G4V7W5_SCHMA Loading...

MEG-7

AlphaFold DB , UniProt , Accession G4V7W5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 116 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
1M60.1Low76.2Confident189 Ų189112.5 Ų112.593%0.93158%0.58SS**  0-130-83.1174.88800115F5M1-F5 HydrophobicContact CB-CE2 4.16Å; M1-F5 HydrophobicContact CE-CE2 3.91Å; M1-F5 HydrophobicContact CE-CZ 4.05Å; M1-F5 WeakPolarHBondContact O-CD2 3.39Å
2N65.5Low77Confident93 Ų93110.6 Ų110.650%0.49758%0.576SS.*Hα-helixtrans-76.6-31.3-169.6-148.8-25.5000114.9R6N2-R6 VanDerWaalsContact O-CG 3.31Å; N2-R6 WeakPolarHBondContact O-CG 3.43Å; N2-R6 PolarHBondContact O-N 3.03Å; N2-R6 PolarHBondContact OD1-NE 3.42Å
3T71.6Confident77.5Confident118 Ų118107.9 Ų107.972%0.72457%0.568SS**Hα-helixtrans-70.5-37.2-177.342.90000113.6R6 S7T3-R6 PolarHBondContact O-N 2.7Å; T3-S7 PolarHBondContact O-N 3.47Å
4L76.8Confident78Confident111 Ų111105 Ų10558%0.58156%0.556SS**Hα-helixtrans-70.2-39.1-178.8-163.4127.5000111.8R6 S7 I8L4-R6 VanDerWaalsContact C-N 3.35Å; L4-S7 PolarHBondContact O-N 3Å; L4-S7 PolarHBondContact O-OG 3.46Å; L4-I8 HydrophobicContact CD2-CD1 3.67Å; L4-I8 HydrophobicContact CG-CD1 4.37Å; L4-I8 WeakPolarHBondContact O-CD1 3.14Å; L4-I8 VanDerWaalsContact O-CG1 3.24Å; L4-I8 WeakPolarHBondContact O-CG1 3.5Å; L4-I8 PolarHBondContact O-N 3.35Å; L4-I8 VanDerWaalsContact O-N 3.13Å
5F76.7Confident78.3Confident122 Ų122109.5 Ų109.554%0.53556%0.564SS.*Hα-helixtrans-66.5-37.7173-68.3-64000112.2M1 I8 F9M1-F5 HydrophobicContact CB-CE2 4.16Å; M1-F5 HydrophobicContact CE-CE2 3.91Å; M1-F5 HydrophobicContact CE-CZ 4.05Å; M1-F5 WeakPolarHBondContact O-CD2 3.39Å; F5-I8 PolarHBondContact O-N 3.16Å; F5-F9 VanDerWaalsContact O-CB 3.31Å; F5-F9 WeakPolarHBondContact O-CB 3.38Å; F5-F9 PolarHBondContact O-N 3.15Å
6R72.3Confident78.4Confident147 Ų147105.4 Ų105.456%0.55555%0.551SS**Hα-helixtrans-64.1-42.4176.3-74.8177.1179.3-146.4-4.4112.3N2 T3 L4 F9 V10N2-R6 VanDerWaalsContact O-CG 3.31Å; N2-R6 WeakPolarHBondContact O-CG 3.43Å; N2-R6 PolarHBondContact O-N 3.03Å; N2-R6 PolarHBondContact OD1-NE 3.42Å; T3-R6 PolarHBondContact O-N 2.7Å; L4-R6 VanDerWaalsContact C-N 3.35Å; R6-F9 PolarHBondContact O-N 3.37Å; R6-V10 WeakPolarHBondContact O-CG2 3.45Å; R6-V10 PolarHBondContact O-N 3.1Å
7S79.2Confident78.4Confident64 Ų64109 Ų10945%0.44856%0.557SS.*Hα-helixtrans-66.3-43.5177.962.90000111.8T3 L4 F9 V10 V11T3-S7 PolarHBondContact O-N 3.47Å; L4-S7 PolarHBondContact O-N 3Å; L4-S7 PolarHBondContact O-OG 3.46Å; S7-F9 VanDerWaalsContact C-N 3.33Å; S7-F9 PolarHBondContact O-N 3.06Å; S7-V10 PolarHBondContact O-N 3.22Å; S7-V11 WeakPolarHBondContact O-CG2 3.41Å; S7-V11 PolarHBondContact O-N 2.95Å
8I84.2Confident78.3Confident86 Ų86109.4 Ų109.444%0.44156%0.555SS.*Hα-helixtrans-59.9-45.8176-66.5166.3000110.4L4 F5 V10 V11 V12L4-I8 HydrophobicContact CD2-CD1 3.67Å; L4-I8 HydrophobicContact CG-CD1 4.37Å; L4-I8 WeakPolarHBondContact O-CD1 3.14Å; L4-I8 VanDerWaalsContact O-CG1 3.24Å; L4-I8 WeakPolarHBondContact O-CG1 3.5Å; L4-I8 PolarHBondContact O-N 3.35Å; L4-I8 VanDerWaalsContact O-N 3.13Å; F5-I8 PolarHBondContact O-N 3.16Å; I8-V10 PolarHBondContact O-N 3.01Å; I8-V11 PolarHBondContact O-N 2.98Å; I8-V12 HydrophobicContact CG2-CG2 4.36Å; I8-V12 WeakPolarHBondContact O-CG2 3.31Å; I8-V12 PolarHBondContact O-N 3.02Å
