G4M005_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4M005, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 129 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
1M39.2Very low65.1Low247 Ų247138.5 Ų138.5100%1.21773%0.726SS**  099.30-69.9176.1-17800106.9
2T47.8Very low65.7Low136 Ų136135.8 Ų135.883%0.83472%0.723SS**  trans-89.4106175.842.70000106.9E4T2-E4 PolarHBondContact O-N 3.14Å
3A60.8Low66.5Low88 Ų88130.2 Ų130.273%0.72772%0.717SS**  trans-64.1118.1169.500000107.2V5A3-V5 PolarHBondContact O-N 3.14Å
4E59.2Low67.4Low194 Ų194123.7 Ų123.791%0.90770%0.695SS**  trans-66.8100.4171.8-63.4-168.4148.700107.2T2 E6T2-E4 PolarHBondContact O-N 3.14Å; E4-E6 PolarHBondContact O-N 3.17Å; E4-E6 VanDerWaalsContact O-N 3.17Å
5V65.9Low68.5Low85 Ų85124.6 Ų124.652%0.51569%0.691SS.*  trans-74.6104.8175.7179.40000106.4A3 I7A3-V5 PolarHBondContact O-N 3.14Å; V5-I7 WeakPolarHBondContact O-CG1 3.26Å; V5-I7 PolarHBondContact O-N 2.94Å
6E67.8Low69.3Low179 Ų179122.1 Ų122.184%0.83668%0.676SS**  trans-56.3112.3168.8-173.6176.4176.200108.2E4 N8E4-E6 PolarHBondContact O-N 3.17Å; E4-E6 VanDerWaalsContact O-N 3.17Å; E6-N8 PolarHBondContact O-N 3.43Å
7I70.4Confident70.2Confident139 Ų139116.9 Ų116.971%0.71365%0.65SS**  trans-76.995.6-172.1-55.4176.4000108.3V5 P9V5-I7 WeakPolarHBondContact O-CG1 3.26Å; V5-I7 PolarHBondContact O-N 2.94Å; I7-P9 WeakPolarHBondContact O-CD 3.35Å
8N71.3Confident71.2Confident69 Ų69118.9 Ų118.937%0.36965%0.651SS.*BIsolated β-bridgetrans-77118.9169.1-176-25.6000109.1E6 F10 R11E6-N8 PolarHBondContact O-N 3.43Å; N8-F10 PolarHBondContact O-N 2.81Å; N8-F10 VanDerWaalsContact O-N 3.11Å; N8-F10 WeakPolarHBondContact OD1-CB 3.1Å; N8-F10 PolarHBondContact OD1-N 2.86Å; N8-R11 HydrophobicContact CB-CB 4.32Å; N8-R11 CarbonylContact O-C 3.05Å; N8-R11 PolarHBondContact O-N 2.83Å
9P80.7Confident72Confident109 Ų109120 Ų12071%0.70865%0.651SS**THydrogen-bonded Turntrans-63.6-19.9-178.225.5-34000113.5I7I7-P9 WeakPolarHBondContact O-CD 3.35Å
10F76.8Confident72.7Confident185 Ų185116.8 Ų116.881%0.81164%0.635SS**THydrogen-bonded Turntrans-87.8-13.6175-58.1-74000113N8N8-F10 PolarHBondContact O-N 2.81Å; N8-F10 VanDerWaalsContact O-N 3.11Å; N8-F10 WeakPolarHBondContact OD1-CB 3.1Å; N8-F10 PolarHBondContact OD1-N 2.86Å
11R75.8Confident73.3Confident93 Ų93113.9 Ų113.935%0.35162%0.619SS.*BIsolated β-bridgetrans-147.476.3-177.1-67-173.4171.6-97.5-9.7110.1N8 G13 G14 E15 L16N8-R11 HydrophobicContact CB-CB 4.32Å; N8-R11 CarbonylContact O-C 3.05Å; N8-R11 PolarHBondContact O-N 2.83Å; R11-G13 PolarHBondContact O-N 2.92Å; R11-G13 VanDerWaalsContact O-N 3.15Å; R11-G14 PolarHBondContact O-N 2.86Å; R11-E15 VanDerWaalsContact CD-O 3.27Å; R11-E15 WeakPolarHBondContact CD-O 3.4Å; R11-E15 PolarHBondContact NH1-O 2.96Å; R11-E15 VanDerWaalsContact NH1-O 3.09Å; R11-L16 PolarHBondContact NH1-O 2.78Å
12P72.4Confident75.6Confident106 Ų106104.7 Ų104.769%0.68858%0.575SS**THydrogen-bonded Turntrans-64-22.6-174.224.5-33.9000113.5G14P12-G14 VanDerWaalsContact C-N 3.3Å
13G76.7Confident77.4Confident62 Ų62102.6 Ų102.664%0.63956%0.558SS**THydrogen-bonded Turntrans-81.4-3.7174.700000114.7R11 E15R11-G13 PolarHBondContact O-N 2.92Å; R11-G13 VanDerWaalsContact O-N 3.15Å; G13-E15 PolarHBondContact O-N 3.26Å; G13-E15 VanDerWaalsContact O-N 3.1Å
14G79.2Confident78.6Confident40 Ų40102 Ų10241%0.41254%0.542SS..  trans64.39.4-174.300000114.2R11 P12R11-G14 PolarHBondContact O-N 2.86Å; P12-G14 VanDerWaalsContact C-N 3.3Å
15E83.1Confident79.8Confident137 Ų13799.3 Ų99.364%0.6453%0.527SS*.PPolyproline II helixtrans-70.5137.6-17763.1-179.4-164.500111.5R11 G13R11-E15 VanDerWaalsContact CD-O 3.27Å; R11-E15 WeakPolarHBondContact CD-O 3.4Å; R11-E15 PolarHBondContact NH1-O 2.96Å; R11-E15 VanDerWaalsContact NH1-O 3.09Å; G13-E15 PolarHBondContact O-N 3.26Å; G13-E15 VanDerWaalsContact O-N 3.1Å
