G4VC17_SCHMA Loading...

Putative camp-regulated phosphoprotein

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

AlphaFold DB , UniProt , Accession G4VC17, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 132 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
1M38.5Very low66.8Low248 Ų248112.6 Ų112.6100%1.22266%0.657SS**  0103.10-80.9178.2137.200107.7
2A54Low68.5Low103 Ų103110.3 Ų110.385%0.85164%0.638SS**  trans-79.3140.4-178.100000110.4I4A2-I4 PolarHBondContact O-N 2.96Å; A2-I4 VanDerWaalsContact O-N 3.11Å
3S58.7Low69.9Low90 Ų90112.2 Ų112.263%0.62963%0.634SS**  trans-6498.5-168.1-163.40000112.6D5S3-D5 PolarHBondContact O-N 3.06Å
4I64.4Low71.2Confident150 Ų150113.4 Ų113.477%0.76963%0.629SS**THydrogen-bonded Turntrans-70.8-16.4172.4-164.367.8000111.8A2 A6A2-I4 PolarHBondContact O-N 2.96Å; A2-I4 VanDerWaalsContact O-N 3.11Å; I4-A6 VanDerWaalsContact C-N 3.35Å; I4-A6 PolarHBondContact O-N 3.12Å
5D65.3Low72.2Confident90 Ų90113.7 Ų113.748%0.48162%0.624SS.*Hα-helixtrans-77.2-14.1-173.9-57.5-25.8000114.5S3 K9S3-D5 PolarHBondContact O-N 3.06Å; D5-K9 WeakPolarHBondContact O-CB 3.32Å; D5-K9 VanDerWaalsContact O-CD 3.29Å; D5-K9 WeakPolarHBondContact O-CD 2.85Å; D5-K9 WeakPolarHBondContact O-CG 3.48Å; D5-K9 PolarHBondContact O-N 3.49Å
6A65.7Low73Confident61 Ų61110.4 Ų110.450%0.50461%0.612SS.*Hα-helixtrans-76.6-40.3-169.600000113.4I4 S10I4-A6 VanDerWaalsContact C-N 3.35Å; I4-A6 PolarHBondContact O-N 3.12Å; A6-S10 PolarHBondContact O-N 3.49Å
7A65.7Low73.8Confident77 Ų77111.6 Ų111.664%0.63661%0.612SS**Hα-helixtrans-68.4-43.7179.900000111.2K9 S10 E11A7-K9 PolarHBondContact O-N 3.14Å; A7-S10 WeakPolarHBondContact O-CB 3.36Å; A7-S10 PolarHBondContact O-N 3.41Å; A7-S10 VanDerWaalsContact O-N 3.11Å; A7-E11 PolarHBondContact O-N 3.27Å
8D75.8Confident74.7Confident100 Ų100113.7 Ų113.754%0.53561%0.614SS.*Hα-helixtrans-62.3-41.9178-16927.4000111.5S10 E11 I12D8-S10 PolarHBondContact O-N 3.45Å; D8-E11 PolarHBondContact O-N 3.46Å; D8-I12 WeakPolarHBondContact O-CB 3.4Å; D8-I12 WeakPolarHBondContact O-CD1 3.01Å; D8-I12 WeakPolarHBondContact O-CG1 3.5Å; D8-I12 PolarHBondContact O-N 3.21Å
9K80.2Confident75.3Confident119 Ų119112.3 Ų112.352%0.51761%0.605SS.*Hα-helixtrans-58.3-32.2174-76.8169.7-171.5175.40113.7D5 A7 K13D5-K9 WeakPolarHBondContact O-CB 3.32Å; D5-K9 VanDerWaalsContact O-CD 3.29Å; D5-K9 WeakPolarHBondContact O-CD 2.85Å; D5-K9 WeakPolarHBondContact O-CG 3.48Å; D5-K9 PolarHBondContact O-N 3.49Å; A7-K9 PolarHBondContact O-N 3.14Å; K9-K13 WeakPolarHBondContact O-CB 3.27Å; K9-K13 WeakPolarHBondContact O-CD 3.44Å; K9-K13 WeakPolarHBondContact O-CG 3.43Å; K9-K13 PolarHBondContact O-N 3.33Å; K9-K13 VanDerWaalsContact O-N 3.16Å
10S82.2Confident75.7Confident61 Ų61115.6 Ų115.643%0.42761%0.608SS.*Hα-helixtrans-70.6-43.8178.6133.60000111.3A6 A7 D8 K13 K14A6-S10 PolarHBondContact O-N 3.49Å; A7-S10 WeakPolarHBondContact O-CB 3.36Å; A7-S10 PolarHBondContact O-N 3.41Å; A7-S10 VanDerWaalsContact O-N 3.11Å; D8-S10 PolarHBondContact O-N 3.45Å; S10-K13 PolarHBondContact O-N 3.34Å; S10-K14 PolarHBondContact O-N 3.02Å
11E83.9Confident76.2Confident140 Ų140113.9 Ų113.965%0.65461%0.611SS**Hα-helixtrans-68.4-46.1179.3-170.1125.1-139.700111A7 D8 K13 K14 E15A7-E11 PolarHBondContact O-N 3.27Å; D8-E11 PolarHBondContact O-N 3.46Å; E11-K13 VanDerWaalsContact C-N 3.25Å; E11-K13 PolarHBondContact O-N 3.13Å; E11-K14 PolarHBondContact O-N 2.82Å; E11-K14 VanDerWaalsContact O-N 3.1Å; E11-E15 PolarHBondContact O-N 3.1Å
12I88Confident78.7Confident84 Ų84109.5 Ų109.543%0.43159%0.585SS.*Hα-helixtrans-55-41.3174.8-68.4166.6000111.2D8 E15 S16D8-I12 WeakPolarHBondContact O-CB 3.4Å; D8-I12 WeakPolarHBondContact O-CD1 3.01Å; D8-I12 WeakPolarHBondContact O-CG1 3.5Å; D8-I12 PolarHBondContact O-N 3.21Å; I12-E15 PolarHBondContact O-N 3.17Å; I12-S16 VanDerWaalsContact O-CB 3.27Å; I12-S16 WeakPolarHBondContact O-CB 3.32Å; I12-S16 PolarHBondContact O-N 3.49Å; I12-S16 PolarHBondContact O-OG 3.4Å
13K86.9Confident80.1Confident135 Ų135111.1 Ų111.159%0.58757%0.571SS**Hα-helixtrans-62-49.5176.7-78.8171.3-177-174.20111.9K9 S10 E11 E15 S16 E17K9-K13 WeakPolarHBondContact O-CB 3.27Å; K9-K13 WeakPolarHBondContact O-CD 3.44Å; K9-K13 WeakPolarHBondContact O-CG 3.43Å; K9-K13 PolarHBondContact O-N 3.33Å; K9-K13 VanDerWaalsContact O-N 3.16Å; S10-K13 PolarHBondContact O-N 3.34Å; E11-K13 VanDerWaalsContact C-N 3.25Å; E11-K13 PolarHBondContact O-N 3.13Å; K13-E15 VanDerWaalsContact C-N 3.31Å; K13-E15 PolarHBondContact O-N 3.47Å; K13-S16 PolarHBondContact O-N 3.44Å; K13-S16 PolarHBondContact O-OG 3.08Å; K13-E17 WeakPolarHBondContact O-CG 3.35Å; K13-E17 PolarHBondContact O-N 3.41Å
14K87.3Confident81.3Confident130 Ų130112.5 Ų112.557%0.56558%0.577SS**Hα-helixtrans-61.7-39.9179.3-69.3177.2-176.4175.80112S10 E11 K18S10-K14 PolarHBondContact O-N 3.02Å; E11-K14 PolarHBondContact O-N 2.82Å; E11-K14 VanDerWaalsContact O-N 3.1Å; K14-K18 WeakPolarHBondContact O-CG 3.43Å; K14-K18 PolarHBondContact O-N 3.49Å
