A0A087XHZ2_POEFO Loading...

Si:ch211-253b8.5

AlphaFold DB , UniProt , Accession A0A087XHZ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 192 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
1P41.3Very low54Low186 Ų186123.1 Ų123.1100%1.20867%0.674SS**  085.1028.4-7.5000110.7
2A51.8Low55.5Low71 Ų71121.8 Ų121.859%0.58767%0.666SS**  trans-149.2-1175.900000114
3E50.9Low57Low170 Ų170121 Ų12179%0.79466%0.657SS**SBendtrans-89.5-4.6-169.3-64.3-72.8127.300114.1
4T51.1Low58.8Low126 Ų126122.1 Ų122.177%0.77366%0.656SS**SBendtrans-97.1-10.6-170.945.80000115.1
5E53.5Low60.6Low120 Ų120117.5 Ų117.556%0.56164%0.637SS**SBendtrans-83.2-35.6178.2-167.4-169.8136.900112.2A7 Q8 R9E5-A7 PolarHBondContact O-N 3.5Å; E5-Q8 PolarHBondContact O-N 3.44Å; E5-R9 IonicContact OE1-CZ 3.95Å; E5-R9 IonicContact OE1-NH1 2.75Å; E5-R9 PolarHBondContact OE1-NH1 3.1Å
6H52.6Low62.3Low122 Ų122113.1 Ų113.157%0.56562%0.621SS**Hα-helixtrans-71.9-27.7-174.5-63.4-64.2000113.6Q8H6-Q8 VanDerWaalsContact C-N 3.34Å; H6-Q8 PolarHBondContact O-N 3.42Å
7A52.8Low64Low68 Ų68114.4 Ų114.456%0.56262%0.622SS**Hα-helixtrans-71.7-26.5179.200000113.3E5 P11E5-A7 PolarHBondContact O-N 3.5Å; A7-P11 WeakPolarHBondContact O-CD 3.42Å
8Q58.2Low65.6Low157 Ų157115.9 Ų115.973%0.73462%0.624SS**Hα-helixtrans-85.8-24.5-179.7-147.7173.622.200112.3E5 H6 P11E5-Q8 PolarHBondContact O-N 3.44Å; H6-Q8 VanDerWaalsContact C-N 3.34Å; H6-Q8 PolarHBondContact O-N 3.42Å; Q8-P11 WeakPolarHBondContact O-CD 3.42Å; Q8-P11 WeakPolarHBondContact O-CG 3.3Å
9R58.6Low67Low139 Ų139114.9 Ų114.953%0.52562%0.618SS.*Hα-helixtrans-76.5-31.4179.1-140.3-178.6-152.5118.20.6113.2E5 D12 M13E5-R9 IonicContact OE1-CZ 3.95Å; E5-R9 IonicContact OE1-NH1 2.75Å; E5-R9 PolarHBondContact OE1-NH1 3.1Å; R9-D12 PolarHBondContact O-N 3.3Å; R9-M13 VanDerWaalsContact O-CG 3.3Å; R9-M13 WeakPolarHBondContact O-CG 3.04Å; R9-M13 PolarHBondContact O-N 3.38Å
10L59.4Low68.3Low127 Ų127116.3 Ų116.367%0.66562%0.618SS**Hα-helixtrans-60.1-52.8177.3-97.8166.7000114.4D12 M13 E14L10-D12 PolarHBondContact O-N 2.75Å; L10-M13 PolarHBondContact O-N 2.99Å; L10-E14 PolarHBondContact O-N 3.47Å
11P64.2Low69.5Low68 Ų68116.4 Ų116.444%0.44262%0.618SS.*Hα-helixtrans-67.6-26179.124.5-33.1000112.7A7 Q8 S15A7-P11 WeakPolarHBondContact O-CD 3.42Å; Q8-P11 WeakPolarHBondContact O-CD 3.42Å; Q8-P11 WeakPolarHBondContact O-CG 3.3Å; P11-S15 WeakPolarHBondContact O-CB 3.28Å; P11-S15 PolarHBondContact O-N 3.43Å; P11-S15 PolarHBondContact O-OG 2.95Å
12D71.6Confident72.1Confident108 Ų108113 Ų11358%0.57858%0.581SS**Hα-helixtrans-74.3-37.3174.8-166.544.2000112.2R9 L10 S15 A16R9-D12 PolarHBondContact O-N 3.3Å; L10-D12 PolarHBondContact O-N 2.75Å; D12-S15 PolarHBondContact O-OG 3Å; D12-A16 VanDerWaalsContact O-CB 3.24Å; D12-A16 WeakPolarHBondContact O-CB 3.44Å; D12-A16 PolarHBondContact O-N 3.21Å
13M74.9Confident74.1Confident111 Ų111114.5 Ų114.555%0.54758%0.576SS.*Hα-helixtrans-68.7-36.6172-71.6-175.571.500112.4R9 L10 Q17R9-M13 VanDerWaalsContact O-CG 3.3Å; R9-M13 WeakPolarHBondContact O-CG 3.04Å; R9-M13 PolarHBondContact O-N 3.38Å; L10-M13 PolarHBondContact O-N 2.99Å; M13-Q17 WeakPolarHBondContact O-CB 3.24Å; M13-Q17 VanDerWaalsContact O-CG 3.28Å; M13-Q17 WeakPolarHBondContact O-CG 3.45Å; M13-Q17 PolarHBondContact O-N 3.47Å
14E82.1Confident76.3Confident137 Ų137114.6 Ų114.664%0.6457%0.569SS**Hα-helixtrans-66.6-45.4174.7-176.4180-151.700111.6L10 A16 Q17 Q18L10-E14 PolarHBondContact O-N 3.47Å; E14-A16 VanDerWaalsContact C-N 3.34Å; E14-A16 PolarHBondContact O-N 2.93Å; E14-Q17 PolarHBondContact O-N 2.95Å; E14-Q18 WeakPolarHBondContact O-CB 3.33Å; E14-Q18 PolarHBondContact O-N 3.36Å
15S85.8Confident78.4Confident53 Ų53114.9 Ų114.937%0.37156%0.562SS.*Hα-helixtrans-64-39.117674.40000111.7P11 D12 Q18 L19P11-S15 WeakPolarHBondContact O-CB 3.28Å; P11-S15 PolarHBondContact O-N 3.43Å; P11-S15 PolarHBondContact O-OG 2.95Å; D12-S15 PolarHBondContact O-OG 3Å; S15-Q18 PolarHBondContact O-N 2.93Å; S15-L19 WeakPolarHBondContact O-CB 3.28Å; S15-L19 PolarHBondContact O-N 3.5Å
16A88.2Confident80.5Confident47 Ų47115.3 Ų115.339%0.38856%0.558SS.*Hα-helixtrans-63.7-41.2173.200000111.8D12 E14 L19 K20D12-A16 VanDerWaalsContact O-CB 3.24Å; D12-A16 WeakPolarHBondContact O-CB 3.44Å; D12-A16 PolarHBondContact O-N 3.21Å; E14-A16 VanDerWaalsContact C-N 3.34Å; E14-A16 PolarHBondContact O-N 2.93Å; A16-L19 PolarHBondContact O-N 3.21Å; A16-K20 WeakPolarHBondContact O-CG 3.48Å; A16-K20 PolarHBondContact O-N 2.95Å
17Q91.6Very high82.7Confident135 Ų135115.5 Ų115.563%0.63156%0.558SS**Hα-helixtrans-65.4-41.7174.5-77.2179.41.300112.1M13 E14 L19 K20 L21M13-Q17 WeakPolarHBondContact O-CB 3.24Å; M13-Q17 VanDerWaalsContact O-CG 3.28Å; M13-Q17 WeakPolarHBondContact O-CG 3.45Å; M13-Q17 PolarHBondContact O-N 3.47Å; E14-Q17 PolarHBondContact O-N 2.95Å; Q17-L19 VanDerWaalsContact C-N 3.34Å; Q17-L19 PolarHBondContact O-N 3.27Å; Q17-K20 PolarHBondContact O-N 3.32Å; Q17-L21 PolarHBondContact O-N 2.94Å
18Q92Very high84.8Confident142 Ų142119.1 Ų119.166%0.66456%0.561SS**Hα-helixtrans-61.5-43.5175.4-169.9-163.85.400111.1E14 S15 K20 L21 R22E14-Q18 WeakPolarHBondContact O-CB 3.33Å; E14-Q18 PolarHBondContact O-N 3.36Å; S15-Q18 PolarHBondContact O-N 2.93Å; Q18-K20 VanDerWaalsContact C-N 3.35Å; Q18-K20 PolarHBondContact O-N 3.19Å; Q18-L21 PolarHBondContact O-N 3.38Å; Q18-R22 WeakPolarHBondContact O-CB 3.34Å; Q18-R22 PolarHBondContact O-N 3.3Å