16L81.8Confident80.6Confident84 Ų84101.5 Ų101.544%0.4454%0.536SS..PPolyproline II helixtrans-68.1161174.1-60.4175000109.8R11 V20 L24R11-L16 PolarHBondContact NH1-O 2.78Å; L16-V20 HydrophobicContact CB-CB 4.1Å; L16-V20 HydrophobicContact CB-CG1 3.97Å; L16-V20 HydrophobicContact CD1-CG1 3.78Å; L16-V20 HydrophobicContact CD2-CG1 4.26Å; L16-V20 HydrophobicContact CG-CG1 4.21Å; L16-L24 HydrophobicContact CD1-CD1 3.43Å; L16-L24 VanDerWaalsContact CD1-CD1 3.43Å
17S84.1Confident80.9Confident35 Ų3595.1 Ų95.125%0.24551%0.511CS..PPolyproline II helixtrans-66.7152.8170.564.60000109.4E19 V20 D21S17-E19 PolarHBondContact O-N 2.92Å; S17-E19 VanDerWaalsContact O-N 3.11Å; S17-V20 PolarHBondContact O-N 3.35Å; S17-V20 VanDerWaalsContact OG-CG2 3.29Å; S17-V20 WeakPolarHBondContact OG-CG2 3.22Å; S17-V20 PolarHBondContact OG-N 3.09Å; S17-D21 PolarHBondContact O-N 3.14Å
18K87.8Confident81.1Confident153 Ų15394.8 Ų94.867%0.66552%0.516SS*.Hα-helixtrans-49.9-40175.7-179.4-176.9179.3-62.90112.2D21 D22K18-D21 PolarHBondContact O-N 3.38Å; K18-D22 IonicContact NZ-OD1 2.67Å; K18-D22 IonicContact NZ-OD2 3.99Å; K18-D22 PolarHBondContact NZ-OD2 2.68Å; K18-D22 WeakPolarHBondContact O-CB 3.37Å; K18-D22 PolarHBondContact O-N 2.86Å
19E86.8Confident81Confident139 Ų13996.9 Ų96.965%0.6553%0.526SS*.Hα-helixtrans-61.2-46.1177.5-179.9178.5-164.200112.2S17 D22 I23S17-E19 PolarHBondContact O-N 2.92Å; S17-E19 VanDerWaalsContact O-N 3.11Å; E19-D22 PolarHBondContact O-N 3.5Å; E19-I23 HydrophobicContact CG-CD1 4.14Å; E19-I23 VanDerWaalsContact O-CG1 3.26Å; E19-I23 WeakPolarHBondContact O-CG1 3.46Å; E19-I23 PolarHBondContact O-N 3.25Å
20V86.6Confident80.4Confident55 Ų5594.8 Ų94.833%0.33351%0.514SS..Hα-helixtrans-67.1-40.8178.3175.30000110.5L16 S17 D22 I23 L24L16-V20 HydrophobicContact CB-CB 4.1Å; L16-V20 HydrophobicContact CB-CG1 3.97Å; L16-V20 HydrophobicContact CD1-CG1 3.78Å; L16-V20 HydrophobicContact CD2-CG1 4.26Å; L16-V20 HydrophobicContact CG-CG1 4.21Å; S17-V20 PolarHBondContact O-N 3.35Å; S17-V20 VanDerWaalsContact OG-CG2 3.29Å; S17-V20 WeakPolarHBondContact OG-CG2 3.22Å; S17-V20 PolarHBondContact OG-N 3.09Å; V20-D22 VanDerWaalsContact C-N 3.32Å; V20-D22 PolarHBondContact O-N 3.3Å; V20-I23 PolarHBondContact O-N 3.4Å; V20-L24 HydrophobicContact CG1-CD1 4.22Å; V20-L24 HydrophobicContact CG1-CG 4.48Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.31Å
21D85.6Confident80Confident57 Ų5794 Ų9431%0.30551%0.505SS..Hα-helixtrans-60.7-42.3173.9-80.5-32000112.1S17 K18 L24 K25S17-D21 PolarHBondContact O-N 3.14Å; K18-D21 PolarHBondContact O-N 3.38Å; D21-L24 PolarHBondContact O-N 2.85Å; D21-K25 WeakPolarHBondContact O-CB 3.29Å; D21-K25 VanDerWaalsContact O-CG 3.23Å; D21-K25 WeakPolarHBondContact O-CG 3.29Å; D21-K25 PolarHBondContact O-N 3.26Å
22D86.8Confident79.7Confident54 Ų5494 Ų9429%0.28951%0.513SS..Hα-helixtrans-65.1-41.6177.4-71.4-18.7000110.6K18 E19 V20 K25 N26K18-D22 IonicContact NZ-OD1 2.67Å; K18-D22 IonicContact NZ-OD2 3.99Å; K18-D22 PolarHBondContact NZ-OD2 2.68Å; K18-D22 WeakPolarHBondContact O-CB 3.37Å; K18-D22 PolarHBondContact O-N 2.86Å; E19-D22 PolarHBondContact O-N 3.5Å; V20-D22 VanDerWaalsContact C-N 3.32Å; V20-D22 PolarHBondContact O-N 3.3Å; D22-K25 PolarHBondContact O-N 3.41Å; D22-N26 VanDerWaalsContact O-CB 3.22Å; D22-N26 WeakPolarHBondContact O-CB 3.23Å; D22-N26 PolarHBondContact O-N 3.48Å; D22-N26 PolarHBondContact O-ND2 3.22Å; D22-N26 VanDerWaalsContact O-ND2 3.09Å
