A0A5K4EEF3_SCHMA Loading...

Ribosome biogenesis protein NSA2 homolog

AlphaFold DB , UniProt , Accession A0A5K4EEF3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 133 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M63Low86.4Confident224 Ų224118.3 Ų118.3100%1.10358%0.581SS**  0134.10-66.5-179.3170.400107.9Q3M1-Q3 PolarHBondContact O-N 3.49Å
2P80Confident86.9Confident101 Ų101121.5 Ų121.566%0.65659%0.59SS**  trans-58.9126.1173.225.7-32.5000108.7
3Q80.2Confident87.5Confident175 Ų175126.8 Ų126.882%0.81860%0.599SS**  trans-79.2134.9-177.6-67.4-171.9-10.600110.1M1M1-Q3 PolarHBondContact O-N 3.49Å
4N87.5Confident88Confident131 Ų131127.4 Ų127.470%0.70160%0.602SS**SBendtrans59.9-170.2170.6-151.351.3000115.2H6N4-H6 PolarHBondContact O-N 3.15Å; N4-H6 PolarHBondContact O-ND1 3.38Å
5E88.7Confident88.4Confident110 Ų110121 Ų12151%0.51458%0.583SS.*SBendtrans-75.449.9177.5-59178164.200112.9I7 E8 L9E5-I7 PolarHBondContact O-N 2.79Å; E5-I7 VanDerWaalsContact O-N 3.12Å; E5-E8 HydrophobicContact CB-CB 4.18Å; E5-E8 HydrophobicContact CB-CG 4.3Å; E5-E8 PolarHBondContact O-N 2.96Å; E5-L9 PolarHBondContact O-N 3.07Å
6H90.4Very high88.7Confident93 Ų93119.3 Ų119.343%0.43157%0.569SS.*Hα-helixtrans-55-32.5-17665.7-74.9000113.9N4 H10N4-H6 PolarHBondContact O-N 3.15Å; N4-H6 PolarHBondContact O-ND1 3.38Å; H6-H10 WeakPolarHBondContact O-CB 3.35Å; H6-H10 PolarHBondContact O-N 3.14Å
7I91.1Very high88.9Confident105 Ų105122.8 Ų122.854%0.53858%0.575SS.*Hα-helixtrans-68-42176.2-61.5175.2000111.4E5 H10 R11E5-I7 PolarHBondContact O-N 2.79Å; E5-I7 VanDerWaalsContact O-N 3.12Å; I7-H10 PolarHBondContact O-N 3.27Å; I7-R11 WeakPolarHBondContact O-CG 3.35Å; I7-R11 PolarHBondContact O-N 3Å
8E90.4Very high89.2Confident92 Ų92127.8 Ų127.843%0.4360%0.595SS.*Hα-helixtrans-69.8-40.1177.5-59.2-158.6173.400111E5 H10 R11 K12E5-E8 HydrophobicContact CB-CB 4.18Å; E5-E8 HydrophobicContact CB-CG 4.3Å; E5-E8 PolarHBondContact O-N 2.96Å; E8-H10 VanDerWaalsContact C-N 3.32Å; E8-H10 PolarHBondContact O-N 2.74Å; E8-R11 PolarHBondContact O-N 2.8Å; E8-K12 WeakPolarHBondContact O-CG 3.35Å; E8-K12 PolarHBondContact O-N 3.24Å
9L92.1Very high89.6Confident62 Ų62123.4 Ų123.433%0.32558%0.577SS.*Hα-helixtrans-58.8-43.7172.1-70.1175000111.6E5 R11 K12 R13E5-L9 PolarHBondContact O-N 3.07Å; L9-R11 PolarHBondContact O-N 2.9Å; L9-K12 PolarHBondContact O-N 3.29Å; L9-R13 WeakPolarHBondContact O-CB 3.34Å; L9-R13 VanDerWaalsContact O-CG 3.31Å; L9-R13 WeakPolarHBondContact O-CG 3.19Å; L9-R13 PolarHBondContact O-N 3Å
10H93.1Very high89.9Confident109 Ų109121.4 Ų121.451%0.50556%0.564SS.*Hα-helixtrans-61.3-43.8174.9-179-77.2000111.6H6 I7 E8 K12 R13 H14H6-H10 WeakPolarHBondContact O-CB 3.35Å; H6-H10 PolarHBondContact O-N 3.14Å; I7-H10 PolarHBondContact O-N 3.27Å; E8-H10 VanDerWaalsContact C-N 3.32Å; E8-H10 PolarHBondContact O-N 2.74Å; H10-K12 VanDerWaalsContact C-N 3.34Å; H10-K12 PolarHBondContact O-N 2.76Å; H10-R13 PolarHBondContact O-N 2.99Å; H10-H14 AromaticContact CD2-CD2 3.64Å; H10-H14 AromaticContact NE2-CD2 3.66Å; H10-H14 PolarHBondContact O-N 3.06Å
11R93.4Very high90.2Very high99 Ų99121.6 Ų121.637%0.37456%0.564SS.*Hα-helixtrans-65.7-34.6176.6-73.9165.778.2-175.53.6112.6I7 E8 L9 G15 Y16I7-R11 WeakPolarHBondContact O-CG 3.35Å; I7-R11 PolarHBondContact O-N 3Å; E8-R11 PolarHBondContact O-N 2.8Å; L9-R11 PolarHBondContact O-N 2.9Å; R11-G15 WeakPolarHBondContact O-CA 3.36Å; R11-G15 PolarHBondContact O-N 3.25Å; R11-Y16 VanDerWaalsContact CZ-CE1 3.48Å; R11-Y16 PolarHBondContact NE-OH 2.94Å; R11-Y16 PolarHBondContact NH2-OH 3.07Å
12K92.7Very high91.8Very high157 Ų157115.6 Ų115.668%0.68353%0.533SS*.Hα-helixtrans-68.4-38.3173.8-72.4172.7-177170.20111.8E8 L9 H10E8-K12 WeakPolarHBondContact O-CG 3.35Å; E8-K12 PolarHBondContact O-N 3.24Å; L9-K12 PolarHBondContact O-N 3.29Å; H10-K12 VanDerWaalsContact C-N 3.34Å; H10-K12 PolarHBondContact O-N 2.76Å
13R94.4Very high92.6Very high190 Ų190117.7 Ų117.772%0.71753%0.528SS*.Hα-helixtrans-79.8-44.2-178.4-70.4175.3-173.5173.91.7114.2L9 H10L9-R13 WeakPolarHBondContact O-CB 3.34Å; L9-R13 VanDerWaalsContact O-CG 3.31Å; L9-R13 WeakPolarHBondContact O-CG 3.19Å; L9-R13 PolarHBondContact O-N 3Å; H10-R13 PolarHBondContact O-N 2.99Å
14H94.8Very high93.4Very high136 Ų136114.1 Ų114.163%0.6351%0.509SS*.Hα-helixtrans-113.9-4.1-171.4-59.7-68.2000113.4H10H10-H14 AromaticContact CD2-CD2 3.64Å; H10-H14 AromaticContact NE2-CD2 3.66Å; H10-H14 PolarHBondContact O-N 3.06Å
15G93.5Very high93.9Very high31 Ų31115 Ų11532%0.3250%0.503SS..  trans73.4-155.9-177.800000113.4R11R11-G15 WeakPolarHBondContact O-CA 3.36Å; R11-G15 PolarHBondContact O-N 3.25Å
16Y93.4Very high94.4Very high93 Ų93113.8 Ų113.837%0.36550%0.496SS..  trans-100.3162.5174.5-66.1-97.1000110.3R11 F18 Y20 F21R11-Y16 VanDerWaalsContact CZ-CE1 3.48Å; R11-Y16 PolarHBondContact NE-OH 2.94Å; R11-Y16 PolarHBondContact NH2-OH 3.07Å; Y16-F18 PolarHBondContact O-N 3.38Å; Y16-Y20 AromaticContact CD1-CD1 3.46Å; Y16-Y20 HydrophobicContact CD1-CD1 3.46Å; Y16-Y20 VanDerWaalsContact CD1-CD1 3.46Å; Y16-Y20 HydrophobicContact CD1-CD2 4.1Å; Y16-Y20 AromaticContact CD1-CE1 3.59Å; Y16-Y20 HydrophobicContact CD1-CE1 3.59Å; Y16-Y20 HydrophobicContact CD1-CE2 4.21Å; Y16-Y20 AromaticContact CD1-CG 3.74Å; Y16-Y20 HydrophobicContact CD1-CG 3.74Å; Y16-Y20 AromaticContact CD1-CZ 3.97Å; Y16-Y20 AromaticContact CE1-CD1 3.94Å; Y16-Y20 HydrophobicContact CE1-CD1 3.94Å; Y16-Y20 AromaticContact CE1-CE1 3.57Å; Y16-Y20 HydrophobicContact CE1-CE1 3.57Å; Y16-Y20 HydrophobicContact CE1-CE2 4.44Å; Y16-Y20 AromaticContact CE1-CZ 3.85Å; Y16-Y20 AromaticContact CG-CD1 3.94Å; Y16-Y20 HydrophobicContact CG-CD1 3.94Å; Y16-Y20 HydrophobicContact CG-CE1 4.4Å; Y16-Y20 HydrophobicContact CG-CG 4.26Å; Y16-F21 AromaticContact CD2-CE2 3.94Å; Y16-F21 HydrophobicContact CD2-CE2 3.94Å; Y16-F21 AromaticContact CD2-CZ 3.67Å; Y16-F21 HydrophobicContact CD2-CZ 3.67Å; Y16-F21 AromaticContact CE2-CZ 3.85Å; Y16-F21 HydrophobicContact CE2-CZ 3.85Å; Y16-F21 HydrophobicContact CG-CE2 4.2Å; Y16-F21 HydrophobicContact CG-CZ 4.11Å
17R92.9Very high94.7Very high179 Ų179115.5 Ų115.568%0.67550%0.502SS*.  trans-55.5138.2164.5-166.3-178.3164.8154.83.9109.7D19 Y20R17-D19 WeakPolarHBondContact CD-OD1 3.45Å; R17-D19 WeakPolarHBondContact CG-OD1 3.32Å; R17-D19 IonicContact CZ-OD2 3.87Å; R17-D19 IonicContact NE-OD1 3.01Å; R17-D19 PolarHBondContact NE-OD1 3.44Å; R17-D19 IonicContact NE-OD2 3.5Å; R17-D19 IonicContact NH2-OD2 3.97Å; R17-D19 PolarHBondContact O-N 2.99Å; R17-D19 VanDerWaalsContact O-N 3.09Å; R17-Y20 WeakPolarHBondContact O-CB 3.26Å; R17-Y20 PolarHBondContact O-N 3.49Å
18F93.8Very high95Very high213 Ų213116 Ų11693%0.93450%0.502SS*.THydrogen-bonded Turntrans-54.3-33.8-173.3-61.3-53.8000114.3Y16Y16-F18 PolarHBondContact O-N 3.38Å
