C1M270_SCHMA Loading...

U1 small nuclear ribonucleoprotein C

Component of the U1 snRNP, which is essential for recognition of the pre-mRNA 5' splice-site and the subsequent assembly of the spliceosome. U1-C is directly involved in initial 5' splice-site recognition for both constitutive and regulated alternative splicing. The interaction with the 5' splice-site seems to precede base-pairing between the pre-mRNA and the U1 snRNA. Component of the spliceosomal U1 snRNP, which is essential for recognition of the pre-mRNA 5' splice-site and the subsequent assembly of the spliceosome. U1-C is directly involved in initial 5' splice-site recognition for both constitutive and regulated alternative splicing. The interaction with the 5' splice-site seems to precede base-pairing between the pre-mRNA and the U1 snRNA. Stimulates commitment or early (E) complex formation by stabilizing the base pairing of the 5' end of the U1 snRNA and the 5' splice-site region.

AlphaFold DB , UniProt , Accession C1M270, 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
1M66.2Low88.5Confident219 Ų21993.1 Ų93.1100%1.07947%0.468SS*.  0114.40-154.883.9123.400107.4K3M1-K3 PolarHBondContact O-N 2.8Å
2P71.8Confident88.8Confident112 Ų11298.1 Ų98.173%0.72748%0.479SS*.PPolyproline II helixtrans-60.4129.2178.8-16.129.2000109.2
3K83.2Confident89Confident137 Ų13792.2 Ų92.260%0.59645%0.45SS*.PPolyproline II helixtrans-74.6137.3173.5-66.7-178.2-179.5177.90108M1 Y5 Y12M1-K3 PolarHBondContact O-N 2.8Å; K3-Y5 PolarHBondContact O-N 2.94Å; K3-Y12 HydrophobicContact CB-CD1 4.37Å
4Y89.7Confident88.9Confident70 Ų7092.9 Ų92.928%0.27546%0.463SS..PPolyproline II helixtrans-63.4126.6177.2175.2-99.9000110.2C6 L13 D16 R21Y4-C6 HydrophobicContact CE1-CB 4.05Å; Y4-L13 HydrophobicContact CD1-CB 4.16Å; Y4-L13 HydrophobicContact CD1-CD2 4.03Å; Y4-L13 WeakPolarHBondContact O-CB 3.49Å; Y4-L13 PolarHBondContact O-N 3.38Å; Y4-D16 VanDerWaalsContact CB-OD1 3.32Å; Y4-D16 WeakPolarHBondContact CB-OD1 3.33Å; Y4-R21 HydrophobicContact CD1-CG 3.92Å; Y4-R21 VanDerWaalsContact CD2-CD 3.48Å; Y4-R21 HydrophobicContact CD2-CG 4.27Å; Y4-R21 HydrophobicContact CE1-CG 4.25Å; Y4-R21 HydrophobicContact CG-CG 3.92Å
5Y93.6Very high88.7Confident74 Ų7495.3 Ų95.329%0.2947%0.472SS..EExtended strand (participates in β ladder)trans-100.1136.5171.7-176-104.8000109K3 D7 D10 T11 Y12K3-Y5 PolarHBondContact O-N 2.94Å; Y5-D7 VanDerWaalsContact CD1-OD1 3.32Å; Y5-D7 WeakPolarHBondContact CD1-OD1 3.09Å; Y5-D7 WeakPolarHBondContact CE1-OD1 3.45Å; Y5-D10 VanDerWaalsContact OH-CA 3.25Å; Y5-D10 WeakPolarHBondContact OH-CA 3.23Å; Y5-D10 PolarHBondContact OH-OD1 3.26Å; Y5-T11 WeakPolarHBondContact CD2-O 3.48Å; Y5-Y12 AromaticContact CD2-CD1 3.75Å; Y5-Y12 HydrophobicContact CD2-CD1 3.75Å; Y5-Y12 AromaticContact CD2-CD2 3.87Å; Y5-Y12 HydrophobicContact CD2-CD2 3.87Å; Y5-Y12 AromaticContact CD2-CE1 3.58Å; Y5-Y12 HydrophobicContact CD2-CE1 3.58Å; Y5-Y12 AromaticContact CD2-CE2 3.68Å; Y5-Y12 HydrophobicContact CD2-CE2 3.68Å; Y5-Y12 AromaticContact CD2-CG 3.9Å; Y5-Y12 HydrophobicContact CD2-CG 3.9Å; Y5-Y12 AromaticContact CD2-CZ 3.54Å; Y5-Y12 HydrophobicContact CE2-CD2 4.21Å; Y5-Y12 AromaticContact CE2-CE2 3.87Å; Y5-Y12 HydrophobicContact CE2-CE2 3.87Å; Y5-Y12 HydrophobicContact CG-CD1 4.33Å; Y5-Y12 HydrophobicContact CG-CE1 4.04Å
6C94.4Very high88.4Confident2 Ų293.6 Ų93.61%0.01447%0.465CS..EExtended strand (participates in β ladder)trans-104.7113.2171.4-1790000110.1Y4 Y8 C9 D10 T11 H24 H30Y4-C6 HydrophobicContact CE1-CB 4.05Å; C6-Y8 VanDerWaalsContact C-N 3.27Å; C6-Y8 PolarHBondContact O-N 3.29Å; C6-C9 HydrophobicContact CB-CB 4.08Å; C6-C9 PolarHBondContact O-N 2.88Å; C6-C9 VanDerWaalsContact O-N 3.14Å; C6-D10 PolarHBondContact O-N 2.76Å; C6-T11 PolarHBondContact N-O 3.01Å; C6-H24 WeakPolarHBondContact CB-NE2 3.32Å; C6-H24 PolarHBondContact SG-NE2 3.23Å; C6-H30 PolarHBondContact SG-CE1 2.87Å; C6-H30 PolarHBondContact SG-ND1 2.85Å
7D95.3Very high88.5Confident120 Ų12090.4 Ų90.464%0.64245%0.454SS*.THydrogen-bonded Turntrans-64.1-29.1-178.2-55-61.7000113.5Y5Y5-D7 VanDerWaalsContact CD1-OD1 3.32Å; Y5-D7 WeakPolarHBondContact CD1-OD1 3.09Å; Y5-D7 WeakPolarHBondContact CE1-OD1 3.45Å
8Y96.1Very high88.6Confident80 Ų8090.6 Ų90.631%0.31446%0.462SS..THydrogen-bonded Turntrans-77.8-23.2177.5-59.3-69.6000113.1C6 H30 N33 V34 Y37C6-Y8 VanDerWaalsContact C-N 3.27Å; C6-Y8 PolarHBondContact O-N 3.29Å; Y8-H30 AromaticContact CD2-CE1 3.69Å; Y8-N33 WeakPolarHBondContact O-CB 3.41Å; Y8-N33 PolarHBondContact O-ND2 3.11Å; Y8-V34 HydrophobicContact CD1-CG2 3.89Å; Y8-V34 HydrophobicContact CD2-CG2 3.6Å; Y8-V34 HydrophobicContact CE1-CG2 4.27Å; Y8-V34 HydrophobicContact CE2-CG2 4Å; Y8-V34 HydrophobicContact CG-CG2 3.52Å; Y8-Y37 HydrophobicContact CD1-CD1 4.32Å; Y8-Y37 HydrophobicContact CD1-CG 4.06Å; Y8-Y37 AromaticContact CE1-CD1 3.76Å; Y8-Y37 HydrophobicContact CE1-CD1 3.76Å; Y8-Y37 HydrophobicContact CE1-CE1 4.2Å; Y8-Y37 AromaticContact CE1-CG 3.96Å; Y8-Y37 HydrophobicContact CE1-CG 3.96Å
