A0A087XUF4_POEFO Loading...

Coiled-coil-helix-coiled-coil-helix domain-containing protein 7

AlphaFold DB (A0A3B3UMN1), UniProt , Accession A0A087XUF4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 85 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
1M40.3Very low46.9Very low239 Ų239147.9 Ų147.9100%1.17773%0.733SS**  0100.50-72.9160.3172.400107.7K3M1-K3 PolarHBondContact O-N 2.92Å
2D41Very low47.4Very low140 Ų140143.3 Ų143.375%0.74971%0.713SS**  trans-63.198.8-176-169.8-96.4000110.7S5D2-S5 PolarHBondContact OD1-OG 3.32Å
3K53.6Low48.4Very low193 Ų193139.1 Ų139.184%0.83969%0.693SS**  trans-91.5115.3167.9-92.5177.2177.4170.90106.9M1M1-K3 PolarHBondContact O-N 2.92Å
4T48.4Very low49.9Very low80 Ų80133.6 Ų133.649%0.49167%0.668SS.*  trans126.726145.1-420000116.2R6 K7T4-R6 PolarHBondContact O-N 3.44Å; T4-K7 HydrophobicContact CG2-CB 4.03Å; T4-K7 HydrophobicContact CG2-CD 3.7Å; T4-K7 HydrophobicContact CG2-CG 3.64Å
5S45.8Very low51.6Low96 Ų96126.7 Ų126.767%0.67164%0.636SS**THydrogen-bonded Turntrans-62.816.2154.1-63.10000114.4D2D2-S5 PolarHBondContact OD1-OG 3.32Å
6R47.7Very low53.7Low234 Ų234118.9 Ų118.988%0.88360%0.598SS**THydrogen-bonded Turntrans-110.33.6-179.8-78.4-173.3-117.1151.1-4.1114.8T4T4-R6 PolarHBondContact O-N 3.44Å
7K45.9Very low55.3Low172 Ų172115.2 Ų115.275%0.74858%0.579SS**SBendtrans-98.5-9.8176.1-81.1-172.8178.9-174.40114.6T4T4-K7 HydrophobicContact CG2-CB 4.03Å; T4-K7 HydrophobicContact CG2-CD 3.7Å; T4-K7 HydrophobicContact CG2-CG 3.64Å
8I44.5Very low56.8Low157 Ų157115.9 Ų115.981%0.80558%0.58SS**THydrogen-bonded Turntrans-80.3-14.3-173.5-73170.7000113.9
9S45.3Very low58.3Low77 Ų77110.4 Ų110.454%0.53855%0.553SS.*THydrogen-bonded Turntrans-126.934.5-167.8-152.60000114.3I13S9-I13 WeakPolarHBondContact O-CD1 3.29Å
10N51.2Low59.6Low71 Ų71106.3 Ų106.338%0.3854%0.535SS..SBendtrans-115.4-41176.7-122.7-69.5000112.6D12 I13 N14 L17N10-D12 PolarHBondContact O-N 3.36Å; N10-I13 PolarHBondContact O-N 3.49Å; N10-N14 PolarHBondContact O-N 2.97Å; N10-N14 PolarHBondContact OD1-ND2 3.48Å; N10-L17 HydrophobicContact CB-CD1 3.69Å; N10-L17 HydrophobicContact CB-CD2 4.5Å; N10-L17 WeakPolarHBondContact O-CD1 3.32Å
11Q51.8Low60.9Low168 Ų168106.4 Ų106.479%0.78554%0.537SS*.THydrogen-bonded Turntrans-60.7-32.4176.9-82178.7-65.100113.1L17 R73Q11-L17 HydrophobicContact CB-CD1 4.49Å; Q11-L17 HydrophobicContact CG-CD1 4.19Å; Q11-L17 VanDerWaalsContact N-CD1 3.32Å; Q11-R73 PolarHBondContact O-NH1 3.07Å
12D53.1Low63.1Low92 Ų9296.2 Ų96.249%0.49249%0.491SS..THydrogen-bonded Turntrans-77.7-24.2176.6-166.3-106.8000112.9N10 R73N10-D12 PolarHBondContact O-N 3.36Å; D12-R73 PolarHBondContact O-NH1 2.76Å; D12-R73 PolarHBondContact O-NH2 3.18Å
13I60.1Low65.2Low89 Ų8989.7 Ų89.746%0.45646%0.456SS..THydrogen-bonded Turntrans-101.9-33.4-174.6-56-175.9000112.6S9 N10 P15 M67S9-I13 WeakPolarHBondContact O-CD1 3.29Å; N10-I13 PolarHBondContact O-N 3.49Å; I13-P15 WeakPolarHBondContact O-CD 3.14Å; I13-M67 WeakPolarHBondContact O-CE 2.99Å
14N69.3Low66.8Low63 Ų6386.7 Ų86.734%0.33745%0.445SS..  trans-113.998.3-175.1-89.4-52.4000111N10 C16 L17N10-N14 PolarHBondContact O-N 2.97Å; N10-N14 PolarHBondContact OD1-ND2 3.48Å; N14-C16 PolarHBondContact O-N 3.25Å; N14-C16 VanDerWaalsContact O-N 3.08Å; N14-L17 HydrophobicContact CB-CD1 3.76Å; N14-L17 HydrophobicContact CB-CG 3.83Å; N14-L17 WeakPolarHBondContact O-CD1 3.43Å; N14-L17 PolarHBondContact O-N 3.49Å
15P76.6Confident68.7Low29 Ų2989.7 Ų89.719%0.18845%0.451CS..THydrogen-bonded Turntrans-71.9-4.9-179.533.9-40.2000113.8I13 W51I13-P15 WeakPolarHBondContact O-CD 3.14Å; P15-W51 HydrophobicContact CB-CD2 3.9Å; P15-W51 HydrophobicContact CB-CG 3.96Å; P15-W51 HydrophobicContact CB-CZ2 4.15Å; P15-W51 HydrophobicContact CG-CB 4.01Å; P15-W51 HydrophobicContact CG-CD2 3.82Å; P15-W51 HydrophobicContact CG-CG 3.4Å; P15-W51 VanDerWaalsContact CG-CG 3.4Å
16C83.9Confident70.8Confident3 Ų385.7 Ų85.72%0.0242%0.423CS..THydrogen-bonded Turntrans-109.223.2179.3-50.10000112.9N14 E19 S20 Y44 C47 R48N14-C16 PolarHBondContact O-N 3.25Å; N14-C16 VanDerWaalsContact O-N 3.08Å; C16-E19 PolarHBondContact O-N 2.88Å; C16-S20 PolarHBondContact O-N 3.33Å; C16-S20 PolarHBondContact O-OG 3.35Å; C16-Y44 HydrophobicContact CB-CD2 3.71Å; C16-Y44 HydrophobicContact CB-CE2 3.64Å; C16-C47 WeakPolarHBondContact CA-SG 3.3Å; C16-C47 HydrophobicContact CB-CB 3.77Å; C16-C47 WeakPolarHBondContact CB-SG 3.05Å; C16-C47 WeakPolarHBondContact SG-CB 3.18Å; C16-C47 CovalentContact SG-SG 2.02Å; C16-C47 PolarHBondContact SG-SG 3.35Å; C16-R48 PolarHBondContact SG-N 3.15Å
17L82.4Confident72.7Confident55 Ų5575.3 Ų75.329%0.28839%0.385SS..Hα-helixtrans-63.7-44-178-102.6155.6000113.2N10 Q11 N14 E19 S20 D21N10-L17 HydrophobicContact CB-CD1 3.69Å; N10-L17 HydrophobicContact CB-CD2 4.5Å; N10-L17 WeakPolarHBondContact O-CD1 3.32Å; Q11-L17 HydrophobicContact CB-CD1 4.49Å; Q11-L17 HydrophobicContact CG-CD1 4.19Å; Q11-L17 VanDerWaalsContact N-CD1 3.32Å; N14-L17 HydrophobicContact CB-CD1 3.76Å; N14-L17 HydrophobicContact CB-CG 3.83Å; N14-L17 WeakPolarHBondContact O-CD1 3.43Å; N14-L17 PolarHBondContact O-N 3.49Å; L17-E19 VanDerWaalsContact C-N 3.27Å; L17-E19 PolarHBondContact O-N 3.19Å; L17-S20 WeakPolarHBondContact O-CB 3.37Å; L17-S20 PolarHBondContact O-N 2.86Å; L17-S20 VanDerWaalsContact O-N 3.16Å; L17-D21 WeakPolarHBondContact O-CB 3.29Å; L17-D21 PolarHBondContact O-N 3.09Å