19D96.3Very high95.3Very high45 Ų45114.7 Ų114.724%0.24151%0.507CS..THydrogen-bonded Turntrans-88.11.2179.667.8-20.2000114.3R17 F21 E22 R23R17-D19 WeakPolarHBondContact CD-OD1 3.45Å; R17-D19 WeakPolarHBondContact CG-OD1 3.32Å; R17-D19 IonicContact CZ-OD2 3.87Å; R17-D19 IonicContact NE-OD1 3.01Å; R17-D19 PolarHBondContact NE-OD1 3.44Å; R17-D19 IonicContact NE-OD2 3.5Å; R17-D19 IonicContact NH2-OD2 3.97Å; R17-D19 PolarHBondContact O-N 2.99Å; R17-D19 VanDerWaalsContact O-N 3.09Å; D19-F21 PolarHBondContact O-N 3.44Å; D19-E22 PolarHBondContact O-N 3.06Å; D19-R23 HydrophobicContact CB-CG 4.43Å; D19-R23 WeakPolarHBondContact O-CB 3.47Å; D19-R23 VanDerWaalsContact O-CG 3.3Å; D19-R23 WeakPolarHBondContact O-CG 3.22Å; D19-R23 PolarHBondContact O-N 2.87Å; D19-R23 WeakPolarHBondContact OD2-CD 3.38Å; D19-R23 IonicContact OD2-NH1 3.37Å; D19-R23 PolarHBondContact OD2-NH1 3.49Å
20Y96.6Very high95.6Very high82 Ų82118.1 Ų118.132%0.32252%0.516SS..Hα-helixtrans-59.4-52.1-170.5174.1-98.1000112.5Y16 R17 E22 R23 K24Y16-Y20 AromaticContact CD1-CD1 3.46Å; Y16-Y20 HydrophobicContact CD1-CD1 3.46Å; Y16-Y20 VanDerWaalsContact CD1-CD1 3.46Å; Y16-Y20 HydrophobicContact CD1-CD2 4.1Å; Y16-Y20 AromaticContact CD1-CE1 3.59Å; Y16-Y20 HydrophobicContact CD1-CE1 3.59Å; Y16-Y20 HydrophobicContact CD1-CE2 4.21Å; Y16-Y20 AromaticContact CD1-CG 3.74Å; Y16-Y20 HydrophobicContact CD1-CG 3.74Å; Y16-Y20 AromaticContact CD1-CZ 3.97Å; Y16-Y20 AromaticContact CE1-CD1 3.94Å; Y16-Y20 HydrophobicContact CE1-CD1 3.94Å; Y16-Y20 AromaticContact CE1-CE1 3.57Å; Y16-Y20 HydrophobicContact CE1-CE1 3.57Å; Y16-Y20 HydrophobicContact CE1-CE2 4.44Å; Y16-Y20 AromaticContact CE1-CZ 3.85Å; Y16-Y20 AromaticContact CG-CD1 3.94Å; Y16-Y20 HydrophobicContact CG-CD1 3.94Å; Y16-Y20 HydrophobicContact CG-CE1 4.4Å; Y16-Y20 HydrophobicContact CG-CG 4.26Å; R17-Y20 WeakPolarHBondContact O-CB 3.26Å; R17-Y20 PolarHBondContact O-N 3.49Å; Y20-E22 PolarHBondContact O-N 3.03Å; Y20-R23 PolarHBondContact O-N 3.41Å; Y20-K24 HydrophobicContact CE1-CD 4.23Å; Y20-K24 WeakPolarHBondContact O-CB 3.38Å; Y20-K24 PolarHBondContact O-N 3.15Å
21F96Very high95.8Very high127 Ų127116 Ų11656%0.55751%0.506SS*.Hα-helixtrans-68.2-37.1-176.3-64.4-71.9000111.8Y16 D19 K24 R25Y16-F21 AromaticContact CD2-CE2 3.94Å; Y16-F21 HydrophobicContact CD2-CE2 3.94Å; Y16-F21 AromaticContact CD2-CZ 3.67Å; Y16-F21 HydrophobicContact CD2-CZ 3.67Å; Y16-F21 AromaticContact CE2-CZ 3.85Å; Y16-F21 HydrophobicContact CE2-CZ 3.85Å; Y16-F21 HydrophobicContact CG-CE2 4.2Å; Y16-F21 HydrophobicContact CG-CZ 4.11Å; D19-F21 PolarHBondContact O-N 3.44Å; F21-K24 PolarHBondContact O-N 3.47Å; F21-R25 WeakPolarHBondContact O-CB 3.37Å; F21-R25 PolarHBondContact O-N 3.38Å
22E96.2Very high95.9Very high97 Ų97114.8 Ų114.845%0.45351%0.511SS..Hα-helixtrans-63.8-45.5174-67.8-155.5173.900112.4D19 Y20 K24 R25 K26D19-E22 PolarHBondContact O-N 3.06Å; Y20-E22 PolarHBondContact O-N 3.03Å; E22-K24 VanDerWaalsContact C-N 3.34Å; E22-R25 PolarHBondContact O-N 3.3Å; E22-K26 WeakPolarHBondContact O-CB 3.3Å; E22-K26 VanDerWaalsContact O-CG 3.29Å; E22-K26 WeakPolarHBondContact O-CG 3.43Å; E22-K26 PolarHBondContact O-N 3.46Å; E22-K26 IonicContact OE2-NZ 3.21Å; E22-K26 PolarHBondContact OE2-NZ 3.35Å
23R97.4Very high96.2Very high146 Ų146113.8 Ų113.855%0.55151%0.509SS*.Hα-helixtrans-64.9-41178.9-75.2178.265.1176.23.5111.2D19 Y20 K26 K27D19-R23 HydrophobicContact CB-CG 4.43Å; D19-R23 WeakPolarHBondContact O-CB 3.47Å; D19-R23 VanDerWaalsContact O-CG 3.3Å; D19-R23 WeakPolarHBondContact O-CG 3.22Å; D19-R23 PolarHBondContact O-N 2.87Å; D19-R23 WeakPolarHBondContact OD2-CD 3.38Å; D19-R23 IonicContact OD2-NH1 3.37Å; D19-R23 PolarHBondContact OD2-NH1 3.49Å; Y20-R23 PolarHBondContact O-N 3.41Å; R23-K26 PolarHBondContact O-N 3.5Å; R23-K27 VanDerWaalsContact O-CB 3.26Å; R23-K27 WeakPolarHBondContact O-CB 3.38Å; R23-K27 PolarHBondContact O-N 2.93Å
24K97.4Very high96.3Very high99 Ų99108 Ų10843%0.4349%0.489SS..Hα-helixtrans-60.8-50.9175.9-172.4179176.9-1740110.9Y20 F21 E22 K26 K27 E28Y20-K24 HydrophobicContact CE1-CD 4.23Å; Y20-K24 WeakPolarHBondContact O-CB 3.38Å; Y20-K24 PolarHBondContact O-N 3.15Å; F21-K24 PolarHBondContact O-N 3.47Å; E22-K24 VanDerWaalsContact C-N 3.34Å; K24-K26 PolarHBondContact O-N 2.91Å; K24-K27 WeakPolarHBondContact O-CB 3.27Å; K24-K27 PolarHBondContact O-N 2.86Å; K24-K27 VanDerWaalsContact O-N 3.13Å; K24-E28 WeakPolarHBondContact CE-OE1 3.45Å; K24-E28 WeakPolarHBondContact O-CG 3.36Å; K24-E28 PolarHBondContact O-N 3.48Å
25R97.7Very high96.3Very high151 Ų151106.6 Ų106.657%0.5748%0.479SS*.Hα-helixtrans-56.8-50.3175.6-174.7-167.472.2-159.60.5112F21 E22 K27 E28 A29F21-R25 WeakPolarHBondContact O-CB 3.37Å; F21-R25 PolarHBondContact O-N 3.38Å; E22-R25 PolarHBondContact O-N 3.3Å; R25-K27 VanDerWaalsContact C-N 3.25Å; R25-K27 PolarHBondContact O-N 3.34Å; R25-E28 PolarHBondContact O-N 2.89Å; R25-A29 WeakPolarHBondContact O-CB 3.3Å; R25-A29 PolarHBondContact O-N 3.06Å
26K98.2Very high96.3Very high83 Ų83108 Ų10836%0.36148%0.484SS..Hα-helixtrans-64.2-30.3179.1-72.1171.1179.3161.40111.8E22 R23 K24 R30E22-K26 WeakPolarHBondContact O-CB 3.3Å; E22-K26 VanDerWaalsContact O-CG 3.29Å; E22-K26 WeakPolarHBondContact O-CG 3.43Å; E22-K26 PolarHBondContact O-N 3.46Å; E22-K26 IonicContact OE2-NZ 3.21Å; E22-K26 PolarHBondContact OE2-NZ 3.35Å; R23-K26 PolarHBondContact O-N 3.5Å; K24-K26 PolarHBondContact O-N 2.91Å; K26-R30 VanDerWaalsContact O-CG 3.23Å; K26-R30 WeakPolarHBondContact O-CG 3.43Å; K26-R30 PolarHBondContact O-N 3.48Å; K26-R30 PolarHBondContact O-NH1 3Å
27K97.6Very high96.5Very high129 Ų129110.5 Ų110.556%0.56149%0.492SS*.Hα-helixtrans-70.3-51.7174.6-173.5-179.6179.2-176.20110.8R23 K24 R25 A29 R30 E31R23-K27 VanDerWaalsContact O-CB 3.26Å; R23-K27 WeakPolarHBondContact O-CB 3.38Å; R23-K27 PolarHBondContact O-N 2.93Å; K24-K27 WeakPolarHBondContact O-CB 3.27Å; K24-K27 PolarHBondContact O-N 2.86Å; K24-K27 VanDerWaalsContact O-N 3.13Å; R25-K27 VanDerWaalsContact C-N 3.25Å; R25-K27 PolarHBondContact O-N 3.34Å; K27-A29 VanDerWaalsContact C-N 3.26Å; K27-A29 PolarHBondContact O-N 3.35Å; K27-R30 PolarHBondContact O-N 3.24Å; K27-E31 PolarHBondContact O-N 2.94Å
28E97.2Very high96.6Very high115 Ų115107.2 Ų107.254%0.53748%0.483SS..Hα-helixtrans-57.1-39.9177.3-71.3170-173.300111.8K24 R25 R30 E31K24-E28 WeakPolarHBondContact CE-OE1 3.45Å; K24-E28 WeakPolarHBondContact O-CG 3.36Å; K24-E28 PolarHBondContact O-N 3.48Å; R25-E28 PolarHBondContact O-N 2.89Å; E28-R30 VanDerWaalsContact C-N 3.33Å; E28-R30 PolarHBondContact O-N 2.9Å; E28-E31 WeakPolarHBondContact O-CB 3.44Å; E28-E31 PolarHBondContact O-N 3.09Å
29A97.8Very high96.7Very high66 Ų66100.1 Ų100.155%0.54546%0.464SS..Hα-helixtrans-65.4-30.7174.500000113.8R25 K27 P32R25-A29 WeakPolarHBondContact O-CB 3.3Å; R25-A29 PolarHBondContact O-N 3.06Å; K27-A29 VanDerWaalsContact C-N 3.26Å; K27-A29 PolarHBondContact O-N 3.35Å; A29-P32 WeakPolarHBondContact O-CD 3.34Å; A29-P32 WeakPolarHBondContact O-CG 3.49Å
30R98.1Very high96.6Very high134 Ų134105.4 Ų105.451%0.50649%0.485SS..Hα-helixtrans-84.2-25.5179.4-73.3179.6-159.4116.3-6.4113.7K26 K27 E28 P32 H33 E34K26-R30 VanDerWaalsContact O-CG 3.23Å; K26-R30 WeakPolarHBondContact O-CG 3.43Å; K26-R30 PolarHBondContact O-N 3.48Å; K26-R30 PolarHBondContact O-NH1 3Å; K27-R30 PolarHBondContact O-N 3.24Å; E28-R30 VanDerWaalsContact C-N 3.33Å; E28-R30 PolarHBondContact O-N 2.9Å; R30-P32 VanDerWaalsContact C-CD 3.44Å; R30-P32 VanDerWaalsContact C-N 3.35Å; R30-H33 PolarHBondContact O-N 3.46Å; R30-E34 PolarHBondContact O-N 3.23Å
