A0A060YDM1_ONCMY Loading...

Protein Churchill

AlphaFold DB (A0A674E917), UniProt , Accession A0A060YDM1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene churc1, Length 112 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
1M76.4Confident92.4Very high114 Ų11466.2 Ų66.256%0.56234%0.341SS*.  01420-55.1177.2177.900108.1Y10 V68 R70 M89M1-Y10 PolarHBondContact SD-OH 2.91Å; M1-Y10 VanDerWaalsContact SD-OH 3.35Å; M1-V68 CarbonylContact C-O 3.58Å; M1-V68 WeakPolarHBondContact CA-O 3.47Å; M1-R70 HydrophobicContact CE-CB 3.65Å; M1-M89 HydrophobicContact CB-CE 3.77Å; M1-M89 HydrophobicContact CB-SD 3.68Å; M1-M89 HydrophobicContact SD-CB 4.25Å; M1-M89 HydrophobicContact SD-CE 3.99Å
2C84.8Confident92.7Very high26 Ų2669.5 Ų69.518%0.17636%0.36CS..  trans-126.8109.4-171.4-175.60000112.5G4 C5 H66 V68C2-G4 PolarHBondContact O-N 3.09Å; C2-C5 HydrophobicContact CB-CB 4.36Å; C2-C5 WeakPolarHBondContact O-CB 3.07Å; C2-C5 PolarHBondContact O-N 2.8Å; C2-H66 WeakPolarHBondContact CB-NE2 3.41Å; C2-V68 PolarHBondContact N-O 3.22Å
3N88.3Confident93Very high85 Ų8568.2 Ų68.246%0.45535%0.347SS..G310 helixtrans-61.7-28.6-180-63.113.6000112.6C5 V6 E9 M89N3-C5 PolarHBondContact O-N 3.07Å; N3-V6 PolarHBondContact O-N 2.91Å; N3-E9 VanDerWaalsContact CG-OE1 3.23Å; N3-E9 PolarHBondContact ND2-OE1 3.11Å; N3-E9 PolarHBondContact ND2-OE2 3.49Å; N3-E9 PolarHBondContact OD1-OE1 3.21Å; N3-M89 WeakPolarHBondContact OD1-CE 3.5Å; N3-M89 PolarHBondContact OD1-SD 3Å; N3-M89 VanDerWaalsContact OD1-SD 3.38Å
4G93.1Very high93.2Very high48 Ų4866.4 Ų66.450%0.49535%0.354SS..G310 helixtrans-71.2-14.517800000114.2C2C2-G4 PolarHBondContact O-N 3.09Å
5C95.3Very high93.2Very high0 Ų068.7 Ų68.70%037%0.366CS..G310 helixtrans-90.4-16.4-179.3-64.60000113.6C2 N3 Y27 L28 G29 A31 V68C2-C5 HydrophobicContact CB-CB 4.36Å; C2-C5 WeakPolarHBondContact O-CB 3.07Å; C2-C5 PolarHBondContact O-N 2.8Å; N3-C5 PolarHBondContact O-N 3.07Å; C5-Y27 HydrophobicContact CB-CE2 4.15Å; C5-Y27 VanDerWaalsContact O-CD2 3.29Å; C5-Y27 WeakPolarHBondContact O-CD2 3.47Å; C5-L28 PolarHBondContact O-N 3.43Å; C5-G29 VanDerWaalsContact CA-O 3.24Å; C5-G29 WeakPolarHBondContact CA-O 3.27Å; C5-A31 PolarHBondContact SG-N 2.93Å; C5-V68 HydrophobicContact CB-CG1 3.73Å; C5-V68 HydrophobicContact CB-CG2 4.44Å
6V96.2Very high93.3Very high8 Ų867.8 Ų67.85%0.04836%0.364CS..BIsolated β-bridgetrans-117149.8-172.2-62.10000110.9N3 E9 N26 L28 V68 M89 L90N3-V6 PolarHBondContact O-N 2.91Å; V6-E9 HydrophobicContact CG2-CG 4.42Å; V6-N26 CarbonylContact C-O 3.55Å; V6-N26 VanDerWaalsContact CA-O 3.3Å; V6-N26 WeakPolarHBondContact CA-O 3.38Å; V6-L28 WeakPolarHBondContact O-CD1 3.39Å; V6-V68 HydrophobicContact CG1-CG1 4.35Å; V6-M89 HydrophobicContact CG2-CG 4.13Å; V6-M89 HydrophobicContact CG2-SD 4.45Å; V6-L90 HydrophobicContact CG1-CB 4.19Å; V6-L90 HydrophobicContact CG1-CD1 3.91Å
7Q95.6Very high93.4Very high140 Ų14065.1 Ų65.165%0.65435%0.351SS*.SBendtrans-76.6-41.2177.3-176.9179.5-43.300111.7N26 L28Q7-N26 WeakPolarHBondContact CB-OD1 3.14Å; Q7-N26 PolarHBondContact N-O 3.02Å; Q7-N26 PolarHBondContact N-OD1 3.23Å; Q7-L28 HydrophobicContact CB-CD1 4.24Å; Q7-L28 HydrophobicContact CB-CD2 3.95Å; Q7-L28 HydrophobicContact CB-CG 3.94Å; Q7-L28 HydrophobicContact CG-CD2 4.34Å
8K96.6Very high93.5Very high125 Ų12565.8 Ų65.854%0.54336%0.355SS..SBendtrans-136135.2177.3-174176.9178.4-178.60108.8P11 N26K8-P11 HydrophobicContact CD-CB 4.46Å; K8-P11 WeakPolarHBondContact O-CD 3.49Å; K8-N26 PolarHBondContact N-OD1 2.81Å; K8-N26 PolarHBondContact O-ND2 3.39Å; K8-N26 PolarHBondContact O-OD1 3.38Å
9E96.5Very high93.4Very high96 Ų9666.7 Ų66.745%0.44936%0.356SS..SBendtrans-71.9129.7171.9-65174.187.800109.4N3 V6 M89N3-E9 VanDerWaalsContact CG-OE1 3.23Å; N3-E9 PolarHBondContact ND2-OE1 3.11Å; N3-E9 PolarHBondContact ND2-OE2 3.49Å; N3-E9 PolarHBondContact OD1-OE1 3.21Å; V6-E9 HydrophobicContact CG2-CG 4.42Å; E9-M89 HydrophobicContact CB-CG 4.42Å; E9-M89 HydrophobicContact CG-CE 4.5Å; E9-M89 HydrophobicContact CG-CG 4.33Å
10Y96.4Very high93.4Very high74 Ų7466.9 Ų66.929%0.2936%0.357SS..SBendtrans46.759.9176.4-53-83.9000112.5M1 D12 L87 C88 M89M1-Y10 PolarHBondContact SD-OH 2.91Å; M1-Y10 VanDerWaalsContact SD-OH 3.35Å; Y10-D12 PolarHBondContact O-N 3.32Å; Y10-L87 HydrophobicContact CD1-CD1 3.72Å; Y10-L87 HydrophobicContact CD1-CG 4.24Å; Y10-L87 HydrophobicContact CE1-CD1 3.97Å; Y10-L87 HydrophobicContact CE1-CG 4.05Å; Y10-C88 VanDerWaalsContact CD1-C 3.48Å; Y10-C88 WeakPolarHBondContact CD1-O 3.3Å; Y10-M89 HydrophobicContact CD1-CB 4.45Å; Y10-M89 HydrophobicContact CE1-CB 4.04Å; Y10-M89 HydrophobicContact CE2-CB 4.27Å; Y10-M89 HydrophobicContact CE2-CE 3.9Å; Y10-M89 HydrophobicContact CE2-CG 4.34Å; Y10-M89 PolarHBondContact N-O 3.31Å
11P97.1Very high93.5Very high12 Ų1265.4 Ų65.48%0.07836%0.358CS..  trans-55.2139.1177.725.2-35.3000110.2K8 R13 Y23 N26 G92 K93K8-P11 HydrophobicContact CD-CB 4.46Å; K8-P11 WeakPolarHBondContact O-CD 3.49Å; P11-R13 PolarHBondContact O-N 3.21Å; P11-Y23 HydrophobicContact CG-CD1 4.26Å; P11-Y23 HydrophobicContact CG-CE1 4.36Å; P11-N26 HydrophobicContact CG-CB 4.49Å; P11-G92 CarbonylContact O-C 3.42Å; P11-G92 WeakPolarHBondContact O-CA 3.29Å; P11-K93 PolarHBondContact O-N 3.35Å