9C95.1Very high88.7Confident27 Ų2790.2 Ų90.218%0.18247%0.469CS..THydrogen-bonded Turntrans-108.9-3.1-173.7-64.40000113C6 T11C6-C9 HydrophobicContact CB-CB 4.08Å; C6-C9 PolarHBondContact O-N 2.88Å; C6-C9 VanDerWaalsContact O-N 3.14Å; C9-T11 HydrophobicContact CB-CG2 3.58Å; C9-T11 PolarHBondContact O-N 3.38Å; C9-T11 VanDerWaalsContact O-N 3.13Å
10D94.6Very high88.9Confident123 Ų12388.1 Ų88.166%0.65846%0.46SS*.THydrogen-bonded Turntrans42.843.4-171-68.1-42.8000113.8Y5 C6Y5-D10 VanDerWaalsContact OH-CA 3.25Å; Y5-D10 WeakPolarHBondContact OH-CA 3.23Å; Y5-D10 PolarHBondContact OH-OD1 3.26Å; C6-D10 PolarHBondContact O-N 2.76Å
11T93.2Very high89.1Confident60 Ų6088 Ų8837%0.36845%0.453SS..EExtended strand (participates in β ladder)trans-137.7143.3-171.6-162.60000113Y5 C6 C9Y5-T11 WeakPolarHBondContact CD2-O 3.48Å; C6-T11 PolarHBondContact N-O 3.01Å; C9-T11 HydrophobicContact CB-CG2 3.58Å; C9-T11 PolarHBondContact O-N 3.38Å; C9-T11 VanDerWaalsContact O-N 3.13Å
12Y92.7Very high90.4Very high153 Ų15385.5 Ų85.560%0.644%0.437SS*.EExtended strand (participates in β ladder)trans-90.8129172.4-69.9-82.8000110.6K3 Y5K3-Y12 HydrophobicContact CB-CD1 4.37Å; Y5-Y12 AromaticContact CD2-CD1 3.75Å; Y5-Y12 HydrophobicContact CD2-CD1 3.75Å; Y5-Y12 AromaticContact CD2-CD2 3.87Å; Y5-Y12 HydrophobicContact CD2-CD2 3.87Å; Y5-Y12 AromaticContact CD2-CE1 3.58Å; Y5-Y12 HydrophobicContact CD2-CE1 3.58Å; Y5-Y12 AromaticContact CD2-CE2 3.68Å; Y5-Y12 HydrophobicContact CD2-CE2 3.68Å; Y5-Y12 AromaticContact CD2-CG 3.9Å; Y5-Y12 HydrophobicContact CD2-CG 3.9Å; Y5-Y12 AromaticContact CD2-CZ 3.54Å; Y5-Y12 HydrophobicContact CE2-CD2 4.21Å; Y5-Y12 AromaticContact CE2-CE2 3.87Å; Y5-Y12 HydrophobicContact CE2-CE2 3.87Å; Y5-Y12 HydrophobicContact CG-CD1 4.33Å; Y5-Y12 HydrophobicContact CG-CE1 4.04Å
13L90.8Very high91.5Very high21 Ų2185.2 Ų85.211%0.1143%0.433CS..  trans-76.8131.6174.8-163.257.7000110.4Y4 H15 V20 R21 H24Y4-L13 HydrophobicContact CD1-CB 4.16Å; Y4-L13 HydrophobicContact CD1-CD2 4.03Å; Y4-L13 WeakPolarHBondContact O-CB 3.49Å; Y4-L13 PolarHBondContact O-N 3.38Å; L13-H15 VanDerWaalsContact C-N 3.31Å; L13-H15 WeakPolarHBondContact CD2-O 3.34Å; L13-H15 PolarHBondContact O-N 2.73Å; L13-V20 HydrophobicContact CD1-CG1 3.6Å; L13-V20 HydrophobicContact CD2-CB 4.14Å; L13-V20 HydrophobicContact CD2-CG1 3.55Å; L13-V20 HydrophobicContact CG-CG1 3.66Å; L13-R21 HydrophobicContact CD2-CG 3.83Å; L13-H24 HydrophobicContact CD1-CB 4.43Å
14T88.1Confident92.1Very high102 Ų10280.6 Ų80.663%0.62641%0.414SS*.SBendtrans-64.5-35.8-17751.30000112.9
15H85.3Confident92.2Very high129 Ų12979.6 Ų79.660%0.59742%0.416SS*.SBendtrans-128.9116.3178.4-63.5-71.5000110.4L13 S17 V20L13-H15 VanDerWaalsContact C-N 3.31Å; L13-H15 WeakPolarHBondContact CD2-O 3.34Å; L13-H15 PolarHBondContact O-N 2.73Å; H15-S17 VanDerWaalsContact C-N 3.26Å; H15-S17 PolarHBondContact O-N 2.9Å; H15-V20 HydrophobicContact CB-CG2 4.4Å
16D84.6Confident92.3Very high68 Ų6878 Ų7836%0.36442%0.422SS..  trans-82.971.5175.9-169.426.7000111.6Y4 R21Y4-D16 VanDerWaalsContact CB-OD1 3.32Å; Y4-D16 WeakPolarHBondContact CB-OD1 3.33Å; D16-R21 VanDerWaalsContact OD1-CD 3.25Å; D16-R21 WeakPolarHBondContact OD1-CD 3.22Å; D16-R21 IonicContact OD1-CZ 3.1Å; D16-R21 IonicContact OD1-NE 3.35Å; D16-R21 PolarHBondContact OD1-NE 3.35Å; D16-R21 IonicContact OD1-NH1 2.6Å; D16-R21 PolarHBondContact OD1-NH1 3.42Å; D16-R21 IonicContact OD2-CZ 3.91Å; D16-R21 IonicContact OD2-NH1 2.89Å; D16-R21 PolarHBondContact OD2-NH1 3.3Å
17S89.6Confident92.4Very high40 Ų4079.1 Ų79.128%0.2843%0.434SS..  trans-110.5149.6170.482.50000110.4H15 S19 V20 R21H15-S17 VanDerWaalsContact C-N 3.26Å; H15-S17 PolarHBondContact O-N 2.9Å; S17-S19 PolarHBondContact O-N 3.4Å; S17-V20 PolarHBondContact O-N 3.41Å; S17-V20 VanDerWaalsContact O-N 3.1Å; S17-V20 WeakPolarHBondContact OG-CB 3.33Å; S17-V20 WeakPolarHBondContact OG-CG2 3.37Å; S17-V20 PolarHBondContact OG-N 3.05Å; S17-R21 PolarHBondContact O-N 2.94Å
18P90Very high92.5Very high93 Ų9382.8 Ų82.860%0.60444%0.439SS*.Hα-helixtrans-57.8-34.6179.722.5-33000112.4K22P18-K22 WeakPolarHBondContact O-CB 3.29Å; P18-K22 PolarHBondContact O-N 3.47Å
19S91.8Very high92.5Very high84 Ų8484.8 Ų84.859%0.58746%0.455SS*.Hα-helixtrans-68.5-41.6177.1-54.70000112.4S17 K22 T23S17-S19 PolarHBondContact O-N 3.4Å; S19-K22 PolarHBondContact O-N 3.31Å; S19-T23 WeakPolarHBondContact O-CB 3.49Å; S19-T23 PolarHBondContact O-N 3.33Å; S19-T23 PolarHBondContact O-OG1 3.16Å
20V92.1Very high92.6Very high48 Ų4884.5 Ų84.529%0.29145%0.451SS..Hα-helixtrans-70.2-41.4179-177.80000109.9L13 H15 S17 K22 T23 H24L13-V20 HydrophobicContact CD1-CG1 3.6Å; L13-V20 HydrophobicContact CD2-CB 4.14Å; L13-V20 HydrophobicContact CD2-CG1 3.55Å; L13-V20 HydrophobicContact CG-CG1 3.66Å; H15-V20 HydrophobicContact CB-CG2 4.4Å; S17-V20 PolarHBondContact O-N 3.41Å; S17-V20 VanDerWaalsContact O-N 3.1Å; S17-V20 WeakPolarHBondContact OG-CB 3.33Å; S17-V20 WeakPolarHBondContact OG-CG2 3.37Å; S17-V20 PolarHBondContact OG-N 3.05Å; V20-K22 PolarHBondContact O-N 2.82Å; V20-T23 PolarHBondContact O-N 2.84Å; V20-H24 WeakPolarHBondContact O-CB 3.39Å; V20-H24 PolarHBondContact O-N 3.37Å