31E96.2Very high96.6Very high64 Ų64108.6 Ų108.630%0.29950%0.5SS..Hα-helixtrans-42.7-48.5178.6-77.3-70158.800114.3K27 E28 H33 E34 R35K27-E31 PolarHBondContact O-N 2.94Å; E28-E31 WeakPolarHBondContact O-CB 3.44Å; E28-E31 PolarHBondContact O-N 3.09Å; E31-H33 PolarHBondContact O-N 3.01Å; E31-E34 PolarHBondContact O-N 2.95Å; E31-R35 WeakPolarHBondContact O-CB 3.37Å; E31-R35 PolarHBondContact O-N 3.18Å
32P96.4Very high96.7Very high73 Ų73105.4 Ų105.447%0.47449%0.489SS..Hα-helixtrans-62.3-40.7178.622.7-34.1000113.5A29 R30 R35 S36A29-P32 WeakPolarHBondContact O-CD 3.34Å; A29-P32 WeakPolarHBondContact O-CG 3.49Å; R30-P32 VanDerWaalsContact C-CD 3.44Å; R30-P32 VanDerWaalsContact C-N 3.35Å; P32-R35 PolarHBondContact O-N 3.48Å; P32-S36 PolarHBondContact O-N 3.29Å
33H97.8Very high96.7Very high137 Ų137110.4 Ų110.463%0.63450%0.503SS*.Hα-helixtrans-69.5-43.3177.7-65.2-67.5000111.7R30 E31 R35 S36 R37R30-H33 PolarHBondContact O-N 3.46Å; E31-H33 PolarHBondContact O-N 3.01Å; H33-R35 VanDerWaalsContact C-N 3.3Å; H33-R35 PolarHBondContact O-N 2.71Å; H33-S36 PolarHBondContact O-N 2.92Å; H33-R37 WeakPolarHBondContact O-CB 3.35Å; H33-R37 PolarHBondContact O-N 3.44Å
34E96.5Very high96.6Very high67 Ų67106 Ų10631%0.31350%0.504SS..Hα-helixtrans-61.7-41.2175.1-73.7-165.2-173.900111.5R30 E31 R37 K38R30-E34 PolarHBondContact O-N 3.23Å; E31-E34 PolarHBondContact O-N 2.95Å; E34-R37 WeakPolarHBondContact O-CB 3.38Å; E34-R37 PolarHBondContact O-N 2.87Å; E34-K38 WeakPolarHBondContact O-CB 3.46Å; E34-K38 VanDerWaalsContact O-CG 3.3Å; E34-K38 WeakPolarHBondContact O-CG 3.37Å; E34-K38 PolarHBondContact O-N 3.46Å; E34-K38 IonicContact OE2-NZ 3.82Å
35R94.9Very high96.6Very high107 Ų107107.7 Ų107.740%0.40452%0.516SS..Hα-helixtrans-64.2-44.5178.3-167.9-176.4-64.6156.8-10.2112E31 P32 H33 R37 K38 A39 R54E31-R35 WeakPolarHBondContact O-CB 3.37Å; E31-R35 PolarHBondContact O-N 3.18Å; P32-R35 PolarHBondContact O-N 3.48Å; H33-R35 VanDerWaalsContact C-N 3.3Å; H33-R35 PolarHBondContact O-N 2.71Å; R35-R37 VanDerWaalsContact C-N 3.33Å; R35-K38 PolarHBondContact O-N 3.31Å; R35-A39 PolarHBondContact O-N 3.35Å; R35-R54 VanDerWaalsContact CD-NH1 3.32Å
36S94.9Very high96.6Very high61 Ų61107.9 Ų107.943%0.42752%0.521SS..Hα-helixtrans-60.9-43173.3-179.60000111.5P32 H33 A39 K40P32-S36 PolarHBondContact O-N 3.29Å; H33-S36 PolarHBondContact O-N 2.92Å; S36-A39 PolarHBondContact O-N 3.08Å; S36-K40 WeakPolarHBondContact O-CG 3.36Å; S36-K40 PolarHBondContact O-N 3.44Å; S36-K40 VanDerWaalsContact O-N 3.15Å
37R96.8Very high96.5Very high145 Ų145104.9 Ų104.955%0.54751%0.512SS..Hα-helixtrans-61.7-45.2175.5-174.3-172.7-65.6170.5-1.5112.1H33 E34 R35 K40 K41H33-R37 WeakPolarHBondContact O-CB 3.35Å; H33-R37 PolarHBondContact O-N 3.44Å; E34-R37 WeakPolarHBondContact O-CB 3.38Å; E34-R37 PolarHBondContact O-N 2.87Å; R35-R37 VanDerWaalsContact C-N 3.33Å; R37-K40 PolarHBondContact O-N 2.96Å; R37-K41 HydrophobicContact CG-CD 3.93Å; R37-K41 HydrophobicContact CG-CG 4.37Å; R37-K41 WeakPolarHBondContact O-CB 3.42Å; R37-K41 WeakPolarHBondContact O-CG 3.33Å; R37-K41 PolarHBondContact O-N 2.97Å
38K95.7Very high96.5Very high110 Ų110106 Ų10648%0.47852%0.517SS..Hα-helixtrans-60.7-46176.5-74.5171.4-170.11700110.6E34 R35 K40 K41 L42E34-K38 WeakPolarHBondContact O-CB 3.46Å; E34-K38 VanDerWaalsContact O-CG 3.3Å; E34-K38 WeakPolarHBondContact O-CG 3.37Å; E34-K38 PolarHBondContact O-N 3.46Å; E34-K38 IonicContact OE2-NZ 3.82Å; R35-K38 PolarHBondContact O-N 3.31Å; K38-K40 VanDerWaalsContact C-N 3.27Å; K38-K40 PolarHBondContact O-N 3.46Å; K38-K41 PolarHBondContact O-N 3.46Å; K38-L42 HydrophobicContact CB-CD1 4.17Å; K38-L42 HydrophobicContact CB-CG 4.46Å; K38-L42 VanDerWaalsContact O-CB 3.28Å; K38-L42 WeakPolarHBondContact O-CB 3.47Å; K38-L42 WeakPolarHBondContact O-CG 3.43Å; K38-L42 PolarHBondContact O-N 2.9Å
39A95.2Very high96.5Very high64 Ų64105 Ų10553%0.52951%0.514SS..Hα-helixtrans-58-38.3177.600000113R35 S36R35-A39 PolarHBondContact O-N 3.35Å; S36-A39 PolarHBondContact O-N 3.08Å
40K94.9Very high96.5Very high156 Ų156103 Ų10368%0.67850%0.498SS*.Hα-helixtrans-76.8-36.8178-66.4177.9-177.6-172.80113.6S36 R37 K38S36-K40 WeakPolarHBondContact O-CG 3.36Å; S36-K40 PolarHBondContact O-N 3.44Å; S36-K40 VanDerWaalsContact O-N 3.15Å; R37-K40 PolarHBondContact O-N 2.96Å; K38-K40 VanDerWaalsContact C-N 3.27Å; K38-K40 PolarHBondContact O-N 3.46Å
41K96.9Very high96.4Very high150 Ų150101.3 Ų101.365%0.65250%0.499SS*.Hα-helixtrans-90.8-29-172-69.4-169178.4-166.70114.1R37 K38R37-K41 HydrophobicContact CG-CD 3.93Å; R37-K41 HydrophobicContact CG-CG 4.37Å; R37-K41 WeakPolarHBondContact O-CB 3.42Å; R37-K41 WeakPolarHBondContact O-CG 3.33Å; R37-K41 PolarHBondContact O-N 2.97Å; K38-K41 PolarHBondContact O-N 3.46Å
42L96.4Very high96.5Very high59 Ų59104.8 Ų104.831%0.30951%0.513SS..  trans-64.4136.6-178.5-72173.2000110.6K38 K46 A47 A50K38-L42 HydrophobicContact CB-CD1 4.17Å; K38-L42 HydrophobicContact CB-CG 4.46Å; K38-L42 VanDerWaalsContact O-CB 3.28Å; K38-L42 WeakPolarHBondContact O-CB 3.47Å; K38-L42 WeakPolarHBondContact O-CG 3.43Å; K38-L42 PolarHBondContact O-N 2.9Å; L42-K46 HydrophobicContact CD2-CB 4.23Å; L42-A47 HydrophobicContact CB-CB 4.1Å; L42-A47 WeakPolarHBondContact O-CB 3.45Å; L42-A50 HydrophobicContact CD1-CB 3.74Å
43R96Very high96.5Very high202 Ų202106.4 Ų106.476%0.76251%0.514SS*.  trans-125163.1179.3-58.3-62.8-177.5166.31.2111.2
44G96.9Very high96.4Very high54 Ų54103.8 Ų103.856%0.55750%0.499SS*.Hα-helixtrans60.9-141.5173.500000114.3K46 A47 K48G44-K46 VanDerWaalsContact C-N 3.3Å; G44-K46 PolarHBondContact O-N 3.44Å; G44-A47 WeakPolarHBondContact O-CB 3.34Å; G44-A47 PolarHBondContact O-N 2.92Å; G44-K48 PolarHBondContact O-N 3.14Å
45L97.1Very high96.5Very high134 Ų134107.3 Ų107.370%0.70251%0.513SS*.Hα-helixtrans-60.4-36.9-178.3-66.3175.8000112.9A47 K48 I49L45-A47 VanDerWaalsContact C-N 3.29Å; L45-A47 PolarHBondContact O-N 3.26Å; L45-K48 PolarHBondContact O-N 3.1Å; L45-K48 VanDerWaalsContact O-N 3.15Å; L45-I49 WeakPolarHBondContact O-CG1 3.48Å; L45-I49 PolarHBondContact O-N 3.17Å
46K96.6Very high96.6Very high155 Ų155108.3 Ų108.367%0.67452%0.52SS*.Hα-helixtrans-60.5-39.3178.7-65.1-177.6179.4178.30111.7L42 G44 I49 A50L42-K46 HydrophobicContact CD2-CB 4.23Å; G44-K46 VanDerWaalsContact C-N 3.3Å; G44-K46 PolarHBondContact O-N 3.44Å; K46-I49 PolarHBondContact O-N 2.87Å; K46-A50 WeakPolarHBondContact O-CB 3.48Å; K46-A50 PolarHBondContact O-N 3.27Å
47A97.4Very high96.7Very high20 Ų20109.6 Ų109.617%0.16552%0.52CS..Hα-helixtrans-65.9-4217600000112L42 G44 L45 I49 A50 N51L42-A47 HydrophobicContact CB-CB 4.1Å; L42-A47 WeakPolarHBondContact O-CB 3.45Å; G44-A47 WeakPolarHBondContact O-CB 3.34Å; G44-A47 PolarHBondContact O-N 2.92Å; L45-A47 VanDerWaalsContact C-N 3.29Å; L45-A47 PolarHBondContact O-N 3.26Å; A47-I49 PolarHBondContact O-N 3.44Å; A47-A50 PolarHBondContact O-N 3.42Å; A47-N51 WeakPolarHBondContact O-CB 3.44Å; A47-N51 VanDerWaalsContact O-CG 3.29Å; A47-N51 PolarHBondContact O-N 3.38Å; A47-N51 PolarHBondContact O-ND2 3.3Å
48K97.3Very high96.7Very high152 Ų152109.4 Ų109.466%0.66152%0.523SS*.Hα-helixtrans-61.4-43.8177-65.9-176.6178.1-1780111.7G44 L45 K52G44-K48 PolarHBondContact O-N 3.14Å; L45-K48 PolarHBondContact O-N 3.1Å; L45-K48 VanDerWaalsContact O-N 3.15Å; K48-K52 WeakPolarHBondContact O-CB 3.42Å; K48-K52 PolarHBondContact O-N 3.49Å; K48-K52 VanDerWaalsContact O-N 3.09Å
