G4VHV5_SCHMA Loading...

Putative camp-regulated phosphoprotein

Protein phosphatase inhibitor that specifically inhibits protein phosphatase 2A (PP2A) during mitosis.

AlphaFold DB , UniProt , Accession G4VHV5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 138 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
1M60.5Low61.7Low251 Ų251138.7 Ų138.7100%1.23680%0.799SS**  0136.30-74.8-170.1163.100107.7
2E52.7Low61.4Low191 Ų191139.4 Ų139.489%0.89379%0.793SS**  trans-73138-157.6-156.1156161.300113.2
3S58.1Low61.2Low115 Ų115133.7 Ų133.780%0.80476%0.762SS**  trans-81.7115.4-178.846.70000111.4
4T68Low61.4Low136 Ų136127.9 Ų127.983%0.83473%0.734SS**PPolyproline II helixtrans-96.2117.4172.851.70000111.2
5S56.9Low62.3Low107 Ų107124.6 Ų124.675%0.74872%0.722SS**PPolyproline II helixtrans-69147.4172.8-52.40000112T7S5-T7 PolarHBondContact O-N 3.07Å
6P71.4Confident63.4Low117 Ų117121.9 Ų121.976%0.7671%0.708SS**PPolyproline II helixtrans-74.6119.1176.829-31.7000111.4V8P6-V8 PolarHBondContact O-N 2.86Å
7T60.3Low64.3Low130 Ų130121.8 Ų121.880%0.79870%0.699SS**  trans-60.2113.3164.3-59.90000109.5S5S5-T7 PolarHBondContact O-N 3.07Å
8V65.1Low65.3Low107 Ų107122.5 Ų122.565%0.64870%0.695SS**  trans-84.9122173.2176.70000109P6 V10 T13P6-V8 PolarHBondContact O-N 2.86Å; V8-V10 PolarHBondContact O-N 3.35Å; V8-T13 HydrophobicContact CG1-CG2 4.46Å
9N62.9Low66.1Low121 Ų121123.4 Ų123.465%0.64769%0.693SS**  trans-66108.2175.3-73.4-24.3000110.7N11 M12N9-N11 PolarHBondContact O-N 3.08Å; N9-N11 VanDerWaalsContact O-N 3.11Å; N9-M12 PolarHBondContact O-N 3.28Å
10V62.5Low67Low109 Ų109121.8 Ų121.866%0.66168%0.682SS**Hα-helixtrans-63.4-14.5-177.7-173.20000113.5V8 T13V8-V10 PolarHBondContact O-N 3.35Å; V10-T13 PolarHBondContact O-OG1 2.77Å
11N60.7Low67.5Low142 Ų142119.9 Ų119.976%0.75967%0.668SS**Hα-helixtrans-88.8-18.5-175.2-65.3-1.1000114.5N9 S14N9-N11 PolarHBondContact O-N 3.08Å; N9-N11 VanDerWaalsContact O-N 3.11Å; N11-S14 PolarHBondContact O-OG 2.84Å
12M58.3Low68.5Low147 Ų147111.2 Ų111.272%0.72463%0.632SS**Hα-helixtrans-83.1-24.4173.3-89.2-78.6-86.400111.9N9N9-M12 PolarHBondContact O-N 3.28Å
13T58.9Low70.1Confident65 Ų65108.7 Ų108.740%0.39962%0.618SS.*Hα-helixtrans-74-31.7-176.355.10000112.4V8 V10 V16 E17V8-T13 HydrophobicContact CG1-CG2 4.46Å; V10-T13 PolarHBondContact O-OG1 2.77Å; T13-V16 PolarHBondContact O-N 3.49Å; T13-E17 WeakPolarHBondContact O-CB 3.33Å; T13-E17 PolarHBondContact O-N 2.89Å
14S63.6Low71.3Confident53 Ų53107.1 Ų107.137%0.37160%0.599SS.*Hα-helixtrans-64.9-41179.657.20000112.9N11 V16 E17 E18N11-S14 PolarHBondContact O-OG 2.84Å; S14-V16 VanDerWaalsContact C-N 3.34Å; S14-V16 PolarHBondContact O-N 3.37Å; S14-E17 PolarHBondContact O-N 3.44Å; S14-E18 WeakPolarHBondContact O-CG 2.97Å; S14-E18 PolarHBondContact O-N 2.92Å
15S74.5Confident71.9Confident78 Ų78105.7 Ų105.755%0.54558%0.582SS.*Hα-helixtrans-66-37.1178.9-176.40000112.4E19S15-E19 PolarHBondContact O-N 3.24Å
16V80.7Confident73.2Confident82 Ų82104.8 Ų104.850%0.49758%0.575SS.*Hα-helixtrans-70.5-41.3175.5178.10000109.8T13 S14 E18 E19 L20T13-V16 PolarHBondContact O-N 3.49Å; S14-V16 VanDerWaalsContact C-N 3.34Å; S14-V16 PolarHBondContact O-N 3.37Å; V16-E18 VanDerWaalsContact C-N 3.34Å; V16-E18 PolarHBondContact O-N 3.11Å; V16-E19 PolarHBondContact O-N 2.65Å; V16-L20 HydrophobicContact CG1-CD2 3.96Å; V16-L20 HydrophobicContact CG1-CG 4.38Å; V16-L20 WeakPolarHBondContact O-CB 3.24Å; V16-L20 WeakPolarHBondContact O-CD2 3.18Å; V16-L20 WeakPolarHBondContact O-CG 3.33Å; V16-L20 PolarHBondContact O-N 2.74Å; V16-L20 VanDerWaalsContact O-N 3.09Å
17E77.8Confident74Confident119 Ų119106.1 Ų106.156%0.55657%0.569SS**Hα-helixtrans-59-44.3177.1-172.7167.3-162.700112.1T13 S14 L20 E21T13-E17 WeakPolarHBondContact O-CB 3.33Å; T13-E17 PolarHBondContact O-N 2.89Å; S14-E17 PolarHBondContact O-N 3.44Å; E17-L20 PolarHBondContact O-N 2.93Å; E17-E21 WeakPolarHBondContact O-CB 3.36Å; E17-E21 WeakPolarHBondContact O-CG 3.27Å; E17-E21 PolarHBondContact O-N 2.91Å
18E82Confident75.1Confident135 Ų135107.3 Ų107.363%0.63156%0.56SS**Hα-helixtrans-63.5-42.1177.8-73.5178-166.700113.5S14 V16 L20 E21 S22S14-E18 WeakPolarHBondContact O-CG 2.97Å; S14-E18 PolarHBondContact O-N 2.92Å; V16-E18 VanDerWaalsContact C-N 3.34Å; V16-E18 PolarHBondContact O-N 3.11Å; E18-L20 VanDerWaalsContact C-N 3.35Å; E18-E21 PolarHBondContact O-N 3.46Å; E18-S22 WeakPolarHBondContact O-CB 3.39Å; E18-S22 PolarHBondContact O-N 2.96Å