21R93.6Very high92.7Very high85 Ų8584.5 Ų84.532%0.32145%0.445SS..Hα-helixtrans-58.4-46.4172.8-73.7-168.5-70.1-132.91112Y4 L13 D16 S17 T23 H24 C25Y4-R21 HydrophobicContact CD1-CG 3.92Å; Y4-R21 VanDerWaalsContact CD2-CD 3.48Å; Y4-R21 HydrophobicContact CD2-CG 4.27Å; Y4-R21 HydrophobicContact CE1-CG 4.25Å; Y4-R21 HydrophobicContact CG-CG 3.92Å; L13-R21 HydrophobicContact CD2-CG 3.83Å; D16-R21 VanDerWaalsContact OD1-CD 3.25Å; D16-R21 WeakPolarHBondContact OD1-CD 3.22Å; D16-R21 IonicContact OD1-CZ 3.1Å; D16-R21 IonicContact OD1-NE 3.35Å; D16-R21 PolarHBondContact OD1-NE 3.35Å; D16-R21 IonicContact OD1-NH1 2.6Å; D16-R21 PolarHBondContact OD1-NH1 3.42Å; D16-R21 IonicContact OD2-CZ 3.91Å; D16-R21 IonicContact OD2-NH1 2.89Å; D16-R21 PolarHBondContact OD2-NH1 3.3Å; S17-R21 PolarHBondContact O-N 2.94Å; R21-T23 VanDerWaalsContact C-N 3.32Å; R21-T23 PolarHBondContact O-N 2.84Å; R21-H24 WeakPolarHBondContact O-CB 3.44Å; R21-H24 PolarHBondContact O-N 2.91Å; R21-C25 PolarHBondContact O-N 2.87Å; R21-C25 PolarHBondContact O-SG 3.26Å; R21-C25 VanDerWaalsContact O-SG 3.39Å
22K93.3Very high92.8Very high168 Ų16885.3 Ų85.373%0.7345%0.448SS*.Hα-helixtrans-61.3-40.3177.3-174.2176.6-70.5-175.50112.1P18 S19 V20 G26P18-K22 WeakPolarHBondContact O-CB 3.29Å; P18-K22 PolarHBondContact O-N 3.47Å; S19-K22 PolarHBondContact O-N 3.31Å; V20-K22 PolarHBondContact O-N 2.82Å; K22-G26 PolarHBondContact O-N 3.45Å
23T95.1Very high93.1Very high106 Ų10680.6 Ų80.665%0.6543%0.433SS*.Hα-helixtrans-66.9-41.5176.9-54.20000111.3S19 V20 R21 G26 G27S19-T23 WeakPolarHBondContact O-CB 3.49Å; S19-T23 PolarHBondContact O-N 3.33Å; S19-T23 PolarHBondContact O-OG1 3.16Å; V20-T23 PolarHBondContact O-N 2.84Å; R21-T23 VanDerWaalsContact C-N 3.32Å; R21-T23 PolarHBondContact O-N 2.84Å; T23-G26 PolarHBondContact O-N 2.91Å; T23-G27 PolarHBondContact O-N 2.9Å
24H95Very high93.3Very high40 Ų4081.2 Ų81.219%0.18544%0.437CS..Hα-helixtrans-60.7-54175.2176.883.2000111.5C6 L13 V20 R21 G26 G27 H30C6-H24 WeakPolarHBondContact CB-NE2 3.32Å; C6-H24 PolarHBondContact SG-NE2 3.23Å; L13-H24 HydrophobicContact CD1-CB 4.43Å; V20-H24 WeakPolarHBondContact O-CB 3.39Å; V20-H24 PolarHBondContact O-N 3.37Å; R21-H24 WeakPolarHBondContact O-CB 3.44Å; R21-H24 PolarHBondContact O-N 2.91Å; H24-G26 VanDerWaalsContact C-N 3.27Å; H24-G26 PolarHBondContact O-N 3.12Å; H24-G27 PolarHBondContact O-N 3.21Å; H24-H30 AromaticContact CD2-ND1 3.86Å; H24-H30 AromaticContact NE2-ND1 3.57Å; H24-H30 VanDerWaalsContact O-CB 3.29Å; H24-H30 WeakPolarHBondContact O-CB 3.42Å
25C93.1Very high93.7Very high48 Ų4883.4 Ų83.432%0.32444%0.438SS..Hα-helixtrans-63.8-31.3179.1-64.90000113.1R21 G27 H30R21-C25 PolarHBondContact O-N 2.87Å; R21-C25 PolarHBondContact O-SG 3.26Å; R21-C25 VanDerWaalsContact O-SG 3.39Å; C25-G27 VanDerWaalsContact C-N 3.3Å; C25-H30 VanDerWaalsContact CA-CD2 3.49Å; C25-H30 WeakPolarHBondContact CA-CD2 3.28Å; C25-H30 PolarHBondContact O-CD2 3.39Å; C25-H30 VanDerWaalsContact O-CD2 3.22Å
26G95.4Very high94.3Very high41 Ų4181.6 Ų81.642%0.42343%0.43SS..Hα-helixtrans-76.9-15.5175.600000114.3K22 T23 H24 K31K22-G26 PolarHBondContact O-N 3.45Å; T23-G26 PolarHBondContact O-N 2.91Å; H24-G26 VanDerWaalsContact C-N 3.27Å; H24-G26 PolarHBondContact O-N 3.12Å; G26-K31 VanDerWaalsContact O-CE 3.29Å; G26-K31 WeakPolarHBondContact O-CE 3.46Å; G26-K31 PolarHBondContact O-NZ 3.21Å; G26-K31 VanDerWaalsContact O-NZ 3.07Å
27G95.7Very high94.9Very high26 Ų2684.3 Ų84.327%0.26844%0.436SS..SBendtrans-66.2154-177.200000113T23 H24 C25 H30 K31T23-G27 PolarHBondContact O-N 2.9Å; H24-G27 PolarHBondContact O-N 3.21Å; C25-G27 VanDerWaalsContact C-N 3.3Å; G27-H30 PolarHBondContact O-N 3.08Å; G27-K31 WeakPolarHBondContact O-CG 3.4Å; G27-K31 PolarHBondContact O-N 3.35Å
28R96.8Very high95.2Very high197 Ų19788.1 Ų88.174%0.74345%0.445SS*.Hα-helixtrans-60.3-49.1-179.5-178.3174.7178.9177.41.5112.1H30 K31 D32R28-H30 VanDerWaalsContact C-N 3.32Å; R28-H30 PolarHBondContact O-N 2.96Å; R28-K31 PolarHBondContact O-N 3.48Å; R28-K31 VanDerWaalsContact O-N 3.13Å; R28-D32 WeakPolarHBondContact CG-OD2 3.5Å; R28-D32 IonicContact NE-OD2 3.62Å; R28-D32 PolarHBondContact O-N 3.41Å
29N95.7Very high95.4Very high121 Ų12188.5 Ų88.565%0.64744%0.439SS*.Hα-helixtrans-57.8-43.5-178.8-64.37.9000112.3K31 D32 N33N29-K31 PolarHBondContact O-N 3.39Å; N29-D32 PolarHBondContact O-N 3.11Å; N29-N33 WeakPolarHBondContact O-CB 3.45Å; N29-N33 PolarHBondContact O-N 3.45Å; N29-N33 PolarHBondContact O-OD1 2.97Å
30H97.4Very high95.5Very high22 Ų2289.4 Ų89.410%0.10243%0.432CS..Hα-helixtrans-62.7-44.8177.6-179.187.3000111.7C6 Y8 H24 C25 G27 R28 D32 N33 V34C6-H30 PolarHBondContact SG-CE1 2.87Å; C6-H30 PolarHBondContact SG-ND1 2.85Å; Y8-H30 AromaticContact CD2-CE1 3.69Å; H24-H30 AromaticContact CD2-ND1 3.86Å; H24-H30 AromaticContact NE2-ND1 3.57Å; H24-H30 VanDerWaalsContact O-CB 3.29Å; H24-H30 WeakPolarHBondContact O-CB 3.42Å; C25-H30 VanDerWaalsContact CA-CD2 3.49Å; C25-H30 WeakPolarHBondContact CA-CD2 3.28Å; C25-H30 PolarHBondContact O-CD2 3.39Å; C25-H30 VanDerWaalsContact O-CD2 3.22Å; G27-H30 PolarHBondContact O-N 3.08Å; R28-H30 VanDerWaalsContact C-N 3.32Å; R28-H30 PolarHBondContact O-N 2.96Å; H30-D32 PolarHBondContact O-N 2.86Å; H30-N33 PolarHBondContact O-N 3.32Å; H30-V34 WeakPolarHBondContact O-CB 3.42Å; H30-V34 WeakPolarHBondContact O-CG2 3.41Å; H30-V34 PolarHBondContact O-N 3.28Å
