContact C-N 3.27Å; Q38-K40 PolarHBondContact O-N 2.87Å; K40-G44 PolarHBondContact O-N 2.68Å; K40-G44 VanDerWaalsContact O-N 3.07Å
41K89.2Confident88.3Confident166 Ų16688.8 Ų88.872%0.72243%0.425SS*.Hα-helixtrans-66.4-45.4174.1-71.7-178.2176.3-171.50112.3K37 Q38 G45K37-K41 WeakPolarHBondContact O-CG 3.43Å; K37-K41 PolarHBondContact O-N 3.02Å; Q38-K41 CarbonylContact O-C 3.59Å; Q38-K41 WeakPolarHBondContact O-CA 3.35Å; Q38-K41 WeakPolarHBondContact O-CB 3.4Å; Q38-K41 PolarHBondContact O-N 2.82Å; K41-G45 PolarHBondContact O-N 3.18Å
42W88.4Confident88.5Confident182 Ų18287.5 Ų87.569%0.68943%0.427SS*.Hα-helixtrans-66.5-48.3-179.2-85.278.2000112.4Q38 L39 G45 M46Q38-W42 PolarHBondContact O-N 3.37Å; L39-W42 PolarHBondContact O-N 2.83Å; W42-G45 PolarHBondContact O-N 2.91Å; W42-M46 VanDerWaalsContact O-CB 3.28Å; W42-M46 WeakPolarHBondContact O-CB 3.23Å; W42-M46 PolarHBondContact O-N 3.02Å
43V88.9Confident88.7Confident22 Ų2290.3 Ų90.313%0.13343%0.433CS..Hα-helixtrans-65.9-40178.2174.20000111.2L39 L47 R91 V95L39-V43 HydrophobicContact CD1-CG2 3.92Å; L39-V43 HydrophobicContact CG-CG2 4.37Å; L39-V43 WeakPolarHBondContact O-CB 3.35Å; L39-V43 WeakPolarHBondContact O-CG2 3.02Å; L39-V43 PolarHBondContact O-N 2.85Å; V43-L47 HydrophobicContact CG1-CD1 4.16Å; V43-L47 WeakPolarHBondContact O-CB 3.36Å; V43-L47 WeakPolarHBondContact O-CG 3.43Å; V43-L47 PolarHBondContact O-N 2.67Å; V43-L47 VanDerWaalsContact O-N 3.14Å; V43-R91 HydrophobicContact CG1-CG 4.37Å; V43-V95 HydrophobicContact CG2-CG2 4.4Å
44G88.2Confident88.9Confident30 Ų3087.1 Ų87.131%0.30942%0.417SS..Hα-helixtrans-64.8-48.7174.600000112.7K40 L47 L48K40-G44 PolarHBondContact O-N 2.68Å; K40-G44 VanDerWaalsContact O-N 3.07Å; G44-L47 PolarHBondContact O-N 2.97Å; G44-L48 WeakPolarHBondContact O-CG 3.49Å; G44-L48 PolarHBondContact O-N 3.4Å
45G90.6Very high89.1Confident19 Ų1987.1 Ų87.120%0.19642%0.421CS..Hα-helixtrans-60.2-47177.400000112.3K41 W42 L47 L48 Y49K41-G45 PolarHBondContact O-N 3.18Å; W42-G45 PolarHBondContact O-N 2.91Å; G45-L47 VanDerWaalsContact C-N 3.31Å; G45-L47 PolarHBondContact O-N 3.12Å; G45-L48 PolarHBondContact O-N 3.3Å; G45-L48 VanDerWaalsContact O-N 3.12Å; G45-Y49 WeakPolarHBondContact O-CD2 3.44Å; G45-Y49 PolarHBondContact O-N 2.98Å
46M88.4Confident89.5Confident40 Ų4087.5 Ų87.520%0.19743%0.43CS..Hα-helixtrans-59.5-40176.5-170.8-164.877.400112.3W42 S50 V87 L90 R91 L94W42-M46 VanDerWaalsContact O-CB 3.28Å; W42-M46 WeakPolarHBondContact O-CB 3.23Å; W42-M46 PolarHBondContact O-N 3.02Å; M46-S50 VanDerWaalsContact O-CB 3.23Å; M46-S50 WeakPolarHBondContact O-CB 3.33Å; M46-S50 PolarHBondContact O-N 3.27Å; M46-S50 PolarHBondContact O-OG 3.36Å; M46-V87 HydrophobicContact CE-CG1 4.47Å; M46-L90 HydrophobicContact SD-CB 4.35Å; M46-R91 HydrophobicContact CE-CB 3.72Å; M46-R91 HydrophobicContact CE-CG 4.3Å; M46-L94 HydrophobicContact CE-CD1 4.46Å; M46-L94 HydrophobicContact SD-CD1 3.55Å; M46-L94 VanDerWaalsContact SD-CD1 3.55Å
47L89.9Confident89.7Confident70 Ų7086.6 Ų86.637%0.36643%0.43SS..Hα-helixtrans-65.9-38.4174.6-77.1167.8000112.6V43 G44 G45 S50 C51V43-L47 HydrophobicContact CG1-CD1 4.16Å; V43-L47 WeakPolarHBondContact O-CB 3.36Å; V43-L47 WeakPolarHBondContact O-CG 3.43Å; V43-L47 PolarHBondContact O-N 2.67Å; V43-L47 VanDerWaalsContact O-N 3.14Å; G44-L47 PolarHBondContact O-N 2.97Å; G45-L47 VanDerWaalsContact C-N 3.31Å; G45-L47 PolarHBondContact O-N 3.12Å; L47-S50 WeakPolarHBondContact CA-OG 3.25Å; L47-S50 PolarHBondContact O-OG 3.14Å; L47-C51 VanDerWaalsContact O-CB 3.25Å; L47-C51 WeakPolarHBondContact O-CB 3.5Å; L47-C51 PolarHBondContact O-N 2.96Å; L47-C51 VanDerWaalsContact O-N 3.09Å
48L91.4Very high89.8Confident128 Ų12884.2 Ų84.267%0.6742%0.423SS*.Hα-helixtrans-68.6-47.9175.7-69.6170.2000112.1G44 G45 C51 L52G44-L48 WeakPolarHBondContact O-CG 3.49Å; G44-L48 PolarHBondContact O-N 3.4Å; G45-L48 PolarHBondContact O-N 3.3Å; G45-L48 VanDerWaalsContact O-N 3.12Å; L48-C51 PolarHBondContact O-N 3.07Å; L48-L52 WeakPolarHBondContact O-CB 3.48Å; L48-L52 PolarHBondContact O-N 3.45Å
49Y92.4Very high90Very high174 Ų17483.3 Ų83.368%0.68242%0.424SS*.Hα-helixtrans-65.9-39.7178.8-69.3-57.5000112.3G45 L52 L53G45-Y49 WeakPolarHBondContact O-CD2 3.44Å; G45-Y49 PolarHBondContact O-N 2.98Å; Y49-L52 PolarHBondContact O-N 2.68Å; Y49-L53 VanDerWaalsContact O-CB 3.28Å; Y49-L53 WeakPolarHBondContact O-CB 3.46Å; Y49-L53 PolarHBondContact O-N 2.84Å
50S92.8Very high90.1Very high19 Ų1985.1 Ų85.113%0.13344%0.437CS..Hα-helixtrans-66.6-39.9176.257.70000112.1M46 L47 Y54 F83M46-S50 VanDerWaalsContact O-CB 3.23Å; M46-S50 WeakPolarHBondContact O-CB 3.33Å; M46-S50 PolarHBondContact O-N 3.27Å; M46-S50 PolarHBondContact O-OG 3.36Å; L47-S50 WeakPolarHBondContact CA-OG 3.25Å; L47-S50 PolarHBondContact O-OG 3.14Å; S50-Y54 VanDerWaalsContact O-CB 3.28Å; S50-Y54 WeakPolarHBondContact O-CB 3.44Å; S50-Y54 PolarHBondContact O-N 2.9Å; S50-F83 WeakPolarHBondContact O-CE1 3.35Å; S50-F83 WeakPolarHBondContact O-CZ 3.46Å
51C91.8Very high90.1Very high71 Ų7180 Ų8048%0.4842%0.418SS..Hα-helixtrans-61.8-46.8171.8-172.60000112.2L47 L48 Y54 L55L47-C51 VanDerWaalsContact O-CB 3.25Å; L47-C51 WeakPolarHBondContact O-CB 3.5Å; L47-C51 PolarHBondContact O-N 2.96Å; L47-C51 VanDerWaalsContact O-N 3.09Å; L48-C51 PolarHBondContact O-N 3.07Å; C51-Y54 WeakPolarHBondContact O-CB 3.24Å; C51-Y54 PolarHBondContact O-N 2.88Å; C51-L55 WeakPolarHBondContact O-CG 3.37Å; C51-L55 PolarHBondContact O-N 2.87Å
52L94.3Very high89.8Confident107 Ų10781.3 Ų81.356%0.5642%0.42SS*.Hα-helixtrans-60.9-47.3178.1-178.666000111.8L48 Y49 Y54 L55 V56L48-L52 WeakPolarHBondContact O-CB 3.48Å; L48-L52 PolarHBondContact O-N 3.45Å; Y49-L52 PolarHBondContact O-N 2.68Å; L52-Y54 VanDerWaalsContact C-N 3.33Å; L52-Y54 PolarHBondContact O-N 3.31Å; L52-L55 PolarHBondContact O-N 3.17Å; L52-V56 WeakPolarHBondContact O-CG2 3.41Å; L52-V56 PolarHBondContact O-N 2.87Å
53L91.7Very high89.7Confident94 Ų9478.6 Ų78.649%0.49242%0.418SS..Hα-helixtrans-62.6-41.2178.7-169155.9000111Y49 V56 T57 F83Y49-L53 VanDerWaalsContact O-CB 3.28Å; Y49-L53 WeakPolarHBondContact O-CB 3.46Å; Y49-L53 PolarHBondContact O-N 2.84Å; L53-V56 PolarHBondContact O-N 2.9Å; L53-T57 HydrophobicContact CD2-CG2 3.99Å; L53-T57 WeakPolarHBondContact O-CG2 3.21Å; L53-T57 PolarHBondContact O-N 3.34Å; L53-T57 PolarHBondContact O-OG1 3.04Å; L53-F83 HydrophobicContact CD2-CE2 3.8Å; L53-F83 HydrophobicContact CD2-CZ 4.04Å
54Y91.1Very high89.5Confident48 Ų4888.3 Ų88.319%0.18845%0.452CS..Hα-helixtrans-60.3-45.5175.3-165.5-114.9000112.4S50 C51 L52 V56 T57 L58 F80 F83S50-Y54 VanDerWaalsContact O-CB 3.28Å; S50-Y54 WeakPolarHBondContact O-CB 3.44Å; S50-Y54 PolarHBondContact O-N 2.9Å; C51-Y54 WeakPolarHBondContact O-CB 3.24Å; C51-Y54 PolarHBondContact O-N 2.88Å; L52-Y54 VanDerWaalsContact C-N 3.33Å; L52-Y54 PolarHBondContact O-N 3.31Å; Y54-V56 PolarHBondContact O-N 2.68Å; Y54-T57 WeakPolarHBondContact CA-OG1 3.32Å; Y54-T57 PolarHBondContact O-N 3.2Å; Y54-T57 PolarHBondContact O-OG1 3.5Å; Y54-L58 HydrophobicContact CD1-CD1 4.23Å; Y54-L58 HydrophobicContact CE1-CD1 4.31Å; Y54-L58 PolarHBondContact O-N 3.37Å; Y54-F80 HydrophobicContact CD1-CE2 4.44Å; Y54-F80 HydrophobicContact CE1-CD2 4.31Å; Y54-F80 AromaticContact CE1-CE2 3.53Å; Y54-F80 HydrophobicContact CE1-CE2 3.53Å; Y54-F80 AromaticContact CE1-CZ 3.76Å; Y54-F80 HydrophobicContact CE1-CZ 3.76Å; Y54-F80 AromaticContact CE2-CD2 3.76Å; Y54-F80 HydrophobicContact CE2-CD2 3.76Å; Y54-F80 AromaticContact CE2-CE2 3.82Å; Y54-F80 HydrophobicContact CE2-CE2 3.82Å; Y54-F80 HydrophobicContact CE2-CG 4.45Å; Y54-F80 AromaticContact CZ-CD2 3.55Å; Y54-F80 AromaticContact CZ-CE2 3.19Å; Y54-F80 AromaticContact CZ-CZ 3.58Å; Y54-F80 WeakPolarHBondContact OH-CD1 3.46Å; Y54-F80 WeakPolarHBondContact OH-CD2 3.5Å; Y54-F80 VanDerWaalsContact OH-CE1 3.28Å; Y54-F80 WeakPolarHBondContact OH-CE1 3.27Å; Y54-F80 WeakPolarHBondContact OH-CE2 3.3Å; Y54-F80 WeakPolarHBondContact OH-CZ 3.45Å; Y54-F80 PolarHBondContact OH-O 3.5Å; Y54-F80 VanDerWaalsContact OH-O 3.12Å; Y54-F83 HydrophobicContact CD2-CB 4.31Å; Y54-F83 AromaticContact CD2-CD1 3.26Å; Y54-F83 HydrophobicContact CD2-CD1 3.26Å; Y54-F83 AromaticContact CD2-CE1 3.74Å; Y54-F83 HydrophobicContact CD2-CE1 3.74Å; Y54-F83 AromaticContact CD2-CG 3.94Å; Y54-F83 HydrophobicContact CD2-CG 3.94Å; Y54-F83 HydrophobicContact CE2-CB 4.2Å; Y54-F83 AromaticContact CE2-CD1 3.76Å; Y54-F83 HydrophobicContact CE2-CD1 3.76Å; Y54-F83 HydrophobicContact CE2-CG 4.3Å; Y54-F83 HydrophobicContact CG-CD1 4.1Å; Y54-F83 HydrophobicContact CG-CE1 4.16Å
55L92.1Very high88.9Confident94 Ų9493 Ų9349%0.49246%0.462SS..Hα-helixtrans-63-40175.1-69.4171.9000111.9C51 L52 L58 V59C51-L55 WeakPolarHBondContact O-CG 3.37Å; C51-L55 PolarHBondContact O-N 2.87Å; L52-L55 PolarHBondContact O-N 3.17Å; L55-L58 HydrophobicContact CD2-CD1 4.48Å; L55-L58 WeakPolarHBondContact O-CB 3.13Å; L55-L58 PolarHBondContact O-N 3.06Å; L55-V59 WeakPolarHBondContact O-CG2 3.3Å; L55-V59 PolarHBondContact O-N 2.96Å
56V91.7Very high87.8Confident80 Ų80100.8 Ų100.849%0.48550%0.495SS..Hα-helixtrans-62.9-44.9173.1171.70000111L52 L53 Y54 L58 V59 V60L52-V56 WeakPolarHBondContact O-CG2 3.41Å; L52-V56 PolarHBondContact O-N 2.87Å; L53-V56 PolarHBondContact O-N 2.9Å; Y54-V56 PolarHBondContact O-N 2.68Å; V56-L58 VanDerWaalsContact C-N 3.32Å; V56-L58 PolarHBondContact O-N 3.41Å; V56-V59 PolarHBondContact O-N 2.84Å; V56-V60 HydrophobicContact CG1-CG2 4.29Å; V56-V60 WeakPolarHBondContact O-CG2 3.44Å; V56-V60 PolarHBondContact O-N 3.44Å
57T87.6Confident86.7Confident63 Ų63100.5 Ų100.539%0.38750%0.497SS..Hα-helixtrans-63.4-37176.654.10000112.5L53 Y54 V61L53-T57 HydrophobicContact CD2-CG2 3.99Å; L53-T57 WeakPolarHBondContact O-CG2 3.21Å; L53-T57 PolarHBondContact O-N 3.34Å; L53-T57 PolarHBondContact O-OG1 3.04Å; Y54-T57 WeakPolarHBondContact CA-OG1 3.32Å; Y54-T57 PolarHBondContact O-N 3.2Å; Y54-T57 PolarHBondContact O-OG1 3.5Å; T57-V61 WeakPolarHBondContact O-CB 3.34Å; T57-V61 WeakPolarHBondContact O-CG2 3.36Å; T57-V61 PolarHBondContact O-N 2.97Å
58L88.1Confident85.8Confident70 Ų70105.9 Ų105.937%0.36652%0.52SS..Hα-helixtrans-61.5-46.1172.6-90.1169.8000112.1Y54 L55 V56 Y62 F80Y54-L58 HydrophobicContact CD1-CD1 4.23Å; Y54-L58 HydrophobicContact CE1-CD1 4.31Å; Y54-L58 PolarHBondContact O-N 3.37Å; L55-L58 HydrophobicContact CD2-CD1 4.48Å; L55-L58 WeakPolarHBondContact O-CB 3.13Å; L55-L58 PolarHBondContact O-N 3.06Å; V56-L58 VanDerWaalsContact C-N 3.32Å; V56-L58 PolarHBondContact O-N 3.41Å; L58-Y62 VanDerWaalsContact O-CB 3.23Å; L58-Y62 WeakPolarHBondContact O-CB 3.44Å; L58-Y62 PolarHBondContact O-N 3.49Å; L58-F80 HydrophobicContact CD1-CE2 3.9Å; L58-F80 HydrophobicContact CD1-CZ 4.32Å; L58-F80 HydrophobicContact CD2-CD2 4.35Å; L58-F80 HydrophobicContact CD2-CE2 3.57Å; L58-F80 HydrophobicContact CD2-CZ 4.18Å; L58-F80 HydrophobicContact CG-CE2 3.77Å
59V89.8Confident85.4Confident83 Ų83107.3 Ų107.350%0.50352%0.523SS..Hα-helixtrans-66.4-43.1179170.50000111.3L55 V56 Y62 L63L55-V59 WeakPolarHBondContact O-CG2 3.3Å; L55-V59 PolarHBondContact O-N 2.96Å; V56-V59 PolarHBondContact O-N 2.84Å; V59-Y62 PolarHBondContact O-N 2.96Å; V59-L63 HydrophobicContact CG1-CD1 3.7Å; V59-L63 HydrophobicContact CG1-CG 4.27Å; V59-L63 WeakPolarHBondContact O-CB 3.15Å; V59-L63 VanDerWaalsContact O-CG 3.26Å; V59-L63 WeakPolarHBondContact O-CG 3.45Å; V59-L63 PolarHBondContact O-N 2.91Å
60V87.9Confident85Confident75 Ų75104.9 Ų104.946%0.45552%0.521SS..Hα-helixtrans-62.7-47.3176.7171.70000111V56 Y62 L63 W64V56-V60 HydrophobicContact CG1-CG2 4.29Å; V56-V60 WeakPolarHBondContact O-CG2 3.44Å; V56-V60 PolarHBondContact O-N 3.44Å; V60-Y62 VanDerWaalsContact C-N 3.35Å; V60-Y62 PolarHBondContact O-N 2.78Å; V60-L63 PolarHBondContact O-N 2.64Å; V60-W64 WeakPolarHBondContact O-CB 3.39Å; V60-W64 PolarHBondContact O-N 3.09Å
61V85.9Confident84.6Confident45 Ų45110.8 Ų110.827%0.27355%0.548SS..Hα-helixtrans-59-45.8175166.40000111T57 L63 W64 Y65 L76T57-V61 WeakPolarHBondContact O-CB 3.34Å; T57-V61 WeakPolarHBondContact O-CG2 3.36Å; T57-V61 PolarHBondContact O-N 2.97Å; V61-L63 PolarHBondContact O-N 2.93Å; V61-W64 PolarHBondContact O-N 2.99Å; V61-Y65 WeakPolarHBondContact O-CA 3.37Å; V61-Y65 WeakPolarHBondContact O-CB 3.46Å; V61-Y65 PolarHBondContact O-N 2.84Å; V61-L76 HydrophobicContact CB-CD1 4.49Å; V61-L76 HydrophobicContact CG1-CD1 3.75Å; V61-L76 HydrophobicContact CG1-CD2 3.91Å; V61-L76 HydrophobicContact CG1-CG 4.45Å; V61-L76 HydrophobicContact CG2-CD1 3.87Å
62Y84.1Confident84.2Confident194 Ų194108.5 Ų108.576%0.76154%0.536SS*.Hα-helixtrans-63.3-38.5179.5177.7-96.3000113L58 V59 V60L58-Y62 VanDerWaalsContact O-CB 3.23Å; L58-Y62 WeakPolarHBondContact O-CB 3.44Å; L58-Y62 PolarHBondContact O-N 3.49Å; V59-Y62 PolarHBondContact O-N 2.96Å; V60-Y62 VanDerWaalsContact C-N 3.35Å; V60-Y62 PolarHBondContact O-N 2.78Å
63L86.1Confident83.7Confident125 Ų125108.9 Ų108.965%0.65453%0.53SS*.Hα-helixtrans-79.6-24.9-179.3-68.9174.9000113.8V59 V60 V61V59-L63 HydrophobicContact CG1-CD1 3.7Å; V59-L63 HydrophobicContact CG1-CG 4.27Å; V59-L63 WeakPolarHBondContact O-CB 3.15Å; V59-L63 VanDerWaalsContact O-CG 3.26Å; V59-L63 WeakPolarHBondContact O-CG 3.45Å; V59-L63 PolarHBondContact O-N 2.91Å; V60-L63 PolarHBondContact O-N 2.64Å; V61-L63 PolarHBondContact O-N 2.93Å
64W83.1Confident83.6Confident225 Ų225109.5 Ų109.585%0.85253%0.534SS*.Hα-helixtrans-107.5-17-177.2-83.430.2000114.8V60 V61V60-W64 WeakPolarHBondContact O-CB 3.39Å; V60-W64 PolarHBondContact O-N 3.09Å; V61-W64 PolarHBondContact O-N 2.99Å
65Y77.3Confident83.5Confident130 Ų130112 Ų11251%0.5155%0.554SS.*  trans-132.5102.9-159.2-134.8-115.5000114.4V61 P67V61-Y65 WeakPolarHBondContact O-CA 3.37Å; V61-Y65 WeakPolarHBondContact O-CB 3.46Å; V61-Y65 PolarHBondContact O-N 2.84Å; Y65-P67 VanDerWaalsContact C-CD 3.44Å; Y65-P67 HydrophobicContact CD1-CB 3.93Å; Y65-P67 HydrophobicContact CD1-CG 3.77Å; Y65-P67 HydrophobicContact CE1-CB 3.76Å; Y65-P67 HydrophobicContact CE1-CG 4.04Å; Y65-P67 VanDerWaalsContact O-CD 3.26Å; Y65-P67 WeakPolarHBondContact O-CD 3.39Å
66M65.8Low83.1Confident182 Ų182110.2 Ų110.290%0.89755%0.545SS*.  trans-111.179.6165.2-78.9-78.4-86.400109.7E68M66-E68 PolarHBondContact O-N 3.1Å
67P65.2Low82.9Confident34 Ų34111.3 Ų111.322%0.22155%0.546CS..  trans-80.3115.2-173.230.5-34.6000112.2Y65 R73Y65-P67 VanDerWaalsContact C-CD 3.44Å; Y65-P67 HydrophobicContact CD1-CB 3.93Å; Y65-P67 HydrophobicContact CD1-CG 3.77Å; Y65-P67 HydrophobicContact CE1-CB 3.76Å; Y65-P67 HydrophobicContact CE1-CG 4.04Å; Y65-P67 VanDerWaalsContact O-CD 3.26Å; Y65-P67 WeakPolarHBondContact O-CD 3.39Å; P67-R73 HydrophobicContact CB-CG 4.42Å; P67-R73 HydrophobicContact CG-CG 4.11Å; P67-R73 VanDerWaalsContact O-CZ 3.25Å; P67-R73 PolarHBondContact O-NE 3.27Å; P67-R73 PolarHBondContact O-NH2 3.17Å