18E82.4Confident74.8Confident128 Ų12872.6 Ų72.660%0.59838%0.379SS*.Hα-helixtrans-59.6-40177.3-69.9-177.777.400111.8S20 D21 A22 K83E18-S20 VanDerWaalsContact C-N 3.35Å; E18-D21 PolarHBondContact O-N 3.03Å; E18-A22 WeakPolarHBondContact O-CB 3.49Å; E18-A22 PolarHBondContact O-N 2.65Å; E18-K83 IonicContact OE1-NZ 2.62Å; E18-K83 PolarHBondContact OE1-NZ 3.28Å; E18-K83 IonicContact OE2-NZ 2.97Å; E18-K83 PolarHBondContact OE2-NZ 3.06Å
19E84.5Confident76.9Confident12 Ų1269.6 Ų69.66%0.05637%0.368CS..Hα-helixtrans-71.5-32.8178.4-62.9-70.670.900112.2C16 L17 S23 R43 Y44 Y85C16-E19 PolarHBondContact O-N 2.88Å; L17-E19 VanDerWaalsContact C-N 3.27Å; L17-E19 PolarHBondContact O-N 3.19Å; E19-S23 WeakPolarHBondContact O-CB 3.26Å; E19-S23 PolarHBondContact O-N 3.48Å; E19-S23 PolarHBondContact O-OG 3.46Å; E19-R43 WeakPolarHBondContact OE2-CB 2.98Å; E19-R43 VanDerWaalsContact OE2-CD 3.3Å; E19-R43 WeakPolarHBondContact OE2-CD 3.37Å; E19-R43 WeakPolarHBondContact OE2-CG 3.41Å; E19-Y44 HydrophobicContact CB-CD2 4.3Å; E19-Y85 HydrophobicContact CG-CD2 3.83Å; E19-Y85 HydrophobicContact CG-CE2 3.52Å; E19-Y85 VanDerWaalsContact OE2-CD2 3.27Å; E19-Y85 WeakPolarHBondContact OE2-CD2 3.37Å
20S84.7Confident78.8Confident28 Ų2867.2 Ų67.220%0.19635%0.351CS..Hα-helixtrans-66-45173.3-52.20000110.7C16 L17 E18 S23 H24 Y44C16-S20 PolarHBondContact O-N 3.33Å; C16-S20 PolarHBondContact O-OG 3.35Å; L17-S20 WeakPolarHBondContact O-CB 3.37Å; L17-S20 PolarHBondContact O-N 2.86Å; L17-S20 VanDerWaalsContact O-N 3.16Å; E18-S20 VanDerWaalsContact C-N 3.35Å; S20-S23 PolarHBondContact O-N 2.93Å; S20-H24 PolarHBondContact O-N 3.38Å; S20-Y44 WeakPolarHBondContact OG-CD2 3.06Å; S20-Y44 WeakPolarHBondContact OG-CE2 3.44Å
21D86.6Confident80.4Confident109 Ų10971 Ų7158%0.58337%0.371SS*.Hα-helixtrans-63.2-46.4176.8-174.3-98.8000111L17 E18 S23 H24 K25L17-D21 WeakPolarHBondContact O-CB 3.29Å; L17-D21 PolarHBondContact O-N 3.09Å; E18-D21 PolarHBondContact O-N 3.03Å; D21-S23 VanDerWaalsContact C-N 3.31Å; D21-S23 PolarHBondContact O-N 2.84Å; D21-H24 PolarHBondContact O-N 2.87Å; D21-K25 WeakPolarHBondContact O-CB 3.3Å; D21-K25 PolarHBondContact O-N 3.21Å
22A86.1Confident81.9Confident24 Ų2470.9 Ų70.920%0.19837%0.365CS..Hα-helixtrans-60-40.6175.700000112.4E18 K25 C26 Y40E18-A22 WeakPolarHBondContact O-CB 3.49Å; E18-A22 PolarHBondContact O-N 2.65Å; A22-K25 PolarHBondContact O-N 3.04Å; A22-C26 WeakPolarHBondContact O-CB 3.48Å; A22-C26 PolarHBondContact O-N 2.98Å; A22-Y40 HydrophobicContact CB-CD1 3.78Å; A22-Y40 HydrophobicContact CB-CE1 4.08Å
23S86.1Confident83.3Confident4 Ų469.6 Ų69.63%0.02836%0.358CS..Hα-helixtrans-63.6-44.8175-58.80000111.7E19 S20 D21 C26 L27 Y40E19-S23 WeakPolarHBondContact O-CB 3.26Å; E19-S23 PolarHBondContact O-N 3.48Å; E19-S23 PolarHBondContact O-OG 3.46Å; S20-S23 PolarHBondContact O-N 2.93Å; D21-S23 VanDerWaalsContact C-N 3.31Å; D21-S23 PolarHBondContact O-N 2.84Å; S23-C26 PolarHBondContact O-N 2.89Å; S23-L27 WeakPolarHBondContact O-CG 3.14Å; S23-L27 PolarHBondContact O-N 2.9Å; S23-Y40 WeakPolarHBondContact OG-CB 3.48Å; S23-Y40 PolarHBondContact OG-O 3.46Å
24H86.2Confident84.3Confident129 Ų12974.2 Ų74.260%0.59737%0.369SS*.Hα-helixtrans-64.5-41.4176.4-74.6154.7000112.2S20 D21 C26 L27 D28S20-H24 PolarHBondContact O-N 3.38Å; D21-H24 PolarHBondContact O-N 2.87Å; H24-C26 VanDerWaalsContact C-N 3.31Å; H24-C26 PolarHBondContact O-N 2.69Å; H24-L27 WeakPolarHBondContact O-CB 3.37Å; H24-L27 PolarHBondContact O-N 3.31Å; H24-D28 PolarHBondContact O-N 3.21Å
25K88.9Confident85Confident143 Ų14376.1 Ų76.162%0.62239%0.388SS*.Hα-helixtrans-62.6-39.8176.1-171.2174.5-177.6177.40111.7D21 A22 D28 T29D21-K25 WeakPolarHBondContact O-CB 3.3Å; D21-K25 PolarHBondContact O-N 3.21Å; A22-K25 PolarHBondContact O-N 3.04Å; K25-D28 PolarHBondContact O-N 2.89Å; K25-T29 WeakPolarHBondContact O-CG2 3.38Å; K25-T29 PolarHBondContact O-N 3.31Å; K25-T29 VanDerWaalsContact O-N 3.14Å; K25-T29 PolarHBondContact O-OG1 3.08Å
26C89.1Confident85.4Confident13 Ų1381.8 Ų81.89%0.08841%0.409CS..Hα-helixtrans-63.5-42.8173.7-179.30000111.8A22 S23 H24 D28 T29 C30 C37 Y40A22-C26 WeakPolarHBondContact O-CB 3.48Å; A22-C26 PolarHBondContact O-N 2.98Å; S23-C26 PolarHBondContact O-N 2.89Å; H24-C26 VanDerWaalsContact C-N 3.31Å; H24-C26 PolarHBondContact O-N 2.69Å; C26-D28 VanDerWaalsContact C-N 3.32Å; C26-D28 PolarHBondContact O-N 3.36Å; C26-T29 PolarHBondContact O-N 2.92Å; C26-T29 PolarHBondContact O-OG1 2.62Å; C26-T29 VanDerWaalsContact O-OG1 3.11Å; C26-C30 WeakPolarHBondContact O-CB 3.49Å; C26-C30 PolarHBondContact O-N 3.46Å; C26-C30 PolarHBondContact O-SG 3.36Å; C26-C30 VanDerWaalsContact O-SG 3.36Å; C26-C37 HydrophobicContact CB-CB 3.81Å; C26-C37 WeakPolarHBondContact CB-SG 3.48Å; C26-C37 PolarHBondContact O-SG 3.42Å; C26-C37 VanDerWaalsContact O-SG 3.34Å; C26-C37 WeakPolarHBondContact SG-CA 3.39Å; C26-C37 WeakPolarHBondContact SG-CB 3.39Å; C26-C37 CovalentContact SG-SG 2.03Å; C26-C37 PolarHBondContact SG-SG 2.95Å; C26-Y40 HydrophobicContact CB-CD2 3.61Å; C26-Y40 HydrophobicContact CB-CE2 3.72Å; C26-Y40 HydrophobicContact CB-CG 4.27Å; C26-Y40 VanDerWaalsContact SG-CD2 3.58Å; C26-Y40 VanDerWaalsContact SG-CE2 3.6Å