19L92.4Very high86.6Confident96 Ų96118 Ų11850%0.50356%0.556SS.*Hα-helixtrans-60.1-45.1175.4-175.966000110.9S15 A16 Q17 L21 R22 E23S15-L19 WeakPolarHBondContact O-CB 3.28Å; S15-L19 PolarHBondContact O-N 3.5Å; A16-L19 PolarHBondContact O-N 3.21Å; Q17-L19 VanDerWaalsContact C-N 3.34Å; Q17-L19 PolarHBondContact O-N 3.27Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L19-L21 PolarHBondContact O-N 2.84Å; L19-R22 PolarHBondContact O-N 3.34Å; L19-E23 WeakPolarHBondContact O-CB 3.49Å; L19-E23 WeakPolarHBondContact O-CG 3.26Å; L19-E23 PolarHBondContact O-N 3.34Å
20K93.5Very high88.4Confident143 Ų143117.5 Ų117.562%0.62256%0.559SS**Hα-helixtrans-62.7-38.1176-70.4-171.588.6164.70112.8A16 Q17 Q18 R24A16-K20 WeakPolarHBondContact O-CG 3.48Å; A16-K20 PolarHBondContact O-N 2.95Å; Q17-K20 PolarHBondContact O-N 3.32Å; Q18-K20 VanDerWaalsContact C-N 3.35Å; Q18-K20 PolarHBondContact O-N 3.19Å; K20-R24 WeakPolarHBondContact O-CB 3.49Å; K20-R24 VanDerWaalsContact O-CG 3.26Å; K20-R24 WeakPolarHBondContact O-CG 3.39Å; K20-R24 PolarHBondContact O-N 3.25Å
21L93.6Very high90.2Very high119 Ų119114.3 Ų114.362%0.62355%0.545SS*.Hα-helixtrans-65.8-42.4175.5-176.163.9000111Q17 Q18 L19 R24 Q25Q17-L21 PolarHBondContact O-N 2.94Å; Q18-L21 PolarHBondContact O-N 3.38Å; L19-L21 VanDerWaalsContact C-N 3.34Å; L19-L21 PolarHBondContact O-N 2.84Å; L21-R24 PolarHBondContact O-N 3Å; L21-Q25 PolarHBondContact O-N 3.47Å
22R94.8Very high91.7Very high115 Ų115117.3 Ų117.343%0.43455%0.551SS.*Hα-helixtrans-66.8-36177.9-176.9-86.5116.1145.79.3112.4Q18 L19 R26Q18-R22 WeakPolarHBondContact O-CB 3.34Å; Q18-R22 PolarHBondContact O-N 3.3Å; L19-R22 PolarHBondContact O-N 3.34Å; R22-R26 PolarHBondContact O-N 3.21Å
23E95.6Very high92.9Very high101 Ų101116.8 Ų116.847%0.47255%0.545SS..Hα-helixtrans-68.4-42.6171.7-76.3179.5169.800111.9L19 Q25 R26 F27L19-E23 WeakPolarHBondContact O-CB 3.49Å; L19-E23 WeakPolarHBondContact O-CG 3.26Å; L19-E23 PolarHBondContact O-N 3.34Å; E23-Q25 VanDerWaalsContact C-N 3.3Å; E23-Q25 PolarHBondContact O-N 2.95Å; E23-R26 WeakPolarHBondContact O-CB 3.4Å; E23-R26 PolarHBondContact O-N 3.48Å; E23-R26 VanDerWaalsContact O-N 3.16Å; E23-F27 PolarHBondContact O-N 3.43Å
24R95.9Very high94Very high172 Ų172117.4 Ų117.465%0.64955%0.546SS*.Hα-helixtrans-59.5-43.2173.5-74.3172.383.6115.62.1111.2K20 L21 R26 F27 F28K20-R24 WeakPolarHBondContact O-CB 3.49Å; K20-R24 VanDerWaalsContact O-CG 3.26Å; K20-R24 WeakPolarHBondContact O-CG 3.39Å; K20-R24 PolarHBondContact O-N 3.25Å; L21-R24 PolarHBondContact O-N 3Å; R24-R26 VanDerWaalsContact C-N 3.35Å; R24-R26 PolarHBondContact O-N 3.43Å; R24-F27 PolarHBondContact O-N 2.9Å; R24-F28 WeakPolarHBondContact O-CD2 3.06Å; R24-F28 PolarHBondContact O-N 3.12Å
25Q96.4Very high94.7Very high133 Ų133116.8 Ų116.862%0.62154%0.544SS*.Hα-helixtrans-60.2-44.4174.7-174.5178.5-1.100111.8L21 E23 F27 F28 E29L21-Q25 PolarHBondContact O-N 3.47Å; E23-Q25 VanDerWaalsContact C-N 3.3Å; E23-Q25 PolarHBondContact O-N 2.95Å; Q25-F27 VanDerWaalsContact C-N 3.3Å; Q25-F27 PolarHBondContact O-N 2.92Å; Q25-F28 PolarHBondContact O-N 3.15Å; Q25-E29 PolarHBondContact O-N 2.82Å
26R97.3Very high95.2Very high129 Ų129116.4 Ų116.449%0.48754%0.539SS..Hα-helixtrans-57.5-43.5176.2-169.7-152.3-71.9-122.87111.6R22 E23 R24 F28 E29 E30R22-R26 PolarHBondContact O-N 3.21Å; E23-R26 WeakPolarHBondContact O-CB 3.4Å; E23-R26 PolarHBondContact O-N 3.48Å; E23-R26 VanDerWaalsContact O-N 3.16Å; R24-R26 VanDerWaalsContact C-N 3.35Å; R24-R26 PolarHBondContact O-N 3.43Å; R26-F28 VanDerWaalsContact C-N 3.34Å; R26-F28 PolarHBondContact O-N 3.23Å; R26-E29 PolarHBondContact O-N 2.89Å; R26-E30 WeakPolarHBondContact O-CB 3.05Å; R26-E30 PolarHBondContact O-N 2.73Å
27F97.3Very high95.5Very high126 Ų126117.8 Ų117.855%0.55354%0.54SS*.Hα-helixtrans-60.4-43.7-178.9-178.8-94000112E23 R24 Q25 E29 E30 V31E23-F27 PolarHBondContact O-N 3.43Å; R24-F27 PolarHBondContact O-N 2.9Å; Q25-F27 VanDerWaalsContact C-N 3.3Å; Q25-F27 PolarHBondContact O-N 2.92Å; F27-E29 VanDerWaalsContact C-N 3.34Å; F27-E29 PolarHBondContact O-N 3.24Å; F27-E30 PolarHBondContact O-N 2.86Å; F27-V31 HydrophobicContact CD1-CG2 4.09Å; F27-V31 HydrophobicContact CE1-CG2 3.65Å; F27-V31 HydrophobicContact CE2-CG2 4.29Å; F27-V31 HydrophobicContact CZ-CG2 3.76Å; F27-V31 WeakPolarHBondContact O-CG2 3.28Å; F27-V31 PolarHBondContact O-N 2.97Å
28F96.7Very high95.7Very high143 Ų143115.1 Ų115.163%0.62753%0.532SS*.Hα-helixtrans-64.1-39.3177.6-72.8-68.7000112.7R24 Q25 R26 F32R24-F28 WeakPolarHBondContact O-CD2 3.06Å; R24-F28 PolarHBondContact O-N 3.12Å; Q25-F28 PolarHBondContact O-N 3.15Å; R26-F28 VanDerWaalsContact C-N 3.34Å; R26-F28 PolarHBondContact O-N 3.23Å; F28-F32 WeakPolarHBondContact O-CB 3.35Å; F28-F32 PolarHBondContact O-N 3.39Å; F28-F32 VanDerWaalsContact O-N 3.08Å
29E96.1Very high95.7Very high135 Ų135116.6 Ų116.663%0.63153%0.533SS*.Hα-helixtrans-65.7-40.4176.3-174.6161.4-146.900111.8Q25 R26 F27 F32 Q33Q25-E29 PolarHBondContact O-N 2.82Å; R26-E29 PolarHBondContact O-N 2.89Å; F27-E29 VanDerWaalsContact C-N 3.34Å; F27-E29 PolarHBondContact O-N 3.24Å; E29-F32 PolarHBondContact O-N 3.29Å; E29-Q33 WeakPolarHBondContact O-CB 3.34Å; E29-Q33 PolarHBondContact O-N 2.91Å
30E96.9Very high95.7Very high128 Ų128117.1 Ų117.160%0.59854%0.536SS*.Hα-helixtrans-64.8-44.6176.9-173.3177146.900112.5R26 F27 Q33 H34R26-E30 WeakPolarHBondContact O-CB 3.05Å; R26-E30 PolarHBondContact O-N 2.73Å; F27-E30 PolarHBondContact O-N 2.86Å; E30-Q33 PolarHBondContact O-N 2.98Å; E30-H34 PolarHBondContact O-N 3.49Å