15E86.8Confident82Confident118 Ų118107.2 Ų107.255%0.55156%0.56SS**Hα-helixtrans-67.7-40.8175.8-170.3175.9-172.400111.7E11 I12 K13 E17 K18 L19E11-E15 PolarHBondContact O-N 3.1Å; I12-E15 PolarHBondContact O-N 3.17Å; K13-E15 VanDerWaalsContact C-N 3.31Å; K13-E15 PolarHBondContact O-N 3.47Å; E15-E17 VanDerWaalsContact C-N 3.3Å; E15-E17 PolarHBondContact O-N 3.12Å; E15-K18 WeakPolarHBondContact O-CB 3.28Å; E15-K18 PolarHBondContact O-N 3.39Å; E15-L19 HydrophobicContact CG-CD1 4.48Å; E15-L19 PolarHBondContact O-N 3.39Å
16S85Confident82.5Confident61 Ų61108.5 Ų108.543%0.42757%0.566SS.*Hα-helixtrans-61.4-36.1176.978.30000112.9I12 K13 L19 R20I12-S16 VanDerWaalsContact O-CB 3.27Å; I12-S16 WeakPolarHBondContact O-CB 3.32Å; I12-S16 PolarHBondContact O-N 3.49Å; I12-S16 PolarHBondContact O-OG 3.4Å; K13-S16 PolarHBondContact O-N 3.44Å; K13-S16 PolarHBondContact O-OG 3.08Å; S16-L19 PolarHBondContact O-N 3.1Å; S16-R20 WeakPolarHBondContact O-CB 3.09Å; S16-R20 PolarHBondContact O-N 2.78Å
17E86.1Confident82.8Confident131 Ų131110.4 Ų110.461%0.61257%0.571SS**Hα-helixtrans-67.9-42175.8-73.2172.3-170.400111.9K13 E15 L19 R20 A21K13-E17 WeakPolarHBondContact O-CG 3.35Å; K13-E17 PolarHBondContact O-N 3.41Å; E15-E17 VanDerWaalsContact C-N 3.3Å; E15-E17 PolarHBondContact O-N 3.12Å; E17-L19 VanDerWaalsContact C-N 3.3Å; E17-L19 PolarHBondContact O-N 2.67Å; E17-R20 PolarHBondContact O-N 3.15Å; E17-A21 PolarHBondContact O-N 3.35Å
18K89.5Confident83.1Confident149 Ų149113.4 Ų113.465%0.64858%0.576SS**Hα-helixtrans-61.3-40.6173.7-69.4173.4-175.4174.30111.4K14 E15 A21 K22K14-K18 WeakPolarHBondContact O-CG 3.43Å; K14-K18 PolarHBondContact O-N 3.49Å; E15-K18 WeakPolarHBondContact O-CB 3.28Å; E15-K18 PolarHBondContact O-N 3.39Å; K18-A21 PolarHBondContact O-N 3.03Å; K18-K22 PolarHBondContact O-N 2.87Å
19L85.7Confident82.8Confident86 Ų86115.1 Ų115.145%0.4559%0.585SS.*Hα-helixtrans-66.6-40.7175-73.6171.6000111.7E15 S16 E17 A21 K22 Y23E15-L19 HydrophobicContact CG-CD1 4.48Å; E15-L19 PolarHBondContact O-N 3.39Å; S16-L19 PolarHBondContact O-N 3.1Å; E17-L19 VanDerWaalsContact C-N 3.3Å; E17-L19 PolarHBondContact O-N 2.67Å; L19-A21 VanDerWaalsContact C-N 3.29Å; L19-A21 PolarHBondContact O-N 2.84Å; L19-K22 PolarHBondContact O-N 3.39Å; L19-K22 VanDerWaalsContact O-N 3.16Å; L19-Y23 HydrophobicContact CD2-CE2 4.42Å; L19-Y23 WeakPolarHBondContact O-CD2 3.31Å; L19-Y23 PolarHBondContact O-N 3.06Å
20R84.5Confident82.5Confident178 Ų178111.6 Ų111.667%0.67258%0.579SS**Hα-helixtrans-62.4-35.9175.4-173.4177172.295.4-0.1112.3S16 E17 Y23S16-R20 WeakPolarHBondContact O-CB 3.09Å; S16-R20 PolarHBondContact O-N 2.78Å; E17-R20 PolarHBondContact O-N 3.15Å; R20-Y23 CarbonylContact O-C 3.52Å; R20-Y23 PolarHBondContact O-N 2.65Å
21A86.2Confident82.5Confident81 Ų81111.2 Ų111.267%0.66958%0.576SS**Hα-helixtrans-68.3-33.9174.800000112.9E17 K18 L19E17-A21 PolarHBondContact O-N 3.35Å; K18-A21 PolarHBondContact O-N 3.03Å; L19-A21 VanDerWaalsContact C-N 3.29Å; L19-A21 PolarHBondContact O-N 2.84Å
22K90.3Very high82.4Confident156 Ų156109.1 Ų109.168%0.67858%0.577SS**Hα-helixtrans-71.5-27.9176.4-74.1-174.2177.2-1760113.6K18 L19 P24K18-K22 PolarHBondContact O-N 2.87Å; L19-K22 PolarHBondContact O-N 3.39Å; L19-K22 VanDerWaalsContact O-N 3.16Å; K22-P24 WeakPolarHBondContact O-CD 3.29Å
23Y84.8Confident82.1Confident137 Ų137109 Ų10954%0.53758%0.576SS.*SBendtrans-126.970.4-175.2-55.7-76.6000112.3L19 R20 G25 L26L19-Y23 HydrophobicContact CD2-CE2 4.42Å; L19-Y23 WeakPolarHBondContact O-CD2 3.31Å; L19-Y23 PolarHBondContact O-N 3.06Å; R20-Y23 CarbonylContact O-C 3.52Å; R20-Y23 PolarHBondContact O-N 2.65Å; Y23-G25 PolarHBondContact O-N 3.31Å; Y23-G25 VanDerWaalsContact O-N 3.09Å; Y23-L26 HydrophobicContact CD2-CD2 4.48Å; Y23-L26 HydrophobicContact CG-CD2 4.24Å; Y23-L26 PolarHBondContact O-N 3.18Å
24P82.9Confident82Confident118 Ų118107 Ų10777%0.76657%0.572SS**THydrogen-bonded Turntrans-62.9113.5175.427.4-33.5000109.7K22K22-P24 WeakPolarHBondContact O-CD 3.29Å
25G78.9Confident81.8Confident39 Ų39105.5 Ų105.540%0.40257%0.567SS.*THydrogen-bonded Turntrans102.10.1176.700000116.4Y23 V27 N28 N29Y23-G25 PolarHBondContact O-N 3.31Å; Y23-G25 VanDerWaalsContact O-N 3.09Å; G25-V27 PolarHBondContact O-N 3.2Å; G25-N28 PolarHBondContact O-N 3.45Å; G25-N28 VanDerWaalsContact O-N 3.07Å; G25-N29 PolarHBondContact O-N 3.06Å; G25-N29 VanDerWaalsContact O-N 3.16Å
26L75.8Confident81.5Confident118 Ų118106.3 Ų106.362%0.61857%0.565SS**THydrogen-bonded Turntrans-60.1-30.9179-17459.7000113.3Y23 N28Y23-L26 HydrophobicContact CD2-CD2 4.48Å; Y23-L26 HydrophobicContact CG-CD2 4.24Å; Y23-L26 PolarHBondContact O-N 3.18Å; L26-N28 VanDerWaalsContact C-N 3.33Å
27V72Confident81.3Confident101 Ų101111.2 Ų111.261%0.61257%0.574SS**THydrogen-bonded Turntrans-75.7-21.9179-560000113.1G25G25-V27 PolarHBondContact O-N 3.2Å