9F82Confident78.2Confident120 Ų120109.2 Ų109.253%0.52656%0.555SS.*Hα-helixtrans-59.6-45.3179.2-176.1-98.8000112.2F5 R6 S7 V11 V12 V13 P108F5-F9 VanDerWaalsContact O-CB 3.31Å; F5-F9 WeakPolarHBondContact O-CB 3.38Å; F5-F9 PolarHBondContact O-N 3.15Å; R6-F9 PolarHBondContact O-N 3.37Å; S7-F9 VanDerWaalsContact C-N 3.33Å; S7-F9 PolarHBondContact O-N 3.06Å; F9-V11 VanDerWaalsContact C-N 3.34Å; F9-V11 PolarHBondContact O-N 3.23Å; F9-V12 PolarHBondContact O-N 3.3Å; F9-V13 HydrophobicContact CD1-CG2 4.17Å; F9-V13 HydrophobicContact CE1-CG2 3.78Å; F9-V13 HydrophobicContact CE2-CG2 4.31Å; F9-V13 HydrophobicContact CZ-CG2 3.86Å; F9-V13 WeakPolarHBondContact O-CG2 3.38Å; F9-V13 PolarHBondContact O-N 3.08Å; F9-P108 HydrophobicContact CZ-CB 4.49Å
10V83.7Confident77.9Confident88 Ų88111.2 Ų111.253%0.53356%0.564SS.*Hα-helixtrans-60.7-44.1177.1171.70000111.2R6 S7 I8 V12 V13 V14R6-V10 WeakPolarHBondContact O-CG2 3.45Å; R6-V10 PolarHBondContact O-N 3.1Å; S7-V10 PolarHBondContact O-N 3.22Å; I8-V10 PolarHBondContact O-N 3.01Å; V10-V12 PolarHBondContact O-N 2.89Å; V10-V13 PolarHBondContact O-N 3.02Å; V10-V14 HydrophobicContact CG1-CG2 4.35Å; V10-V14 WeakPolarHBondContact O-CB 3.16Å; V10-V14 VanDerWaalsContact O-CG2 3.24Å; V10-V14 WeakPolarHBondContact O-CG2 3.48Å; V10-V14 PolarHBondContact O-N 2.69Å
11V85.9Confident77.4Confident100 Ų100108.5 Ų108.561%0.60656%0.559SS**Hα-helixtrans-62.2-43178.71740000111.3S7 I8 F9 V14 Y15S7-V11 WeakPolarHBondContact O-CG2 3.41Å; S7-V11 PolarHBondContact O-N 2.95Å; I8-V11 PolarHBondContact O-N 2.98Å; F9-V11 VanDerWaalsContact C-N 3.34Å; F9-V11 PolarHBondContact O-N 3.23Å; V11-V14 PolarHBondContact O-N 2.77Å; V11-Y15 WeakPolarHBondContact O-CB 3.45Å; V11-Y15 PolarHBondContact O-N 2.76Å
12V85.6Confident77.6Confident89 Ų89105.6 Ų105.654%0.53955%0.547SS..Hα-helixtrans-63.6-44.5178.4172.40000111.5I8 F9 V10 Y15 A16I8-V12 HydrophobicContact CG2-CG2 4.36Å; I8-V12 WeakPolarHBondContact O-CG2 3.31Å; I8-V12 PolarHBondContact O-N 3.02Å; F9-V12 PolarHBondContact O-N 3.3Å; V10-V12 PolarHBondContact O-N 2.89Å; V12-Y15 PolarHBondContact O-N 3.13Å; V12-A16 WeakPolarHBondContact O-CB 3.24Å; V12-A16 PolarHBondContact O-N 3.01Å
13V84.3Confident77.3Confident76 Ų76103.6 Ų103.646%0.46155%0.549SS..Hα-helixtrans-63.4-43.5178.7171.90000111.2F9 V10 A16 Y17F9-V13 HydrophobicContact CD1-CG2 4.17Å; F9-V13 HydrophobicContact CE1-CG2 3.78Å; F9-V13 HydrophobicContact CE2-CG2 4.31Å; F9-V13 HydrophobicContact CZ-CG2 3.86Å; F9-V13 WeakPolarHBondContact O-CG2 3.38Å; F9-V13 PolarHBondContact O-N 3.08Å; V10-V13 PolarHBondContact O-N 3.02Å; V13-A16 PolarHBondContact O-N 3.09Å; V13-Y17 PolarHBondContact O-N 3.46Å
14V84Confident76.7Confident67 Ų67102.7 Ų102.741%0.40654%0.542SS..Hα-helixtrans-64.1-43.9177.7171.60000110.8V10 V11 Y17 F18V10-V14 HydrophobicContact CG1-CG2 4.35Å; V10-V14 WeakPolarHBondContact O-CB 3.16Å; V10-V14 VanDerWaalsContact O-CG2 3.24Å; V10-V14 WeakPolarHBondContact O-CG2 3.48Å; V10-V14 PolarHBondContact O-N 2.69Å; V11-V14 PolarHBondContact O-N 2.77Å; V14-Y17 WeakPolarHBondContact O-CB 3.39Å; V14-Y17 PolarHBondContact O-N 3.32Å; V14-F18 HydrophobicContact CG1-CD2 3.7Å; V14-F18 HydrophobicContact CG1-CE2 3.44Å; V14-F18 VanDerWaalsContact CG1-CE2 3.44Å; V14-F18 WeakPolarHBondContact O-CD2 3.34Å; V14-F18 PolarHBondContact O-N 3.08Å
15Y82.4Confident75.9Confident173 Ų173102.6 Ų102.668%0.67855%0.548SS*.Hα-helixtrans-62.5-45.1178.2-168.5-94.8000112.1V11 V12 Y17 F18 D19V11-Y15 WeakPolarHBondContact O-CB 3.45Å; V11-Y15 PolarHBondContact O-N 2.76Å; V12-Y15 PolarHBondContact O-N 3.13Å; Y15-Y17 VanDerWaalsContact C-N 3.29Å; Y15-Y17 PolarHBondContact O-N 2.94Å; Y15-F18 PolarHBondContact O-N 2.93Å; Y15-D19 PolarHBondContact O-N 2.83Å
16A79.8Confident75Confident43 Ų43103.3 Ų103.336%0.35555%0.553SS.*Hα-helixtrans-62-36.4176.300000112.4V12 V13 D19 M20V12-A16 WeakPolarHBondContact O-CB 3.24Å; V12-A16 PolarHBondContact O-N 3.01Å; V13-A16 PolarHBondContact O-N 3.09Å; A16-D19 PolarHBondContact O-N 3.19Å; A16-M20 VanDerWaalsContact O-CG 3.31Å; A16-M20 WeakPolarHBondContact O-CG 3.24Å; A16-M20 PolarHBondContact O-N 3.33Å