19E81Confident75.7Confident139 Ų139108 Ų10865%0.6557%0.567SS**Hα-helixtrans-63.8-43.2177.5-175.6-179.1173.600111.1S15 V16 S22 K23S15-E19 PolarHBondContact O-N 3.24Å; V16-E19 PolarHBondContact O-N 2.65Å; E19-S22 WeakPolarHBondContact O-CB 3.44Å; E19-S22 PolarHBondContact O-N 3.12Å; E19-K23 PolarHBondContact O-N 3.35Å
20L83.8Confident76.2Confident91 Ų91103.6 Ų103.648%0.47655%0.55SS..Hα-helixtrans-67.6-41.7179.7-79.4-82.9000110.6V16 E17 E18 S22 K23 I24V16-L20 HydrophobicContact CG1-CD2 3.96Å; V16-L20 HydrophobicContact CG1-CG 4.38Å; V16-L20 WeakPolarHBondContact O-CB 3.24Å; V16-L20 WeakPolarHBondContact O-CD2 3.18Å; V16-L20 WeakPolarHBondContact O-CG 3.33Å; V16-L20 PolarHBondContact O-N 2.74Å; V16-L20 VanDerWaalsContact O-N 3.09Å; E17-L20 PolarHBondContact O-N 2.93Å; E18-L20 VanDerWaalsContact C-N 3.35Å; L20-S22 VanDerWaalsContact C-N 3.33Å; L20-S22 PolarHBondContact O-N 2.83Å; L20-K23 WeakPolarHBondContact O-CB 3.4Å; L20-K23 PolarHBondContact O-N 3.45Å; L20-I24 VanDerWaalsContact O-CG1 3.3Å; L20-I24 WeakPolarHBondContact O-CG1 3.37Å; L20-I24 PolarHBondContact O-N 3.37Å
21E77.6Confident76.7Confident83 Ų83104 Ų10439%0.38855%0.548SS..Hα-helixtrans-59.3-42.1171.4-82.1-164-17000112.4E17 E18 K23 I24 K25E17-E21 WeakPolarHBondContact O-CB 3.36Å; E17-E21 WeakPolarHBondContact O-CG 3.27Å; E17-E21 PolarHBondContact O-N 2.91Å; E18-E21 PolarHBondContact O-N 3.46Å; E21-K23 VanDerWaalsContact C-N 3.33Å; E21-K23 PolarHBondContact O-N 2.81Å; E21-I24 PolarHBondContact O-N 3.34Å; E21-K25 WeakPolarHBondContact O-CB 3.37Å; E21-K25 VanDerWaalsContact O-CG 3.29Å; E21-K25 WeakPolarHBondContact O-CG 3.38Å; E21-K25 PolarHBondContact O-N 3.31Å; E21-K25 IonicContact OE2-NZ 2.77Å; E21-K25 PolarHBondContact OE2-NZ 3.34Å
22S81.8Confident77Confident68 Ų68103.2 Ų103.248%0.47654%0.544SS..Hα-helixtrans-63.7-40.5177.4-1740000111.6E18 E19 L20 I24 K25 S26E18-S22 WeakPolarHBondContact O-CB 3.39Å; E18-S22 PolarHBondContact O-N 2.96Å; E19-S22 WeakPolarHBondContact O-CB 3.44Å; E19-S22 PolarHBondContact O-N 3.12Å; L20-S22 VanDerWaalsContact C-N 3.33Å; L20-S22 PolarHBondContact O-N 2.83Å; S22-I24 VanDerWaalsContact C-N 3.35Å; S22-I24 PolarHBondContact O-N 2.85Å; S22-K25 PolarHBondContact O-N 2.82Å; S22-S26 WeakPolarHBondContact O-CB 3.31Å; S22-S26 PolarHBondContact O-N 3.35Å; S22-S26 PolarHBondContact O-OG 3.45Å
23K86.8Confident77.5Confident138 Ų138103.7 Ų103.760%0.654%0.542SS*.Hα-helixtrans-61.6-43.1173.5-16469.6170.4-165.90111.7E19 L20 E21 S26 K27E19-K23 PolarHBondContact O-N 3.35Å; L20-K23 WeakPolarHBondContact O-CB 3.4Å; L20-K23 PolarHBondContact O-N 3.45Å; E21-K23 VanDerWaalsContact C-N 3.33Å; E21-K23 PolarHBondContact O-N 2.81Å; K23-S26 PolarHBondContact O-N 2.81Å; K23-K27 VanDerWaalsContact O-CG 3.32Å; K23-K27 WeakPolarHBondContact O-CG 3.27Å; K23-K27 PolarHBondContact O-N 3.12Å; K23-K27 VanDerWaalsContact O-N 3.07Å
24I83.1Confident77.6Confident82 Ų82109.2 Ų109.242%0.42156%0.563SS.*Hα-helixtrans-65.6-46.6177.5-69.4165.8000110.8L20 E21 S22 S26 K27 Y28 L31L20-I24 VanDerWaalsContact O-CG1 3.3Å; L20-I24 WeakPolarHBondContact O-CG1 3.37Å; L20-I24 PolarHBondContact O-N 3.37Å; E21-I24 PolarHBondContact O-N 3.34Å; S22-I24 VanDerWaalsContact C-N 3.35Å; S22-I24 PolarHBondContact O-N 2.85Å; I24-S26 VanDerWaalsContact C-N 3.27Å; I24-S26 PolarHBondContact O-N 2.83Å; I24-K27 PolarHBondContact O-N 3.48Å; I24-K27 VanDerWaalsContact O-N 3.15Å; I24-Y28 HydrophobicContact CG2-CD2 4.36Å; I24-Y28 PolarHBondContact O-N 3.46Å; I24-L31 HydrophobicContact CG2-CD2 3.54Å
25K81.2Confident77.6Confident106 Ų106108.3 Ų108.346%0.46156%0.562SS.*Hα-helixtrans-59.7-37.1176.7-74.5166.2-171.4157.20111.9E21 S22 Y28E21-K25 WeakPolarHBondContact O-CB 3.37Å; E21-K25 VanDerWaalsContact O-CG 3.29Å; E21-K25 WeakPolarHBondContact O-CG 3.38Å; E21-K25 PolarHBondContact O-N 3.31Å; E21-K25 IonicContact OE2-NZ 2.77Å; E21-K25 PolarHBondContact OE2-NZ 3.34Å; S22-K25 PolarHBondContact O-N 2.82Å; K25-Y28 CarbonylContact O-C 3.47Å
26S83.6Confident77Confident88 Ų88110.5 Ų110.562%0.61557%0.572SS**Hα-helixtrans-70.4-35.1176.5-59.20000112.9S22 K23 I24S22-S26 WeakPolarHBondContact O-CB 3.31Å; S22-S26 PolarHBondContact O-N 3.35Å; S22-S26 PolarHBondContact O-OG 3.45Å; K23-S26 PolarHBondContact O-N 2.81Å; I24-S26 VanDerWaalsContact C-N 3.27Å; I24-S26 PolarHBondContact O-N 2.83Å
27K88.3Confident76.5Confident146 Ų146108.6 Ų108.664%0.63557%0.569SS**Hα-helixtrans-76.7-34.3178.1-72.7-70-173.9178.70112.9K23 I24 P29K23-K27 VanDerWaalsContact O-CG 3.32Å; K23-K27 WeakPolarHBondContact O-CG 3.27Å; K23-K27 PolarHBondContact O-N 3.12Å; K23-K27 VanDerWaalsContact O-N 3.07Å; I24-K27 PolarHBondContact O-N 3.48Å; I24-K27 VanDerWaalsContact O-N 3.15Å; K27-P29 WeakPolarHBondContact O-CD 3.41Å