28N71.6Confident81.2Confident139 Ų139111.7 Ų111.774%0.74358%0.58SS**THydrogen-bonded Turntrans-95.5-20.6-177.6-55.965000112.1G25 L26G25-N28 PolarHBondContact O-N 3.45Å; G25-N28 VanDerWaalsContact O-N 3.07Å; L26-N28 VanDerWaalsContact C-N 3.33Å
29N69.9Low80.8Confident136 Ų136108.7 Ų108.773%0.72758%0.578SS**  trans-108.231.5-172.1-161.818.1000113.2G25 S31G25-N29 PolarHBondContact O-N 3.06Å; G25-N29 VanDerWaalsContact O-N 3.16Å; N29-S31 PolarHBondContact O-N 3.17Å
30A74.7Confident80.2Confident45 Ų45110.8 Ų110.837%0.37258%0.583SS.*  trans-64.3130.116600000108.6S32 H35A30-S32 PolarHBondContact O-N 3.25Å; A30-H35 WeakPolarHBondContact CB-NE2 3.22Å
31S82.2Confident79.8Confident54 Ų54108.8 Ų108.838%0.37859%0.586SS.*  trans-52.9132.5-177.369.50000110.9N29 L33 L34 H35N29-S31 PolarHBondContact O-N 3.17Å; S31-L33 PolarHBondContact O-N 3.08Å; S31-L34 WeakPolarHBondContact O-CA 3.38Å; S31-L34 PolarHBondContact O-N 2.94Å; S31-L34 VanDerWaalsContact OG-CB 3.31Å; S31-L34 WeakPolarHBondContact OG-CB 3.27Å; S31-L34 VanDerWaalsContact OG-CG 3.27Å; S31-L34 WeakPolarHBondContact OG-CG 3.31Å; S31-L34 PolarHBondContact OG-N 3.45Å; S31-H35 PolarHBondContact O-N 2.88Å
32S80.9Confident79.6Confident96 Ų96110.5 Ų110.567%0.67159%0.588SS**Hα-helixtrans-54.4-30.5178.162.70000112A30 R36A30-S32 PolarHBondContact O-N 3.25Å; S32-R36 VanDerWaalsContact O-CB 3.22Å; S32-R36 WeakPolarHBondContact O-CB 3.1Å; S32-R36 PolarHBondContact O-N 3.22Å
33L82.9Confident79.3Confident80 Ų80111.4 Ų111.442%0.41959%0.592SS.*Hα-helixtrans-63.7-42.3173.9-63.4176.7000112.9S31 R37S31-L33 PolarHBondContact O-N 3.08Å; L33-R37 VanDerWaalsContact O-CG 3.31Å; L33-R37 WeakPolarHBondContact O-CG 3.23Å; L33-R37 PolarHBondContact O-N 3.4Å; L33-R37 VanDerWaalsContact O-N 3.08Å
34L83.7Confident79.4Confident94 Ų94114.5 Ų114.549%0.49260%0.604SS.*Hα-helixtrans-70-47.2175.8-82.5174.1000111.2S31 R36 R37 L38S31-L34 WeakPolarHBondContact O-CA 3.38Å; S31-L34 PolarHBondContact O-N 2.94Å; S31-L34 VanDerWaalsContact OG-CB 3.31Å; S31-L34 WeakPolarHBondContact OG-CB 3.27Å; S31-L34 VanDerWaalsContact OG-CG 3.27Å; S31-L34 WeakPolarHBondContact OG-CG 3.31Å; S31-L34 PolarHBondContact OG-N 3.45Å; L34-R36 VanDerWaalsContact C-N 3.29Å; L34-R36 PolarHBondContact O-N 2.85Å; L34-R37 CarbonylContact O-C 3.57Å; L34-R37 WeakPolarHBondContact O-CA 3.46Å; L34-R37 PolarHBondContact O-N 2.75Å; L34-L38 WeakPolarHBondContact O-CG 3.46Å; L34-L38 PolarHBondContact O-N 3.38Å
35H82.6Confident79.6Confident99 Ų99113.2 Ų113.246%0.45859%0.586SS.*Hα-helixtrans-55.5-46.8174.8-90.4-55.9000111.2A30 S31 R37 L38 S39A30-H35 WeakPolarHBondContact CB-NE2 3.22Å; S31-H35 PolarHBondContact O-N 2.88Å; H35-R37 PolarHBondContact O-N 2.83Å; H35-L38 PolarHBondContact O-N 2.99Å; H35-S39 WeakPolarHBondContact O-CB 3.5Å; H35-S39 PolarHBondContact O-N 3.37Å; H35-S39 PolarHBondContact O-OG 3.27Å
36R81.7Confident80.1Confident134 Ų134116.2 Ų116.251%0.50659%0.593SS.*Hα-helixtrans-59.8-33.8174.9-176.1176.669.7-167.52.3112.7S32 L34 K40S32-R36 VanDerWaalsContact O-CB 3.22Å; S32-R36 WeakPolarHBondContact O-CB 3.1Å; S32-R36 PolarHBondContact O-N 3.22Å; L34-R36 VanDerWaalsContact C-N 3.29Å; L34-R36 PolarHBondContact O-N 2.85Å; R36-K40 HydrophobicContact CG-CD 4.16Å; R36-K40 VanDerWaalsContact CG-CE 3.46Å; R36-K40 VanDerWaalsContact O-CB 3.23Å; R36-K40 WeakPolarHBondContact O-CB 2.95Å; R36-K40 WeakPolarHBondContact O-CD 3.16Å; R36-K40 WeakPolarHBondContact O-CG 3.39Å; R36-K40 PolarHBondContact O-N 2.72Å
37R81.3Confident80.8Confident165 Ų165114.7 Ų114.762%0.62359%0.592SS**Hα-helixtrans-77-39.2178.2-78.8175.3169.6118.6-5.2112.6L33 L34 H35L33-R37 VanDerWaalsContact O-CG 3.31Å; L33-R37 WeakPolarHBondContact O-CG 3.23Å; L33-R37 PolarHBondContact O-N 3.4Å; L33-R37 VanDerWaalsContact O-N 3.08Å; L34-R37 CarbonylContact O-C 3.57Å; L34-R37 WeakPolarHBondContact O-CA 3.46Å; L34-R37 PolarHBondContact O-N 2.75Å; H35-R37 PolarHBondContact O-N 2.83Å
38L83.2Confident81.9Confident140 Ų140111.4 Ų111.473%0.73358%0.579SS**Hα-helixtrans-77.4-40.1-179.9-67.7173.5000112.2L34 H35 K40L34-L38 WeakPolarHBondContact O-CG 3.46Å; L34-L38 PolarHBondContact O-N 3.38Å; H35-L38 PolarHBondContact O-N 2.99Å; L38-K40 PolarHBondContact O-N 3.48Å
39S80.3Confident82.9Confident86 Ų86107.6 Ų107.660%0.60156%0.558SS**SBendtrans-72.5-18.8174.4-58.40000112.6H35 N41H35-S39 WeakPolarHBondContact O-CB 3.5Å; H35-S39 PolarHBondContact O-N 3.37Å; H35-S39 PolarHBondContact O-OG 3.27Å; S39-N41 PolarHBondContact O-N 3.09Å; S39-N41 VanDerWaalsContact O-N 3.12Å; S39-N41 PolarHBondContact O-OD1 2.89Å
40K74Confident84Confident130 Ų130107.3 Ų107.357%0.56555%0.548SS*.SBendtrans-73.4102.5168.8-84.5171.1-175.8-175.30108R36 L38 V42R36-K40 HydrophobicContact CG-CD 4.16Å; R36-K40 VanDerWaalsContact CG-CE 3.46Å; R36-K40 VanDerWaalsContact O-CB 3.23Å; R36-K40 WeakPolarHBondContact O-CB 2.95Å; R36-K40 WeakPolarHBondContact O-CD 3.16Å; R36-K40 WeakPolarHBondContact O-CG 3.39Å; R36-K40 PolarHBondContact O-N 2.72Å; L38-K40 PolarHBondContact O-N 3.48Å; K40-V42 PolarHBondContact O-N 3.27Å