12D96.7Very high94.3Very high106 Ų10661.8 Ų61.857%0.56734%0.344SS*.BIsolated β-bridgetrans-68.4131.7175.8-164.6-87.1000110Y10 G14 K93Y10-D12 PolarHBondContact O-N 3.32Å; D12-G14 PolarHBondContact OD1-N 2.88Å; D12-G14 VanDerWaalsContact OD1-N 3.11Å; D12-K93 WeakPolarHBondContact OD2-CE 3.24Å
13R96Very high94.9Very high53 Ų5364.6 Ų64.620%0.235%0.351CS..  trans-118.212.6-175.9-70.1-69.7-64.1-123.8-2.5112.3P11 N15 T16 Y23 M86 C91 K93 A94P11-R13 PolarHBondContact O-N 3.21Å; R13-N15 PolarHBondContact O-N 3.47Å; R13-N15 VanDerWaalsContact O-N 3.17Å; R13-T16 WeakPolarHBondContact O-CB 2.92Å; R13-T16 PolarHBondContact O-N 3.3Å; R13-T16 PolarHBondContact O-OG1 2.97Å; R13-Y23 VanDerWaalsContact NH1-CD1 3.35Å; R13-Y23 VanDerWaalsContact NH1-CE2 3.26Å; R13-M86 HydrophobicContact CB-CE 4.21Å; R13-M86 HydrophobicContact CG-CE 4.04Å; R13-C91 WeakPolarHBondContact CD-O 3.45Å; R13-C91 WeakPolarHBondContact CG-O 3.5Å; R13-K93 PolarHBondContact N-O 3.02Å; R13-A94 HydrophobicContact CB-CB 3.86Å
14G95.4Very high95.1Very high42 Ų4264.4 Ų64.443%0.43335%0.35SS..THydrogen-bonded Turntrans53.7-118.8-17300000110.5D12 A94 E95D12-G14 PolarHBondContact OD1-N 2.88Å; D12-G14 VanDerWaalsContact OD1-N 3.11Å; G14-A94 VanDerWaalsContact O-CA 3.31Å; G14-A94 WeakPolarHBondContact O-CA 3.33Å; G14-A94 WeakPolarHBondContact O-CB 3.2Å; G14-E95 PolarHBondContact O-N 3.05Å
15N93.7Very high95.2Very high101 Ų10169.3 Ų69.354%0.5436%0.362SS..THydrogen-bonded Turntrans-97.410.7179.764.4-12.9000114.7R13 C17 D96R13-N15 PolarHBondContact O-N 3.47Å; R13-N15 VanDerWaalsContact O-N 3.17Å; N15-C17 PolarHBondContact O-N 3.24Å; N15-C17 VanDerWaalsContact O-N 3.16Å; N15-D96 HydrophobicContact CB-CB 3.87Å; N15-D96 VanDerWaalsContact CB-OD2 3.24Å; N15-D96 WeakPolarHBondContact CB-OD2 3.32Å
16T94.2Very high95.2Very high55 Ų5569.7 Ų69.734%0.33736%0.364SS..  trans-85.690-179.5-56.60000111.4R13 L18 M86 A94R13-T16 WeakPolarHBondContact O-CB 2.92Å; R13-T16 PolarHBondContact O-N 3.3Å; R13-T16 PolarHBondContact O-OG1 2.97Å; T16-L18 HydrophobicContact CG2-CD1 4.19Å; T16-L18 HydrophobicContact CG2-CD2 4.36Å; T16-L18 HydrophobicContact CG2-CG 4.02Å; T16-M86 VanDerWaalsContact O-CE 3.29Å; T16-M86 WeakPolarHBondContact O-CE 3.48Å; T16-A94 VanDerWaalsContact O-CB 3.28Å; T16-A94 WeakPolarHBondContact O-CB 3.47Å
17C95.1Very high95.2Very high21 Ų2169.6 Ų69.614%0.14236%0.363CS..  trans-95.4123.9172.2-59.40000109.9N15 Y73 Y84 M86 A94N15-C17 PolarHBondContact O-N 3.24Å; N15-C17 VanDerWaalsContact O-N 3.16Å; C17-Y73 HydrophobicContact CB-CD2 4.27Å; C17-Y73 HydrophobicContact CB-CE2 4.02Å; C17-Y84 PolarHBondContact SG-O 2.88Å; C17-M86 HydrophobicContact CB-CB 4.14Å; C17-A94 VanDerWaalsContact SG-C 3.51Å; C17-A94 WeakPolarHBondContact SG-CB 3.49Å; C17-A94 PolarHBondContact SG-O 2.84Å
18L94.8Very high95.2Very high79 Ų7967.3 Ų67.341%0.41435%0.354SS..  trans-126.1127.4-178-63.3174.9000110.6T16 N20 H71 M86T16-L18 HydrophobicContact CG2-CD1 4.19Å; T16-L18 HydrophobicContact CG2-CD2 4.36Å; T16-L18 HydrophobicContact CG2-CG 4.02Å; L18-N20 VanDerWaalsContact C-N 3.29Å; L18-H71 PolarHBondContact O-CE1 2.75Å; L18-H71 VanDerWaalsContact O-CE1 3.3Å; L18-H71 PolarHBondContact O-NE2 2.9Å; L18-M86 HydrophobicContact CB-SD 4.16Å; L18-M86 PolarHBondContact N-SD 2.82Å; L18-M86 VanDerWaalsContact N-SD 3.39Å
19E92.4Very high95.1Very high82 Ų8261.8 Ų61.838%0.38333%0.333SS..SBendtrans-75.6-14.9172.455.6153142.100113.4K44 Y57 Y73E19-K44 IonicContact OE2-NZ 3.91Å; E19-Y57 VanDerWaalsContact O-CE1 3.23Å; E19-Y57 WeakPolarHBondContact O-CE1 3.45Å; E19-Y73 HydrophobicContact CB-CD1 3.63Å; E19-Y73 HydrophobicContact CB-CD2 4.36Å; E19-Y73 HydrophobicContact CB-CE1 3.77Å; E19-Y73 HydrophobicContact CB-CE2 4.47Å; E19-Y73 HydrophobicContact CB-CG 3.92Å
20N94.1Very high95.1Very high70 Ų7057.3 Ų57.337%0.37431%0.312SS..SBendtrans-145.1160.7-175.3-66.5-60.5000112.4L18 K44L18-N20 VanDerWaalsContact C-N 3.29Å; N20-K44 PolarHBondContact OD1-NZ 3.36Å
21G93.8Very high95.1Very high36 Ų3655.5 Ų55.537%0.37131%0.313SS..  trans108-163.1172.200000112.6Y57 H59G21-Y57 PolarHBondContact O-OH 3.17Å; G21-H59 PolarHBondContact O-CE1 2.87Å; G21-H59 VanDerWaalsContact O-CE1 3.22Å
22S94.9Very high94.9Very high38 Ų3859.8 Ų59.827%0.26634%0.335SS..  trans-155.2132.4177.6-66.60000109.3L24 H59S22-L24 VanDerWaalsContact C-N 3.34Å; S22-L24 PolarHBondContact O-N 3.05Å; S22-H59 PolarHBondContact OG-CE1 3.1Å; S22-H59 PolarHBondContact OG-ND1 3.09Å
23Y95.7Very high94.9Very high85 Ų8556.4 Ų56.433%0.33332%0.319SS..  trans-83.478.9179.8-172.4-142.9000112P11 R13 M25 N26P11-Y23 HydrophobicContact CG-CD1 4.26Å; P11-Y23 HydrophobicContact CG-CE1 4.36Å; R13-Y23 VanDerWaalsContact NH1-CD1 3.35Å; R13-Y23 VanDerWaalsContact NH1-CE2 3.26Å; Y23-M25 HydrophobicContact CD2-CB 4.1Å; Y23-M25 HydrophobicContact CD2-CG 4.49Å; Y23-M25 HydrophobicContact CE1-CB 4.46Å; Y23-M25 HydrophobicContact CE2-CB 3.58Å; Y23-M25 HydrophobicContact CE2-CG 3.94Å; Y23-M25 PolarHBondContact O-N 2.99Å; Y23-M25 VanDerWaalsContact O-N 3.09Å; Y23-N26 HydrophobicContact CD1-CB 3.48Å; Y23-N26 VanDerWaalsContact CD1-CB 3.48Å; Y23-N26 HydrophobicContact CE1-CB 3.84Å; Y23-N26 HydrophobicContact CG-CB 4.3Å; Y23-N26 PolarHBondContact O-N 3.28Å