17Y78.9Confident74.6Confident167 Ų167100.9 Ų100.966%0.65556%0.557SS**Hα-helixtrans-64.8-43.1175.2-173.4-95.7000112V13 V14 Y15 M20 A21V13-Y17 PolarHBondContact O-N 3.46Å; V14-Y17 WeakPolarHBondContact O-CB 3.39Å; V14-Y17 PolarHBondContact O-N 3.32Å; Y15-Y17 VanDerWaalsContact C-N 3.29Å; Y15-Y17 PolarHBondContact O-N 2.94Å; Y17-M20 PolarHBondContact O-N 3.44Å; Y17-A21 WeakPolarHBondContact O-CB 3.34Å; Y17-A21 PolarHBondContact O-N 2.77Å
18F77.1Confident73.8Confident117 Ų117103.5 Ų103.551%0.51357%0.572SS.*Hα-helixtrans-65.9-38.2174.8-79.1-66.6000112.4V14 Y15 A21 N22V14-F18 HydrophobicContact CG1-CD2 3.7Å; V14-F18 HydrophobicContact CG1-CE2 3.44Å; V14-F18 VanDerWaalsContact CG1-CE2 3.44Å; V14-F18 WeakPolarHBondContact O-CD2 3.34Å; V14-F18 PolarHBondContact O-N 3.08Å; Y15-F18 PolarHBondContact O-N 2.93Å; F18-A21 PolarHBondContact O-N 2.98Å; F18-N22 WeakPolarHBondContact O-CB 3.47Å; F18-N22 PolarHBondContact O-N 2.85Å; F18-N22 PolarHBondContact O-ND2 2.82Å
19D76.4Confident72.6Confident105 Ų105109.1 Ų109.156%0.56159%0.588SS**Hα-helixtrans-65.5-41.9177-16437.2000111.4Y15 A16 A21 N22 G23Y15-D19 PolarHBondContact O-N 2.83Å; A16-D19 PolarHBondContact O-N 3.19Å; D19-A21 VanDerWaalsContact C-N 3.34Å; D19-A21 PolarHBondContact O-N 2.73Å; D19-N22 PolarHBondContact O-N 2.97Å; D19-G23 WeakPolarHBondContact O-CA 3.43Å; D19-G23 PolarHBondContact O-N 2.96Å
20M71.1Confident71.8Confident148 Ų148108.8 Ų108.873%0.72960%0.596SS**Hα-helixtrans-64.4-36.3172.8-71.3-179.2-177.400112.9A16 Y17A16-M20 VanDerWaalsContact O-CG 3.31Å; A16-M20 WeakPolarHBondContact O-CG 3.24Å; A16-M20 PolarHBondContact O-N 3.33Å; Y17-M20 PolarHBondContact O-N 3.44Å
21A68.4Low70.8Confident56 Ų56109.2 Ų109.246%0.46360%0.6SS.*Hα-helixtrans-71.5-36.2178.600000112.7Y17 F18 D19Y17-A21 WeakPolarHBondContact O-CB 3.34Å; Y17-A21 PolarHBondContact O-N 2.77Å; F18-A21 PolarHBondContact O-N 2.98Å; D19-A21 VanDerWaalsContact C-N 3.34Å; D19-A21 PolarHBondContact O-N 2.73Å
22N63.4Low69.5Low128 Ų128111 Ų11168%0.68461%0.606SS**Hα-helixtrans-87.3-21.6178.7-66.5-42.4000113F18 D19 V24F18-N22 WeakPolarHBondContact O-CB 3.47Å; F18-N22 PolarHBondContact O-N 2.85Å; F18-N22 PolarHBondContact O-ND2 2.82Å; D19-N22 PolarHBondContact O-N 2.97Å; N22-V24 PolarHBondContact O-N 3.42Å
23G60.3Low68.2Low51 Ų51115.2 Ų115.253%0.52662%0.62SS.*  trans-80.16.7179.600000114.4D19 P25D19-G23 WeakPolarHBondContact O-CA 3.43Å; D19-G23 PolarHBondContact O-N 2.96Å; G23-P25 WeakPolarHBondContact O-CD 3.31Å
24V58Low67Low98 Ų98118.8 Ų118.859%0.59464%0.636SS**  trans-67.5111.2170.8-177.30000107.4N22 E26N22-V24 PolarHBondContact O-N 3.42Å; V24-E26 PolarHBondContact O-N 2.99Å
25P60.2Low65.4Low109 Ų109119.2 Ų119.271%0.70865%0.647SS**PPolyproline II helixtrans-59.2127.2171.7-11.726.8000106.7G23 P27G23-P25 WeakPolarHBondContact O-CD 3.31Å; P25-P27 VanDerWaalsContact O-N 3.08Å
26E58.9Low64.3Low137 Ų137116.5 Ų116.564%0.6465%0.648SS**PPolyproline II helixtrans-48.1123172-157.3-177.3168.300106.9V24 R29V24-E26 PolarHBondContact O-N 2.99Å; E26-R29 IonicContact OE1-CZ 3.65Å; E26-R29 IonicContact OE1-NE 3.6Å; E26-R29 IonicContact OE1-NH2 2.83Å; E26-R29 PolarHBondContact OE1-NH2 2.93Å; E26-R29 IonicContact OE2-NH2 3.84Å
27P62.7Low63Low96 Ų96120 Ų12062%0.62367%0.668SS**PPolyproline II helixtrans-55.7139.4-17418.3-29.2000108.6P25 R29P25-P27 VanDerWaalsContact O-N 3.08Å; P27-R29 PolarHBondContact O-N 3.28Å
28P61.7Low61.9Low119 Ų119118.8 Ų118.877%0.77368%0.677SS**PPolyproline II helixtrans-49.7119.5178.9-22.630000108.2V30P28-V30 VanDerWaalsContact C-N 3.33Å; P28-V30 PolarHBondContact O-N 3.05Å