23I86.7Confident79.4Confident92 Ų9291 Ų9147%0.47249%0.492SS..Hα-helixtrans-60-48.9173-69163.9000109.9E19 V20 K25 N26 S27E19-I23 HydrophobicContact CG-CD1 4.14Å; E19-I23 VanDerWaalsContact O-CG1 3.26Å; E19-I23 WeakPolarHBondContact O-CG1 3.46Å; E19-I23 PolarHBondContact O-N 3.25Å; V20-I23 PolarHBondContact O-N 3.4Å; I23-K25 VanDerWaalsContact C-N 3.34Å; I23-K25 PolarHBondContact O-N 2.89Å; I23-N26 PolarHBondContact O-N 3.4Å; I23-S27 WeakPolarHBondContact O-CA 3.37Å; I23-S27 WeakPolarHBondContact O-CB 3.19Å; I23-S27 PolarHBondContact O-N 2.96Å; I23-S27 PolarHBondContact O-OG 2.67Å
24L84Confident79.1Confident74 Ų7491.8 Ų91.839%0.38748%0.481SS..Hα-helixtrans-64.3-37.4-179.6-71.8174.2000112.4L16 V20 D21 R31L16-L24 HydrophobicContact CD1-CD1 3.43Å; L16-L24 VanDerWaalsContact CD1-CD1 3.43Å; V20-L24 HydrophobicContact CG1-CD1 4.22Å; V20-L24 HydrophobicContact CG1-CG 4.48Å; V20-L24 WeakPolarHBondContact O-CG 3.47Å; V20-L24 PolarHBondContact O-N 3.31Å; D21-L24 PolarHBondContact O-N 2.85Å; L24-R31 PolarHBondContact O-NH2 3.46Å
25K84.4Confident78.6Confident138 Ų13896.6 Ų96.660%0.650%0.496SS*.Hα-helixtrans-68.8-40.5176.8-74.9169.5-1731690112.2D21 D22 I23D21-K25 WeakPolarHBondContact O-CB 3.29Å; D21-K25 VanDerWaalsContact O-CG 3.23Å; D21-K25 WeakPolarHBondContact O-CG 3.29Å; D21-K25 PolarHBondContact O-N 3.26Å; D22-K25 PolarHBondContact O-N 3.41Å; I23-K25 VanDerWaalsContact C-N 3.34Å; I23-K25 PolarHBondContact O-N 2.89Å
26N83Confident78.1Confident131 Ų13194.1 Ų94.170%0.70149%0.486SS*.Hα-helixtrans-89.4-14.4-176.9-61.6-28.1000113.2D22 I23 T28D22-N26 VanDerWaalsContact O-CB 3.22Å; D22-N26 WeakPolarHBondContact O-CB 3.23Å; D22-N26 PolarHBondContact O-N 3.48Å; D22-N26 PolarHBondContact O-ND2 3.22Å; D22-N26 VanDerWaalsContact O-ND2 3.09Å; I23-N26 PolarHBondContact O-N 3.4Å; N26-T28 PolarHBondContact O-N 2.9Å
27S75.5Confident77.5Confident45 Ų4595.6 Ų95.632%0.31549%0.494SS..  trans-66.7133177-73.40000110.3I23 I29I23-S27 WeakPolarHBondContact O-CA 3.37Å; I23-S27 WeakPolarHBondContact O-CB 3.19Å; I23-S27 PolarHBondContact O-N 2.96Å; I23-S27 PolarHBondContact O-OG 2.67Å; S27-I29 PolarHBondContact O-N 3.4Å; S27-I29 VanDerWaalsContact O-N 3.15Å
28T73.4Confident77.1Confident133 Ų13397.2 Ų97.282%0.81650%0.5SS*.  trans-78.114.8171.8-32.30000112.3N26 S30N26-T28 PolarHBondContact O-N 2.9Å; T28-S30 PolarHBondContact O-N 3.11Å; T28-S30 VanDerWaalsContact O-N 3.11Å
29I70.4Confident76.2Confident112 Ų11294.8 Ų94.857%0.57450%0.5SS*.  trans-62.6119.3177-165.6165.1000108S27 R31S27-I29 PolarHBondContact O-N 3.4Å; S27-I29 VanDerWaalsContact O-N 3.15Å; I29-R31 PolarHBondContact O-N 3.41Å
30S66.8Low75.6Confident65 Ų6592.3 Ų92.346%0.45550%0.503SS..  trans-63.5105.8174.3178.60000107.5T28 D32 T33T28-S30 PolarHBondContact O-N 3.11Å; T28-S30 VanDerWaalsContact O-N 3.11Å; S30-D32 PolarHBondContact O-N 3.34Å; S30-T33 WeakPolarHBondContact CB-OG1 3.44Å; S30-T33 PolarHBondContact O-N 2.59Å; S30-T33 PolarHBondContact OG-OG1 3.09Å
31R70Confident74.7Confident169 Ų16995.1 Ų95.164%0.63852%0.516SS*.THydrogen-bonded Turntrans-59-18.9179.7-67.8-171.7171.582.86.3112.4L24 I29L24-R31 PolarHBondContact O-NH2 3.46Å; I29-R31 PolarHBondContact O-N 3.41Å
32D68.3Low73.7Confident94 Ų9499.5 Ų99.550%0.50353%0.528SS..THydrogen-bonded Turntrans-98.64-175.6-68.7-19.4000113.4S30 N57S30-D32 PolarHBondContact O-N 3.34Å; D32-N57 VanDerWaalsContact C-OD1 3.26Å; D32-N57 WeakPolarHBondContact CA-OD1 3.3Å; D32-N57 WeakPolarHBondContact CB-OD1 3.43Å; D32-N57 PolarHBondContact O-N 2.73Å; D32-N57 PolarHBondContact O-OD1 3.28Å; D32-N57 PolarHBondContact OD1-OD1 3.39Å
33T65.7Low72.3Confident41 Ų41105.9 Ų105.925%0.25255%0.548SS..EExtended strand (participates in β ladder)trans-103.1105.4179.2-63.60000110.1S30 I35 I54S30-T33 WeakPolarHBondContact CB-OG1 3.44Å; S30-T33 PolarHBondContact O-N 2.59Å; S30-T33 PolarHBondContact OG-OG1 3.09Å; T33-I35 HydrophobicContact CG2-CG1 4.09Å; T33-I54 HydrophobicContact CG2-CB 4.22Å; T33-I54 HydrophobicContact CG2-CD1 4.09Å; T33-I54 HydrophobicContact CG2-CG1 3.87Å; T33-I54 HydrophobicContact CG2-CG2 3.62Å