24L94.3Very high94.8Very high81 Ų8161.5 Ų61.542%0.42435%0.345SS..G310 helixtrans-61.5-21.3-174.6-59.5-177.5000114.2S22 N26 Y27 V39S22-L24 VanDerWaalsContact C-N 3.34Å; S22-L24 PolarHBondContact O-N 3.05Å; L24-N26 PolarHBondContact O-N 3.46Å; L24-Y27 WeakPolarHBondContact O-CB 3.47Å; L24-Y27 PolarHBondContact O-N 3.11Å; L24-Y27 VanDerWaalsContact O-N 3.1Å; L24-V39 HydrophobicContact CD2-CG2 4.34Å
25M94.4Very high94.7Very high152 Ų15263 Ų6375%0.74934%0.341SS*.G310 helixtrans-65.5-26.6174.1-63.8-61.6-174.100112.7Y23Y23-M25 HydrophobicContact CD2-CB 4.1Å; Y23-M25 HydrophobicContact CD2-CG 4.49Å; Y23-M25 HydrophobicContact CE1-CB 4.46Å; Y23-M25 HydrophobicContact CE2-CB 3.58Å; Y23-M25 HydrophobicContact CE2-CG 3.94Å; Y23-M25 PolarHBondContact O-N 2.99Å; Y23-M25 VanDerWaalsContact O-N 3.09Å
26N95.9Very high94.6Very high7 Ų766.9 Ų66.94%0.03735%0.347CS..G310 helixtrans-90.3-3174.6-169.240.1000112.7V6 Q7 K8 P11 Y23 L24 M89 L90V6-N26 CarbonylContact C-O 3.55Å; V6-N26 VanDerWaalsContact CA-O 3.3Å; V6-N26 WeakPolarHBondContact CA-O 3.38Å; Q7-N26 WeakPolarHBondContact CB-OD1 3.14Å; Q7-N26 PolarHBondContact N-O 3.02Å; Q7-N26 PolarHBondContact N-OD1 3.23Å; K8-N26 PolarHBondContact N-OD1 2.81Å; K8-N26 PolarHBondContact O-ND2 3.39Å; K8-N26 PolarHBondContact O-OD1 3.38Å; P11-N26 HydrophobicContact CG-CB 4.49Å; Y23-N26 HydrophobicContact CD1-CB 3.48Å; Y23-N26 VanDerWaalsContact CD1-CB 3.48Å; Y23-N26 HydrophobicContact CE1-CB 3.84Å; Y23-N26 HydrophobicContact CG-CB 4.3Å; Y23-N26 PolarHBondContact O-N 3.28Å; L24-N26 PolarHBondContact O-N 3.46Å; N26-M89 PolarHBondContact ND2-O 3.32Å; N26-L90 HydrophobicContact CB-CD1 4.37Å; N26-L90 PolarHBondContact ND2-O 3.37Å
27Y95.9Very high94.4Very high7 Ų767.5 Ų67.53%0.02735%0.349CS..BIsolated β-bridgetrans-91.4112.9-178.8-174.3-120.2000111.5C5 L24 C30 D37 V39 V68 L90C5-Y27 HydrophobicContact CB-CE2 4.15Å; C5-Y27 VanDerWaalsContact O-CD2 3.29Å; C5-Y27 WeakPolarHBondContact O-CD2 3.47Å; L24-Y27 WeakPolarHBondContact O-CB 3.47Å; L24-Y27 PolarHBondContact O-N 3.11Å; L24-Y27 VanDerWaalsContact O-N 3.1Å; Y27-C30 WeakPolarHBondContact OH-CB 3.42Å; Y27-C30 PolarHBondContact OH-N 3.46Å; Y27-D37 WeakPolarHBondContact CE1-O 3.34Å; Y27-V39 HydrophobicContact CD1-CG2 3.93Å; Y27-V39 HydrophobicContact CD2-CG2 4.05Å; Y27-V39 HydrophobicContact CE1-CG2 3.75Å; Y27-V39 HydrophobicContact CE2-CG2 3.87Å; Y27-V39 HydrophobicContact CG-CG2 4.07Å; Y27-V68 HydrophobicContact CD2-CG1 4.23Å; Y27-V68 HydrophobicContact CE2-CG1 4.1Å; Y27-V68 HydrophobicContact CE2-CG2 4.03Å; Y27-L90 HydrophobicContact CD2-CD1 4.33Å
28L95.3Very high94Very high91 Ų9172.7 Ų72.748%0.47637%0.369SS..  trans-78.8-28177.1-68.8178.6000112.2C5 V6 Q7 R36C5-L28 PolarHBondContact O-N 3.43Å; V6-L28 WeakPolarHBondContact O-CD1 3.39Å; Q7-L28 HydrophobicContact CB-CD1 4.24Å; Q7-L28 HydrophobicContact CB-CD2 3.95Å; Q7-L28 HydrophobicContact CB-CG 3.94Å; Q7-L28 HydrophobicContact CG-CD2 4.34Å; L28-R36 VanDerWaalsContact O-CD 3.27Å; L28-R36 WeakPolarHBondContact O-CD 3.46Å
29G95Very high94Very high9 Ų969.7 Ų69.79%0.09335%0.354CS..  trans130.5162.8-170.200000110.2C5 A31C5-G29 VanDerWaalsContact CA-O 3.24Å; C5-G29 WeakPolarHBondContact CA-O 3.27Å; G29-A31 PolarHBondContact O-N 2.92Å
30C96.4Very high94.1Very high2 Ų269.6 Ų69.61%0.01436%0.356CS..  trans-74.8121-177.2-176.50000110Y27 N32 C33 H34 Q35 C61 C64Y27-C30 WeakPolarHBondContact OH-CB 3.42Å; Y27-C30 PolarHBondContact OH-N 3.46Å; C30-N32 PolarHBondContact O-N 2.88Å; C30-N32 PolarHBondContact SG-N 2.89Å; C30-C33 VanDerWaalsContact CB-SG 3.59Å; C30-H34 WeakPolarHBondContact O-CA 3.44Å; C30-H34 PolarHBondContact O-N 2.91Å; C30-Q35 PolarHBondContact N-O 3.28Å; C30-C61 HydrophobicContact CB-CB 4.04Å; C30-C61 VanDerWaalsContact CB-SG 3.51Å; C30-C64 VanDerWaalsContact SG-SG 3.64Å
31A95.1Very high94.3Very high37 Ų3769.8 Ų69.831%0.30636%0.356SS..THydrogen-bonded Turntrans-66.5-19.4176.900000113.4C5 G29 H34C5-A31 PolarHBondContact SG-N 2.93Å; G29-A31 PolarHBondContact O-N 2.92Å; A31-H34 PolarHBondContact O-CE1 3.46Å
32N94.9Very high94.4Very high102 Ų10270.4 Ų70.455%0.54536%0.355SS..THydrogen-bonded Turntrans-83.8-45.9-177.7-172.759.3000112.9C30 H66C30-N32 PolarHBondContact O-N 2.88Å; C30-N32 PolarHBondContact SG-N 2.89Å; N32-H66 HydrophobicContact CB-CB 4.16Å
33C95.9Very high94.4Very high34 Ų3473.9 Ų73.923%0.2337%0.37CS..THydrogen-bonded Turntrans-107.4-3.5-179.869.80000114C30 Q35 C61 C64C30-C33 VanDerWaalsContact CB-SG 3.59Å; C33-Q35 PolarHBondContact O-N 3.43Å; C33-Q35 VanDerWaalsContact O-N 3.09Å; C33-C61 VanDerWaalsContact SG-SG 3.69Å; C33-C64 HydrophobicContact CB-CB 3.95Å; C33-C64 VanDerWaalsContact SG-SG 3.62Å
34H94.1Very high94.5Very high161 Ų16174.5 Ų74.575%0.74538%0.375SS*.  trans59.714.2-178.3-53.4-63.3000115.3C30 A31C30-H34 WeakPolarHBondContact O-CA 3.44Å; C30-H34 PolarHBondContact O-N 2.91Å; A31-H34 PolarHBondContact O-CE1 3.46Å