41N76.7Confident84.7Confident137 Ų137110.5 Ų110.573%0.73356%0.559SS**  trans-48.9139.4163.6-58.170.7000109S39 K43S39-N41 PolarHBondContact O-N 3.09Å; S39-N41 VanDerWaalsContact O-N 3.12Å; S39-N41 PolarHBondContact O-OD1 2.89Å; N41-K43 VanDerWaalsContact C-N 3.31Å; N41-K43 PolarHBondContact O-N 3.37Å
42V82.4Confident85Confident116 Ų116113 Ų11370%0.70357%0.566SS**  trans-57.199.8170178.40000107K40 Y44K40-V42 PolarHBondContact O-N 3.27Å; V42-Y44 HydrophobicContact CG1-CE1 4.35Å; V42-Y44 PolarHBondContact O-N 3.06Å
43K83.2Confident85.2Confident176 Ų176111.3 Ų111.377%0.76556%0.557SS**  trans-80.2106.9174.6-72.4-177.760.666.20106.2N41 F45N41-K43 VanDerWaalsContact C-N 3.31Å; N41-K43 PolarHBondContact O-N 3.37Å; K43-F45 PolarHBondContact O-N 3.23Å
44Y87.3Confident85.2Confident202 Ų202115.6 Ų115.679%0.79257%0.573SS**PPolyproline II helixtrans-60.9135.4160.4-59.1-76.3000107.6V42 D46V42-Y44 HydrophobicContact CG1-CE1 4.35Å; V42-Y44 PolarHBondContact O-N 3.06Å; Y44-D46 PolarHBondContact O-N 2.88Å
45F85.6Confident85.1Confident91 Ų91115.2 Ų115.240%0.39958%0.578SS.*PPolyproline II helixtrans-81.6118.2-174.7-171.4-81.9000108K43 D49 Y50 A53K43-F45 PolarHBondContact O-N 3.23Å; F45-D49 HydrophobicContact CD1-CB 3.82Å; F45-D49 HydrophobicContact CD2-CB 3.83Å; F45-D49 HydrophobicContact CE1-CB 3.37Å; F45-D49 HydrophobicContact CE2-CB 3.45Å; F45-D49 VanDerWaalsContact CE2-CB 3.45Å; F45-D49 HydrophobicContact CG-CB 4.03Å; F45-D49 HydrophobicContact CZ-CB 3.24Å; F45-D49 VanDerWaalsContact CZ-O 3.29Å; F45-D49 WeakPolarHBondContact CZ-O 3.46Å; F45-Y50 AromaticContact CD1-CD1 3.78Å; F45-Y50 HydrophobicContact CD1-CD1 3.78Å; F45-Y50 AromaticContact CD1-CD2 3.67Å; F45-Y50 HydrophobicContact CD1-CD2 3.67Å; F45-Y50 AromaticContact CD1-CE1 3.49Å; F45-Y50 HydrophobicContact CD1-CE1 3.49Å; F45-Y50 VanDerWaalsContact CD1-CE1 3.49Å; F45-Y50 AromaticContact CD1-CE2 3.38Å; F45-Y50 HydrophobicContact CD1-CE2 3.38Å; F45-Y50 AromaticContact CD1-CG 3.85Å; F45-Y50 HydrophobicContact CD1-CG 3.85Å; F45-Y50 AromaticContact CD1-CZ 3.26Å; F45-Y50 AromaticContact CE1-CD1 3.07Å; F45-Y50 HydrophobicContact CE1-CD1 3.07Å; F45-Y50 AromaticContact CE1-CD2 3.4Å; F45-Y50 HydrophobicContact CE1-CD2 3.4Å; F45-Y50 VanDerWaalsContact CE1-CD2 3.4Å; F45-Y50 AromaticContact CE1-CE1 3.28Å; F45-Y50 HydrophobicContact CE1-CE1 3.28Å; F45-Y50 AromaticContact CE1-CE2 3.6Å; F45-Y50 HydrophobicContact CE1-CE2 3.6Å; F45-Y50 AromaticContact CE1-CG 3.12Å; F45-Y50 HydrophobicContact CE1-CG 3.12Å; F45-Y50 AromaticContact CE1-CZ 3.52Å; F45-Y50 HydrophobicContact CG-CE1 4.34Å; F45-Y50 VanDerWaalsContact CZ-CA 3.46Å; F45-Y50 AromaticContact CZ-CD1 3.63Å; F45-Y50 HydrophobicContact CZ-CD1 3.63Å; F45-Y50 AromaticContact CZ-CE1 3.95Å; F45-Y50 HydrophobicContact CZ-CE1 3.95Å; F45-Y50 AromaticContact CZ-CG 3.97Å; F45-Y50 HydrophobicContact CZ-CG 3.97Å; F45-A53 HydrophobicContact CZ-CB 4.2Å
46D89.7Confident84.5Confident101 Ų101119 Ų11954%0.5459%0.588SS.*PPolyproline II helixtrans-71.9150.1179.1-172.35.3000109.5Y44 G48 D49Y44-D46 PolarHBondContact O-N 2.88Å; D46-G48 PolarHBondContact O-N 3.05Å; D46-G48 VanDerWaalsContact O-N 3.09Å; D46-D49 PolarHBondContact N-OD2 2.95Å; D46-D49 VanDerWaalsContact N-OD2 3.13Å; D46-D49 WeakPolarHBondContact O-CB 3.39Å; D46-D49 PolarHBondContact O-N 3.08Å
47S92Very high83.6Confident87 Ų87117.1 Ų117.161%0.60859%0.593SS**Hα-helixtrans-48.7-32.4169620000113
48G93.9Very high82.6Confident31 Ų31117.3 Ų117.332%0.3261%0.606SS.*Hα-helixtrans-70-33.1174.100000114.4D46 Y50 N51D46-G48 PolarHBondContact O-N 3.05Å; D46-G48 VanDerWaalsContact O-N 3.09Å; G48-Y50 PolarHBondContact O-N 3.25Å; G48-N51 PolarHBondContact O-N 3.28Å
49D93Very high81.2Confident59 Ų59116.6 Ų116.632%0.31660%0.6SS.*Hα-helixtrans-64.8-28.1179.1-68.8-35.7000110.7F45 D46 N51 M52 A53F45-D49 HydrophobicContact CD1-CB 3.82Å; F45-D49 HydrophobicContact CD2-CB 3.83Å; F45-D49 HydrophobicContact CE1-CB 3.37Å; F45-D49 HydrophobicContact CE2-CB 3.45Å; F45-D49 VanDerWaalsContact CE2-CB 3.45Å; F45-D49 HydrophobicContact CG-CB 4.03Å; F45-D49 HydrophobicContact CZ-CB 3.24Å; F45-D49 VanDerWaalsContact CZ-O 3.29Å; F45-D49 WeakPolarHBondContact CZ-O 3.46Å; D46-D49 PolarHBondContact N-OD2 2.95Å; D46-D49 VanDerWaalsContact N-OD2 3.13Å; D46-D49 WeakPolarHBondContact O-CB 3.39Å; D46-D49 PolarHBondContact O-N 3.08Å; D49-N51 VanDerWaalsContact C-N 3.28Å; D49-N51 PolarHBondContact O-N 2.9Å; D49-M52 PolarHBondContact O-N 3.13Å; D49-A53 WeakPolarHBondContact O-CB 3.34Å; D49-A53 PolarHBondContact O-N 3.48Å