28Y82.6Confident76.4Confident155 Ų155105.4 Ų105.461%0.60856%0.56SS**SBendtrans-125.574.2-176.6-57.1-76.2000111I24 K25 G30 L31I24-Y28 HydrophobicContact CG2-CD2 4.36Å; I24-Y28 PolarHBondContact O-N 3.46Å; K25-Y28 CarbonylContact O-C 3.47Å; Y28-G30 PolarHBondContact O-N 3.19Å; Y28-L31 PolarHBondContact O-N 3.16Å; Y28-L31 VanDerWaalsContact O-N 3.13Å
29P78.1Confident76.4Confident121 Ų121103.6 Ų103.679%0.78655%0.554SS**THydrogen-bonded Turntrans-59.2114176.123.5-32000109.6K27K27-P29 WeakPolarHBondContact O-CD 3.41Å
30G74Confident76.5Confident28 Ų28100.1 Ų100.129%0.28954%0.54SS..THydrogen-bonded Turntrans107.93.6-179.100000116.1Y28 N32 K33Y28-G30 PolarHBondContact O-N 3.19Å; G30-N32 PolarHBondContact O-N 3.27Å; G30-K33 WeakPolarHBondContact O-CB 3.27Å; G30-K33 PolarHBondContact O-N 3.33Å
31L72.9Confident76.5Confident118 Ų118100.9 Ų100.962%0.61854%0.544SS*.THydrogen-bonded Turntrans-59.9-31.2176-169.763.9000113.3I24 Y28I24-L31 HydrophobicContact CG2-CD2 3.54Å; Y28-L31 PolarHBondContact O-N 3.16Å; Y28-L31 VanDerWaalsContact O-N 3.13Å
32N67.4Low76.9Confident126 Ų126101.7 Ų101.767%0.67455%0.548SS*.THydrogen-bonded Turntrans-87.8-7177.262.4-18.7000114G30 Q34G30-N32 PolarHBondContact O-N 3.27Å; N32-Q34 PolarHBondContact O-N 2.85Å
33K66.9Low77.1Confident157 Ų157103.9 Ų103.968%0.68355%0.548SS*.SBendtrans-72.8119.7170.3-63.6174.4-175.5-83.40105G30 G35G30-K33 WeakPolarHBondContact O-CB 3.27Å; G30-K33 PolarHBondContact O-N 3.33Å; K33-G35 PolarHBondContact O-N 2.9Å
34Q61.7Low77Confident180 Ų180104.3 Ų104.384%0.84155%0.546SS*.  trans-60.376.8159.8-87.6175.8-75.400107.6N32N32-Q34 PolarHBondContact O-N 2.85Å
35G64.7Low77Confident35 Ų35107 Ų10736%0.36156%0.56SS.*  trans-76.1177.1-173.700000110.2K33 G37 S38K33-G35 PolarHBondContact O-N 2.9Å; G35-G37 PolarHBondContact O-N 3.05Å; G35-S38 PolarHBondContact O-N 3.26Å
36V61.3Low77.2Confident123 Ų123107.8 Ų107.875%0.74557%0.57SS**Hα-helixtrans-44.4-28.3176.5-173.20000112.7L39 L40V36-L39 PolarHBondContact O-N 3.01Å; V36-L40 WeakPolarHBondContact O-CB 3.09Å; V36-L40 PolarHBondContact O-N 3.32Å
37G70.2Confident77Confident43 Ų43111.9 Ų111.944%0.44357%0.572SS.*Hα-helixtrans-56.5-48172.100000114.3G35 L40 L41G35-G37 PolarHBondContact O-N 3.05Å; G37-L40 PolarHBondContact O-N 2.87Å; G37-L41 VanDerWaalsContact O-CB 3.3Å; G37-L41 WeakPolarHBondContact O-CB 3.46Å; G37-L41 WeakPolarHBondContact O-CG 3.41Å; G37-L41 PolarHBondContact O-N 3.33Å
38S76.2Confident76.4Confident52 Ų52107 Ų10736%0.36456%0.564SS.*Hα-helixtrans-65.1-43.9179.2-173.70000111.4G35 L40 L41 Q42G35-S38 PolarHBondContact O-N 3.26Å; S38-L40 VanDerWaalsContact C-N 3.35Å; S38-L41 PolarHBondContact O-N 3.41Å; S38-Q42 VanDerWaalsContact O-CB 3.27Å; S38-Q42 WeakPolarHBondContact O-CB 3.37Å; S38-Q42 PolarHBondContact O-N 3.02Å
39L80.6Confident76.2Confident97 Ų97108 Ų10851%0.50857%0.573SS.*Hα-helixtrans-68.4-36.5179.3-155.878.4000111.6V36 K43V36-L39 PolarHBondContact O-N 3.01Å; L39-K43 VanDerWaalsContact O-CB 3.3Å; L39-K43 WeakPolarHBondContact O-CB 3.47Å; L39-K43 VanDerWaalsContact O-CG 3.23Å; L39-K43 WeakPolarHBondContact O-CG 3.19Å; L39-K43 PolarHBondContact O-N 3.41Å
40L84.3Confident76.2Confident66 Ų66110.6 Ų110.635%0.34657%0.572SS.*Hα-helixtrans-68.8-43.7176.4179.364000111.5V36 G37 S38 K43 R44V36-L40 WeakPolarHBondContact O-CB 3.09Å; V36-L40 PolarHBondContact O-N 3.32Å; G37-L40 PolarHBondContact O-N 2.87Å; S38-L40 VanDerWaalsContact C-N 3.35Å; L40-K43 PolarHBondContact O-N 2.84Å; L40-R44 WeakPolarHBondContact O-CG 3.42Å; L40-R44 PolarHBondContact O-N 2.95Å
41L83.9Confident76.7Confident106 Ų106119.3 Ų119.356%0.55560%0.598SS**Hα-helixtrans-62.4-46.8173.9-72.6172000110.4G37 S38 K43 R44 L45G37-L41 VanDerWaalsContact O-CB 3.3Å; G37-L41 WeakPolarHBondContact O-CB 3.46Å; G37-L41 WeakPolarHBondContact O-CG 3.41Å; G37-L41 PolarHBondContact O-N 3.33Å; S38-L41 PolarHBondContact O-N 3.41Å; L41-K43 VanDerWaalsContact C-N 3.35Å; L41-K43 PolarHBondContact O-N 3.05Å; L41-R44 CarbonylContact O-C 3.6Å; L41-R44 WeakPolarHBondContact O-CA 3.45Å; L41-R44 WeakPolarHBondContact O-CB 3.31Å; L41-R44 PolarHBondContact O-N 3.02Å; L41-L45 WeakPolarHBondContact O-CG 3.42Å; L41-L45 PolarHBondContact O-N 3.33Å