35Q93.1Very high94.6Very high74 Ų7472.6 Ų72.635%0.34637%0.371SS..  trans-90.5137.4174.5-59.1-161.614.500111.3C30 C33 N63C30-Q35 PolarHBondContact N-O 3.28Å; C33-Q35 PolarHBondContact O-N 3.43Å; C33-Q35 VanDerWaalsContact O-N 3.09Å; Q35-N63 PolarHBondContact NE2-ND2 2.89Å; Q35-N63 VanDerWaalsContact NE2-ND2 3.11Å; Q35-N63 PolarHBondContact OE1-ND2 3.27Å; Q35-N63 PolarHBondContact OE1-OD1 2.76Å
36R90.8Very high94.7Very high181 Ų18168.9 Ų68.968%0.68336%0.357SS*.  trans-105.863.6174.8-166.2-177.8-178.4-159-1.6110L28L28-R36 VanDerWaalsContact O-CD 3.27Å; L28-R36 WeakPolarHBondContact O-CD 3.46Å
37D89.6Confident94.6Very high69 Ų6973.6 Ų73.637%0.36938%0.378SS..  trans-101.4-170.4176.9-117-86.3000111.3Y27Y27-D37 WeakPolarHBondContact CE1-O 3.34Å
38F87.7Confident94.5Very high130 Ų13078.7 Ų78.757%0.5741%0.406SS*.PPolyproline II helixtrans-65.3150.6177.4-67.4-87.8000113.2K62F38-K62 HydrophobicContact CB-CD 4.4Å; F38-K62 WeakPolarHBondContact O-CB 3.33Å; F38-K62 PolarHBondContact O-N 3.09Å
39V94Very high94.1Very high15 Ų1581 Ų819%0.09141%0.414CS..EExtended strand (participates in β ladder)trans-99.3129.4169.8-177.80000107.5L24 Y27 H59 V60 L90L24-V39 HydrophobicContact CD2-CG2 4.34Å; Y27-V39 HydrophobicContact CD1-CG2 3.93Å; Y27-V39 HydrophobicContact CD2-CG2 4.05Å; Y27-V39 HydrophobicContact CE1-CG2 3.75Å; Y27-V39 HydrophobicContact CE2-CG2 3.87Å; Y27-V39 HydrophobicContact CG-CG2 4.07Å; V39-H59 HydrophobicContact CG1-CB 3.56Å; V39-V60 CarbonylContact C-O 3.58Å; V39-V60 WeakPolarHBondContact CA-O 3.39Å; V39-L90 HydrophobicContact CG1-CD2 4.37Å
40L96.1Very high93.6Very high80 Ų8088.8 Ų88.842%0.41945%0.454SS..EExtended strand (participates in β ladder)trans-96.1158.8176.3-58.6176.7000110H59 V60 K62L40-H59 CarbonylContact O-C 3.56Å; L40-H59 WeakPolarHBondContact O-CA 3.44Å; L40-V60 HydrophobicContact CB-CG2 3.76Å; L40-V60 PolarHBondContact N-O 3Å; L40-V60 PolarHBondContact O-N 3.48Å; L40-K62 HydrophobicContact CD1-CB 4.11Å; L40-K62 HydrophobicContact CD1-CG 4.11Å; L40-K62 HydrophobicContact CG-CB 4.05Å; L40-K62 HydrophobicContact CG-CG 4.39Å
41I96.7Very high93Very high74 Ų7491.6 Ų91.638%0.37948%0.484SS..EExtended strand (participates in β ladder)trans-99.1130.1170.8-68.4168.6000107.7Y57 D58I41-Y57 HydrophobicContact CB-CD2 4.19Å; I41-Y57 HydrophobicContact CD1-CD2 4.31Å; I41-Y57 HydrophobicContact CD1-CE2 3.89Å; I41-Y57 HydrophobicContact CG1-CD2 3.83Å; I41-Y57 HydrophobicContact CG1-CE2 3.72Å; I41-Y57 HydrophobicContact CG2-CD2 3.52Å; I41-Y57 HydrophobicContact CG2-CE2 4.21Å; I41-Y57 HydrophobicContact CG2-CG 3.8Å; I41-D58 WeakPolarHBondContact CA-O 3.24Å
42S96.3Very high92.9Very high49 Ų4993.9 Ų93.934%0.34349%0.488SS..EExtended strand (participates in β ladder)trans-134.1165.5175.4-163.10000110.6K44 D58S42-K44 PolarHBondContact O-N 2.84Å; S42-K44 VanDerWaalsContact O-N 3.16Å; S42-D58 PolarHBondContact N-O 3.07Å; S42-D58 PolarHBondContact O-N 3.4Å
43N95.4Very high93Very high112 Ų11291.7 Ų91.760%0.59947%0.474SS*.EExtended strand (participates in β ladder)trans52.137.3176.4-53.1-40.7000114A45 D58N43-A45 PolarHBondContact O-N 2.95Å; N43-D58 PolarHBondContact ND2-OD2 2.86Å
44K96.9Very high93Very high98 Ų9892 Ų9243%0.42647%0.473SS..EExtended strand (participates in β ladder)trans-66.4124.6176.9-173.7174-178.7176.80109.9E19 N20 S42 T56E19-K44 IonicContact OE2-NZ 3.91Å; N20-K44 PolarHBondContact OD1-NZ 3.36Å; S42-K44 PolarHBondContact O-N 2.84Å; S42-K44 VanDerWaalsContact O-N 3.16Å; K44-T56 CarbonylContact C-O 3.56Å; K44-T56 VanDerWaalsContact CA-O 3.31Å; K44-T56 WeakPolarHBondContact CA-O 3.31Å
45A96.8Very high93.2Very high41 Ų4184.4 Ų84.434%0.33944%0.438SS..EExtended strand (participates in β ladder)trans-127.1147.6172.500000109.5N43 V55 T56N43-A45 PolarHBondContact O-N 2.95Å; A45-V55 WeakPolarHBondContact O-CA 3.28Å; A45-T56 PolarHBondContact N-O 3.35Å; A45-T56 PolarHBondContact O-N 3.42Å
46T96.1Very high93.4Very high74 Ų7481.4 Ų81.445%0.45443%0.425SS..EExtended strand (participates in β ladder)trans-128.3128.2173.1-58.70000107E53 I54 V55T46-E53 HydrophobicContact CG2-CG 3.99Å; T46-I54 CarbonylContact C-O 3.53Å; T46-I54 WeakPolarHBondContact CA-O 3.5Å; T46-V55 HydrophobicContact CG2-CG2 4.23Å
47E95.2Very high93.7Very high105 Ų10572.8 Ų72.849%0.49139%0.392SS..EExtended strand (participates in β ladder)trans-122.7127.1-179.5-64.5175.4114.100107.8E53 I54E47-E53 CarbonylContact O-C 3.58Å; E47-E53 WeakPolarHBondContact O-CA 3.31Å; E47-I54 HydrophobicContact CB-CB 4.49Å; E47-I54 PolarHBondContact N-O 2.91Å; E47-I54 PolarHBondContact O-N 3.32Å
48D93.3Very high94.1Very high115 Ų11570.7 Ų70.762%0.61538%0.381SS*.EExtended strand (participates in β ladder)trans-119.9106.7178.8-78.6-98.4000108.2E52D48-E52 WeakPolarHBondContact CA-O 3.49Å
49E87.4Confident94.6Very high138 Ų13864.5 Ų64.565%0.64535%0.354SS*.EExtended strand (participates in β ladder)trans-133.5131.6177.7-73.5-168.895.800110.4G51 E52E49-G51 PolarHBondContact O-N 3.19Å; E49-E52 PolarHBondContact N-O 2.8Å; E49-E52 WeakPolarHBondContact O-CB 3.47Å; E49-E52 PolarHBondContact O-N 3.01Å
50D84.8Confident94.7Very high174 Ų17464.3 Ų64.393%0.9335%0.353SS*.THydrogen-bonded Turntrans50.129172.7-70.4-93.1000116.8