29R59.1Low60.6Low205 Ų205124 Ų12477%0.77469%0.693SS**  trans-60.4103.8175.5-68.7-175.9-173.2159.26106.3E26 P27E26-R29 IonicContact OE1-CZ 3.65Å; E26-R29 IonicContact OE1-NE 3.6Å; E26-R29 IonicContact OE1-NH2 2.83Å; E26-R29 PolarHBondContact OE1-NH2 2.93Å; E26-R29 IonicContact OE2-NH2 3.84Å; P27-R29 PolarHBondContact O-N 3.28Å
30V65.9Low59.5Low113 Ų113123.3 Ų123.369%0.68570%0.702SS**  trans-54.7127.9170.8-177.20000105.3P28 D32P28-V30 VanDerWaalsContact C-N 3.33Å; P28-V30 PolarHBondContact O-N 3.05Å; V30-D32 PolarHBondContact O-N 2.88Å; V30-D32 VanDerWaalsContact O-N 3.13Å
31P62.5Low59Low97 Ų97125.2 Ų125.263%0.6371%0.707SS**  trans-55.2125.2172.7-13.624.4000106.9E33P31-E33 PolarHBondContact O-N 2.73Å
32D58.4Low58.2Low136 Ų136127.8 Ų127.873%0.72772%0.718SS**  trans-58105.8171.7-77.6-41.7000107.1V30 D34 A35V30-D32 PolarHBondContact O-N 2.88Å; V30-D32 VanDerWaalsContact O-N 3.13Å; D32-D34 PolarHBondContact O-N 2.74Å; D32-A35 WeakPolarHBondContact O-CB 3.33Å; D32-A35 PolarHBondContact O-N 2.95Å
33E59.8Low58.1Low179 Ų179126.4 Ų126.484%0.83673%0.725SS**THydrogen-bonded Turntrans-61.3-2.6175.2-66.8-86.5143.500111.8P31P31-E33 PolarHBondContact O-N 2.73Å
34D57.2Low58.1Low150 Ų150129 Ų12980%0.80273%0.731SS**THydrogen-bonded Turntrans-112.814174.8-72.8-42.1000113.7D32 V36D32-D34 PolarHBondContact O-N 2.74Å; D34-V36 PolarHBondContact O-N 3.47Å
35A52Low57.9Low76 Ų76130.1 Ų130.163%0.62874%0.74SS**  trans-6883.6165.900000109D32 P37D32-A35 WeakPolarHBondContact O-CB 3.33Å; D32-A35 PolarHBondContact O-N 2.95Å; A35-P37 VanDerWaalsContact O-N 3.13Å
36V58.7Low58Low116 Ų116131.6 Ų131.670%0.70374%0.74SS**  trans-36.5122.4164.3175.90000107D34 V38D34-V36 PolarHBondContact O-N 3.47Å; V36-V38 PolarHBondContact O-N 3.39Å
37P51.8Low57.8Low118 Ų118134.8 Ų134.877%0.76675%0.752SS**  trans-58.7109.4-178.822-30.1000106.4A35 R39A35-P37 VanDerWaalsContact O-N 3.13Å; P37-R39 PolarHBondContact O-N 2.91Å
38V57.4Low57.6Low140 Ų140136.6 Ų136.685%0.84876%0.755SS**  trans-62.292.4172.5176.60000104.7V36 A40V36-V38 PolarHBondContact O-N 3.39Å; V38-A40 PolarHBondContact O-N 2.99Å; V38-A40 VanDerWaalsContact O-N 3.08Å
39R48.6Very low57Low227 Ų227135.2 Ų135.286%0.85775%0.748SS**  trans19.284.7161.2-162.9178.4-173.1-1652111.1P37 K41P37-R39 PolarHBondContact O-N 2.91Å; R39-K41 PolarHBondContact O-N 2.76Å
40A53.4Low56.8Low91 Ų91131.7 Ų131.775%0.75275%0.75SS**  trans-47.9112.117000000107.4V38V38-A40 PolarHBondContact O-N 2.99Å; V38-A40 VanDerWaalsContact O-N 3.08Å
41K59.9Low56.2Low188 Ų188131.9 Ų131.982%0.81775%0.747SS**  trans-54.5129.2167.9-76.3178.4178.1176.20105.7R39 A43R39-K41 PolarHBondContact O-N 2.76Å; K41-A43 PolarHBondContact O-N 2.74Å
42P53.4Low55.5Low109 Ų109136.4 Ų136.471%0.70876%0.757SS**  trans-61.7113.217524.3-29000107T44P42-T44 PolarHBondContact O-N 2.83Å; P42-T44 VanDerWaalsContact O-N 3.1Å
43A60.4Low55.3Low100 Ų100137.1 Ų137.183%0.82676%0.759SS**SBendtrans-74.812.9-178.300000112.9K41K41-A43 PolarHBondContact O-N 2.74Å
44T59.6Low54.7Low105 Ų105134.3 Ų134.364%0.64476%0.756SS**SBendtrans-127.9116.1-179.335.80000110.1P42 I46P42-T44 PolarHBondContact O-N 2.83Å; P42-T44 VanDerWaalsContact O-N 3.1Å; T44-I46 PolarHBondContact O-N 3.47Å
45P55.4Low54.4Low121 Ų121133.2 Ų133.279%0.78676%0.755SS**  trans-66.4110.8171.526-29.6000108.1K47P45-K47 PolarHBondContact O-N 2.95Å
46I61.7Low54.2Low140 Ų140136 Ų13672%0.71876%0.759SS**  trans-65.5104.7170.9-57173000106.4T44 I48T44-I46 PolarHBondContact O-N 3.47Å; I46-I48 VanDerWaalsContact C-N 3.32Å; I46-I48 HydrophobicContact CB-CG1 4.45Å; I46-I48 HydrophobicContact CG2-CD1 4.48Å; I46-I48 HydrophobicContact CG2-CG1 3.69Å; I46-I48 PolarHBondContact O-N 3.38Å