50Y93.1Very high80Confident131 Ų131120.4 Ų120.451%0.51461%0.606SS.*Hα-helixtrans-66.9-39.2-174.8-81.6-56.3000109.1F45 G48 A53 K54F45-Y50 AromaticContact CD1-CD1 3.78Å; F45-Y50 HydrophobicContact CD1-CD1 3.78Å; F45-Y50 AromaticContact CD1-CD2 3.67Å; F45-Y50 HydrophobicContact CD1-CD2 3.67Å; F45-Y50 AromaticContact CD1-CE1 3.49Å; F45-Y50 HydrophobicContact CD1-CE1 3.49Å; F45-Y50 VanDerWaalsContact CD1-CE1 3.49Å; F45-Y50 AromaticContact CD1-CE2 3.38Å; F45-Y50 HydrophobicContact CD1-CE2 3.38Å; F45-Y50 AromaticContact CD1-CG 3.85Å; F45-Y50 HydrophobicContact CD1-CG 3.85Å; F45-Y50 AromaticContact CD1-CZ 3.26Å; F45-Y50 AromaticContact CE1-CD1 3.07Å; F45-Y50 HydrophobicContact CE1-CD1 3.07Å; F45-Y50 AromaticContact CE1-CD2 3.4Å; F45-Y50 HydrophobicContact CE1-CD2 3.4Å; F45-Y50 VanDerWaalsContact CE1-CD2 3.4Å; F45-Y50 AromaticContact CE1-CE1 3.28Å; F45-Y50 HydrophobicContact CE1-CE1 3.28Å; F45-Y50 AromaticContact CE1-CE2 3.6Å; F45-Y50 HydrophobicContact CE1-CE2 3.6Å; F45-Y50 AromaticContact CE1-CG 3.12Å; F45-Y50 HydrophobicContact CE1-CG 3.12Å; F45-Y50 AromaticContact CE1-CZ 3.52Å; F45-Y50 HydrophobicContact CG-CE1 4.34Å; F45-Y50 VanDerWaalsContact CZ-CA 3.46Å; F45-Y50 AromaticContact CZ-CD1 3.63Å; F45-Y50 HydrophobicContact CZ-CD1 3.63Å; F45-Y50 AromaticContact CZ-CE1 3.95Å; F45-Y50 HydrophobicContact CZ-CE1 3.95Å; F45-Y50 AromaticContact CZ-CG 3.97Å; F45-Y50 HydrophobicContact CZ-CG 3.97Å; G48-Y50 PolarHBondContact O-N 3.25Å; Y50-A53 PolarHBondContact O-N 3Å; Y50-K54 VanDerWaalsContact O-CB 3.32Å; Y50-K54 WeakPolarHBondContact O-CB 3.41Å; Y50-K54 VanDerWaalsContact O-CG 3.28Å; Y50-K54 WeakPolarHBondContact O-CG 3.49Å; Y50-K54 PolarHBondContact O-N 2.77Å
51N89.3Confident79Confident112 Ų112120.8 Ų120.860%0.59961%0.614SS**Hα-helixtrans-67.4-40.4-179.6-65.1-20000110.8G48 D49 S55G48-N51 PolarHBondContact O-N 3.28Å; D49-N51 VanDerWaalsContact C-N 3.28Å; D49-N51 PolarHBondContact O-N 2.9Å; N51-S55 WeakPolarHBondContact O-CB 3.44Å; N51-S55 PolarHBondContact O-N 2.92Å; N51-S55 PolarHBondContact O-OG 2.82Å
52M87.4Confident77.6Confident106 Ų106118.1 Ų118.152%0.52261%0.606SS.*Hα-helixtrans-69.8-39.9176-68.6-179.65900112.7D49 S55 R56D49-M52 PolarHBondContact O-N 3.13Å; M52-S55 PolarHBondContact O-N 3.35Å; M52-S55 PolarHBondContact O-OG 3.46Å; M52-R56 VanDerWaalsContact O-CG 3.27Å; M52-R56 WeakPolarHBondContact O-CG 3.27Å; M52-R56 PolarHBondContact O-N 3.29Å
53A85.8Confident76.1Confident60 Ų60120.7 Ų120.750%0.49661%0.609SS.*Hα-helixtrans-68.4-37.5178.100000112F45 D49 Y50F45-A53 HydrophobicContact CZ-CB 4.2Å; D49-A53 WeakPolarHBondContact O-CB 3.34Å; D49-A53 PolarHBondContact O-N 3.48Å; Y50-A53 PolarHBondContact O-N 3Å
54K83.3Confident74.5Confident171 Ų171117.9 Ų117.974%0.74361%0.608SS**Hα-helixtrans-68.8-35.7174.9-77.4179.9175.9-176.80112.8Y50Y50-K54 VanDerWaalsContact O-CB 3.32Å; Y50-K54 WeakPolarHBondContact O-CB 3.41Å; Y50-K54 VanDerWaalsContact O-CG 3.28Å; Y50-K54 WeakPolarHBondContact O-CG 3.49Å; Y50-K54 PolarHBondContact O-N 2.77Å
55S80.4Confident72.7Confident86 Ų86113.6 Ų113.660%0.60161%0.608SS**Hα-helixtrans-82-16.9-176.569.90000113.9N51 M52 P57N51-S55 WeakPolarHBondContact O-CB 3.44Å; N51-S55 PolarHBondContact O-N 2.92Å; N51-S55 PolarHBondContact O-OG 2.82Å; M52-S55 PolarHBondContact O-N 3.35Å; M52-S55 PolarHBondContact O-OG 3.46Å; S55-P57 WeakPolarHBondContact O-CD 3.5Å; S55-P57 VanDerWaalsContact O-N 3.11Å
56R71Confident70.9Confident177 Ų177111.4 Ų111.467%0.66861%0.611SS**SBendtrans-64.5106.8164.3-67.5-82.9-145-98.7-0.4106.4M52 L58M52-R56 VanDerWaalsContact O-CG 3.27Å; M52-R56 WeakPolarHBondContact O-CG 3.27Å; M52-R56 PolarHBondContact O-N 3.29Å; R56-L58 PolarHBondContact O-N 3.45Å
57P61.9Low69Low95 Ų95113 Ų11362%0.61762%0.619SS**  trans-55.5141.1162.527.6-33000105.7S55 M59S55-P57 WeakPolarHBondContact O-CD 3.5Å; S55-P57 VanDerWaalsContact O-N 3.11Å; P57-M59 HydrophobicContact CB-CG 4.31Å; P57-M59 HydrophobicContact CG-CG 4.01Å; P57-M59 PolarHBondContact O-N 3.12Å
58L61.8Low66.9Low169 Ų169114.7 Ų114.789%0.88562%0.621SS**  trans-6761.8172.2-167.667.3000108.6R56 K60R56-L58 PolarHBondContact O-N 3.45Å; L58-K60 PolarHBondContact O-N 2.79Å
59M53.9Low65.2Low126 Ų126119.9 Ų119.962%0.62164%0.641SS**  trans-71.878.7162-75.9-81.3147.900104.9P57 D61 S62P57-M59 HydrophobicContact CB-CG 4.31Å; P57-M59 HydrophobicContact CG-CG 4.01Å; P57-M59 PolarHBondContact O-N 3.12Å; M59-D61 PolarHBondContact O-N 3.27Å; M59-S62 PolarHBondContact O-N 3.33Å
60K53.7Low63.6Low165 Ų165120.5 Ų120.572%0.71765%0.65SS**THydrogen-bonded Turntrans-52.9-16.6164.8-175.172.6178-162.90111L58L58-K60 PolarHBondContact O-N 2.79Å
61D53.8Low62Low139 Ų139116.9 Ų116.974%0.74364%0.643SS**THydrogen-bonded Turntrans-121.830.9-173.4-49.1-42.7000113.5M59M59-D61 PolarHBondContact O-N 3.27Å
62S47Very low61Low81 Ų81118.1 Ų118.157%0.56666%0.655SS**  trans-119.731.6166.7-54.10000113.4M59M59-S62 PolarHBondContact O-N 3.33Å
63F50.8Low60.3Low170 Ų170116.4 Ų116.475%0.74666%0.664SS**SBendtrans-54.6131.5131.4-68.3-77.9000105.3S65F63-S65 PolarHBondContact O-N 3.21Å