27L88Confident85.6Confident16 Ų1681.7 Ų81.78%0.08441%0.408CS..Hα-helixtrans-61.3-42.1176.4-72.5172.1000111.6S23 H24 T29 C30 N31 Y32 R34 C37 F41S23-L27 WeakPolarHBondContact O-CG 3.14Å; S23-L27 PolarHBondContact O-N 2.9Å; H24-L27 WeakPolarHBondContact O-CB 3.37Å; H24-L27 PolarHBondContact O-N 3.31Å; L27-T29 PolarHBondContact O-N 3.22Å; L27-C30 PolarHBondContact O-N 2.97Å; L27-N31 PolarHBondContact O-N 3.31Å; L27-Y32 HydrophobicContact CB-CD1 4.22Å; L27-Y32 WeakPolarHBondContact O-CA 3.44Å; L27-Y32 PolarHBondContact O-N 3.44Å; L27-R34 HydrophobicContact CD2-CG 4.12Å; L27-C37 PolarHBondContact N-SG 3.2Å; L27-F41 HydrophobicContact CD1-CZ 3.89Å; L27-F41 HydrophobicContact CD2-CE2 4.29Å; L27-F41 HydrophobicContact CD2-CZ 4Å; L27-F41 HydrophobicContact CG-CZ 4.04Å
28D89.2Confident85.8Confident114 Ų11481.8 Ų81.861%0.6141%0.414SS*.Hα-helixtrans-58.7-46.5177.7-175.8-105.4000111.6H24 K25 C26H24-D28 PolarHBondContact O-N 3.21Å; K25-D28 PolarHBondContact O-N 2.89Å; C26-D28 VanDerWaalsContact C-N 3.32Å; C26-D28 PolarHBondContact O-N 3.36Å
29T88.9Confident86Confident95 Ų9578.4 Ų78.458%0.58341%0.408SS*.Hα-helixtrans-75.9-26.2179.563.30000113.9K25 C26 L27K25-T29 WeakPolarHBondContact O-CG2 3.38Å; K25-T29 PolarHBondContact O-N 3.31Å; K25-T29 VanDerWaalsContact O-N 3.14Å; K25-T29 PolarHBondContact O-OG1 3.08Å; C26-T29 PolarHBondContact O-N 2.92Å; C26-T29 PolarHBondContact O-OG1 2.62Å; C26-T29 VanDerWaalsContact O-OG1 3.11Å; L27-T29 PolarHBondContact O-N 3.22Å
30C85Confident86.1Confident27 Ų2782.2 Ų82.218%0.18242%0.422CS..THydrogen-bonded Turntrans-97.417.4-176.5-66.60000113.8C26 L27 Y32 D33 K36C26-C30 WeakPolarHBondContact O-CB 3.49Å; C26-C30 PolarHBondContact O-N 3.46Å; C26-C30 PolarHBondContact O-SG 3.36Å; C26-C30 VanDerWaalsContact O-SG 3.36Å; L27-C30 PolarHBondContact O-N 2.97Å; C30-Y32 PolarHBondContact O-N 3.28Å; C30-D33 HydrophobicContact CB-CB 4.28Å; C30-D33 WeakPolarHBondContact O-CB 3.13Å; C30-D33 PolarHBondContact O-N 2.81Å; C30-K36 HydrophobicContact CB-CB 4.27Å; C30-K36 HydrophobicContact CB-CD 4.17Å
31N86.4Confident86.1Confident150 Ų15083.7 Ų83.780%0.80243%0.425SS*.THydrogen-bonded Turntrans53.838.9-175.9-65.5-87.6000112.9L27 D33L27-N31 PolarHBondContact O-N 3.31Å; N31-D33 PolarHBondContact O-N 3.43Å
32Y81.5Confident86.2Confident166 Ų16683.8 Ų83.865%0.65142%0.422SS*.THydrogen-bonded Turntrans62.920-177.1-66-104.5000114.8L27 C30 R34L27-Y32 HydrophobicContact CB-CD1 4.22Å; L27-Y32 WeakPolarHBondContact O-CA 3.44Å; L27-Y32 PolarHBondContact O-N 3.44Å; C30-Y32 PolarHBondContact O-N 3.28Å; Y32-R34 PolarHBondContact O-N 3.43Å
33D84Confident86.3Confident64 Ų6488.1 Ų88.134%0.34243%0.434SS..  trans-69.8101.6173.1-165.4-73.5000110.7C30 N31 S35 K36C30-D33 HydrophobicContact CB-CB 4.28Å; C30-D33 WeakPolarHBondContact O-CB 3.13Å; C30-D33 PolarHBondContact O-N 2.81Å; N31-D33 PolarHBondContact O-N 3.43Å; D33-S35 PolarHBondContact O-N 3.4Å; D33-S35 VanDerWaalsContact OD1-CB 3.32Å; D33-S35 WeakPolarHBondContact OD1-CB 3.35Å; D33-S35 PolarHBondContact OD1-N 3.43Å; D33-S35 VanDerWaalsContact OD1-N 3.13Å; D33-K36 HydrophobicContact CB-CD 4.22Å; D33-K36 HydrophobicContact CB-CG 4.39Å; D33-K36 PolarHBondContact O-N 3.39Å; D33-K36 PolarHBondContact OD1-N 2.85Å; D33-K36 VanDerWaalsContact OD1-N 3.11Å
34R81.3Confident86.3Confident187 Ų18790.9 Ų90.971%0.70644%0.444SS*.THydrogen-bonded Turntrans-66-26.8-177.3-63.7-175.8177.8101.9-0112.8L27 Y32 C37 S38 F41L27-R34 HydrophobicContact CD2-CG 4.12Å; Y32-R34 PolarHBondContact O-N 3.43Å; R34-C37 CarbonylContact O-C 3.59Å; R34-C37 PolarHBondContact O-N 3.02Å; R34-S38 PolarHBondContact O-N 2.8Å; R34-S38 VanDerWaalsContact O-N 3.15Å; R34-F41 HydrophobicContact CB-CE2 4.28Å; R34-F41 HydrophobicContact CG-CE2 4.47Å
35S84.3Confident86.4Confident103 Ų10391.5 Ų91.572%0.7245%0.445SS*.THydrogen-bonded Turntrans-68-41.4-177.8-58.30000110.7D33 C37 S38D33-S35 PolarHBondContact O-N 3.4Å; D33-S35 VanDerWaalsContact OD1-CB 3.32Å; D33-S35 WeakPolarHBondContact OD1-CB 3.35Å; D33-S35 PolarHBondContact OD1-N 3.43Å; D33-S35 VanDerWaalsContact OD1-N 3.13Å; S35-C37 VanDerWaalsContact C-N 3.27Å; S35-C37 PolarHBondContact O-N 3.39Å; S35-S38 WeakPolarHBondContact O-CB 3.34Å; S35-S38 PolarHBondContact O-N 2.96Å
36K82.9Confident86.5Confident148 Ų14888.3 Ų88.364%0.64343%0.434SS*.THydrogen-bonded Turntrans-65.3-31.3175.7-68179.5-177.1176.80113C30 D33C30-K36 HydrophobicContact CB-CB 4.27Å; C30-K36 HydrophobicContact CB-CD 4.17Å; D33-K36 HydrophobicContact CB-CD 4.22Å; D33-K36 HydrophobicContact CB-CG 4.39Å; D33-K36 PolarHBondContact O-N 3.39Å; D33-K36 PolarHBondContact OD1-N 2.85Å; D33-K36 VanDerWaalsContact OD1-N 3.11Å
37C88.5Confident86.4Confident0 Ų087.7 Ų87.70%043%0.43CS..THydrogen-bonded Turntrans-95.68-177.9-55.90000114.3C26 L27 R34 S35 A39 Y40 F41C26-C37 HydrophobicContact CB-CB 3.81Å; C26-C37 WeakPolarHBondContact CB-SG 3.48Å; C26-C37 PolarHBondContact O-SG 3.42Å; C26-C37 VanDerWaalsContact O-SG 3.34Å; C26-C37 WeakPolarHBondContact SG-CA 3.39Å; C26-C37 WeakPolarHBondContact SG-CB 3.39Å; C26-C37 CovalentContact SG-SG 2.03Å; C26-C37 PolarHBondContact SG-SG 2.95Å; L27-C37 PolarHBondContact N-SG 3.2Å; R34-C37 CarbonylContact O-C 3.59Å; R34-C37 PolarHBondContact O-N 3.02Å; S35-C37 VanDerWaalsContact C-N 3.27Å; S35-C37 PolarHBondContact O-N 3.39Å; C37-A39 PolarHBondContact O-N 3.38Å; C37-A39 VanDerWaalsContact O-N 3.15Å; C37-Y40 HydrophobicContact CB-CD2 4.36Å; C37-Y40 WeakPolarHBondContact O-CB 3.2Å; C37-Y40 PolarHBondContact O-N 3.22Å; C37-F41 HydrophobicContact CB-CD2 4.21Å; C37-F41 HydrophobicContact CB-CE2 3.76Å; C37-F41 WeakPolarHBondContact O-CD2 2.97Å; C37-F41 PolarHBondContact O-N 2.86Å