49I97.5Very high96.9Very high95 Ų95106.6 Ų106.649%0.48752%0.515SS..Hα-helixtrans-63.7-50.9177.4-65.4167000110.5L45 K46 A47 N51 K52 E53L45-I49 WeakPolarHBondContact O-CG1 3.48Å; L45-I49 PolarHBondContact O-N 3.17Å; K46-I49 PolarHBondContact O-N 2.87Å; A47-I49 PolarHBondContact O-N 3.44Å; I49-N51 VanDerWaalsContact C-N 3.32Å; I49-N51 PolarHBondContact O-N 2.9Å; I49-K52 WeakPolarHBondContact O-CB 3.41Å; I49-K52 PolarHBondContact O-N 2.89Å; I49-K52 VanDerWaalsContact O-N 3.11Å; I49-E53 PolarHBondContact O-N 2.95Å
50A96.6Very high97Very high23 Ų23108.9 Ų108.919%0.1952%0.515CS..Hα-helixtrans-59.1-41.4-179.900000112.3L42 K46 A47 E53 R54L42-A50 HydrophobicContact CD1-CB 3.74Å; K46-A50 WeakPolarHBondContact O-CB 3.48Å; K46-A50 PolarHBondContact O-N 3.27Å; A47-A50 PolarHBondContact O-N 3.42Å; A50-E53 PolarHBondContact O-N 2.91Å; A50-R54 WeakPolarHBondContact O-CB 3.43Å; A50-R54 VanDerWaalsContact O-CG 3.23Å; A50-R54 WeakPolarHBondContact O-CG 3.31Å; A50-R54 PolarHBondContact O-N 3.34Å
51N96.4Very high97.1Very high99 Ų99106.7 Ų106.753%0.52951%0.508SS..Hα-helixtrans-66-38.7176.9-73-19.2000112.5A47 I49 R54 F55A47-N51 WeakPolarHBondContact O-CB 3.44Å; A47-N51 VanDerWaalsContact O-CG 3.29Å; A47-N51 PolarHBondContact O-N 3.38Å; A47-N51 PolarHBondContact O-ND2 3.3Å; I49-N51 VanDerWaalsContact C-N 3.32Å; I49-N51 PolarHBondContact O-N 2.9Å; N51-R54 PolarHBondContact O-N 3.48Å; N51-F55 WeakPolarHBondContact O-CB 3.48Å; N51-F55 PolarHBondContact O-N 3.34Å
52K97.6Very high97.1Very high137 Ų137107.3 Ų107.360%0.59651%0.511SS*.Hα-helixtrans-63.5-43.4175.5-176.3176.4-177.4177.10111.6K48 I49 F55 K56K48-K52 WeakPolarHBondContact O-CB 3.42Å; K48-K52 PolarHBondContact O-N 3.49Å; K48-K52 VanDerWaalsContact O-N 3.09Å; I49-K52 WeakPolarHBondContact O-CB 3.41Å; I49-K52 PolarHBondContact O-N 2.89Å; I49-K52 VanDerWaalsContact O-N 3.11Å; K52-F55 PolarHBondContact O-N 3.36Å; K52-K56 WeakPolarHBondContact O-CG 3.32Å; K52-K56 PolarHBondContact O-N 2.95Å; K52-K56 VanDerWaalsContact O-N 3.08Å
53E96.9Very high97.1Very high107 Ų107110.5 Ų110.550%0.552%0.522SS..Hα-helixtrans-62.2-46.7175.2-70.7172172.800111.3I49 A50 F55 K56 E57I49-E53 PolarHBondContact O-N 2.95Å; A50-E53 PolarHBondContact O-N 2.91Å; E53-F55 VanDerWaalsContact C-N 3.3Å; E53-F55 PolarHBondContact O-N 3.36Å; E53-K56 WeakPolarHBondContact O-CB 3.36Å; E53-K56 PolarHBondContact O-N 2.97Å; E53-K56 VanDerWaalsContact O-N 3.12Å; E53-E57 WeakPolarHBondContact O-CG 3.49Å; E53-E57 PolarHBondContact O-N 3.47Å
54R96.3Very high97.2Very high82 Ų82103.7 Ų103.731%0.30950%0.503SS..Hα-helixtrans-61.7-36.4176.9-69.2-63.8-65.5165.6-4.6113.2R35 A50 N51 E57 K58R35-R54 VanDerWaalsContact CD-NH1 3.32Å; A50-R54 WeakPolarHBondContact O-CB 3.43Å; A50-R54 VanDerWaalsContact O-CG 3.23Å; A50-R54 WeakPolarHBondContact O-CG 3.31Å; A50-R54 PolarHBondContact O-N 3.34Å; N51-R54 PolarHBondContact O-N 3.48Å; R54-E57 WeakPolarHBondContact CD-OE2 3.47Å; R54-E57 IonicContact CZ-OE2 3.54Å; R54-E57 IonicContact NE-OE2 3.82Å; R54-E57 IonicContact NH1-OE2 2.64Å; R54-E57 PolarHBondContact NH1-OE2 3.17Å; R54-K58 WeakPolarHBondContact O-CG 3.42Å; R54-K58 PolarHBondContact O-N 3.07Å; R54-K58 VanDerWaalsContact O-N 3.08Å
55F97.5Very high97.1Very high141 Ų141105.7 Ų105.762%0.61850%0.501SS*.Hα-helixtrans-63.9-47.2173.5178.4-100.4000111.2N51 K52 E53 E57 K58 V59N51-F55 WeakPolarHBondContact O-CB 3.48Å; N51-F55 PolarHBondContact O-N 3.34Å; K52-F55 PolarHBondContact O-N 3.36Å; E53-F55 VanDerWaalsContact C-N 3.3Å; E53-F55 PolarHBondContact O-N 3.36Å; F55-E57 PolarHBondContact O-N 2.97Å; F55-K58 PolarHBondContact O-N 3.48Å; F55-V59 HydrophobicContact CD1-CG2 4.22Å; F55-V59 HydrophobicContact CD2-CG2 4.4Å; F55-V59 HydrophobicContact CE1-CG2 3.8Å; F55-V59 HydrophobicContact CE2-CG2 4Å; F55-V59 HydrophobicContact CZ-CG2 3.68Å; F55-V59 WeakPolarHBondContact O-CG2 3.42Å; F55-V59 PolarHBondContact O-N 3.19Å
56K98Very high96.9Very high128 Ų128107.4 Ų107.456%0.55750%0.498SS*.Hα-helixtrans-57.5-46.8176.3-71176.5176.7-173.10112K52 E53 K58 V59 Q60K52-K56 WeakPolarHBondContact O-CG 3.32Å; K52-K56 PolarHBondContact O-N 2.95Å; K52-K56 VanDerWaalsContact O-N 3.08Å; E53-K56 WeakPolarHBondContact O-CB 3.36Å; E53-K56 PolarHBondContact O-N 2.97Å; E53-K56 VanDerWaalsContact O-N 3.12Å; K56-K58 PolarHBondContact O-N 3.11Å; K56-V59 PolarHBondContact O-N 2.95Å; K56-Q60 WeakPolarHBondContact O-CB 3.43Å; K56-Q60 PolarHBondContact O-N 2.94Å
57E96.9Very high96.7Very high89 Ų89106.1 Ų106.142%0.41650%0.495SS..Hα-helixtrans-58.3-47.6176.9-71171.9-17300111.9E53 R54 F55 V59 Q60 M61E53-E57 WeakPolarHBondContact O-CG 3.49Å; E53-E57 PolarHBondContact O-N 3.47Å; R54-E57 WeakPolarHBondContact CD-OE2 3.47Å; R54-E57 IonicContact CZ-OE2 3.54Å; R54-E57 IonicContact NE-OE2 3.82Å; R54-E57 IonicContact NH1-OE2 2.64Å; R54-E57 PolarHBondContact NH1-OE2 3.17Å; F55-E57 PolarHBondContact O-N 2.97Å; E57-V59 PolarHBondContact O-N 3.42Å; E57-Q60 PolarHBondContact O-N 3.33Å; E57-M61 WeakPolarHBondContact O-CG 3.41Å; E57-M61 PolarHBondContact O-N 3.08Å
58K97.7Very high96.5Very high141 Ų141112.2 Ų112.261%0.61352%0.52SS*.Hα-helixtrans-62.4-43.3178.4-76.2-179.5177.9-173.20112.3R54 F55 K56 Q60 M61 K62R54-K58 WeakPolarHBondContact O-CG 3.42Å; R54-K58 PolarHBondContact O-N 3.07Å; R54-K58 VanDerWaalsContact O-N 3.08Å; F55-K58 PolarHBondContact O-N 3.48Å; K56-K58 PolarHBondContact O-N 3.11Å; K58-Q60 VanDerWaalsContact C-N 3.34Å; K58-M61 PolarHBondContact O-N 2.94Å; K58-K62 WeakPolarHBondContact O-CB 3.23Å; K58-K62 PolarHBondContact O-N 2.98Å
59V98Very high96.1Very high51 Ų51110.5 Ų110.531%0.30952%0.515SS..Hα-helixtrans-63.5-43.7177.2170.40000110.4F55 K56 E57 K62 K63F55-V59 HydrophobicContact CD1-CG2 4.22Å; F55-V59 HydrophobicContact CD2-CG2 4.4Å; F55-V59 HydrophobicContact CE1-CG2 3.8Å; F55-V59 HydrophobicContact CE2-CG2 4Å; F55-V59 HydrophobicContact CZ-CG2 3.68Å; F55-V59 WeakPolarHBondContact O-CG2 3.42Å; F55-V59 PolarHBondContact O-N 3.19Å; K56-V59 PolarHBondContact O-N 2.95Å; E57-V59 PolarHBondContact O-N 3.42Å; V59-K62 PolarHBondContact O-N 3.42Å; V59-K63 HydrophobicContact CG1-CD 4.29Å; V59-K63 WeakPolarHBondContact O-CG 3.49Å; V59-K63 PolarHBondContact O-N 3.24Å
60Q97.7Very high95.7Very high112 Ų112108.6 Ų108.652%0.52351%0.505SS..Hα-helixtrans-61.1-47.1177-175.461.513.500111.2K56 E57 K58 K62 K63 T64K56-Q60 WeakPolarHBondContact O-CB 3.43Å; K56-Q60 PolarHBondContact O-N 2.94Å; E57-Q60 PolarHBondContact O-N 3.33Å; K58-Q60 VanDerWaalsContact C-N 3.34Å; Q60-K62 PolarHBondContact O-N 3.18Å; Q60-K63 WeakPolarHBondContact O-CB 3.47Å; Q60-K63 PolarHBondContact O-N 3.41Å; Q60-T64 WeakPolarHBondContact O-CG2 3.48Å; Q60-T64 PolarHBondContact O-N 3.33Å; Q60-T64 PolarHBondContact O-OG1 3.4Å
61M97.2Very high95.2Very high109 Ų109116.1 Ų116.154%0.53753%0.534SS..Hα-helixtrans-61.7-40.7176.3-71-58.9-6000112.6E57 K58 K63 T64 L65E57-M61 WeakPolarHBondContact O-CG 3.41Å; E57-M61 PolarHBondContact O-N 3.08Å; K58-M61 PolarHBondContact O-N 2.94Å; M61-K63 VanDerWaalsContact C-N 3.32Å; M61-K63 PolarHBondContact O-N 3.11Å; M61-T64 WeakPolarHBondContact CA-OG1 3.16Å; M61-T64 PolarHBondContact O-N 3.12Å; M61-T64 PolarHBondContact O-OG1 3.08Å; M61-L65 WeakPolarHBondContact O-CB 3.44Å; M61-L65 VanDerWaalsContact O-CG 3.27Å; M61-L65 WeakPolarHBondContact O-CG 3.46Å; M61-L65 PolarHBondContact O-N 3.07Å