64P50.9Low59.8Low116 Ų116119.4 Ų119.475%0.75367%0.672SS**  trans-64.982.4161.130-32.4000106.4G66P64-G66 PolarHBondContact O-N 3.16Å; P64-G66 VanDerWaalsContact O-N 3.1Å
65S47.5Very low59.6Low113 Ų113115.7 Ų115.779%0.7966%0.663SS**  -68.343.8129.5-69.90000107.7F63 N67F63-S65 PolarHBondContact O-N 3.21Å; S65-N67 VanDerWaalsContact C-N 3.29Å; S65-N67 PolarHBondContact O-N 3.07Å
66G49.1Very low59.6Low45 Ų45118.4 Ų118.446%0.46467%0.669SS.*  trans-61.6110.6154.400000102.1P64 L68P64-G66 PolarHBondContact O-N 3.16Å; P64-G66 VanDerWaalsContact O-N 3.1Å; G66-L68 VanDerWaalsContact C-N 3.32Å; G66-L68 PolarHBondContact O-N 3.09Å
67N48.7Very low60.2Low133 Ų133113.7 Ų113.771%0.71166%0.662SS**  trans-29.9104163.8-88.5-62.9000107.6S65 D69S65-N67 VanDerWaalsContact C-N 3.29Å; S65-N67 PolarHBondContact O-N 3.07Å; N67-D69 WeakPolarHBondContact CB-OD2 3.47Å; N67-D69 PolarHBondContact O-N 2.78Å
68L49.2Very low61.4Low123 Ų123112.5 Ų112.564%0.64465%0.653SS**  trans-7552.5172.4-12487.5000106G66 S70G66-L68 VanDerWaalsContact C-N 3.32Å; G66-L68 PolarHBondContact O-N 3.09Å; L68-S70 CarbonylContact O-C 3.6Å; L68-S70 PolarHBondContact O-N 3.01Å; L68-S70 VanDerWaalsContact O-N 3.1Å
69D57.5Low62.6Low141 Ų141110.2 Ų110.275%0.75465%0.646SS**SBendtrans-68.2-5.8175.4-68.7-19.2000110.6N67N67-D69 WeakPolarHBondContact CB-OD2 3.47Å; N67-D69 PolarHBondContact O-N 2.78Å
70S60.1Low64.1Low72 Ų72109.8 Ų109.850%0.50365%0.646SS.*SBendtrans-125.8102.5155.667.50000109L68 T72L68-S70 CarbonylContact O-C 3.6Å; L68-S70 PolarHBondContact O-N 3.01Å; L68-S70 VanDerWaalsContact O-N 3.1Å; S70-T72 PolarHBondContact O-N 3.34Å; S70-T72 VanDerWaalsContact O-N 3.17Å
71P58.4Low65.5Low55 Ų55105.1 Ų105.136%0.35763%0.629SS.*  trans-47.6127162.516.9-30.4000108.9G73 D74P71-G73 PolarHBondContact O-N 3.23Å; P71-D74 HydrophobicContact CB-CB 4.49Å; P71-D74 WeakPolarHBondContact CB-OD2 3.2Å; P71-D74 HydrophobicContact CG-CB 3.77Å; P71-D74 VanDerWaalsContact CG-CG 3.44Å; P71-D74 WeakPolarHBondContact CG-OD2 3.41Å; P71-D74 PolarHBondContact O-N 3.42Å; P71-D74 VanDerWaalsContact O-N 3.12Å
72T68.8Low66.9Low138 Ų138101.7 Ų101.785%0.84761%0.61SS**THydrogen-bonded Turntrans-54.7102.6175.9-62.20000108S70S70-T72 PolarHBondContact O-N 3.34Å; S70-T72 VanDerWaalsContact O-N 3.17Å
73G72.2Confident68.6Low69 Ų69101.4 Ų101.471%0.71161%0.608SS**THydrogen-bonded Turntrans124.8-20.9178.700000116.4P71P71-G73 PolarHBondContact O-N 3.23Å
74D76.3Confident70.1Confident124 Ų12497.5 Ų97.566%0.66359%0.594SS**THydrogen-bonded Turntrans-86.8-22.6-170.8-67.1-4.6000113.7P71P71-D74 HydrophobicContact CB-CB 4.49Å; P71-D74 WeakPolarHBondContact CB-OD2 3.2Å; P71-D74 HydrophobicContact CG-CB 3.77Å; P71-D74 VanDerWaalsContact CG-CG 3.44Å; P71-D74 WeakPolarHBondContact CG-OD2 3.41Å; P71-D74 PolarHBondContact O-N 3.42Å; P71-D74 VanDerWaalsContact O-N 3.12Å
75T78.9Confident71.3Confident92 Ų9296.6 Ų96.656%0.56458%0.582SS**SBendtrans-100.4107.1177.9-51.50000110.4
76I80.8Confident72.7Confident143 Ų14399.4 Ų99.473%0.73358%0.575SS**PPolyproline II helixtrans-63.2129.6168.6-60.3177.9000108T78I76-T78 PolarHBondContact O-N 3.2Å; I76-T78 VanDerWaalsContact O-N 3.13Å
77P82.5Confident73.9Confident79 Ų79101.2 Ų101.251%0.51358%0.581SS.*PPolyproline II helixtrans-62.1118.4178.322.8-31.1000110.6I82 L85P77-I82 HydrophobicContact CB-CG1 4.13Å; P77-L85 HydrophobicContact CB-CD1 4.37Å
78T86.9Confident75Confident70 Ų70101.7 Ų101.743%0.42958%0.577SS.*PPolyproline II helixtrans-81.7158.6167.755.60000110.2I76 D80 N81 I82I76-T78 PolarHBondContact O-N 3.2Å; I76-T78 VanDerWaalsContact O-N 3.13Å; T78-D80 PolarHBondContact O-N 3.48Å; T78-D80 VanDerWaalsContact O-N 3.12Å; T78-N81 PolarHBondContact O-N 3.2Å; T78-N81 PolarHBondContact OG1-ND2 3.16Å; T78-I82 WeakPolarHBondContact O-CG1 3.46Å; T78-I82 PolarHBondContact O-N 3.04Å
79V87.7Confident75.9Confident120 Ų12099.5 Ų99.573%0.72757%0.572SS**THydrogen-bonded Turntrans-53.1-36.2-175.8-66.40000113.5
80D86.2Confident76.1Confident118 Ų11898.6 Ų98.663%0.63157%0.566SS**THydrogen-bonded Turntrans-75.2-26.5-179.6-53.9-54.2000113T78T78-D80 PolarHBondContact O-N 3.48Å; T78-D80 VanDerWaalsContact O-N 3.12Å
81N82.4Confident76Confident66 Ų6699.5 Ų99.535%0.35357%0.572SS.*Hα-helixtrans-88.1-15.9-172.7-70.4-8.3000113.4T78 S83 I84 L85T78-N81 PolarHBondContact O-N 3.2Å; T78-N81 PolarHBondContact OG1-ND2 3.16Å; N81-S83 PolarHBondContact O-N 3.5Å; N81-I84 PolarHBondContact O-N 3.19Å; N81-L85 WeakPolarHBondContact O-CG 3.43Å; N81-L85 PolarHBondContact O-N 3.22Å; N81-L85 VanDerWaalsContact O-N 3.14Å
82I82.5Confident75.8Confident68 Ų68104 Ų10435%0.34959%0.592SS.*Hα-helixtrans-65.4-42.5-173.5-66.1155.5000112.2P77 T78 L85 R86P77-I82 HydrophobicContact CB-CG1 4.13Å; T78-I82 WeakPolarHBondContact O-CG1 3.46Å; T78-I82 PolarHBondContact O-N 3.04Å; I82-L85 PolarHBondContact O-N 2.87Å; I82-R86 WeakPolarHBondContact O-CG 3.16Å; I82-R86 PolarHBondContact O-N 3.35Å; I82-R86 VanDerWaalsContact O-N 3.15Å