38S86.3Confident86.4Confident57 Ų5794.3 Ų94.340%0.39945%0.454SS..Hα-helixtrans-52.2-39.4-177.7-172.30000112.8R34 S35 Y40 F41 Q42R34-S38 PolarHBondContact O-N 2.8Å; R34-S38 VanDerWaalsContact O-N 3.15Å; S35-S38 WeakPolarHBondContact O-CB 3.34Å; S35-S38 PolarHBondContact O-N 2.96Å; S38-Y40 PolarHBondContact O-N 3.03Å; S38-F41 PolarHBondContact O-N 3.49Å; S38-Q42 WeakPolarHBondContact O-CG 3.33Å; S38-Q42 PolarHBondContact O-N 3.45Å
39A86.8Confident86.4Confident58 Ų5896.5 Ų96.548%0.47946%0.458SS..Hα-helixtrans-58.6-44.1177.100000112.7C37 Q42 R43C37-A39 PolarHBondContact O-N 3.38Å; C37-A39 VanDerWaalsContact O-N 3.15Å; A39-Q42 PolarHBondContact O-N 3.18Å; A39-R43 VanDerWaalsContact O-CB 3.32Å; A39-R43 WeakPolarHBondContact O-CB 3.32Å; A39-R43 PolarHBondContact O-N 2.93Å
40Y86.8Confident86.4Confident91 Ų9194.6 Ų94.636%0.35744%0.441SS..Hα-helixtrans-67-38.2177.4-63.9-81.4000111.9A22 S23 C26 C37 S38 R43 Y44A22-Y40 HydrophobicContact CB-CD1 3.78Å; A22-Y40 HydrophobicContact CB-CE1 4.08Å; S23-Y40 WeakPolarHBondContact OG-CB 3.48Å; S23-Y40 PolarHBondContact OG-O 3.46Å; C26-Y40 HydrophobicContact CB-CD2 3.61Å; C26-Y40 HydrophobicContact CB-CE2 3.72Å; C26-Y40 HydrophobicContact CB-CG 4.27Å; C26-Y40 VanDerWaalsContact SG-CD2 3.58Å; C26-Y40 VanDerWaalsContact SG-CE2 3.6Å; C37-Y40 HydrophobicContact CB-CD2 4.36Å; C37-Y40 WeakPolarHBondContact O-CB 3.2Å; C37-Y40 PolarHBondContact O-N 3.22Å; S38-Y40 PolarHBondContact O-N 3.03Å; Y40-R43 WeakPolarHBondContact O-CB 3.3Å; Y40-R43 PolarHBondContact O-N 3.33Å; Y40-Y44 PolarHBondContact O-N 2.9Å
41F85.9Confident86.5Confident59 Ų5993.5 Ų93.526%0.25943%0.433SS..Hα-helixtrans-67.1-38.7174.4-67.1-62.9000112.9L27 R34 C37 S38 R43 Y44 K45L27-F41 HydrophobicContact CD1-CZ 3.89Å; L27-F41 HydrophobicContact CD2-CE2 4.29Å; L27-F41 HydrophobicContact CD2-CZ 4Å; L27-F41 HydrophobicContact CG-CZ 4.04Å; R34-F41 HydrophobicContact CB-CE2 4.28Å; R34-F41 HydrophobicContact CG-CE2 4.47Å; C37-F41 HydrophobicContact CB-CD2 4.21Å; C37-F41 HydrophobicContact CB-CE2 3.76Å; C37-F41 WeakPolarHBondContact O-CD2 2.97Å; C37-F41 PolarHBondContact O-N 2.86Å; S38-F41 PolarHBondContact O-N 3.49Å; F41-R43 VanDerWaalsContact C-N 3.33Å; F41-Y44 PolarHBondContact O-N 3.33Å; F41-K45 WeakPolarHBondContact O-CB 3.45Å; F41-K45 VanDerWaalsContact O-CG 3.32Å; F41-K45 WeakPolarHBondContact O-CG 3.48Å; F41-K45 PolarHBondContact O-N 2.02Å
42Q88.8Confident86.6Confident111 Ų11191.9 Ų91.952%0.51942%0.42SS..Hα-helixtrans-61.7-45.5174.8-75.5-178.7-79.400110.6S38 A39 K45 N46S38-Q42 WeakPolarHBondContact O-CG 3.33Å; S38-Q42 PolarHBondContact O-N 3.45Å; A39-Q42 PolarHBondContact O-N 3.18Å; Q42-K45 WeakPolarHBondContact O-CB 3.24Å; Q42-K45 PolarHBondContact O-N 2.67Å; Q42-N46 WeakPolarHBondContact O-CB 3.32Å; Q42-N46 PolarHBondContact O-N 3Å; Q42-N46 PolarHBondContact O-ND2 3.2Å; Q42-N46 PolarHBondContact O-OD1 2.96Å
43R87.8Confident87Confident116 Ų11688.4 Ų88.444%0.43841%0.413SS..Hα-helixtrans-52-52.7171.3-104.8177.3-169.9-155.45.4113.8E19 A39 Y40 F41 K45 N46 C47 Y85E19-R43 WeakPolarHBondContact OE2-CB 2.98Å; E19-R43 VanDerWaalsContact OE2-CD 3.3Å; E19-R43 WeakPolarHBondContact OE2-CD 3.37Å; E19-R43 WeakPolarHBondContact OE2-CG 3.41Å; A39-R43 VanDerWaalsContact O-CB 3.32Å; A39-R43 WeakPolarHBondContact O-CB 3.32Å; A39-R43 PolarHBondContact O-N 2.93Å; Y40-R43 WeakPolarHBondContact O-CB 3.3Å; Y40-R43 PolarHBondContact O-N 3.33Å; F41-R43 VanDerWaalsContact C-N 3.33Å; R43-K45 PolarHBondContact O-N 2.7Å; R43-N46 PolarHBondContact O-N 2.89Å; R43-C47 PolarHBondContact O-N 3.44Å; R43-Y85 WeakPolarHBondContact CG-OXT 3.46Å
44Y86.6Confident87.2Confident62 Ų6286.7 Ų86.724%0.24340%0.403CS..Hα-helixtrans-59.2-42.8174.3176.7-104.3000112.9C16 E19 S20 Y40 F41 C47 R48C16-Y44 HydrophobicContact CB-CD2 3.71Å; C16-Y44 HydrophobicContact CB-CE2 3.64Å; E19-Y44 HydrophobicContact CB-CD2 4.3Å; S20-Y44 WeakPolarHBondContact OG-CD2 3.06Å; S20-Y44 WeakPolarHBondContact OG-CE2 3.44Å; Y40-Y44 PolarHBondContact O-N 2.9Å; F41-Y44 PolarHBondContact O-N 3.33Å; Y44-C47 PolarHBondContact O-N 3.06Å; Y44-R48 HydrophobicContact CE1-CG 4.33Å; Y44-R48 HydrophobicContact CE2-CG 4.34Å; Y44-R48 PolarHBondContact O-N 3.12Å
45K88.1Confident87.5Confident142 Ų14280.5 Ų80.562%0.61738%0.383SS*.Hα-helixtrans-63.7-42.4176.2-74.7175.6-178.8179.80111.9F41 Q42 R43 R48 K49F41-K45 WeakPolarHBondContact O-CB 3.45Å; F41-K45 VanDerWaalsContact O-CG 3.32Å; F41-K45 WeakPolarHBondContact O-CG 3.48Å; F41-K45 PolarHBondContact O-N 2.02Å; Q42-K45 WeakPolarHBondContact O-CB 3.24Å; Q42-K45 PolarHBondContact O-N 2.67Å; R43-K45 PolarHBondContact O-N 2.7Å; K45-R48 PolarHBondContact O-N 2.84Å; K45-K49 WeakPolarHBondContact O-CB 3.18Å; K45-K49 PolarHBondContact O-N 3.1Å
46N89.6Confident87.9Confident75 Ų7577.6 Ų77.640%0.40136%0.361SS..Hα-helixtrans-63.8-44.4178.3-71.1-14.6000110.7Q42 R43 R48 K49 Y50 Y85Q42-N46 WeakPolarHBondContact O-CB 3.32Å; Q42-N46 PolarHBondContact O-N 3Å; Q42-N46 PolarHBondContact O-ND2 3.2Å; Q42-N46 PolarHBondContact O-OD1 2.96Å; R43-N46 PolarHBondContact O-N 2.89Å; N46-R48 PolarHBondContact O-N 3.36Å; N46-K49 PolarHBondContact O-N 2.84Å; N46-Y50 WeakPolarHBondContact O-CB 3.27Å; N46-Y50 PolarHBondContact O-N 3.25Å; N46-Y85 VanDerWaalsContact CB-CB 3.44Å