62K97.6Very high94.2Very high163 Ų163114.8 Ų114.871%0.70954%0.543SS*.Hα-helixtrans-62.9-40.3175.6-174.1175.2-178.8177.20111.3K58 V59 Q60 R66K58-K62 WeakPolarHBondContact O-CB 3.23Å; K58-K62 PolarHBondContact O-N 2.98Å; V59-K62 PolarHBondContact O-N 3.42Å; Q60-K62 PolarHBondContact O-N 3.18Å; K62-R66 WeakPolarHBondContact O-CB 3.48Å; K62-R66 PolarHBondContact O-N 3.43Å
63K97.1Very high93.2Very high126 Ų126114.9 Ų114.955%0.54854%0.544SS..Hα-helixtrans-64.9-45.4175.2-73.3178178.9-173.70111.5V59 Q60 M61 R66 M67V59-K63 HydrophobicContact CG1-CD 4.29Å; V59-K63 WeakPolarHBondContact O-CG 3.49Å; V59-K63 PolarHBondContact O-N 3.24Å; Q60-K63 WeakPolarHBondContact O-CB 3.47Å; Q60-K63 PolarHBondContact O-N 3.41Å; M61-K63 VanDerWaalsContact C-N 3.32Å; M61-K63 PolarHBondContact O-N 3.11Å; K63-R66 PolarHBondContact O-N 3.36Å; K63-M67 WeakPolarHBondContact O-CB 3.13Å; K63-M67 VanDerWaalsContact O-CG 3.26Å; K63-M67 WeakPolarHBondContact O-CG 3.45Å; K63-M67 PolarHBondContact O-N 2.99Å
64T96.1Very high91.8Very high59 Ų59117.3 Ų117.336%0.36256%0.56SS.*Hα-helixtrans-65.3-41.518055.90000112.1Q60 M61 M67 H68Q60-T64 WeakPolarHBondContact O-CG2 3.48Å; Q60-T64 PolarHBondContact O-N 3.33Å; Q60-T64 PolarHBondContact O-OG1 3.4Å; M61-T64 WeakPolarHBondContact CA-OG1 3.16Å; M61-T64 PolarHBondContact O-N 3.12Å; M61-T64 PolarHBondContact O-OG1 3.08Å; T64-M67 PolarHBondContact O-N 2.91Å; T64-H68 WeakPolarHBondContact O-CB 3.36Å; T64-H68 PolarHBondContact O-N 3.02Å
65L94.8Very high90.1Very high97 Ų97120 Ų12051%0.50858%0.576SS.*Hα-helixtrans-61.2-48.2173.5-70.4171.7000111.2M61 M67 H68 E69M61-L65 WeakPolarHBondContact O-CB 3.44Å; M61-L65 VanDerWaalsContact O-CG 3.27Å; M61-L65 WeakPolarHBondContact O-CG 3.46Å; M61-L65 PolarHBondContact O-N 3.07Å; L65-M67 VanDerWaalsContact C-N 3.33Å; L65-M67 PolarHBondContact O-N 2.99Å; L65-H68 PolarHBondContact O-N 2.82Å; L65-H68 VanDerWaalsContact O-N 3.15Å; L65-E69 WeakPolarHBondContact O-CG 3.41Å; L65-E69 PolarHBondContact O-N 3.48Å
66R93.3Very high88.2Confident170 Ų170122 Ų12264%0.64259%0.585SS**Hα-helixtrans-58.5-43.5175.7-174.7-179179.8-166.4-0.1111.9K62 K63 H68 E69 L70K62-R66 WeakPolarHBondContact O-CB 3.48Å; K62-R66 PolarHBondContact O-N 3.43Å; K63-R66 PolarHBondContact O-N 3.36Å; R66-H68 VanDerWaalsContact C-N 3.34Å; R66-H68 PolarHBondContact O-N 2.9Å; R66-E69 PolarHBondContact O-N 3.4Å; R66-L70 HydrophobicContact CG-CD1 3.9Å; R66-L70 HydrophobicContact CG-CG 4.32Å; R66-L70 WeakPolarHBondContact O-CB 3.46Å; R66-L70 WeakPolarHBondContact O-CG 3.38Å; R66-L70 PolarHBondContact O-N 3.34Å
67M92.5Very high86.2Confident127 Ų127122.9 Ų122.963%0.62659%0.594SS**Hα-helixtrans-63.4-39.7177-72.3-57-61.500112K63 T64 L65 K71K63-M67 WeakPolarHBondContact O-CB 3.13Å; K63-M67 VanDerWaalsContact O-CG 3.26Å; K63-M67 WeakPolarHBondContact O-CG 3.45Å; K63-M67 PolarHBondContact O-N 2.99Å; T64-M67 PolarHBondContact O-N 2.91Å; L65-M67 VanDerWaalsContact C-N 3.33Å; L65-M67 PolarHBondContact O-N 2.99Å; M67-K71 WeakPolarHBondContact O-CB 3.49Å; M67-K71 PolarHBondContact O-N 3.48Å
68H92.8Very high84Confident148 Ų148125.2 Ų125.269%0.68561%0.609SS**Hα-helixtrans-66.6-43.5176.4-174.9-84.7000111.9T64 L65 R66 K71T64-H68 WeakPolarHBondContact O-CB 3.36Å; T64-H68 PolarHBondContact O-N 3.02Å; L65-H68 PolarHBondContact O-N 2.82Å; L65-H68 VanDerWaalsContact O-N 3.15Å; R66-H68 VanDerWaalsContact C-N 3.34Å; R66-H68 PolarHBondContact O-N 2.9Å; H68-K71 PolarHBondContact O-N 3.42Å
69E90.8Very high81.7Confident117 Ų117128 Ų12855%0.54763%0.625SS.*Hα-helixtrans-62.9-40.7175.5-72.1169.8-171.400112.5L65 R66L65-E69 WeakPolarHBondContact O-CG 3.41Å; L65-E69 PolarHBondContact O-N 3.48Å; R66-E69 PolarHBondContact O-N 3.4Å
70L88.4Confident79.2Confident54 Ų54129.7 Ų129.728%0.28364%0.644SS.*Hα-helixtrans-71.8-33.8177.5-69.8174.5000112.1R66 G72 K73 Q75R66-L70 HydrophobicContact CG-CD1 3.9Å; R66-L70 HydrophobicContact CG-CG 4.32Å; R66-L70 WeakPolarHBondContact O-CB 3.46Å; R66-L70 WeakPolarHBondContact O-CG 3.38Å; R66-L70 PolarHBondContact O-N 3.34Å; L70-G72 PolarHBondContact O-N 2.64Å; L70-K73 CarbonylContact O-C 3.42Å; L70-K73 PolarHBondContact O-N 3.41Å; L70-Q75 VanDerWaalsContact CD2-NE2 3.29Å
71K85.9Confident76.8Confident182 Ų182127.7 Ų127.779%0.79165%0.653SS**Hα-helixtrans-61.8-29.8178.8-171.6175.6179.5-177.30113M67 H68M67-K71 WeakPolarHBondContact O-CB 3.49Å; M67-K71 PolarHBondContact O-N 3.48Å; H68-K71 PolarHBondContact O-N 3.42Å
72G75.7Confident74.7Confident71 Ų71132.5 Ų132.573%0.73267%0.665SS**THydrogen-bonded Turntrans-84-12.6174.600000114.3L70L70-G72 PolarHBondContact O-N 2.64Å
73K75.4Confident72.9Confident139 Ų139131.3 Ų131.360%0.60468%0.678SS**  trans-110.7101.1-179.1-66.8178.8-177.7179.10108.3L70 Q75L70-K73 CarbonylContact O-C 3.42Å; L70-K73 PolarHBondContact O-N 3.41Å; K73-Q75 PolarHBondContact O-N 2.98Å
74N67.3Low71.4Confident158 Ų158128 Ų12885%0.84568%0.679SS**  trans-62.490.4161.1-69.3-26.6000107.2K76N74-K76 VanDerWaalsContact C-N 3.31Å; N74-K76 PolarHBondContact O-N 2.97Å
75Q61.9Low70.1Confident138 Ų138133.1 Ų133.165%0.64570%0.699SS**  trans-66.5101.8166.5-69.3-171.8-12.200105.3L70 K73 I77L70-Q75 VanDerWaalsContact CD2-NE2 3.29Å; K73-Q75 PolarHBondContact O-N 2.98Å; Q75-I77 PolarHBondContact O-N 3.32Å; Q75-I77 VanDerWaalsContact O-N 3.14Å
76K56.8Low69Low183 Ų183131.6 Ų131.680%0.79669%0.694SS**  trans-55.7119.1160-67.8-174.6178-175.90105N74 D78N74-K76 VanDerWaalsContact C-N 3.31Å; N74-K76 PolarHBondContact O-N 2.97Å; K76-D78 PolarHBondContact O-N 3.41Å; K76-D78 VanDerWaalsContact O-N 3.07Å
77I56.3Low68.3Low146 Ų146126.3 Ų126.375%0.74968%0.681SS**  trans-68.4104.8170.6-63.1169.2000103.6Q75 E79Q75-I77 PolarHBondContact O-N 3.32Å; Q75-I77 VanDerWaalsContact O-N 3.14Å; I77-E79 PolarHBondContact O-N 3.11Å; I77-E79 VanDerWaalsContact O-N 3.15Å
78D50.2Low67.7Low139 Ų139124.4 Ų124.474%0.74369%0.686SS**  trans-61.8118.4168.7-67.2-34.8000106.7K76 A80K76-D78 PolarHBondContact O-N 3.41Å; K76-D78 VanDerWaalsContact O-N 3.07Å; D78-A80 PolarHBondContact O-N 3.09Å
79E49.7Very low67.1Low200 Ų200124.9 Ų124.994%0.93568%0.682SS**  trans-69.658.5-179.9-65.9-179.2159.400111.2I77I77-E79 PolarHBondContact O-N 3.11Å; I77-E79 VanDerWaalsContact O-N 3.15Å
80A45.3Very low66.5Low86 Ų86122.4 Ų122.471%0.71167%0.673SS**  trans-111.884.7178.200000110.1D78 R82D78-A80 PolarHBondContact O-N 3.09Å; A80-R82 PolarHBondContact O-N 2.97Å
81G48.1Very low65.8Low70 Ų70125 Ų12572%0.72269%0.686SS**  trans43.676.215200000116.8S83G81-S83 PolarHBondContact O-N 3.23Å
82R53.4Low65.3Low209 Ų209122.9 Ų122.979%0.78968%0.684SS**  trans-72121.3164.5-94.8176.6157.4160.2-4.9108.8A80 G84 E85A80-R82 PolarHBondContact O-N 2.97Å; R82-G84 PolarHBondContact O-N 3.47Å; R82-E85 PolarHBondContact O-N 3.12Å
83S59.1Low65Low139 Ų139127.1 Ų127.197%0.97268%0.678SS**THydrogen-bonded Turntrans-65.629.1177.564.20000115.1G81G81-S83 PolarHBondContact O-N 3.23Å