68E72.7Confident83.1Confident182 Ų182114.1 Ų114.185%0.8556%0.558SS**  trans-71.7-33.3169.4-61.9-165.4141.900112.3M66 R73M66-E68 PolarHBondContact O-N 3.1Å; E68-R73 PolarHBondContact O-NH2 2.85Å
69Q82.6Confident83.1Confident158 Ų158116.3 Ų116.374%0.73857%0.57SS**SBendtrans-87.8134.5-167.8-137.4171.322.200113.7M71 G72 R73Q69-M71 PolarHBondContact O-N 3.31Å; Q69-G72 PolarHBondContact O-N 2.84Å; Q69-R73 PolarHBondContact O-N 2.84Å
70L83.6Confident83Confident123 Ų123116.7 Ų116.764%0.64457%0.565SS**Hα-helixtrans-61.7-37.7-171.5-63.6178.6000114.4G72 R73 L74L70-G72 PolarHBondContact O-N 2.74Å; L70-R73 WeakPolarHBondContact O-CB 3.47Å; L70-R73 PolarHBondContact O-N 2.7Å; L70-R73 VanDerWaalsContact O-N 3.15Å; L70-L74 PolarHBondContact O-N 3.37Å
71M84.9Confident83.2Confident144 Ų144117.5 Ų117.571%0.70957%0.57SS**Hα-helixtrans-62-41.6-179.2-67.1-58.3-160.300112.2Q69 R73 L74 V75Q69-M71 PolarHBondContact O-N 3.31Å; M71-R73 VanDerWaalsContact C-N 3.29Å; M71-R73 PolarHBondContact O-N 3.49Å; M71-L74 PolarHBondContact O-N 2.88Å; M71-L74 HydrophobicContact SD-CD1 4.39Å; M71-V75 WeakPolarHBondContact O-CG2 3.3Å; M71-V75 PolarHBondContact O-N 2.66Å
72G83.8Confident83.5Confident22 Ų22117.6 Ų117.623%0.22758%0.575CS.*Hα-helixtrans-62.5-36.5175.600000112.4Q69 L70 L76Q69-G72 PolarHBondContact O-N 2.84Å; L70-G72 PolarHBondContact O-N 2.74Å; G72-L76 WeakPolarHBondContact O-CB 3.45Å; G72-L76 PolarHBondContact O-N 3.24Å
73R83.9Confident83.8Confident115 Ų115110.7 Ų110.743%0.43455%0.549SS..Hα-helixtrans-65.7-41.7174.7-60.5177.5-176.8175.90.2111.8P67 E68 Q69 L70 M71 L76 I77P67-R73 HydrophobicContact CB-CG 4.42Å; P67-R73 HydrophobicContact CG-CG 4.11Å; P67-R73 VanDerWaalsContact O-CZ 3.25Å; P67-R73 PolarHBondContact O-NE 3.27Å; P67-R73 PolarHBondContact O-NH2 3.17Å; E68-R73 PolarHBondContact O-NH2 2.85Å; Q69-R73 PolarHBondContact O-N 2.84Å; L70-R73 WeakPolarHBondContact O-CB 3.47Å; L70-R73 PolarHBondContact O-N 2.7Å; L70-R73 VanDerWaalsContact O-N 3.15Å; M71-R73 VanDerWaalsContact C-N 3.29Å; M71-R73 PolarHBondContact O-N 3.49Å; R73-L76 PolarHBondContact O-N 2.94Å; R73-I77 WeakPolarHBondContact O-CD1 3.27Å; R73-I77 VanDerWaalsContact O-CG1 3.24Å; R73-I77 WeakPolarHBondContact O-CG1 3.39Å; R73-I77 PolarHBondContact O-N 2.74Å
74L89.6Confident83.9Confident108 Ų108107.5 Ų107.557%0.56554%0.536SS*.Hα-helixtrans-65.3-43.9176.9-68.8175000112.4L70 M71 L76 I77 L78L70-L74 PolarHBondContact O-N 3.37Å; M71-L74 PolarHBondContact O-N 2.88Å; M71-L74 HydrophobicContact SD-CD1 4.39Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.47Å; L74-I77 PolarHBondContact O-N 3.47Å; L74-L78 WeakPolarHBondContact O-CB 3.47Å; L74-L78 PolarHBondContact O-N 2.94Å
75V87.1Confident84.4Confident100 Ų10099 Ų9961%0.60651%0.514SS*.Hα-helixtrans-63-40.4175.7173.60000111.2M71 L78 L79M71-V75 WeakPolarHBondContact O-CG2 3.3Å; M71-V75 PolarHBondContact O-N 2.66Å; V75-L78 PolarHBondContact O-N 2.63Å; V75-L79 PolarHBondContact O-N 2.85Å
76L84.6Confident85.1Confident57 Ų5797.4 Ų97.430%0.29851%0.514SS..Hα-helixtrans-63.8-45.6176.5-170.973.7000112.1V61 G72 R73 L74 L78 L79 F80V61-L76 HydrophobicContact CB-CD1 4.49Å; V61-L76 HydrophobicContact CG1-CD1 3.75Å; V61-L76 HydrophobicContact CG1-CD2 3.91Å; V61-L76 HydrophobicContact CG1-CG 4.45Å; V61-L76 HydrophobicContact CG2-CD1 3.87Å; G72-L76 WeakPolarHBondContact O-CB 3.45Å; G72-L76 PolarHBondContact O-N 3.24Å; R73-L76 PolarHBondContact O-N 2.94Å; L74-L76 VanDerWaalsContact C-N 3.33Å; L74-L76 PolarHBondContact O-N 3.47Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 2.77Å; L76-L79 PolarHBondContact O-N 2.96Å; L76-F80 WeakPolarHBondContact O-CB 3.3Å; L76-F80 PolarHBondContact O-N 2.87Å
77I87.9Confident86.4Confident102 Ų10289.9 Ų89.952%0.52348%0.478SS..Hα-helixtrans-61.5-43.3176.1-69.4162.9000110.5R73 L74 L79 F80 V81R73-I77 WeakPolarHBondContact O-CD1 3.27Å; R73-I77 VanDerWaalsContact O-CG1 3.24Å; R73-I77 WeakPolarHBondContact O-CG1 3.39Å; R73-I77 PolarHBondContact O-N 2.74Å; L74-I77 PolarHBondContact O-N 3.47Å; I77-L79 PolarHBondContact O-N 2.78Å; I77-F80 PolarHBondContact O-N 3.08Å; I77-V81 WeakPolarHBondContact O-CG2 3.48Å; I77-V81 PolarHBondContact O-N 3.26Å
78L90.7Very high87.7Confident122 Ų12295.8 Ų95.864%0.63950%0.496SS*.Hα-helixtrans-59.8-46.7176.6178.761.2000111.5L74 V75 L76 F80 V81 A82L74-L78 WeakPolarHBondContact O-CB 3.47Å; L74-L78 PolarHBondContact O-N 2.94Å; V75-L78 PolarHBondContact O-N 2.63Å; L76-L78 VanDerWaalsContact C-N 3.34Å; L76-L78 PolarHBondContact O-N 2.77Å; L78-F80 PolarHBondContact O-N 3.33Å; L78-V81 PolarHBondContact O-N 3.03Å; L78-A82 WeakPolarHBondContact O-CB 3.27Å; L78-A82 PolarHBondContact O-N 2.66Å
79L88.4Confident88.7Confident117 Ų11791.8 Ų91.861%0.61348%0.48SS*.Hα-helixtrans-61.9-43.1177.1-177.662.1000111.9V75 L76 I77 V81 A82 F83V75-L79 PolarHBondContact O-N 2.85Å; L76-L79 PolarHBondContact O-N 2.96Å; I77-L79 PolarHBondContact O-N 2.78Å; L79-V81 VanDerWaalsContact C-N 3.32Å; L79-V81 PolarHBondContact O-N 3.34Å; L79-A82 PolarHBondContact O-N 3.06Å; L79-F83 PolarHBondContact O-N 3.1Å
80F88.9Confident89.1Confident91 Ų9188.4 Ų88.440%0.39947%0.466SS..Hα-helixtrans-65.4-31.3179.3-164.6-110.2000113.1Y54 L58 L76 I77 L78 P84Y54-F80 HydrophobicContact CD1-CE2 4.44Å; Y54-F80 HydrophobicContact CE1-CD2 4.31Å; Y54-F80 AromaticContact CE1-CE2 3.53Å; Y54-F80 HydrophobicContact CE1-CE2 3.53Å; Y54-F80 AromaticContact CE1-CZ 3.76Å; Y54-F80 HydrophobicContact CE1-CZ 3.76Å; Y54-F80 AromaticContact CE2-CD2 3.76Å; Y54-F80 HydrophobicContact CE2-CD2 3.76Å; Y54-F80 AromaticContact CE2-CE2 3.82Å; Y54-F80 HydrophobicContact CE2-CE2 3.82Å; Y54-F80 HydrophobicContact CE2-CG 4.45Å; Y54-F80 AromaticContact CZ-CD2 3.55Å; Y54-F80 AromaticContact CZ-CE2 3.19Å; Y54-F80 AromaticContact CZ-CZ 3.58Å; Y54-F80 WeakPolarHBondContact OH-CD1 3.46Å; Y54-F80 WeakPolarHBondContact OH-CD2 3.5Å; Y54-F80 VanDerWaalsContact OH-CE1 3.28Å; Y54-F80 WeakPolarHBondContact OH-CE1 3.27Å; Y54-F80 WeakPolarHBondContact OH-CE2 3.3Å; Y54-F80 WeakPolarHBondContact OH-CZ 3.45Å; Y54-F80 PolarHBondContact OH-O 3.5Å; Y54-F80 VanDerWaalsContact OH-O 3.12Å; L58-F80 HydrophobicContact CD1-CE2 3.9Å; L58-F80 HydrophobicContact CD1-CZ 4.32Å; L58-F80 HydrophobicContact CD2-CD2 4.35Å; L58-F80 HydrophobicContact CD2-CE2 3.57Å; L58-F80 HydrophobicContact CD2-CZ 4.18Å; L58-F80 HydrophobicContact CG-CE2 3.77Å; L76-F80 WeakPolarHBondContact O-CB 3.3Å; L76-F80 PolarHBondContact O-N 2.87Å; I77-F80 PolarHBondContact O-N 3.08Å; L78-F80 PolarHBondContact O-N 3.33Å; F80-P84 WeakPolarHBondContact O-CD 2.92Å; F80-P84 WeakPolarHBondContact O-CG 3.46Å
81V91.1Very high89.4Confident91 Ų9188 Ų8855%0.55246%0.456SS*.Hα-helixtrans-85.5-36.1174.6174.50000112.1I77 L78 L79 P84 A85I77-V81 WeakPolarHBondContact O-CG2 3.48Å; I77-V81 PolarHBondContact O-N 3.26Å; L78-V81 PolarHBondContact O-N 3.03Å; L79-V81 VanDerWaalsContact C-N 3.32Å; L79-V81 PolarHBondContact O-N 3.34Å; V81-P84 WeakPolarHBondContact O-CD 3.49Å; V81-P84 WeakPolarHBondContact O-CG 3.5Å; V81-A85 WeakPolarHBondContact O-CB 3.42Å; V81-A85 PolarHBondContact O-N 2.94Å
82A91.4Very high89.8Confident47 Ų4786.8 Ų86.839%0.38845%0.447SS..Hα-helixtrans-66.8-38.1-179.700000112.5L78 L79 A85 L86L78-A82 WeakPolarHBondContact O-CB 3.27Å; L78-A82 PolarHBondContact O-N 2.66Å; L79-A82 PolarHBondContact O-N 3.06Å; A82-A85 PolarHBondContact O-N 2.94Å; A82-L86 VanDerWaalsContact O-CB 3.29Å; A82-L86 WeakPolarHBondContact O-CB 3.33Å; A82-L86 PolarHBondContact O-N 3.23Å
83F90.3Very high90.2Very high49 Ų4988.1 Ų88.122%0.21546%0.456CS..Hα-helixtrans-59.9-55.2179.5-177.1-89.7000114.2S50 L53 Y54 L79 A85 L86 V87S50-F83 WeakPolarHBondContact O-CE1 3.35Å; S50-F83 WeakPolarHBondContact O-CZ 3.46Å; L53-F83 HydrophobicContact CD2-CE2 3.8Å; L53-F83 HydrophobicContact CD2-CZ 4.04Å; Y54-F83 HydrophobicContact CD2-CB 4.31Å; Y54-F83 AromaticContact CD2-CD1 3.26Å; Y54-F83 HydrophobicContact CD2-CD1 3.26Å; Y54-F83 AromaticContact CD2-CE1 3.74Å; Y54-F83 HydrophobicContact CD2-CE1 3.74Å; Y54-F83 AromaticContact CD2-CG 3.94Å; Y54-F83 HydrophobicContact CD2-CG 3.94Å; Y54-F83 HydrophobicContact CE2-CB 4.2Å; Y54-F83 AromaticContact CE2-CD1 3.76Å; Y54-F83 HydrophobicContact CE2-CD1 3.76Å; Y54-F83 HydrophobicContact CE2-CG 4.3Å; Y54-F83 HydrophobicContact CG-CD1 4.1Å; Y54-F83 HydrophobicContact CG-CE1 4.16Å; L79-F83 PolarHBondContact O-N 3.1Å; F83-A85 VanDerWaalsContact C-N 3.28Å; F83-A85 PolarHBondContact O-N 3.11Å; F83-L86 WeakPolarHBondContact O-CB 3.48Å; F83-L86 PolarHBondContact O-N 2.91Å; F83-V87 HydrophobicContact CD1-CG2 4.11Å; F83-V87 HydrophobicContact CE1-CG2 3.71Å; F83-V87 HydrophobicContact CE2-CG2 4.35Å; F83-V87 HydrophobicContact CZ-CG2 3.86Å; F83-V87 WeakPolarHBondContact O-CG2 3.08Å; F83-V87 PolarHBondContact O-N 3.32Å
84P90.1Very high90.5Very high59 Ų5985.2 Ų85.238%0.38345%0.449SS..Hα-helixtrans-65.4-31177.925.6-34.1000112.5F80 V81 W88F80-P84 WeakPolarHBondContact O-CD 2.92Å; F80-P84 WeakPolarHBondContact O-CG 3.46Å; V81-P84 WeakPolarHBondContact O-CD 3.49Å; V81-P84 WeakPolarHBondContact O-CG 3.5Å; P84-W88 VanDerWaalsContact O-CB 3.31Å; P84-W88 WeakPolarHBondContact O-CB 3.34Å; P84-W88 PolarHBondContact O-N 3.08Å
85A93.1Very high90.5Very high46 Ų4682.9 Ų82.938%0.3844%0.439SS..Hα-helixtrans-64.4-44.7172.200000111.9V81 A82 F83 W88 L89V81-A85 WeakPolarHBondContact O-CB 3.42Å; V81-A85 PolarHBondContact O-N 2.94Å; A82-A85 PolarHBondContact O-N 2.94Å; F83-A85 VanDerWaalsContact C-N 3.28Å; F83-A85 PolarHBondContact O-N 3.11Å; A85-W88 PolarHBondContact O-N 3.12Å; A85-L89 WeakPolarHBondContact O-CG 3.42Å; A85-L89 PolarHBondContact O-N 2.87Å
86L92.3Very high90.7Very high97 Ų9780.9 Ų80.951%0.50843%0.426SS..Hα-helixtrans-61.8-46175.1-179.864.6000111.5A82 F83 W88 L89 L90A82-L86 VanDerWaalsContact O-CB 3.29Å; A82-L86 WeakPolarHBondContact O-CB 3.33Å; A82-L86 PolarHBondContact O-N 3.23Å; F83-L86 WeakPolarHBondContact O-CB 3.48Å; F83-L86 PolarHBondContact O-N 2.91Å; L86-W88 VanDerWaalsContact C-N 3.31Å; L86-W88 PolarHBondContact O-N 3.4Å; L86-L89 PolarHBondContact O-N 3Å; L86-L90 HydrophobicContact CD1-CD1 3.64Å; L86-L90 HydrophobicContact CG-CD1 4.09Å; L86-L90 WeakPolarHBondContact O-CD1 3.25Å; L86-L90 PolarHBondContact O-N 2.95Å
87V91.8Very high91Very high24 Ų2483.3 Ų83.315%0.14544%0.439CS..Hα-helixtrans-62.3-38.6176.4172.70000111.5M46 F83 R91M46-V87 HydrophobicContact CE-CG1 4.47Å; F83-V87 HydrophobicContact CD1-CG2 4.11Å; F83-V87 HydrophobicContact CE1-CG2 3.71Å; F83-V87 HydrophobicContact CE2-CG2 4.35Å; F83-V87 HydrophobicContact CZ-CG2 3.86Å; F83-V87 WeakPolarHBondContact O-CG2 3.08Å; F83-V87 PolarHBondContact O-N 3.32Å; V87-R91 VanDerWaalsContact O-CB 3.3Å; V87-R91 WeakPolarHBondContact O-CB 3.46Å; V87-R91 PolarHBondContact O-N 3.42Å
88W92.4Very high90.9Very high157 Ų15781.3 Ų81.360%0.59543%0.426SS*.Hα-helixtrans-66-43174179.893000112.1P84 A85 L86 R91 K92P84-W88 VanDerWaalsContact O-CB 3.31Å; P84-W88 WeakPolarHBondContact O-CB 3.34Å; P84-W88 PolarHBondContact O-N 3.08Å; A85-W88 PolarHBondContact O-N 3.12Å; L86-W88 VanDerWaalsContact C-N 3.31Å; L86-W88 PolarHBondContact O-N 3.4Å; W88-R91 PolarHBondContact O-N 3.23Å; W88-K92 WeakPolarHBondContact O-CB 3.17Å; W88-K92 PolarHBondContact O-N 3.27Å
89L93.9Very high90.8Very high98 Ų9878.3 Ų78.351%0.51342%0.415SS..Hα-helixtrans-62.4-47.8174.9-74.6171.8000111.7A85 L86 R91 K92 A93A85-L89 WeakPolarHBondContact O-CG 3.42Å; A85-L89 PolarHBondContact O-N 2.87Å; L86-L89 PolarHBondContact O-N 3Å; L89-R91 PolarHBondContact O-N 2.99Å; L89-K92 PolarHBondContact O-N 3.38Å; L89-A93 WeakPolarHBondContact O-CB 3.19Å; L89-A93 PolarHBondContact O-N 2.86Å
90L91.5Very high90.9Very high87 Ų8780.5 Ų80.546%0.45542%0.416SS..Hα-helixtrans-58.9-45.8175-95.965.5000111.1M46 L86 K92 A93 L94M46-L90 HydrophobicContact SD-CB 4.35Å; L86-L90 HydrophobicContact CD1-CD1 3.64Å; L86-L90 HydrophobicContact CG-CD1 4.09Å; L86-L90 WeakPolarHBondContact O-CD1 3.25Å; L86-L90 PolarHBondContact O-N 2.95Å; L90-K92 VanDerWaalsContact C-N 3.33Å; L90-K92 PolarHBondContact O-N 3.43Å; L90-A93 PolarHBondContact O-N 3.32Å; L90-L94 WeakPolarHBondContact O-CB 3.39Å; L90-L94 VanDerWaalsContact O-CG 3.23Å; L90-L94 WeakPolarHBondContact O-CG 3.48Å; L90-L94 PolarHBondContact O-N 3.42Å
91R90.8Very high90.9Very high114 Ų11482.9 Ų82.943%0.4342%0.422SS..Hα-helixtrans-58-45.2175.1-173.2179.2174.1-133.8-1.2111.7V43 M46 V87 W88 L89 V95V43-R91 HydrophobicContact CG1-CG 4.37Å; M46-R91 HydrophobicContact CE-CB 3.72Å; M46-R91 HydrophobicContact CE-CG 4.3Å; V87-R91 VanDerWaalsContact O-CB 3.3Å; V87-R91 WeakPolarHBondContact O-CB 3.46Å; V87-R91 PolarHBondContact O-N 3.42Å; W88-R91 PolarHBondContact O-N 3.23Å; L89-R91 PolarHBondContact O-N 2.99Å; R91-V95 WeakPolarHBondContact O-CB 3.46Å; R91-V95 VanDerWaalsContact O-CG2 3.25Å; R91-V95 WeakPolarHBondContact O-CG2 3.42Å; R91-V95 PolarHBondContact O-N 3.34Å
92K92.6Very high90.7Very high120 Ų12081.2 Ų81.252%0.52241%0.412SS..Hα-helixtrans-67.7-44.6-179.2-173.166.4175.3-177.80111.1W88 L89 L90 V95 V96W88-K92 WeakPolarHBondContact O-CB 3.17Å; W88-K92 PolarHBondContact O-N 3.27Å; L89-K92 PolarHBondContact O-N 3.38Å; L90-K92 VanDerWaalsContact C-N 3.33Å; L90-K92 PolarHBondContact O-N 3.43Å; K92-V95 PolarHBondContact O-N 2.89Å; K92-V96 HydrophobicContact CD-CG2 4.44Å; K92-V96 WeakPolarHBondContact O-CB 3.39Å; K92-V96 VanDerWaalsContact O-CG2 3.28Å; K92-V96 WeakPolarHBondContact O-CG2 3.14Å; K92-V96 PolarHBondContact O-N 2.85Å
93A92.3Very high90.7Very high49 Ų4984.2 Ų84.241%0.40542%0.418SS..Hα-helixtrans-60.9-50.1176.900000111.5L89 L90 V95 V96 I97L89-A93 WeakPolarHBondContact O-CB 3.19Å; L89-A93 PolarHBondContact O-N 2.86Å; L90-A93 PolarHBondContact O-N 3.32Å; A93-V95 PolarHBondContact O-N 3.45Å; A93-V96 PolarHBondContact O-N 3.38Å; A93-I97 WeakPolarHBondContact O-CB 3.28Å; A93-I97 WeakPolarHBondContact O-CD1 3.32Å; A93-I97 VanDerWaalsContact O-CG1 3.23Å; A93-I97 WeakPolarHBondContact O-CG1 3.4Å; A93-I97 PolarHBondContact O-N 2.93Å
94L89.6Confident90.7Very high55 Ų5590 Ų9029%0.28844%0.438SS..Hα-helixtrans-56.3-51.9175.4-71.2167.2000111.1M46 L90 V96 I97 F98M46-L94 HydrophobicContact CE-CD1 4.46Å; M46-L94 HydrophobicContact SD-CD1 3.55Å; M46-L94 VanDerWaalsContact SD-CD1 3.55Å; L90-L94 WeakPolarHBondContact O-CB 3.39Å; L90-L94 VanDerWaalsContact O-CG 3.23Å; L90-L94 WeakPolarHBondContact O-CG 3.48Å; L90-L94 PolarHBondContact O-N 3.42Å; L94-V96 VanDerWaalsContact C-N 3.32Å; L94-V96 PolarHBondContact O-N 3.48Å; L94-I97 PolarHBondContact O-N 2.74Å; L94-F98 HydrophobicContact CB-CD2 4.41Å; L94-F98 HydrophobicContact CD2-CE2 4.02Å; L94-F98 WeakPolarHBondContact O-CB 3.38Å; L94-F98 WeakPolarHBondContact O-CD2 3.46Å; L94-F98 PolarHBondContact O-N 2.96Å