47C88.7Confident88.2Confident0 Ų075.1 Ų75.10%035%0.352CS..Hα-helixtrans-56.7-51.9173.4177.30000111.6C16 R43 Y44 K49 Y50 W51 Y85C16-C47 WeakPolarHBondContact CA-SG 3.3Å; C16-C47 HydrophobicContact CB-CB 3.77Å; C16-C47 WeakPolarHBondContact CB-SG 3.05Å; C16-C47 WeakPolarHBondContact SG-CB 3.18Å; C16-C47 CovalentContact SG-SG 2.02Å; C16-C47 PolarHBondContact SG-SG 3.35Å; R43-C47 PolarHBondContact O-N 3.44Å; Y44-C47 PolarHBondContact O-N 3.06Å; C47-K49 VanDerWaalsContact C-N 3.28Å; C47-K49 PolarHBondContact O-N 3Å; C47-Y50 PolarHBondContact O-N 3.4Å; C47-W51 PolarHBondContact O-N 3.38Å; C47-W51 VanDerWaalsContact O-N 3.08Å; C47-W51 VanDerWaalsContact SG-CD1 3.53Å; C47-Y85 VanDerWaalsContact CA-CD1 3.47Å; C47-Y85 HydrophobicContact CB-CD1 3.6Å; C47-Y85 HydrophobicContact CB-CD2 3.77Å; C47-Y85 HydrophobicContact CB-CE1 3.65Å; C47-Y85 HydrophobicContact CB-CE2 3.79Å; C47-Y85 HydrophobicContact CB-CG 3.66Å; C47-Y85 VanDerWaalsContact SG-CE1 3.6Å
48R86.8Confident88.3Confident156 Ų15677 Ų7759%0.58936%0.359SS*.Hα-helixtrans-59.5-40.1177.8-80-131.5-67.9168.7-3.8112.2C16 Y44 K45 N46 H52C16-R48 PolarHBondContact SG-N 3.15Å; Y44-R48 HydrophobicContact CE1-CG 4.33Å; Y44-R48 HydrophobicContact CE2-CG 4.34Å; Y44-R48 PolarHBondContact O-N 3.12Å; K45-R48 PolarHBondContact O-N 2.84Å; N46-R48 PolarHBondContact O-N 3.36Å; R48-H52 WeakPolarHBondContact O-CB 2.95Å; R48-H52 PolarHBondContact O-N 3.13Å
49K89.6Confident88.5Confident159 Ų15982.3 Ų82.369%0.69137%0.37SS*.Hα-helixtrans-64.6-42178.8-172.8177.3179.6-178.20111.8K45 N46 C47 H52 N53K45-K49 WeakPolarHBondContact O-CB 3.18Å; K45-K49 PolarHBondContact O-N 3.1Å; N46-K49 PolarHBondContact O-N 2.84Å; C47-K49 VanDerWaalsContact C-N 3.28Å; C47-K49 PolarHBondContact O-N 3Å; K49-H52 PolarHBondContact O-N 3.33Å; K49-N53 PolarHBondContact O-N 2.99Å
50Y88.9Confident88.7Confident55 Ų5588.6 Ų88.622%0.21638%0.382CS..Hα-helixtrans-60.9-55.6177.1179.1-96.4000111.1N46 C47 H52 N53 I54 I80 P84N46-Y50 WeakPolarHBondContact O-CB 3.27Å; N46-Y50 PolarHBondContact O-N 3.25Å; C47-Y50 PolarHBondContact O-N 3.4Å; Y50-H52 VanDerWaalsContact C-N 3.27Å; Y50-H52 PolarHBondContact O-N 3.15Å; Y50-N53 WeakPolarHBondContact O-CB 3.44Å; Y50-N53 PolarHBondContact O-N 3.33Å; Y50-I54 HydrophobicContact CD1-CG1 4.48Å; Y50-I54 HydrophobicContact CE1-CG1 4.05Å; Y50-I54 PolarHBondContact O-N 3.27Å; Y50-I54 VanDerWaalsContact O-N 3.09Å; Y50-I80 HydrophobicContact CE2-CD1 3.88Å; Y50-I80 WeakPolarHBondContact OH-CD1 3.47Å; Y50-P84 HydrophobicContact CD1-CG 4.16Å; Y50-P84 HydrophobicContact CD2-CB 4.35Å; Y50-P84 HydrophobicContact CD2-CG 3.79Å; Y50-P84 HydrophobicContact CE1-CG 4.3Å; Y50-P84 HydrophobicContact CE2-CG 3.94Å; Y50-P84 HydrophobicContact CG-CG 3.92Å
51W87.3Confident88.9Confident5 Ų590.1 Ų90.12%0.01940%0.396CS..Hα-helixtrans-63.7-33.8179.3-67.2109.6000112.9P15 C47 N53 I54 M55 P68 R73 M76 L77P15-W51 HydrophobicContact CB-CD2 3.9Å; P15-W51 HydrophobicContact CB-CG 3.96Å; P15-W51 HydrophobicContact CB-CZ2 4.15Å; P15-W51 HydrophobicContact CG-CB 4.01Å; P15-W51 HydrophobicContact CG-CD2 3.82Å; P15-W51 HydrophobicContact CG-CG 3.4Å; P15-W51 VanDerWaalsContact CG-CG 3.4Å; C47-W51 PolarHBondContact O-N 3.38Å; C47-W51 VanDerWaalsContact O-N 3.08Å; C47-W51 VanDerWaalsContact SG-CD1 3.53Å; W51-N53 VanDerWaalsContact C-N 3.35Å; W51-I54 PolarHBondContact O-N 2.93Å; W51-M55 WeakPolarHBondContact O-CG 3.22Å; W51-M55 PolarHBondContact O-N 2.73Å; W51-P68 HydrophobicContact CE3-CG 3.56Å; W51-P68 HydrophobicContact CZ3-CB 4.36Å; W51-P68 HydrophobicContact CZ3-CG 3.43Å; W51-P68 VanDerWaalsContact CZ3-CG 3.43Å; W51-R73 HydrophobicContact CE3-CG 4.31Å; W51-R73 HydrophobicContact CH2-CB 3.4Å; W51-R73 VanDerWaalsContact CH2-CB 3.4Å; W51-R73 HydrophobicContact CH2-CG 3.4Å; W51-R73 HydrophobicContact CZ2-CB 3.94Å; W51-R73 HydrophobicContact CZ2-CG 4.04Å; W51-R73 HydrophobicContact CZ3-CB 4.07Å; W51-R73 HydrophobicContact CZ3-CG 3.55Å; W51-M76 HydrophobicContact CH2-CB 4.43Å; W51-M76 HydrophobicContact CH2-SD 4.37Å; W51-M76 HydrophobicContact CZ3-SD 3.86Å; W51-L77 HydrophobicContact CZ2-CD1 4.43Å; W51-L77 HydrophobicContact CZ2-CD2 4.4Å; W51-L77 HydrophobicContact CZ2-CG 4.3Å
52H88.3Confident89.2Confident115 Ų11590 Ų9053%0.53241%0.412SS..Hα-helixtrans-63.4-40.4172.9-171.881.3000112.2R48 K49 Y50 M55 V56R48-H52 WeakPolarHBondContact O-CB 2.95Å; R48-H52 PolarHBondContact O-N 3.13Å; K49-H52 PolarHBondContact O-N 3.33Å; Y50-H52 VanDerWaalsContact C-N 3.27Å; Y50-H52 PolarHBondContact O-N 3.15Å; H52-M55 HydrophobicContact CB-CE 4.34Å; H52-M55 PolarHBondContact O-N 2.95Å; H52-V56 VanDerWaalsContact O-CG2 3.29Å; H52-V56 WeakPolarHBondContact O-CG2 3.47Å; H52-V56 PolarHBondContact O-N 3.18Å
53N89.6Confident89.1Confident94 Ų9487.8 Ų87.850%0.50340%0.402SS..Hα-helixtrans-61.9-45.1175.1-165.6-78.4000111.2K49 Y50 W51 M55 V56 Q57K49-N53 PolarHBondContact O-N 2.99Å; Y50-N53 WeakPolarHBondContact O-CB 3.44Å; Y50-N53 PolarHBondContact O-N 3.33Å; W51-N53 VanDerWaalsContact C-N 3.35Å; N53-M55 PolarHBondContact O-N 3.13Å; N53-V56 PolarHBondContact O-N 3.2Å; N53-Q57 WeakPolarHBondContact O-CG 3.5Å; N53-Q57 PolarHBondContact O-N 3.02Å
54I88.6Confident88.9Confident27 Ų2790.9 Ų90.914%0.13842%0.419CS..Hα-helixtrans-60-46.2175.1-59.8-50.9000111.2Y50 W51 V56 Q57 R58 P68 M76Y50-I54 HydrophobicContact CD1-CG1 4.48Å; Y50-I54 HydrophobicContact CE1-CG1 4.05Å; Y50-I54 PolarHBondContact O-N 3.27Å; Y50-I54 VanDerWaalsContact O-N 3.09Å; W51-I54 PolarHBondContact O-N 2.93Å; I54-V56 VanDerWaalsContact C-N 3.31Å; I54-V56 PolarHBondContact O-N 3.41Å; I54-Q57 PolarHBondContact O-N 2.81Å; I54-R58 HydrophobicContact CG2-CG 4.21Å; I54-R58 WeakPolarHBondContact O-CB 3.32Å; I54-R58 VanDerWaalsContact O-CG 3.3Å; I54-R58 WeakPolarHBondContact O-CG 3.39Å; I54-R58 PolarHBondContact O-N 3.31Å; I54-P68 HydrophobicContact CG2-CG 4.28Å; I54-M76 HydrophobicContact CB-CE 4.32Å; I54-M76 HydrophobicContact CD1-CE 3.41Å; I54-M76 VanDerWaalsContact CD1-CE 3.41Å; I54-M76 HydrophobicContact CG1-CE 3.56Å; I54-M76 HydrophobicContact CG2-CE 3.78Å; I54-M76 HydrophobicContact CG2-SD 4.21Å