42Q84.8Confident77.1Confident101 Ų101119.7 Ų119.747%0.47260%0.595SS.*Hα-helixtrans-59-44.5175-170.4-1795.600111.6S38 R44 L45 N46S38-Q42 VanDerWaalsContact O-CB 3.27Å; S38-Q42 WeakPolarHBondContact O-CB 3.37Å; S38-Q42 PolarHBondContact O-N 3.02Å; Q42-R44 PolarHBondContact O-N 3.18Å; Q42-L45 PolarHBondContact O-N 3.48Å; Q42-N46 WeakPolarHBondContact O-CB 3.17Å; Q42-N46 PolarHBondContact O-N 3.23Å; Q42-N46 PolarHBondContact O-OD1 3.28Å
43K86.4Confident78.1Confident114 Ų114118.3 Ų118.350%0.49659%0.587SS.*Hα-helixtrans-63.8-23.4173.5-77.8179.8-179.8-176.40113.5L39 L40 L41 R47L39-K43 VanDerWaalsContact O-CB 3.3Å; L39-K43 WeakPolarHBondContact O-CB 3.47Å; L39-K43 VanDerWaalsContact O-CG 3.23Å; L39-K43 WeakPolarHBondContact O-CG 3.19Å; L39-K43 PolarHBondContact O-N 3.41Å; L40-K43 PolarHBondContact O-N 2.84Å; L41-K43 VanDerWaalsContact C-N 3.35Å; L41-K43 PolarHBondContact O-N 3.05Å; K43-R47 WeakPolarHBondContact O-CD 2.99Å; K43-R47 VanDerWaalsContact O-CG 3.23Å; K43-R47 WeakPolarHBondContact O-CG 3.46Å; K43-R47 PolarHBondContact O-NH1 3.29Å
44R84.9Confident79.1Confident147 Ų147115.2 Ų115.256%0.55559%0.585SS**Hα-helixtrans-84.2-43.7175.7-77.5179176.9129.62.8111.4L40 L41 Q42 R47L40-R44 WeakPolarHBondContact O-CG 3.42Å; L40-R44 PolarHBondContact O-N 2.95Å; L41-R44 CarbonylContact O-C 3.6Å; L41-R44 WeakPolarHBondContact O-CA 3.45Å; L41-R44 WeakPolarHBondContact O-CB 3.31Å; L41-R44 PolarHBondContact O-N 3.02Å; Q42-R44 PolarHBondContact O-N 3.18Å; R44-R47 PolarHBondContact O-N 3.03Å
45L84.2Confident80.7Confident137 Ų137108 Ų10872%0.71756%0.559SS**Hα-helixtrans-63.9-44.2174.9-65.5176.9000111.2L41 Q42 R47 G48L41-L45 WeakPolarHBondContact O-CG 3.42Å; L41-L45 PolarHBondContact O-N 3.33Å; Q42-L45 PolarHBondContact O-N 3.48Å; L45-R47 VanDerWaalsContact C-N 3.26Å; L45-R47 PolarHBondContact O-N 3.24Å; L45-G48 PolarHBondContact O-N 3.35Å
46N83.5Confident81.9Confident123 Ų123109.2 Ų109.266%0.65856%0.557SS**THydrogen-bonded Turntrans-66.6-22.6178.3-71.6-5.5000113.8Q42 G48Q42-N46 WeakPolarHBondContact O-CB 3.17Å; Q42-N46 PolarHBondContact O-N 3.23Å; Q42-N46 PolarHBondContact O-OD1 3.28Å; N46-G48 PolarHBondContact O-N 2.82Å
47R81Confident83.5Confident174 Ų174108.2 Ų108.266%0.65754%0.541SS*.THydrogen-bonded Turntrans-68.6-10.3173.3-82.8175.3178.8106.2-7.9112.4K43 R44 L45K43-R47 WeakPolarHBondContact O-CD 2.99Å; K43-R47 VanDerWaalsContact O-CG 3.23Å; K43-R47 WeakPolarHBondContact O-CG 3.46Å; K43-R47 PolarHBondContact O-NH1 3.29Å; R44-R47 PolarHBondContact O-N 3.03Å; L45-R47 VanDerWaalsContact C-N 3.26Å; L45-R47 PolarHBondContact O-N 3.24Å
48G75Confident84.5Confident45 Ų45111.2 Ų111.246%0.46455%0.547SS..  trans70.7168.8-179.700000112.8L45 N46 K50L45-G48 PolarHBondContact O-N 3.35Å; N46-G48 PolarHBondContact O-N 2.82Å; G48-K50 PolarHBondContact O-N 2.84Å
49H77.8Confident85.1Confident174 Ų174113.8 Ų113.881%0.80655%0.554SS**  trans-71.2107.3166.2-60.6-70000108Y51H49-Y51 PolarHBondContact O-N 3.4Å
50K79.6Confident85.4Confident176 Ų176111.1 Ų111.177%0.76555%0.546SS*.  trans-73.6112.3167.9-67.8-168.473.6-157.70107.8G48G48-K50 PolarHBondContact O-N 2.84Å
51Y82.8Confident85.6Confident211 Ų211114.2 Ų114.283%0.82755%0.554SS**PPolyproline II helixtrans-63146.9162.6-56.1-74.6000108.7H49H49-Y51 PolarHBondContact O-N 3.4Å
52F82.8Confident85.7Confident126 Ų126111.4 Ų111.455%0.55355%0.545SS*.PPolyproline II helixtrans-81.4122.7175.2-178.5-114000109D56 Y57F52-D56 HydrophobicContact CD2-CB 3.69Å; F52-D56 HydrophobicContact CE2-CB 3.56Å; F52-D56 HydrophobicContact CZ-CB 4.33Å; F52-Y57 AromaticContact CE1-CD2 3.61Å; F52-Y57 HydrophobicContact CE1-CD2 3.61Å; F52-Y57 AromaticContact CE1-CG 3.91Å; F52-Y57 HydrophobicContact CE1-CG 3.91Å; F52-Y57 AromaticContact CZ-CD2 3.78Å; F52-Y57 HydrophobicContact CZ-CD2 3.78Å; F52-Y57 HydrophobicContact CZ-CG 4.16Å
53D87.5Confident85.7Confident97 Ų97112.8 Ų112.852%0.51955%0.55SS..PPolyproline II helixtrans-75.2144.6172.6-173.810000109.6G55 D56 Y57D53-G55 PolarHBondContact O-N 3.45Å; D53-G55 VanDerWaalsContact O-N 3.12Å; D53-G55 PolarHBondContact OD1-N 2.84Å; D53-D56 WeakPolarHBondContact O-CB 3.46Å; D53-D56 PolarHBondContact O-N 3.4Å; D53-Y57 PolarHBondContact O-N 2.96Å
54S88.5Confident85.5Confident92 Ų92111.5 Ų111.564%0.64355%0.547SS*.Hα-helixtrans-51.5-29.3169.362.30000113Y57S54-Y57 WeakPolarHBondContact O-CB 3.37Å
55G94.3Very high85.2Confident28 Ų28109.2 Ų109.229%0.28955%0.546SS..Hα-helixtrans-69.6-39.4172.500000114.1D53 Y57 N58 M59D53-G55 PolarHBondContact O-N 3.45Å; D53-G55 VanDerWaalsContact O-N 3.12Å; D53-G55 PolarHBondContact OD1-N 2.84Å; G55-Y57 PolarHBondContact O-N 2.97Å; G55-N58 PolarHBondContact O-N 2.88Å; G55-M59 PolarHBondContact O-N 3.28Å; G55-M59 VanDerWaalsContact O-N 3.16Å