31K96.6Very high95.6Very high122 Ų12293 Ų9353%0.5344%0.441SS..Hα-helixtrans-63.7-41.2178.2-70.2173.8178.8166.70112.6G26 G27 R28 N29 V34 K35G26-K31 VanDerWaalsContact O-CE 3.29Å; G26-K31 WeakPolarHBondContact O-CE 3.46Å; G26-K31 PolarHBondContact O-NZ 3.21Å; G26-K31 VanDerWaalsContact O-NZ 3.07Å; G27-K31 WeakPolarHBondContact O-CG 3.4Å; G27-K31 PolarHBondContact O-N 3.35Å; R28-K31 PolarHBondContact O-N 3.48Å; R28-K31 VanDerWaalsContact O-N 3.13Å; N29-K31 PolarHBondContact O-N 3.39Å; K31-V34 PolarHBondContact O-N 3.11Å; K31-K35 WeakPolarHBondContact O-CB 3.49Å; K31-K35 PolarHBondContact O-N 2.92Å
32D97.2Very high95.7Very high78 Ų7893.9 Ų93.942%0.41745%0.451SS..Hα-helixtrans-65.6-44.6179-69.1-17.9000110.3R28 N29 H30 K35 E36R28-D32 WeakPolarHBondContact CG-OD2 3.5Å; R28-D32 IonicContact NE-OD2 3.62Å; R28-D32 PolarHBondContact O-N 3.41Å; N29-D32 PolarHBondContact O-N 3.11Å; H30-D32 PolarHBondContact O-N 2.86Å; D32-K35 WeakPolarHBondContact O-CB 3.44Å; D32-K35 PolarHBondContact O-N 3.37Å; D32-E36 PolarHBondContact O-N 3.19Å
33N97Very high95.8Very high53 Ų5391.2 Ų91.228%0.28344%0.441SS..Hα-helixtrans-65.6-39.5176.4-68.78.8000113Y8 N29 H30 K35 E36 Y37Y8-N33 WeakPolarHBondContact O-CB 3.41Å; Y8-N33 PolarHBondContact O-ND2 3.11Å; N29-N33 WeakPolarHBondContact O-CB 3.45Å; N29-N33 PolarHBondContact O-N 3.45Å; N29-N33 PolarHBondContact O-OD1 2.97Å; H30-N33 PolarHBondContact O-N 3.32Å; N33-K35 VanDerWaalsContact C-N 3.29Å; N33-K35 PolarHBondContact O-N 3.45Å; N33-E36 PolarHBondContact O-N 3.5Å; N33-Y37 WeakPolarHBondContact O-CB 3.38Å; N33-Y37 PolarHBondContact O-N 2.83Å
34V97Very high95.7Very high35 Ų3591 Ų9121%0.21243%0.433CS..Hα-helixtrans-61-42.1174.8168.50000110.4Y8 H30 K31 Y37 Y38Y8-V34 HydrophobicContact CD1-CG2 3.89Å; Y8-V34 HydrophobicContact CD2-CG2 3.6Å; Y8-V34 HydrophobicContact CE1-CG2 4.27Å; Y8-V34 HydrophobicContact CE2-CG2 4Å; Y8-V34 HydrophobicContact CG-CG2 3.52Å; H30-V34 WeakPolarHBondContact O-CB 3.42Å; H30-V34 WeakPolarHBondContact O-CG2 3.41Å; H30-V34 PolarHBondContact O-N 3.28Å; K31-V34 PolarHBondContact O-N 3.11Å; V34-Y37 PolarHBondContact O-N 3.33Å; V34-Y38 HydrophobicContact CG1-CD2 4.02Å; V34-Y38 HydrophobicContact CG1-CE2 3.88Å; V34-Y38 VanDerWaalsContact O-CD2 3.23Å; V34-Y38 WeakPolarHBondContact O-CD2 3.49Å; V34-Y38 PolarHBondContact O-N 3.38Å
35K96.2Very high95.5Very high148 Ų14892.9 Ų92.964%0.64344%0.442SS*.Hα-helixtrans-63.6-47.1176-176.6-175.9174.2-1710111.3K31 D32 N33 Y37 Y38 Q39K31-K35 WeakPolarHBondContact O-CB 3.49Å; K31-K35 PolarHBondContact O-N 2.92Å; D32-K35 WeakPolarHBondContact O-CB 3.44Å; D32-K35 PolarHBondContact O-N 3.37Å; N33-K35 VanDerWaalsContact C-N 3.29Å; N33-K35 PolarHBondContact O-N 3.45Å; K35-Y37 VanDerWaalsContact C-N 3.32Å; K35-Y37 PolarHBondContact O-N 2.96Å; K35-Y38 PolarHBondContact O-N 3.45Å; K35-Q39 WeakPolarHBondContact O-CB 3.04Å; K35-Q39 PolarHBondContact O-N 2.97Å
36E96.2Very high95.5Very high91 Ų9194.4 Ų94.443%0.42545%0.449SS..Hα-helixtrans-60.8-40.7178.1-173.9179.9164.900111.8D32 N33 Y38 Q39 K40D32-E36 PolarHBondContact O-N 3.19Å; N33-E36 PolarHBondContact O-N 3.5Å; E36-Y38 PolarHBondContact O-N 3.38Å; E36-Q39 PolarHBondContact O-N 3.06Å; E36-K40 HydrophobicContact CG-CD 4.3Å; E36-K40 HydrophobicContact CG-CG 4.48Å; E36-K40 WeakPolarHBondContact O-CG 3.22Å; E36-K40 PolarHBondContact O-N 2.92Å; E36-K40 WeakPolarHBondContact OE1-CE 3.16Å; E36-K40 IonicContact OE1-NZ 2.64Å; E36-K40 PolarHBondContact OE1-NZ 3.49Å
37Y97.2Very high95.4Very high125 Ų12597.1 Ų97.149%0.4945%0.451SS..Hα-helixtrans-57.2-51.6176.8175.2-94.9000111.9Y8 N33 V34 K35 Q39 K40 W41Y8-Y37 HydrophobicContact CD1-CD1 4.32Å; Y8-Y37 HydrophobicContact CD1-CG 4.06Å; Y8-Y37 AromaticContact CE1-CD1 3.76Å; Y8-Y37 HydrophobicContact CE1-CD1 3.76Å; Y8-Y37 HydrophobicContact CE1-CE1 4.2Å; Y8-Y37 AromaticContact CE1-CG 3.96Å; Y8-Y37 HydrophobicContact CE1-CG 3.96Å; N33-Y37 WeakPolarHBondContact O-CB 3.38Å; N33-Y37 PolarHBondContact O-N 2.83Å; V34-Y37 PolarHBondContact O-N 3.33Å; K35-Y37 VanDerWaalsContact C-N 3.32Å; K35-Y37 PolarHBondContact O-N 2.96Å; Y37-Q39 VanDerWaalsContact C-N 3.3Å; Y37-Q39 PolarHBondContact O-N 2.89Å; Y37-K40 PolarHBondContact O-N 3.4Å; Y37-W41 WeakPolarHBondContact O-CB 3.33Å; Y37-W41 PolarHBondContact O-N 3.49Å
38Y95.6Very high95.2Very high120 Ų120102.9 Ų102.947%0.47147%0.465SS..Hα-helixtrans-70.7-28.2179.1-73.3-63.3000113V34 K35 E36 L42V34-Y38 HydrophobicContact CG1-CD2 4.02Å; V34-Y38 HydrophobicContact CG1-CE2 3.88Å; V34-Y38 VanDerWaalsContact O-CD2 3.23Å; V34-Y38 WeakPolarHBondContact O-CD2 3.49Å; V34-Y38 PolarHBondContact O-N 3.38Å; K35-Y38 PolarHBondContact O-N 3.45Å; E36-Y38 PolarHBondContact O-N 3.38Å; Y38-L42 WeakPolarHBondContact O-CB 3.34Å; Y38-L42 PolarHBondContact O-N 2.96Å