83S84.4Confident74.9Confident75 Ų75105.6 Ų105.652%0.52459%0.59SS.*Hα-helixtrans-62.4-44.2-179.457.10000111.2N81 L85 R86 S87N81-S83 PolarHBondContact O-N 3.5Å; S83-L85 PolarHBondContact O-N 3.37Å; S83-R86 PolarHBondContact O-N 3.42Å; S83-S87 PolarHBondContact O-N 2.93Å; S83-S87 PolarHBondContact O-OG 3.4Å
84I80.6Confident73.6Confident88 Ų88107.7 Ų107.745%0.45159%0.585SS.*Hα-helixtrans-64.2-42.3179.8-58.8165.8000110.9N81 S87 K88N81-I84 PolarHBondContact O-N 3.19Å; I84-S87 PolarHBondContact O-N 3.44Å; I84-K88 HydrophobicContact CG2-CD 4.37Å; I84-K88 WeakPolarHBondContact O-CG 3.44Å; I84-K88 PolarHBondContact O-N 3.38Å
85L77.4Confident72.2Confident96 Ų96109.8 Ų109.850%0.50360%0.597SS.*Hα-helixtrans-64.5-39.6178.3-69.8174.6000112.2P77 N81 I82 S83 K88 S89P77-L85 HydrophobicContact CB-CD1 4.37Å; N81-L85 WeakPolarHBondContact O-CG 3.43Å; N81-L85 PolarHBondContact O-N 3.22Å; N81-L85 VanDerWaalsContact O-N 3.14Å; I82-L85 PolarHBondContact O-N 2.87Å; S83-L85 PolarHBondContact O-N 3.37Å; L85-K88 PolarHBondContact O-N 3.03Å; L85-S89 PolarHBondContact O-N 3.45Å
86R77.1Confident70.5Confident172 Ų172111.9 Ų111.965%0.64961%0.609SS**Hα-helixtrans-63.9-42.6177.2-74.5178.8128.8144.5-0.3112.7I82 S83 K88 S89 I90I82-R86 WeakPolarHBondContact O-CG 3.16Å; I82-R86 PolarHBondContact O-N 3.35Å; I82-R86 VanDerWaalsContact O-N 3.15Å; S83-R86 PolarHBondContact O-N 3.42Å; R86-K88 VanDerWaalsContact C-N 3.31Å; R86-K88 PolarHBondContact O-N 2.67Å; R86-S89 PolarHBondContact O-N 3.18Å; R86-S89 PolarHBondContact O-OG 3.21Å; R86-S89 VanDerWaalsContact O-OG 3.08Å; R86-I90 WeakPolarHBondContact O-CG1 3.41Å; R86-I90 PolarHBondContact O-N 2.96Å
87S73.8Confident68.3Low84 Ų84111 Ų11159%0.58761%0.611SS**Hα-helixtrans-65.3-35.4179.1-60.20000112.4S83 I84 S89 I90S83-S87 PolarHBondContact O-N 2.93Å; S83-S87 PolarHBondContact O-OG 3.4Å; I84-S87 PolarHBondContact O-N 3.44Å; S87-S89 PolarHBondContact O-N 2.86Å; S87-I90 PolarHBondContact O-N 3.27Å
88K71.6Confident66.2Low142 Ų142114.3 Ų114.362%0.61763%0.629SS**Hα-helixtrans-65.4-36178.1-71.7175178.2-172.30112.9I84 L85 R86I84-K88 HydrophobicContact CG2-CD 4.37Å; I84-K88 WeakPolarHBondContact O-CG 3.44Å; I84-K88 PolarHBondContact O-N 3.38Å; L85-K88 PolarHBondContact O-N 3.03Å; R86-K88 VanDerWaalsContact C-N 3.31Å; R86-K88 PolarHBondContact O-N 2.67Å
89S67.7Low63.6Low78 Ų78115.2 Ų115.255%0.54564%0.638SS.*Hα-helixtrans-76.4-30.1179.767.90000113.5L85 R86 S87L85-S89 PolarHBondContact O-N 3.45Å; R86-S89 PolarHBondContact O-N 3.18Å; R86-S89 PolarHBondContact O-OG 3.21Å; R86-S89 VanDerWaalsContact O-OG 3.08Å; S87-S89 PolarHBondContact O-N 2.86Å
90I63Low61.9Low121 Ų121116.1 Ų116.162%0.62165%0.647SS**Hα-helixtrans-78.4-29.5-174-66.5167.8000112.2R86 S87 L92 Q93R86-I90 WeakPolarHBondContact O-CG1 3.41Å; R86-I90 PolarHBondContact O-N 2.96Å; S87-I90 PolarHBondContact O-N 3.27Å; I90-L92 PolarHBondContact O-N 3.4Å; I90-Q93 PolarHBondContact O-N 3.2Å
91S58Low59.2Low91 Ų91119.1 Ų119.164%0.63666%0.657SS**THydrogen-bonded Turntrans-68.4-3.3-179.3-170.80000114.8
92L53.3Low57Low150 Ų150120.8 Ų120.879%0.78567%0.674SS**THydrogen-bonded Turntrans-93.50.5179-75.8164000113.8I90I90-L92 PolarHBondContact O-N 3.4Å
93Q49Very low55Low171 Ų171124.3 Ų124.380%0.79970%0.699SS**SBendtrans-13670.5-176.6-66.6-17617.600112.8I90I90-Q93 PolarHBondContact O-N 3.2Å
94N46.5Very low52.5Low114 Ų114127 Ų12761%0.6171%0.712SS**  trans-162.864.3166.943-15.2000109.3
95N45.6Very low50.1Low168 Ų168126.3 Ų126.390%0.89872%0.72SS**  trans-155.352.4157.1-92.4-10000109.5
96T43.1Very low47.8Very low135 Ų135127.5 Ų127.583%0.82873%0.734SS**  trans-134.644.3173.3-20.30000111.3
97T35Very low45.7Very low125 Ų125124.9 Ų124.977%0.76774%0.738SS**  trans-156.576.1163.1-39.80000109.6
98V38.8Very low44Very low149 Ų149126.1 Ų126.190%0.90374%0.742SS**  trans-103.1100.7151.5-75.50000106.9
99S33Very low42.8Very low89 Ų89124.7 Ų124.762%0.62275%0.747SS**  trans-52.9146.3171.1-59.80000110.9Q101S99-Q101 PolarHBondContact O-N 3.42Å; S99-Q101 VanDerWaalsContact O-N 3.08Å
100P50.4Low41.3Very low139 Ų139126.9 Ų126.990%0.90376%0.757SS**  trans-75.4101.8-179.930.6-30.8000108.7
101Q30.5Very low40.4Very low180 Ų180125.4 Ų125.484%0.84176%0.758SS**  trans-144.689.2174.1-157.8174.519.600110.6S99S99-Q101 PolarHBondContact O-N 3.42Å; S99-Q101 VanDerWaalsContact O-N 3.08Å
102S34.8Very low39.6Very low102 Ų102126.8 Ų126.871%0.71376%0.763SS**  -175.4111.1124.754.50000108.3T104S102-T104 PolarHBondContact O-N 3.47Å
103T41.5Very low39.2Very low141 Ų141124.2 Ų124.287%0.86576%0.757SS**  trans-32.5115.1156.547.10000111.9
104T32Very low38.7Very low132 Ų132121.4 Ų121.481%0.8175%0.752SS**  trans-140.9127.5146.4-53.40000107.4S102S102-T104 PolarHBondContact O-N 3.47Å