95V89.6Confident90.7Very high59 Ų5989.8 Ų89.836%0.35843%0.434SS..Hα-helixtrans-60.1-40.1-179.6169.20000112V43 R91 K92 A93 S99V43-V95 HydrophobicContact CG2-CG2 4.4Å; R91-V95 WeakPolarHBondContact O-CB 3.46Å; R91-V95 VanDerWaalsContact O-CG2 3.25Å; R91-V95 WeakPolarHBondContact O-CG2 3.42Å; R91-V95 PolarHBondContact O-N 3.34Å; K92-V95 PolarHBondContact O-N 2.89Å; A93-V95 PolarHBondContact O-N 3.45Å; V95-S99 VanDerWaalsContact O-CB 3.25Å; V95-S99 WeakPolarHBondContact O-CB 3.27Å; V95-S99 PolarHBondContact O-N 3.07Å; V95-S99 PolarHBondContact O-OG 2.76Å
96V92.4Very high90.6Very high57 Ų5791.1 Ų91.135%0.34544%0.435SS..Hα-helixtrans-73.2-40.3179170.60000112.5K92 A93 L94 S99 R100K92-V96 HydrophobicContact CD-CG2 4.44Å; K92-V96 WeakPolarHBondContact O-CB 3.39Å; K92-V96 VanDerWaalsContact O-CG2 3.28Å; K92-V96 WeakPolarHBondContact O-CG2 3.14Å; K92-V96 PolarHBondContact O-N 2.85Å; A93-V96 PolarHBondContact O-N 3.38Å; L94-V96 VanDerWaalsContact C-N 3.32Å; L94-V96 PolarHBondContact O-N 3.48Å; V96-S99 PolarHBondContact O-N 2.86Å; V96-S99 PolarHBondContact O-OG 3.28Å; V96-R100 HydrophobicContact CG1-CG 4.48Å; V96-R100 WeakPolarHBondContact O-CB 3.41Å; V96-R100 WeakPolarHBondContact O-CG 3.31Å; V96-R100 PolarHBondContact O-N 2.99Å
97I90Very high90.7Very high109 Ų10991.5 Ų91.556%0.55943%0.434SS*.Hα-helixtrans-64.9-45.2176.5-69.9164.7000109.9A93 L94 R101A93-I97 WeakPolarHBondContact O-CB 3.28Å; A93-I97 WeakPolarHBondContact O-CD1 3.32Å; A93-I97 VanDerWaalsContact O-CG1 3.23Å; A93-I97 WeakPolarHBondContact O-CG1 3.4Å; A93-I97 PolarHBondContact O-N 2.93Å; L94-I97 PolarHBondContact O-N 2.74Å; I97-R101 VanDerWaalsContact O-CB 3.31Å; I97-R101 WeakPolarHBondContact O-CB 3.26Å; I97-R101 PolarHBondContact O-N 2.91Å; I97-R101 VanDerWaalsContact O-N 3.1Å
98F86.2Confident90.7Very high59 Ų5995.8 Ų95.826%0.25945%0.451SS..Hα-helixtrans-69.3-38.5176.5-75.8-64.3000112.5Y35 L39 L94 R101 T102Y35-F98 HydrophobicContact CD1-CD1 4.34Å; Y35-F98 HydrophobicContact CD1-CE1 4.44Å; Y35-F98 HydrophobicContact CE1-CD1 4.31Å; Y35-F98 HydrophobicContact CE1-CE1 4.11Å; L39-F98 HydrophobicContact CD1-CB 4.01Å; L39-F98 HydrophobicContact CD1-CD2 3.58Å; L39-F98 HydrophobicContact CD1-CE2 4.3Å; L39-F98 HydrophobicContact CD1-CG 3.92Å; L39-F98 HydrophobicContact CD2-CB 4.34Å; L94-F98 HydrophobicContact CB-CD2 4.41Å; L94-F98 HydrophobicContact CD2-CE2 4.02Å; L94-F98 WeakPolarHBondContact O-CB 3.38Å; L94-F98 WeakPolarHBondContact O-CD2 3.46Å; L94-F98 PolarHBondContact O-N 2.96Å; F98-R101 PolarHBondContact O-N 2.72Å; F98-T102 PolarHBondContact O-N 2.97Å; F98-T102 PolarHBondContact O-OG1 2.72Å
99S87.9Confident90.8Very high59 Ų5989.1 Ų89.141%0.41343%0.427SS..Hα-helixtrans-63.8-48177.472.80000111.7V95 V96 R101 T102 E103V95-S99 VanDerWaalsContact O-CB 3.25Å; V95-S99 WeakPolarHBondContact O-CB 3.27Å; V95-S99 PolarHBondContact O-N 3.07Å; V95-S99 PolarHBondContact O-OG 2.76Å; V96-S99 PolarHBondContact O-N 2.86Å; V96-S99 PolarHBondContact O-OG 3.28Å; S99-R101 PolarHBondContact O-N 2.77Å; S99-T102 PolarHBondContact O-N 2.73Å; S99-T102 VanDerWaalsContact O-N 3.11Å; S99-E103 VanDerWaalsContact O-CB 3.28Å; S99-E103 WeakPolarHBondContact O-CB 3.33Å; S99-E103 PolarHBondContact O-N 3.34Å
100R91.9Very high90.8Very high164 Ų16489.9 Ų89.962%0.61943%0.428SS*.Hα-helixtrans-64.5-25.5176.8-64.7-179.594.51778.2112.8V96 R104V96-R100 HydrophobicContact CG1-CG 4.48Å; V96-R100 WeakPolarHBondContact O-CB 3.41Å; V96-R100 WeakPolarHBondContact O-CG 3.31Å; V96-R100 PolarHBondContact O-N 2.99Å; R100-R104 WeakPolarHBondContact O-CB 3.32Å; R100-R104 WeakPolarHBondContact O-CG 3.47Å; R100-R104 PolarHBondContact O-N 3.46Å
101R87.6Confident91Very high141 Ų14190.4 Ų90.453%0.53243%0.431SS..Hα-helixtrans-79-34.8172.8-171.8172.7-177.9136.82112.7I97 F98 S99 N105I97-R101 VanDerWaalsContact O-CB 3.31Å; I97-R101 WeakPolarHBondContact O-CB 3.26Å; I97-R101 PolarHBondContact O-N 2.91Å; I97-R101 VanDerWaalsContact O-N 3.1Å; F98-R101 PolarHBondContact O-N 2.72Å; S99-R101 PolarHBondContact O-N 2.77Å; R101-N105 PolarHBondContact O-N 2.82Å
102T87.4Confident91.2Very high55 Ų5586.1 Ų86.134%0.33742%0.416SS..Hα-helixtrans-69.4-43.7172.4-65.10000111.1F98 S99 N105 N106F98-T102 PolarHBondContact O-N 2.97Å; F98-T102 PolarHBondContact O-OG1 2.72Å; S99-T102 PolarHBondContact O-N 2.73Å; S99-T102 VanDerWaalsContact O-N 3.11Å; T102-N105 CarbonylContact O-C 3.52Å; T102-N105 PolarHBondContact O-N 3.36Å; T102-N105 VanDerWaalsContact O-N 3.07Å; T102-N106 PolarHBondContact O-N 2.84Å
103E90.8Very high91.3Very high110 Ų11083.5 Ų83.551%0.51441%0.405SS..Hα-helixtrans-52.6-56.7174.4-172.9168.3-128.100110.9S99 N105 N106 E107S99-E103 VanDerWaalsContact O-CB 3.28Å; S99-E103 WeakPolarHBondContact O-CB 3.33Å; S99-E103 PolarHBondContact O-N 3.34Å; E103-N105 PolarHBondContact O-N 2.98Å; E103-N105 VanDerWaalsContact O-N 3.1Å; E103-N106 WeakPolarHBondContact O-CA 3.17Å; E103-N106 WeakPolarHBondContact O-CB 3.49Å; E103-N106 PolarHBondContact O-N 2.99Å; E103-E107 WeakPolarHBondContact O-CG 3.38Å; E103-E107 PolarHBondContact O-N 2.96Å
104R90.1Very high91.4Very high171 Ų17184.3 Ų84.365%0.64540%0.4SS*.Hα-helixtrans-62.3-15.5174.6-76.1177.1166.2-179.1-4.7116.6R100 E107 K108R100-R104 WeakPolarHBondContact O-CB 3.32Å; R100-R104 WeakPolarHBondContact O-CG 3.47Å; R100-R104 PolarHBondContact O-N 3.46Å; R104-E107 WeakPolarHBondContact CA-OE2 3.28Å; R104-K108 WeakPolarHBondContact O-CD 3.41Å; R104-K108 WeakPolarHBondContact O-CG 3.25Å
105N89.8Confident91.6Very high55 Ų5586.7 Ų86.729%0.29441%0.41SS..Hα-helixtrans-92.7-27.4171.9-79.33.7000111.6L28 R101 T102 E103 L109L28-N105 HydrophobicContact CD2-CB 4.45Å; R101-N105 PolarHBondContact O-N 2.82Å; T102-N105 CarbonylContact O-C 3.52Å; T102-N105 PolarHBondContact O-N 3.36Å; T102-N105 VanDerWaalsContact O-N 3.07Å; E103-N105 PolarHBondContact O-N 2.98Å; E103-N105 VanDerWaalsContact O-N 3.1Å; N105-L109 WeakPolarHBondContact O-CB 3.42Å; N105-L109 PolarHBondContact O-N 2.79Å; N105-L109 VanDerWaalsContact O-N 3.12Å
106N91.2Very high91.7Very high74 Ų7484.8 Ų84.840%0.39640%0.397SS..Hα-helixtrans-74.5-40.9173.8-167.176.7000111.5T102 E103 K108 L109 E110T102-N106 PolarHBondContact O-N 2.84Å; E103-N106 WeakPolarHBondContact O-CA 3.17Å; E103-N106 WeakPolarHBondContact O-CB 3.49Å; E103-N106 PolarHBondContact O-N 2.99Å; N106-K108 VanDerWaalsContact C-N 3.33Å; N106-K108 PolarHBondContact O-N 2.87Å; N106-L109 WeakPolarHBondContact O-CB 3.4Å; N106-L109 PolarHBondContact O-N 3.31Å; N106-L109 VanDerWaalsContact O-N 3.08Å; N106-E110 PolarHBondContact ND2-OE1 3.29Å; N106-E110 PolarHBondContact O-N 3.36Å
107E94.1Very high91.7Very high104 Ų10488.8 Ų88.849%0.48641%0.406SS..Hα-helixtrans-49.2-54.6170.1-69.9168.7167.700110.5E103 R104 L109 E110 D111E103-E107 WeakPolarHBondContact O-CG 3.38Å; E103-E107 PolarHBondContact O-N 2.96Å; R104-E107 WeakPolarHBondContact CA-OE2 3.28Å; E107-L109 VanDerWaalsContact C-N 3.32Å; E107-L109 PolarHBondContact O-N 3.49Å; E107-E110 PolarHBondContact O-N 3.28Å; E107-E110 VanDerWaalsContact O-N 3.11Å; E107-D111 PolarHBondContact O-N 3.27Å
108K93Very high91.9Very high115 Ų11588.9 Ų88.950%0.540%0.402SS..Hα-helixtrans-61.8-34.6177.1-67174.7-176.6-1780114.1R104 N106 E110 L112R104-K108 WeakPolarHBondContact O-CD 3.41Å; R104-K108 WeakPolarHBondContact O-CG 3.25Å; N106-K108 VanDerWaalsContact C-N 3.33Å; N106-K108 PolarHBondContact O-N 2.87Å; K108-E110 VanDerWaalsContact C-N 3.32Å; K108-L112 WeakPolarHBondContact O-CB 3.48Å; K108-L112 WeakPolarHBondContact O-CD1 3.49Å; K108-L112 VanDerWaalsContact O-CG 3.25Å; K108-L112 WeakPolarHBondContact O-CG 3.47Å; K108-L112 PolarHBondContact O-N 3.11Å
109L94.6Very high92.1Very high17 Ų1787.5 Ų87.59%0.08940%0.397CS..Hα-helixtrans-68.7-35.4177.1178.562.6000111I25 L28 E29 N105 N106 E107 K113I25-L109 HydrophobicContact CB-CD1 4.28Å; I25-L109 HydrophobicContact CG1-CD1 4.38Å; I25-L109 HydrophobicContact CG2-CD1 3.9Å; L28-L109 HydrophobicContact CB-CD1 4.06Å; E29-L109 HydrophobicContact CG-CD1 3.85Å; E29-L109 HydrophobicContact CG-CD2 3.72Å; E29-L109 HydrophobicContact CG-CG 4.44Å; N105-L109 WeakPolarHBondContact O-CB 3.42Å; N105-L109 PolarHBondContact O-N 2.79Å; N105-L109 VanDerWaalsContact O-N 3.12Å; N106-L109 WeakPolarHBondContact O-CB 3.4Å; N106-L109 PolarHBondContact O-N 3.31Å; N106-L109 VanDerWaalsContact O-N 3.08Å; E107-L109 VanDerWaalsContact C-N 3.32Å; E107-L109 PolarHBondContact O-N 3.49Å; L109-K113 HydrophobicContact CD1-CD 4.41Å; L109-K113 HydrophobicContact CG-CD 4.3Å; L109-K113 WeakPolarHBondContact O-CB 3.27Å; L109-K113 WeakPolarHBondContact O-CD 3.5Å; L109-K113 WeakPolarHBondContact O-CG 3.46Å; L109-K113 PolarHBondContact O-N 3.07Å; L109-K113 VanDerWaalsContact O-N 3.17Å
110E94.4Very high92.3Very high114 Ų11485.6 Ų85.653%0.53338%0.382SS..Hα-helixtrans-73-41.3174-71.2176.9-170.300111.4N106 E107 K108 L112 K113 E114N106-E110 PolarHBondContact ND2-OE1 3.29Å; N106-E110 PolarHBondContact O-N 3.36Å; E107-E110 PolarHBondContact O-N 3.28Å; E107-E110 VanDerWaalsContact O-N 3.11Å; K108-E110 VanDerWaalsContact C-N 3.32Å; E110-L112 PolarHBondContact O-N 3.08Å; E110-K113 PolarHBondContact O-N 2.84Å; E110-E114 VanDerWaalsContact O-CB 3.3Å; E110-E114 WeakPolarHBondContact O-CB 3.48Å; E110-E114 PolarHBondContact O-N 2.91Å
111D95.6Very high92.2Very high97 Ų9783 Ų8352%0.51938%0.377SS..Hα-helixtrans-56.4-48.3172.1-73.2-34.8000112.3E107 K113 E114 Q115E107-D111 PolarHBondContact O-N 3.27Å; D111-K113 PolarHBondContact O-N 3.29Å; D111-E114 WeakPolarHBondContact O-CB 3.43Å; D111-E114 PolarHBondContact O-N 3.09Å; D111-Q115 WeakPolarHBondContact O-CG 3.35Å; D111-Q115 PolarHBondContact O-N 2.84Å
112L94.6Very high92.4Very high24 Ų2481.6 Ų81.613%0.12638%0.377CS..Hα-helixtrans-67-36.2179.5-70.4166.2000112L21 E24 I25 L28 K108 E110 E114 K116L21-L112 HydrophobicContact CD2-CD2 3.5Å; L21-L112 VanDerWaalsContact CD2-CD2 3.5Å; E24-L112 HydrophobicContact CB-CD1 4.22Å; I25-L112 HydrophobicContact CD1-CB 4.3Å; I25-L112 HydrophobicContact CG1-CB 3.78Å; L28-L112 HydrophobicContact CD1-CD1 3.45Å; L28-L112 VanDerWaalsContact CD1-CD1 3.45Å; K108-L112 WeakPolarHBondContact O-CB 3.48Å; K108-L112 WeakPolarHBondContact O-CD1 3.49Å; K108-L112 VanDerWaalsContact O-CG 3.25Å; K108-L112 WeakPolarHBondContact O-CG 3.47Å; K108-L112 PolarHBondContact O-N 3.11Å; E110-L112 PolarHBondContact O-N 3.08Å; L112-E114 VanDerWaalsContact C-N 3.35Å; L112-K116 WeakPolarHBondContact O-CB 3.38Å; L112-K116 PolarHBondContact O-N 3.42Å
113K93.4Very high92.5Very high65 Ų6579 Ų7928%0.28336%0.361SS..Hα-helixtrans-67.2-36.5173.2-75.8168.4-178.2173.80111.9I25 E29 L109 E110 D111 K116 R117I25-K113 HydrophobicContact CD1-CG 3.86Å; I25-K113 HydrophobicContact CG1-CG 4.2Å; I25-K113 HydrophobicContact CG2-CG 4.44Å; E29-K113 VanDerWaalsContact OE1-CE 3.27Å; E29-K113 WeakPolarHBondContact OE1-CE 3.17Å; E29-K113 IonicContact OE1-NZ 2.91Å; E29-K113 PolarHBondContact OE1-NZ 2.85Å; L109-K113 HydrophobicContact CD1-CD 4.41Å; L109-K113 HydrophobicContact CG-CD 4.3Å; L109-K113 WeakPolarHBondContact O-CB 3.27Å; L109-K113 WeakPolarHBondContact O-CD 3.5Å; L109-K113 WeakPolarHBondContact O-CG 3.46Å; L109-K113 PolarHBondContact O-N 3.07Å; L109-K113 VanDerWaalsContact O-N 3.17Å; E110-K113 PolarHBondContact O-N 2.84Å; D111-K113 PolarHBondContact O-N 3.29Å; K113-K116 PolarHBondContact O-N 3.03Å; K113-R117 WeakPolarHBondContact O-CG 3.38Å; K113-R117 PolarHBondContact O-N 3.19Å
114E95Very high92.3Very high67 Ų6779.3 Ų79.331%0.31336%0.364SS..Hα-helixtrans-68.9-42.3175.2179.568.1175.500112E110 D111 L112 R117 K118E110-E114 VanDerWaalsContact O-CB 3.3Å; E110-E114 WeakPolarHBondContact O-CB 3.48Å; E110-E114 PolarHBondContact O-N 2.91Å; D111-E114 WeakPolarHBondContact O-CB 3.43Å; D111-E114 PolarHBondContact O-N 3.09Å; L112-E114 VanDerWaalsContact C-N 3.35Å; E114-R117 PolarHBondContact O-N 3.13Å; E114-R117 IonicContact OE2-CZ 4Å; E114-R117 IonicContact OE2-NE 3.21Å; E114-R117 PolarHBondContact OE2-NE 2.95Å; E114-R117 IonicContact OE2-NH2 2.67Å; E114-R117 PolarHBondContact OE2-NH2 3.44Å; E114-K118 HydrophobicContact CG-CD 4.36Å; E114-K118 WeakPolarHBondContact O-CG 3.42Å; E114-K118 PolarHBondContact O-N 3.21Å; E114-K118 WeakPolarHBondContact OE1-CE 3.26Å; E114-K118 IonicContact OE1-NZ 3Å; E114-K118 PolarHBondContact OE1-NZ 3.03Å
115Q93.1Very high92.3Very high104 Ų10478.7 Ų78.749%0.48637%0.368SS..Hα-helixtrans-60.8-43.7171.2-73.1178.40.800111.5L21 D111 R117 K118 I119L21-Q115 HydrophobicContact CD1-CB 4.27Å; D111-Q115 WeakPolarHBondContact O-CG 3.35Å; D111-Q115 PolarHBondContact O-N 2.84Å; Q115-R117 VanDerWaalsContact C-N 3.35Å; Q115-R117 PolarHBondContact O-N 3.06Å; Q115-K118 PolarHBondContact O-N 3.48Å; Q115-I119 WeakPolarHBondContact O-CG1 3.44Å; Q115-I119 PolarHBondContact O-N 3.01Å
116K92.6Very high92.3Very high19 Ų1980.7 Ų80.78%0.08338%0.382CS..Hα-helixtrans-60.6-41.9175.6-169.5-171.8171.3-163.70111.9L18 L21 E22 I25 L112 K113 L120 F139L18-K116 HydrophobicContact CD2-CG 3.78Å; L21-K116 HydrophobicContact CD1-CB 4.23Å; E22-K116 IonicContact OE1-NZ 2.74Å; E22-K116 PolarHBondContact OE1-NZ 3.42Å; E22-K116 IonicContact OE2-NZ 2.7Å; I25-K116 HydrophobicContact CD1-CB 4.33Å; I25-K116 HydrophobicContact CD1-CD 4.06Å; L112-K116 WeakPolarHBondContact O-CB 3.38Å; L112-K116 PolarHBondContact O-N 3.42Å; K113-K116 PolarHBondContact O-N 3.03Å; K116-L120 HydrophobicContact CG-CD1 4.25Å; K116-L120 WeakPolarHBondContact O-CD1 3.44Å; K116-L120 WeakPolarHBondContact O-CG 3.36Å; K116-L120 PolarHBondContact O-N 2.97Å; K116-L120 VanDerWaalsContact O-N 3.14Å; K116-F139 VanDerWaalsContact CE-O 3.27Å; K116-F139 WeakPolarHBondContact CE-O 3.32Å; K116-F139 PolarHBondContact NZ-O 3.38Å
117R91.8Very high92.1Very high141 Ų14179.1 Ų79.153%0.53237%0.373SS..Hα-helixtrans-59.1-48.9173.8-79-171.4-70.5-104.23.7111.8K113 E114 Q115 I119 L120 E121K113-R117 WeakPolarHBondContact O-CG 3.38Å; K113-R117 PolarHBondContact O-N 3.19Å; E114-R117 PolarHBondContact O-N 3.13Å; E114-R117 IonicContact OE2-CZ 4Å; E114-R117 IonicContact OE2-NE 3.21Å; E114-R117 PolarHBondContact OE2-NE 2.95Å; E114-R117 IonicContact OE2-NH2 2.67Å; E114-R117 PolarHBondContact OE2-NH2 3.44Å; Q115-R117 VanDerWaalsContact C-N 3.35Å; Q115-R117 PolarHBondContact O-N 3.06Å; R117-I119 VanDerWaalsContact C-N 3.35Å; R117-I119 PolarHBondContact O-N 2.87Å; R117-L120 WeakPolarHBondContact O-CB 3.31Å; R117-L120 PolarHBondContact O-N 3.38Å; R117-L120 VanDerWaalsContact O-N 3.12Å; R117-E121 PolarHBondContact O-N 2.92Å