51G83.6Confident94.8Very high61 Ų6160.5 Ų60.563%0.62933%0.333SS*.THydrogen-bonded Turntrans87.79.3179.900000114.6E49E49-G51 PolarHBondContact O-N 3.19Å
52E93.3Very high94.7Very high85 Ų8562.2 Ų62.240%0.39734%0.338SS..EExtended strand (participates in β ladder)trans-106128.7167.9-177174.7-117.100109.5D48 E49 I54 T74 F75D48-E52 WeakPolarHBondContact CA-O 3.49Å; E49-E52 PolarHBondContact N-O 2.8Å; E49-E52 WeakPolarHBondContact O-CB 3.47Å; E49-E52 PolarHBondContact O-N 3.01Å; E52-I54 HydrophobicContact CG-CD1 4.41Å; E52-I54 HydrophobicContact CG-CG1 3.95Å; E52-T74 HydrophobicContact CG-CG2 3.58Å; E52-T74 WeakPolarHBondContact OE1-CG2 3.17Å; E52-F75 CarbonylContact C-O 3.59Å; E52-F75 WeakPolarHBondContact CA-O 3.29Å
53E95.9Very high94.6Very high56 Ų5663.8 Ų63.826%0.26234%0.342SS..EExtended strand (participates in β ladder)trans-105.5121.9171.3-174.7-166.1115.100108.6T46 E47 V55 T74 F75T46-E53 HydrophobicContact CG2-CG 3.99Å; E47-E53 CarbonylContact O-C 3.58Å; E47-E53 WeakPolarHBondContact O-CA 3.31Å; E53-V55 HydrophobicContact CG-CG2 4.49Å; E53-V55 WeakPolarHBondContact OE1-CG2 3.27Å; E53-T74 CarbonylContact O-C 3.58Å; E53-T74 WeakPolarHBondContact O-CA 3.23Å; E53-F75 HydrophobicContact CB-CB 4.36Å; E53-F75 HydrophobicContact CB-CD1 4.17Å; E53-F75 PolarHBondContact N-O 3.26Å; E53-F75 PolarHBondContact O-N 2.82Å
54I96.7Very high94.6Very high41 Ų4160.3 Ų60.321%0.2133%0.326CS..EExtended strand (participates in β ladder)trans-114.8122.5177.2-49.1177.3000108.7T46 E47 E52 T56 E72 T74T46-I54 CarbonylContact C-O 3.53Å; T46-I54 WeakPolarHBondContact CA-O 3.5Å; E47-I54 HydrophobicContact CB-CB 4.49Å; E47-I54 PolarHBondContact N-O 2.91Å; E47-I54 PolarHBondContact O-N 3.32Å; E52-I54 HydrophobicContact CG-CD1 4.41Å; E52-I54 HydrophobicContact CG-CG1 3.95Å; I54-T56 HydrophobicContact CG2-CG2 3.99Å; I54-E72 HydrophobicContact CG2-CG 4.44Å; I54-T74 HydrophobicContact CG1-CG2 4.15Å
55V97.4Very high94.5Very high1 Ų161.4 Ų61.41%0.00634%0.337CS..EExtended strand (participates in β ladder)trans-109.4119.9174-178.90000109.1A45 T46 E53 Y57 Y73A45-V55 WeakPolarHBondContact O-CA 3.28Å; T46-V55 HydrophobicContact CG2-CG2 4.23Å; E53-V55 HydrophobicContact CG-CG2 4.49Å; E53-V55 WeakPolarHBondContact OE1-CG2 3.27Å; V55-Y57 HydrophobicContact CG1-CD1 4.33Å; V55-Y73 HydrophobicContact CB-CD1 4.08Å; V55-Y73 HydrophobicContact CG2-CD1 4.08Å; V55-Y73 PolarHBondContact N-O 2.99Å; V55-Y73 PolarHBondContact O-N 3.45Å
56T97.6Very high94.4Very high10 Ų1061.7 Ų61.76%0.06133%0.331CS..EExtended strand (participates in β ladder)trans-122.3141.8175.366.10000111.9K44 A45 I54 H71 E72K44-T56 CarbonylContact C-O 3.56Å; K44-T56 VanDerWaalsContact CA-O 3.31Å; K44-T56 WeakPolarHBondContact CA-O 3.31Å; A45-T56 PolarHBondContact N-O 3.35Å; A45-T56 PolarHBondContact O-N 3.42Å; I54-T56 HydrophobicContact CG2-CG2 3.99Å; T56-H71 VanDerWaalsContact CA-O 3.29Å; T56-H71 WeakPolarHBondContact CA-O 3.39Å; T56-E72 HydrophobicContact CG2-CB 4.44Å; T56-E72 HydrophobicContact CG2-CG 4.16Å
57Y98.1Very high94.4Very high1 Ų160.8 Ų60.80%0.00433%0.325CS..EExtended strand (participates in β ladder)trans-159.3164.1172.662.5-90.5000112.4E19 G21 I41 V55 H59 H71E19-Y57 VanDerWaalsContact O-CE1 3.23Å; E19-Y57 WeakPolarHBondContact O-CE1 3.45Å; G21-Y57 PolarHBondContact O-OH 3.17Å; I41-Y57 HydrophobicContact CB-CD2 4.19Å; I41-Y57 HydrophobicContact CD1-CD2 4.31Å; I41-Y57 HydrophobicContact CD1-CE2 3.89Å; I41-Y57 HydrophobicContact CG1-CD2 3.83Å; I41-Y57 HydrophobicContact CG1-CE2 3.72Å; I41-Y57 HydrophobicContact CG2-CD2 3.52Å; I41-Y57 HydrophobicContact CG2-CE2 4.21Å; I41-Y57 HydrophobicContact CG2-CG 3.8Å; V55-Y57 HydrophobicContact CG1-CD1 4.33Å; Y57-H59 AromaticContact CE2-CE1 3.48Å; Y57-H59 VanDerWaalsContact CE2-CE1 3.48Å; Y57-H59 WeakPolarHBondContact CE2-CE1 3.29Å; Y57-H59 AromaticContact CE2-ND1 4Å; Y57-H59 AromaticContact CE2-NE2 3.69Å; Y57-H71 HydrophobicContact CD1-CB 4.02Å; Y57-H71 HydrophobicContact CD2-CB 3.91Å; Y57-H71 HydrophobicContact CE1-CB 3.68Å; Y57-H71 AromaticContact CE1-CD2 3.23Å; Y57-H71 WeakPolarHBondContact CE1-CD2 3.35Å; Y57-H71 AromaticContact CE1-CG 3.48Å; Y57-H71 VanDerWaalsContact CE1-CG 3.48Å; Y57-H71 AromaticContact CE1-NE2 3.93Å; Y57-H71 HydrophobicContact CE2-CB 3.6Å; Y57-H71 AromaticContact CE2-CG 3.94Å; Y57-H71 HydrophobicContact CG-CB 4.13Å; Y57-H71 VanDerWaalsContact CZ-CB 3.48Å; Y57-H71 AromaticContact CZ-CD2 3.52Å; Y57-H71 AromaticContact CZ-CG 3.3Å; Y57-H71 AromaticContact CZ-ND1 3.77Å; Y57-H71 PolarHBondContact N-O 2.9Å; Y57-H71 PolarHBondContact O-N 2.83Å; Y57-H71 PolarHBondContact OH-CD2 3.28Å; Y57-H71 PolarHBondContact OH-CE1 2.86Å; Y57-H71 VanDerWaalsContact OH-CG 3.28Å; Y57-H71 PolarHBondContact OH-ND1 2.84Å
58D97.8Very high94.5Very high25 Ų2555.8 Ų55.813%0.13430%0.302CS..EExtended strand (participates in β ladder)trans-103.9135.4177.9-67.8-38.5000111.7I41 S42 N43 V60 V67 R70I41-D58 WeakPolarHBondContact CA-O 3.24Å; S42-D58 PolarHBondContact N-O 3.07Å; S42-D58 PolarHBondContact O-N 3.4Å; N43-D58 PolarHBondContact ND2-OD2 2.86Å; D58-V60 HydrophobicContact CB-CG1 4.14Å; D58-V67 HydrophobicContact CB-CG1 4.26Å; D58-R70 WeakPolarHBondContact OD1-CG 3.33Å