34I70.7Confident71Confident79 Ų79106.5 Ų106.541%0.40557%0.567SS.*EExtended strand (participates in β ladder)trans-78.3120.2170-53.6177000107.9I36I34-I36 HydrophobicContact CG2-CD1 4.31Å; I34-I36 HydrophobicContact CG2-CG1 3.71Å
35I69.9Low69.4Low142 Ų142109.4 Ų109.473%0.72858%0.583SS**EExtended strand (participates in β ladder)trans-101.8102.4172.7-56.1175.9000107.8T33T33-I35 HydrophobicContact CG2-CG1 4.09Å
36I72.5Confident67.7Low85 Ų85106.6 Ų106.644%0.43659%0.593SS.*  trans-90108.3177.1-52.8176.4000109I34 D38 L41 I55I34-I36 HydrophobicContact CG2-CD1 4.31Å; I34-I36 HydrophobicContact CG2-CG1 3.71Å; I36-D38 VanDerWaalsContact C-N 3.3Å; I36-D38 HydrophobicContact CG2-CB 3.82Å; I36-D38 PolarHBondContact O-N 3.5Å; I36-L41 HydrophobicContact CB-CD1 4.38Å; I36-L41 HydrophobicContact CD1-CD1 4.48Å; I36-L41 HydrophobicContact CG2-CD1 3.6Å; I36-I55 HydrophobicContact CD1-CD1 3.95Å
37N69.4Low65.9Low115 Ų115106.5 Ų106.562%0.61559%0.593SS**  trans-95.247.8175.2-17040.7000111.6P39 R42N37-P39 WeakPolarHBondContact O-CD 3.27Å; N37-R42 PolarHBondContact OD1-NH1 2.9Å
38D74.2Confident64.7Low69 Ų69108.7 Ų108.737%0.36961%0.614SS.*  trans-86.2119.5175.6-175.3-12000109.4I36 A40 L41 R42I36-D38 VanDerWaalsContact C-N 3.3Å; I36-D38 HydrophobicContact CG2-CB 3.82Å; I36-D38 PolarHBondContact O-N 3.5Å; D38-A40 PolarHBondContact O-N 3.15Å; D38-A40 VanDerWaalsContact O-N 3.15Å; D38-A40 VanDerWaalsContact OD1-CB 3.3Å; D38-A40 WeakPolarHBondContact OD1-CB 2.92Å; D38-A40 PolarHBondContact OD1-N 2.67Å; D38-L41 HydrophobicContact CB-CB 4.17Å; D38-L41 HydrophobicContact CB-CD1 3.93Å; D38-L41 HydrophobicContact CB-CG 4Å; D38-L41 PolarHBondContact O-N 3.11Å; D38-R42 WeakPolarHBondContact O-CG 2.94Å; D38-R42 PolarHBondContact O-N 3.12Å
39P68.9Low63.5Low102 Ų102108 Ų10866%0.66261%0.609SS**G310 helixtrans-51.6-33.2173.7-25.534.8000113.7N37 L41 R42N37-P39 WeakPolarHBondContact O-CD 3.27Å; P39-L41 VanDerWaalsContact C-N 3.26Å; P39-L41 PolarHBondContact O-N 3.26Å; P39-R42 PolarHBondContact O-N 3Å
40A75.8Confident62.3Low86 Ų86105.3 Ų105.371%0.71160%0.6SS**G310 helixtrans-69.3-23.4178.800000113.1D38D38-A40 PolarHBondContact O-N 3.15Å; D38-A40 VanDerWaalsContact O-N 3.15Å; D38-A40 VanDerWaalsContact OD1-CB 3.3Å; D38-A40 WeakPolarHBondContact OD1-CB 2.92Å; D38-A40 PolarHBondContact OD1-N 2.67Å
41L67.4Low61.7Low115 Ų115107.6 Ų107.660%0.60261%0.611SS**G310 helixtrans-93.8-4.9177-63.8176.4000112.7I36 D38 P39 R43I36-L41 HydrophobicContact CB-CD1 4.38Å; I36-L41 HydrophobicContact CD1-CD1 4.48Å; I36-L41 HydrophobicContact CG2-CD1 3.6Å; D38-L41 HydrophobicContact CB-CB 4.17Å; D38-L41 HydrophobicContact CB-CD1 3.93Å; D38-L41 HydrophobicContact CB-CG 4Å; D38-L41 PolarHBondContact O-N 3.11Å; P39-L41 VanDerWaalsContact C-N 3.26Å; P39-L41 PolarHBondContact O-N 3.26Å; L41-R43 PolarHBondContact O-N 3.28Å
42R63.7Low60.6Low148 Ų148105.8 Ų105.856%0.55861%0.614SS**SBendtrans-77.7122.8174.5-56.9-172.8100.2121.410.8109.2N37 D38 P39N37-R42 PolarHBondContact OD1-NH1 2.9Å; D38-R42 WeakPolarHBondContact O-CG 2.94Å; D38-R42 PolarHBondContact O-N 3.12Å; P39-R42 PolarHBondContact O-N 3Å
43R58.2Low59.6Low188 Ų188103.5 Ų103.571%0.70961%0.613SS**  trans-60.4142.9170.8-71.5-165.8-74.6178.9-8.6109.9L41 N45L41-R43 PolarHBondContact O-N 3.28Å; R43-N45 PolarHBondContact O-N 3.19Å
44A59.6Low58.8Low105 Ų105105 Ų10587%0.86862%0.619SS**SBendtrans-58.9-15.6-176.300000114.9
45N48.6Very low57.8Low135 Ų135105.8 Ų105.872%0.72262%0.623SS**SBendtrans-95.9103.7175.9-60.3-4.6000107.1R43 N47R43-N45 PolarHBondContact O-N 3.19Å; N45-N47 PolarHBondContact O-N 2.65Å
46G49.6Very low56.7Low79 Ų79103 Ų10381%0.81462%0.616SS**  trans-59.531.9-170.200000118.2A48G46-A48 PolarHBondContact O-N 2.95Å