56D90.8Very high84.6Confident61 Ų61109 Ų10933%0.32654%0.541SS..Hα-helixtrans-63.3-32.8177.5-79.1-13.2000111.1F52 D53 M59 A60F52-D56 HydrophobicContact CD2-CB 3.69Å; F52-D56 HydrophobicContact CE2-CB 3.56Å; F52-D56 HydrophobicContact CZ-CB 4.33Å; D53-D56 WeakPolarHBondContact O-CB 3.46Å; D53-D56 PolarHBondContact O-N 3.4Å; D56-M59 PolarHBondContact O-N 3.48Å; D56-M59 WeakPolarHBondContact OD1-CE 3.3Å; D56-A60 VanDerWaalsContact O-CB 3.31Å; D56-A60 WeakPolarHBondContact O-CB 3.47Å; D56-A60 PolarHBondContact O-N 3.38Å
57Y94Very high83.8Confident103 Ų103109 Ų10940%0.40454%0.537SS..Hα-helixtrans-57.3-49.9172.5-170-110000113.1F52 D53 S54 G55 M59 A60 R61F52-Y57 AromaticContact CE1-CD2 3.61Å; F52-Y57 HydrophobicContact CE1-CD2 3.61Å; F52-Y57 AromaticContact CE1-CG 3.91Å; F52-Y57 HydrophobicContact CE1-CG 3.91Å; F52-Y57 AromaticContact CZ-CD2 3.78Å; F52-Y57 HydrophobicContact CZ-CD2 3.78Å; F52-Y57 HydrophobicContact CZ-CG 4.16Å; D53-Y57 PolarHBondContact O-N 2.96Å; S54-Y57 WeakPolarHBondContact O-CB 3.37Å; G55-Y57 PolarHBondContact O-N 2.97Å; Y57-M59 VanDerWaalsContact C-N 3.34Å; Y57-M59 PolarHBondContact O-N 2.86Å; Y57-A60 PolarHBondContact O-N 2.89Å; Y57-R61 HydrophobicContact CD1-CG 4.1Å; Y57-R61 HydrophobicContact CE1-CG 3.76Å; Y57-R61 HydrophobicContact CE2-CG 4.28Å; Y57-R61 WeakPolarHBondContact O-CB 3.05Å; Y57-R61 WeakPolarHBondContact O-CG 3.18Å; Y57-R61 PolarHBondContact O-N 3.28Å; Y57-R61 PolarHBondContact OH-NE 3.46Å; Y57-R61 PolarHBondContact OH-NH2 2.93Å
58N91.3Very high82.8Confident106 Ų106107.1 Ų107.157%0.56754%0.536SS*.Hα-helixtrans-66.6-41-176-66.8-20.5000110.6G55 A62G55-N58 PolarHBondContact O-N 2.88Å; N58-A62 WeakPolarHBondContact O-CB 3.45Å; N58-A62 PolarHBondContact O-N 3.35Å
59M89.6Confident82Confident105 Ų105114.2 Ų114.252%0.51755%0.554SS.*Hα-helixtrans-63.3-43174.2-68.6-168.8-69.500112.3G55 D56 Y57 A62 K63G55-M59 PolarHBondContact O-N 3.28Å; G55-M59 VanDerWaalsContact O-N 3.16Å; D56-M59 PolarHBondContact O-N 3.48Å; D56-M59 WeakPolarHBondContact OD1-CE 3.3Å; Y57-M59 VanDerWaalsContact C-N 3.34Å; Y57-M59 PolarHBondContact O-N 2.86Å; M59-A62 PolarHBondContact O-N 3.19Å; M59-K63 WeakPolarHBondContact O-CG 3.23Å; M59-K63 PolarHBondContact O-N 3.4Å
60A86.5Confident81Confident41 Ų41113.9 Ų113.934%0.33955%0.552SS.*Hα-helixtrans-65.2-45.4178.300000111.6D56 Y57 A62 K63 I64D56-A60 VanDerWaalsContact O-CB 3.31Å; D56-A60 WeakPolarHBondContact O-CB 3.47Å; D56-A60 PolarHBondContact O-N 3.38Å; Y57-A60 PolarHBondContact O-N 2.89Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 2.88Å; A60-K63 PolarHBondContact O-N 2.87Å; A60-I64 WeakPolarHBondContact O-CG1 3.3Å; A60-I64 PolarHBondContact O-N 2.85Å
61R87.6Confident79.6Confident132 Ų132110.1 Ų110.150%0.49854%0.544SS..Hα-helixtrans-54.7-50.5171.9-80.5-71.7-154.8150.54.9110.7Y57 K63 I64 L65Y57-R61 HydrophobicContact CD1-CG 4.1Å; Y57-R61 HydrophobicContact CE1-CG 3.76Å; Y57-R61 HydrophobicContact CE2-CG 4.28Å; Y57-R61 WeakPolarHBondContact O-CB 3.05Å; Y57-R61 WeakPolarHBondContact O-CG 3.18Å; Y57-R61 PolarHBondContact O-N 3.28Å; Y57-R61 PolarHBondContact OH-NE 3.46Å; Y57-R61 PolarHBondContact OH-NH2 2.93Å; R61-K63 VanDerWaalsContact C-N 3.32Å; R61-K63 PolarHBondContact O-N 2.84Å; R61-I64 PolarHBondContact O-N 3.39Å; R61-I64 VanDerWaalsContact O-N 3.12Å; R61-L65 WeakPolarHBondContact O-CD1 3.3Å; R61-L65 PolarHBondContact O-N 2.84Å
62A87.6Confident78.3Confident46 Ų46106.9 Ų106.938%0.3854%0.54SS..Hα-helixtrans-59.3-40.5179.800000112.7N58 M59 A60 L65 Q66N58-A62 WeakPolarHBondContact O-CB 3.45Å; N58-A62 PolarHBondContact O-N 3.35Å; M59-A62 PolarHBondContact O-N 3.19Å; A60-A62 VanDerWaalsContact C-N 3.35Å; A60-A62 PolarHBondContact O-N 2.88Å; A62-L65 PolarHBondContact O-N 3.36Å; A62-Q66 WeakPolarHBondContact O-CB 3.32Å; A62-Q66 VanDerWaalsContact O-CG 3.27Å; A62-Q66 WeakPolarHBondContact O-CG 3.27Å; A62-Q66 PolarHBondContact O-N 3.37Å
63K84.6Confident76.7Confident131 Ų131106 Ų10657%0.5755%0.547SS*.Hα-helixtrans-63.1-40.7175.1-72.7174.2-177.2176.20112.3M59 A60 R61 Q66 Q67M59-K63 WeakPolarHBondContact O-CG 3.23Å; M59-K63 PolarHBondContact O-N 3.4Å; A60-K63 PolarHBondContact O-N 2.87Å; R61-K63 VanDerWaalsContact C-N 3.32Å; R61-K63 PolarHBondContact O-N 2.84Å; K63-Q66 PolarHBondContact O-N 3.42Å; K63-Q67 VanDerWaalsContact O-CB 3.31Å; K63-Q67 WeakPolarHBondContact O-CB 3.44Å; K63-Q67 VanDerWaalsContact O-CG 3.27Å; K63-Q67 WeakPolarHBondContact O-CG 3.23Å; K63-Q67 PolarHBondContact O-N 3.09Å