31V96.6Very high95.6Very high60 Ų60114.1 Ų114.136%0.36453%0.533SS..Hα-helixtrans-61.6-45.9176.5171.10000110.8F27 Q33 H34 E35F27-V31 HydrophobicContact CD1-CG2 4.09Å; F27-V31 HydrophobicContact CE1-CG2 3.65Å; F27-V31 HydrophobicContact CE2-CG2 4.29Å; F27-V31 HydrophobicContact CZ-CG2 3.76Å; F27-V31 WeakPolarHBondContact O-CG2 3.28Å; F27-V31 PolarHBondContact O-N 2.97Å; V31-Q33 PolarHBondContact O-N 3.18Å; V31-H34 PolarHBondContact O-N 3.16Å; V31-E35 PolarHBondContact O-N 2.96Å
32F96.4Very high95.3Very high130 Ų130110.9 Ų110.957%0.5752%0.521SS*.Hα-helixtrans-63.6-42.8178.5-177.9-100.9000111.8F28 E29 H34 E35 V36F28-F32 WeakPolarHBondContact O-CB 3.35Å; F28-F32 PolarHBondContact O-N 3.39Å; F28-F32 VanDerWaalsContact O-N 3.08Å; E29-F32 PolarHBondContact O-N 3.29Å; F32-H34 VanDerWaalsContact C-N 3.3Å; F32-H34 PolarHBondContact O-N 3.42Å; F32-E35 PolarHBondContact O-N 3.4Å; F32-V36 HydrophobicContact CD1-CG2 4.06Å; F32-V36 HydrophobicContact CE1-CG2 3.58Å; F32-V36 HydrophobicContact CE2-CG2 4.23Å; F32-V36 HydrophobicContact CZ-CG2 3.68Å; F32-V36 WeakPolarHBondContact O-CG2 3.38Å; F32-V36 PolarHBondContact O-N 3.49Å
33Q97.4Very high94.7Very high97 Ų97108.1 Ų108.145%0.45352%0.522SS..Hα-helixtrans-59.3-43.3176.5-170.86265.200111.3E29 E30 V31 E35 V36 D37E29-Q33 WeakPolarHBondContact O-CB 3.34Å; E29-Q33 PolarHBondContact O-N 2.91Å; E30-Q33 PolarHBondContact O-N 2.98Å; V31-Q33 PolarHBondContact O-N 3.18Å; Q33-E35 PolarHBondContact O-N 3.44Å; Q33-V36 PolarHBondContact O-N 3.03Å; Q33-D37 PolarHBondContact NE2-OD1 2.59Å; Q33-D37 WeakPolarHBondContact O-CB 3.44Å; Q33-D37 PolarHBondContact O-N 3.16Å
34H97.9Very high93.8Very high124 Ų124111.3 Ų111.357%0.57454%0.537SS*.Hα-helixtrans-60.9-44176.1-176.6-79.5000112.3E30 V31 F32 V36 D37 V38E30-H34 PolarHBondContact O-N 3.49Å; V31-H34 PolarHBondContact O-N 3.16Å; F32-H34 VanDerWaalsContact C-N 3.3Å; F32-H34 PolarHBondContact O-N 3.42Å; H34-V36 VanDerWaalsContact C-N 3.35Å; H34-V36 PolarHBondContact O-N 3.04Å; H34-D37 PolarHBondContact O-N 3.45Å; H34-V38 WeakPolarHBondContact O-CB 3.14Å; H34-V38 VanDerWaalsContact O-CG2 3.26Å; H34-V38 WeakPolarHBondContact O-CG2 3.33Å; H34-V38 PolarHBondContact O-N 3.49Å
35E95.6Very high92.9Very high124 Ų124109 Ų10958%0.57954%0.537SS*.Hα-helixtrans-60.9-43.9176.3-73-173.5169.500112.2V31 F32 Q33 V38 Y39V31-E35 PolarHBondContact O-N 2.96Å; F32-E35 PolarHBondContact O-N 3.4Å; Q33-E35 PolarHBondContact O-N 3.44Å; E35-V38 PolarHBondContact O-N 3.31Å; E35-Y39 WeakPolarHBondContact O-CB 3.37Å; E35-Y39 PolarHBondContact O-N 3.29Å
36V96.1Very high91.8Very high45 Ų45106.9 Ų106.927%0.27354%0.535SS..Hα-helixtrans-62.3-45.5176.4171.40000111F32 Q33 H34 V38 Y39 L40F32-V36 HydrophobicContact CD1-CG2 4.06Å; F32-V36 HydrophobicContact CE1-CG2 3.58Å; F32-V36 HydrophobicContact CE2-CG2 4.23Å; F32-V36 HydrophobicContact CZ-CG2 3.68Å; F32-V36 WeakPolarHBondContact O-CG2 3.38Å; F32-V36 PolarHBondContact O-N 3.49Å; Q33-V36 PolarHBondContact O-N 3.03Å; H34-V36 VanDerWaalsContact C-N 3.35Å; H34-V36 PolarHBondContact O-N 3.04Å; V36-V38 VanDerWaalsContact C-N 3.35Å; V36-V38 PolarHBondContact O-N 3.1Å; V36-Y39 PolarHBondContact O-N 3.14Å; V36-L40 HydrophobicContact CG1-CD1 3.77Å; V36-L40 HydrophobicContact CG1-CG 4.36Å; V36-L40 WeakPolarHBondContact O-CB 3.47Å; V36-L40 WeakPolarHBondContact O-CG 3.05Å; V36-L40 PolarHBondContact O-N 3.33Å
37D95.6Very high90.3Very high77 Ų77107.3 Ų107.341%0.41255%0.546SS..Hα-helixtrans-64.3-40.4-179-68.6-12.5000111.3Q33 H34 S41Q33-D37 PolarHBondContact NE2-OD1 2.59Å; Q33-D37 WeakPolarHBondContact O-CB 3.44Å; Q33-D37 PolarHBondContact O-N 3.16Å; H34-D37 PolarHBondContact O-N 3.45Å; D37-S41 WeakPolarHBondContact O-CB 3.47Å; D37-S41 PolarHBondContact O-N 3.47Å; D37-S41 PolarHBondContact O-OG 3.25Å
38V94.7Very high88.7Confident78 Ų78109.5 Ų109.547%0.47355%0.55SS.*Hα-helixtrans-65.3-44174.5170.90000111.4H34 E35 V36 S41 S42H34-V38 WeakPolarHBondContact O-CB 3.14Å; H34-V38 VanDerWaalsContact O-CG2 3.26Å; H34-V38 WeakPolarHBondContact O-CG2 3.33Å; H34-V38 PolarHBondContact O-N 3.49Å; E35-V38 PolarHBondContact O-N 3.31Å; V36-V38 VanDerWaalsContact C-N 3.35Å; V36-V38 PolarHBondContact O-N 3.1Å; V38-S41 PolarHBondContact O-N 3.43Å; V38-S42 WeakPolarHBondContact O-CB 3.26Å; V38-S42 PolarHBondContact O-N 3.08Å; V38-S42 PolarHBondContact O-OG 3.08Å
39Y92.5Very high86.8Confident173 Ų173107.2 Ų107.268%0.67855%0.545SS*.Hα-helixtrans-62.9-46.3178.4177.6-99.6000112E35 V36 S42 A43E35-Y39 WeakPolarHBondContact O-CB 3.37Å; E35-Y39 PolarHBondContact O-N 3.29Å; V36-Y39 PolarHBondContact O-N 3.14Å; Y39-S42 PolarHBondContact O-N 2.94Å; Y39-S42 PolarHBondContact O-OG 3.05Å; Y39-A43 PolarHBondContact O-N 2.98Å
40L92.6Very high84.8Confident107 Ų107109.5 Ų109.556%0.5655%0.549SS*.Hα-helixtrans-66.3-41.1176.9-70.8171.5000111.7V36 S42 A43V36-L40 HydrophobicContact CG1-CD1 3.77Å; V36-L40 HydrophobicContact CG1-CG 4.36Å; V36-L40 WeakPolarHBondContact O-CB 3.47Å; V36-L40 WeakPolarHBondContact O-CG 3.05Å; V36-L40 PolarHBondContact O-N 3.33Å; L40-S42 VanDerWaalsContact C-N 3.25Å; L40-S42 PolarHBondContact O-N 3.45Å; L40-A43 WeakPolarHBondContact O-CB 3.43Å; L40-A43 PolarHBondContact O-N 3.29Å; L40-A43 VanDerWaalsContact O-N 3.13Å