39Q95Very high94.8Very high100 Ų10099.2 Ų99.247%0.46746%0.459SS..Hα-helixtrans-67-49.8173.5-178.1174.5-11.400111.5K35 E36 Y37 W41 L42 E43K35-Q39 WeakPolarHBondContact O-CB 3.04Å; K35-Q39 PolarHBondContact O-N 2.97Å; E36-Q39 PolarHBondContact O-N 3.06Å; Y37-Q39 VanDerWaalsContact C-N 3.3Å; Y37-Q39 PolarHBondContact O-N 2.89Å; Q39-W41 VanDerWaalsContact C-N 3.29Å; Q39-W41 PolarHBondContact O-N 3.48Å; Q39-L42 WeakPolarHBondContact O-CB 3.45Å; Q39-L42 PolarHBondContact O-N 3.37Å; Q39-L42 VanDerWaalsContact O-N 3.11Å; Q39-E43 WeakPolarHBondContact CG-OE1 3.29Å; Q39-E43 PolarHBondContact NE2-OE1 3.38Å; Q39-E43 VanDerWaalsContact NE2-OE1 3.11Å; Q39-E43 WeakPolarHBondContact O-CG 3.42Å; Q39-E43 PolarHBondContact O-N 3.43Å
40K94.9Very high94.5Very high104 Ų10496.8 Ų96.845%0.45245%0.449SS..Hα-helixtrans-58.8-43.2174.4-73.5179-178.5168.50111.4E36 Y37 L42 E43 E44E36-K40 HydrophobicContact CG-CD 4.3Å; E36-K40 HydrophobicContact CG-CG 4.48Å; E36-K40 WeakPolarHBondContact O-CG 3.22Å; E36-K40 PolarHBondContact O-N 2.92Å; E36-K40 WeakPolarHBondContact OE1-CE 3.16Å; E36-K40 IonicContact OE1-NZ 2.64Å; E36-K40 PolarHBondContact OE1-NZ 3.49Å; Y37-K40 PolarHBondContact O-N 3.4Å; K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 2.93Å; K40-E43 PolarHBondContact O-N 3.24Å; K40-E44 WeakPolarHBondContact O-CG 3.49Å; K40-E44 PolarHBondContact O-N 3.5Å
41W94.1Very high94.2Very high124 Ų12498.9 Ų98.947%0.4746%0.46SS..Hα-helixtrans-58.5-41.9175.1178.474.9000112.1Y37 Q39 E44 Q45Y37-W41 WeakPolarHBondContact O-CB 3.33Å; Y37-W41 PolarHBondContact O-N 3.49Å; Q39-W41 VanDerWaalsContact C-N 3.29Å; Q39-W41 PolarHBondContact O-N 3.48Å; W41-E44 PolarHBondContact O-N 3.32Å; W41-Q45 HydrophobicContact CD2-CG 4.32Å; W41-Q45 HydrophobicContact CZ2-CG 4.15Å; W41-Q45 WeakPolarHBondContact O-CG 3.23Å; W41-Q45 PolarHBondContact O-N 3.13Å
42L94.8Very high93.7Very high103 Ų10399.3 Ų99.354%0.53946%0.464SS..Hα-helixtrans-66.8-41.9176.2-176.763000112Y38 Q39 K40 E44 Q45 V46Y38-L42 WeakPolarHBondContact O-CB 3.34Å; Y38-L42 PolarHBondContact O-N 2.96Å; Q39-L42 WeakPolarHBondContact O-CB 3.45Å; Q39-L42 PolarHBondContact O-N 3.37Å; Q39-L42 VanDerWaalsContact O-N 3.11Å; K40-L42 VanDerWaalsContact C-N 3.3Å; K40-L42 PolarHBondContact O-N 2.93Å; L42-E44 VanDerWaalsContact C-N 3.34Å; L42-E44 PolarHBondContact O-N 3.32Å; L42-Q45 PolarHBondContact O-N 2.96Å; L42-V46 WeakPolarHBondContact O-CG2 3.41Å; L42-V46 PolarHBondContact O-N 3.03Å
43E94.6Very high93.1Very high111 Ų11198.7 Ų98.752%0.51946%0.463SS..Hα-helixtrans-60.8-42.8176.3-71.5169.7-167.100111.3Q39 K40 Q45 V46 Q47Q39-E43 WeakPolarHBondContact CG-OE1 3.29Å; Q39-E43 PolarHBondContact NE2-OE1 3.38Å; Q39-E43 VanDerWaalsContact NE2-OE1 3.11Å; Q39-E43 WeakPolarHBondContact O-CG 3.42Å; Q39-E43 PolarHBondContact O-N 3.43Å; K40-E43 PolarHBondContact O-N 3.24Å; E43-Q45 VanDerWaalsContact C-N 3.34Å; E43-Q45 PolarHBondContact O-N 2.87Å; E43-V46 PolarHBondContact O-N 3.45Å; E43-Q47 WeakPolarHBondContact O-CB 3.43Å; E43-Q47 PolarHBondContact O-N 3.25Å
44E93.4Very high92.4Very high103 Ų10398.1 Ų98.148%0.48146%0.463SS..Hα-helixtrans-61.4-40.7173.2-73.6178.5-167.500112.3K40 W41 L42 Q47 R48K40-E44 WeakPolarHBondContact O-CG 3.49Å; K40-E44 PolarHBondContact O-N 3.5Å; W41-E44 PolarHBondContact O-N 3.32Å; L42-E44 VanDerWaalsContact C-N 3.34Å; L42-E44 PolarHBondContact O-N 3.32Å; E44-Q47 PolarHBondContact O-N 3.47Å; E44-R48 WeakPolarHBondContact O-CG 3.38Å; E44-R48 PolarHBondContact O-N 3.24Å
45Q92.2Very high91.7Very high78 Ų78101.5 Ų101.536%0.36448%0.477SS..Hα-helixtrans-66.8-40.3177.5-70.1-69.298.900112W41 L42 E43 L49W41-Q45 HydrophobicContact CD2-CG 4.32Å; W41-Q45 HydrophobicContact CZ2-CG 4.15Å; W41-Q45 WeakPolarHBondContact O-CG 3.23Å; W41-Q45 PolarHBondContact O-N 3.13Å; L42-Q45 PolarHBondContact O-N 2.96Å; E43-Q45 VanDerWaalsContact C-N 3.34Å; E43-Q45 PolarHBondContact O-N 2.87Å; Q45-L49 PolarHBondContact O-N 3.07Å
46V92.5Very high90.8Very high81 Ų8195.5 Ų95.549%0.49146%0.455SS..Hα-helixtrans-64.6-43.4173.8171.90000110.3L42 E43 R48 L49 V50L42-V46 WeakPolarHBondContact O-CG2 3.41Å; L42-V46 PolarHBondContact O-N 3.03Å; E43-V46 PolarHBondContact O-N 3.45Å; V46-R48 PolarHBondContact O-N 3.48Å; V46-L49 WeakPolarHBondContact O-CB 3.38Å; V46-L49 PolarHBondContact O-N 3.24Å; V46-L49 VanDerWaalsContact O-N 3.12Å; V46-V50 HydrophobicContact CG1-CG2 4.31Å; V46-V50 WeakPolarHBondContact O-CG2 3.29Å; V46-V50 PolarHBondContact O-N 3.45Å
47Q92.6Very high89.8Confident98 Ų9896.9 Ų96.946%0.45846%0.457SS..Hα-helixtrans-61-44.6178.5-170.559.94600111.5E43 E44 L49 V50 D51E43-Q47 WeakPolarHBondContact O-CB 3.43Å; E43-Q47 PolarHBondContact O-N 3.25Å; E44-Q47 PolarHBondContact O-N 3.47Å; Q47-L49 VanDerWaalsContact C-N 3.26Å; Q47-L49 PolarHBondContact O-N 2.92Å; Q47-V50 PolarHBondContact O-N 2.86Å; Q47-V50 VanDerWaalsContact O-N 3.11Å; Q47-D51 PolarHBondContact NE2-OD1 3.21Å; Q47-D51 WeakPolarHBondContact O-CB 3.21Å; Q47-D51 PolarHBondContact O-N 3.49Å
48R91.6Very high88.8Confident146 Ų14699.3 Ų99.355%0.55147%0.47SS*.Hα-helixtrans-57.2-38.7174.3-73.9173.2-177.9157.65.6112.8E44 V46 H52E44-R48 WeakPolarHBondContact O-CG 3.38Å; E44-R48 PolarHBondContact O-N 3.24Å; V46-R48 PolarHBondContact O-N 3.48Å; R48-H52 WeakPolarHBondContact O-CB 3.49Å; R48-H52 PolarHBondContact O-N 2.99Å; R48-H52 VanDerWaalsContact O-N 3.08Å