118K94.6Very high91.9Very high111 Ų11179.3 Ų79.348%0.48338%0.381SS..Hα-helixtrans-62.3-38.5-178.1-75.2167.3-179.9158.50113.1E114 Q115 E121 E122E114-K118 HydrophobicContact CG-CD 4.36Å; E114-K118 WeakPolarHBondContact O-CG 3.42Å; E114-K118 PolarHBondContact O-N 3.21Å; E114-K118 WeakPolarHBondContact OE1-CE 3.26Å; E114-K118 IonicContact OE1-NZ 3Å; E114-K118 PolarHBondContact OE1-NZ 3.03Å; Q115-K118 PolarHBondContact O-N 3.48Å; K118-E121 PolarHBondContact O-N 2.61Å; K118-E122 WeakPolarHBondContact O-CB 3.28Å; K118-E122 PolarHBondContact O-N 3.21Å
119I91.5Very high91.6Very high30 Ų3082.9 Ų82.915%0.15439%0.393CS..Hα-helixtrans-70.4-34.1175.4-63166.7000111.4T17 L18 L21 Q115 R117 E121 V123T17-I119 HydrophobicContact CG2-CD1 3.89Å; L18-I119 HydrophobicContact CD1-CG2 4.12Å; L18-I119 HydrophobicContact CD2-CB 3.99Å; L18-I119 HydrophobicContact CD2-CG2 3.8Å; L18-I119 HydrophobicContact CG-CG2 3.81Å; L21-I119 HydrophobicContact CD1-CD1 3.7Å; Q115-I119 WeakPolarHBondContact O-CG1 3.44Å; Q115-I119 PolarHBondContact O-N 3.01Å; R117-I119 VanDerWaalsContact C-N 3.35Å; R117-I119 PolarHBondContact O-N 2.87Å; I119-E121 VanDerWaalsContact C-N 3.34Å; I119-V123 HydrophobicContact CG2-CG2 4.48Å; I119-V123 WeakPolarHBondContact O-CB 3.49Å; I119-V123 VanDerWaalsContact O-CG2 3.23Å; I119-V123 WeakPolarHBondContact O-CG2 3.23Å; I119-V123 PolarHBondContact O-N 3.47Å
120L90.7Very high91.2Very high20 Ų2090.2 Ų90.211%0.10542%0.424CS..Hα-helixtrans-66.7-35.5173.4-73.1163.9000112.3L18 K116 R117 M124 I135 L136 F139L18-L120 HydrophobicContact CD1-CD2 4.27Å; L18-L120 HydrophobicContact CD2-CG 4.21Å; K116-L120 HydrophobicContact CG-CD1 4.25Å; K116-L120 WeakPolarHBondContact O-CD1 3.44Å; K116-L120 WeakPolarHBondContact O-CG 3.36Å; K116-L120 PolarHBondContact O-N 2.97Å; K116-L120 VanDerWaalsContact O-N 3.14Å; R117-L120 WeakPolarHBondContact O-CB 3.31Å; R117-L120 PolarHBondContact O-N 3.38Å; R117-L120 VanDerWaalsContact O-N 3.12Å; L120-M124 WeakPolarHBondContact O-CB 3.16Å; L120-M124 PolarHBondContact O-N 3.39Å; L120-M124 VanDerWaalsContact O-N 3.13Å; L120-I135 HydrophobicContact CD2-CG2 4.43Å; L120-L136 HydrophobicContact CD2-CD2 4.21Å; L120-F139 HydrophobicContact CD2-CB 3.95Å
121E90Very high90.8Very high109 Ų10987.9 Ų87.951%0.50942%0.415SS..Hα-helixtrans-69.7-48.6174.5-168.2164.3-138.800111.2R117 K118 I119 V123 M124 E125R117-E121 PolarHBondContact O-N 2.92Å; K118-E121 PolarHBondContact O-N 2.61Å; I119-E121 VanDerWaalsContact C-N 3.34Å; E121-V123 VanDerWaalsContact C-N 3.31Å; E121-V123 PolarHBondContact O-N 2.56Å; E121-M124 WeakPolarHBondContact O-CA 3.36Å; E121-M124 WeakPolarHBondContact O-CB 3.35Å; E121-M124 PolarHBondContact O-N 3.12Å; E121-E125 PolarHBondContact O-N 3.19Å
122E91.6Very high90.4Very high112 Ų11283.6 Ų83.652%0.52339%0.393SS..Hα-helixtrans-56.4-42.4173.8-176.4179.9-172.300112K118 M124 E125 T126K118-E122 WeakPolarHBondContact O-CB 3.28Å; K118-E122 PolarHBondContact O-N 3.21Å; E122-M124 VanDerWaalsContact C-N 3.34Å; E122-M124 PolarHBondContact O-N 3.34Å; E122-E125 PolarHBondContact O-N 3.29Å; E122-T126 HydrophobicContact CG-CG2 4.24Å; E122-T126 WeakPolarHBondContact O-CB 3.25Å; E122-T126 WeakPolarHBondContact O-CG2 3.4Å; E122-T126 PolarHBondContact O-N 3.4Å; E122-T126 PolarHBondContact O-OG1 3.01Å
123V89.6Confident90Very high1 Ų186.8 Ų86.81%0.00641%0.406CS..Hα-helixtrans-64.3-36.8175163.70000112.1T14 I119 E121 E127 A132 I135T14-V123 HydrophobicContact CG2-CG2 4.01Å; I119-V123 HydrophobicContact CG2-CG2 4.48Å; I119-V123 WeakPolarHBondContact O-CB 3.49Å; I119-V123 VanDerWaalsContact O-CG2 3.23Å; I119-V123 WeakPolarHBondContact O-CG2 3.23Å; I119-V123 PolarHBondContact O-N 3.47Å; E121-V123 VanDerWaalsContact C-N 3.31Å; E121-V123 PolarHBondContact O-N 2.56Å; V123-E127 HydrophobicContact CG1-CB 4.3Å; V123-E127 HydrophobicContact CG1-CG 4.23Å; V123-E127 HydrophobicContact CG2-CG 4.48Å; V123-E127 WeakPolarHBondContact O-CB 3.41Å; V123-E127 PolarHBondContact O-N 3.28Å; V123-E127 VanDerWaalsContact O-N 3.07Å; V123-A132 HydrophobicContact CG1-CB 4.16Å; V123-I135 HydrophobicContact CG1-CB 3.98Å; V123-I135 HydrophobicContact CG1-CD1 3.82Å; V123-I135 HydrophobicContact CG1-CG1 4.48Å; V123-I135 HydrophobicContact CG1-CG2 3.97Å; V123-I135 HydrophobicContact CG2-CD1 4.34Å; V123-I135 HydrophobicContact CG2-CG2 4.48Å
124M86.6Confident89.7Confident116 Ų11689.1 Ų89.157%0.57142%0.419SS*.Hα-helixtrans-69.9-31.9178-174.8176.764.300112.5L120 E121 E122L120-M124 WeakPolarHBondContact O-CB 3.16Å; L120-M124 PolarHBondContact O-N 3.39Å; L120-M124 VanDerWaalsContact O-N 3.13Å; E121-M124 WeakPolarHBondContact O-CA 3.36Å; E121-M124 WeakPolarHBondContact O-CB 3.35Å; E121-M124 PolarHBondContact O-N 3.12Å; E122-M124 VanDerWaalsContact C-N 3.34Å; E122-M124 PolarHBondContact O-N 3.34Å
125E90.6Very high89.2Confident157 Ų15786.1 Ų86.173%0.73441%0.405SS*.Hα-helixtrans-83.3-36.7176.6-66.2-167.9150.600113.6E121 E122E121-E125 PolarHBondContact O-N 3.19Å; E122-E125 PolarHBondContact O-N 3.29Å
126T89.3Confident88.9Confident97 Ų9783.3 Ų83.360%0.59539%0.393SS*.Hα-helixtrans-104.1-28.4-167.664.60000115.1E122E122-T126 HydrophobicContact CG-CG2 4.24Å; E122-T126 WeakPolarHBondContact O-CB 3.25Å; E122-T126 WeakPolarHBondContact O-CG2 3.4Å; E122-T126 PolarHBondContact O-N 3.4Å; E122-T126 PolarHBondContact O-OG1 3.01Å
127E87.1Confident88.5Confident42 Ų4285.6 Ų85.620%0.19640%0.404CS..SBendtrans-92.9151.9-176.8-63.2-161-162.400112.9T14 V123 N131 A132 I135T14-E127 PolarHBondContact OG1-OE1 2.98Å; V123-E127 HydrophobicContact CG1-CB 4.3Å; V123-E127 HydrophobicContact CG1-CG 4.23Å; V123-E127 HydrophobicContact CG2-CG 4.48Å; V123-E127 WeakPolarHBondContact O-CB 3.41Å; V123-E127 PolarHBondContact O-N 3.28Å; V123-E127 VanDerWaalsContact O-N 3.07Å; E127-N131 WeakPolarHBondContact OE2-CB 3.35Å; E127-N131 PolarHBondContact OE2-ND2 3.41Å; E127-A132 HydrophobicContact CB-CB 4.28Å; E127-I135 WeakPolarHBondContact OE1-CD1 3.31Å; E127-I135 VanDerWaalsContact OE2-CD1 3.25Å; E127-I135 WeakPolarHBondContact OE2-CD1 3.41Å
128T89.3Confident88.1Confident108 Ų10887.2 Ų87.266%0.66341%0.41SS*.  trans-61143.3177.570.30000111.2K130 N131 A132T128-K130 PolarHBondContact O-N 2.82Å; T128-N131 PolarHBondContact O-N 3.26Å; T128-A132 PolarHBondContact O-N 2.9Å
129Y88.1Confident87.7Confident189 Ų18982.3 Ų82.374%0.74139%0.389SS*.Hα-helixtrans-44.1-38-177.1175.1-101.2000114.9K133Y129-K133 WeakPolarHBondContact O-CB 3.35Å; Y129-K133 PolarHBondContact O-N 3.1Å
130K86.4Confident87.4Confident171 Ų17182.5 Ų82.574%0.74339%0.39SS*.Hα-helixtrans-67.4-42.5177.4-69.8-175.4177.8-179.80112.9T128 M134T128-K130 PolarHBondContact O-N 2.82Å; K130-M134 WeakPolarHBondContact O-CG 3.31Å; K130-M134 PolarHBondContact O-N 3.37Å
131N85.4Confident86.7Confident66 Ų6685 Ų8535%0.35341%0.408SS..Hα-helixtrans-77.2-46.1-179.7-141.648.9000110.8E127 T128 K133 M134 I135E127-N131 WeakPolarHBondContact OE2-CB 3.35Å; E127-N131 PolarHBondContact OE2-ND2 3.41Å; T128-N131 PolarHBondContact O-N 3.26Å; N131-K133 VanDerWaalsContact C-N 3.29Å; N131-K133 PolarHBondContact O-N 2.84Å; N131-M134 PolarHBondContact O-N 3.35Å; N131-M134 VanDerWaalsContact OD1-CE 3.3Å; N131-M134 WeakPolarHBondContact OD1-CE 3.35Å; N131-I135 WeakPolarHBondContact O-CG1 3.46Å; N131-I135 PolarHBondContact O-N 3.47Å
132A86.8Confident86Confident6 Ų685.2 Ų85.25%0.0541%0.409CS..Hα-helixtrans-53.7-44.6172.900000111.6V123 E127 T128 M134 I135 L136V123-A132 HydrophobicContact CG1-CB 4.16Å; E127-A132 HydrophobicContact CB-CB 4.28Å; T128-A132 PolarHBondContact O-N 2.9Å; A132-M134 PolarHBondContact O-N 3.29Å; A132-I135 PolarHBondContact O-N 3.03Å; A132-L136 WeakPolarHBondContact O-CB 3.37Å; A132-L136 VanDerWaalsContact O-CG 3.25Å; A132-L136 WeakPolarHBondContact O-CG 3.18Å; A132-L136 PolarHBondContact O-N 3.03Å
133K87.2Confident85Confident91 Ų9180.6 Ų80.640%0.39639%0.389SS..Hα-helixtrans-59.8-47.1174.8-179.6173.8173.6-178.80112.4Y129 N131 I135 L136 E137Y129-K133 WeakPolarHBondContact O-CB 3.35Å; Y129-K133 PolarHBondContact O-N 3.1Å; N131-K133 VanDerWaalsContact C-N 3.29Å; N131-K133 PolarHBondContact O-N 2.84Å; K133-I135 VanDerWaalsContact C-N 3.33Å; K133-I135 PolarHBondContact O-N 3.15Å; K133-L136 PolarHBondContact O-N 3.35Å; K133-E137 WeakPolarHBondContact CE-OE1 3.12Å; K133-E137 VanDerWaalsContact CE-OE2 3.31Å; K133-E137 WeakPolarHBondContact CE-OE2 3.02Å; K133-E137 HydrophobicContact CG-CG 4.33Å; K133-E137 IonicContact NZ-OE1 3.34Å; K133-E137 PolarHBondContact NZ-OE1 3.1Å; K133-E137 IonicContact NZ-OE2 2.68Å; K133-E137 WeakPolarHBondContact O-CB 3.37Å; K133-E137 WeakPolarHBondContact O-CG 3.45Å; K133-E137 PolarHBondContact O-N 3.25Å
134M85.4Confident84.1Confident114 Ų11484 Ų8456%0.56240%0.404SS*.Hα-helixtrans-62.6-38.9178.8-70.9-166.8-53.600112.4K130 N131 A132 R138K130-M134 WeakPolarHBondContact O-CG 3.31Å; K130-M134 PolarHBondContact O-N 3.37Å; N131-M134 PolarHBondContact O-N 3.35Å; N131-M134 VanDerWaalsContact OD1-CE 3.3Å; N131-M134 WeakPolarHBondContact OD1-CE 3.35Å; A132-M134 PolarHBondContact O-N 3.29Å; M134-R138 VanDerWaalsContact O-CB 3.24Å; M134-R138 WeakPolarHBondContact O-CB 3.38Å; M134-R138 PolarHBondContact O-N 3.47Å
135I85.9Confident83.6Confident5 Ų584.7 Ų84.73%0.02640%0.403CS..Hα-helixtrans-69.3-43.5178-62.8174.2000110.4V15 L18 L120 V123 E127 N131 A132 K133 R138 F139V15-I135 HydrophobicContact CG2-CD1 3.99Å; V15-I135 HydrophobicContact CG2-CG1 3.94Å; L18-I135 HydrophobicContact CD1-CG2 3.48Å; L18-I135 VanDerWaalsContact CD1-CG2 3.48Å; L120-I135 HydrophobicContact CD2-CG2 4.43Å; V123-I135 HydrophobicContact CG1-CB 3.98Å; V123-I135 HydrophobicContact CG1-CD1 3.82Å; V123-I135 HydrophobicContact CG1-CG1 4.48Å; V123-I135 HydrophobicContact CG1-CG2 3.97Å; V123-I135 HydrophobicContact CG2-CD1 4.34Å; V123-I135 HydrophobicContact CG2-CG2 4.48Å; E127-I135 WeakPolarHBondContact OE1-CD1 3.31Å; E127-I135 VanDerWaalsContact OE2-CD1 3.25Å; E127-I135 WeakPolarHBondContact OE2-CD1 3.41Å; N131-I135 WeakPolarHBondContact O-CG1 3.46Å; N131-I135 PolarHBondContact O-N 3.47Å; A132-I135 PolarHBondContact O-N 3.03Å; K133-I135 VanDerWaalsContact C-N 3.33Å; K133-I135 PolarHBondContact O-N 3.15Å; I135-R138 PolarHBondContact O-N 2.94Å; I135-R138 VanDerWaalsContact O-N 3.17Å; I135-F139 HydrophobicContact CG2-CD2 3.91Å; I135-F139 WeakPolarHBondContact O-CD2 3.47Å; I135-F139 PolarHBondContact O-N 3.43Å
136L85.8Confident82.8Confident44 Ų4482.6 Ų82.623%0.2339%0.392CS..Hα-helixtrans-59.8-50.9174.4-73.4165.4000111.2L120 A132 K133 R138 F139 D140 S143L120-L136 HydrophobicContact CD2-CD2 4.21Å; A132-L136 WeakPolarHBondContact O-CB 3.37Å; A132-L136 VanDerWaalsContact O-CG 3.25Å; A132-L136 WeakPolarHBondContact O-CG 3.18Å; A132-L136 PolarHBondContact O-N 3.03Å; K133-L136 PolarHBondContact O-N 3.35Å; L136-R138 PolarHBondContact O-N 2.85Å; L136-F139 PolarHBondContact O-N 2.89Å; L136-D140 HydrophobicContact CD2-CB 4.22Å; L136-D140 VanDerWaalsContact O-CB 3.32Å; L136-D140 WeakPolarHBondContact O-CB 3.41Å; L136-D140 PolarHBondContact O-N 3.25Å; L136-S143 PolarHBondContact O-OG 3.16Å
137E84.3Confident81.7Confident67 Ų6781 Ų8131%0.31338%0.38SS..Hα-helixtrans-59.5-28.9175.8-72.9-176.5146.700112.9K133 S143 N147K133-E137 WeakPolarHBondContact CE-OE1 3.12Å; K133-E137 VanDerWaalsContact CE-OE2 3.31Å; K133-E137 WeakPolarHBondContact CE-OE2 3.02Å; K133-E137 HydrophobicContact CG-CG 4.33Å; K133-E137 IonicContact NZ-OE1 3.34Å; K133-E137 PolarHBondContact NZ-OE1 3.1Å; K133-E137 IonicContact NZ-OE2 2.68Å; K133-E137 WeakPolarHBondContact O-CB 3.37Å; K133-E137 WeakPolarHBondContact O-CG 3.45Å; K133-E137 PolarHBondContact O-N 3.25Å; E137-S143 WeakPolarHBondContact CA-OG 3.36Å; E137-N147 PolarHBondContact OE1-ND2 2.87Å; E137-N147 VanDerWaalsContact OE1-ND2 3.16Å
138R84.5Confident81Confident176 Ų17685.1 Ų85.166%0.66440%0.399SS*.Hα-helixtrans-84.1-30.2-180-171.860.3-179.8-175.92.7114.3M134 I135 L136 K144M134-R138 VanDerWaalsContact O-CB 3.24Å; M134-R138 WeakPolarHBondContact O-CB 3.38Å; M134-R138 PolarHBondContact O-N 3.47Å; I135-R138 PolarHBondContact O-N 2.94Å; I135-R138 VanDerWaalsContact O-N 3.17Å; L136-R138 PolarHBondContact O-N 2.85Å; R138-K144 VanDerWaalsContact C-CE 3.44Å; R138-K144 WeakPolarHBondContact O-CE 3.41Å; R138-K144 PolarHBondContact O-NZ 3.42Å
139F85.9Confident80.1Confident7 Ų786.9 Ų86.93%0.03140%0.403CS..Hα-helixtrans-128.4-24.1-168.4-66.6-73.5000115.8V15 L18 E19 K116 L120 I135 L136V15-F139 HydrophobicContact CB-CE2 4.49Å; V15-F139 HydrophobicContact CG1-CE2 4.04Å; V15-F139 HydrophobicContact CG1-CZ 4.12Å; L18-F139 HydrophobicContact CB-CD1 3.83Å; L18-F139 HydrophobicContact CB-CD2 4.03Å; L18-F139 HydrophobicContact CB-CE1 3.84Å; L18-F139 HydrophobicContact CB-CE2 4.03Å; L18-F139 HydrophobicContact CB-CG 3.92Å; L18-F139 HydrophobicContact CB-CZ 3.92Å; L18-F139 HydrophobicContact CD1-CB 4.36Å; L18-F139 HydrophobicContact CD1-CD2 3.82Å; L18-F139 HydrophobicContact CD1-CE2 4.28Å; L18-F139 HydrophobicContact CD1-CG 4.12Å; E19-F139 HydrophobicContact CB-CE1 4.16Å; E19-F139 HydrophobicContact CB-CZ 4.19Å; K116-F139 VanDerWaalsContact CE-O 3.27Å; K116-F139 WeakPolarHBondContact CE-O 3.32Å; K116-F139 PolarHBondContact NZ-O 3.38Å; L120-F139 HydrophobicContact CD2-CB 3.95Å; I135-F139 HydrophobicContact CG2-CD2 3.91Å; I135-F139 WeakPolarHBondContact O-CD2 3.47Å; I135-F139 PolarHBondContact O-N 3.43Å; L136-F139 PolarHBondContact O-N 2.89Å
140D84.4Confident79Confident34 Ų3486 Ų8618%0.18241%0.406CS..  trans-73.8128.9173.6166.534.6000110.7L136 E142 S143 K144L136-D140 HydrophobicContact CD2-CB 4.22Å; L136-D140 VanDerWaalsContact O-CB 3.32Å; L136-D140 WeakPolarHBondContact O-CB 3.41Å; L136-D140 PolarHBondContact O-N 3.25Å; D140-E142 VanDerWaalsContact C-N 3.31Å; D140-E142 PolarHBondContact OD1-N 3.37Å; D140-E142 WeakPolarHBondContact OD2-CB 3.36Å; D140-S143 PolarHBondContact O-OG 3.4Å; D140-S143 WeakPolarHBondContact OD2-CB 3.4Å; D140-S143 PolarHBondContact OD2-N 3.05Å; D140-K144 WeakPolarHBondContact O-CG 3.39Å; D140-K144 PolarHBondContact O-N 3.09Å
141P76.9Confident77.6Confident73 Ų7382 Ų8247%0.47440%0.399SS..Hα-helixtrans-70.8-19173.529.6-36.8000114.2K145P141-K145 WeakPolarHBondContact O-CD 3.4Å; P141-K145 VanDerWaalsContact O-CG 3.3Å; P141-K145 WeakPolarHBondContact O-CG 3.35Å; P141-K145 PolarHBondContact O-N 2.6Å
142E74.6Confident76Confident114 Ų11483.2 Ų83.253%0.53341%0.41SS..Hα-helixtrans-79.4-45.2175.4-70-154.3176.700113D140 K144 K145 K146D140-E142 VanDerWaalsContact C-N 3.31Å; D140-E142 PolarHBondContact OD1-N 3.37Å; D140-E142 WeakPolarHBondContact OD2-CB 3.36Å; E142-K144 VanDerWaalsContact C-N 3.3Å; E142-K144 PolarHBondContact O-N 2.79Å; E142-K145 PolarHBondContact O-N 3.22Å; E142-K146 WeakPolarHBondContact O-CB 3.32Å; E142-K146 WeakPolarHBondContact O-CD 3.45Å; E142-K146 VanDerWaalsContact O-CG 3.27Å; E142-K146 WeakPolarHBondContact O-CG 3.48Å; E142-K146 PolarHBondContact O-N 3.33Å; E142-K146 WeakPolarHBondContact OE2-CE 3.31Å; E142-K146 IonicContact OE2-NZ 2.73Å; E142-K146 PolarHBondContact OE2-NZ 3.49Å