41S91.4Very high82.9Confident80 Ų80113.8 Ų113.856%0.55956%0.56SS**Hα-helixtrans-62.5-33.8176.9-63.80000111.9D37 V38 A43 H44D37-S41 WeakPolarHBondContact O-CB 3.47Å; D37-S41 PolarHBondContact O-N 3.47Å; D37-S41 PolarHBondContact O-OG 3.25Å; V38-S41 PolarHBondContact O-N 3.43Å; S41-A43 VanDerWaalsContact C-N 3.34Å; S41-H44 PolarHBondContact O-CE1 2.98Å; S41-H44 PolarHBondContact O-ND1 3.36Å
42S87.8Confident81.1Confident52 Ų52118.9 Ų118.936%0.36457%0.572SS.*G310 helixtrans-85.2-1.2177.556.10000114.2V38 Y39 L40 H44 L45 C46V38-S42 WeakPolarHBondContact O-CB 3.26Å; V38-S42 PolarHBondContact O-N 3.08Å; V38-S42 PolarHBondContact O-OG 3.08Å; Y39-S42 PolarHBondContact O-N 2.94Å; Y39-S42 PolarHBondContact O-OG 3.05Å; L40-S42 VanDerWaalsContact C-N 3.25Å; L40-S42 PolarHBondContact O-N 3.45Å; S42-H44 PolarHBondContact O-N 3.5Å; S42-H44 VanDerWaalsContact O-N 3.14Å; S42-L45 WeakPolarHBondContact O-CB 3.47Å; S42-L45 PolarHBondContact O-N 2.95Å; S42-C46 PolarHBondContact O-N 3.25Å
43A81Confident79.3Confident57 Ų57117.5 Ų117.547%0.47158%0.577SS.*G310 helixtrans-59-30.6-178.100000113.5Y39 L40 S41 L45 C46Y39-A43 PolarHBondContact O-N 2.98Å; L40-A43 WeakPolarHBondContact O-CB 3.43Å; L40-A43 PolarHBondContact O-N 3.29Å; L40-A43 VanDerWaalsContact O-N 3.13Å; S41-A43 VanDerWaalsContact C-N 3.34Å; A43-L45 VanDerWaalsContact C-N 3.29Å; A43-L45 PolarHBondContact O-N 2.92Å; A43-C46 VanDerWaalsContact O-CB 3.23Å; A43-C46 WeakPolarHBondContact O-CB 3.37Å; A43-C46 PolarHBondContact O-N 3.36Å
44H78Confident77.4Confident168 Ų168119 Ų11978%0.77860%0.595SS**G310 helixtrans-71.9-21.9177.368.2-86.4000113.6S41 S42 C46S41-H44 PolarHBondContact O-CE1 2.98Å; S41-H44 PolarHBondContact O-ND1 3.36Å; S42-H44 PolarHBondContact O-N 3.5Å; S42-H44 VanDerWaalsContact O-N 3.14Å; H44-C46 VanDerWaalsContact C-N 3.33Å
45L77.7Confident75.5Confident124 Ų124119.7 Ų119.765%0.64960%0.601SS**G310 helixtrans-86-8.8175-171.858.2000111.8S42 A43 I47S42-L45 WeakPolarHBondContact O-CB 3.47Å; S42-L45 PolarHBondContact O-N 2.95Å; A43-L45 VanDerWaalsContact C-N 3.29Å; A43-L45 PolarHBondContact O-N 2.92Å; L45-I47 WeakPolarHBondContact O-CG1 3.41Å; L45-I47 PolarHBondContact O-N 3.43Å
46C72.7Confident73.8Confident87 Ų87117.6 Ų117.659%0.58861%0.613SS**  trans-63.8100.4173.1-169.60000109S42 A43 H44 R48S42-C46 PolarHBondContact O-N 3.25Å; A43-C46 VanDerWaalsContact O-CB 3.23Å; A43-C46 WeakPolarHBondContact O-CB 3.37Å; A43-C46 PolarHBondContact O-N 3.36Å; H44-C46 VanDerWaalsContact C-N 3.33Å; C46-R48 PolarHBondContact O-N 3.44Å
47I66.2Low71.4Confident138 Ų138120.4 Ų120.471%0.70864%0.635SS**  trans-72.962.8173.4-48.9172.8000107.6L45 D49L45-I47 WeakPolarHBondContact O-CG1 3.41Å; L45-I47 PolarHBondContact O-N 3.43Å; I47-D49 PolarHBondContact O-N 2.98Å
48R63.9Low69.8Low172 Ų172124.9 Ų124.965%0.64966%0.657SS**  trans-73.5-19.4175.1-149.5-177.4-170-170.92.9111.4C46C46-R48 PolarHBondContact O-N 3.44Å
49D56.5Low67.7Low95 Ų95126.4 Ų126.451%0.50867%0.671SS.*  trans-116.480.3-177-54.7-40000111.1I47 R51 R52I47-D49 PolarHBondContact O-N 2.98Å; D49-R51 PolarHBondContact O-N 3.12Å; D49-R52 PolarHBondContact O-N 2.95Å; D49-R52 VanDerWaalsContact O-N 3.15Å
50Y54.4Low66.2Low184 Ų184123.7 Ų123.772%0.72268%0.677SS**THydrogen-bonded Turntrans-63.36.3156.242.7-93.5000112.6
51R55.9Low64.7Low218 Ų218126.4 Ų126.482%0.82369%0.689SS**THydrogen-bonded Turntrans-113.216.5174-85.5-73.1-174.6159.7-0.4113.1D49 P53D49-R51 PolarHBondContact O-N 3.12Å; R51-P53 WeakPolarHBondContact O-CD 3.38Å
52R58Low63.6Low167 Ų167130.8 Ų130.863%0.6370%0.7SS**  trans-70.7122.3164.8-169.5-178.7-108.3103.8-2.1108.1D49D49-R52 PolarHBondContact O-N 2.95Å; D49-R52 VanDerWaalsContact O-N 3.15Å
53P58.9Low62.6Low101 Ų101133.3 Ų133.366%0.65671%0.714SS**  trans-57.3144.8169.5-17.329.4000109.1R51 I55R51-P53 WeakPolarHBondContact O-CD 3.38Å; P53-I55 PolarHBondContact O-N 3.34Å
54P57.3Low62Low128 Ų128135.3 Ų135.383%0.83172%0.717SS**  trans-49.8115.3-178.2-26.133.4000110.5G56P54-G56 PolarHBondContact O-N 3.48Å; P54-G56 VanDerWaalsContact O-N 3.08Å
55I58Low61.2Low138 Ų138132.2 Ų132.271%0.70871%0.709SS**  trans-55.7115.8171.27.4171.9000106.1P53 S57P53-I55 PolarHBondContact O-N 3.34Å; I55-S57 PolarHBondContact O-N 2.95Å
56G60.3Low60.5Low81 Ų81132.1 Ų132.184%0.83571%0.709SS**SBendtrans-68.966.4-179.200000112P54P54-G56 PolarHBondContact O-N 3.48Å; P54-G56 VanDerWaalsContact O-N 3.08Å
57S46.9Very low60Low104 Ų104133.8 Ų133.873%0.72771%0.712SS**  trans-147.398.5175.6-64.20000107.9I55 S59I55-S57 PolarHBondContact O-N 2.95Å; S57-S59 PolarHBondContact O-N 3.46Å; S57-S59 VanDerWaalsContact O-N 3.14Å
58I60.3Low60Low171 Ų171132.2 Ų132.288%0.87770%0.704SS**  trans-56.7107.4172.644157.8000110.7
59S51.5Low60Low109 Ų109131.3 Ų131.376%0.76271%0.712SS**  trans-109.1113.7155.1-177.50000106.6S57 M61S57-S59 PolarHBondContact O-N 3.46Å; S57-S59 VanDerWaalsContact O-N 3.14Å; S59-M61 PolarHBondContact O-N 3.29Å
60S60.6Low60.2Low117 Ų117133.8 Ų133.882%0.81872%0.721SS**SBendtrans-7553.9-166.8-510000114.5
61M61.9Low60.8Low164 Ų164132.3 Ų132.381%0.80872%0.722SS**  trans-139.554.1168.2-160.214761.700110.2S59 V63S59-M61 PolarHBondContact O-N 3.29Å; M61-V63 PolarHBondContact O-N 2.99Å
62E67.5Low61.3Low171 Ų171130.3 Ų130.380%0.79972%0.722SS**  trans-73.8112.8163.262.5-169.2133.600108.6
63V67Low61.7Low106 Ų106130 Ų13064%0.64273%0.732SS**  trans-88.9119.4169.7177.40000106.7M61 V65 L68M61-V63 PolarHBondContact O-N 2.99Å; V63-V65 PolarHBondContact O-N 3.47Å; V63-L68 HydrophobicContact CG1-CD1 4.23Å