49L89.2Confident87.7Confident121 Ų12199.8 Ų99.863%0.63448%0.477SS*.Hα-helixtrans-69.1-41.6176.4-178.262.4000111.8Q45 V46 Q47 H52 T53Q45-L49 PolarHBondContact O-N 3.07Å; V46-L49 WeakPolarHBondContact O-CB 3.38Å; V46-L49 PolarHBondContact O-N 3.24Å; V46-L49 VanDerWaalsContact O-N 3.12Å; Q47-L49 VanDerWaalsContact C-N 3.26Å; Q47-L49 PolarHBondContact O-N 2.92Å; L49-H52 PolarHBondContact O-N 2.95Å; L49-T53 WeakPolarHBondContact O-CG2 3.49Å; L49-T53 PolarHBondContact O-N 3.39Å
50V89.6Confident86.1Confident69 Ų6998.2 Ų98.242%0.41849%0.487SS..Hα-helixtrans-62.1-45.1175.7172.70000110.8V46 Q47 T53 S54V46-V50 HydrophobicContact CG1-CG2 4.31Å; V46-V50 WeakPolarHBondContact O-CG2 3.29Å; V46-V50 PolarHBondContact O-N 3.45Å; Q47-V50 PolarHBondContact O-N 2.86Å; Q47-V50 VanDerWaalsContact O-N 3.11Å; V50-T53 VanDerWaalsContact O-CG2 3.23Å; V50-T53 WeakPolarHBondContact O-CG2 3.43Å; V50-T53 PolarHBondContact O-N 3.48Å; V50-S54 VanDerWaalsContact O-CB 3.22Å; V50-S54 WeakPolarHBondContact O-CB 3.22Å; V50-S54 PolarHBondContact O-N 3.32Å; V50-S54 PolarHBondContact O-OG 3.22Å
51D90.4Very high84.5Confident66 Ų66101.3 Ų101.335%0.35350%0.501SS..Hα-helixtrans-61.8-49.2178.9-64.9-22.7000110Q47 T53 S54 E55Q47-D51 PolarHBondContact NE2-OD1 3.21Å; Q47-D51 WeakPolarHBondContact O-CB 3.21Å; Q47-D51 PolarHBondContact O-N 3.49Å; D51-T53 PolarHBondContact O-N 3.06Å; D51-S54 PolarHBondContact O-N 3.44Å; D51-S54 VanDerWaalsContact O-N 3.16Å; D51-S54 PolarHBondContact O-OG 3.29Å; D51-E55 WeakPolarHBondContact O-CB 3.49Å; D51-E55 WeakPolarHBondContact O-CG 3.37Å; D51-E55 PolarHBondContact O-N 2.98Å
52H86Confident82.6Confident132 Ų132100 Ų10061%0.61150%0.501SS*.Hα-helixtrans-60.5-42.6177.8-176.5-91.6000113R48 L49 A56R48-H52 WeakPolarHBondContact O-CB 3.49Å; R48-H52 PolarHBondContact O-N 2.99Å; R48-H52 VanDerWaalsContact O-N 3.08Å; L49-H52 PolarHBondContact O-N 2.95Å; H52-A56 WeakPolarHBondContact O-CB 3.32Å; H52-A56 PolarHBondContact O-N 2.64Å
53T84.5Confident80.7Confident64 Ų64100.3 Ų100.339%0.39351%0.509SS..Hα-helixtrans-70.9-33.6176.8-168.10000112.4L49 V50 D51 Y57L49-T53 WeakPolarHBondContact O-CG2 3.49Å; L49-T53 PolarHBondContact O-N 3.39Å; V50-T53 VanDerWaalsContact O-CG2 3.23Å; V50-T53 WeakPolarHBondContact O-CG2 3.43Å; V50-T53 PolarHBondContact O-N 3.48Å; D51-T53 PolarHBondContact O-N 3.06Å; T53-Y57 WeakPolarHBondContact O-CB 3.25Å; T53-Y57 PolarHBondContact O-N 3.06Å
54S82.6Confident79.1Confident41 Ų4199 Ų9929%0.28751%0.51SS..Hα-helixtrans-70.5-37.3178.279.40000111.5V50 D51 Y57 K58V50-S54 VanDerWaalsContact O-CB 3.22Å; V50-S54 WeakPolarHBondContact O-CB 3.22Å; V50-S54 PolarHBondContact O-N 3.32Å; V50-S54 PolarHBondContact O-OG 3.22Å; D51-S54 PolarHBondContact O-N 3.44Å; D51-S54 VanDerWaalsContact O-N 3.16Å; D51-S54 PolarHBondContact O-OG 3.29Å; S54-Y57 WeakPolarHBondContact O-CB 3.49Å; S54-Y57 PolarHBondContact O-N 2.94Å; S54-K58 WeakPolarHBondContact O-CB 3.09Å; S54-K58 VanDerWaalsContact O-CG 3.29Å; S54-K58 WeakPolarHBondContact O-CG 3.48Å; S54-K58 PolarHBondContact O-N 3.23Å
55E81.9Confident77.5Confident107 Ų10798.8 Ų98.850%0.552%0.517SS..Hα-helixtrans-68.2-43.6173.3-72.2179167.400111.3D51 Y57 K58 Q59D51-E55 WeakPolarHBondContact O-CB 3.49Å; D51-E55 WeakPolarHBondContact O-CG 3.37Å; D51-E55 PolarHBondContact O-N 2.98Å; E55-Y57 PolarHBondContact O-N 3.39Å; E55-K58 PolarHBondContact O-N 2.86Å; E55-Q59 WeakPolarHBondContact O-CB 3.25Å; E55-Q59 VanDerWaalsContact O-CG 3.28Å; E55-Q59 WeakPolarHBondContact O-CG 3.39Å; E55-Q59 PolarHBondContact O-N 3.4Å
56A78.5Confident75.8Confident22 Ų22101.2 Ų101.218%0.18253%0.533CS..Hα-helixtrans-61.1-35.1173.700000112.3H52 K61 M62H52-A56 WeakPolarHBondContact O-CB 3.32Å; H52-A56 PolarHBondContact O-N 2.64Å; A56-K61 PolarHBondContact O-N 3.23Å; A56-M62 HydrophobicContact CB-CG 3.99Å
57Y73.6Confident73.6Confident120 Ų120107.2 Ų107.247%0.47155%0.552SS.*Hα-helixtrans-68.5-46.1174.2-161.9-99.5000111.9T53 S54 E55 Q59 G60 M62T53-Y57 WeakPolarHBondContact O-CB 3.25Å; T53-Y57 PolarHBondContact O-N 3.06Å; S54-Y57 WeakPolarHBondContact O-CB 3.49Å; S54-Y57 PolarHBondContact O-N 2.94Å; E55-Y57 PolarHBondContact O-N 3.39Å; Y57-Q59 VanDerWaalsContact C-N 3.3Å; Y57-Q59 PolarHBondContact O-N 2.9Å; Y57-G60 PolarHBondContact O-N 3.13Å; Y57-M62 HydrophobicContact CD2-CB 4.29Å
58K76.6Confident71.4Confident175 Ų175105.9 Ų105.976%0.76157%0.565SS**Hα-helixtrans-63.1-34175.6-73.7172.5-176.3173.80112.7S54 E55 G60S54-K58 WeakPolarHBondContact O-CB 3.09Å; S54-K58 VanDerWaalsContact O-CG 3.29Å; S54-K58 WeakPolarHBondContact O-CG 3.48Å; S54-K58 PolarHBondContact O-N 3.23Å; E55-K58 PolarHBondContact O-N 2.86Å; K58-G60 PolarHBondContact O-N 3.23Å
59Q72.8Confident68.9Low131 Ų131101.5 Ų101.561%0.61256%0.56SS**THydrogen-bonded Turntrans-74.51.6174.8-70.8-179.922.600113.5E55 Y57 K61E55-Q59 WeakPolarHBondContact O-CB 3.25Å; E55-Q59 VanDerWaalsContact O-CG 3.28Å; E55-Q59 WeakPolarHBondContact O-CG 3.39Å; E55-Q59 PolarHBondContact O-N 3.4Å; Y57-Q59 VanDerWaalsContact C-N 3.3Å; Y57-Q59 PolarHBondContact O-N 2.9Å; Q59-K61 VanDerWaalsContact C-N 3.3Å; Q59-K61 PolarHBondContact O-N 3.44Å