47K55.1Low53.9Low205 Ų205138.7 Ų138.789%0.89176%0.761SS**  trans-6991.9167-73.6-176.4179.6-179.20107.9P45 S49P45-K47 PolarHBondContact O-N 2.95Å; K47-S49 PolarHBondContact O-N 3.36Å; K47-S49 VanDerWaalsContact O-N 3.16Å
48I57.2Low53.4Low133 Ų133138.7 Ų138.768%0.68276%0.759SS**  trans-80.291.6168.4-49174.2000106.3I46 T50I46-I48 VanDerWaalsContact C-N 3.32Å; I46-I48 HydrophobicContact CB-CG1 4.45Å; I46-I48 HydrophobicContact CG2-CD1 4.48Å; I46-I48 HydrophobicContact CG2-CG1 3.69Å; I46-I48 PolarHBondContact O-N 3.38Å; I48-T50 PolarHBondContact O-N 2.93Å; I48-T50 PolarHBondContact O-OG1 3.21Å
49S50.2Low53Low91 Ų91140.4 Ų140.464%0.63676%0.76SS**  trans-64107.5166.9-148.80000106.7K47 D51K47-S49 PolarHBondContact O-N 3.36Å; K47-S49 VanDerWaalsContact O-N 3.16Å; S49-D51 PolarHBondContact O-N 3.06Å; S49-D51 PolarHBondContact OG-OD2 3.27Å
50T54.4Low53Low131 Ų131138.7 Ų138.780%0.80476%0.759SS**  trans-84.561.1177.3-450000107.9I48 K52I48-T50 PolarHBondContact O-N 2.93Å; I48-T50 PolarHBondContact O-OG1 3.21Å; T50-K52 PolarHBondContact O-N 2.72Å
51D52.5Low52.9Low117 Ų117141.1 Ų141.163%0.62676%0.758SS**  trans-94.997175.7-75.2-49.1000109.5S49S49-D51 PolarHBondContact O-N 3.06Å; S49-D51 PolarHBondContact OG-OD2 3.27Å
52K48.7Very low52.4Low191 Ų191140.8 Ų140.883%0.8376%0.759SS**  trans46.983148-56.4-177.5-176-177.30116.2T50T50-K52 PolarHBondContact O-N 2.72Å
53I53.3Low52.2Low151 Ų151141.5 Ų141.577%0.77476%0.762SS**  trans-109.9104.3156.4-58.7175.4000108.4V55I53-V55 HydrophobicContact CG2-CG2 3.63Å
54P48.5Very low52Low120 Ų120142.4 Ų142.478%0.77976%0.757SS**  trans-90.5103.6168.932.5-24.3000108.6
55V51.2Low51.6Low128 Ų128143.3 Ų143.378%0.77677%0.765SS**  trans-124.899.8170.9-178.60000109.9I53I53-V55 HydrophobicContact CG2-CG2 3.63Å
56N47.8Very low51.3Low134 Ų134143.3 Ų143.372%0.71777%0.767SS**  trans-66.7153.8165.8-166.7-6.8000110.1
57K51Low51Low173 Ų173146 Ų14675%0.75277%0.774SS**  trans96.294.8163.8-55178.6-178.5178.20118.4
58T42.9Very low51Low117 Ų117144.2 Ų144.272%0.71877%0.769SS**  52.794.3118-39.50000118
59M48Very low51Low177 Ų177147.2 Ų147.287%0.87278%0.777SS**  trans-122.9103.5146.6-99.6177.87800108.7I61M59-I61 PolarHBondContact O-N 2.84Å
60K48.8Very low51.3Low191 Ų191151.7 Ų151.783%0.8379%0.785SS**  trans-74.2108.5165.3-70.5-176.8178.5-178.90107.3Q62K60-Q62 PolarHBondContact O-N 3.31Å
61I50.4Low51.5Low141 Ų141154.4 Ų154.472%0.72379%0.789SS**  trans-78.3100.8168.5-60.3172.7000106.7M59 T63M59-I61 PolarHBondContact O-N 2.84Å; I61-T63 PolarHBondContact O-N 2.99Å
62Q49.3Very low52Low182 Ų182158.1 Ų158.185%0.8580%0.799SS**  trans-78.4106.3162.8-90-178.5-100108K60K60-Q62 PolarHBondContact O-N 3.31Å
63T49.2Very low52.5Low124 Ų124154.1 Ų154.176%0.76179%0.793SS**  trans-87.6108170-41.20000108.6I61I61-T63 PolarHBondContact O-N 2.99Å
64T57Low53Low118 Ų118151.4 Ų151.472%0.72478%0.78SS**  trans-71.8138.916738.70000110.6S66T64-S66 PolarHBondContact O-N 3.47Å; T64-S66 VanDerWaalsContact O-N 3.15Å
65P51.1Low53.5Low124 Ų124151.1 Ų151.181%0.80578%0.778SS**  trans-74.6107.3178.929.7-31.3000109.8K67P65-K67 PolarHBondContact O-N 3.43Å
66S49.9Very low53.9Low121 Ų121153.9 Ų153.985%0.84678%0.779SS**  trans-72.2119174.4-172.50000109.8T64 E68T64-S66 PolarHBondContact O-N 3.47Å; T64-S66 VanDerWaalsContact O-N 3.15Å; S66-E68 PolarHBondContact O-N 3.24Å
67K55.6Low54.1Low196 Ų196158 Ų15885%0.85279%0.785SS**  trans-63.3116.2174.4-70.6-176.3177.7-179.30109.5P65 K69P65-K67 PolarHBondContact O-N 3.43Å; K67-K69 PolarHBondContact O-N 3Å