47N45.3Very low55.6Low130 Ų130102 Ų10270%0.69561%0.611SS**  trans-85.898.9169.2-75.718.5000108.5N45 T49N45-N47 PolarHBondContact O-N 2.65Å; N47-T49 PolarHBondContact O-N 2.94Å
48A50.3Low54.4Low91 Ų91103.4 Ų103.475%0.75262%0.619SS**THydrogen-bonded Turntrans-70.833.8170.800000113G46G46-A48 PolarHBondContact O-N 2.95Å
49T48.7Very low53Low118 Ų118105.2 Ų105.272%0.72463%0.632SS**THydrogen-bonded Turntrans-112.111.2-170.540.20000114.9N47N47-T49 PolarHBondContact O-N 2.94Å
50S43.9Very low51.3Low56 Ų56107.6 Ų107.639%0.39263%0.634SS.*  trans-98.4114.7168.5-155.10000112.1D52S50-D52 PolarHBondContact O-N 2.86Å; S50-D52 VanDerWaalsContact OG-CB 3.29Å; S50-D52 WeakPolarHBondContact OG-CB 3.49Å; S50-D52 PolarHBondContact OG-N 2.87Å; S50-D52 PolarHBondContact OG-OD2 3.32Å
51V54.1Low49.4Very low113 Ų113108.9 Ų108.969%0.68563%0.634SS**G310 helixtrans-51.4-01561580000112.9G53 I54V51-G53 PolarHBondContact O-N 2.77Å; V51-I54 HydrophobicContact CG1-CD1 4.11Å; V51-I54 HydrophobicContact CG2-CD1 4.4Å; V51-I54 PolarHBondContact O-N 3.06Å
52D48.7Very low47.7Very low131 Ų131112.4 Ų112.470%0.70164%0.644SS**G310 helixtrans-70.4-9.6174.4-72.5-33.9000115.3S50 I54S50-D52 PolarHBondContact O-N 2.86Å; S50-D52 VanDerWaalsContact OG-CB 3.29Å; S50-D52 WeakPolarHBondContact OG-CB 3.49Å; S50-D52 PolarHBondContact OG-N 2.87Å; S50-D52 PolarHBondContact OG-OD2 3.32Å; D52-I54 VanDerWaalsContact C-N 3.28Å
53G45.9Very low46.3Very low46 Ų46111.3 Ų111.347%0.47466%0.658SS.*G310 helixtrans-81.6-5.6172.500000114.1V51 I55V51-G53 PolarHBondContact O-N 2.77Å; G53-I55 PolarHBondContact O-N 3.04Å
54I48.6Very low45.1Very low73 Ų73106.8 Ų106.837%0.37466%0.655SS.*EExtended strand (participates in β ladder)trans-85.396.6-178.4-60.6-178.6000108.4T33 V51 D52 S56T33-I54 HydrophobicContact CG2-CB 4.22Å; T33-I54 HydrophobicContact CG2-CD1 4.09Å; T33-I54 HydrophobicContact CG2-CG1 3.87Å; T33-I54 HydrophobicContact CG2-CG2 3.62Å; V51-I54 HydrophobicContact CG1-CD1 4.11Å; V51-I54 HydrophobicContact CG2-CD1 4.4Å; V51-I54 PolarHBondContact O-N 3.06Å; D52-I54 VanDerWaalsContact C-N 3.28Å; I54-S56 PolarHBondContact O-N 2.87Å
55I51.4Low43.8Very low94 Ų94110.6 Ų110.648%0.48266%0.655SS.*EExtended strand (participates in β ladder)trans-80.7100.4167.2-54.4173.9000106.3I36 G53 N57I36-I55 HydrophobicContact CD1-CD1 3.95Å; G53-I55 PolarHBondContact O-N 3.04Å; I55-N57 PolarHBondContact O-N 2.96Å; I55-N57 VanDerWaalsContact O-N 3.1Å
56S46.4Very low43.2Very low85 Ų85109.7 Ų109.759%0.59466%0.659SS**EExtended strand (participates in β ladder)trans-61.1111.7165.1-66.10000107.9I54 N58I54-S56 PolarHBondContact O-N 2.87Å; S56-N58 PolarHBondContact O-N 2.89Å
57N48.9Very low42.6Very low62 Ų62111.1 Ų111.133%0.33265%0.654SS.*  trans-74.45917259.3-7.6000110.2D32 I55 V59D32-N57 VanDerWaalsContact C-OD1 3.26Å; D32-N57 WeakPolarHBondContact CA-OD1 3.3Å; D32-N57 WeakPolarHBondContact CB-OD1 3.43Å; D32-N57 PolarHBondContact O-N 2.73Å; D32-N57 PolarHBondContact O-OD1 3.28Å; D32-N57 PolarHBondContact OD1-OD1 3.39Å; I55-N57 PolarHBondContact O-N 2.96Å; I55-N57 VanDerWaalsContact O-N 3.1Å; N57-V59 PolarHBondContact O-N 2.99Å
58N43.7Very low42Very low146 Ų146114.7 Ų114.778%0.78166%0.664SS**  trans-76.459.4169.3-151.613.4000109.4S56 H60S56-N58 PolarHBondContact O-N 2.89Å; N58-H60 PolarHBondContact O-N 3.36Å; N58-H60 VanDerWaalsContact O-N 3.07Å
59V45.2Very low41.7Very low107 Ų107120.4 Ų120.465%0.64867%0.671SS**  trans-81.186.3167.9-178.80000105.8N57 T61N57-V59 PolarHBondContact O-N 2.99Å; V59-T61 HydrophobicContact CG1-CG2 3.63Å; V59-T61 PolarHBondContact O-N 3.15Å; V59-T61 PolarHBondContact O-OG1 2.96Å
60H33Very low41.1Very low151 Ų151120 Ų12070%0.69967%0.673SS**  trans-60.771165.5-178.5-73.8000109.4N58 K62N58-H60 PolarHBondContact O-N 3.36Å; N58-H60 VanDerWaalsContact O-N 3.07Å; H60-K62 PolarHBondContact O-N 3.39Å