64I81.3Confident75Confident86 Ų86106.8 Ų106.844%0.44156%0.558SS.*Hα-helixtrans-64-44.5175.5-64.4163.2000110.1A60 R61 Q66 Q67 Q68A60-I64 WeakPolarHBondContact O-CG1 3.3Å; A60-I64 PolarHBondContact O-N 2.85Å; R61-I64 PolarHBondContact O-N 3.39Å; R61-I64 VanDerWaalsContact O-N 3.12Å; I64-Q66 VanDerWaalsContact C-N 3.34Å; I64-Q66 PolarHBondContact O-N 2.94Å; I64-Q67 PolarHBondContact O-N 2.85Å; I64-Q68 HydrophobicContact CG2-CG 4.48Å; I64-Q68 WeakPolarHBondContact O-CB 3.18Å; I64-Q68 VanDerWaalsContact O-CG 3.27Å; I64-Q68 WeakPolarHBondContact O-CG 3.41Å; I64-Q68 PolarHBondContact O-N 2.97Å
65L78.4Confident73Confident100 Ų100110.1 Ų110.152%0.52456%0.563SS.*Hα-helixtrans-64-36.9175.9-83.484.3000112.6R61 A62R61-L65 WeakPolarHBondContact O-CD1 3.3Å; R61-L65 PolarHBondContact O-N 2.84Å; A62-L65 PolarHBondContact O-N 3.36Å
66Q72.8Confident70.6Confident133 Ų133113 Ų11362%0.62158%0.575SS**Hα-helixtrans-70.2-40.7175.7-74.8174.5-8.200111.8A62 K63 I64 K69A62-Q66 WeakPolarHBondContact O-CB 3.32Å; A62-Q66 VanDerWaalsContact O-CG 3.27Å; A62-Q66 WeakPolarHBondContact O-CG 3.27Å; A62-Q66 PolarHBondContact O-N 3.37Å; K63-Q66 PolarHBondContact O-N 3.42Å; I64-Q66 VanDerWaalsContact C-N 3.34Å; I64-Q66 PolarHBondContact O-N 2.94Å; Q66-K69 PolarHBondContact O-N 3.5Å
67Q66.1Low68.8Low123 Ų123117.4 Ų117.458%0.57559%0.594SS**Hα-helixtrans-67.9-36.4175.3-74.3-179.1-18.400111.2K63 I64 K69 H70 V71K63-Q67 VanDerWaalsContact O-CB 3.31Å; K63-Q67 WeakPolarHBondContact O-CB 3.44Å; K63-Q67 VanDerWaalsContact O-CG 3.27Å; K63-Q67 WeakPolarHBondContact O-CG 3.23Å; K63-Q67 PolarHBondContact O-N 3.09Å; I64-Q67 PolarHBondContact O-N 2.85Å; Q67-K69 PolarHBondContact O-N 3.45Å; Q67-K69 VanDerWaalsContact O-N 3.11Å; Q67-H70 CarbonylContact O-C 3.38Å; Q67-H70 WeakPolarHBondContact O-CA 3.35Å; Q67-H70 PolarHBondContact O-N 3.25Å; Q67-V71 HydrophobicContact CB-CG2 4.32Å; Q67-V71 WeakPolarHBondContact O-CB 3.39Å; Q67-V71 WeakPolarHBondContact O-CG2 3.4Å; Q67-V71 PolarHBondContact O-N 3.26Å
68Q60.1Low66.9Low134 Ų134119.5 Ų119.563%0.62661%0.607SS**Hα-helixtrans-58.2-24.7173.1-78.4177.37.900113.5I64 H70I64-Q68 HydrophobicContact CG2-CG 4.48Å; I64-Q68 WeakPolarHBondContact O-CB 3.18Å; I64-Q68 VanDerWaalsContact O-CG 3.27Å; I64-Q68 WeakPolarHBondContact O-CG 3.41Å; I64-Q68 PolarHBondContact O-N 2.97Å; Q68-H70 VanDerWaalsContact C-N 3.3Å
69K57.3Low65Low194 Ų194117.4 Ų117.484%0.84361%0.605SS**THydrogen-bonded Turntrans-76.1-16.2172.2-68.3-173.4177.1-175.20113.9Q66 Q67Q66-K69 PolarHBondContact O-N 3.5Å; Q67-K69 PolarHBondContact O-N 3.45Å; Q67-K69 VanDerWaalsContact O-N 3.11Å
70H57.3Low63.4Low166 Ų166116.7 Ų116.777%0.76960%0.602SS**THydrogen-bonded Turntrans-122.63.5-176.9-147.3-65.1000113.3Q67 Q68Q67-H70 CarbonylContact O-C 3.38Å; Q67-H70 WeakPolarHBondContact O-CA 3.35Å; Q67-H70 PolarHBondContact O-N 3.25Å; Q68-H70 VanDerWaalsContact C-N 3.3Å
71V51Low61.9Low98 Ų98120.6 Ų120.659%0.59462%0.616SS**SBendtrans-92115.1173.4172.20000106.3Q67Q67-V71 HydrophobicContact CB-CG2 4.32Å; Q67-V71 WeakPolarHBondContact O-CB 3.39Å; Q67-V71 WeakPolarHBondContact O-CG2 3.4Å; Q67-V71 PolarHBondContact O-N 3.26Å
72L54.4Low60.4Low143 Ų143121.7 Ų121.775%0.74963%0.627SS**  trans-42146.1169.5-81.676.8000109.7
73P50.3Low59Low106 Ų106125.9 Ų125.969%0.68864%0.638SS**  trans-47.8138.6-17420.2-32.7000109.9Q75P73-Q75 VanDerWaalsContact C-N 3.3Å; P73-Q75 PolarHBondContact O-N 2.95Å
74P52.1Low57.6Low115 Ų115122.6 Ų122.675%0.74763%0.632SS**  trans-55.4103.7173.624.3-31.1000105.9T76P74-T76 PolarHBondContact O-N 3.45Å
75Q45.3Very low56.6Low162 Ų162124.4 Ų124.476%0.75765%0.648SS**  trans-59.1106.1165.4-75.3-174.2-60.700103.1P73 E77P73-Q75 VanDerWaalsContact C-N 3.3Å; P73-Q75 PolarHBondContact O-N 2.95Å; Q75-E77 PolarHBondContact O-N 2.93Å
76T44.8Very low55.9Low89 Ų89123 Ų12355%0.54666%0.657SS.*  trans-19.7100.6173.746.40000110.3P74 E78 A79P74-T76 PolarHBondContact O-N 3.45Å; T76-E78 PolarHBondContact O-N 2.82Å; T76-E78 VanDerWaalsContact O-N 3.08Å; T76-A79 PolarHBondContact O-N 3.41Å; T76-A79 WeakPolarHBondContact OG1-CB 3.43Å
77E53.5Low55.6Low152 Ų152124.5 Ų124.571%0.7166%0.664SS**Hα-helixtrans-56.7-23.1174.1-62.5-167175.900110.1Q75 A79 I80 L81Q75-E77 PolarHBondContact O-N 2.93Å; E77-A79 VanDerWaalsContact C-N 3.3Å; E77-A79 PolarHBondContact O-N 3.26Å; E77-I80 PolarHBondContact O-N 3.49Å; E77-L81 WeakPolarHBondContact O-CD1 3.29Å; E77-L81 VanDerWaalsContact O-CG 3.24Å; E77-L81 WeakPolarHBondContact O-CG 3.46Å; E77-L81 PolarHBondContact O-N 3.06Å