64N68.2Low62Low99 Ų99132 Ų13253%0.52974%0.736SS.*  trans-65.4102.1178.2-63.6-44.1000109.6D66 L67N64-D66 PolarHBondContact O-N 3.23Å; N64-L67 HydrophobicContact CB-CB 4.33Å; N64-L67 PolarHBondContact O-N 2.87Å; N64-L67 VanDerWaalsContact O-N 3.11Å
65V60.9Low62.2Low103 Ų103131.2 Ų131.262%0.62473%0.725SS**Hα-helixtrans-58.2-26.7171.9-79.60000112.3V63 L67 L68 D69V63-V65 PolarHBondContact O-N 3.47Å; V65-L67 PolarHBondContact O-N 3.41Å; V65-L68 WeakPolarHBondContact O-CB 3.41Å; V65-L68 PolarHBondContact O-N 3.31Å; V65-D69 PolarHBondContact O-N 3.33Å
66D63.4Low62.4Low121 Ų121132.3 Ų132.365%0.64773%0.731SS**Hα-helixtrans-68.5-18.7177.1-53.5-35.7000113.6N64 Q70N64-D66 PolarHBondContact O-N 3.23Å; D66-Q70 PolarHBondContact O-NE2 3.43Å
67L62.8Low62.4Low123 Ų123132.6 Ų132.664%0.64472%0.72SS**Hα-helixtrans-89.7-24.2174.4-175.559.7000112N64 V65 Q70N64-L67 HydrophobicContact CB-CB 4.33Å; N64-L67 PolarHBondContact O-N 2.87Å; N64-L67 VanDerWaalsContact O-N 3.11Å; V65-L67 PolarHBondContact O-N 3.41Å; L67-Q70 PolarHBondContact O-N 3.43Å
68L65.9Low62.8Low105 Ų105133.8 Ų133.855%0.5572%0.718SS.*Hα-helixtrans-70.6-34.2172.5-76.6158.7000111.3V63 V65 Q70 M71V63-L68 HydrophobicContact CG1-CD1 4.23Å; V65-L68 WeakPolarHBondContact O-CB 3.41Å; V65-L68 PolarHBondContact O-N 3.31Å; L68-Q70 PolarHBondContact O-N 3.3Å; L68-M71 WeakPolarHBondContact O-CB 3.14Å; L68-M71 PolarHBondContact O-N 2.93Å
69D63.6Low62.8Low152 Ų152131.3 Ų131.381%0.81371%0.714SS**THydrogen-bonded Turntrans-71.4-9.8177.9-154.339.2000113.5V65V65-D69 PolarHBondContact O-N 3.33Å
70Q60.8Low63Low147 Ų147132 Ų13269%0.68771%0.709SS**THydrogen-bonded Turntrans-1003.1175.2-72.2172.787.200113.2D66 L67 L68 E72D66-Q70 PolarHBondContact O-NE2 3.43Å; L67-Q70 PolarHBondContact O-N 3.43Å; L68-Q70 PolarHBondContact O-N 3.3Å; Q70-E72 VanDerWaalsContact C-N 3.34Å; Q70-E72 PolarHBondContact O-N 3Å
71M67.4Low62.9Low153 Ų153130.6 Ų130.675%0.75470%0.697SS**SBendtrans-72.693.6173.2-168.4170.266.300109.1L68 L73L68-M71 WeakPolarHBondContact O-CB 3.14Å; L68-M71 PolarHBondContact O-N 2.93Å; M71-L73 PolarHBondContact O-N 2.82Å
72E66.5Low62.6Low176 Ų176129.4 Ų129.482%0.82270%0.698SS**  trans-32.7126.1172.1-173172.3-167.300112.5Q70 I74Q70-E72 VanDerWaalsContact C-N 3.34Å; Q70-E72 PolarHBondContact O-N 3Å; E72-I74 PolarHBondContact O-N 3.42Å; E72-I74 VanDerWaalsContact O-N 3.12Å
73L65.6Low62.2Low162 Ų162126 Ų12685%0.84869%0.686SS**  trans-53.7117.5169.7-114.170000107.7M71 D75M71-L73 PolarHBondContact O-N 2.82Å; L73-D75 PolarHBondContact O-N 2.88Å
74I65.5Low61.8Low143 Ų143125.8 Ų125.873%0.73369%0.685SS**  trans-54.4114.9165.9-62.2172.8000106.4E72 L76E72-I74 PolarHBondContact O-N 3.42Å; E72-I74 VanDerWaalsContact O-N 3.12Å; I74-L76 HydrophobicContact CG2-CD2 4.1Å; I74-L76 PolarHBondContact O-N 2.89Å
75D62.6Low61.2Low111 Ų111130.3 Ų130.359%0.59470%0.7SS**  trans-68.996177-170.64.2000108.4L73 S77L73-D75 PolarHBondContact O-N 2.88Å; D75-S77 PolarHBondContact O-N 3.33Å; D75-S77 VanDerWaalsContact O-N 3.14Å; D75-S77 WeakPolarHBondContact OD1-CB 3.38Å; D75-S77 PolarHBondContact OD1-N 3.24Å; D75-S77 VanDerWaalsContact OD1-N 3.08Å; D75-S77 PolarHBondContact OD1-OG 3.27Å; D75-S77 PolarHBondContact OD2-OG 2.95Å; D75-S77 VanDerWaalsContact OD2-OG 3.1Å
76L60.5Low61.1Low161 Ų161134.1 Ų134.184%0.84371%0.708SS**THydrogen-bonded Turntrans-72.76.9175.7-61.6175.1000112.2I74I74-L76 HydrophobicContact CG2-CD2 4.1Å; I74-L76 PolarHBondContact O-N 2.89Å
77S60.7Low60.7Low86 Ų86132.6 Ų132.660%0.60171%0.707SS**THydrogen-bonded Turntrans-87.31.7178.980.10000114.8D75 P79D75-S77 PolarHBondContact O-N 3.33Å; D75-S77 VanDerWaalsContact O-N 3.14Å; D75-S77 WeakPolarHBondContact OD1-CB 3.38Å; D75-S77 PolarHBondContact OD1-N 3.24Å; D75-S77 VanDerWaalsContact OD1-N 3.08Å; D75-S77 PolarHBondContact OD1-OG 3.27Å; D75-S77 PolarHBondContact OD2-OG 2.95Å; D75-S77 VanDerWaalsContact OD2-OG 3.1Å; S77-P79 WeakPolarHBondContact O-CD 3.47Å
78D56.4Low60.2Low129 Ų129131.8 Ų131.869%0.6971%0.712SS**  trans-96.197.8170.6-164.621.5000111.2D80D78-D80 PolarHBondContact O-N 3.47Å; D78-D80 VanDerWaalsContact O-N 3.12Å
79P59.3Low59.7Low120 Ų120133.8 Ų133.878%0.77973%0.728SS**  trans-81.383.6175.934.2-36.2000110.6S77S77-P79 WeakPolarHBondContact O-CD 3.47Å
80D56.1Low59Low123 Ų123129.7 Ų129.766%0.65872%0.722SS**  trans-111.2150.8164-141.618.7000109.9D78 V82D78-D80 PolarHBondContact O-N 3.47Å; D78-D80 VanDerWaalsContact O-N 3.12Å; D80-V82 PolarHBondContact O-N 2.68Å; D80-V82 VanDerWaalsContact O-N 3.15Å
81P59Low58.4Low88 Ų88131.3 Ų131.357%0.57173%0.729SS**  -105.269.9-115.829.4-9000110.1D83 V84P81-D83 PolarHBondContact O-N 2.87Å; P81-V84 HydrophobicContact CB-CG2 4.39Å
82V55.4Low57.7Low138 Ų138132.8 Ų132.884%0.83673%0.734SS**SBendtrans-71.7-2.1170.1-62.80000112.9D80D80-V82 PolarHBondContact O-N 2.68Å; D80-V82 VanDerWaalsContact O-N 3.15Å
83D58Low56.6Low101 Ų101128.5 Ų128.554%0.5473%0.729SS.*THydrogen-bonded Turntrans-98.541.4176-163.718.2000113.6P81P81-D83 PolarHBondContact O-N 2.87Å
84V58.1Low56Low101 Ų101126.9 Ų126.961%0.61273%0.726SS**THydrogen-bonded Turntrans-95.4-20.8164.5-178.70000111.1P81P81-V84 HydrophobicContact CB-CG2 4.39Å
85F56.7Low54.9Low194 Ų194128 Ų12885%0.85173%0.732SS**SBendtrans-83.4-21.2-177-94.5-88.5000114.8
86F57.9Low54Low183 Ų183128.8 Ų128.880%0.80375%0.747SS**SBendtrans-95.8-10.2179.2-72.8-79.9000114.3