68E54.1Low54.2Low168 Ų168158.8 Ų158.879%0.78578%0.784SS**  trans-56.2104171.4-169.8-172.5165.300110.4S66 K70S66-E68 PolarHBondContact O-N 3.24Å; E68-K70 PolarHBondContact O-N 3.42Å
69K57.4Low54.7Low197 Ų197162.6 Ų162.686%0.85779%0.791SS**  trans-77.7104.5164.3-83.9-174.1177-1800107.8K67 Q71K67-K69 PolarHBondContact O-N 3Å; K69-Q71 PolarHBondContact O-N 3.04Å
70K56.9Low54.9Low184 Ų184165.9 Ų165.980%0.879%0.794SS**  trans-57.6107.1168.1-67-168.3176.8-171.70109.5E68 K72E68-K70 PolarHBondContact O-N 3.42Å; K70-K72 PolarHBondContact O-N 3.01Å
71Q57.3Low55.1Low189 Ų189162 Ų16288%0.88379%0.79SS**PPolyproline II helixtrans-75.2120.6173.7-163.2163.224.100108.6K69K69-Q71 PolarHBondContact O-N 3.04Å
72K63Low55.3Low195 Ų195160 Ų16085%0.84879%0.789SS**PPolyproline II helixtrans-59.4133.6175.1-86.5-177.3176.1-175.90109.6K70 D74K70-K72 PolarHBondContact O-N 3.01Å; K72-D74 PolarHBondContact O-N 3.38Å
73P60.7Low55.3Low107 Ų107161 Ų16170%0.69579%0.786SS**PPolyproline II helixtrans-65.7125.117325.4-30.1000109.6P75P73-P75 WeakPolarHBondContact O-CD 3.32Å
74D62.6Low55.3Low94 Ų94163.8 Ų163.850%0.50379%0.791SS.*PPolyproline II helixtrans-69.9116.7176.3-171.9-15.3000109.6K72 K76 R77K72-D74 PolarHBondContact O-N 3.38Å; D74-K76 PolarHBondContact O-N 3.07Å; D74-K76 VanDerWaalsContact O-N 3.08Å; D74-K76 WeakPolarHBondContact OD1-CB 3.48Å; D74-K76 PolarHBondContact OD1-N 3.33Å; D74-K76 VanDerWaalsContact OD1-N 3.09Å; D74-R77 WeakPolarHBondContact O-CB 3.45Å; D74-R77 PolarHBondContact O-N 2.73Å
75P59.9Low55Low113 Ų113166.3 Ų166.373%0.73479%0.792SS**G310 helixtrans-64.7-13.2-177.625.5-32.9000113P73 R77P73-P75 WeakPolarHBondContact O-CD 3.32Å; P75-R77 VanDerWaalsContact C-N 3.32Å
76K59.1Low55.2Low187 Ų187167.3 Ų167.381%0.81379%0.79SS**G310 helixtrans-79.2-12174.1-66.8-177.7179.3177.80113.6D74D74-K76 PolarHBondContact O-N 3.07Å; D74-K76 VanDerWaalsContact O-N 3.08Å; D74-K76 WeakPolarHBondContact OD1-CB 3.48Å; D74-K76 PolarHBondContact OD1-N 3.33Å; D74-K76 VanDerWaalsContact OD1-N 3.09Å
77R53Low55.5Low220 Ų220171.1 Ų171.183%0.8379%0.791SS**G310 helixtrans-84-9.3-177.6-150.4173.6-171.9-157.71.2114D74 P75D74-R77 WeakPolarHBondContact O-CB 3.45Å; D74-R77 PolarHBondContact O-N 2.73Å; P75-R77 VanDerWaalsContact C-N 3.32Å
78Y52.9Low55.4Low190 Ų190170.7 Ų170.775%0.74579%0.79SS**G310 helixtrans-908.4-173.6-96.1-90.6000116
79K52Low55.6Low196 Ų196166.9 Ų166.985%0.85279%0.787SS**SBendtrans-104.723-179-76.2-159.5177.2-170.50115.7
80R52.2Low55.2Low247 Ų247167.1 Ų167.193%0.93279%0.788SS**SBendtrans-132.966.7176.7-77.8-175.9173.9174.5-2112
81S53.6Low54.7Low108 Ų108163.4 Ų163.476%0.75579%0.785SS**SBendtrans-148.30.316762.90000115.9
82S54.6Low54.1Low99 Ų99159.7 Ų159.769%0.69278%0.78SS**SBendtrans-101.913.9-177.169.10000115.2
83Y49.1Very low53.3Low203 Ų203154.6 Ų154.680%0.79677%0.769SS**  trans-126.349.8174.5-70.7-81.8000111K85Y83-K85 PolarHBondContact O-N 2.74Å
84Q49.5Very low52.7Low184 Ų184154 Ų15486%0.8677%0.768SS**  trans-73.281.3148.1-156.1162.515.700105.1D86Q84-D86 PolarHBondContact O-N 2.89Å
85K49.8Very low52.2Low170 Ų170155.3 Ų155.374%0.73978%0.779SS**  trans-52.2113.2167.9-85.7-178.3175.3179.30104.9Y83 K87Y83-K85 PolarHBondContact O-N 2.74Å; K85-K87 PolarHBondContact O-N 2.93Å
86D56.1Low51.7Low146 Ų146156.5 Ų156.578%0.78178%0.778SS**  trans-48.699.5157.8-72.5-36.6000105.6Q84 K88Q84-D86 PolarHBondContact O-N 2.89Å; D86-K88 PolarHBondContact O-N 3.44Å
87K56.3Low51.3Low200 Ų200153.8 Ų153.887%0.8778%0.778SS**  trans-66.382.4162.4-74.9-176.7179.4179.40103K85 A89K85-K87 PolarHBondContact O-N 2.93Å; K87-A89 VanDerWaalsContact C-N 3.34Å; K87-A89 PolarHBondContact O-N 3.45Å