78E53.7Low55.9Low148 Ų148124.6 Ų124.669%0.69267%0.673SS**Hα-helixtrans-64.2-21.3171.1-56.7-75.5151.300114.7T76 H82T76-E78 PolarHBondContact O-N 2.82Å; T76-E78 VanDerWaalsContact O-N 3.08Å; E78-H82 PolarHBondContact O-CD2 3.27Å
79A52Low56.5Low62 Ų62125.9 Ų125.951%0.51268%0.681SS.*Hα-helixtrans-94.4-19.6179.200000113.5T76 E77T76-A79 PolarHBondContact O-N 3.41Å; T76-A79 WeakPolarHBondContact OG1-CB 3.43Å; E77-A79 VanDerWaalsContact C-N 3.3Å; E77-A79 PolarHBondContact O-N 3.26Å
80I54.9Low57.3Low89 Ų89120.5 Ų120.546%0.45667%0.673SS.*Hα-helixtrans-93.6-18-178-53.8171.1000110.7E77 E83E77-I80 PolarHBondContact O-N 3.49Å; I80-E83 WeakPolarHBondContact O-CG 3.44Å
81L55.6Low58.4Low123 Ų123116.1 Ų116.164%0.64466%0.658SS**SBendtrans-85.5-11.3178.5-68.5169.1000114E77E77-L81 WeakPolarHBondContact O-CD1 3.29Å; E77-L81 VanDerWaalsContact O-CG 3.24Å; E77-L81 WeakPolarHBondContact O-CG 3.46Å; E77-L81 PolarHBondContact O-N 3.06Å
82H55.4Low59.8Low155 Ų155116.7 Ų116.772%0.71866%0.664SS**SBendtrans-93.4-11.5-178-78.4-121.1000113.9E78 S84E78-H82 PolarHBondContact O-CD2 3.27Å; H82-S84 PolarHBondContact O-N 3.27Å
83E58.1Low61.2Low134 Ų134117.2 Ų117.263%0.62667%0.667SS**SBendtrans-83.299.2168.949.5-175.6-173.500108.8I80 T85I80-E83 WeakPolarHBondContact O-CG 3.44Å; E83-T85 PolarHBondContact O-N 2.63Å; E83-T85 PolarHBondContact O-OG1 3.15Å
84S54.5Low62.3Low62 Ų62116.2 Ų116.243%0.43466%0.663SS.*  trans-6.682.2169.6-168.20000114.3H82 G86 E87H82-S84 PolarHBondContact O-N 3.27Å; S84-G86 PolarHBondContact O-N 3.07Å; S84-E87 WeakPolarHBondContact OG-CB 3.4Å; S84-E87 WeakPolarHBondContact OG-CG 3.37Å; S84-E87 PolarHBondContact OG-OE2 2.81Å
85T60.6Low63.3Low125 Ų125114.6 Ų114.677%0.76765%0.651SS**THydrogen-bonded Turntrans-71.983.3-179.1-60.20000107.6E83E83-T85 PolarHBondContact O-N 2.63Å; E83-T85 PolarHBondContact O-OG1 3.15Å
86G65.3Low64.9Low71 Ų71112.2 Ų112.273%0.73265%0.649SS**THydrogen-bonded Turntrans145.7-14.1175.100000116.7S84S84-G86 PolarHBondContact O-N 3.07Å
87E65.7Low66.3Low164 Ų164113 Ų11377%0.76667%0.665SS**THydrogen-bonded Turntrans-90.2-11.8-177.1-70.6177.6162.200114S84S84-E87 WeakPolarHBondContact OG-CB 3.4Å; S84-E87 WeakPolarHBondContact OG-CG 3.37Å; S84-E87 PolarHBondContact OG-OE2 2.81Å
88T72.1Confident67.4Low125 Ų125111.2 Ų111.277%0.76766%0.664SS**SBendtrans-114103.4177.7-54.80000110.4
89M71.9Confident68.3Low161 Ų161115.1 Ų115.179%0.79367%0.672SS**  trans-71.3134.5170.6-75.1-164.359.800110.7T91M89-T91 PolarHBondContact O-N 3.34Å; M89-T91 PolarHBondContact O-OG1 3.43Å
90A75Confident69.3Low81 Ų81122.3 Ų122.367%0.66969%0.692SS**  trans-61.6100.1170.900000109.9V95A90-V95 HydrophobicContact CB-CG2 4.24Å
91T81.2Confident70.1Confident74 Ų74127.1 Ų127.145%0.45471%0.71SS.*  trans-80.1145.7174.6-55.80000108.4M89 D93 S94 V95M89-T91 PolarHBondContact O-N 3.34Å; M89-T91 PolarHBondContact O-OG1 3.43Å; T91-D93 PolarHBondContact O-N 2.93Å; T91-S94 WeakPolarHBondContact O-CA 3.41Å; T91-S94 WeakPolarHBondContact O-CB 3.41Å; T91-S94 PolarHBondContact O-N 3.02Å; T91-V95 PolarHBondContact O-N 3.13Å
92P79.8Confident70.8Confident110 Ų110127 Ų12771%0.71472%0.719SS**G310 helixtrans-52.1-30.4-17917.3-32.7000114.3S94P92-S94 VanDerWaalsContact C-N 3.35Å
93D82.6Confident71.2Confident154 Ų154126.6 Ų126.682%0.82472%0.721SS**G310 helixtrans-76.7-20.2177-56.3-44.6000113.8T91T91-D93 PolarHBondContact O-N 2.93Å
94S73.8Confident71Confident85 Ų85128 Ų12859%0.59473%0.732SS**G310 helixtrans-88.2-13.2178.9177.90000112.7T91 P92T91-S94 WeakPolarHBondContact O-CA 3.41Å; T91-S94 WeakPolarHBondContact O-CB 3.41Å; T91-S94 PolarHBondContact O-N 3.02Å; P92-S94 VanDerWaalsContact C-N 3.35Å
95V74.2Confident70.7Confident80 Ų80130.3 Ų130.349%0.48575%0.748SS.*SBendtrans-91123.8178.5-178.10000108.4A90 T91 A97A90-V95 HydrophobicContact CB-CG2 4.24Å; T91-V95 PolarHBondContact O-N 3.13Å; V95-A97 PolarHBondContact O-N 3.11Å
96P77.9Confident70.1Confident112 Ų112129.3 Ų129.373%0.72774%0.744SS**  trans-53.4116.7176.4-26.534.2000111.3V98P96-V98 PolarHBondContact O-N 3.46Å
97A75.5Confident69.3Low106 Ų106134.2 Ų134.288%0.87675%0.753SS**SBendtrans-63.1-14.3-175.300000114V95V95-A97 PolarHBondContact O-N 3.11Å
98V75.9Confident68.6Low115 Ų115130.3 Ų130.370%0.69776%0.756SS**SBendtrans-123.9114.9-173.5-171.50000110.6P96 K100P96-V98 PolarHBondContact O-N 3.46Å; V98-K100 PolarHBondContact O-N 3.28Å
99R72.7Confident67.6Low229 Ų229130 Ų13086%0.86475%0.754SS**  trans-65.3123.6164.6-81.7-179.1-84.6126-4.6109.5K101R99-K101 PolarHBondContact O-N 2.98Å