59H97.4Very high94.7Very high0 Ų050.3 Ų50.30%027%0.273CS..EExtended strand (participates in β ladder)trans-84.4113.8165.2-68.6-72.9000109.6G21 S22 V39 L40 Y57 V67 V68 A69 H71 C88 L90 C91G21-H59 PolarHBondContact O-CE1 2.87Å; G21-H59 VanDerWaalsContact O-CE1 3.22Å; S22-H59 PolarHBondContact OG-CE1 3.1Å; S22-H59 PolarHBondContact OG-ND1 3.09Å; V39-H59 HydrophobicContact CG1-CB 3.56Å; L40-H59 CarbonylContact O-C 3.56Å; L40-H59 WeakPolarHBondContact O-CA 3.44Å; Y57-H59 AromaticContact CE2-CE1 3.48Å; Y57-H59 VanDerWaalsContact CE2-CE1 3.48Å; Y57-H59 WeakPolarHBondContact CE2-CE1 3.29Å; Y57-H59 AromaticContact CE2-ND1 4Å; Y57-H59 AromaticContact CE2-NE2 3.69Å; H59-V67 CarbonylContact O-C 3.44Å; H59-V68 HydrophobicContact CB-CB 4.2Å; H59-V68 WeakPolarHBondContact O-CB 3.32Å; H59-V68 PolarHBondContact O-N 2.81Å; H59-A69 HydrophobicContact CB-CB 4.38Å; H59-A69 WeakPolarHBondContact CB-O 3.19Å; H59-A69 PolarHBondContact N-O 3.25Å; H59-H71 AromaticContact NE2-ND1 3.7Å; H59-C88 VanDerWaalsContact CD2-SG 3.53Å; H59-C88 PolarHBondContact NE2-SG 3.06Å; H59-C88 VanDerWaalsContact NE2-SG 3.38Å; H59-L90 HydrophobicContact CB-CD2 4.17Å; H59-C91 VanDerWaalsContact CE1-SG 3.55Å; H59-C91 PolarHBondContact NE2-SG 3.48Å
60V97.1Very high95.1Very high11 Ų1149.7 Ų49.77%0.06726%0.264CS..EExtended strand (participates in β ladder)trans-115.7139.6-178-56.70000111.6V39 L40 D58 K62 H66 V67V39-V60 CarbonylContact C-O 3.58Å; V39-V60 WeakPolarHBondContact CA-O 3.39Å; L40-V60 HydrophobicContact CB-CG2 3.76Å; L40-V60 PolarHBondContact N-O 3Å; L40-V60 PolarHBondContact O-N 3.48Å; D58-V60 HydrophobicContact CB-CG1 4.14Å; V60-K62 PolarHBondContact O-N 3.16Å; V60-H66 CarbonylContact C-O 3.57Å; V60-H66 WeakPolarHBondContact CA-O 3.48Å; V60-V67 HydrophobicContact CG1-CG2 4.2Å
61C96.4Very high95.8Very high0 Ų041.4 Ų41.40%022%0.22CC..EExtended strand (participates in β ladder)trans-66.2124.2173.8176.90000109.7C30 C33 N63 C64 D65 H66 V68C30-C61 HydrophobicContact CB-CB 4.04Å; C30-C61 VanDerWaalsContact CB-SG 3.51Å; C33-C61 VanDerWaalsContact SG-SG 3.69Å; C61-N63 PolarHBondContact O-N 3.32Å; C61-N63 PolarHBondContact SG-N 3.3Å; C61-C64 PolarHBondContact O-N 3.39Å; C61-D65 WeakPolarHBondContact O-CA 3.42Å; C61-D65 PolarHBondContact O-N 3.48Å; C61-H66 HydrophobicContact CB-CB 4.14Å; C61-H66 PolarHBondContact N-O 3.24Å; C61-V68 HydrophobicContact CB-CG2 4.48Å
62K94.7Very high96.5Very high110 Ų11042.4 Ų42.448%0.47821%0.208SC..THydrogen-bonded Turntrans-54.1-27.7177.8179.6175.7178.1-175.20114.2F38 L40 V60F38-K62 HydrophobicContact CB-CD 4.4Å; F38-K62 WeakPolarHBondContact O-CB 3.33Å; F38-K62 PolarHBondContact O-N 3.09Å; L40-K62 HydrophobicContact CD1-CB 4.11Å; L40-K62 HydrophobicContact CD1-CG 4.11Å; L40-K62 HydrophobicContact CG-CB 4.05Å; L40-K62 HydrophobicContact CG-CG 4.39Å; V60-K62 PolarHBondContact O-N 3.16Å
63N94.9Very high96.7Very high81 Ų8139.3 Ų39.343%0.43319%0.193SC..THydrogen-bonded Turntrans-99.2-14-167.7-143.788.5000114.8Q35 C61Q35-N63 PolarHBondContact NE2-ND2 2.89Å; Q35-N63 VanDerWaalsContact NE2-ND2 3.11Å; Q35-N63 PolarHBondContact OE1-ND2 3.27Å; Q35-N63 PolarHBondContact OE1-OD1 2.76Å; C61-N63 PolarHBondContact O-N 3.32Å; C61-N63 PolarHBondContact SG-N 3.3Å
64C94.9Very high96.7Very high40 Ų4037.3 Ų37.327%0.2719%0.185SC..THydrogen-bonded Turntrans-149.110.5-179.966.30000113.9C30 C33 C61 H66C30-C64 VanDerWaalsContact SG-SG 3.64Å; C33-C64 HydrophobicContact CB-CB 3.95Å; C33-C64 VanDerWaalsContact SG-SG 3.62Å; C61-C64 PolarHBondContact O-N 3.39Å; C64-H66 PolarHBondContact O-N 3.39Å; C64-H66 WeakPolarHBondContact SG-CB 3.43Å
65D95.1Very high96.7Very high121 Ų12137.5 Ų37.565%0.64718%0.184SC*.  trans55.718.1-179.4-60.1-79.1000114.4C61 V67C61-D65 WeakPolarHBondContact O-CA 3.42Å; C61-D65 PolarHBondContact O-N 3.48Å; D65-V67 PolarHBondContact O-N 3.38Å
66H95Very high96.6Very high47 Ų4738.2 Ų38.222%0.21819%0.189CC..  trans-67.1125.4178.217776.2000110.9C2 N32 V60 C61 C64 V68C2-H66 WeakPolarHBondContact CB-NE2 3.41Å; N32-H66 HydrophobicContact CB-CB 4.16Å; V60-H66 CarbonylContact C-O 3.57Å; V60-H66 WeakPolarHBondContact CA-O 3.48Å; C61-H66 HydrophobicContact CB-CB 4.14Å; C61-H66 PolarHBondContact N-O 3.24Å; C64-H66 PolarHBondContact O-N 3.39Å; C64-H66 WeakPolarHBondContact SG-CB 3.43Å; H66-V68 PolarHBondContact O-N 3.36Å; H66-V68 VanDerWaalsContact O-N 3.09Å
67V96.8Very high96.3Very high55 Ų5541.3 Ų41.333%0.33321%0.208SC..EExtended strand (participates in β ladder)trans-72.3101.1177.2-176.30000110.4D58 H59 V60 D65D58-V67 HydrophobicContact CB-CG1 4.26Å; H59-V67 CarbonylContact O-C 3.44Å; V60-V67 HydrophobicContact CG1-CG2 4.2Å; D65-V67 PolarHBondContact O-N 3.38Å
68V96Very high95.9Very high0 Ų044.4 Ų44.40%023%0.227CC..EExtended strand (participates in β ladder)trans-67.3-54.2179175.90000110.1M1 C2 C5 V6 Y27 H59 C61 H66 L90M1-V68 CarbonylContact C-O 3.58Å; M1-V68 WeakPolarHBondContact CA-O 3.47Å; C2-V68 PolarHBondContact N-O 3.22Å; C5-V68 HydrophobicContact CB-CG1 3.73Å; C5-V68 HydrophobicContact CB-CG2 4.44Å; V6-V68 HydrophobicContact CG1-CG1 4.35Å; Y27-V68 HydrophobicContact CD2-CG1 4.23Å; Y27-V68 HydrophobicContact CE2-CG1 4.1Å; Y27-V68 HydrophobicContact CE2-CG2 4.03Å; H59-V68 HydrophobicContact CB-CB 4.2Å; H59-V68 WeakPolarHBondContact O-CB 3.32Å; H59-V68 PolarHBondContact O-N 2.81Å; C61-V68 HydrophobicContact CB-CG2 4.48Å; H66-V68 PolarHBondContact O-N 3.36Å; H66-V68 VanDerWaalsContact O-N 3.09Å; V68-L90 HydrophobicContact CG1-CD2 4.38Å