88K53.2Low51.1Low187 Ų187149.6 Ų149.681%0.81377%0.771SS**  trans-47.9112.6161.9-74.8-161.9177.5-158.30103.7D86 K90D86-K88 PolarHBondContact O-N 3.44Å; K88-K90 PolarHBondContact O-N 3.45Å
89A58Low50.8Low89 Ų89142.6 Ų142.674%0.73676%0.757SS**  trans-43.8124.1173.900000105.8K87 S91K87-A89 VanDerWaalsContact C-N 3.34Å; K87-A89 PolarHBondContact O-N 3.45Å; A89-S91 PolarHBondContact O-N 3.49Å
90K49.4Very low50.7Low202 Ų202142 Ų14288%0.87875%0.75SS**  trans-58.898.7165.9-75-178.7177.7-176.80103.5K88 S92K88-K90 PolarHBondContact O-N 3.45Å; K90-S92 PolarHBondContact O-N 2.95Å
91S46.3Very low50.6Low105 Ų105133.2 Ų133.273%0.73473%0.725SS**  trans-54.4105.2164.3175.60000103.4A89 S93A89-S91 PolarHBondContact O-N 3.49Å; S91-S93 PolarHBondContact O-N 3.47Å
92S45.9Very low50.4Low111 Ų111133.9 Ų133.978%0.77672%0.719SS**  trans-67.184.5167.1-169.60000103.8K90 S94K90-S92 PolarHBondContact O-N 2.95Å; S92-S94 PolarHBondContact O-N 3.13Å
93S46Very low50.1Low89 Ų89134.3 Ų134.362%0.62271%0.713SS**  trans-58.485.51621560000104.5S91 T95S91-S93 PolarHBondContact O-N 3.47Å; S93-T95 PolarHBondContact O-N 3.35Å
94S46.3Very low50.1Low94 Ų94132.6 Ų132.666%0.65771%0.71SS**  trans-60.898.9163.5-162.10000103.5S92 L96S92-S94 PolarHBondContact O-N 3.13Å; S94-L96 PolarHBondContact O-N 3.01Å
95T52Low50.2Low122 Ų122129.6 Ų129.675%0.74870%0.699SS**  trans-60.679.7158.916.50000104.7S93 T97S93-T95 PolarHBondContact O-N 3.35Å; T95-T97 VanDerWaalsContact C-N 3.33Å; T95-T97 PolarHBondContact O-N 3.07Å
96L49.8Very low50.4Low137 Ų137124.5 Ų124.572%0.71768%0.682SS**  trans-53.9111.1165.8-152.495.7000102.8S94 I98S94-L96 PolarHBondContact O-N 3.01Å; L96-I98 PolarHBondContact O-N 2.65Å
97T50.8Low50.3Low131 Ų131120.6 Ų120.680%0.80466%0.663SS**  trans-65.593.9178.7-27.70000104.1T95 G99T95-T97 VanDerWaalsContact C-N 3.33Å; T95-T97 PolarHBondContact O-N 3.07Å; T97-G99 PolarHBondContact O-N 3.43Å
98I50.3Low50.1Low131 Ų131113.7 Ų113.767%0.67264%0.639SS**THydrogen-bonded Turntrans-7055.4167.4-55.7168.2000105.6L96 P101L96-I98 PolarHBondContact O-N 2.65Å; I98-P101 HydrophobicContact CG2-CG 3.57Å
99G46.4Very low50.1Low44 Ų44113.1 Ų113.145%0.45464%0.637SS.*THydrogen-bonded Turntrans-97.2-11.8179.300000111.8T97T97-G99 PolarHBondContact O-N 3.43Å
100Y48.5Very low50Low183 Ų183113 Ų11372%0.71863%0.626SS**SBendtrans-142.314.2-172.5-72.3-76000119.1
101P49.9Very low50.3Low63 Ų63108 Ų10841%0.40961%0.609SS.*SBendtrans-82.5-13.3169.329.7-27.5000113.8I98 I105I98-P101 HydrophobicContact CG2-CG 3.57Å; P101-I105 WeakPolarHBondContact O-CD1 3.35Å; P101-I105 WeakPolarHBondContact O-CG1 3.38Å
102I50.7Low50.7Low121 Ų121106 Ų10662%0.62159%0.594SS**Hα-helixtrans-74.5-32.7179.3-58.9172000111F104 I105 T106I102-F104 VanDerWaalsContact C-N 3.31Å; I102-F104 PolarHBondContact O-N 3.03Å; I102-I105 PolarHBondContact O-N 3.06Å; I102-T106 HydrophobicContact CG2-CG2 3.94Å; I102-T106 WeakPolarHBondContact O-CG2 3.48Å; I102-T106 PolarHBondContact O-N 3.36Å; I102-T106 PolarHBondContact O-OG1 3.34Å
103L47.2Very low51.2Low109 Ų109109.1 Ų109.157%0.57159%0.594SS**Hα-helixtrans-68.8-27.9-177.5-150.179.1000112.9T107L103-T107 WeakPolarHBondContact O-CB 3.05Å; L103-T107 WeakPolarHBondContact O-CG2 3.18Å; L103-T107 PolarHBondContact O-N 3.29Å; L103-T107 PolarHBondContact O-OG1 3.42Å
104F49Very low51.7Low166 Ų166113.7 Ų113.773%0.72860%0.603SS**Hα-helixtrans-83-22.1176.7-85.7-85.4000113.8I102 T107 P108I102-F104 VanDerWaalsContact C-N 3.31Å; I102-F104 PolarHBondContact O-N 3.03Å; F104-T107 WeakPolarHBondContact CA-OG1 3.31Å; F104-T107 PolarHBondContact O-OG1 3.39Å; F104-P108 WeakPolarHBondContact O-CD 3.34Å