87S55.1Low52.9Low88 Ų88126 Ų12662%0.61574%0.741SS**  trans-91.81178.9-69.70000114.7V89S87-V89 PolarHBondContact O-N 3.31Å
88S53.8Low52.3Low107 Ų107127.8 Ų127.875%0.74875%0.75SS**  trans-79.978.8167.4-84.50000110.6G90S88-G90 PolarHBondContact O-N 3.21Å
89V54.8Low51.6Low147 Ų147129.2 Ų129.289%0.89176%0.757SS**  trans-53.6128.7156.292.70000108.3S87S87-V89 PolarHBondContact O-N 3.31Å
90G47.8Very low51Low66 Ų66129.2 Ų129.268%0.6876%0.757SS**  trans-164.679-179.300000111.1S88S88-G90 PolarHBondContact O-N 3.21Å
91E49.9Very low50.4Low181 Ų181128.5 Ų128.585%0.84677%0.768SS**  trans68.1109.2142.7-177.3-164.4178.500118.8
92E51.7Low49.4Very low183 Ų183127.8 Ų127.886%0.85578%0.776SS**  trans36.292.9137.4-67.8-73.9161.300118.1
93A44.3Very low49.1Very low86 Ų86130 Ų13071%0.71178%0.777SS**  trans-177.5111132.500000111.8
94V51.4Low48.4Very low129 Ų129128.8 Ų128.878%0.78278%0.777SS**  trans37.598.5130.9-169.10000115.9
95L44Very low48.1Very low166 Ų166129.1 Ų129.187%0.86978%0.783SS**  -161.592129.1-79.3-162.4000109.2S97L95-S97 PolarHBondContact O-N 3.47Å
96S43.6Very low48Very low128 Ų128125 Ų12590%0.89577%0.77SS**  trans-61.5117.4163.9-48.90000109.7
97S37.4Very low47.8Very low103 Ų103121.9 Ų121.972%0.7276%0.758SS**  trans-135.6113.2157.8-175.20000108.9L95 L99L95-S97 PolarHBondContact O-N 3.47Å; S97-L99 PolarHBondContact O-N 3.25Å
98P47.4Very low47.7Very low122 Ų122122.6 Ų122.679%0.79275%0.752SS**  trans-85.6105.3-179.431.4-27.4000109.7
99L42.4Very low47.8Very low160 Ų160120.3 Ų120.384%0.83874%0.74SS**  trans-92.9120.4156-87.3165.1000107.7S97 A101S97-L99 PolarHBondContact O-N 3.25Å; L99-A101 PolarHBondContact O-N 3.27Å; L99-A101 VanDerWaalsContact O-N 3.1Å
100P46.1Very low47.9Very low119 Ų119118.2 Ų118.277%0.77372%0.722SS**  trans-72.4108.2174.728.5-29.6000108.9G102P100-G102 PolarHBondContact O-N 3.17Å
101A43.3Very low48.4Very low109 Ų109120.3 Ų120.390%0.90171%0.71SS**  trans-59.9110154.900000108.4L99L99-A101 PolarHBondContact O-N 3.27Å; L99-A101 VanDerWaalsContact O-N 3.1Å
102G38.4Very low48.7Very low72 Ų72116.7 Ų116.774%0.74270%0.696SS**  trans-121.596.3176.100000109.8P100P100-G102 PolarHBondContact O-N 3.17Å
103H49.9Very low49.1Very low184 Ų184110 Ų11085%0.85268%0.677SS**  trans-48.8122.7173.8-178.6-85.5000114.7
104S42.4Very low49.8Very low77 Ų77111.6 Ų111.654%0.53867%0.673SS.*  trans-163.687.4149.766.20000111.6D106S104-D106 PolarHBondContact O-N 3.29Å
105S51.1Low50Low107 Ų107112.4 Ų112.475%0.74867%0.666SS**SBendtrans-81.815.1172.675.10000113.7
106D54.3Low50.6Low108 Ų108114.2 Ų114.258%0.57866%0.661SS**SBendtrans-108-21.1-171.8-142.7-2.6000112.9S104 E108 A109 I110S104-D106 PolarHBondContact O-N 3.29Å; D106-E108 PolarHBondContact O-N 2.94Å; D106-A109 PolarHBondContact O-N 3.49Å; D106-I110 WeakPolarHBondContact O-CD1 3.47Å; D106-I110 VanDerWaalsContact O-CG1 3.28Å; D106-I110 WeakPolarHBondContact O-CG1 3.5Å; D106-I110 PolarHBondContact O-N 2.86Å
107E54.5Low51.1Low117 Ų117114.8 Ų114.855%0.54765%0.649SS.*Hα-helixtrans-68.6-33.8179.5-73.9-80.1146.700112.5R111E107-R111 VanDerWaalsContact O-CB 3.28Å; E107-R111 WeakPolarHBondContact O-CB 3.23Å; E107-R111 PolarHBondContact O-N 2.78Å; E107-R111 VanDerWaalsContact O-N 3.16Å
108E54Low52Low103 Ų103114.3 Ų114.348%0.48164%0.642SS.*Hα-helixtrans-72.3-34177-113.965-156.400111.9D106 R111 N112D106-E108 PolarHBondContact O-N 2.94Å; E108-R111 IonicContact OE1-CZ 3.21Å; E108-R111 IonicContact OE1-NH1 2.73Å; E108-R111 PolarHBondContact OE1-NH1 3.46Å; E108-R111 IonicContact OE1-NH2 2.91Å; E108-R111 PolarHBondContact OE1-NH2 2.96Å; E108-R111 IonicContact OE2-CZ 3.86Å; E108-R111 IonicContact OE2-NH2 2.89Å; E108-R111 PolarHBondContact OE2-NH2 3.14Å; E108-N112 WeakPolarHBondContact O-CB 3.46Å; E108-N112 PolarHBondContact O-N 3.24Å; E108-N112 PolarHBondContact O-OD1 3.48Å
109A54.5Low52.3Low60 Ų60114.2 Ų114.250%0.49663%0.634SS.*Hα-helixtrans-73.1-41.1178.900000111.9D106 N112 G113D106-A109 PolarHBondContact O-N 3.49Å; A109-N112 PolarHBondContact O-N 3.13Å; A109-G113 PolarHBondContact O-N 2.73Å
110I57.6Low52.8Low103 Ų103113.5 Ų113.553%0.52863%0.626SS.*Hα-helixtrans-68.3-42.6178.9-63.2167.8000110.8D106 N112 G113 L114D106-I110 WeakPolarHBondContact O-CD1 3.47Å; D106-I110 VanDerWaalsContact O-CG1 3.28Å; D106-I110 WeakPolarHBondContact O-CG1 3.5Å; D106-I110 PolarHBondContact O-N 2.86Å; I110-N112 PolarHBondContact O-N 3.37Å; I110-G113 PolarHBondContact O-N 3.35Å; I110-L114 WeakPolarHBondContact O-CB 3.43Å; I110-L114 PolarHBondContact O-N 3.24Å
111R58.9Low53.2Low109 Ų109112.8 Ų112.841%0.41162%0.624SS.*Hα-helixtrans-59.4-49176.4-164.6-173.1-40.9142.815.7110.4E107 E108 G113 L114 F115E107-R111 VanDerWaalsContact O-CB 3.28Å; E107-R111 WeakPolarHBondContact O-CB 3.23Å; E107-R111 PolarHBondContact O-N 2.78Å; E107-R111 VanDerWaalsContact O-N 3.16Å; E108-R111 IonicContact OE1-CZ 3.21Å; E108-R111 IonicContact OE1-NH1 2.73Å; E108-R111 PolarHBondContact OE1-NH1 3.46Å; E108-R111 IonicContact OE1-NH2 2.91Å; E108-R111 PolarHBondContact OE1-NH2 2.96Å; E108-R111 IonicContact OE2-CZ 3.86Å; E108-R111 IonicContact OE2-NH2 2.89Å; E108-R111 PolarHBondContact OE2-NH2 3.14Å; R111-G113 PolarHBondContact O-N 2.91Å; R111-L114 PolarHBondContact O-N 2.97Å; R111-F115 HydrophobicContact CG-CD2 4.29Å; R111-F115 HydrophobicContact CG-CE2 3.79Å; R111-F115 WeakPolarHBondContact O-CD2 3.37Å