69A97.3Very high95.3Very high0 Ų050.2 Ų50.20%026%0.258CS..EExtended strand (participates in β ladder)trans-153.8158.2-177.300000110H59 M89 L90H59-A69 HydrophobicContact CB-CB 4.38Å; H59-A69 WeakPolarHBondContact CB-O 3.19Å; H59-A69 PolarHBondContact N-O 3.25Å; A69-M89 HydrophobicContact CB-CB 4.01Å; A69-L90 HydrophobicContact CB-CB 3.65Å
70R97.3Very high94.8Very high124 Ų12454.1 Ų54.147%0.46828%0.279SS..EExtended strand (participates in β ladder)trans-105.9137.7166.2-178.1171.3174.9165.9-0.4107.8M1 D58M1-R70 HydrophobicContact CE-CB 3.65Å; D58-R70 WeakPolarHBondContact OD1-CG 3.33Å
71H98.3Very high94.5Very high1 Ų155.1 Ų55.11%0.00528%0.282CS..EExtended strand (participates in β ladder)trans-108.1132180-167.8103.4000108.6L18 T56 Y57 H59 M86 C88L18-H71 PolarHBondContact O-CE1 2.75Å; L18-H71 VanDerWaalsContact O-CE1 3.3Å; L18-H71 PolarHBondContact O-NE2 2.9Å; T56-H71 VanDerWaalsContact CA-O 3.29Å; T56-H71 WeakPolarHBondContact CA-O 3.39Å; Y57-H71 HydrophobicContact CD1-CB 4.02Å; Y57-H71 HydrophobicContact CD2-CB 3.91Å; Y57-H71 HydrophobicContact CE1-CB 3.68Å; Y57-H71 AromaticContact CE1-CD2 3.23Å; Y57-H71 WeakPolarHBondContact CE1-CD2 3.35Å; Y57-H71 AromaticContact CE1-CG 3.48Å; Y57-H71 VanDerWaalsContact CE1-CG 3.48Å; Y57-H71 AromaticContact CE1-NE2 3.93Å; Y57-H71 HydrophobicContact CE2-CB 3.6Å; Y57-H71 AromaticContact CE2-CG 3.94Å; Y57-H71 HydrophobicContact CG-CB 4.13Å; Y57-H71 VanDerWaalsContact CZ-CB 3.48Å; Y57-H71 AromaticContact CZ-CD2 3.52Å; Y57-H71 AromaticContact CZ-CG 3.3Å; Y57-H71 AromaticContact CZ-ND1 3.77Å; Y57-H71 PolarHBondContact N-O 2.9Å; Y57-H71 PolarHBondContact O-N 2.83Å; Y57-H71 PolarHBondContact OH-CD2 3.28Å; Y57-H71 PolarHBondContact OH-CE1 2.86Å; Y57-H71 VanDerWaalsContact OH-CG 3.28Å; Y57-H71 PolarHBondContact OH-ND1 2.84Å; H59-H71 AromaticContact NE2-ND1 3.7Å; H71-M86 PolarHBondContact CE1-SD 3.13Å; H71-C88 HydrophobicContact CB-CB 4.16Å; H71-C88 WeakPolarHBondContact ND1-CB 3.38Å
72E98Very high94.3Very high81 Ų8157.7 Ų57.738%0.37929%0.294SS..EExtended strand (participates in β ladder)trans-127.4129.6173-175.5171.290.100107I54 T56 M86 L87I54-E72 HydrophobicContact CG2-CG 4.44Å; T56-E72 HydrophobicContact CG2-CB 4.44Å; T56-E72 HydrophobicContact CG2-CG 4.16Å; E72-M86 CarbonylContact O-C 3.55Å; E72-M86 WeakPolarHBondContact O-CA 3.29Å; E72-L87 PolarHBondContact N-O 2.88Å; E72-L87 PolarHBondContact O-N 2.89Å
73Y97.9Very high94.4Very high20 Ų2056.3 Ų56.38%0.07829%0.289CS..EExtended strand (participates in β ladder)trans-130.4131.8173.2163.8-89.5000106.8C17 E19 V55 F75 Y84 T85C17-Y73 HydrophobicContact CB-CD2 4.27Å; C17-Y73 HydrophobicContact CB-CE2 4.02Å; E19-Y73 HydrophobicContact CB-CD1 3.63Å; E19-Y73 HydrophobicContact CB-CD2 4.36Å; E19-Y73 HydrophobicContact CB-CE1 3.77Å; E19-Y73 HydrophobicContact CB-CE2 4.47Å; E19-Y73 HydrophobicContact CB-CG 3.92Å; V55-Y73 HydrophobicContact CB-CD1 4.08Å; V55-Y73 HydrophobicContact CG2-CD1 4.08Å; V55-Y73 PolarHBondContact N-O 2.99Å; V55-Y73 PolarHBondContact O-N 3.45Å; Y73-F75 HydrophobicContact CE1-CB 3.88Å; Y73-Y84 HydrophobicContact CE2-CD1 4.27Å; Y73-Y84 VanDerWaalsContact OH-CD1 3.25Å; Y73-Y84 WeakPolarHBondContact OH-CD1 3.06Å; Y73-T85 WeakPolarHBondContact CA-O 3.43Å
74T96.7Very high94.4Very high15 Ų1554.5 Ų54.59%0.09228%0.276CS..EExtended strand (participates in β ladder)trans-124.6135.4177.8-56.10000108.8E52 E53 I54 Y84 T85E52-T74 HydrophobicContact CG-CG2 3.58Å; E52-T74 WeakPolarHBondContact OE1-CG2 3.17Å; E53-T74 CarbonylContact O-C 3.58Å; E53-T74 WeakPolarHBondContact O-CA 3.23Å; I54-T74 HydrophobicContact CG1-CG2 4.15Å; T74-Y84 WeakPolarHBondContact O-CA 3.2Å; T74-T85 WeakPolarHBondContact CB-OG1 3.47Å; T74-T85 PolarHBondContact N-O 2.77Å; T74-T85 PolarHBondContact O-N 3.16Å
75F96.2Very high94.5Very high44 Ų4455.2 Ų55.219%0.19328%0.28CS..EExtended strand (participates in β ladder)trans-122.5132.2171.9166.8-105.7000108.7E52 E53 Y73 V77 Q82 E83 Y84E52-F75 CarbonylContact C-O 3.59Å; E52-F75 WeakPolarHBondContact CA-O 3.29Å; E53-F75 HydrophobicContact CB-CB 4.36Å; E53-F75 HydrophobicContact CB-CD1 4.17Å; E53-F75 PolarHBondContact N-O 3.26Å; E53-F75 PolarHBondContact O-N 2.82Å; Y73-F75 HydrophobicContact CE1-CB 3.88Å; F75-V77 HydrophobicContact CE1-CG2 4.14Å; F75-V77 HydrophobicContact CE2-CG2 4.4Å; F75-V77 HydrophobicContact CZ-CG2 3.68Å; F75-Q82 HydrophobicContact CE2-CB 3.95Å; F75-Q82 HydrophobicContact CE2-CG 3.86Å; F75-Q82 HydrophobicContact CZ-CG 4.2Å; F75-E83 WeakPolarHBondContact CA-O 3.34Å; F75-Y84 AromaticContact CD2-CD1 3.65Å; F75-Y84 HydrophobicContact CD2-CD1 3.65Å; F75-Y84 AromaticContact CD2-CE1 3.26Å; F75-Y84 HydrophobicContact CD2-CE1 3.26Å; F75-Y84 AromaticContact CD2-CZ 3.9Å; F75-Y84 HydrophobicContact CE2-CD1 4.39Å; F75-Y84 AromaticContact CE2-CE1 3.61Å; F75-Y84 HydrophobicContact CE2-CE1 3.61Å; F75-Y84 AromaticContact CE2-CZ 3.8Å; F75-Y84 HydrophobicContact CG-CE1 4.33Å