84G66.6Low64.5Low56 Ų56122.6 Ų122.658%0.57767%0.671SS**THydrogen-bonded Turntrans-15326.1-177.800000112.2R82 V86R82-G84 PolarHBondContact O-N 3.47Å; G84-V86 PolarHBondContact O-N 3.37Å
85E68.4Low64.4Low167 Ų167122.8 Ų122.878%0.7867%0.667SS**  trans-72.193.6177.8-154.1154.2-131.900109.3R82R82-E85 PolarHBondContact O-N 3.12Å
86V72Confident64.4Low65 Ų65123.2 Ų123.239%0.39467%0.669SS.*  trans-85.7133.8171.2-159.20000106.9G84 L90 L91G84-V86 PolarHBondContact O-N 3.37Å; V86-L90 HydrophobicContact CB-CB 4.36Å; V86-L90 HydrophobicContact CG1-CB 3.3Å; V86-L90 HydrophobicContact CG1-CD1 3.6Å; V86-L90 HydrophobicContact CG1-CG 4.08Å; V86-L91 HydrophobicContact CB-CD2 4.31Å; V86-L91 WeakPolarHBondContact O-CD2 3.5Å
87P78Confident64.9Low59 Ų59119.8 Ų119.838%0.38366%0.658SS.*  trans-47.5144.4177-31.434.6000112.6Y89 L90P87-Y89 HydrophobicContact CB-CD1 3.64Å; P87-Y89 HydrophobicContact CB-CE1 3.12Å; P87-Y89 HydrophobicContact CB-CE2 4.24Å; P87-Y89 HydrophobicContact CB-CG 4.38Å; P87-Y89 VanDerWaalsContact CB-CZ 3.45Å; P87-Y89 HydrophobicContact CG-CE1 4.01Å; P87-Y89 PolarHBondContact O-N 2.93Å; P87-L90 PolarHBondContact O-N 3.4Å
88A80.5Confident65.5Low87 Ų87115.6 Ų115.672%0.71964%0.641SS**G310 helixtrans-51.1-31.4-170.100000114.2L90 L91A88-L90 PolarHBondContact O-N 3.31Å; A88-L91 HydrophobicContact CB-CD1 4.35Å
89Y79.9Confident66.6Low157 Ų157111.7 Ų111.762%0.61663%0.628SS**G310 helixtrans-71-6.7177.860.8-95.3000115.2P87 R93P87-Y89 HydrophobicContact CB-CD1 3.64Å; P87-Y89 HydrophobicContact CB-CE1 3.12Å; P87-Y89 HydrophobicContact CB-CE2 4.24Å; P87-Y89 HydrophobicContact CB-CG 4.38Å; P87-Y89 VanDerWaalsContact CB-CZ 3.45Å; P87-Y89 HydrophobicContact CG-CE1 4.01Å; P87-Y89 PolarHBondContact O-N 2.93Å; Y89-R93 PolarHBondContact O-NE 3.49Å
90L76.5Confident68Low66 Ų66109.5 Ų109.535%0.34662%0.616SS.*G310 helixtrans-117-7.1179.8-69.6173.5000113.9V86 P87 A88 D92 R93V86-L90 HydrophobicContact CB-CB 4.36Å; V86-L90 HydrophobicContact CG1-CB 3.3Å; V86-L90 HydrophobicContact CG1-CD1 3.6Å; V86-L90 HydrophobicContact CG1-CG 4.08Å; P87-L90 PolarHBondContact O-N 3.4Å; A88-L90 PolarHBondContact O-N 3.31Å; L90-D92 PolarHBondContact O-N 2.96Å; L90-R93 PolarHBondContact O-N 2.93Å
91L75.7Confident69.7Low108 Ų108109.3 Ų109.357%0.56561%0.606SS**THydrogen-bonded Turntrans-57.8-21.8-168.8-77173.1000115V86 A88V86-L91 HydrophobicContact CB-CD2 4.31Å; V86-L91 WeakPolarHBondContact O-CD2 3.5Å; A88-L91 HydrophobicContact CB-CD1 4.35Å
92D73.5Confident71.2Confident138 Ų138111.3 Ų111.374%0.73860%0.599SS**THydrogen-bonded Turntrans-121.14.6179.4-58.8-53.2000113.8L90L90-D92 PolarHBondContact O-N 2.96Å
93R70.4Confident72.6Confident159 Ų159103.7 Ų103.760%0.658%0.578SS**THydrogen-bonded Turntrans-89.5-25.8-176.7-63.5-171.5-178-176.52.4113.1Y89 L90 E95 Q96 I97Y89-R93 PolarHBondContact O-NE 3.49Å; L90-R93 PolarHBondContact O-N 2.93Å; R93-E95 PolarHBondContact O-N 2.94Å; R93-Q96 PolarHBondContact O-N 2.98Å; R93-I97 PolarHBondContact O-N 3.44Å
94G65.3Low74Confident45 Ų45101 Ų10146%0.46455%0.553SS.*Hα-helixtrans-66.1-34.1-176.200000114.8Q96 I97 S98G94-Q96 PolarHBondContact O-N 3.24Å; G94-I97 PolarHBondContact O-N 2.81Å; G94-S98 PolarHBondContact O-N 3.38Å; G94-S98 PolarHBondContact O-OG 3.28Å
95E64.5Low75Confident162 Ų162100.8 Ų100.876%0.75754%0.54SS*.Hα-helixtrans-67.5-36.4179.2-69.3-166.3158.500112.1R93 S98 A99R93-E95 PolarHBondContact O-N 2.94Å; E95-S98 PolarHBondContact O-OG 3.31Å; E95-S98 VanDerWaalsContact O-OG 3.07Å; E95-A99 VanDerWaalsContact O-CB 3.3Å; E95-A99 WeakPolarHBondContact O-CB 3.45Å; E95-A99 PolarHBondContact O-N 3.35Å
96Q62.3Low75.9Confident147 Ų14796.6 Ų96.669%0.68753%0.526SS*.Hα-helixtrans-69.2-38178.3-61.7-172.64.100112.4R93 G94 K100R93-Q96 PolarHBondContact O-N 2.98Å; G94-Q96 PolarHBondContact O-N 3.24Å; Q96-K100 PolarHBondContact O-N 3Å
97I66.3Low76.7Confident110 Ų110100.1 Ų100.156%0.56454%0.536SS*.Hα-helixtrans-71-46.7-179.8-61.7169.4000110R93 G94 A99 K100 V101R93-I97 PolarHBondContact O-N 3.44Å; G94-I97 PolarHBondContact O-N 2.81Å; I97-A99 PolarHBondContact O-N 3.17Å; I97-K100 PolarHBondContact O-N 3Å; I97-V101 WeakPolarHBondContact O-CG2 3.35Å; I97-V101 PolarHBondContact O-N 3.32Å
98S68.7Low77.1Confident58 Ų58103 Ų10341%0.40654%0.544SS..Hα-helixtrans-63.5-40178.758.20000112.2G94 E95 K100 V101 L102G94-S98 PolarHBondContact O-N 3.38Å; G94-S98 PolarHBondContact O-OG 3.28Å; E95-S98 PolarHBondContact O-OG 3.31Å; E95-S98 VanDerWaalsContact O-OG 3.07Å; S98-K100 PolarHBondContact O-N 3.43Å; S98-V101 PolarHBondContact O-N 2.8Å; S98-L102 WeakPolarHBondContact O-CB 3.3Å; S98-L102 VanDerWaalsContact O-CG 3.22Å; S98-L102 WeakPolarHBondContact O-CG 3.45Å; S98-L102 PolarHBondContact O-N 3.46Å
99A73.8Confident77.6Confident57 Ų57105.7 Ų105.747%0.47154%0.54SS..Hα-helixtrans-61.1-43.4175.200000112.7E95 I97 L102 S103E95-A99 VanDerWaalsContact O-CB 3.3Å; E95-A99 WeakPolarHBondContact O-CB 3.45Å; E95-A99 PolarHBondContact O-N 3.35Å; I97-A99 PolarHBondContact O-N 3.17Å; A99-L102 PolarHBondContact O-N 3.36Å; A99-S103 WeakPolarHBondContact O-CB 3.46Å; A99-S103 PolarHBondContact O-N 3.15Å
100K79.8Confident77.9Confident155 Ų155105.2 Ų105.267%0.67454%0.541SS*.Hα-helixtrans-63.9-45175.5-91179.7177.7174.20112Q96 I97 S98 S103 N104Q96-K100 PolarHBondContact O-N 3Å; I97-K100 PolarHBondContact O-N 3Å; S98-K100 PolarHBondContact O-N 3.43Å; K100-S103 PolarHBondContact O-N 3.28Å; K100-S103 PolarHBondContact O-OG 2.91Å; K100-N104 PolarHBondContact O-N 3.39Å; K100-N104 PolarHBondContact O-ND2 2.9Å
101V80.3Confident78.4Confident82 Ų82104.8 Ų104.850%0.49755%0.547SS..Hα-helixtrans-61.8-43.9177.3174.40000111.3I97 S98 S103 N104 T105I97-V101 WeakPolarHBondContact O-CG2 3.35Å; I97-V101 PolarHBondContact O-N 3.32Å; S98-V101 PolarHBondContact O-N 2.8Å; V101-S103 VanDerWaalsContact C-N 3.34Å; V101-S103 PolarHBondContact O-N 3.41Å; V101-N104 PolarHBondContact O-N 2.91Å; V101-T105 HydrophobicContact CG1-CG2 4.47Å; V101-T105 WeakPolarHBondContact O-CG2 3.28Å; V101-T105 PolarHBondContact O-N 3.35Å; V101-T105 PolarHBondContact O-OG1 3.36Å; V101-T105 VanDerWaalsContact O-OG1 3.09Å
102L80Confident78.8Confident111 Ų111104.3 Ų104.358%0.58154%0.541SS*.Hα-helixtrans-62-40.6174.8-71.8168.2000111.9S98 A99 N104 T105 V106S98-L102 WeakPolarHBondContact O-CB 3.3Å; S98-L102 VanDerWaalsContact O-CG 3.22Å; S98-L102 WeakPolarHBondContact O-CG 3.45Å; S98-L102 PolarHBondContact O-N 3.46Å; A99-L102 PolarHBondContact O-N 3.36Å; L102-N104 VanDerWaalsContact C-N 3.35Å; L102-N104 PolarHBondContact O-N 2.96Å; L102-T105 WeakPolarHBondContact CA-OG1 3.34Å; L102-T105 PolarHBondContact O-OG1 3.24Å; L102-V106 VanDerWaalsContact O-CG2 3.3Å; L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.28Å; L102-V106 VanDerWaalsContact O-N 3.08Å
103S83.5Confident79.5Confident50 Ų50104.8 Ų104.835%0.3554%0.537SS..Hα-helixtrans-64-39.6177.181.70000112.4A99 K100 V101 K107A99-S103 WeakPolarHBondContact O-CB 3.46Å; A99-S103 PolarHBondContact O-N 3.15Å; K100-S103 PolarHBondContact O-N 3.28Å; K100-S103 PolarHBondContact O-OG 2.91Å; V101-S103 VanDerWaalsContact C-N 3.34Å; V101-S103 PolarHBondContact O-N 3.41Å; S103-K107 WeakPolarHBondContact O-CG 3.13Å; S103-K107 PolarHBondContact O-N 2.96Å; S103-K107 VanDerWaalsContact O-N 3.1Å