112N56.4Low53.9Low106 Ų106113.5 Ų113.557%0.56761%0.612SS**Hα-helixtrans-70-31.1-176.8-66.624.3000112.7E108 A109 I110E108-N112 WeakPolarHBondContact O-CB 3.46Å; E108-N112 PolarHBondContact O-N 3.24Å; E108-N112 PolarHBondContact O-OD1 3.48Å; A109-N112 PolarHBondContact O-N 3.13Å; I110-N112 PolarHBondContact O-N 3.37Å
113G58.4Low54.4Low43 Ų43116.2 Ų116.244%0.44361%0.61SS.*Hα-helixtrans-72.7-39.3175.800000114A109 I110 R111 R116A109-G113 PolarHBondContact O-N 2.73Å; I110-G113 PolarHBondContact O-N 3.35Å; R111-G113 PolarHBondContact O-N 2.91Å; G113-R116 PolarHBondContact O-N 3.11Å
114L59.4Low54.7Low119 Ų119110.5 Ų110.562%0.62360%0.6SS**Hα-helixtrans-67.2-39.1-176.7-173.262.5000112.5I110 R111 R116 V118I110-L114 WeakPolarHBondContact O-CB 3.43Å; I110-L114 PolarHBondContact O-N 3.24Å; R111-L114 PolarHBondContact O-N 2.97Å; L114-R116 VanDerWaalsContact C-N 3.33Å; L114-R116 PolarHBondContact O-N 3Å; L114-V118 WeakPolarHBondContact O-CG2 3.18Å
115F56.8Low55.4Low145 Ų145116.4 Ų116.464%0.63662%0.616SS**Hα-helixtrans-67.8-29.2178.6-74.2-70.9000113.3R111R111-F115 HydrophobicContact CG-CD2 4.29Å; R111-F115 HydrophobicContact CG-CE2 3.79Å; R111-F115 WeakPolarHBondContact O-CD2 3.37Å
116R55.6Low55.2Low205 Ų205116.6 Ų116.677%0.77462%0.618SS**Hα-helixtrans-70.9-41.3178.7-72-145177.1-77.40.5112.9G113 L114 V118 L119G113-R116 PolarHBondContact O-N 3.11Å; L114-R116 VanDerWaalsContact C-N 3.33Å; L114-R116 PolarHBondContact O-N 3Å; R116-V118 VanDerWaalsContact C-N 3.33Å; R116-V118 PolarHBondContact O-N 3.39Å; R116-L119 PolarHBondContact O-N 3.15Å
117H55Low55.3Low140 Ų140123 Ų12365%0.64863%0.634SS**Hα-helixtrans-71.8-26.9-177.3-162.3-94.6000113
118V55.1Low55.5Low92 Ų92125.5 Ų125.556%0.55865%0.648SS**Hα-helixtrans-72.3-35.5177.1174.70000112L114 R116L114-V118 WeakPolarHBondContact O-CG2 3.18Å; R116-V118 VanDerWaalsContact C-N 3.33Å; R116-V118 PolarHBondContact O-N 3.39Å
119L54.9Low54.9Low121 Ų121126.4 Ų126.463%0.63467%0.665SS**Hα-helixtrans-67-39178-120.997.1000111.9R116 S121 L122R116-L119 PolarHBondContact O-N 3.15Å; L119-S121 VanDerWaalsContact C-N 3.26Å; L119-S121 PolarHBondContact O-N 3.14Å; L119-L122 PolarHBondContact O-N 2.85Å
120E52.2Low54.3Low145 Ų145129.5 Ų129.568%0.67868%0.683SS**Hα-helixtrans-66.7-25.6-177-163.4168.6-157.700112.9L122E120-L122 VanDerWaalsContact C-N 3.28Å; E120-L122 PolarHBondContact O-N 2.96Å
121S54.7Low53.7Low104 Ų104131.6 Ų131.673%0.72770%0.701SS**THydrogen-bonded Turntrans-76.3-9.2179.8-1660000114.4L119L119-S121 VanDerWaalsContact C-N 3.26Å; L119-S121 PolarHBondContact O-N 3.14Å
122L57.5Low53.6Low124 Ų124131.9 Ų131.965%0.64972%0.72SS**THydrogen-bonded Turntrans-92.5-14.4-178.5-88.3150.6000113.9L119 E120 G124L119-L122 PolarHBondContact O-N 2.85Å; E120-L122 VanDerWaalsContact C-N 3.28Å; E120-L122 PolarHBondContact O-N 2.96Å; L122-G124 PolarHBondContact O-N 2.75Å
123D48.6Very low53.3Low128 Ų128132.2 Ų132.268%0.68473%0.73SS**SBendtrans-82.12.9-176.8-75-39.6000114.3
124G57.3Low52.8Low64 Ų64138.3 Ų138.366%0.6675%0.753SS**SBendtrans-106.242.9-169.400000116.6L122L122-G124 PolarHBondContact O-N 2.75Å
125K55.7Low52.2Low201 Ų201138.6 Ų138.687%0.87476%0.763SS**  trans170.486.3155.750.7-172.7174.395.80113.9
126S47.1Very low52Low111 Ų111137.4 Ų137.478%0.77677%0.773SS**  trans-114.290.9160.1-168.10000109.6M128S126-M128 PolarHBondContact O-N 3.08Å
127R57Low51.4Low244 Ų244133.3 Ų133.392%0.92178%0.776SS**  trans-81.898.7164.5-72.4-17980.8-167.35.2106.8
128M59.7Low50.9Low169 Ų169133 Ų13383%0.83378%0.779SS**  trans-65.8131.6167.8-61.8-1776900109.5S126S126-M128 PolarHBondContact O-N 3.08Å
129S39.8Very low50.6Low122 Ų122133 Ų13385%0.85378%0.783SS**  trans-155.3133.8157.3-74.60000110.3
130S42.5Very low50.5Low125 Ų125135.2 Ų135.287%0.87479%0.79SS**  trans-81.9154.7-157.6-45.20000115.3
131T45.5Very low50.2Low147 Ų147134.7 Ų134.790%0.90280%0.797SS**  trans-90127.4161.410.10000110
132S56.9Low49.9Very low114 Ų114135 Ų13580%0.79781%0.806SS**  trans-119.2127.7160.960.60000108.8
133S49.3Very low49.4Very low114 Ų114136.4 Ų136.480%0.79781%0.814SS**  trans-145.1115.3163.256.10000109.1
134D48.5Very low49.8Very low171 Ų171137.3 Ų137.391%0.91482%0.824SS**  trans-71.7129.2169.3-65.8-59.6000109.7
135C47.4Very low49.2Very low124 Ų124141.7 Ų141.784%0.83883%0.832SS**  trans-132.8108.1165.8-167.90000108.7
136S51.1Low49Very low121 Ų121135.4 Ų135.485%0.84682%0.824SS**  trans-92.8125.6170.7171.40000108.6
137S44.1Very low49.3Very low119 Ų119133 Ų13383%0.83282%0.817SS**  trans-141.6114.4159.8-167.10000110
138D44.8Very low48.5Very low132 Ų132129.4 Ų129.471%0.70682%0.816SS**  trans-78.7133.3173.1174.132.1000109.9
139S48.5Very low48.3Very low93 Ų93127.4 Ų127.465%0.6581%0.814SS**  165.3111.9127.7-75.10000113.2
140Q52.2Low49Very low167 Ų167127.3 Ų127.378%0.7881%0.811SS**  80.3125.9127.7-64.3-162.2-30.900124
141T45.8Very low49.6Very low135 Ų135129.4 Ų129.483%0.82881%0.811SS**  trans86.9104.7153.670.80000118.8
142A49.3Very low49.8Very low110 Ų110129 Ų12991%0.90981%0.808SS**  trans-79.2123.6162.300000109.5
143N47Very low49.4Very low153 Ų153126.6 Ų126.682%0.81880%0.801SS**  trans-111.9114153.859.9-4.1000108.7N145N143-N145 PolarHBondContact O-N 3.15Å
144V55.3Low49.2Very low148 Ų148127.4 Ų127.490%0.89781%0.807SS**  trans-82.7107.1168.2690000107.2
145N45Very low49.1Very low155 Ų155126.2 Ų126.283%0.82980%0.8SS**  trans-156113.1151.5-164.264.7000109N143N143-N145 PolarHBondContact O-N 3.15Å
146G52.5Low49.1Very low69 Ų69125.9 Ų125.971%0.71179%0.79SS**  trans-72.9155.8174.600000112.1