100K73.3Confident66.3Low213 Ų213130.6 Ų130.693%0.92676%0.755SS**  trans-62.8124.2169-74.1-176.4173.9176.10109.3V98V98-K100 PolarHBondContact O-N 3.28Å
101K70.6Confident64.9Low191 Ų191132 Ų13283%0.8376%0.76SS**  trans-81.8115.6176.2-36.8-169.7-172.4-175.60107R99 I103R99-K101 PolarHBondContact O-N 2.98Å; K101-I103 PolarHBondContact O-N 3.45Å
102S71.6Confident63.1Low119 Ų119135.2 Ų135.283%0.83278%0.779SS**  trans-64.7133.3172.5-175.50000109.4L104S102-L104 PolarHBondContact O-N 3.27Å
103I63.7Low61.5Low147 Ų147135.9 Ų135.975%0.75478%0.781SS**  trans-68.5106.3-167.8-62.2157.6000110.2K101K101-I103 PolarHBondContact O-N 3.45Å
104L53.7Low59.4Low164 Ų164135.4 Ų135.486%0.85978%0.779SS**  trans-98.3104.8152.3-76.2153.4000104.8S102 P106S102-L104 PolarHBondContact O-N 3.27Å; L104-P106 WeakPolarHBondContact O-CD 3.47Å
105S47.7Very low58.5Low110 Ų110137.4 Ų137.477%0.76979%0.789SS**  trans-69120.6178.6-76.50000111
106P47.9Very low57.1Low105 Ų105139.4 Ų139.468%0.68280%0.801SS**  trans-103.1114.5168.130.9-14.7000109.2L104L104-P106 WeakPolarHBondContact O-CD 3.47Å
107N48.1Very low55.4Low174 Ų174137.8 Ų137.893%0.9380%0.798SS**  trans144.1110.4158.8-73.4-12000110.8
108G50.9Low53.8Low81 Ų81139.6 Ų139.684%0.83580%0.798SS**  trans157.488.3174.400000111.7
109V51.2Low52.3Low119 Ų119139.8 Ų139.872%0.72180%0.804SS**  trans-69.9148.8-160.7-68.30000116.6
110E45Very low51.3Low173 Ų173133.5 Ų133.581%0.80880%0.801SS**  trans77.6132.6135.5-70.3160-160.600122.5
111S46.7Very low50Low111 Ų111129 Ų12978%0.77679%0.794SS**  trans72.387.5171.176.50000117.1
112V42.8Very low49.4Very low141 Ų141126 Ų12686%0.85580%0.796SS**  55.586.780.8179.80000113.1
113V45.2Very low48.1Very low124 Ų124130.5 Ų130.575%0.75280%0.801SS**  trans-149.5120.7140.1-54.50000109.1
114N39.1Very low47.6Very low145 Ų145127.6 Ų127.678%0.77580%0.799SS**  trans-69.9128.3136.9-75.7-36.2000104.5V116N114-V116 PolarHBondContact O-N 3.31Å
115P54.7Low47.7Very low126 Ų126125 Ų12582%0.81879%0.794SS**  trans-76.270.9158.531.4-30.5000108
116V44Very low48.2Very low122 Ų122127.3 Ų127.374%0.73980%0.797SS**  trans-76.2126.3148.562.30000106.2N114N114-V116 PolarHBondContact O-N 3.31Å
117A42.6Very low48.3Very low79 Ų79126.7 Ų126.765%0.65380%0.795SS**SBendtrans89.4133.7162.400000120
118V41.9Very low48.9Very low144 Ų144127.2 Ų127.287%0.87379%0.792SS**  trans67101.8146-770000121.2
119S45.5Very low49.3Very low118 Ų118129.2 Ų129.283%0.82579%0.79SS**  -157.3103.912869.50000111.8
120A50.9Low49.7Very low98 Ų98128 Ų12881%0.8179%0.792SS**  trans11.8157.7146.700000122.8
121P47.2Very low50.4Low119 Ų119127.7 Ų127.777%0.77380%0.797SS**  trans-91.9153-160.236.7-30000113.2
122S56.6Low51.4Low126 Ų126127.7 Ų127.788%0.88180%0.797SS**  trans-151.9116162.8-73.50000112.2
123K44.5Very low52.4Low215 Ų215129.3 Ų129.394%0.93580%0.799SS**  trans-25135.8166.2-80.7174.4167.6176.10116.7
124A52.5Low53.5Low86 Ų86129 Ų12971%0.71180%0.803SS**  trans-160.6104.7134.300000106.8
125S57.2Low54.8Low109 Ų109130.3 Ų130.376%0.76281%0.809SS**  57124.596.1750000111.5
126L57.3Low55.8Low158 Ų158132.1 Ų132.183%0.82781%0.811SS**  cis176.2149.432.7-177.556.2000107.8
127S51.3Low56.7Low92 Ų92131.6 Ų131.664%0.64381%0.813SS**  trans63.5105.3150.961.50000122.8
128H59.8Low58.1Low186 Ų186137.5 Ų137.586%0.86184%0.841SS**  27.5163.9108.1-64.4-44.1000121.2
129P60Low58.9Low123 Ų123137.2 Ų137.280%0.79984%0.839SS**  cis-13817516.628-2.9000117.2
130A58.9Low59.6Low92 Ų92138.2 Ų138.276%0.7684%0.84SS**PPolyproline II helixtrans-76.5143.7176.400000113.2
131D59.8Low60.1Low168 Ų168140.4 Ų140.490%0.89884%0.842SS**PPolyproline II helixtrans-79.3117.9165.4-78.7-33.1000110.2
132S67.7Low60.9Low111 Ų111141.7 Ų141.778%0.77685%0.846SS**PPolyproline II helixtrans-70.8129.8-18048.40000112.5S134S132-S134 PolarHBondContact O-N 2.77Å
133L62.9Low61.1Low174 Ų174142.7 Ų142.791%0.91184%0.843SS**PPolyproline II helixtrans-64.4125.5161.5-63.2171.4000109.4
134S68.6Low62.2Low118 Ų118137.9 Ų137.983%0.82584%0.837SS**  trans-100111.5162.650.20000108.7S132S132-S134 PolarHBondContact O-N 2.77Å
135L67.3Low62.9Low172 Ų172141.6 Ų141.690%0.90185%0.846SS**  trans-75.1117.3166-77.7159.9000107.9
136L75.7Confident63.4Low165 Ų165144.1 Ų144.186%0.86485%0.853SS**  trans-91.5111.6165.6-17563.1000107.9
137S62.9Low63.9Low111 Ų111142.9 Ų142.978%0.77686%0.855SS**  trans-88.9131.3169.2-178.90000108.8
138T71.8Confident65Low203 Ų203147.5 Ų147.5100%1.24587%0.874SS**  trans-127.50155.916.60000107.6

Retrieved 138 of 138 residues in 31.8 ms (Link to these results)