143S70.4Confident74.3Confident15 Ų1588.8 Ų88.811%0.10545%0.445CS..Hα-helixtrans-54.9-46174.769.20000111.1L136 E137 D140 K145 K146 N147L136-S143 PolarHBondContact O-OG 3.16Å; E137-S143 WeakPolarHBondContact CA-OG 3.36Å; D140-S143 PolarHBondContact O-OG 3.4Å; D140-S143 WeakPolarHBondContact OD2-CB 3.4Å; D140-S143 PolarHBondContact OD2-N 3.05Å; S143-K145 PolarHBondContact O-N 2.83Å; S143-K146 PolarHBondContact O-N 2.91Å; S143-N147 WeakPolarHBondContact O-CB 3.23Å; S143-N147 PolarHBondContact O-N 3.27Å
144K71.4Confident72.6Confident73 Ų7391.7 Ų91.732%0.31747%0.47SS..Hα-helixtrans-56.2-50.1174.6-71.8173.2-175.9173.90111.5E22 R138 D140 E142 K146 N147 E148E22-K144 IonicContact OE2-NZ 3.75Å; R138-K144 VanDerWaalsContact C-CE 3.44Å; R138-K144 WeakPolarHBondContact O-CE 3.41Å; R138-K144 PolarHBondContact O-NZ 3.42Å; D140-K144 WeakPolarHBondContact O-CG 3.39Å; D140-K144 PolarHBondContact O-N 3.09Å; E142-K144 VanDerWaalsContact C-N 3.3Å; E142-K144 PolarHBondContact O-N 2.79Å; K144-K146 PolarHBondContact O-N 3.13Å; K144-N147 PolarHBondContact O-N 2.8Å; K144-E148 PolarHBondContact O-N 3.19Å
145K75.3Confident70.4Confident130 Ų13089.2 Ų89.257%0.56547%0.474SS*.Hα-helixtrans-64.8-39.7178.8-74.7172.2-177.2174.20112.9P141 E142 S143 N147 E148 L149P141-K145 WeakPolarHBondContact O-CD 3.4Å; P141-K145 VanDerWaalsContact O-CG 3.3Å; P141-K145 WeakPolarHBondContact O-CG 3.35Å; P141-K145 PolarHBondContact O-N 2.6Å; E142-K145 PolarHBondContact O-N 3.22Å; S143-K145 PolarHBondContact O-N 2.83Å; K145-N147 VanDerWaalsContact C-N 3.33Å; K145-E148 PolarHBondContact O-N 3.47Å; K145-L149 WeakPolarHBondContact O-CB 3.3Å; K145-L149 WeakPolarHBondContact O-CD1 3.49Å; K145-L149 WeakPolarHBondContact O-CG 3.43Å; K145-L149 PolarHBondContact O-N 3.02Å
146K74.6Confident68.7Low113 Ų11394.8 Ų94.849%0.49151%0.511SS..Hα-helixtrans-61.8-44.3175-70.1160-169.5162.70109.8E142 S143 K144 L149 E150E142-K146 WeakPolarHBondContact O-CB 3.32Å; E142-K146 WeakPolarHBondContact O-CD 3.45Å; E142-K146 VanDerWaalsContact O-CG 3.27Å; E142-K146 WeakPolarHBondContact O-CG 3.48Å; E142-K146 PolarHBondContact O-N 3.33Å; E142-K146 WeakPolarHBondContact OE2-CE 3.31Å; E142-K146 IonicContact OE2-NZ 2.73Å; E142-K146 PolarHBondContact OE2-NZ 3.49Å; S143-K146 PolarHBondContact O-N 2.91Å; K144-K146 PolarHBondContact O-N 3.13Å; K146-L149 PolarHBondContact O-N 3.23Å; K146-E150 WeakPolarHBondContact O-CB 3.34Å; K146-E150 PolarHBondContact O-N 2.95Å
147N66.1Low66.8Low63 Ų63101 Ų10134%0.33754%0.539SS..Hα-helixtrans-68.5-37.1176.8-71.71.7000113.2E137 S143 K144 K145 E150 S151E137-N147 PolarHBondContact OE1-ND2 2.87Å; E137-N147 VanDerWaalsContact OE1-ND2 3.16Å; S143-N147 WeakPolarHBondContact O-CB 3.23Å; S143-N147 PolarHBondContact O-N 3.27Å; K144-N147 PolarHBondContact O-N 2.8Å; K145-N147 VanDerWaalsContact C-N 3.33Å; N147-E150 PolarHBondContact O-N 3.45Å; N147-S151 WeakPolarHBondContact O-CB 3.47Å; N147-S151 PolarHBondContact O-N 2.88Å; N147-S151 PolarHBondContact O-OG 3.22Å
148E71.4Confident64.9Low129 Ų129105.4 Ų105.460%0.60356%0.563SS**Hα-helixtrans-65.6-39.1172.3-75.5-175.7110.400112.4K144 K145 T152K144-E148 PolarHBondContact O-N 3.19Å; K145-E148 PolarHBondContact O-N 3.47Å; E148-T152 PolarHBondContact O-N 3.3Å; E148-T152 PolarHBondContact O-OG1 3.42Å
149L70.6Confident62.9Low144 Ų144103.2 Ų103.275%0.75457%0.569SS**Hα-helixtrans-68.2-35.5175.8-72.3165.5000112.4K145 K146K145-L149 WeakPolarHBondContact O-CB 3.3Å; K145-L149 WeakPolarHBondContact O-CD1 3.49Å; K145-L149 WeakPolarHBondContact O-CG 3.43Å; K145-L149 PolarHBondContact O-N 3.02Å; K146-L149 PolarHBondContact O-N 3.23Å
150E66.4Low60.8Low171 Ų171108.5 Ų108.580%0.79961%0.605SS**Hα-helixtrans-81.1-31.3178.1-167.3167.7113.300113.2K146 N147K146-E150 WeakPolarHBondContact O-CB 3.34Å; K146-E150 PolarHBondContact O-N 2.95Å; N147-E150 PolarHBondContact O-N 3.45Å
151S57Low59Low86 Ų86116.4 Ų116.460%0.60164%0.637SS**Hα-helixtrans-86.7-5.4178.360.80000114.6N147 P153N147-S151 WeakPolarHBondContact O-CB 3.47Å; N147-S151 PolarHBondContact O-N 2.88Å; N147-S151 PolarHBondContact O-OG 3.22Å; S151-P153 WeakPolarHBondContact O-CD 3.39Å
152T52Low57.3Low93 Ų93119.2 Ų119.257%0.57166%0.655SS**SBendtrans-68.5110.4169.7-66.70000109.7E148 V154E148-T152 PolarHBondContact O-N 3.3Å; E148-T152 PolarHBondContact O-OG1 3.42Å; T152-V154 PolarHBondContact O-N 2.92Å; T152-V154 VanDerWaalsContact O-N 3.13Å
153P49.8Very low56.1Low122 Ų122117.1 Ų117.179%0.79267%0.665SS**  trans-75.3111.9-173.9-13.430.3000110.5S151 G155S151-P153 WeakPolarHBondContact O-CD 3.39Å; P153-G155 PolarHBondContact O-N 3.4Å
154V52.3Low54.8Low153 Ų153125.9 Ų125.993%0.92770%0.704SS**  trans-66.7113.6168.9177.20000108.5T152T152-V154 PolarHBondContact O-N 2.92Å; T152-V154 VanDerWaalsContact O-N 3.13Å
155G39.8Very low53.4Low62 Ų62131.3 Ų131.364%0.63973%0.73SS**  trans-155156.1175.200000114.3P153P153-G155 PolarHBondContact O-N 3.4Å
156P48.7Very low52Low122 Ų122132.4 Ų132.479%0.79274%0.742SS**PPolyproline II helixcis-93.1159.2-9.736.1-31.6000112.6L158P156-L158 PolarHBondContact O-N 3.41Å
157Q45.9Very low50.6Low175 Ų175138.4 Ų138.482%0.81876%0.761SS**PPolyproline II helixtrans-58.1121165.6-78.6-90.63500110.7
158L45.2Very low49.5Very low158 Ų158144.5 Ų144.583%0.82779%0.788SS**PPolyproline II helixtrans-91134.2157.8-80.1171.8000108.7P156P156-L158 PolarHBondContact O-N 3.41Å
159T42.1Very low48.1Very low130 Ų130149.3 Ų149.380%0.79880%0.8SS**PPolyproline II helixtrans-65.3133.5-167.742.80000113K161T159-K161 PolarHBondContact O-N 2.88Å
160P42.2Very low46.9Very low119 Ų119149.6 Ų149.677%0.77380%0.801SS**PPolyproline II helixtrans-67.3117.7171.9-18.131.2000110.7
161K45.8Very low45.8Very low200 Ų200147.6 Ų147.687%0.8780%0.8SS**PPolyproline II helixtrans-72136.5156-97.9-174.2172.8-178.50108.5T159T159-K161 PolarHBondContact O-N 2.88Å
162P41Very low45.2Very low131 Ų131149 Ų14985%0.85181%0.805SS**SBendtrans-72.7142.6-178.829.7-34.7000111.6
163G50Low44.9Very low71 Ų71150.9 Ų150.973%0.73282%0.819SS**  trans105.881162.300000116.7
164Q42.9Very low44.2Very low199 Ų199154.4 Ų154.493%0.9382%0.822SS**  -166.3130.7122.3-106.4169.28.300111.6
165E42.9Very low43.7Very low186 Ų186155.5 Ų155.587%0.86982%0.819SS**  trans-79.9125-179.8-73.4-177.7123.300110.6
166L44.8Very low44.1Very low154 Ų154158.3 Ų158.381%0.80683%0.826SS**  77.492.886.4-162.7157000114
167R45.9Very low43.5Very low239 Ų239160.5 Ų160.590%0.90283%0.83SS**  trans-159.485.1137.3-158.9172.8-173.894.5-1.1112.2
168Q43.7Very low43.2Very low190 Ų190158.6 Ų158.689%0.88883%0.83SS**  trans-66.1149.4163.4-72177.9-18.100110.2
169R41Very low43.2Very low231 Ų231155.2 Ų155.287%0.87283%0.825SS**  trans-124.5115.8164-166.7175.9-166.1166.75.4109.5
170I45.4Very low43.8Very low150 Ų150154.8 Ų154.877%0.76982%0.824SS**  trans-62.4136.5174.6-60.8161.9000108.9
171V42.8Very low43.9Very low128 Ų128156.2 Ų156.278%0.77683%0.826SS**  trans-128.4100.5169.6-179.10000108.6
172T44.9Very low44.3Very low116 Ų116152 Ų15271%0.71282%0.819SS**  trans-80.9135.1165.136.30000109.6K174T172-K174 PolarHBondContact O-N 3.38Å
173P45.3Very low44Very low132 Ų132150.5 Ų150.586%0.85782%0.817SS**  trans-76124.1173.730.3-32.2000109.9
174K35.8Very low43.3Very low196 Ų196155.4 Ų155.485%0.85283%0.827SS**  trans-115.8121.6172.6-171.8175.3177.867.10109.7T172T172-K174 PolarHBondContact O-N 3.38Å
175M41.9Very low42.8Very low177 Ų177149.9 Ų149.987%0.87282%0.823SS**PPolyproline II helixtrans-66.4139.3174.2-64.7171.86800110.9
176P47.1Very low42.6Very low120 Ų120146.5 Ų146.578%0.77982%0.82SS**PPolyproline II helixtrans-82.9121.816732-30.2000110.4
177L35.8Very low42.3Very low168 Ų168144 Ų14488%0.8882%0.822SS**PPolyproline II helixtrans-86.1138.3164.7-179.266.2000108.7
178V41.4Very low41.7Very low135 Ų135137.7 Ų137.782%0.81882%0.82SS**  trans-108.3119.9178.1177.40000110.1
179A43.5Very low41.4Very low88 Ų88140 Ų14073%0.72782%0.821SS**  trans-147.1154.2164.100000108.8
180P55.6Low42.6Very low120 Ų120133.8 Ų133.878%0.77981%0.811SS**  trans-118-164.4-148.142.8-33.7000115.6
181N44.3Very low43.3Very low150 Ų150131.2 Ų131.280%0.80280%0.804SS**  trans101.7161.4155.8-112.621.7000118
182P54.3Low43Very low111 Ų111133.2 Ų133.272%0.72181%0.809SS**  -138.8174.9-107.641.7-22.6000116.7
183A34.8Very low42.4Very low99 Ų99131.4 Ų131.482%0.81881%0.806SS**  trans-155.9152.7162.500000113.9
184N34.3Very low41.9Very low175 Ų175130.8 Ų130.894%0.93681%0.805SS**  trans-82.8169.4-174.4-54.9-28.6000114
185G34Very low41.7Very low82 Ų82124.9 Ų124.985%0.84580%0.8SS**  trans167.4103.6160.100000116.4
186S38.5Very low42Very low115 Ų115122.2 Ų122.280%0.80480%0.795SS**  trans-94.9136.6-172.253.50000116.6
187A38.7Very low41.3Very low102 Ų102122 Ų12284%0.84380%0.796SS**  trans46.6131.4137.800000123.7
188A33.6Very low41.1Very low106 Ų106124.8 Ų124.888%0.87680%0.797SS**  trans-159.3162.1149.700000113.2
189R37.3Very low41.3Very low238 Ų238124.2 Ų124.290%0.89880%0.796SS**  trans-161.7-178.4-179.6-128.4-161.8159.5-162.6-1107.6
190P65.4Low40.7Very low101 Ų101123.3 Ų123.366%0.65680%0.795SS**  cis-113.9-99-12.421.45.5000111.9
191P60.7Low39.5Very low96 Ų96129 Ų12962%0.62380%0.801SS**  cis-131.9151.1-41.137.8-20.7000117.3
192L35.6Very low39Very low171 Ų171126.2 Ų126.290%0.89579%0.793SS**  trans62.2151.6150.9-61.6161.2000119.5
193A33.5Very low38Very low77 Ų77125.3 Ų125.364%0.63679%0.79SS**  cis-161.5143.3-25.400000107
194S34.8Very low38Very low120 Ų120129.9 Ų129.984%0.83979%0.794SS**  158.9162.189.8-78.80000108.4
195G30.7Very low37.9Very low72 Ų72127 Ų12774%0.74279%0.788SS**  trans-96.2-163.7168.600000113.1
196P47.5Very low38.3Very low120 Ų120127.7 Ų127.778%0.77979%0.785SS**  cis-138.5-169.72.742.4-23.9000115.7
197S32.8Very low38.6Very low115 Ų115128.6 Ų128.680%0.80479%0.788SS**  trans82.5126.9153.1-59.60000122
198Y32Very low38.2Very low227 Ų227127.9 Ų127.989%0.8979%0.791SS**  trans-73.9174.5152.9-76.7-92.8000110.4
199P46.5Very low38.2Very low124 Ų124126.2 Ų126.281%0.80578%0.784SS**  cis-136173.29.542.1-25.7000116.9
200G29.1Very low39Very low69 Ų69120.8 Ų120.871%0.71178%0.78SS**  trans116.9124.8131.100000120.1
201R30.4Very low38.8Very low239 Ų239121 Ų12190%0.90278%0.781SS**  trans63.4112.8134.2-154.4171.3-159.5-1724.9121
202S34.8Very low37.8Very low91 Ų91122.8 Ų122.864%0.63678%0.781SS**  trans-12.1143.6149.160.10000119.7
203S33.2Very low38Very low92 Ų92124.5 Ų124.564%0.64378%0.776SS**  166.8121.4100.4-83.90000115
204H34.9Very low38.1Very low195 Ų195124.2 Ų124.290%0.90378%0.78SS**  trans-143.3106149.4-62.8-71.1000106.4
205S33.1Very low38Very low115 Ų115127 Ų12780%0.80479%0.785SS**  85.3112.561.9-64.90000112.9
206A41.1Very low38.2Very low96 Ų96129.1 Ų129.179%0.79379%0.788SS**  trans-94.1-175.2173.600000111.5
207P45.9Very low37.8Very low134 Ų134128.1 Ų128.187%0.8779%0.79SS**  -145.5149.8129.835.9-20.7000117
208G29.5Very low37.9Very low87 Ų87129.3 Ų129.390%0.89779%0.792SS**  trans92.5136.4163.300000116.6
209G33.9Very low38.2Very low72 Ų72122.5 Ų122.574%0.74278%0.783SS**  cis-167163-6.800000112.4
210P53.6Low38Very low124 Ų124120.9 Ų120.981%0.80578%0.78SS**  trans-113.8-161.2-165.245.3-35.5000112.7
211P61.3Low38.4Very low105 Ų105126.3 Ų126.368%0.68279%0.787SS**  cis-124.7-173.2-525.42000112.9
212E40.4Very low38.6Very low133 Ų133123.4 Ų123.462%0.62178%0.784SS**  -167.3178.258.8-106-61.2119.100114.6
213R39.6Very low38.7Very low207 Ų207124.8 Ų124.878%0.78179%0.793SS**  trans-48.8162.2-176.7-64.8160.3171.783.4-0.7117.1
214G34.6Very low38.8Very low71 Ų71128.3 Ų128.373%0.73280%0.804SS**  cis118.3116.8-4.200000115.5
215L33.2Very low38.8Very low180 Ų180127.9 Ų127.994%0.94280%0.804SS**  trans-159.7168.6163-113.1173.6000112.3
216S35.3Very low39.1Very low115 Ų115133.9 Ų133.980%0.80481%0.81SS**  trans-103166-149.5-600000118.2
217A37.8Very low38.8Very low100 Ų100140.5 Ų140.583%0.82681%0.814SS**  trans-74154.4179.200000115.7
218V36.1Very low38.4Very low139 Ų139140.4 Ų140.484%0.84281%0.813SS**  trans-146143.9161.6179.50000108.2
219A37.4Very low38.8Very low85 Ų85145 Ų14570%0.70281%0.814SS**  trans51117.2166.500000117.8
220A42.4Very low39.1Very low89 Ų89147.7 Ų147.774%0.73682%0.816SS**  cis60.6126.520.700000115
221Q36.8Very low38.7Very low183 Ų183148.1 Ų148.186%0.85582%0.819SS**  trans70143.5-166.8-46.1179.3-10.900112.5
222Q36.2Very low37.4Very low179 Ų179146.2 Ų146.284%0.83682%0.818SS**  cis-129.2139.47.4-62.5169.3-1.800110.6
223S36.4Very low37.2Very low120 Ų120146.1 Ų146.184%0.83983%0.827SS**  trans-141.657.4177.764.50000112.2
224L35.4Very low37.4Very low166 Ų166142.2 Ų142.287%0.86983%0.828SS**  trans-95.5104.3175.6-67.9178.3000110.8
225M34.9Very low37.7Very low185 Ų185145 Ų14591%0.91183%0.831SS**  trans174.473.1140.6-94.3-58159.800109.3
226R38.8Very low38.3Very low242 Ų242142.5 Ų142.591%0.91383%0.825SS**  trans-108.796178.5-160.3179.8-158.9173.46.6109.7
227R34.7Very low38.7Very low235 Ų235140.7 Ų140.789%0.88783%0.825SS**  trans-66137.2169.2-77.8-173171.8-165.6-2.4109.6
228P37.6Very low39.2Very low131 Ų131142.3 Ų142.385%0.85182%0.824SS**  trans-75.7139.7172.131.3-32.9000110.3
229M39Very low39.7Very low184 Ų184139 Ų13991%0.90682%0.819SS**  trans-125.9141.2166.2-169.4166.1-175.800108.4
230T39.7Very low39.9Very low129 Ų129143.7 Ų143.779%0.79183%0.828SS**  trans-76.7149.7-171.641.30000112.6
231P44.1Very low40.1Very low133 Ų133143 Ų14386%0.86481%0.809SS**  trans-80.8126.7177.231.8-32.7000111.2
232G33.9Very low40.8Very low64 Ų64137.9 Ų137.966%0.6679%0.792SS**  trans-164.8125.3176.600000114.1
233T37.6Very low41.5Very low132 Ų132135.8 Ų135.881%0.8179%0.794SS**  trans50.8116.716355.10000119.5
234P42.6Very low42.5Very low125 Ų125131.3 Ų131.381%0.81277%0.767SS**PPolyproline II helixtrans-77.8132.5164.432.5-32000111.1
235V41.6Very low43.6Very low130 Ų130126.2 Ų126.279%0.78874%0.743SS**PPolyproline II helixtrans-88.4120.5172.2-179.80000109.5
236P45.2Very low44.8Very low126 Ų126123.3 Ų123.382%0.81874%0.739SS**THydrogen-bonded Turntrans-73.8127.3173.5-11.527.8000110.5
237G45.4Very low45.9Very low78 Ų78114.7 Ų114.780%0.80471%0.71SS**THydrogen-bonded Turntrans154.7-27168.500000116.8
238V48.4Very low47Very low133 Ų133107.6 Ų107.681%0.80669%0.693SS**SBendtrans-85.6120.2176.3-173.30000109.2M240V238-M240 PolarHBondContact O-N 2.93Å
239G44.9Very low48.3Very low71 Ų71106 Ų10673%0.73267%0.67SS**  trans-59.7126.2-175.300000112.6H241G239-H241 PolarHBondContact O-N 2.89Å