60G61.3Low66.6Low66 Ų66100.7 Ų100.768%0.6857%0.571SS**THydrogen-bonded Turntrans70.718.5171.200000115Y57 K58Y57-G60 PolarHBondContact O-N 3.13Å; K58-G60 PolarHBondContact O-N 3.23Å
61K60.8Low64.5Low170 Ų170101.6 Ų101.674%0.73959%0.585SS**  trans-101.52.5-177.2-75.5175.6178.5171.60114.6A56 Q59A56-K61 PolarHBondContact O-N 3.23Å; Q59-K61 VanDerWaalsContact C-N 3.3Å; Q59-K61 PolarHBondContact O-N 3.44Å
62M54.5Low62.5Low96 Ų96102 Ų10247%0.47361%0.605SS.*SBendtrans-122.4124.4-179.4-64.8-82.2-91.100108.8A56 Y57A56-M62 HydrophobicContact CB-CG 3.99Å; Y57-M62 HydrophobicContact CD2-CB 4.29Å
63P55.9Low61.1Low109 Ų109102.3 Ų102.371%0.70861%0.61SS**  trans-58.4148.6171.425-31000109.2
64P59.5Low59.6Low84 Ų84104.2 Ų104.255%0.54562%0.623SS.*  trans-44.9134.5175.616.7-29.3000109.7L66P64-L66 PolarHBondContact O-N 3.03Å
65P59.9Low58.2Low98 Ų98107.6 Ų107.664%0.63665%0.645SS**  trans-52.7117.117621.7-30.7000106.4F67P65-F67 PolarHBondContact O-N 3.14Å
66L56.4Low56.6Low130 Ų130109.3 Ų109.368%0.68167%0.665SS**  trans-73.443.4-176.3-148.998.2000110P64 G68 A69 I73P64-L66 PolarHBondContact O-N 3.03Å; L66-G68 PolarHBondContact O-N 3.31Å; L66-A69 HydrophobicContact CD1-CB 4.02Å; L66-A69 HydrophobicContact CD2-CB 3.78Å; L66-A69 HydrophobicContact CG-CB 3.59Å; L66-I73 HydrophobicContact CD2-CD1 4.36Å
67F48Very low55.4Low206 Ų206111.1 Ų111.190%0.90469%0.686SS**SBendtrans-93.778.4172.3-156.9-91.1000106.8P65P65-F67 PolarHBondContact O-N 3.14Å
68G44.8Very low54.3Low71 Ų71114 Ų11473%0.73271%0.709SS**  trans139.46.5-179.600000116.1L66 A70L66-G68 PolarHBondContact O-N 3.31Å; G68-A70 PolarHBondContact O-N 2.8Å
69A39Very low53.1Low54 Ų54109 Ų10945%0.44671%0.707SS.*  trans-69.979.3166.400000109.9L66 A71L66-A69 HydrophobicContact CD1-CB 4.02Å; L66-A69 HydrophobicContact CD2-CB 3.78Å; L66-A69 HydrophobicContact CG-CB 3.59Å; A69-A71 PolarHBondContact O-N 2.81Å
70A41.1Very low52.4Low103 Ų103113.7 Ų113.785%0.85172%0.72SS**  trans-65.167.3157.200000109G68G68-A70 PolarHBondContact O-N 2.8Å
71A46.1Very low52.5Low88 Ų88114.9 Ų114.973%0.72772%0.716SS**SBendtrans-174.595.8167.400000110A69A69-A71 PolarHBondContact O-N 2.81Å
72G47.9Very low52.2Low75 Ų75113.1 Ų113.177%0.77372%0.722SS**  trans109.814.4146.300000120P74G72-P74 WeakPolarHBondContact O-CD 3.49Å
73I56.9Low52.4Low138 Ų138119 Ų11971%0.70874%0.739SS**  trans-95108.5169.3-56.7175.7000109L66L66-I73 HydrophobicContact CD2-CD1 4.36Å
74P52.8Low52.8Low104 Ų104124.4 Ų124.468%0.67575%0.747SS**  trans-65145177.526.9-33000110.5G72G72-P74 WeakPolarHBondContact O-CD 3.49Å
75P54.2Low53Low113 Ų113125.6 Ų125.673%0.73475%0.754SS**  trans-57.7132.8-173.720.8-31.2000111.2G77P75-G77 VanDerWaalsContact C-N 3.29Å; P75-G77 PolarHBondContact O-N 3.19Å
76P48Very low53.1Low143 Ų143126.1 Ų126.193%0.92976%0.758SS**SBendtrans-68.189.5176.527.1-31.9000109.2
77G52.8Low53.1Low60 Ų60129 Ų12962%0.61977%0.77SS**  trans-157.9-0.2-175.400000116P75P75-G77 VanDerWaalsContact C-N 3.29Å; P75-G77 PolarHBondContact O-N 3.19Å
78L51.3Low53.6Low181 Ų181126.5 Ų126.595%0.94877%0.765SS**SBendtrans-135.7108.4177.7-94.992.3000110.9
79G51.4Low54Low70 Ų70126.4 Ų126.472%0.72276%0.763SS**  trans121.668.9163.600000114.9P81G79-P81 WeakPolarHBondContact O-CD 3.44Å
80Y57.4Low54.9Low229 Ų229130 Ų13090%0.89878%0.779SS**  trans-85.6108.9159.4-75.7-84.9000109.2
81P64.3Low55.4Low90 Ų90130.6 Ų130.658%0.58478%0.775SS**  trans-74.5139.5155.629.5-31.1000109G79 R83G79-P81 WeakPolarHBondContact O-CD 3.44Å; P81-R83 PolarHBondContact O-N 3.1Å
82P54Low55.7Low134 Ų134133.8 Ų133.887%0.8779%0.785SS**  trans-64.2103.5178.2-3.111.9000110.1
83R57.9Low56.4Low219 Ų219133.2 Ų133.283%0.82678%0.78SS**  trans-100.267.4174.9-78-169.9163.1-167.8-2.6110.6P81P81-R83 PolarHBondContact O-N 3.1Å
84Y65.4Low56.4Low223 Ų223136.7 Ų136.788%0.87579%0.79SS**  trans-112.3105.3155.7-73.6-78.4000108.3
85P63.4Low56.9Low108 Ų108142.5 Ų142.570%0.70180%0.799SS**  trans-67.8142.7157.128.2-30000108.9M87P85-M87 PolarHBondContact O-N 3.44Å
86P62.1Low57.4Low109 Ų109142.2 Ų142.271%0.70880%0.797SS**  trans-60.4126.9-175.324.4-33.1000110.6I88P86-I88 VanDerWaalsContact C-N 3.32Å; P86-I88 PolarHBondContact O-N 3Å
87M56.8Low58.3Low190 Ų190141.5 Ų141.594%0.93679%0.792SS**  trans-61.594.6167.6-83.2-74.4-169.800108.7P85 G89P85-M87 PolarHBondContact O-N 3.44Å; M87-G89 PolarHBondContact O-N 3.45Å
88I57.3Low59.2Low155 Ų155145.9 Ų145.980%0.79580%0.8SS**  trans-80.2106.9169.1-72171.6000107.8P86P86-I88 VanDerWaalsContact C-N 3.32Å; P86-I88 PolarHBondContact O-N 3Å
89G53.4Low60Low68 Ų68142.8 Ų142.870%0.70179%0.791SS**  trans51.183.9145.400000118.3M87M87-G89 PolarHBondContact O-N 3.45Å
90V58.1Low60.9Low130 Ų130147.4 Ų147.479%0.78880%0.798SS**  trans-85.3126154.9-179.10000108.2T92V90-T92 PolarHBondContact O-N 3.2Å
91P52.1Low61.6Low116 Ų116142.2 Ų142.275%0.75379%0.79SS**  trans-63.9123.4176.28.8-6.6000110.6G93P91-G93 PolarHBondContact O-N 2.94Å
92T53Low61.6Low154 Ų154143 Ų14395%0.94580%0.795SS**THydrogen-bonded Turntrans-54.999.2171.6-35.20000109.7V90V90-T92 PolarHBondContact O-N 3.2Å
93G61.7Low62Low64 Ų64142.7 Ų142.766%0.6679%0.793SS**THydrogen-bonded Turntrans-170.9-23-179.300000119P91P91-G93 PolarHBondContact O-N 2.94Å