55M88.1Confident88.7Confident57 Ų5791.7 Ų91.728%0.28143%0.432SS..Hα-helixtrans-58-43.6176-77.3-172.3-7700111.9W51 H52 N53 R58 R59 E66 M67W51-M55 WeakPolarHBondContact O-CG 3.22Å; W51-M55 PolarHBondContact O-N 2.73Å; H52-M55 HydrophobicContact CB-CE 4.34Å; H52-M55 PolarHBondContact O-N 2.95Å; N53-M55 PolarHBondContact O-N 3.13Å; M55-R58 PolarHBondContact O-N 3.08Å; M55-R59 VanDerWaalsContact O-CB 3.26Å; M55-R59 WeakPolarHBondContact O-CB 3.46Å; M55-R59 PolarHBondContact O-N 2.8Å; M55-E66 WeakPolarHBondContact CG-O 3.18Å; M55-M67 HydrophobicContact CG-CG 4.1Å; M55-M67 HydrophobicContact SD-CB 4.39Å; M55-M67 HydrophobicContact SD-CG 3.62Å
56V91.2Very high88.4Confident43 Ų4388.3 Ų88.326%0.26142%0.418SS..Hα-helixtrans-65.5-40.4177.6171.90000111.3H52 N53 I54 R59 R60H52-V56 VanDerWaalsContact O-CG2 3.29Å; H52-V56 WeakPolarHBondContact O-CG2 3.47Å; H52-V56 PolarHBondContact O-N 3.18Å; N53-V56 PolarHBondContact O-N 3.2Å; I54-V56 VanDerWaalsContact C-N 3.31Å; I54-V56 PolarHBondContact O-N 3.41Å; V56-R59 PolarHBondContact O-N 3.15Å; V56-R60 VanDerWaalsContact O-CG 3.29Å; V56-R60 WeakPolarHBondContact O-CG 3.22Å; V56-R60 PolarHBondContact O-N 3.11Å
57Q90.3Very high87.9Confident96 Ų9687 Ų8745%0.44941%0.41SS..Hα-helixtrans-62.8-49.7175-72.6-65.6-30.900111.3N53 I54 R59 R60 D61N53-Q57 WeakPolarHBondContact O-CG 3.5Å; N53-Q57 PolarHBondContact O-N 3.02Å; I54-Q57 PolarHBondContact O-N 2.81Å; Q57-R59 VanDerWaalsContact C-N 3.31Å; Q57-R59 PolarHBondContact O-N 3.16Å; Q57-R60 WeakPolarHBondContact O-CB 2.93Å; Q57-R60 PolarHBondContact O-N 3.03Å; Q57-R60 VanDerWaalsContact O-N 3.07Å; Q57-D61 PolarHBondContact O-N 2.92Å
58R89.9Confident87.7Confident40 Ų4087 Ų8715%0.15141%0.41CS..Hα-helixtrans-61-39.4177.8-66.9-177.797.8112.76.6112I54 M55 D61 G62 I63 E66 E72I54-R58 HydrophobicContact CG2-CG 4.21Å; I54-R58 WeakPolarHBondContact O-CB 3.32Å; I54-R58 VanDerWaalsContact O-CG 3.3Å; I54-R58 WeakPolarHBondContact O-CG 3.39Å; I54-R58 PolarHBondContact O-N 3.31Å; M55-R58 PolarHBondContact O-N 3.08Å; R58-D61 PolarHBondContact O-N 2.72Å; R58-G62 PolarHBondContact O-N 3.45Å; R58-I63 HydrophobicContact CB-CB 4.22Å; R58-I63 PolarHBondContact O-N 3.41Å; R58-E66 WeakPolarHBondContact CD-O 3.35Å; R58-E72 IonicContact CZ-OE1 3.69Å; R58-E72 IonicContact NH1-OE1 2.72Å; R58-E72 PolarHBondContact NH1-OE1 3.43Å; R58-E72 IonicContact NH2-OE1 2.92Å; R58-E72 PolarHBondContact NH2-OE1 2.86Å; R58-E72 IonicContact NH2-OE2 3.22Å
59R90.1Very high87.5Confident167 Ų16782.7 Ų82.763%0.6340%0.401SS*.Hα-helixtrans-61.6-42.8173.1179.4-177.7-70.4-176.5-4.2112M55 V56 Q57 D61 G62 E66M55-R59 VanDerWaalsContact O-CB 3.26Å; M55-R59 WeakPolarHBondContact O-CB 3.46Å; M55-R59 PolarHBondContact O-N 2.8Å; V56-R59 PolarHBondContact O-N 3.15Å; Q57-R59 VanDerWaalsContact C-N 3.31Å; Q57-R59 PolarHBondContact O-N 3.16Å; R59-D61 VanDerWaalsContact C-N 3.32Å; R59-G62 PolarHBondContact O-N 2.87Å; R59-E66 IonicContact CZ-OE1 3.08Å; R59-E66 IonicContact NE-OE1 2.65Å; R59-E66 PolarHBondContact NE-OE1 2.78Å; R59-E66 IonicContact NH2-OE1 2.69Å; R59-E66 PolarHBondContact NH2-OE1 3.05Å; R59-E66 IonicContact NH2-OE2 3.77Å
60R91.8Very high87.1Confident191 Ų19177.6 Ų77.672%0.72139%0.389SS*.Hα-helixtrans-65.6-37177.1-75.7172.7175.6-171.9-2.5112.1V56 Q57 G62V56-R60 VanDerWaalsContact O-CG 3.29Å; V56-R60 WeakPolarHBondContact O-CG 3.22Å; V56-R60 PolarHBondContact O-N 3.11Å; Q57-R60 WeakPolarHBondContact O-CB 2.93Å; Q57-R60 PolarHBondContact O-N 3.03Å; Q57-R60 VanDerWaalsContact O-N 3.07Å; R60-G62 PolarHBondContact O-N 3.26Å
61D92.1Very high86.8Confident123 Ų12378.4 Ų78.466%0.65841%0.407SS*.Hα-helixtrans-77.3-9.3177.2-153.9-109.7000112.9Q57 R58 R59 I63Q57-D61 PolarHBondContact O-N 2.92Å; R58-D61 PolarHBondContact O-N 2.72Å; R59-D61 VanDerWaalsContact C-N 3.32Å; D61-I63 VanDerWaalsContact C-N 3.28Å; D61-I63 HydrophobicContact CB-CD1 4Å; D61-I63 HydrophobicContact CB-CG1 4.04Å; D61-I63 PolarHBondContact O-N 3.11Å; D61-I63 WeakPolarHBondContact OD1-CD1 3.45Å; D61-I63 WeakPolarHBondContact OD1-CG1 3.4Å
62G90.9Very high86.7Confident57 Ų5780.9 Ų80.959%0.58842%0.419SS*.THydrogen-bonded Turntrans76.312.8-177.600000114.2R58 R59 R60 K64R58-G62 PolarHBondContact O-N 3.45Å; R59-G62 PolarHBondContact O-N 2.87Å; R60-G62 PolarHBondContact O-N 3.26Å; G62-K64 PolarHBondContact O-N 2.03Å
63I86.6Confident86.5Confident63 Ų6376.2 Ų76.232%0.32340%0.396SS..  trans-76123.2179.6-61.8170.3000109.9R58 D61R58-I63 HydrophobicContact CB-CB 4.22Å; R58-I63 PolarHBondContact O-N 3.41Å; D61-I63 VanDerWaalsContact C-N 3.28Å; D61-I63 HydrophobicContact CB-CD1 4Å; D61-I63 HydrophobicContact CB-CG1 4.04Å; D61-I63 PolarHBondContact O-N 3.11Å; D61-I63 WeakPolarHBondContact OD1-CD1 3.45Å; D61-I63 WeakPolarHBondContact OD1-CG1 3.4Å
64K82.9Confident86.2Confident182 Ų18277.6 Ų77.679%0.79140%0.403SS*.SBendtrans-116.3136.9170-67.7-176-179.61780110G62G62-K64 PolarHBondContact O-N 2.03Å
65P83.3Confident86.1Confident78 Ų7883.2 Ų83.251%0.50643%0.429SS..SBendcis-70.2145.61.629.1-34.6000113.2M67P65-M67 PolarHBondContact O-N 3.34Å