105A30.7Very low38.8Very low74 Ų74119.8 Ų119.861%0.61275%0.754SS**  trans-27138.7-174.300000116.2T107A105-T107 VanDerWaalsContact C-N 3.34Å; A105-T107 PolarHBondContact O-N 2.95Å; A105-T107 PolarHBondContact O-OG1 3.1Å
106C29.2Very low38.8Very low120 Ų120116.7 Ų116.781%0.81174%0.741SS**  trans-34.5101.4143.5174.50000109.6
107T32.6Very low39.3Very low118 Ų118116 Ų11672%0.72474%0.737SS**  trans-119.999.6155.719.20000104A105 P109A105-T107 VanDerWaalsContact C-N 3.34Å; A105-T107 PolarHBondContact O-N 2.95Å; A105-T107 PolarHBondContact O-OG1 3.1Å; T107-P109 WeakPolarHBondContact O-CD 3.29Å; T107-P109 VanDerWaalsContact O-N 3.15Å
108T37.5Very low40.3Very low110 Ų110115.1 Ų115.168%0.67573%0.732SS**  trans-48.3112.815626.30000107.9T110T108-T110 PolarHBondContact O-N 3.24Å
109P45.9Very low40.7Very low111 Ų111112.5 Ų112.572%0.72172%0.719SS**  trans-72.995155.330.9-26.2000105.6T107 S111T107-P109 WeakPolarHBondContact O-CD 3.29Å; T107-P109 VanDerWaalsContact O-N 3.15Å; P109-S111 PolarHBondContact O-N 3.25Å
110T37.1Very low42Very low124 Ų124113.1 Ų113.176%0.76172%0.724SS**  trans-6275.9148.1-52.50000106.6T108T108-T110 PolarHBondContact O-N 3.24Å
111S44.2Very low43.1Very low90 Ų90116.9 Ų116.963%0.62972%0.721SS**  trans-109.393158.670.10000105.8P109 S113P109-S111 PolarHBondContact O-N 3.25Å; S111-S113 PolarHBondContact O-N 3.44Å
112T39.9Very low44.9Very low121 Ų121115.3 Ų115.374%0.74272%0.717SS**  trans-60.774.1162.5-44.60000107.9
113S44.9Very low46.8Very low95 Ų95116.6 Ų116.666%0.66472%0.721SS**  trans-97.387163.1-178.10000105.6S111 A115S111-S113 PolarHBondContact O-N 3.44Å; S113-A115 PolarHBondContact O-N 3.16Å
114T40.3Very low48.4Very low112 Ų112116.9 Ų116.969%0.68772%0.716SS**  trans-61.676.4167.1-39.90000107.7T116T114-T116 PolarHBondContact O-N 2.92Å
115A47Very low50Low80 Ų80115.9 Ų115.966%0.66171%0.711SS**  trans-74.883.6165.800000105.6S113 T117S113-A115 PolarHBondContact O-N 3.16Å; A115-T117 PolarHBondContact O-N 3.47Å
116T45.9Very low52.1Low103 Ų103116.9 Ų116.963%0.63272%0.72SS**  trans-56.991.8171-540000107.7T114 T118T114-T116 PolarHBondContact O-N 2.92Å; T116-T118 WeakPolarHBondContact CG2-OG1 3.14Å; T116-T118 PolarHBondContact O-N 3.46Å
117T53.4Low54.3Low120 Ų120121.6 Ų121.674%0.73672%0.721SS**  trans-75.784.7161.9-64.30000105.3A115 C119A115-T117 PolarHBondContact O-N 3.47Å; T117-C119 PolarHBondContact O-N 3.36Å
118T56.4Low56.1Low107 Ų107122.2 Ų122.266%0.65672%0.724SS**  trans-67.3102.9167.3-76.70000106.8T116 S120T116-T118 WeakPolarHBondContact CG2-OG1 3.14Å; T116-T118 PolarHBondContact O-N 3.46Å; T118-S120 PolarHBondContact O-N 3.18Å
119C47.2Very low57.8Low95 Ų95124.6 Ų124.664%0.64273%0.728SS**  trans-72.898.2163.4-60.60000107.6T117 Y121T117-C119 PolarHBondContact O-N 3.36Å; C119-Y121 PolarHBondContact O-N 3.46Å
120S61.4Low58.7Low102 Ų102125.7 Ų125.771%0.71373%0.732SS**  trans-75105.5166.638.60000108.8T118 I122T118-S120 PolarHBondContact O-N 3.18Å; S120-I122 PolarHBondContact O-N 3.11Å
121Y72.1Confident59.5Low217 Ų217124.3 Ų124.385%0.85173%0.734SS**  trans-68124.2163.8-91-90.6000108.6C119C119-Y121 PolarHBondContact O-N 3.46Å
122I69.1Low60.5Low148 Ų148133.3 Ų133.376%0.75976%0.761SS**  trans-86.6112.8166.1-64.5172.8000106.9S120 I124S120-I122 PolarHBondContact O-N 3.11Å; I122-I124 PolarHBondContact O-N 3.18Å
123T75.2Confident61.5Low129 Ų129133.9 Ų133.979%0.79176%0.762SS**PPolyproline II helixtrans-77118.2170.1-590000109
124I73.8Confident62.4Low146 Ų146135.9 Ų135.975%0.74977%0.767SS**PPolyproline II helixtrans-86.9124.5173.5-54175.1000107.8I122I122-I124 PolarHBondContact O-N 3.18Å
125P66.7Low63.6Low111 Ų111137.3 Ų137.372%0.72177%0.772SS**PPolyproline II helixtrans-67.4140.8179.326.3-32.8000111.7R127P125-R127 PolarHBondContact O-N 3.41Å
126A74.8Confident64.6Low96 Ų96140.6 Ų140.679%0.79378%0.778SS**PPolyproline II helixtrans-62.6126177.900000110.7T128A126-T128 PolarHBondContact O-N 3.25Å
127R75.2Confident65.8Low219 Ų219143 Ų14383%0.82679%0.787SS**  trans-77.799.3174.7-176.7175.9179165.90109.2P125 Q129P125-R127 PolarHBondContact O-N 3.41Å; R127-Q129 PolarHBondContact O-N 3.37Å
128T70.3Confident66.6Low130 Ų130144.5 Ų144.580%0.79879%0.791SS**PPolyproline II helixtrans-67.7122.2170.2-9.70000109.4A126A126-T128 PolarHBondContact O-N 3.25Å
129Q73.8Confident67.3Low160 Ų160147.2 Ų147.275%0.74880%0.8SS**PPolyproline II helixtrans-80.3126168.2-67.9-82.821.400108R127 A131R127-Q129 PolarHBondContact O-N 3.37Å; Q129-A131 PolarHBondContact O-N 3.42Å
130V63.4Low68.9Low134 Ų134151.2 Ų151.281%0.81281%0.813SS**PPolyproline II helixtrans-72.4123.3176.5175.70000108.2K132V130-K132 PolarHBondContact O-N 3.11Å
131A55.5Low69.5Low96 Ų96155.3 Ų155.379%0.79382%0.821SS**PPolyproline II helixtrans-58.8131.5170.700000110Q129Q129-A131 PolarHBondContact O-N 3.42Å
132K64.1Low69.3Low278 Ų278149.7 Ų149.7100%1.20982%0.818SS**  trans-119.80156.6-89.6-176.1175.81760107.8V130V130-K132 PolarHBondContact O-N 3.11Å

Retrieved 132 of 132 residues in 32.8 ms (Link to these results)