61T36Very low40.9Very low114 Ų114125.9 Ų125.970%0.69970%0.695SS**  trans-89.693.7166.838.30000108.5V59 C63V59-T61 HydrophobicContact CG1-CG2 3.63Å; V59-T61 PolarHBondContact O-N 3.15Å; V59-T61 PolarHBondContact O-OG1 2.96Å; T61-C63 PolarHBondContact O-N 3.49Å
62K32.7Very low40.1Very low188 Ų188125.8 Ų125.882%0.81769%0.694SS**  trans-17.7102.3158.3-60.2-108-174.4-178.70112.5H60H60-K62 PolarHBondContact O-N 3.39Å
63C33.1Very low39.5Very low126 Ų126124.1 Ų124.185%0.85169%0.693SS**  trans-128.4125.6159.4-137.40000107.9T61T61-C63 PolarHBondContact O-N 3.49Å
64S33.2Very low39.1Very low93 Ų93129.7 Ų129.765%0.6571%0.712SS**  trans-68.6143.8-165.751.60000113.6
65E31.6Very low38.4Very low185 Ų185129.6 Ų129.686%0.86473%0.729SS**  trans56.2103.8144.5-66.5171.4114.300119
66S36Very low38Very low116 Ų116133.1 Ų133.181%0.81175%0.748SS**  -169.9122.2122.8-175.40000111.2
67P37.2Very low37.3Very low108 Ų108134.6 Ų134.670%0.70176%0.758SS**  trans-87.5143.4174.834.8-29.6000111.2
68F34.3Very low37.2Very low206 Ų206138 Ų13890%0.90478%0.781SS**  trans-2.6124.9160-68.5-91.8000117.9
69K43.1Very low37.1Very low210 Ų210136.7 Ų136.791%0.91378%0.779SS**  trans-126.8113.6153.8-98.6-177.5176.1-177.30111.1
70S36Very low36.4Very low109 Ų109138.4 Ų138.476%0.76278%0.784SS**  trans-64144.8171.6-39.40000112.4
71Q39.3Very low36.8Very low181 Ų181142.8 Ų142.885%0.84679%0.794SS**  trans-167.3108.5136.7-117-175.1-50.300114.1
72T36.9Very low37Very low110 Ų110141 Ų14168%0.67579%0.786SS**  43.9110127.962.30000122.1
73S38Very low37.7Very low97 Ų97138 Ų13868%0.67879%0.787SS**  40.4120.412668.90000120.8
74N35.7Very low38.6Very low163 Ų163139.6 Ų139.687%0.87278%0.781SS**  176.6120.3109.1-83.2-18.6000109.2
75G34.6Very low39.4Very low71 Ų71140.9 Ų140.973%0.73279%0.787SS**  trans158108.4165.100000116.3
76L43.7Very low40.3Very low168 Ų168138.4 Ų138.488%0.8879%0.791SS**  trans7097.1159.1-75.2110.4000119.4V78L76-V78 PolarHBondContact O-N 3.25Å
77S31.8Very low41.1Very low116 Ų116135.3 Ų135.381%0.81178%0.777SS**  trans-48.2118.7150.2-178.90000111.8
78V45.2Very low41.8Very low133 Ų133137.6 Ų137.681%0.80678%0.782SS**  trans-130.1119.7155.7179.10000108L76L76-V78 PolarHBondContact O-N 3.25Å
79T42.5Very low43Very low119 Ų119134 Ų13473%0.7378%0.777SS**  trans-46.1129178.8-52.80000114.7
80D31.5Very low44.3Very low143 Ų143130.2 Ų130.277%0.76577%0.771SS**  trans45.4103.1138.8-161.917.8000118.7
81R39.9Very low45.6Very low242 Ų242130 Ų13091%0.91377%0.769SS**  trans-155.3105.3148-108.4174.4-164-139.73.2111
82S41.3Very low46.8Very low76 Ų76130.3 Ų130.353%0.53177%0.77SS.*  trans16.7129.5148.1-175.40000119H84S82-H84 PolarHBondContact O-N 3.4Å; S82-H84 PolarHBondContact O-ND1 3.18Å; S82-H84 VanDerWaalsContact O-ND1 3.17Å
83P46.6Very low48.3Very low127 Ų127131.2 Ų131.283%0.82578%0.775SS**  trans-68.6101.1178.830.2-31.8000109.8
84H51.2Low49.9Very low158 Ų158132 Ų13273%0.73178%0.776SS**  trans-75.8131.2167.9-76.743.6000108.3S82 S86S82-H84 PolarHBondContact O-N 3.4Å; S82-H84 PolarHBondContact O-ND1 3.18Å; S82-H84 VanDerWaalsContact O-ND1 3.17Å; H84-S86 PolarHBondContact O-N 3.09Å
85P51Low51.2Low121 Ų121129.9 Ų129.979%0.78677%0.774SS**  trans-63.3126.2-176.725.5-32.1000109.7G87P85-G87 PolarHBondContact O-N 3.3Å
86S50.6Low52.5Low133 Ų133134.4 Ų134.493%0.9378%0.776SS**  trans-65.181.1165.448.10000109.1H84H84-S86 PolarHBondContact O-N 3.09Å
87G51.7Low53.6Low51 Ų51134 Ų13453%0.52677%0.769SS.*  trans-134.1131.3173.900000109.2P85 V89P85-G87 PolarHBondContact O-N 3.3Å; G87-V89 PolarHBondContact O-N 3.27Å; G87-V89 VanDerWaalsContact O-N 3.09Å
88L52Low55.3Low156 Ų156135.7 Ų135.782%0.81777%0.768SS**  trans-57.5113.9170.6-75.6162000108.4T90L88-T90 PolarHBondContact O-N 3.42Å; L88-T90 VanDerWaalsContact O-N 3.14Å