94F56.8Low61.6Low211 Ų211141.7 Ų141.793%0.92580%0.798SS**  trans-107.692.6-176.5-97.8-96.9000112.1P96F94-P96 WeakPolarHBondContact O-CD 3.32Å
95R63.1Low61.2Low226 Ų226134.4 Ų134.485%0.85379%0.79SS**  trans-91.3112.6162.7-65.3-179.680-147.95.8108.2
96P64.7Low60.9Low107 Ų107138.1 Ų138.170%0.69580%0.801SS**PPolyproline II helixtrans-69.3144.8168.927.1-31000110.2F94F94-P96 WeakPolarHBondContact O-CD 3.32Å
97P67.8Low60.8Low128 Ų128140.9 Ų140.983%0.83181%0.808SS**PPolyproline II helixtrans-66.5132.7-177.125-31.2000111.4
98L70.9Confident60.9Low152 Ų152139.2 Ų139.280%0.79680%0.801SS**PPolyproline II helixtrans-70.2141.8174.5-73.1164.7000110.4L100L98-L100 PolarHBondContact O-N 3.35Å
99P69.4Low61.5Low116 Ų116136.5 Ų136.575%0.75379%0.794SS**PPolyproline II helixtrans-68121173.2-13.227.7000110.7V101P99-V101 PolarHBondContact O-N 2.79Å
100L69Low62Low167 Ų167139.3 Ų139.387%0.87480%0.799SS**PPolyproline II helixtrans-68.6116.7170.5-17671.5000109.4L98L98-L100 PolarHBondContact O-N 3.35Å
101V71.8Confident62.4Low120 Ų120144.4 Ų144.473%0.72780%0.804SS**PPolyproline II helixtrans-82124.2171.4178.50000108.7P99P99-V101 PolarHBondContact O-N 2.79Å
102P66Low63.1Low105 Ų105144.5 Ų144.568%0.68281%0.805SS**PPolyproline II helixtrans-75.3143.8171.428.7-31.5000111.4
103P60.6Low63.5Low128 Ų128145.7 Ų145.783%0.83180%0.8SS**PPolyproline II helixtrans-67.6135-170.825.3-33.3000113.2G105P103-G105 PolarHBondContact O-N 2.98Å
104Q51.4Low63.8Low199 Ų199148.6 Ų148.693%0.9380%0.799SS**PPolyproline II helixtrans-60.2127.7167.9-73149.5-70.500110.2
105G56Low63.9Low69 Ų69143.8 Ų143.871%0.71179%0.789SS**  trans157.670.4164.900000113.9P103P103-G105 PolarHBondContact O-N 2.98Å
106M57.6Low63.8Low186 Ų186143.4 Ų143.492%0.91679%0.788SS**  trans-141.3114.9149.9-72.7-158.6173.800110.8
107I59.6Low63.8Low167 Ų167143.8 Ų143.886%0.85679%0.79SS**  trans-31.3120.9168.4-64.6152.8000112.5
108I58.9Low63.4Low156 Ų156146.6 Ų146.680%0.879%0.792SS**PPolyproline II helixtrans-87.7120.7168.2-58.3175000107.7
109P68.9Low62.4Low98 Ų98145.5 Ų145.564%0.63679%0.794SS**PPolyproline II helixtrans-71145.2172.228.5-32.7000111R111P109-R111 PolarHBondContact O-N 3Å
110P65.4Low61.6Low127 Ų127143 Ų14383%0.82579%0.79SS**PPolyproline II helixtrans-66.9124.2-174.326.7-32.7000110.9
111R65.9Low61Low236 Ų236142.4 Ų142.489%0.89179%0.793SS**PPolyproline II helixtrans-78130.8170.4-96.9-173.4172-141-0.9109.9P109 Q113P109-R111 PolarHBondContact O-N 3Å; R111-Q113 PolarHBondContact O-N 3.32Å
112P66.7Low60.1Low119 Ų119141.4 Ų141.477%0.77380%0.797SS**PPolyproline II helixtrans-61.9125.1173.2-20.131.3000111.5I114P112-I114 PolarHBondContact O-N 2.89Å
113Q61.2Low60.1Low179 Ų179142.8 Ų142.884%0.83680%0.804SS**  trans-70.4112173.5-172.584.222.200109.2R111R111-Q113 PolarHBondContact O-N 3.32Å
114I68.4Low60.5Low124 Ų124142.2 Ų142.264%0.63680%0.799SS**  trans-98118.1165.6-63.8167.7000107.4P112 W116P112-I114 PolarHBondContact O-N 2.89Å; I114-W116 PolarHBondContact O-N 2.6Å
115P58.9Low61.4Low111 Ų111138.2 Ų138.272%0.72179%0.791SS**  trans-75.9115177.31.514000109.4
116W61.3Low62Low218 Ų218141.1 Ų141.183%0.82680%0.795SS**PPolyproline II helixtrans-85129.5167-69.591.2000109.3I114 Q118I114-W116 PolarHBondContact O-N 2.6Å; W116-Q118 PolarHBondContact O-N 3.4Å
117P64.8Low62Low114 Ų114143.2 Ų143.274%0.7479%0.794SS**PPolyproline II helixtrans-71.1128.417928.3-32000110.1
118Q58.9Low62.5Low187 Ų187141.6 Ų141.687%0.87479%0.792SS**PPolyproline II helixtrans-97.6130.4154.5-52.2-158.41.100105.5W116W116-Q118 PolarHBondContact O-N 3.4Å
119P49Very low63.1Low129 Ų129140.3 Ų140.384%0.83879%0.791SS**  -157.5169.290.635.6-15.2000114.8
120G54.4Low63.2Low65 Ų65140.9 Ų140.967%0.6780%0.795SS**  trans127.588.5143.600000116.1
121V54.6Low63.4Low153 Ų153140.7 Ų140.793%0.92779%0.794SS**  trans11.1110.7139.1-70.10000117.6
122A54.2Low62.9Low99 Ų99142 Ų14282%0.81881%0.81SS**  trans-141.2115153.500000108.9
123V64.8Low62.7Low135 Ų135143.1 Ų143.182%0.81881%0.812SS**PPolyproline II helixtrans-58.2144.6179.6-83.50000112.9
124P69.3Low62.8Low115 Ų115141.2 Ų141.275%0.74781%0.811SS**PPolyproline II helixtrans-74.3139.417130.5-32.6000110.8
125P69.8Low62.5Low116 Ų116142.2 Ų142.275%0.75382%0.82SS**PPolyproline II helixtrans-68.3137.1173.627.4-32.3000111.2
126T68.6Low62.7Low129 Ų129144 Ų14479%0.79183%0.826SS**PPolyproline II helixtrans-56.5131.2174.340.90000112.5T128T126-T128 PolarHBondContact O-N 3.33Å
127Y58.3Low62.8Low230 Ų230139.4 Ų139.490%0.90283%0.826SS**PPolyproline II helixtrans-70.3116.2168.8-69.1-90.6000110.3
128T70.6Confident62.7Low133 Ų133141.1 Ų141.182%0.81683%0.832SS**  trans-99.4108.5159420000108.4T126T126-T128 PolarHBondContact O-N 3.33Å
129V71.7Confident63Low129 Ų129137.8 Ų137.878%0.78283%0.829SS**PPolyproline II helixtrans-87.3125.3165.7176.70000107.8
130P70.3Confident64Low111 Ų111138.5 Ų138.572%0.72183%0.828SS**PPolyproline II helixtrans-82.5145.4170.831.1-31.1000111.4
131P68.9Low64.8Low122 Ų122144.6 Ų144.679%0.79284%0.841SS**PPolyproline II helixtrans-86.6130.8178.633-31.7000112.2
132Q57Low65.8Low263 Ų263143.8 Ų143.8100%1.22983%0.834SS**  trans-153.40147-79.2-65.9-30.900107.4

Retrieved 132 of 132 residues in 27.1 ms (Link to these results)