104N88.2Confident80Confident82 Ų8299.5 Ų99.544%0.43953%0.528SS..Hα-helixtrans-71.6-42.3179.7-71.8-20.2000111.8K100 V101 L102 V106 K107 Q108K100-N104 PolarHBondContact O-N 3.39Å; K100-N104 PolarHBondContact O-ND2 2.9Å; V101-N104 PolarHBondContact O-N 2.91Å; L102-N104 VanDerWaalsContact C-N 3.35Å; L102-N104 PolarHBondContact O-N 2.96Å; N104-V106 VanDerWaalsContact C-N 3.33Å; N104-V106 PolarHBondContact O-N 2.96Å; N104-K107 WeakPolarHBondContact O-CB 3.5Å; N104-K107 PolarHBondContact O-N 3.31Å; N104-K107 VanDerWaalsContact O-N 3.17Å; N104-Q108 WeakPolarHBondContact O-CG 3.5Å; N104-Q108 PolarHBondContact O-N 3.33Å
105T87.4Confident81Confident52 Ų52101.1 Ų101.132%0.31953%0.528SS..Hα-helixtrans-63.6-37.9176.252.20000112.1V101 L102 Q108 K109V101-T105 HydrophobicContact CG1-CG2 4.47Å; V101-T105 WeakPolarHBondContact O-CG2 3.28Å; V101-T105 PolarHBondContact O-N 3.35Å; V101-T105 PolarHBondContact O-OG1 3.36Å; V101-T105 VanDerWaalsContact O-OG1 3.09Å; L102-T105 WeakPolarHBondContact CA-OG1 3.34Å; L102-T105 PolarHBondContact O-OG1 3.24Å; T105-Q108 PolarHBondContact O-N 3.36Å; T105-K109 WeakPolarHBondContact O-CG 3.29Å; T105-K109 PolarHBondContact O-N 3.02Å
106V87.2Confident81.9Confident79 Ų79101.7 Ų101.748%0.47952%0.523SS..Hα-helixtrans-64.7-41.3172.9171.40000111.4L102 N104 K109 K110L102-V106 VanDerWaalsContact O-CG2 3.3Å; L102-V106 WeakPolarHBondContact O-CG2 3.39Å; L102-V106 PolarHBondContact O-N 3.28Å; L102-V106 VanDerWaalsContact O-N 3.08Å; N104-V106 VanDerWaalsContact C-N 3.33Å; N104-V106 PolarHBondContact O-N 2.96Å; V106-K109 PolarHBondContact O-N 3.49Å; V106-K110 WeakPolarHBondContact O-CG 3.23Å; V106-K110 PolarHBondContact O-N 3Å; V106-K110 VanDerWaalsContact O-N 3.07Å
107K88.6Confident82.9Confident139 Ų13999.6 Ų99.660%0.60452%0.517SS*.Hα-helixtrans-62.4-45.4175.2-74.3174.8-178179.10111.6S103 N104 K110 A111S103-K107 WeakPolarHBondContact O-CG 3.13Å; S103-K107 PolarHBondContact O-N 2.96Å; S103-K107 VanDerWaalsContact O-N 3.1Å; N104-K107 WeakPolarHBondContact O-CB 3.5Å; N104-K107 PolarHBondContact O-N 3.31Å; N104-K107 VanDerWaalsContact O-N 3.17Å; K107-K110 PolarHBondContact O-N 3.15Å; K107-K110 VanDerWaalsContact O-N 3.17Å; K107-A111 PolarHBondContact O-N 2.9Å
108Q86.8Confident83.9Confident119 Ų11999.7 Ų99.756%0.55652%0.517SS*.Hα-helixtrans-59.6-47176.1-74.1173.3-17.700111.6N104 T105 K110 A111 E112N104-Q108 WeakPolarHBondContact O-CG 3.5Å; N104-Q108 PolarHBondContact O-N 3.33Å; T105-Q108 PolarHBondContact O-N 3.36Å; Q108-K110 VanDerWaalsContact C-N 3.27Å; Q108-K110 PolarHBondContact O-N 3.02Å; Q108-A111 PolarHBondContact O-N 2.85Å; Q108-A111 VanDerWaalsContact O-N 3.14Å; Q108-E112 WeakPolarHBondContact O-CG 3.41Å; Q108-E112 PolarHBondContact O-N 3.44Å
109K90.3Very high84.7Confident144 Ų144101.3 Ų101.363%0.62652%0.521SS*.Hα-helixtrans-61.1-31.5175.7-75.3-174.9176.8-1780113.7T105 V106 K113T105-K109 WeakPolarHBondContact O-CG 3.29Å; T105-K109 PolarHBondContact O-N 3.02Å; V106-K109 PolarHBondContact O-N 3.49Å; K109-K113 WeakPolarHBondContact O-CG 3.41Å; K109-K113 PolarHBondContact O-N 3.49Å
110K86.3Confident85.2Confident147 Ų147103.7 Ų103.764%0.63953%0.525SS*.Hα-helixtrans-72.3-43.3173.9-74.8-178.9178.9-175.50111.7V106 K107 Q108 K113 A114V106-K110 WeakPolarHBondContact O-CG 3.23Å; V106-K110 PolarHBondContact O-N 3Å; V106-K110 VanDerWaalsContact O-N 3.07Å; K107-K110 PolarHBondContact O-N 3.15Å; K107-K110 VanDerWaalsContact O-N 3.17Å; Q108-K110 VanDerWaalsContact C-N 3.27Å; Q108-K110 PolarHBondContact O-N 3.02Å; K110-K113 PolarHBondContact O-N 3.13Å; K110-A114 PolarHBondContact O-N 3.35Å; K110-A114 VanDerWaalsContact O-N 3.11Å
111A87.1Confident85.5Confident56 Ų56105 Ų10546%0.46353%0.527SS..Hα-helixtrans-61.9-45.7176.900000111.7K107 Q108 K113 A114 V115K107-A111 PolarHBondContact O-N 2.9Å; Q108-A111 PolarHBondContact O-N 2.85Å; Q108-A111 VanDerWaalsContact O-N 3.14Å; A111-K113 VanDerWaalsContact C-N 3.33Å; A111-K113 PolarHBondContact O-N 2.85Å; A111-A114 PolarHBondContact O-N 3.45Å; A111-V115 WeakPolarHBondContact O-CG2 3.41Å; A111-V115 PolarHBondContact O-N 3.36Å
112E83.8Confident85.8Confident98 Ų98104.4 Ų104.446%0.45853%0.527SS..Hα-helixtrans-60.2-39.6176.9-73.5176.1-159.900112.9Q108 V115 R116Q108-E112 WeakPolarHBondContact O-CG 3.41Å; Q108-E112 PolarHBondContact O-N 3.44Å; E112-V115 PolarHBondContact O-N 2.93Å; E112-R116 WeakPolarHBondContact O-CG 3.43Å; E112-R116 PolarHBondContact O-N 3.35Å; E112-R116 IonicContact OE2-NH2 3.84Å
113K87.9Confident86.1Confident148 Ų148103.2 Ų103.264%0.64352%0.524SS*.Hα-helixtrans-65.1-42.1175.9-76.5-179.2-179.4-171.70112K109 K110 A111 R116 L117K109-K113 WeakPolarHBondContact O-CG 3.41Å; K109-K113 PolarHBondContact O-N 3.49Å; K110-K113 PolarHBondContact O-N 3.13Å; A111-K113 VanDerWaalsContact C-N 3.33Å; A111-K113 PolarHBondContact O-N 2.85Å; K113-R116 PolarHBondContact O-N 2.94Å; K113-L117 WeakPolarHBondContact O-CG 3.42Å; K113-L117 PolarHBondContact O-N 3.49Å; K113-L117 VanDerWaalsContact O-N 3.11Å
114A82.1Confident86.1Confident49 Ų49104 Ų10441%0.40553%0.529SS..Hα-helixtrans-63.6-44.3176.700000111.4K110 A111 R116 L117 I118K110-A114 PolarHBondContact O-N 3.35Å; K110-A114 VanDerWaalsContact O-N 3.11Å; A111-A114 PolarHBondContact O-N 3.45Å; A114-R116 PolarHBondContact O-N 3.41Å; A114-L117 PolarHBondContact O-N 3.41Å; A114-I118 VanDerWaalsContact O-CG1 3.32Å; A114-I118 WeakPolarHBondContact O-CG1 3.4Å; A114-I118 PolarHBondContact O-N 3.26Å
115V85.9Confident85.9Confident79 Ų79107.9 Ų107.948%0.47954%0.539SS..Hα-helixtrans-61.5-43.2176.3174.30000111.4A111 E112 L117 I118 N119A111-V115 WeakPolarHBondContact O-CG2 3.41Å; A111-V115 PolarHBondContact O-N 3.36Å; E112-V115 PolarHBondContact O-N 2.93Å; V115-L117 VanDerWaalsContact C-N 3.33Å; V115-L117 PolarHBondContact O-N 3.46Å; V115-I118 PolarHBondContact O-N 3.45Å; V115-N119 WeakPolarHBondContact O-CB 3.35Å; V115-N119 PolarHBondContact O-N 3.47Å
116R84.3Confident85.7Confident173 Ų173108.3 Ų108.365%0.65354%0.544SS*.Hα-helixtrans-59.8-41.7175.6-74.7-179.5-154.2-171.25.5112.6E112 K113 A114 L120E112-R116 WeakPolarHBondContact O-CG 3.43Å; E112-R116 PolarHBondContact O-N 3.35Å; E112-R116 IonicContact OE2-NH2 3.84Å; K113-R116 PolarHBondContact O-N 2.94Å; A114-R116 PolarHBondContact O-N 3.41Å; R116-L120 WeakPolarHBondContact O-CB 3.38Å; R116-L120 PolarHBondContact O-N 3.44Å
117L83.4Confident85.4Confident104 Ų104111.4 Ų111.455%0.54555%0.551SS.*Hα-helixtrans-65.3-46.6177.5-71.6171.9000111.2K113 A114 V115 N119 L120 Y121K113-L117 WeakPolarHBondContact O-CG 3.42Å; K113-L117 PolarHBondContact O-N 3.49Å; K113-L117 VanDerWaalsContact O-N 3.11Å; A114-L117 PolarHBondContact O-N 3.41Å; V115-L117 VanDerWaalsContact C-N 3.33Å; V115-L117 PolarHBondContact O-N 3.46Å; L117-N119 VanDerWaalsContact C-N 3.33Å; L117-N119 PolarHBondContact O-N 2.89Å; L117-L120 WeakPolarHBondContact O-CB 3.26Å; L117-L120 PolarHBondContact O-N 2.7Å; L117-Y121 VanDerWaalsContact O-CD2 3.31Å; L117-Y121 WeakPolarHBondContact O-CD2 3.34Å; L117-Y121 PolarHBondContact O-N 3.5Å