89V60.5Low56.4Low131 Ų131136.7 Ų136.779%0.79476%0.763SS**  trans-75.2102172179.80000107.3G87G87-V89 PolarHBondContact O-N 3.27Å; G87-V89 VanDerWaalsContact O-N 3.09Å
90T70.3Confident57.2Low129 Ų129136.5 Ų136.579%0.79176%0.764SS**  trans-86.7108.6168.854.50000108.5L88L88-T90 PolarHBondContact O-N 3.42Å; L88-T90 VanDerWaalsContact O-N 3.14Å
91C62.4Low58.4Low104 Ų104137.6 Ų137.670%0.70377%0.767SS**  trans-86.4121.1168.5-64.90000108.8V93C91-V93 PolarHBondContact O-N 2.86Å
92E64.9Low59.3Low189 Ų189134.7 Ų134.788%0.88376%0.763SS**  trans-68.3120167.9-68.5-174.8160.800109.2
93V68.4Low60Low128 Ų128135.3 Ų135.378%0.77677%0.768SS**  trans-96.4104171.8-173.70000107.3C91 S95C91-V93 PolarHBondContact O-N 2.86Å; V93-S95 PolarHBondContact O-N 3.24Å
94V73Confident60.6Low115 Ų115133.8 Ų133.870%0.69776%0.758SS**  trans-70114.9171.1179.50000108Q96V94-Q96 PolarHBondContact O-N 3.1Å
95S62.1Low60.8Low117 Ų117132.8 Ų132.882%0.81876%0.763SS**  trans-65.194.5169.4-72.50000109.6V93 H97V93-S95 PolarHBondContact O-N 3.24Å; S95-H97 PolarHBondContact O-N 3.34Å
96Q61.8Low60.9Low166 Ų166135.8 Ų135.878%0.77676%0.764SS**  trans-73.1118.7163-74.9-174.124.400108.2V94 I98V94-Q96 PolarHBondContact O-N 3.1Å; Q96-I98 PolarHBondContact O-N 2.84Å
97H67.8Low61.1Low161 Ų161137.3 Ų137.375%0.74576%0.757SS**  trans-64.398.4168.2175.3-79.5000108.5S95 Q99S95-H97 PolarHBondContact O-N 3.34Å; H97-Q99 PolarHBondContact O-N 2.92Å
98I66.1Low61.5Low151 Ų151140 Ų14077%0.77477%0.768SS**  trans-71113.4170.7-52.3178000106.3Q96Q96-I98 PolarHBondContact O-N 2.84Å
99Q68Low62Low153 Ų153136.7 Ų136.772%0.71576%0.757SS**  trans-57.8139.8170.2-77.3-158.71.700108.8H97 M101H97-Q99 PolarHBondContact O-N 2.92Å; Q99-M101 PolarHBondContact O-N 2.92Å
100P61.1Low62Low116 Ų116139.2 Ų139.275%0.75376%0.76SS**  trans-55.5109.8173.4-15.926.8000107.7Q102P100-Q102 PolarHBondContact O-N 3.11Å; P100-Q102 VanDerWaalsContact O-N 3.14Å
101M55.3Low61.9Low166 Ų166139 Ų13982%0.81875%0.753SS**  trans-58.3123.9170.2-136-161.993.600105.4Q99 S103Q99-M101 PolarHBondContact O-N 2.92Å; M101-S103 PolarHBondContact O-N 2.96Å
102Q58.7Low62.6Low180 Ų180142.3 Ų142.384%0.84176%0.758SS**  trans-49.8115.6170.7-76.6-179.3-27.800106.6P100P100-Q102 PolarHBondContact O-N 3.11Å; P100-Q102 VanDerWaalsContact O-N 3.14Å
103S57.3Low63.3Low90 Ų90141.3 Ų141.363%0.62975%0.753SS**  trans-54.8130.6175.541.20000106.9M101 T105M101-S103 PolarHBondContact O-N 2.96Å; S103-T105 PolarHBondContact O-N 3.1Å; S103-T105 VanDerWaalsContact O-N 3.14Å
104P58.5Low63.8Low95 Ų95140.4 Ų140.462%0.61775%0.748SS**  trans-53.4130.3167.623.4-30.5000106F106P104-F106 PolarHBondContact O-N 2.97Å
105T54.7Low64.1Low136 Ų136142.3 Ų142.383%0.83475%0.754SS**  trans-50.1104.2-179.3-21.80000106.7S103 Q107S103-T105 PolarHBondContact O-N 3.1Å; S103-T105 VanDerWaalsContact O-N 3.14Å; T105-Q107 VanDerWaalsContact C-N 3.31Å; T105-Q107 PolarHBondContact O-N 3.15Å
106F54.2Low64.7Low185 Ų185143.7 Ų143.781%0.81175%0.751SS**  trans-62.8103.1176.4-96.9-95.9000105.2P104 S108P104-F106 PolarHBondContact O-N 2.97Å; F106-S108 VanDerWaalsContact C-N 3.28Å; F106-S108 PolarHBondContact O-N 2.8Å
107Q55.5Low65.4Low165 Ų165144.9 Ų144.977%0.77175%0.753SS**  trans-58100.5165.9-75.5-92.7-7.300105.3T105 S109T105-Q107 VanDerWaalsContact C-N 3.31Å; T105-Q107 PolarHBondContact O-N 3.15Å; Q107-S109 PolarHBondContact O-N 2.85Å
108S60.2Low65.6Low108 Ų108142.4 Ų142.476%0.75575%0.754SS**  trans-64.217-178.2-178.90000113.3F106F106-S108 VanDerWaalsContact C-N 3.28Å; F106-S108 PolarHBondContact O-N 2.8Å
109S61.7Low65.7Low85 Ų85140.6 Ų140.659%0.59476%0.755SS**  trans-966.7-159.950.10000115.7Q107Q107-S109 PolarHBondContact O-N 2.85Å
110Q60.3Low65.7Low184 Ų184143.5 Ų143.586%0.8676%0.759SS**  trans-143.448.8178.3-67.7-171.4-8.200114.5E112Q110-E112 PolarHBondContact O-N 3.46Å