105I52.1Low52Low122 Ų122116.2 Ų116.263%0.62661%0.609SS**Hα-helixtrans-87.4-31.4177.2-57.8166.4000110.4P101 I102P101-I105 WeakPolarHBondContact O-CD1 3.35Å; P101-I105 WeakPolarHBondContact O-CG1 3.38Å; I102-I105 PolarHBondContact O-N 3.06Å
106T53.3Low51.7Low62 Ų62120 Ų12038%0.3862%0.623SS.*Hα-helixtrans-83.2-28.4179.5580000113.6I102 F109 V110I102-T106 HydrophobicContact CG2-CG2 3.94Å; I102-T106 WeakPolarHBondContact O-CG2 3.48Å; I102-T106 PolarHBondContact O-N 3.36Å; I102-T106 PolarHBondContact O-OG1 3.34Å; T106-F109 PolarHBondContact O-N 3.23Å; T106-F109 VanDerWaalsContact O-N 3.14Å; T106-V110 WeakPolarHBondContact O-CG2 3.35Å; T106-V110 PolarHBondContact O-N 3.22Å
107T55.7Low51.8Low64 Ų64119.2 Ų119.239%0.39362%0.619SS.*Hα-helixtrans-59.2-46.9179.825.50000114.2L103 F104 F109 V110 I111L103-T107 WeakPolarHBondContact O-CB 3.05Å; L103-T107 WeakPolarHBondContact O-CG2 3.18Å; L103-T107 PolarHBondContact O-N 3.29Å; L103-T107 PolarHBondContact O-OG1 3.42Å; F104-T107 WeakPolarHBondContact CA-OG1 3.31Å; F104-T107 PolarHBondContact O-OG1 3.39Å; T107-F109 VanDerWaalsContact C-N 3.28Å; T107-F109 PolarHBondContact O-N 3.24Å; T107-V110 PolarHBondContact O-N 3.41Å; T107-I111 WeakPolarHBondContact O-CD1 3.44Å; T107-I111 WeakPolarHBondContact O-CG1 3.22Å; T107-I111 PolarHBondContact O-N 3.11Å; T107-I111 VanDerWaalsContact O-N 3.11Å
108P52Low51.8Low56 Ų56118.6 Ų118.636%0.36461%0.609SS.*Hα-helixtrans-69.8-25.3175.325.8-32.5000112.8F9 F104 S112F9-P108 HydrophobicContact CZ-CB 4.49Å; F104-P108 WeakPolarHBondContact O-CD 3.34Å; P108-S112 WeakPolarHBondContact O-CB 3.34Å; P108-S112 PolarHBondContact O-N 2.93Å; P108-S112 VanDerWaalsContact O-N 3.16Å
109F53.1Low51.9Low174 Ų174117.9 Ų117.976%0.76361%0.605SS**Hα-helixtrans-75.2-32.3177.4-130.2-89.3000112.7T106 T107T106-F109 PolarHBondContact O-N 3.23Å; T106-F109 VanDerWaalsContact O-N 3.14Å; T107-F109 VanDerWaalsContact C-N 3.28Å; T107-F109 PolarHBondContact O-N 3.24Å
110V55.4Low52.2Low86 Ų86122.2 Ų122.252%0.52161%0.614SS.*Hα-helixtrans-77.9-38.3175.21770000111.3T106 T107 S112 K113T106-V110 WeakPolarHBondContact O-CG2 3.35Å; T106-V110 PolarHBondContact O-N 3.22Å; T107-V110 PolarHBondContact O-N 3.41Å; V110-S112 VanDerWaalsContact C-N 3.33Å; V110-S112 PolarHBondContact O-N 3.14Å; V110-K113 PolarHBondContact O-N 3.19Å
111I55.7Low52.5Low98 Ų98118.4 Ų118.450%0.50361%0.608SS.*Hα-helixtrans-66.6-35.6177.2-64.1162.7000111.1T107 K113 F114 L115T107-I111 WeakPolarHBondContact O-CD1 3.44Å; T107-I111 WeakPolarHBondContact O-CG1 3.22Å; T107-I111 PolarHBondContact O-N 3.11Å; T107-I111 VanDerWaalsContact O-N 3.11Å; I111-K113 PolarHBondContact O-N 3.16Å; I111-F114 PolarHBondContact O-N 3.46Å; I111-L115 HydrophobicContact CG2-CD1 4.02Å
112S54Low52.6Low62 Ų62122.1 Ų122.143%0.43462%0.621SS.*Hα-helixtrans-65.8-17.3175.5-177.90000114.1P108 V110P108-S112 WeakPolarHBondContact O-CB 3.34Å; P108-S112 PolarHBondContact O-N 2.93Å; P108-S112 VanDerWaalsContact O-N 3.16Å; V110-S112 VanDerWaalsContact C-N 3.33Å; V110-S112 PolarHBondContact O-N 3.14Å
113K56.1Low52.8Low178 Ų178122.2 Ų122.277%0.77462%0.621SS**Hα-helixtrans-92.3-13.5176.9-110-155.6178.4-170.20113.9V110 I111V110-K113 PolarHBondContact O-N 3.19Å; I111-K113 PolarHBondContact O-N 3.16Å
114F57.9Low53.2Low185 Ų185123.2 Ų123.281%0.81163%0.625SS**Hα-helixtrans-97.2-8.3178.8-100.6-87.2000113.7I111I111-F114 PolarHBondContact O-N 3.46Å
115L51.4Low53.6Low147 Ų147119.7 Ų119.777%0.7762%0.616SS**  trans-112.215.6-176-102.2145.4000113.4I111I111-L115 HydrophobicContact CG2-CD1 4.02Å
116L46Very low53.7Low202 Ų202119.5 Ų119.5100%1.05862%0.615SS**  trans-118.70172.2-137.7106.2000109.1

Retrieved 116 of 116 residues in 311.2 ms (Link to these results)