240M41.2Very low49.3Very low182 Ų182102.5 Ų102.590%0.89766%0.661SS**  trans-7096178.1-69.2-66.4154.800110.4V238V238-M240 PolarHBondContact O-N 2.93Å
241H48Very low50.3Low74 Ų74100.6 Ų100.634%0.34365%0.649SS.*  trans-61.7135.8160.3-168.6-76.5000108G239 Y303G239-H241 PolarHBondContact O-N 2.89Å; H241-Y303 AromaticContact CD2-CE1 3.99Å; H241-Y303 AromaticContact NE2-CE1 3.6Å
242P50.9Low51Low77 Ų7797.7 Ų97.750%0.563%0.626SS.*  trans-59.3163.3174.825.7-35.1000111.3G244P242-G244 PolarHBondContact O-N 2.84Å
243P51.3Low52.2Low135 Ų13598.7 Ų98.788%0.87762%0.621SS**SBendtrans-71.171.1-179.230.9-36.8000111.9
244G58.1Low53.2Low26 Ų26104 Ų10427%0.26863%0.626SS.*  trans-93.3174.9172.300000112.5P242 Y305P242-G244 PolarHBondContact O-N 2.84Å; G244-Y305 WeakPolarHBondContact CA-OH 3.33Å
245P58.5Low53.9Low58 Ų58106.6 Ų106.638%0.37763%0.627SS.*SBendtrans-58146.4174.5-20.633.5000110.3L247 Y305P245-L247 PolarHBondContact O-N 3.14Å; P245-Y305 VanDerWaalsContact CD-CE1 3.45Å; P245-Y305 HydrophobicContact CG-CD1 4.2Å; P245-Y305 HydrophobicContact CG-CE1 3.85Å
246P59.9Low54.9Low125 Ų125103.4 Ų103.481%0.81260%0.601SS**PPolyproline II helixtrans-56.1132.2178.523.9-33.6000110.3V248P246-V248 PolarHBondContact O-N 3.07Å
247L61.2Low56.2Low60 Ų6099.9 Ų99.931%0.31459%0.587SS.*PPolyproline II helixtrans-56.8132.7176.3-68.9171.1000109.5P245 R249 V251 A302P245-L247 PolarHBondContact O-N 3.14Å; L247-R249 WeakPolarHBondContact CB-O 2.97Å; L247-R249 PolarHBondContact O-N 2.9Å; L247-V251 HydrophobicContact CD1-CG2 4.1Å; L247-A302 HydrophobicContact CD2-CB 3.55Å
248V57.9Low57.6Low87 Ų8799.6 Ų99.653%0.52758%0.577SS.*SBendtrans-54.4-28.7-175.1-179.30000112.1P246 I297 F299P246-V248 PolarHBondContact O-N 3.07Å; V248-I297 HydrophobicContact CG1-CD1 4.27Å; V248-F299 HydrophobicContact CG2-CB 4.21Å
249R64.4Low58.8Low96 Ų9699.8 Ų99.836%0.36257%0.571SS.*SBendtrans-137.4149.3159.5-68-168.7172.5111.6-2.9110.7L247 E293L247-R249 WeakPolarHBondContact CB-O 2.97Å; L247-R249 PolarHBondContact O-N 2.9Å; R249-E293 IonicContact CZ-OE1 2.82Å; R249-E293 IonicContact CZ-OE2 3.96Å; R249-E293 IonicContact NH1-OE1 2.66Å; R249-E293 IonicContact NH1-OE2 2.63Å; R249-E293 PolarHBondContact NH1-OE2 3.4Å; R249-E293 IonicContact NH2-OE1 3.36Å; R249-E293 PolarHBondContact NH2-OE1 3.4Å; R249-E293 IonicContact NH2-OE2 3.92Å; R249-E293 PolarHBondContact NH2-OE2 2.84Å
250P61.4Low60Low112 Ų11298.7 Ų98.773%0.72755%0.549SS*.  trans-55.5139.3167.2-23.434000111.3L252P250-L252 PolarHBondContact O-N 2.82Å
251V59.8Low61.5Low88 Ų8896 Ų9653%0.53353%0.528SS..  trans-72.999.5169.5-179.80000107.8L247L247-V251 HydrophobicContact CD1-CG2 4.1Å
252L58.8Low62.8Low73 Ų7396.6 Ų96.638%0.38254%0.537SS..  trans-52.9131.6175.1-73.1158.6000109.8P250 R256P250-L252 PolarHBondContact O-N 2.82Å; L252-R256 VanDerWaalsContact CB-NH1 3.27Å; L252-R256 PolarHBondContact O-NH1 2.98Å
253P59.5Low63.9Low84 Ų8497.6 Ų97.655%0.54554%0.538SS..  trans-51.3150.9-173.4-31.636.7000115.1E255 R256P253-E255 VanDerWaalsContact C-N 3.34Å; P253-R256 VanDerWaalsContact O-CD 3.27Å; P253-R256 WeakPolarHBondContact O-CD 3.41Å; P253-R256 WeakPolarHBondContact O-CG 3.36Å; P253-R256 PolarHBondContact O-NH1 2.98Å
254R59Low64.8Low245 Ų24591.8 Ų91.893%0.92550%0.499SS*.SBendtrans-70.7-31176.1179.6174.6172.4167.4-2.7112.3
255E57.1Low65.5Low178 Ų178100.5 Ų100.583%0.83253%0.525SS*.SBendtrans-105.5123.3176.1-66.7179.9-160.300109P253P253-E255 VanDerWaalsContact C-N 3.34Å
256R62.5Low66.3Low63 Ų63104.9 Ų104.924%0.23854%0.544CS..  trans-138135.5-169.4-72151.7120.9129.2-28.3110L252 P253 D260 E264L252-R256 VanDerWaalsContact CB-NH1 3.27Å; L252-R256 PolarHBondContact O-NH1 2.98Å; P253-R256 VanDerWaalsContact O-CD 3.27Å; P253-R256 WeakPolarHBondContact O-CD 3.41Å; P253-R256 WeakPolarHBondContact O-CG 3.36Å; P253-R256 PolarHBondContact O-NH1 2.98Å; R256-D260 HydrophobicContact CB-CB 4.2Å; R256-D260 WeakPolarHBondContact CD-OD2 3.29Å; R256-D260 VanDerWaalsContact CG-OD2 3.31Å; R256-D260 WeakPolarHBondContact CG-OD2 3.35Å; R256-D260 IonicContact CZ-OD2 2.66Å; R256-D260 IonicContact NE-OD2 2.87Å; R256-D260 PolarHBondContact NE-OD2 3.46Å; R256-D260 IonicContact NH2-OD2 2.78Å; R256-E264 IonicContact CZ-OE1 3.79Å; R256-E264 IonicContact NE-OE1 3.54Å; R256-E264 IonicContact NH2-OE1 3.16Å; R256-E264 PolarHBondContact NH2-OE1 3.42Å
257G71.6Confident67Low52 Ų52104 Ų10454%0.53654%0.536SS..  trans-72.6165.7178.200000113.2M259 D260G257-M259 PolarHBondContact O-N 3.12Å; G257-D260 WeakPolarHBondContact O-CB 3.49Å; G257-D260 PolarHBondContact O-N 3.4Å; G257-D260 VanDerWaalsContact O-N 3.12Å
258A74.4Confident67.2Low72 Ų72103 Ų10360%0.59554%0.541SS*.Hα-helixtrans-58.9-31.1-17800000113.9D260 R261 V262A258-D260 VanDerWaalsContact C-N 3.34Å; A258-D260 PolarHBondContact O-N 3.06Å; A258-R261 WeakPolarHBondContact O-CB 3.34Å; A258-R261 PolarHBondContact O-N 3.39Å; A258-V262 PolarHBondContact O-N 3.16Å
259M74.4Confident67.7Low138 Ų138100.5 Ų100.568%0.6853%0.525SS*.Hα-helixtrans-64-37.8177.5-61.5-63.294.900112.5G257 R261 V262 I263G257-M259 PolarHBondContact O-N 3.12Å; M259-R261 PolarHBondContact O-N 2.93Å; M259-V262 PolarHBondContact O-N 3.39Å; M259-V262 VanDerWaalsContact O-N 3.13Å; M259-I263 WeakPolarHBondContact O-CG1 3.36Å; M259-I263 PolarHBondContact O-N 3.37Å
260D71.3Confident68Low48 Ų4896.7 Ų96.726%0.25752%0.516SS..Hα-helixtrans-63.1-33.8176.8-165.861.4000110.9R256 G257 A258 I263 E264R256-D260 HydrophobicContact CB-CB 4.2Å; R256-D260 WeakPolarHBondContact CD-OD2 3.29Å; R256-D260 VanDerWaalsContact CG-OD2 3.31Å; R256-D260 WeakPolarHBondContact CG-OD2 3.35Å; R256-D260 IonicContact CZ-OD2 2.66Å; R256-D260 IonicContact NE-OD2 2.87Å; R256-D260 PolarHBondContact NE-OD2 3.46Å; R256-D260 IonicContact NH2-OD2 2.78Å; G257-D260 WeakPolarHBondContact O-CB 3.49Å; G257-D260 PolarHBondContact O-N 3.4Å; G257-D260 VanDerWaalsContact O-N 3.12Å; A258-D260 VanDerWaalsContact C-N 3.34Å; A258-D260 PolarHBondContact O-N 3.06Å; D260-I263 PolarHBondContact O-N 2.84Å; D260-E264 WeakPolarHBondContact O-CB 3.48Å; D260-E264 WeakPolarHBondContact O-CG 3.23Å; D260-E264 PolarHBondContact O-N 3.09Å
261R71.1Confident68.3Low124 Ų12495.6 Ų95.647%0.46851%0.508SS..Hα-helixtrans-69.7-33.7174.2-58.8-53.2-162.41646.3113.7A258 M259 E264 Y265A258-R261 WeakPolarHBondContact O-CB 3.34Å; A258-R261 PolarHBondContact O-N 3.39Å; M259-R261 PolarHBondContact O-N 2.93Å; R261-E264 VanDerWaalsContact CD-OE2 3.26Å; R261-E264 WeakPolarHBondContact CD-OE2 3.28Å; R261-E264 IonicContact CZ-OE2 3.85Å; R261-E264 IonicContact NE-OE2 2.6Å; R261-E264 IonicContact NH1-OE2 3.74Å; R261-E264 PolarHBondContact NH1-OE2 3.21Å; R261-Y265 WeakPolarHBondContact O-CB 3.28Å; R261-Y265 PolarHBondContact O-N 3.12Å
262V75.1Confident68.7Low87 Ų87100.7 Ų100.753%0.52753%0.526SS..Hα-helixtrans-69.3-38.8173.8178.50000110.3A258 M259 Y265 L266A258-V262 PolarHBondContact O-N 3.16Å; M259-V262 PolarHBondContact O-N 3.39Å; M259-V262 VanDerWaalsContact O-N 3.13Å; V262-Y265 PolarHBondContact O-N 2.99Å; V262-L266 WeakPolarHBondContact O-CB 3.1Å; V262-L266 PolarHBondContact O-N 3.27Å
263I75.8Confident69.6Low99 Ų9999.1 Ų99.151%0.50852%0.518SS..Hα-helixtrans-66.8-46.9174.2-63.2163.3000110.7M259 D260 Y265 L266 V267M259-I263 WeakPolarHBondContact O-CG1 3.36Å; M259-I263 PolarHBondContact O-N 3.37Å; D260-I263 PolarHBondContact O-N 2.84Å; I263-Y265 PolarHBondContact O-N 3.36Å; I263-L266 PolarHBondContact O-N 2.71Å; I263-V267 HydrophobicContact CG2-CG2 4.09Å; I263-V267 VanDerWaalsContact O-CB 3.31Å; I263-V267 WeakPolarHBondContact O-CB 3.11Å; I263-V267 WeakPolarHBondContact O-CG2 3.33Å; I263-V267 PolarHBondContact O-N 3.39Å
264E70Confident70.8Confident13 Ų1396.7 Ų96.76%0.06150%0.498CS..Hα-helixtrans-56.2-37.4174-77.7-176.816000112.3R256 D260 R261 G268 D269 R274R256-E264 IonicContact CZ-OE1 3.79Å; R256-E264 IonicContact NE-OE1 3.54Å; R256-E264 IonicContact NH2-OE1 3.16Å; R256-E264 PolarHBondContact NH2-OE1 3.42Å; D260-E264 WeakPolarHBondContact O-CB 3.48Å; D260-E264 WeakPolarHBondContact O-CG 3.23Å; D260-E264 PolarHBondContact O-N 3.09Å; R261-E264 VanDerWaalsContact CD-OE2 3.26Å; R261-E264 WeakPolarHBondContact CD-OE2 3.28Å; R261-E264 IonicContact CZ-OE2 3.85Å; R261-E264 IonicContact NE-OE2 2.6Å; R261-E264 IonicContact NH1-OE2 3.74Å; R261-E264 PolarHBondContact NH1-OE2 3.21Å; E264-G268 CarbonylContact O-C 3.56Å; E264-G268 WeakPolarHBondContact O-CA 3.46Å; E264-G268 PolarHBondContact O-N 2.9Å; E264-D269 PolarHBondContact O-N 2.84Å; E264-R274 IonicContact OE1-NH2 3.76Å
265Y71.5Confident72.1Confident208 Ų20889.9 Ų89.982%0.81647%0.473SS*.Hα-helixtrans-72.5-44176.7-177-102.5000112.9R261 V262 I263R261-Y265 WeakPolarHBondContact O-CB 3.28Å; R261-Y265 PolarHBondContact O-N 3.12Å; V262-Y265 PolarHBondContact O-N 2.99Å; I263-Y265 PolarHBondContact O-N 3.36Å
266L75.6Confident73.6Confident150 Ų15083.4 Ų83.479%0.78545%0.45SS*.Hα-helixtrans-72.1-29.9-178.8-171.565000113V262 I263V262-L266 WeakPolarHBondContact O-CB 3.1Å; V262-L266 PolarHBondContact O-N 3.27Å; I263-L266 PolarHBondContact O-N 2.71Å
267V74.9Confident75Confident106 Ų10680.9 Ų80.964%0.64244%0.441SS*.Hα-helixtrans-94.9-17.3-180-179.90000112.3I263 D269I263-V267 HydrophobicContact CG2-CG2 4.09Å; I263-V267 VanDerWaalsContact O-CB 3.31Å; I263-V267 WeakPolarHBondContact O-CB 3.11Å; I263-V267 WeakPolarHBondContact O-CG2 3.33Å; I263-V267 PolarHBondContact O-N 3.39Å; V267-D269 VanDerWaalsContact C-N 3.26Å; V267-D269 HydrophobicContact CG1-CB 4.19Å; V267-D269 PolarHBondContact O-N 2.92Å
268G65.8Low76Confident41 Ų4183 Ų8342%0.42344%0.439SS..SBendtrans79.4-1-176.900000115E264 G270E264-G268 CarbonylContact O-C 3.56Å; E264-G268 WeakPolarHBondContact O-CA 3.46Å; E264-G268 PolarHBondContact O-N 2.9Å; G268-G270 PolarHBondContact O-N 2.89Å
269D68.4Low76.9Confident34 Ų3479.6 Ų79.618%0.18241%0.411CS..  trans-81.137.3-177.7-165.320.8000112.6E264 V267 R274 L290E264-D269 PolarHBondContact O-N 2.84Å; V267-D269 VanDerWaalsContact C-N 3.26Å; V267-D269 HydrophobicContact CG1-CB 4.19Å; V267-D269 PolarHBondContact O-N 2.92Å; D269-R274 PolarHBondContact O-NE 2.97Å; D269-R274 PolarHBondContact O-NH2 3.34Å; D269-R274 IonicContact OD1-CZ 3.98Å; D269-R274 IonicContact OD1-NE 2.72Å; D269-R274 PolarHBondContact OD1-NE 3.5Å; D269-R274 IonicContact OD1-NH1 3.96Å; D269-R274 PolarHBondContact OD1-NH1 3.33Å; D269-R274 IonicContact OD1-NH2 2.72Å; D269-R274 PolarHBondContact OD1-NH2 2.81Å; D269-R274 IonicContact OD2-CZ 3.47Å; D269-R274 IonicContact OD2-NH1 3.52Å; D269-R274 PolarHBondContact OD2-NH1 3.49Å; D269-R274 IonicContact OD2-NH2 2.74Å; D269-R274 PolarHBondContact OD2-NH2 3.38Å; D269-L290 HydrophobicContact CB-CD2 4.26Å; D269-L290 WeakPolarHBondContact OD1-CD2 3.24Å
270G71.1Confident77.7Confident16 Ų1678.7 Ų78.717%0.16541%0.405CS..  trans-73.6165.5179.600000113.4G268 Q272 N273G268-G270 PolarHBondContact O-N 2.89Å; G270-Q272 PolarHBondContact O-N 3.46Å; G270-N273 PolarHBondContact O-N 3.38Å
271P66.6Low78.8Confident89 Ų8983 Ų8358%0.57842%0.424SS*.THydrogen-bonded Turntrans-63-13.8-173.525.6-36000115.1
272Q68.6Low79.8Confident194 Ų19479.1 Ų79.191%0.90742%0.416SS*.THydrogen-bonded Turntrans-85.8-18.1175.2-65.6-178.5-2.300113.7G270G270-Q272 PolarHBondContact O-N 3.46Å
273N77.5Confident80.7Confident41 Ų4181.5 Ų81.522%0.21943%0.425CS..SBendtrans-105.919.7-179.7-152.945.5000113.6G270 K291 E292G270-N273 PolarHBondContact O-N 3.38Å; N273-K291 WeakPolarHBondContact O-CB 3.36Å; N273-K291 PolarHBondContact O-N 3.03Å; N273-K291 WeakPolarHBondContact OD1-CB 3.48Å; N273-K291 WeakPolarHBondContact OD1-CD 3.28Å; N273-E292 PolarHBondContact ND2-OE1 3.48Å; N273-E292 PolarHBondContact ND2-OE2 2.93Å
274R84.6Confident81.2Confident32 Ų3278.7 Ų78.712%0.12141%0.413CS..EExtended strand (participates in β ladder)trans-118142178.2-61.7-178.1-167.8-95.911.3111.2E264 D269 M288 A289E264-R274 IonicContact OE1-NH2 3.76Å; D269-R274 PolarHBondContact O-NE 2.97Å; D269-R274 PolarHBondContact O-NH2 3.34Å; D269-R274 IonicContact OD1-CZ 3.98Å; D269-R274 IonicContact OD1-NE 2.72Å; D269-R274 PolarHBondContact OD1-NE 3.5Å; D269-R274 IonicContact OD1-NH1 3.96Å; D269-R274 PolarHBondContact OD1-NH1 3.33Å; D269-R274 IonicContact OD1-NH2 2.72Å; D269-R274 PolarHBondContact OD1-NH2 2.81Å; D269-R274 IonicContact OD2-CZ 3.47Å; D269-R274 IonicContact OD2-NH1 3.52Å; D269-R274 PolarHBondContact OD2-NH1 3.49Å; D269-R274 IonicContact OD2-NH2 2.74Å; D269-R274 PolarHBondContact OD2-NH2 3.38Å; R274-M288 HydrophobicContact CB-CB 4.26Å; R274-M288 HydrophobicContact CB-SD 4.26Å; R274-A289 CarbonylContact C-O 3.48Å; R274-A289 VanDerWaalsContact CA-O 3.27Å; R274-A289 WeakPolarHBondContact CA-O 3.25Å
275Y86.2Confident82.2Confident103 Ų10382.2 Ų82.240%0.40443%0.43SS..EExtended strand (participates in β ladder)trans-115.6147.5171.5-67.3-46000112.1M288 A289 K291 F294Y275-M288 WeakPolarHBondContact O-CA 3.42Å; Y275-A289 PolarHBondContact N-O 3.4Å; Y275-A289 PolarHBondContact O-N 3.49Å; Y275-K291 HydrophobicContact CD2-CB 4.46Å; Y275-K291 HydrophobicContact CD2-CG 4.48Å; Y275-K291 HydrophobicContact CE2-CB 4.17Å; Y275-K291 HydrophobicContact CE2-CG 3.74Å; Y275-F294 HydrophobicContact CD2-CB 3.81Å; Y275-F294 AromaticContact CD2-CD1 3.52Å; Y275-F294 HydrophobicContact CD2-CD1 3.52Å; Y275-F294 HydrophobicContact CD2-CD2 4.42Å; Y275-F294 HydrophobicContact CD2-CE1 4.14Å; Y275-F294 AromaticContact CD2-CG 3.67Å; Y275-F294 HydrophobicContact CD2-CG 3.67Å; Y275-F294 HydrophobicContact CE2-CD1 4.3Å; Y275-F294 HydrophobicContact CG-CD1 4.12Å; Y275-F294 HydrophobicContact CG-CD2 4.45Å; Y275-F294 HydrophobicContact CG-CE1 4.4Å; Y275-F294 HydrophobicContact CG-CG 4.13Å
276A89.5Confident82.9Confident42 Ų4272.7 Ų72.735%0.34739%0.393SS..EExtended strand (participates in β ladder)trans-79.6129.2-177.900000112.4I278A276-I278 VanDerWaalsContact C-N 3.33Å; A276-I278 HydrophobicContact CB-CD1 4.38Å; A276-I278 HydrophobicContact CB-CG1 4.11Å; A276-I278 PolarHBondContact O-N 3.31Å
277L90.2Very high83.5Confident9 Ų965.8 Ų65.85%0.04736%0.358CS..EExtended strand (participates in β ladder)trans-81.477.5175.8-62.1179.7000110.6N286 G287 A289 F294 I297 F299L277-N286 HydrophobicContact CB-CB 4.24Å; L277-N286 WeakPolarHBondContact O-CB 3.39Å; L277-N286 PolarHBondContact O-N 2.98Å; L277-N286 PolarHBondContact O-ND2 2.89Å; L277-G287 WeakPolarHBondContact CB-O 3.14Å; L277-G287 PolarHBondContact N-O 2.97Å; L277-A289 HydrophobicContact CD1-CB 4.34Å; L277-A289 HydrophobicContact CD2-CB 3.96Å; L277-A289 HydrophobicContact CG-CB 4.24Å; L277-F294 HydrophobicContact CD2-CD2 3.97Å; L277-F294 HydrophobicContact CD2-CE2 4.17Å; L277-I297 HydrophobicContact CD2-CG2 3.99Å; L277-F299 HydrophobicContact CB-CD1 4.39Å; L277-F299 HydrophobicContact CB-CE1 4.01Å; L277-F299 HydrophobicContact CB-CE2 4.21Å; L277-F299 HydrophobicContact CB-CZ 3.92Å; L277-F299 HydrophobicContact CD2-CD1 4.01Å; L277-F299 HydrophobicContact CD2-CE1 3.99Å