147G52.3Low49.2Very low61 Ų61128.9 Ų128.963%0.62979%0.791SS**  trans105.499.4167.300000112.2
148D41.8Very low49.6Very low168 Ų168131.2 Ų131.290%0.89879%0.789SS**  trans-172.784.3142.5-85.2-25000109.6
149T55.6Low49.7Very low128 Ų128130.5 Ų130.579%0.78579%0.789SS**  trans-81.5127.7161.8220000109.3L151T149-L151 PolarHBondContact O-N 3.33Å
150P52.5Low49.6Very low120 Ų120132.4 Ų132.478%0.77980%0.8SS**  trans-75.3107.5168.229.2-30.9000109.9V152P150-V152 PolarHBondContact O-N 3.46Å
151L55.8Low48.8Very low169 Ų169129.9 Ų129.989%0.88580%0.8SS**  trans-79.299.4164.2-91.5159.8000108.5T149T149-L151 PolarHBondContact O-N 3.33Å
152V50.6Low48.4Very low138 Ų138126.9 Ų126.984%0.83680%0.796SS**  trans-71.2125.2164165.60000108P150P150-V152 PolarHBondContact O-N 3.46Å
153G48Very low47.9Very low63 Ų63131 Ų13165%0.64980%0.797SS**  trans-88.1-175.2-176.500000115.6
154S45Very low47.5Very low131 Ų131127.8 Ų127.892%0.91679%0.791SS**  trans82.1123.8-175.9-61.90000113.9
155D45.7Very low46.8Very low146 Ų146126.5 Ų126.578%0.78178%0.783SS**  cis-150.8143.748.3-175.722.1000111.9
156N47.9Very low46.4Very low118 Ų118126.2 Ų126.263%0.63178%0.782SS**  trans-138104.1175.7158.413.9000106.8E158N156-E158 WeakPolarHBondContact OD1-CB 3.48Å; N156-E158 PolarHBondContact OD1-N 3.22Å; N156-E158 VanDerWaalsContact OD1-N 3.15Å
157E54.5Low45.7Very low184 Ų184134.4 Ų134.486%0.8679%0.791SS**  trans-87.9107.1158-75.5-153.4105.100109.4
158E52.2Low44.7Very low168 Ų168134.6 Ų134.679%0.78579%0.793SS**PPolyproline II helixtrans-96.9117.5173.9-169.2173110.900110N156N156-E158 WeakPolarHBondContact OD1-CB 3.48Å; N156-E158 PolarHBondContact OD1-N 3.22Å; N156-E158 VanDerWaalsContact OD1-N 3.15Å
159T46.4Very low44.2Very low117 Ų117133.7 Ų133.772%0.71879%0.793SS**PPolyproline II helixtrans-65.7145.4175.349.30000112.2S161T159-S161 PolarHBondContact O-N 3.46Å
160P45.7Very low43.3Very low133 Ų133132.4 Ų132.486%0.86479%0.789SS**PPolyproline II helixtrans-81.5122.7-174.932.7-31.5000111.1
161S36.7Very low43Very low114 Ų114131.3 Ų131.380%0.79778%0.783SS**  trans-138.1105.4161.265.50000111.5T159T159-S161 PolarHBondContact O-N 3.46Å
162G36.3Very low42.1Very low72 Ų72131 Ų13174%0.74278%0.776SS**  70130.5128.700000120.5
163E39.2Very low41.4Very low196 Ų196132 Ų13292%0.91678%0.777SS**  trans87.689148.2-67.4-177126.800120.5
164A39.7Very low40.6Very low86 Ų86132.9 Ų132.971%0.71179%0.786SS**  63.7114.7114.300000122
165V38.6Very low40.2Very low120 Ų120134.4 Ų134.473%0.72778%0.779SS**  81.2100.4122.3175.40000118.5
166N37.7Very low39.9Very low149 Ų149134.8 Ų134.880%0.79778%0.776SS**  158.7117.2107.4-95-35.3000114.9
167R37.2Very low39.4Very low242 Ų242137.8 Ų137.891%0.91378%0.778SS**  trans11.6128135.9-171.2-172.7-66.6-1290.5119.9
168G31.8Very low39Very low64 Ų64135.7 Ų135.766%0.6678%0.778SS**  trans151.7115.5136.600000118.7
169V32.3Very low38.6Very low149 Ų149136.9 Ų136.990%0.90378%0.775SS**  trans74.8112.1132.4166.50000120.1
170S34.8Very low38.4Very low101 Ų101136.1 Ų136.171%0.70677%0.774SS**  trans-62.5173.3152.3-46.80000111
171P46.9Very low38.2Very low98 Ų98136 Ų13664%0.63677%0.771SS**  cis-161.5-176.528.236.7-8.6000120.4
172E36.5Very low38.5Very low161 Ų161137.5 Ų137.575%0.75277%0.77SS**  trans64.6144.2137.862-146.263.800127.6
173D36.6Very low38.9Very low160 Ų160139.5 Ų139.586%0.85677%0.773SS**  trans84.5139.3147.9-66.6-20.5000125
174G31.3Very low39Very low81 Ų81140.1 Ų140.184%0.83577%0.768SS**  trans154.989.615200000117.8
175E37.3Very low38.8Very low164 Ų164141.4 Ų141.477%0.76677%0.771SS**  trans-70.7167.7176-65179.186.900116.5
176Q37.7Very low38.9Very low153 Ų153144.2 Ų144.272%0.71578%0.776SS**  trans91.1119.9132.3-91.416142.800122.5
177R39Very low39Very low181 Ų181146.5 Ų146.568%0.68378%0.782SS**  118.7111.5112.7-169.9175.4179.5176.39.7117.8
178V45.8Very low39.5Very low140 Ų140139 Ų13985%0.84877%0.772SS**  trans-54.7132.8161.8-150.20000112.1
179R43.1Very low40.4Very low193 Ų193141.8 Ų141.873%0.72878%0.781SS**  trans-146.5120.9153.4-75.6-166.2174.5148.9-8.2111.3
180S42.7Very low41.3Very low101 Ų101145.4 Ų145.471%0.70678%0.779SS**  trans-72.2143.1166.9169.80000110.7
181V42.2Very low42.3Very low132 Ų132146.4 Ų146.480%0.878%0.781SS**  trans-145.1101.3157.6-175.10000108.4
182D41.3Very low42.2Very low144 Ų144154.9 Ų154.977%0.7781%0.807SS**  trans-67.2135.1157.5-77.3-44.2000109.3
183S45.6Very low42.5Very low115 Ų115154.6 Ų154.680%0.80481%0.81SS**  trans-134.5113.8169.5-178.60000109.6
184Y42.1Very low42.8Very low208 Ų208154.3 Ų154.382%0.81681%0.808SS**  trans-77.9153.8169-86.3-101.6000111.6
185C34.2Very low43.4Very low114 Ų114158.3 Ų158.377%0.7781%0.806SS**  trans158.4107.5139.2-83.60000107.2
186E41.8Very low43.8Very low178 Ų178158 Ų15883%0.83281%0.809SS**  67.810687.7-166.9-178.3-173.300111.8
187E39.6Very low44.2Very low198 Ų198158.3 Ų158.393%0.92581%0.814SS**  -164.9148.3129.8-127.4174131.600113.6
188A47.3Very low44.5Very low85 Ų85156.8 Ų156.870%0.70282%0.823SS**  trans-76.5154.3-168.500000114.4
189S51Low44.4Very low122 Ų122158 Ų15885%0.85382%0.821SS**  trans-16584.7151-77.60000107.7
190R52Low44.5Very low225 Ų225155.3 Ų155.385%0.84983%0.829SS**  57.7105.885.6-136.5-165.4-151.4-1420.8113.6
191T54.4Low44.7Very low121 Ų121159.8 Ų159.874%0.74284%0.839SS**  trans41.3126.814058.70000117.7
192K44.7Very low44.9Very low276 Ų276162.4 Ų162.4100%1.284%0.842SS**  -174.6067.5-173.4176.2-178.8179.10109.6

Retrieved 192 of 192 residues in 125.4 ms (Link to these results)