66E81.1Confident85.9Confident71 Ų7182.5 Ų82.533%0.33243%0.425SS..SBendtrans-64.9-31179.6-58.6175.576.100111.5M55 R58 R59M55-E66 WeakPolarHBondContact CG-O 3.18Å; R58-E66 WeakPolarHBondContact CD-O 3.35Å; R59-E66 IonicContact CZ-OE1 3.08Å; R59-E66 IonicContact NE-OE1 2.65Å; R59-E66 PolarHBondContact NE-OE1 2.78Å; R59-E66 IonicContact NH2-OE1 2.69Å; R59-E66 PolarHBondContact NH2-OE1 3.05Å; R59-E66 IonicContact NH2-OE2 3.77Å
67M80Confident85.5Confident48 Ų4882 Ų8224%0.23642%0.421CS..SBendtrans-92.1122.9177.1-132.4-95.9-74.400108.6I13 M55 P65 R73I13-M67 WeakPolarHBondContact O-CE 2.99Å; M55-M67 HydrophobicContact CG-CG 4.1Å; M55-M67 HydrophobicContact SD-CB 4.39Å; M55-M67 HydrophobicContact SD-CG 3.62Å; P65-M67 PolarHBondContact O-N 3.34Å; M67-R73 PolarHBondContact SD-NH2 3.5Å
68P83.6Confident85.2Confident0 Ų081.9 Ų81.90%043%0.431CS..PPolyproline II helixtrans-61.1144.4-179.621.3-29.6000110.4W51 I54 E72 R73W51-P68 HydrophobicContact CE3-CG 3.56Å; W51-P68 HydrophobicContact CZ3-CB 4.36Å; W51-P68 HydrophobicContact CZ3-CG 3.43Å; W51-P68 VanDerWaalsContact CZ3-CG 3.43Å; I54-P68 HydrophobicContact CG2-CG 4.28Å; P68-E72 HydrophobicContact CB-CB 4.04Å; P68-R73 HydrophobicContact CB-CG 4.04Å; P68-R73 HydrophobicContact CG-CG 3.9Å; P68-R73 PolarHBondContact O-NE 3.29Å; P68-R73 PolarHBondContact O-NH2 3.02Å
69T84.1Confident85Confident65 Ų6584.1 Ų84.140%0.39946%0.458SS..PPolyproline II helixtrans-69.8160.4176.760.20000111.8A71 E72 R73T69-A71 PolarHBondContact O-N 3.37Å; T69-A71 VanDerWaalsContact O-N 3.11Å; T69-E72 PolarHBondContact N-OE2 3.38Å; T69-E72 PolarHBondContact O-N 3.35Å; T69-E72 WeakPolarHBondContact OG1-CG 3.33Å; T69-E72 PolarHBondContact OG1-OE2 3.36Å; T69-E72 VanDerWaalsContact OG1-OE2 3.1Å; T69-R73 VanDerWaalsContact O-CG 3.3Å; T69-R73 WeakPolarHBondContact O-CG 3.03Å; T69-R73 PolarHBondContact O-N 3.39Å
70A80.9Confident84.5Confident52 Ų5279.9 Ų79.943%0.4345%0.447SS..Hα-helixtrans-52.5-36.5-178.900000114R73 L74A70-R73 PolarHBondContact O-N 3.25Å; A70-L74 PolarHBondContact O-N 3.17Å; A70-L74 VanDerWaalsContact O-N 3.13Å
71A82.8Confident83.6Confident73 Ų7374.3 Ų74.360%0.60345%0.449SS*.Hα-helixtrans-66.1-48.5176.200000112.2T69 R73 L74 E75T69-A71 PolarHBondContact O-N 3.37Å; T69-A71 VanDerWaalsContact O-N 3.11Å; A71-R73 PolarHBondContact O-N 3.05Å; A71-L74 WeakPolarHBondContact O-CB 3.01Å; A71-L74 PolarHBondContact O-N 2.94Å; A71-L74 VanDerWaalsContact O-N 3.15Å; A71-E75 PolarHBondContact O-N 2.81Å
72E85.4Confident82.7Confident56 Ų5670.1 Ų70.126%0.26243%0.434SS..Hα-helixtrans-61.6-36.8176.2-67.5-179.889.800111.6R58 P68 T69 L74 E75 M76R58-E72 IonicContact CZ-OE1 3.69Å; R58-E72 IonicContact NH1-OE1 2.72Å; R58-E72 PolarHBondContact NH1-OE1 3.43Å; R58-E72 IonicContact NH2-OE1 2.92Å; R58-E72 PolarHBondContact NH2-OE1 2.86Å; R58-E72 IonicContact NH2-OE2 3.22Å; P68-E72 HydrophobicContact CB-CB 4.04Å; T69-E72 PolarHBondContact N-OE2 3.38Å; T69-E72 PolarHBondContact O-N 3.35Å; T69-E72 WeakPolarHBondContact OG1-CG 3.33Å; T69-E72 PolarHBondContact OG1-OE2 3.36Å; T69-E72 VanDerWaalsContact OG1-OE2 3.1Å; E72-L74 VanDerWaalsContact C-N 3.31Å; E72-L74 PolarHBondContact O-N 2.95Å; E72-E75 PolarHBondContact O-N 2.87Å; E72-M76 WeakPolarHBondContact O-CB 3.42Å; E72-M76 WeakPolarHBondContact O-CG 3.48Å; E72-M76 PolarHBondContact O-N 3.36Å
73R84.2Confident81.8Confident17 Ų1771.5 Ų71.56%0.06442%0.424CS..Hα-helixtrans-62.4-43177.1-63.7-175.2-159.9133.316.1111.6Q11 D12 W51 M67 P68 T69 A70 A71 E75 M76 L77Q11-R73 PolarHBondContact O-NH1 3.07Å; D12-R73 PolarHBondContact O-NH1 2.76Å; D12-R73 PolarHBondContact O-NH2 3.18Å; W51-R73 HydrophobicContact CE3-CG 4.31Å; W51-R73 HydrophobicContact CH2-CB 3.4Å; W51-R73 VanDerWaalsContact CH2-CB 3.4Å; W51-R73 HydrophobicContact CH2-CG 3.4Å; W51-R73 HydrophobicContact CZ2-CB 3.94Å; W51-R73 HydrophobicContact CZ2-CG 4.04Å; W51-R73 HydrophobicContact CZ3-CB 4.07Å; W51-R73 HydrophobicContact CZ3-CG 3.55Å; M67-R73 PolarHBondContact SD-NH2 3.5Å; P68-R73 HydrophobicContact CB-CG 4.04Å; P68-R73 HydrophobicContact CG-CG 3.9Å; P68-R73 PolarHBondContact O-NE 3.29Å; P68-R73 PolarHBondContact O-NH2 3.02Å; T69-R73 VanDerWaalsContact O-CG 3.3Å; T69-R73 WeakPolarHBondContact O-CG 3.03Å; T69-R73 PolarHBondContact O-N 3.39Å; A70-R73 PolarHBondContact O-N 3.25Å; A71-R73 PolarHBondContact O-N 3.05Å; R73-E75 VanDerWaalsContact C-N 3.31Å; R73-M76 PolarHBondContact O-N 3.11Å; R73-L77 WeakPolarHBondContact O-CB 3.34Å; R73-L77 VanDerWaalsContact O-CG 3.22Å; R73-L77 WeakPolarHBondContact O-CG 3.19Å; R73-L77 PolarHBondContact O-N 3.42Å
74L82.4Confident81Confident124 Ų12471.3 Ų71.365%0.64943%0.427SS*.Hα-helixtrans-63.2-41.7177.1-173.166.2000110.8A70 A71 E72 L77 S78A70-L74 PolarHBondContact O-N 3.17Å; A70-L74 VanDerWaalsContact O-N 3.13Å; A71-L74 WeakPolarHBondContact O-CB 3.01Å; A71-L74 PolarHBondContact O-N 2.94Å; A71-L74 VanDerWaalsContact O-N 3.15Å; E72-L74 VanDerWaalsContact C-N 3.31Å; E72-L74 PolarHBondContact O-N 2.95Å; L74-L77 PolarHBondContact O-N 2.9Å; L74-S78 VanDerWaalsContact O-CB 3.24Å; L74-S78 WeakPolarHBondContact O-CB 3.45Å; L74-S78 PolarHBondContact O-N 3.45Å
75E86.3Confident80.5Confident145 Ų14564.4 Ų64.468%0.67840%0.397SS*.Hα-helixtrans-62.7-45.6176.1-169.6173.389.900111.8A71 E72 R73 L77 S78 A79A71-E75 PolarHBondContact O-N 2.81Å; E72-E75 PolarHBondContact O-N 2.87Å; R73-E75 VanDerWaalsContact C-N 3.31Å; E75-L77 PolarHBondContact O-N 3.36Å; E75-S78 WeakPolarHBondContact O-CB 3.43Å; E75-S78 PolarHBondContact O-N 2.86Å; E75-A79 WeakPolarHBondContact O-CB 3.46Å; E75-A79 PolarHBondContact O-N 3.45Å