278I92.5Very high84Confident97 Ų9764.1 Ų64.150%0.49734%0.344SS..EExtended strand (participates in β ladder)trans-83.9126.7177.3-58.3174.9000109.4A276A276-I278 VanDerWaalsContact C-N 3.33Å; A276-I278 HydrophobicContact CB-CD1 4.38Å; A276-I278 HydrophobicContact CB-CG1 4.11Å; A276-I278 PolarHBondContact O-N 3.31Å
279C93.2Very high85Confident0 Ų062.1 Ų62.10%032%0.324CS..  trans-76.4134.3178178.20000111.9Q281 L283 S284 C301 C304 N308C279-Q281 PolarHBondContact O-N 2.95Å; C279-L283 WeakPolarHBondContact O-CA 3.07Å; C279-L283 PolarHBondContact O-N 3.25Å; C279-S284 PolarHBondContact N-O 3.5Å; C279-C301 HydrophobicContact CB-CB 3.87Å; C279-C301 VanDerWaalsContact SG-CB 3.6Å; C279-C304 VanDerWaalsContact SG-SG 3.64Å; C279-N308 VanDerWaalsContact CA-OD1 3.29Å; C279-N308 WeakPolarHBondContact CA-OD1 3.4Å; C279-N308 PolarHBondContact SG-OD1 3.29Å
280Q93.1Very high85.7Confident120 Ų12062.8 Ų62.856%0.56133%0.327SS*.THydrogen-bonded Turntrans-64.6-36.9-178.8-60.5176.210.500112.9F306 N308Q280-F306 HydrophobicContact CB-CE1 4.2Å; Q280-N308 PolarHBondContact N-OD1 2.88Å
281Q94.3Very high86.2Confident137 Ų13766.8 Ų66.864%0.6434%0.34SS*.THydrogen-bonded Turntrans-82.9-29.3-173.1-172.364.811.900114.4C279 F306C279-Q281 PolarHBondContact O-N 2.95Å; Q281-F306 HydrophobicContact CB-CB 3.87Å; Q281-F306 HydrophobicContact CB-CD1 3.94Å; Q281-F306 HydrophobicContact CB-CD2 3.9Å; Q281-F306 HydrophobicContact CB-CE1 4.46Å; Q281-F306 HydrophobicContact CB-CE2 4.43Å; Q281-F306 HydrophobicContact CB-CG 3.63Å; Q281-F306 HydrophobicContact CG-CB 4.39Å; Q281-F306 HydrophobicContact CG-CD2 4.17Å; Q281-F306 HydrophobicContact CG-CG 4.29Å
282C91.3Very high87Confident44 Ų4467.6 Ų67.630%0.29734%0.336SS..THydrogen-bonded Turntrans-131.75.3-175.470.30000114.6S284 C301 C304C282-S284 PolarHBondContact O-N 3Å; C282-S284 PolarHBondContact O-OG 2.9Å; C282-S284 PolarHBondContact SG-OG 3.33Å; C282-S284 VanDerWaalsContact SG-OG 3.41Å; C282-C301 VanDerWaalsContact SG-SG 3.64Å; C282-C304 HydrophobicContact CB-CB 3.97Å; C282-C304 PolarHBondContact SG-SG 3.32Å
283L94Very high87.7Confident137 Ų13760.6 Ų60.672%0.71730%0.303SS*.  trans54.510179.2-52.1-178.9000115.7C279C279-L283 WeakPolarHBondContact O-CA 3.07Å; C279-L283 PolarHBondContact O-N 3.25Å
284S86.9Confident88.2Confident39 Ų3960.4 Ų60.427%0.27330%0.3SS..  trans-77.6147.3-177.8-580000111.5C279 C282 N286 Y303C279-S284 PolarHBondContact N-O 3.5Å; C282-S284 PolarHBondContact O-N 3Å; C282-S284 PolarHBondContact O-OG 2.9Å; C282-S284 PolarHBondContact SG-OG 3.33Å; C282-S284 VanDerWaalsContact SG-OG 3.41Å; S284-N286 PolarHBondContact O-ND2 3.46Å; S284-Y303 VanDerWaalsContact CB-CD2 3.45Å
285H90.6Very high88.3Confident88 Ų8862 Ų6241%0.40731%0.31SS..EExtended strand (participates in β ladder)trans-87.2125.5-179176-119.8000111.9G287 Y303H285-G287 PolarHBondContact NE2-O 2.94Å; H285-G287 VanDerWaalsContact NE2-O 3.09Å; H285-Y303 WeakPolarHBondContact O-CE2 3.44Å; H285-Y303 PolarHBondContact O-OH 2.77Å
286N86.7Confident88.4Confident8 Ų860.7 Ų60.74%0.04330%0.304CS..EExtended strand (participates in β ladder)trans-112.123.3-174.6-56.2-98.6000112.6L277 S284 F299 C301 A302L277-N286 HydrophobicContact CB-CB 4.24Å; L277-N286 WeakPolarHBondContact O-CB 3.39Å; L277-N286 PolarHBondContact O-N 2.98Å; L277-N286 PolarHBondContact O-ND2 2.89Å; S284-N286 PolarHBondContact O-ND2 3.46Å; N286-F299 HydrophobicContact CB-CD2 4.17Å; N286-F299 HydrophobicContact CB-CE2 3.9Å; N286-C301 WeakPolarHBondContact OD1-CA 3.41Å; N286-C301 PolarHBondContact OD1-SG 2.81Å; N286-A302 PolarHBondContact OD1-N 2.84Å
287G87.2Confident88.3Confident5 Ų560.2 Ų60.25%0.05230%0.296CS..EExtended strand (participates in β ladder)trans96.5-168.9-175.400000113.3L277 H285L277-G287 WeakPolarHBondContact CB-O 3.14Å; L277-G287 PolarHBondContact N-O 2.97Å; H285-G287 PolarHBondContact NE2-O 2.94Å; H285-G287 VanDerWaalsContact NE2-O 3.09Å
288M85.6Confident88.4Confident70 Ų7062.4 Ų62.435%0.34532%0.315SS..EExtended strand (participates in β ladder)trans-118.6149.3-173.3-63.9-177.7-69.100112R274 Y275R274-M288 HydrophobicContact CB-CB 4.26Å; R274-M288 HydrophobicContact CB-SD 4.26Å; Y275-M288 WeakPolarHBondContact O-CA 3.42Å
289A86.1Confident88.3Confident0 Ų058.6 Ų58.60%030%0.295CS..EExtended strand (participates in β ladder)trans-124.1156.5171.200000110.9R274 Y275 L277 I297R274-A289 CarbonylContact C-O 3.48Å; R274-A289 VanDerWaalsContact CA-O 3.27Å; R274-A289 WeakPolarHBondContact CA-O 3.25Å; Y275-A289 PolarHBondContact N-O 3.4Å; Y275-A289 PolarHBondContact O-N 3.49Å; L277-A289 HydrophobicContact CD1-CB 4.34Å; L277-A289 HydrophobicContact CD2-CB 3.96Å; L277-A289 HydrophobicContact CG-CB 4.24Å; A289-I297 HydrophobicContact CB-CD1 4.49Å; A289-I297 HydrophobicContact CB-CG2 4.47Å
290L83.8Confident88.2Confident47 Ų4765.4 Ų65.425%0.24632%0.32CS..EExtended strand (participates in β ladder)trans-61.9147.8171.3-84.6160.5000111D269 E292 E293 F294D269-L290 HydrophobicContact CB-CD2 4.26Å; D269-L290 WeakPolarHBondContact OD1-CD2 3.24Å; L290-E292 PolarHBondContact O-N 3.33Å; L290-E293 HydrophobicContact CB-CB 4.33Å; L290-E293 HydrophobicContact CB-CG 4.08Å; L290-E293 PolarHBondContact O-N 3.15Å; L290-E293 VanDerWaalsContact O-N 3.08Å; L290-F294 WeakPolarHBondContact O-CB 3.39Å; L290-F294 PolarHBondContact O-N 3.49Å
291K82.7Confident88.1Confident100 Ų10059.7 Ų59.744%0.43529%0.294SS..Hα-helixtrans-53.5-41.2179.4176.9174.8-173.4-177.60112.8N273 Y275 E293N273-K291 WeakPolarHBondContact O-CB 3.36Å; N273-K291 PolarHBondContact O-N 3.03Å; N273-K291 WeakPolarHBondContact OD1-CB 3.48Å; N273-K291 WeakPolarHBondContact OD1-CD 3.28Å; Y275-K291 HydrophobicContact CD2-CB 4.46Å; Y275-K291 HydrophobicContact CD2-CG 4.48Å; Y275-K291 HydrophobicContact CE2-CB 4.17Å; Y275-K291 HydrophobicContact CE2-CG 3.74Å; K291-E293 VanDerWaalsContact C-N 3.31Å; K291-E293 PolarHBondContact O-N 3.43Å
292E83Confident87.6Confident107 Ų10753.5 Ų53.550%0.527%0.266SS..Hα-helixtrans-73.3-24.7-177.2-54.770.5-152.400112N273 L290 Y296N273-E292 PolarHBondContact ND2-OE1 3.48Å; N273-E292 PolarHBondContact ND2-OE2 2.93Å; L290-E292 PolarHBondContact O-N 3.33Å; E292-Y296 WeakPolarHBondContact O-CD2 3.39Å
293E82.9Confident87.4Confident46 Ų4656.8 Ų56.822%0.21527%0.273CS..Hα-helixtrans-93.8-30.5178.4-64.2-176.5127.800113.3R249 L290 K291 E295 Y296 I297R249-E293 IonicContact CZ-OE1 2.82Å; R249-E293 IonicContact CZ-OE2 3.96Å; R249-E293 IonicContact NH1-OE1 2.66Å; R249-E293 IonicContact NH1-OE2 2.63Å; R249-E293 PolarHBondContact NH1-OE2 3.4Å; R249-E293 IonicContact NH2-OE1 3.36Å; R249-E293 PolarHBondContact NH2-OE1 3.4Å; R249-E293 IonicContact NH2-OE2 3.92Å; R249-E293 PolarHBondContact NH2-OE2 2.84Å; L290-E293 HydrophobicContact CB-CB 4.33Å; L290-E293 HydrophobicContact CB-CG 4.08Å; L290-E293 PolarHBondContact O-N 3.15Å; L290-E293 VanDerWaalsContact O-N 3.08Å; K291-E293 VanDerWaalsContact C-N 3.31Å; K291-E293 PolarHBondContact O-N 3.43Å; E293-E295 PolarHBondContact O-N 3.01Å; E293-E295 VanDerWaalsContact O-N 3.1Å; E293-Y296 CarbonylContact O-C 3.56Å; E293-Y296 PolarHBondContact O-N 3.22Å; E293-I297 PolarHBondContact O-N 3.33Å
294F87Confident87.1Confident37 Ų3752.6 Ų52.616%0.16225%0.254CS..Hα-helixtrans-56.9-29.6-170.8177.5-103.1000113.9Y275 L277 L290Y275-F294 HydrophobicContact CD2-CB 3.81Å; Y275-F294 AromaticContact CD2-CD1 3.52Å; Y275-F294 HydrophobicContact CD2-CD1 3.52Å; Y275-F294 HydrophobicContact CD2-CD2 4.42Å; Y275-F294 HydrophobicContact CD2-CE1 4.14Å; Y275-F294 AromaticContact CD2-CG 3.67Å; Y275-F294 HydrophobicContact CD2-CG 3.67Å; Y275-F294 HydrophobicContact CE2-CD1 4.3Å; Y275-F294 HydrophobicContact CG-CD1 4.12Å; Y275-F294 HydrophobicContact CG-CD2 4.45Å; Y275-F294 HydrophobicContact CG-CE1 4.4Å; Y275-F294 HydrophobicContact CG-CG 4.13Å; L277-F294 HydrophobicContact CD2-CD2 3.97Å; L277-F294 HydrophobicContact CD2-CE2 4.17Å; L290-F294 WeakPolarHBondContact O-CB 3.39Å; L290-F294 PolarHBondContact O-N 3.49Å
295E88.4Confident87.2Confident67 Ų6755.8 Ų55.831%0.31326%0.261SS..THydrogen-bonded Turntrans-72.6-29.5175-56.5-164.5121.400112.8E293 R311 K312E293-E295 PolarHBondContact O-N 3.01Å; E293-E295 VanDerWaalsContact O-N 3.1Å; E295-R311 CarbonylContact O-C 3.57Å; E295-R311 WeakPolarHBondContact O-CA 3.09Å; E295-R311 WeakPolarHBondContact O-CB 3.36Å; E295-R311 PolarHBondContact O-N 3.24Å; E295-K312 HydrophobicContact CB-CB 4.48Å; E295-K312 HydrophobicContact CB-CD 4.11Å; E295-K312 HydrophobicContact CB-CG 4.3Å; E295-K312 VanDerWaalsContact CD-CE 3.45Å; E295-K312 PolarHBondContact O-N 3.39Å; E295-K312 WeakPolarHBondContact OE1-CE 3.47Å; E295-K312 IonicContact OE1-NZ 2.76Å; E295-K312 PolarHBondContact OE1-NZ 2.99Å; E295-K312 WeakPolarHBondContact OE2-CD 3.26Å; E295-K312 WeakPolarHBondContact OE2-CE 3.39Å; E295-K312 IonicContact OE2-NZ 2.68Å; E295-K312 PolarHBondContact OE2-NZ 2.86Å
296Y87.4Confident87.3Confident75 Ų7555.1 Ų55.129%0.29426%0.257SS..THydrogen-bonded Turntrans-107.1-8-170-56.7-76.8000114.1E292 E293 A310 K312 T313 R314E292-Y296 WeakPolarHBondContact O-CD2 3.39Å; E293-Y296 CarbonylContact O-C 3.56Å; E293-Y296 PolarHBondContact O-N 3.22Å; Y296-A310 WeakPolarHBondContact O-CB 3.26Å; Y296-K312 HydrophobicContact CD1-CB 3.83Å; Y296-K312 WeakPolarHBondContact CD1-O 3.41Å; Y296-K312 HydrophobicContact CE1-CB 3.53Å; Y296-K312 HydrophobicContact CE1-CD 4.28Å; Y296-T313 WeakPolarHBondContact CE1-O 3.28Å; Y296-R314 HydrophobicContact CD1-CB 4.28Å; Y296-R314 HydrophobicContact CD1-CG 3.46Å; Y296-R314 VanDerWaalsContact CD1-CG 3.46Å; Y296-R314 HydrophobicContact CE1-CG 4.17Å; Y296-R314 HydrophobicContact CG-CG 3.7Å
297I87.7Confident87.6Confident32 Ų3259.1 Ų59.116%0.16428%0.278CS..  trans-84.9122-178.9-165170.4000111.4V248 L277 A289 E293V248-I297 HydrophobicContact CG1-CD1 4.27Å; L277-I297 HydrophobicContact CD2-CG2 3.99Å; A289-I297 HydrophobicContact CB-CD1 4.49Å; A289-I297 HydrophobicContact CB-CG2 4.47Å; E293-I297 PolarHBondContact O-N 3.33Å
298A91.1Very high87.9Confident55 Ų5559 Ų5946%0.45528%0.276SS..  trans-95.3139.5162.800000108.8N308 A310A298-N308 CarbonylContact C-O 3.59Å; A298-N308 VanDerWaalsContact CA-O 3.3Å; A298-N308 WeakPolarHBondContact CA-O 3.48Å; A298-A310 HydrophobicContact CB-CB 4.35Å
299F90.4Very high88.2Confident17 Ų1759.3 Ų59.38%0.07528%0.284CS..EExtended strand (participates in β ladder)trans-143.4138.8-179.573.9-84.9000112.6V248 L277 N286 N308V248-F299 HydrophobicContact CG2-CB 4.21Å; L277-F299 HydrophobicContact CB-CD1 4.39Å; L277-F299 HydrophobicContact CB-CE1 4.01Å; L277-F299 HydrophobicContact CB-CE2 4.21Å; L277-F299 HydrophobicContact CB-CZ 3.92Å; L277-F299 HydrophobicContact CD2-CD1 4.01Å; L277-F299 HydrophobicContact CD2-CE1 3.99Å; N286-F299 HydrophobicContact CB-CD2 4.17Å; N286-F299 HydrophobicContact CB-CE2 3.9Å; F299-N308 HydrophobicContact CD1-CB 3.93Å; F299-N308 HydrophobicContact CE1-CB 3.61Å; F299-N308 HydrophobicContact CE2-CB 4.27Å; F299-N308 WeakPolarHBondContact CE2-ND2 3.36Å; F299-N308 HydrophobicContact CG-CB 4.4Å; F299-N308 HydrophobicContact CZ-CB 3.79Å; F299-N308 WeakPolarHBondContact CZ-ND2 3.38Å; F299-N308 PolarHBondContact N-O 3.41Å; F299-N308 WeakPolarHBondContact O-CB 3.38Å; F299-N308 PolarHBondContact O-N 3.41Å; F299-N308 PolarHBondContact O-ND2 3.36Å
300R92.3Very high88.4Confident142 Ų14261 Ų6154%0.53630%0.298SS..EExtended strand (participates in β ladder)trans-83132.3169.8-166.2174.4-71.5-97.59.3109.2Y305 F306 L307R300-Y305 WeakPolarHBondContact CD-O 3.22Å; R300-Y305 WeakPolarHBondContact CG-O 3.46Å; R300-Y305 PolarHBondContact NH1-O 2.98Å; R300-F306 CarbonylContact C-O 3.53Å; R300-F306 WeakPolarHBondContact CA-O 3.4Å; R300-L307 HydrophobicContact CB-CD1 4.47Å
301C90.5Very high88.5Confident1 Ų167.3 Ų67.31%0.00732%0.318CS..  trans-69.7135.9178.9-179.70000111.4C279 C282 N286 Y303 C304 Y305 F306C279-C301 HydrophobicContact CB-CB 3.87Å; C279-C301 VanDerWaalsContact SG-CB 3.6Å; C282-C301 VanDerWaalsContact SG-SG 3.64Å; N286-C301 WeakPolarHBondContact OD1-CA 3.41Å; N286-C301 PolarHBondContact OD1-SG 2.81Å; C301-Y303 VanDerWaalsContact C-N 3.29Å; C301-Y303 PolarHBondContact O-N 2.94Å; C301-C304 VanDerWaalsContact SG-SG 3.67Å; C301-Y305 WeakPolarHBondContact O-CA 3.34Å; C301-Y305 PolarHBondContact O-N 3.22Å; C301-F306 PolarHBondContact N-O 3.33Å
302A84.9Confident88.7Confident6 Ų667 Ų675%0.0532%0.317CS..THydrogen-bonded Turntrans-71.9-20.8-178.700000114.2L247 N286L247-A302 HydrophobicContact CD2-CB 3.55Å; N286-A302 PolarHBondContact OD1-N 2.84Å
303Y85.6Confident88.7Confident114 Ų11468.2 Ų68.245%0.44733%0.332SS..THydrogen-bonded Turntrans-98.8-51.6-175.5-48.5-82.1000112.4H241 S284 H285 C301H241-Y303 AromaticContact CD2-CE1 3.99Å; H241-Y303 AromaticContact NE2-CE1 3.6Å; S284-Y303 VanDerWaalsContact CB-CD2 3.45Å; H285-Y303 WeakPolarHBondContact O-CE2 3.44Å; H285-Y303 PolarHBondContact O-OH 2.77Å; C301-Y303 VanDerWaalsContact C-N 3.29Å; C301-Y303 PolarHBondContact O-N 2.94Å
304C87.4Confident88.4Confident48 Ų4873.8 Ų73.832%0.32435%0.351SS..THydrogen-bonded Turntrans-105.71.2-17674.40000114.3C279 C282 C301 F306C279-C304 VanDerWaalsContact SG-SG 3.64Å; C282-C304 HydrophobicContact CB-CB 3.97Å; C282-C304 PolarHBondContact SG-SG 3.32Å; C301-C304 VanDerWaalsContact SG-SG 3.67Å; C304-F306 PolarHBondContact O-N 2.89Å; C304-F306 VanDerWaalsContact SG-CB 3.53Å
305Y88.9Confident87.8Confident107 Ų10777.4 Ų77.442%0.4238%0.378SS..  trans59.85.5177.6-61.2-107.2000115.6G244 P245 R300 C301G244-Y305 WeakPolarHBondContact CA-OH 3.33Å; P245-Y305 VanDerWaalsContact CD-CE1 3.45Å; P245-Y305 HydrophobicContact CG-CD1 4.2Å; P245-Y305 HydrophobicContact CG-CE1 3.85Å; R300-Y305 WeakPolarHBondContact CD-O 3.22Å; R300-Y305 WeakPolarHBondContact CG-O 3.46Å; R300-Y305 PolarHBondContact NH1-O 2.98Å; C301-Y305 WeakPolarHBondContact O-CA 3.34Å; C301-Y305 PolarHBondContact O-N 3.22Å
306F93.4Very high86.9Confident74 Ų7482.8 Ų82.833%0.32540%0.403SS..  trans-63.3137.7174.2-177.3-98.7000111.1Q280 Q281 R300 C301 C304 N308Q280-F306 HydrophobicContact CB-CE1 4.2Å; Q281-F306 HydrophobicContact CB-CB 3.87Å; Q281-F306 HydrophobicContact CB-CD1 3.94Å; Q281-F306 HydrophobicContact CB-CD2 3.9Å; Q281-F306 HydrophobicContact CB-CE1 4.46Å; Q281-F306 HydrophobicContact CB-CE2 4.43Å; Q281-F306 HydrophobicContact CB-CG 3.63Å; Q281-F306 HydrophobicContact CG-CB 4.39Å; Q281-F306 HydrophobicContact CG-CD2 4.17Å; Q281-F306 HydrophobicContact CG-CG 4.29Å; R300-F306 CarbonylContact C-O 3.53Å; R300-F306 WeakPolarHBondContact CA-O 3.4Å; C301-F306 PolarHBondContact N-O 3.33Å; C304-F306 PolarHBondContact O-N 2.89Å; C304-F306 VanDerWaalsContact SG-CB 3.53Å; F306-N308 WeakPolarHBondContact CD1-OD1 3.5Å; F306-N308 PolarHBondContact O-ND2 2.85Å