111I68.6Low66Low124 Ų124146.9 Ų146.964%0.63676%0.762SS**  trans-86.699.1160-56.3176.9000107.3H113I111-H113 PolarHBondContact O-CD2 2.76Å; I111-H113 PolarHBondContact O-N 3.07Å
112E77.2Confident66.7Low174 Ų174144.8 Ų144.881%0.81376%0.761SS**  trans-75.2107.5168.8-171177.8-178.600108.9Q110 V114Q110-E112 PolarHBondContact O-N 3.46Å; E112-V114 PolarHBondContact O-N 3.01Å
113H79.7Confident67.2Low168 Ų168142.5 Ų142.578%0.77876%0.759SS**  trans-76.8102.5173.3-69.3-90.1000109.6I111 N115I111-H113 PolarHBondContact O-CD2 2.76Å; I111-H113 PolarHBondContact O-N 3.07Å; H113-N115 PolarHBondContact O-N 3.02Å
114V78.6Confident67.9Low109 Ų109147.6 Ų147.666%0.66177%0.77SS**  trans-75.8122170.1-70.50000110.5E112 I116E112-V114 PolarHBondContact O-N 3.01Å; V114-I116 PolarHBondContact O-N 3.04Å
115N78.2Confident68.6Low156 Ų156148.8 Ų148.883%0.83478%0.779SS**  trans-82.899.2175.6-166.3-1.1000109.5H113 K117H113-N115 PolarHBondContact O-N 3.02Å; N115-K117 PolarHBondContact O-N 3.14Å; N115-K117 VanDerWaalsContact O-N 3.12Å
116I75.8Confident69.7Low146 Ų146148.1 Ų148.175%0.74978%0.779SS**  trans-75.1102.5175.6-55.9174.9000108V114 S118V114-I116 PolarHBondContact O-N 3.04Å; I116-S118 PolarHBondContact O-N 3.17Å
117K76.6Confident70.6Confident190 Ų190145.6 Ų145.683%0.82678%0.778SS**  trans-61.5106.4170.9-121.2175.6-179.1175.60108.5N115 S119N115-K117 PolarHBondContact O-N 3.14Å; N115-K117 VanDerWaalsContact O-N 3.12Å; K117-S119 PolarHBondContact O-N 2.97Å
118S71.7Confident71.2Confident110 Ų110145.7 Ų145.777%0.76978%0.783SS**  trans-63.694.9170.5-177.50000109.2I116I116-S118 PolarHBondContact O-N 3.17Å
119S67.1Low71Confident112 Ų112153.1 Ų153.178%0.78381%0.806SS**  trans-99.15.7-17859.80000113.5K117K117-S119 PolarHBondContact O-N 2.97Å
120R68.8Low71.5Confident214 Ų214156.6 Ų156.681%0.80882%0.817SS**SBendtrans-117.8122.3175.5-68.4-172.7-179.2-1791109.7
121K67.5Low72.1Confident187 Ų187155.1 Ų155.181%0.81381%0.814SS**PPolyproline II helixtrans-49.5135.2168.5-71.2176.6177.4175.50107.9T123K121-T123 PolarHBondContact O-N 3.38Å
122P69.4Low72.3Confident123 Ų123156.8 Ų156.880%0.79982%0.824SS**PPolyproline II helixtrans-56.8116.7175.421.8-30.1000108.2K124P122-K124 PolarHBondContact O-N 3.06Å; P122-K124 VanDerWaalsContact O-N 3.14Å
123T69.3Low72Confident131 Ų131155.8 Ų155.880%0.80483%0.825SS**PPolyproline II helixtrans-60.8116.4172.3-49.60000106.7K121 C125K121-T123 PolarHBondContact O-N 3.38Å; T123-C125 PolarHBondContact O-N 3.3Å
124K72.5Confident71.5Confident198 Ų198155.1 Ų155.186%0.86183%0.828SS**  trans-62.8109.5171.6-72-164.5177.5-171.60107.4P122 C126P122-K124 PolarHBondContact O-N 3.06Å; P122-K124 VanDerWaalsContact O-N 3.14Å; K124-C126 PolarHBondContact O-N 3.22Å
125C73.8Confident71.1Confident119 Ų119158.1 Ų158.180%0.80484%0.839SS**PPolyproline II helixtrans-63.8120.7163.9-69.20000107.5T123 V127T123-C125 PolarHBondContact O-N 3.3Å; C125-V127 PolarHBondContact O-N 3.26Å
126C77.8Confident70.5Confident122 Ų122158.3 Ų158.382%0.82484%0.84SS**PPolyproline II helixtrans-65.4118.9169.9-63.10000108K124 L128K124-C126 PolarHBondContact O-N 3.22Å; C126-L128 PolarHBondContact O-N 3.34Å
127V72.5Confident70.1Confident133 Ų133159.2 Ų159.281%0.80685%0.847SS**PPolyproline II helixtrans-71.2116.1164.3-177.80000105.8C125 Q129C125-V127 PolarHBondContact O-N 3.26Å; V127-Q129 PolarHBondContact O-N 3.26Å
128L67.9Low69.6Low167 Ų167156.7 Ų156.787%0.87485%0.848SS**PPolyproline II helixtrans-64.2116.2168.2-70.6161.8000107C126C126-L128 PolarHBondContact O-N 3.34Å
129Q57Low69.4Low264 Ų264160.9 Ų160.9100%1.23486%0.855SS**  trans-79.40165-92-176.7-3200110.2V127V127-Q129 PolarHBondContact O-N 3.26Å

Retrieved 129 of 129 residues in 57.9 ms (Link to these results)