76M84.6Confident80.3Confident41 Ų4163.8 Ų63.820%0.20239%0.391CS..Hα-helixtrans-62-41176.8-67.7179.885.800112.3W51 I54 E72 R73 I80W51-M76 HydrophobicContact CH2-CB 4.43Å; W51-M76 HydrophobicContact CH2-SD 4.37Å; W51-M76 HydrophobicContact CZ3-SD 3.86Å; I54-M76 HydrophobicContact CB-CE 4.32Å; I54-M76 HydrophobicContact CD1-CE 3.41Å; I54-M76 VanDerWaalsContact CD1-CE 3.41Å; I54-M76 HydrophobicContact CG1-CE 3.56Å; I54-M76 HydrophobicContact CG2-CE 3.78Å; I54-M76 HydrophobicContact CG2-SD 4.21Å; E72-M76 WeakPolarHBondContact O-CB 3.42Å; E72-M76 WeakPolarHBondContact O-CG 3.48Å; E72-M76 PolarHBondContact O-N 3.36Å; R73-M76 PolarHBondContact O-N 3.11Å; M76-I80 WeakPolarHBondContact O-CG1 3.4Å; M76-I80 PolarHBondContact O-N 3.36Å
77L83Confident80.3Confident33 Ų3363.4 Ų63.417%0.17339%0.394CS..Hα-helixtrans-68.6-38.3176-68.7170.2000111.6W51 R73 L74 E75 I80 G81 G82 K83 Y85W51-L77 HydrophobicContact CZ2-CD1 4.43Å; W51-L77 HydrophobicContact CZ2-CD2 4.4Å; W51-L77 HydrophobicContact CZ2-CG 4.3Å; R73-L77 WeakPolarHBondContact O-CB 3.34Å; R73-L77 VanDerWaalsContact O-CG 3.22Å; R73-L77 WeakPolarHBondContact O-CG 3.19Å; R73-L77 PolarHBondContact O-N 3.42Å; L74-L77 PolarHBondContact O-N 2.9Å; E75-L77 PolarHBondContact O-N 3.36Å; L77-I80 PolarHBondContact O-N 3.27Å; L77-G81 PolarHBondContact O-N 3.48Å; L77-G82 PolarHBondContact O-N 3.38Å; L77-K83 HydrophobicContact CD2-CG 4.31Å; L77-Y85 HydrophobicContact CD2-CE1 4.36Å
78S84.2Confident80.3Confident93 Ų9364.2 Ų64.265%0.6540%0.403SS*.Hα-helixtrans-65-43175.8-169.70000111.4L74 E75 I80 G81L74-S78 VanDerWaalsContact O-CB 3.24Å; L74-S78 WeakPolarHBondContact O-CB 3.45Å; L74-S78 PolarHBondContact O-N 3.45Å; E75-S78 WeakPolarHBondContact O-CB 3.43Å; E75-S78 PolarHBondContact O-N 2.86Å; S78-I80 VanDerWaalsContact C-N 3.26Å; S78-I80 PolarHBondContact O-N 3.33Å; S78-G81 PolarHBondContact O-N 3.14Å
79A84.6Confident80.1Confident87 Ų8768 Ų6872%0.71943%0.427SS*.Hα-helixtrans-63.2-30.8178.600000113.1E75 G81E75-A79 WeakPolarHBondContact O-CB 3.46Å; E75-A79 PolarHBondContact O-N 3.45Å; A79-G81 VanDerWaalsContact C-N 3.29Å
80I79Confident79.9Confident79 Ų7968.2 Ų68.241%0.40543%0.429SS..Hα-helixtrans-79.2-14.9175.5-68.2170.5000111.7Y50 M76 L77 S78 G82 P84Y50-I80 HydrophobicContact CE2-CD1 3.88Å; Y50-I80 WeakPolarHBondContact OH-CD1 3.47Å; M76-I80 WeakPolarHBondContact O-CG1 3.4Å; M76-I80 PolarHBondContact O-N 3.36Å; L77-I80 PolarHBondContact O-N 3.27Å; S78-I80 VanDerWaalsContact C-N 3.26Å; S78-I80 PolarHBondContact O-N 3.33Å; I80-G82 VanDerWaalsContact C-N 3.28Å; I80-P84 HydrophobicContact CD1-CB 4.32Å; I80-P84 HydrophobicContact CD1-CG 4Å; I80-P84 HydrophobicContact CG2-CB 4.19Å
81G73.4Confident79.8Confident73 Ų7369.3 Ų69.375%0.75343%0.428SS*.THydrogen-bonded Turntrans73.919.1-174.600000113.3L77 S78 A79L77-G81 PolarHBondContact O-N 3.48Å; S78-G81 PolarHBondContact O-N 3.14Å; A79-G81 VanDerWaalsContact C-N 3.29Å
82G72.6Confident79.6Confident35 Ų3569 Ų6936%0.36142%0.416SS..SBendtrans161.2-177.8-177.900000113.6L77 I80 P84L77-G82 PolarHBondContact O-N 3.38Å; I80-G82 VanDerWaalsContact C-N 3.28Å; G82-P84 WeakPolarHBondContact O-CD 3.17Å
83K72.2Confident79.1Confident86 Ų8670 Ų7037%0.37443%0.428SS..  trans-78.8120.2171.6-68.5173.4178.5179.60107.7E18 L77 Y85E18-K83 IonicContact OE1-NZ 2.62Å; E18-K83 PolarHBondContact OE1-NZ 3.28Å; E18-K83 IonicContact OE2-NZ 2.97Å; E18-K83 PolarHBondContact OE2-NZ 3.06Å; L77-K83 HydrophobicContact CD2-CG 4.31Å; K83-Y85 HydrophobicContact CB-CD1 4.48Å; K83-Y85 HydrophobicContact CB-CD2 3.98Å; K83-Y85 HydrophobicContact CB-CE1 4.26Å; K83-Y85 HydrophobicContact CB-CE2 3.75Å; K83-Y85 HydrophobicContact CB-CG 4.36Å; K83-Y85 HydrophobicContact CD-CE2 3.81Å; K83-Y85 HydrophobicContact CG-CE2 3.97Å; K83-Y85 PolarHBondContact O-N 2.92Å
84P70.5Confident78.7Confident60 Ų6074.4 Ų74.439%0.3946%0.458SS..  trans-70.715.9-179.328-33.9000113.6Y50 I80 G82Y50-P84 HydrophobicContact CD1-CG 4.16Å; Y50-P84 HydrophobicContact CD2-CB 4.35Å; Y50-P84 HydrophobicContact CD2-CG 3.79Å; Y50-P84 HydrophobicContact CE1-CG 4.3Å; Y50-P84 HydrophobicContact CE2-CG 3.94Å; Y50-P84 HydrophobicContact CG-CG 3.92Å; I80-P84 HydrophobicContact CD1-CB 4.32Å; I80-P84 HydrophobicContact CD1-CG 4Å; I80-P84 HydrophobicContact CG2-CB 4.19Å; G82-P84 WeakPolarHBondContact O-CD 3.17Å
85Y71.9Confident78.4Confident37 Ų3769.9 Ų69.915%0.14544%0.441CS..  trans-137.10-172.345-100.1000111.4E19 R43 N46 C47 L77 K83E19-Y85 HydrophobicContact CG-CD2 3.83Å; E19-Y85 HydrophobicContact CG-CE2 3.52Å; E19-Y85 VanDerWaalsContact OE2-CD2 3.27Å; E19-Y85 WeakPolarHBondContact OE2-CD2 3.37Å; R43-Y85 WeakPolarHBondContact CG-OXT 3.46Å; N46-Y85 VanDerWaalsContact CB-CB 3.44Å; C47-Y85 VanDerWaalsContact CA-CD1 3.47Å; C47-Y85 HydrophobicContact CB-CD1 3.6Å; C47-Y85 HydrophobicContact CB-CD2 3.77Å; C47-Y85 HydrophobicContact CB-CE1 3.65Å; C47-Y85 HydrophobicContact CB-CE2 3.79Å; C47-Y85 HydrophobicContact CB-CG 3.66Å; C47-Y85 VanDerWaalsContact SG-CE1 3.6Å; L77-Y85 HydrophobicContact CD2-CE1 4.36Å; K83-Y85 HydrophobicContact CB-CD1 4.48Å; K83-Y85 HydrophobicContact CB-CD2 3.98Å; K83-Y85 HydrophobicContact CB-CE1 4.26Å; K83-Y85 HydrophobicContact CB-CE2 3.75Å; K83-Y85 HydrophobicContact CB-CG 4.36Å; K83-Y85 HydrophobicContact CD-CE2 3.81Å; K83-Y85 HydrophobicContact CG-CE2 3.97Å; K83-Y85 PolarHBondContact O-N 2.92Å

Retrieved 85 of 85 residues in 367.6 ms (Link to these results)