307L94.1Very high86.1Confident91 Ų9183 Ų8348%0.47642%0.421SS..EExtended strand (participates in β ladder)trans-89108.3175.9179.361.1000109.4R300 P309R300-L307 HydrophobicContact CB-CD1 4.47Å; L307-P309 WeakPolarHBondContact O-CD 3.23Å
308N93.1Very high85.3Confident2 Ų287.2 Ų87.21%0.01145%0.45CS..EExtended strand (participates in β ladder)trans-82.9115.4173.9-52.1-89.5000107.4C279 Q280 A298 F299 F306C279-N308 VanDerWaalsContact CA-OD1 3.29Å; C279-N308 WeakPolarHBondContact CA-OD1 3.4Å; C279-N308 PolarHBondContact SG-OD1 3.29Å; Q280-N308 PolarHBondContact N-OD1 2.88Å; A298-N308 CarbonylContact C-O 3.59Å; A298-N308 VanDerWaalsContact CA-O 3.3Å; A298-N308 WeakPolarHBondContact CA-O 3.48Å; F299-N308 HydrophobicContact CD1-CB 3.93Å; F299-N308 HydrophobicContact CE1-CB 3.61Å; F299-N308 HydrophobicContact CE2-CB 4.27Å; F299-N308 WeakPolarHBondContact CE2-ND2 3.36Å; F299-N308 HydrophobicContact CG-CB 4.4Å; F299-N308 HydrophobicContact CZ-CB 3.79Å; F299-N308 WeakPolarHBondContact CZ-ND2 3.38Å; F299-N308 PolarHBondContact N-O 3.41Å; F299-N308 WeakPolarHBondContact O-CB 3.38Å; F299-N308 PolarHBondContact O-N 3.41Å; F299-N308 PolarHBondContact O-ND2 3.36Å; F306-N308 WeakPolarHBondContact CD1-OD1 3.5Å; F306-N308 PolarHBondContact O-ND2 2.85Å
309P92.3Very high84Confident78 Ų7895.5 Ų95.551%0.50647%0.47SS..  trans-72.3159-179.630.9-35.5000111.5L307L307-P309 WeakPolarHBondContact O-CD 3.23Å
310A90.3Very high82.7Confident36 Ų36102.1 Ų102.130%0.29851%0.505SS..  trans-62.7147.6169.300000110.7Y296 A298Y296-A310 WeakPolarHBondContact O-CB 3.26Å; A298-A310 HydrophobicContact CB-CB 4.35Å
311R85.9Confident81.4Confident178 Ų178101.2 Ų101.267%0.67252%0.517SS*.SBendtrans-76.9-26.8178.4-61174.7176.7-96.5-0.8112.3E295E295-R311 CarbonylContact O-C 3.57Å; E295-R311 WeakPolarHBondContact O-CA 3.09Å; E295-R311 WeakPolarHBondContact O-CB 3.36Å; E295-R311 PolarHBondContact O-N 3.24Å
312K86.8Confident79.8Confident95 Ų95109.5 Ų109.541%0.41356%0.556SS.*SBendtrans-136.9144.3176.3-62.3-177.9-172.9169.60109.1E295 Y296E295-K312 HydrophobicContact CB-CB 4.48Å; E295-K312 HydrophobicContact CB-CD 4.11Å; E295-K312 HydrophobicContact CB-CG 4.3Å; E295-K312 VanDerWaalsContact CD-CE 3.45Å; E295-K312 PolarHBondContact O-N 3.39Å; E295-K312 WeakPolarHBondContact OE1-CE 3.47Å; E295-K312 IonicContact OE1-NZ 2.76Å; E295-K312 PolarHBondContact OE1-NZ 2.99Å; E295-K312 WeakPolarHBondContact OE2-CD 3.26Å; E295-K312 WeakPolarHBondContact OE2-CE 3.39Å; E295-K312 IonicContact OE2-NZ 2.68Å; E295-K312 PolarHBondContact OE2-NZ 2.86Å; Y296-K312 HydrophobicContact CD1-CB 3.83Å; Y296-K312 WeakPolarHBondContact CD1-O 3.41Å; Y296-K312 HydrophobicContact CE1-CB 3.53Å; Y296-K312 HydrophobicContact CE1-CD 4.28Å
313T81.9Confident78.4Confident132 Ų132116.3 Ų116.381%0.8159%0.591SS**PPolyproline II helixtrans-77.6142.2163.144.90000109.2Y296Y296-T313 WeakPolarHBondContact CE1-O 3.28Å
314R77.6Confident76.9Confident163 Ų163115.5 Ų115.562%0.61561%0.608SS**PPolyproline II helixtrans-68.2139.4167.1-71-175.4176.6173.8-0.5108.2Y296 Q316Y296-R314 HydrophobicContact CD1-CB 4.28Å; Y296-R314 HydrophobicContact CD1-CG 3.46Å; Y296-R314 VanDerWaalsContact CD1-CG 3.46Å; Y296-R314 HydrophobicContact CE1-CG 4.17Å; Y296-R314 HydrophobicContact CG-CG 3.7Å; R314-Q316 PolarHBondContact O-N 3.45Å
315P73.8Confident75.3Confident113 Ų113116.9 Ų116.973%0.73462%0.623SS**PPolyproline II helixtrans-53.3134.5166-22.433000109.1A317P315-A317 PolarHBondContact O-N 3.45Å
316Q70.1Confident73.6Confident179 Ų179120.1 Ų120.184%0.83664%0.642SS**PPolyproline II helixtrans-67126.5167.6-75.1-156.47.600108.1R314R314-Q316 PolarHBondContact O-N 3.45Å
317A70.3Confident71.7Confident81 Ų81125 Ų12567%0.66967%0.67SS**PPolyproline II helixtrans-58.2131.1165.600000108.1P315 R319P315-A317 PolarHBondContact O-N 3.45Å; A317-R319 PolarHBondContact O-N 3.32Å
318P70.1Confident69.7Low120 Ų120129.6 Ų129.678%0.77969%0.686SS**PPolyproline II helixtrans-52.4134.3171-25.434.5000109.5L320P318-L320 PolarHBondContact O-N 2.98Å
319R63.6Low67.3Low228 Ų228138.4 Ų138.486%0.8673%0.73SS**  trans-66.5113.2175.5-75.9-168.8171.5155.1-0.2108.7A317A317-R319 PolarHBondContact O-N 3.32Å
320L62.8Low65.2Low156 Ų156139.9 Ų139.982%0.81775%0.749SS**PPolyproline II helixtrans-54.6136.4162.7-72.5167.8000108.1P318 E322P318-L320 PolarHBondContact O-N 2.98Å; L320-E322 PolarHBondContact O-N 3.45Å
321P66.5Low63.1Low123 Ų123143 Ų14380%0.79977%0.774SS**PPolyproline II helixtrans-52.5126.2174.3-27.736000110.6
322E56.1Low60.6Low176 Ų176138.1 Ų138.182%0.82278%0.779SS**PPolyproline II helixtrans-71.2134.9-172-157.4162.6134.300110.4L320 A324L320-E322 PolarHBondContact O-N 3.45Å; E322-A324 PolarHBondContact O-N 3.34Å
323L54.8Low58.2Low149 Ų149141.8 Ų141.878%0.7880%0.803SS**  trans-7457.6177.1-83.3165000111.3A325L323-A325 PolarHBondContact O-N 2.92Å
324A55.2Low56Low96 Ų96140.3 Ų140.379%0.79381%0.805SS**THydrogen-bonded Turntrans-72.126.1179.600000113.7E322E322-A324 PolarHBondContact O-N 3.34Å
325A54.3Low53.8Low78 Ų78137.3 Ų137.365%0.64582%0.815SS**THydrogen-bonded Turntrans-114.5-23.6-170.800000114.2L323L323-A325 PolarHBondContact O-N 2.92Å
326E51.8Low52Low174 Ų174137.5 Ų137.581%0.81382%0.819SS**SBendtrans-112.826.7-171.5-64.2-159.9117.800114.9
327L55.1Low50.4Low177 Ų177134.3 Ų134.393%0.92782%0.817SS**SBendtrans-119.235.2167.3-150.693.3000113
328K50.8Low48.9Very low187 Ų187135.4 Ų135.481%0.81382%0.819SS**SBendtrans-143.4131.2174.2-150.9161.8-172.3170.70109.5
329M44.3Very low47.3Very low187 Ų187134.9 Ų134.992%0.92182%0.818SS**  trans82.239.2-168.9-49.3-169.8-171.400117
330A46.2Very low45.8Very low110 Ų110128.9 Ų128.991%0.90981%0.811SS**  trans-102.766151.500000109.6
331A47.4Very low44.3Very low100 Ų100127.3 Ų127.383%0.82681%0.814SS**  trans-151.4112.417800000109.6
332G34.3Very low42.7Very low76 Ų76127.1 Ų127.178%0.78482%0.815SS**  trans159.8112-17600000110.7
333D35Very low41.6Very low172 Ų172124.6 Ų124.692%0.9282%0.817SS**  trans-78.2173.8-176.5-73.8-76.3000113.9
334A36.5Very low40.5Very low102 Ų102123.1 Ų123.184%0.84382%0.819SS**  trans-65145.5-175.300000115.2
335A31.1Very low39.3Very low99 Ų99123.6 Ų123.682%0.81882%0.823SS**  trans-159.2139.2143.700000113.1
336S35.1Very low38.2Very low118 Ų118126.7 Ų126.783%0.82583%0.834SS**  trans-71.8172.2156.556.80000110.7
337S37.5Very low37.2Very low112 Ų112121.6 Ų121.678%0.78383%0.828SS**  cis-158.2-167.114.159.70000107.5
338S38.6Very low36Very low103 Ų103123.2 Ų123.272%0.7283%0.831SS**  cis-157.8-174571.60000107.4
339S36.2Very low34.9Very low109 Ų109117.5 Ų117.576%0.76283%0.825SS**  cis-132-127.7-3.533.40000107.4
340S32.3Very low34.2Very low102 Ų102115.3 Ų115.371%0.71382%0.817SS**  cis-166.7148.3-7.744.90000106.7
341S32.3Very low33.9Very low124 Ų124117.3 Ų117.387%0.86781%0.808SS**  cis-151.8165.9-546.40000109.2
342S32.6Very low33.8Very low119 Ų119117.6 Ų117.683%0.83280%0.801SS**  trans-108.2145.6-164.256.20000115.5
343S32Very low33.9Very low123 Ų123120.8 Ų120.886%0.8680%0.799SS**  trans-160.4162.2139.759.70000110.6
344S31.4Very low34.2Very low118 Ų118118.7 Ų118.783%0.82580%0.798SS**  trans-158.6128-168.156.60000113
345A30.1Very low33.9Very low105 Ų105117.1 Ų117.187%0.86879%0.792SS**  trans-158.7146.9160.700000112.2
346T31.2Very low34.2Very low143 Ų143122.3 Ų122.388%0.87780%0.796SS**  trans-62.2151.7-178.348.10000117.6
347G31.1Very low34.7Very low67 Ų67122.1 Ų122.169%0.69179%0.792SS**  trans118.1144.7138.700000117.6
348E30.7Very low34.5Very low211 Ų211125.9 Ų125.999%0.98679%0.794SS**  trans64.5159.7168.9-48.8-176.2130.300114.6
349G27Very low34.5Very low67 Ų67128.8 Ų128.869%0.69180%0.8SS**  cis-175.4165-7.500000110.3
350D30.6Very low34.6Very low141 Ų141127.1 Ų127.175%0.75479%0.793SS**  trans64.6135.8175.1-72.9-43.5000118.4
351Q38.6Very low34.5Very low153 Ų153129.4 Ų129.472%0.71580%0.798SS**  cis95159.543.8-80.6-158.196.900113.8
352P46.6Very low34.7Very low105 Ų105129.5 Ų129.568%0.68279%0.793SS**  cis-136.8173.410.442.3-24.7000118.7
353L36Very low35.9Very low144 Ų144129.2 Ų129.275%0.75479%0.788SS**  trans39.3143.7144.9-83.446.6000123.8
354S40.2Very low35.8Very low128 Ų128131.8 Ų131.890%0.89579%0.791SS**  cis114.4139.8-3.5-165.80000118.9
355G30.3Very low35.7Very low69 Ų69129.7 Ų129.771%0.71179%0.788SS**  trans132.4142.9170.200000114
356K38.4Very low35.6Very low208 Ų208130.7 Ų130.790%0.90478%0.784SS**  cis-154.8175-3.8-107.5-158.7166177.60110.7
357P45Very low35.6Very low113 Ų113131.2 Ų131.273%0.73478%0.781SS**  trans-140.1-171.7-147.445.5-28.6000119.6
358K33.8Very low35.5Very low192 Ų192131.5 Ų131.584%0.83578%0.777SS**  trans87124.6151.3-148.9170.7-177.5-178.40117.5
359L37.5Very low35.4Very low163 Ų163130.4 Ų130.485%0.85377%0.772SS**  77.4137.553.6-138.883000113.3
360A38.9Very low35.5Very low74 Ų74135.4 Ų135.461%0.61278%0.777SS**  cis-139.9-145.616.800000112.3
361D30.6Very low36.4Very low150 Ų150134.2 Ų134.280%0.80278%0.777SS**  cis-161.6-170.77.6-135.3-45.6000114.3
362V35.9Very low36Very low126 Ų126130.1 Ų130.176%0.76478%0.776SS**  trans-149.3172.7-162.4151.50000111.4
363P57.9Low35.1Very low113 Ų113131.4 Ų131.473%0.73478%0.782SS**  cis-136.3-167.6333.8-8.6000118.9
364L30.3Very low35Very low178 Ų178131.7 Ų131.793%0.93278%0.783SS**  trans105.8137.9134.5-156.970.3000122.8
365G28.3Very low34.4Very low73 Ų73131 Ų13175%0.75377%0.774SS**  trans148.5131.3154.600000118.2
366T29.9Very low34.3Very low127 Ų127133.4 Ų133.478%0.77977%0.774SS**  trans-107.9151.5164.745.90000111
367D29.6Very low33.9Very low154 Ų154130.4 Ų130.482%0.82477%0.773SS**  175.6178.9110.9-106.6-72.6000115.7
368A29.7Very low33.3Very low72 Ų72133 Ų13360%0.59578%0.776SS**  trans-64.3169.9-16100000121.7
369Q27.9Very low34Very low189 Ų189129.4 Ų129.488%0.88377%0.772SS**  trans102.9124.3135.4-142.7112.2-12.400121.1
370E30.5Very low33.6Very low172 Ų172124.5 Ų124.580%0.80476%0.761SS**  trans-87.6-174.9156-122-156.1119.500110.1
371P49.4Very low33.2Very low115 Ų115126.8 Ų126.875%0.74777%0.773SS**  cis-126.3-179.4-15.439.6-23.8000113.5
372G29Very low33.3Very low68 Ų68124.1 Ų124.170%0.70177%0.771SS**  trans-163.8148.9173.300000114.9
373T28.2Very low33.2Very low132 Ų132123 Ų12381%0.8177%0.769SS**  trans-171.4164.9-174.3-99.50000112.8
374I33Very low32Very low150 Ų150124.1 Ų124.177%0.76977%0.769SS**  trans62.9156.5-176.729.8178.8000116.8
375T28.8Very low32Very low114 Ų114120.3 Ų120.370%0.69976%0.757SS**  cis-154.5151.313-10.80000113.9
376T28.1Very low32.4Very low118 Ų118126.3 Ų126.372%0.72477%0.765SS**  trans33.1129.7136.6-580000124
377T30Very low32.4Very low145 Ų145127.1 Ų127.189%0.8977%0.765SS**  -158.5139.9121.219.30000114.8
378E31.5Very low32.4Very low169 Ų169126.7 Ų126.779%0.7976%0.763SS**  trans-99-169.4161.6-124.3-148.2110.900108.7
379P50.1Low32.5Very low115 Ų115128.2 Ų128.275%0.74777%0.769SS**  cis-136.4-172.29.343.5-25.8000115.8
380G28Very low32.9Very low61 Ų61127.5 Ų127.563%0.62977%0.766SS**  trans165.564.8154.600000123.3
381S31.1Very low33.7Very low122 Ų122125 Ų12585%0.85377%0.765SS**  trans62.1124.8148-61.30000123.5
382A31.3Very low33.1Very low93 Ų93127.5 Ų127.577%0.76977%0.766SS**  trans56.1130.9134.500000121
383S34.3Very low33.1Very low103 Ų103131.9 Ų131.972%0.7277%0.773SS**  cis-164.4-167.1-4.5-73.20000107.8
384D32.3Very low33.7Very low136 Ų136129.9 Ų129.973%0.72777%0.765SS**  cis-157.9174.97.2-142.6-67.9000112.6
385S31.6Very low34.2Very low98 Ų98129 Ų12969%0.68577%0.769SS**  trans-2.7115.8162-62.20000121
386Q36.1Very low34.4Very low199 Ų199128.5 Ų128.593%0.9377%0.77SS**  -164.7100.6108.3-107.5177.64.700114.9
387N30.1Very low34.8Very low145 Ų145131.4 Ų131.478%0.77578%0.775SS**  trans-5.3117.2151.7-172.659.1000120.1
388N28.8Very low35.1Very low145 Ų145134 Ų13478%0.77578%0.775SS**  -168.2151.5106.1-15726.7000111.5
389S32.2Very low35.4Very low104 Ų104129.7 Ų129.773%0.72776%0.763SS**  trans-123.3161.7-172.4-58.40000114.5
390E37.1Very low34.9Very low173 Ų173130 Ų13081%0.80876%0.758SS**  trans-63.4165.8173.2-56.5175.471.800113.1
391P45.9Very low35.5Very low121 Ų121133.7 Ų133.779%0.78676%0.763SS**  -144171.390.340-25.4000116.7
392H36.8Very low35.9Very low167 Ų167134.7 Ų134.777%0.77376%0.755SS**  trans-42.6159.5160.2-72.7-116.1000115
393D30.2Very low36.3Very low159 Ų159137.8 Ų137.885%0.8575%0.753SS**  -152.8163.2115.5-143-20.5000113.1
394S39.7Very low36.5Very low90 Ų90139.6 Ų139.663%0.62976%0.755SS**  trans-95.3-172.3161.7-54.30000110
395P43.4Very low36.8Very low132 Ų132140.4 Ų140.486%0.85776%0.757SS**  -142.3153.2115.828.6-11.7000114.3
396S33.5Very low37.3Very low104 Ų104141 Ų14173%0.72776%0.761SS**  trans-92.8165.3176.350.80000113.4
397E36.2Very low37.7Very low178 Ų178135.6 Ų135.683%0.83275%0.751SS**  trans8.7139.2152.2-63167.5118.100120.6
398K37Very low38.5Very low201 Ų201136.3 Ų136.387%0.87475%0.752SS**  trans-143.8114.2133.7-128.5-165.3175.3-168.70113.1
399S38.8Very low39.4Very low78 Ų78138.7 Ų138.755%0.54576%0.758SS.*  trans-71.7-178149.446.20000108.6
400D39.5Very low40.4Very low122 Ų122139 Ų13965%0.65276%0.755SS**  cis-149.3147.335.2-50.4-65.7000110.4
401D38.8Very low40.9Very low137 Ų137143.1 Ų143.173%0.73378%0.775SS**  48.8159.1126.5-64-56.7000122.8
402E41.3Very low40.7Very low143 Ų143144.2 Ų144.267%0.66877%0.774SS**  cis-157.1160.34.2-132.8177.8156.400111.1
403Q38.7Very low40.9Very low158 Ų158143 Ų14374%0.73877%0.774SS**  trans50.4157.1146.2-75.8170.929.500121.9
404D37.7Very low41.5Very low142 Ų142142.1 Ų142.176%0.75977%0.77SS**  cis-168.4-160.5-21.1-170.34.3000107.1
405I39.8Very low41.6Very low152 Ų152145.2 Ų145.278%0.77978%0.778SS**  trans10884.6164.8-53.2165.8000115.6
406S42.1Very low41.5Very low110 Ų110146 Ų14677%0.76977%0.773SS**  64.5161114.7-1540000123.2
407A45.1Very low42Very low86 Ų86148.8 Ų148.871%0.71178%0.776SS**  trans84.3136169.100000118
408M46.6Very low42.4Very low161 Ų161146.7 Ų146.779%0.79377%0.772SS**  cis-160.6154.8-10.3-124.9169.967.200111V410M408-V410 HydrophobicContact CE-CG2 3.51Å
409E46.8Very low42.8Very low195 Ų195142.5 Ų142.591%0.91176%0.764SS**  trans-88.9125.1163.2-74.2177.1102.400110.9
410V53.6Low43.2Very low110 Ų110147.9 Ų147.967%0.66778%0.783SS**  trans-158.7131.8163.1-165.70000105.3M408M408-V410 HydrophobicContact CE-CG2 3.51Å
411E47.9Very low43.5Very low259 Ų259150.3 Ų150.3100%1.2179%0.794SS**  cis-137.702.7-136.3171.1131.700109.9

Retrieved 411 of 411 residues in 51.8 ms (Link to these results)