118I86.3Confident85Confident111 Ų111110.1 Ų110.157%0.56955%0.55SS**Hα-helixtrans-59.4-45.1178.7-66.8162.4000110.9A114 V115 L120 Y121 S122A114-I118 VanDerWaalsContact O-CG1 3.32Å; A114-I118 WeakPolarHBondContact O-CG1 3.4Å; A114-I118 PolarHBondContact O-N 3.26Å; V115-I118 PolarHBondContact O-N 3.45Å; I118-L120 VanDerWaalsContact C-N 3.33Å; I118-L120 PolarHBondContact O-N 2.94Å; I118-Y121 PolarHBondContact O-N 2.91Å; I118-S122 WeakPolarHBondContact O-CB 3.37Å; I118-S122 PolarHBondContact O-N 2.96Å
119N86Confident84.8Confident93 Ų93108.7 Ų108.750%0.49755%0.545SS..Hα-helixtrans-62.1-40.8177.7-72.1-12.1000111.6V115 L117 S122 T123V115-N119 WeakPolarHBondContact O-CB 3.35Å; V115-N119 PolarHBondContact O-N 3.47Å; L117-N119 VanDerWaalsContact C-N 3.33Å; L117-N119 PolarHBondContact O-N 2.89Å; N119-S122 PolarHBondContact O-N 3.21Å; N119-T123 WeakPolarHBondContact O-CG2 3.3Å; N119-T123 PolarHBondContact O-N 3.33Å; N119-T123 PolarHBondContact O-OG1 3.48Å
120L84.7Confident84.2Confident106 Ų106107.9 Ų107.956%0.55555%0.548SS*.Hα-helixtrans-62.6-46.5177-161.580000111.6R116 L117 I118 S122 T123 C124R116-L120 WeakPolarHBondContact O-CB 3.38Å; R116-L120 PolarHBondContact O-N 3.44Å; L117-L120 WeakPolarHBondContact O-CB 3.26Å; L117-L120 PolarHBondContact O-N 2.7Å; I118-L120 VanDerWaalsContact C-N 3.33Å; I118-L120 PolarHBondContact O-N 2.94Å; L120-S122 PolarHBondContact O-N 3.09Å; L120-T123 WeakPolarHBondContact CA-OG1 3.08Å; L120-T123 PolarHBondContact O-N 3.29Å; L120-T123 PolarHBondContact O-OG1 3.29Å; L120-C124 WeakPolarHBondContact O-CB 3.43Å; L120-C124 PolarHBondContact O-N 3.46Å; L120-C124 PolarHBondContact O-SG 3.2Å
121Y85.4Confident83.7Confident182 Ų182108.6 Ų108.671%0.71455%0.551SS**Hα-helixtrans-60.9-44.1176.1-89.3-82.2000111.8L117 I118 C124 Y125L117-Y121 VanDerWaalsContact O-CD2 3.31Å; L117-Y121 WeakPolarHBondContact O-CD2 3.34Å; L117-Y121 PolarHBondContact O-N 3.5Å; I118-Y121 PolarHBondContact O-N 2.91Å; Y121-C124 PolarHBondContact O-N 3.45Å; Y121-Y125 WeakPolarHBondContact O-CB 3.38Å; Y121-Y125 PolarHBondContact O-N 2.95Å
122S86.5Confident82.5Confident70 Ų70112.9 Ų112.949%0.4957%0.566SS.*Hα-helixtrans-62-44.9177-167.90000111.6I118 N119 L120 Y125 S126I118-S122 WeakPolarHBondContact O-CB 3.37Å; I118-S122 PolarHBondContact O-N 2.96Å; N119-S122 PolarHBondContact O-N 3.21Å; L120-S122 PolarHBondContact O-N 3.09Å; S122-Y125 PolarHBondContact O-N 2.99Å; S122-S126 WeakPolarHBondContact O-CB 3.11Å; S122-S126 PolarHBondContact O-N 2.89Å; S122-S126 PolarHBondContact O-OG 2.83Å
123T86.3Confident81.1Confident86 Ų86117.7 Ų117.753%0.52859%0.593SS.*Hα-helixtrans-65.4-40.4178.247.60000112.5N119 L120 F127N119-T123 WeakPolarHBondContact O-CG2 3.3Å; N119-T123 PolarHBondContact O-N 3.33Å; N119-T123 PolarHBondContact O-OG1 3.48Å; L120-T123 WeakPolarHBondContact CA-OG1 3.08Å; L120-T123 PolarHBondContact O-N 3.29Å; L120-T123 PolarHBondContact O-OG1 3.29Å; T123-F127 WeakPolarHBondContact O-CB 2.99Å; T123-F127 PolarHBondContact O-N 2.95Å
124C84.3Confident80.7Confident67 Ų67116.2 Ų116.245%0.45359%0.591SS.*Hα-helixtrans-66.3-40.1176.6-69.10000111.8L120 Y121 F127 L128L120-C124 WeakPolarHBondContact O-CB 3.43Å; L120-C124 PolarHBondContact O-N 3.46Å; L120-C124 PolarHBondContact O-SG 3.2Å; Y121-C124 PolarHBondContact O-N 3.45Å; C124-F127 PolarHBondContact O-N 2.85Å; C124-L128 WeakPolarHBondContact O-CB 3.31Å; C124-L128 WeakPolarHBondContact O-CG 3.47Å; C124-L128 PolarHBondContact O-N 3.5Å
125Y84Confident80.6Confident164 Ų164119.7 Ų119.764%0.64360%0.601SS**Hα-helixtrans-68.3-42.8179-159.3-102.1000111.8Y121 S122 F127 L128 I129Y121-Y125 WeakPolarHBondContact O-CB 3.38Å; Y121-Y125 PolarHBondContact O-N 2.95Å; S122-Y125 PolarHBondContact O-N 2.99Å; Y125-F127 VanDerWaalsContact C-N 3.31Å; Y125-F127 PolarHBondContact O-N 2.97Å; Y125-L128 PolarHBondContact O-N 3.46Å; Y125-I129 HydrophobicContact CD1-CD1 3.51Å; Y125-I129 HydrophobicContact CD1-CG1 4.34Å; Y125-I129 HydrophobicContact CE1-CD1 3.48Å; Y125-I129 VanDerWaalsContact CE1-CD1 3.48Å; Y125-I129 HydrophobicContact CE1-CG1 4.28Å; Y125-I129 WeakPolarHBondContact O-CG1 3.02Å; Y125-I129 PolarHBondContact O-N 3.41Å
126S81.8Confident80.4Confident60 Ų60122 Ų12242%0.4261%0.607SS.*Hα-helixtrans-62.5-36.8172.5-67.10000112.4S122 N130S122-S126 WeakPolarHBondContact O-CB 3.11Å; S122-S126 PolarHBondContact O-N 2.89Å; S122-S126 PolarHBondContact O-OG 2.83Å; S126-N130 PolarHBondContact O-N 3.01Å; S126-N130 VanDerWaalsContact O-N 3.17Å; S126-N130 PolarHBondContact O-ND2 3.12Å
127F82.4Confident80.1Confident145 Ų145119 Ų11964%0.63661%0.605SS**Hα-helixtrans-67.7-42.2175.9-157.8-94000111.8T123 C124 Y125 I129 N130 F131T123-F127 WeakPolarHBondContact O-CB 2.99Å; T123-F127 PolarHBondContact O-N 2.95Å; C124-F127 PolarHBondContact O-N 2.85Å; Y125-F127 VanDerWaalsContact C-N 3.31Å; Y125-F127 PolarHBondContact O-N 2.97Å; F127-I129 PolarHBondContact O-N 2.9Å; F127-N130 PolarHBondContact O-N 3.25Å; F127-F131 AromaticContact CE1-CD2 3.98Å; F127-F131 HydrophobicContact CE1-CD2 3.98Å; F127-F131 HydrophobicContact CE1-CE2 4.38Å; F127-F131 HydrophobicContact CZ-CD2 4.35Å; F127-F131 WeakPolarHBondContact O-CB 3.09Å; F127-F131 PolarHBondContact O-N 3.37Å; F127-F131 VanDerWaalsContact O-N 3.12Å
128L79.1Confident79.9Confident112 Ų112119.9 Ų119.959%0.58661%0.609SS**Hα-helixtrans-63.2-37.5175.9-79.4162.5000112.9C124 Y125 N132C124-L128 WeakPolarHBondContact O-CB 3.31Å; C124-L128 WeakPolarHBondContact O-CG 3.47Å; C124-L128 PolarHBondContact O-N 3.5Å; Y125-L128 PolarHBondContact O-N 3.46Å; L128-N132 WeakPolarHBondContact O-CB 3.37Å; L128-N132 PolarHBondContact O-N 3.24Å
129I82.2Confident79.5Confident88 Ų88120.5 Ų120.545%0.45161%0.611SS.*Hα-helixtrans-68-42.2176.6-68.9164.5000111.4Y125 F127 F131Y125-I129 HydrophobicContact CD1-CD1 3.51Å; Y125-I129 HydrophobicContact CD1-CG1 4.34Å; Y125-I129 HydrophobicContact CE1-CD1 3.48Å; Y125-I129 VanDerWaalsContact CE1-CD1 3.48Å; Y125-I129 HydrophobicContact CE1-CG1 4.28Å; Y125-I129 WeakPolarHBondContact O-CG1 3.02Å; Y125-I129 PolarHBondContact O-N 3.41Å; F127-I129 PolarHBondContact O-N 2.9Å; I129-F131 VanDerWaalsContact C-N 3.3Å; I129-F131 PolarHBondContact O-N 3.01Å
130N78.8Confident79Confident127 Ų127122.5 Ų122.568%0.67962%0.619SS**Hα-helixtrans-74.2-17.8-179.2-77-75.6000113.7S126 F127S126-N130 PolarHBondContact O-N 3.01Å; S126-N130 VanDerWaalsContact O-N 3.17Å; S126-N130 PolarHBondContact O-ND2 3.12Å; F127-N130 PolarHBondContact O-N 3.25Å
131F75Confident78.6Confident163 Ų163123.8 Ų123.872%0.71562%0.624SS**THydrogen-bonded Turntrans-96.4-6.2179.3-137.2-89.4000113.5F127 I129F127-F131 AromaticContact CE1-CD2 3.98Å; F127-F131 HydrophobicContact CE1-CD2 3.98Å; F127-F131 HydrophobicContact CE1-CE2 4.38Å; F127-F131 HydrophobicContact CZ-CD2 4.35Å; F127-F131 WeakPolarHBondContact O-CB 3.09Å; F127-F131 PolarHBondContact O-N 3.37Å; F127-F131 VanDerWaalsContact O-N 3.12Å; I129-F131 VanDerWaalsContact C-N 3.3Å; I129-F131 PolarHBondContact O-N 3.01Å
132N62.6Low78Confident145 Ų145118.9 Ų118.978%0.77562%0.617SS**  trans-10816.4-177.8-142.8-31.5000112.8L128L128-N132 WeakPolarHBondContact O-CB 3.37Å; L128-N132 PolarHBondContact O-N 3.24Å
133I53.4Low77.3Confident200 Ų200123.4 Ų123.4100%1.02663%0.628SS**  trans-119.60166.6-62.8172.4000106.3

Retrieved 133 of 133 residues in 39.6 ms (Link to these results)