76S95Very high94.6Very high17 Ų1749.8 Ų49.812%0.11925%0.25CS..EExtended strand (participates in β ladder)trans-143.4157.7173.160.50000110.7E83S76-E83 PolarHBondContact N-O 2.86Å; S76-E83 PolarHBondContact O-N 2.78Å
77V91.9Very high94.8Very high75 Ų7551.4 Ų51.446%0.45526%0.26SS..EExtended strand (participates in β ladder)trans-113.6111.8170.9-176.60000108.2F75 Y81 Q82F75-V77 HydrophobicContact CE1-CG2 4.14Å; F75-V77 HydrophobicContact CE2-CG2 4.4Å; F75-V77 HydrophobicContact CZ-CG2 3.68Å; V77-Y81 WeakPolarHBondContact CA-O 3.23Å; V77-Q82 HydrophobicContact CG2-CG 4.3Å
78V88.8Confident94.8Very high65 Ų6548.8 Ų48.839%0.39425%0.245SC..EExtended strand (participates in β ladder)trans-117120.8178.8-176.30000108.7D80 Y81 E83V78-D80 PolarHBondContact O-N 2.91Å; V78-Y81 PolarHBondContact N-O 3.5Å; V78-Y81 PolarHBondContact O-N 2.76Å; V78-E83 WeakPolarHBondContact CB-OE2 3.45Å; V78-E83 WeakPolarHBondContact CG2-OE2 3.42Å
79D85.9Confident94.9Very high148 Ų14849.3 Ų49.379%0.79125%0.247SC*.THydrogen-bonded Turntrans53.4-104.1-171-58.8-58.7000112
80D87.8Confident94.8Very high81 Ų8149.3 Ų49.343%0.43325%0.247SC..THydrogen-bonded Turntrans-119.424.7-179-64-69.5000112.4V78 S99 V100 L101V78-D80 PolarHBondContact O-N 2.91Å; D80-S99 WeakPolarHBondContact O-CA 3.42Å; D80-S99 PolarHBondContact O-OG 2.84Å; D80-V100 HydrophobicContact CB-CG2 4.1Å; D80-V100 WeakPolarHBondContact O-CG2 3.48Å; D80-V100 PolarHBondContact O-N 2.88Å; D80-L101 HydrophobicContact CB-CD1 4.44Å; D80-L101 HydrophobicContact CB-CG 4.36Å
81Y90.6Very high94.9Very high32 Ų3243.8 Ų43.813%0.12523%0.227CC..EExtended strand (participates in β ladder)trans-129.3139-179.5-63.8-93000111.4V77 V78 I98 P105 R106V77-Y81 WeakPolarHBondContact CA-O 3.23Å; V78-Y81 PolarHBondContact N-O 3.5Å; V78-Y81 PolarHBondContact O-N 2.76Å; Y81-I98 WeakPolarHBondContact CA-O 3.33Å; Y81-P105 WeakPolarHBondContact OH-CG 3.19Å; Y81-R106 HydrophobicContact CE1-CG 4.44Å; Y81-R106 VanDerWaalsContact CE1-NE 3.3Å; Y81-R106 VanDerWaalsContact CE2-NH2 3.33Å; Y81-R106 VanDerWaalsContact CZ-CZ 3.43Å; Y81-R106 VanDerWaalsContact CZ-NH2 3.3Å; Y81-R106 WeakPolarHBondContact OH-CG 3.43Å; Y81-R106 PolarHBondContact OH-NE 3.02Å
82Q92Very high94.8Very high54 Ų5443.7 Ų43.725%0.25223%0.227SC..EExtended strand (participates in β ladder)trans-86.1121.1164.3-72.5166.110300108F75 V77 Y84 S97 I98 V100F75-Q82 HydrophobicContact CE2-CB 3.95Å; F75-Q82 HydrophobicContact CE2-CG 3.86Å; F75-Q82 HydrophobicContact CZ-CG 4.2Å; V77-Q82 HydrophobicContact CG2-CG 4.3Å; Q82-Y84 HydrophobicContact CB-CE2 3.62Å; Q82-Y84 PolarHBondContact OE1-OH 2.99Å; Q82-S97 CarbonylContact O-C 3.56Å; Q82-S97 VanDerWaalsContact O-CA 3.29Å; Q82-S97 WeakPolarHBondContact O-CA 3.49Å; Q82-I98 PolarHBondContact N-O 3.23Å; Q82-I98 PolarHBondContact O-N 2.93Å; Q82-V100 HydrophobicContact CG-CG1 3.71Å
83E95.2Very high94.8Very high82 Ų8244.7 Ų44.738%0.38323%0.23SC..EExtended strand (participates in β ladder)trans-105.8130.9175.9-60.4-166.9100.400109.3F75 S76 V78F75-E83 WeakPolarHBondContact CA-O 3.34Å; S76-E83 PolarHBondContact N-O 2.86Å; S76-E83 PolarHBondContact O-N 2.78Å; V78-E83 WeakPolarHBondContact CB-OE2 3.45Å; V78-E83 WeakPolarHBondContact CG2-OE2 3.42Å
84Y96.3Very high94.7Very high42 Ų4244 Ų4417%0.16523%0.228CC..EExtended strand (participates in β ladder)trans-123.4124.1179.7-55.9-85.4000108.7C17 Y73 T74 F75 Q82 E95 D96 I98C17-Y84 PolarHBondContact SG-O 2.88Å; Y73-Y84 HydrophobicContact CE2-CD1 4.27Å; Y73-Y84 VanDerWaalsContact OH-CD1 3.25Å; Y73-Y84 WeakPolarHBondContact OH-CD1 3.06Å; T74-Y84 WeakPolarHBondContact O-CA 3.2Å; F75-Y84 AromaticContact CD2-CD1 3.65Å; F75-Y84 HydrophobicContact CD2-CD1 3.65Å; F75-Y84 AromaticContact CD2-CE1 3.26Å; F75-Y84 HydrophobicContact CD2-CE1 3.26Å; F75-Y84 AromaticContact CD2-CZ 3.9Å; F75-Y84 HydrophobicContact CE2-CD1 4.39Å; F75-Y84 AromaticContact CE2-CE1 3.61Å; F75-Y84 HydrophobicContact CE2-CE1 3.61Å; F75-Y84 AromaticContact CE2-CZ 3.8Å; F75-Y84 HydrophobicContact CG-CE1 4.33Å; Q82-Y84 HydrophobicContact CB-CE2 3.62Å; Q82-Y84 PolarHBondContact OE1-OH 2.99Å; Y84-E95 CarbonylContact O-C 3.59Å; Y84-E95 WeakPolarHBondContact O-CA 3.41Å; Y84-D96 HydrophobicContact CD2-CB 4.37Å; Y84-D96 PolarHBondContact N-O 2.78Å; Y84-D96 PolarHBondContact O-N 2.81Å; Y84-I98 HydrophobicContact CD2-CD1 4.43Å; Y84-I98 HydrophobicContact CE2-CB 4.47Å; Y84-I98 HydrophobicContact CE2-CD1 3.82Å; Y84-I98 HydrophobicContact CE2-CG1 4.07Å
85T97.2Very high94.7Very high56 Ų5650.7 Ų50.734%0.34426%0.258SS..EExtended strand (participates in β ladder)trans-125.9147.8171.472.20000110.4Y73 T74 A94 E95Y73-T85 WeakPolarHBondContact CA-O 3.43Å; T74-T85 WeakPolarHBondContact CB-OG1 3.47Å; T74-T85 PolarHBondContact N-O 2.77Å; T74-T85 PolarHBondContact O-N 3.16Å; T85-A94 WeakPolarHBondContact CA-O 3.31Å; T85-E95 HydrophobicContact CG2-CG 4.21Å
86M97.4Very high94.7Very high6 Ų650.8 Ų50.83%0.0326%0.261CS..EExtended strand (participates in β ladder)trans-139.7131.3176.7-178.8-173.770.100109.2R13 T16 C17 L18 H71 E72 C91 K93 A94R13-M86 HydrophobicContact CB-CE 4.21Å; R13-M86 HydrophobicContact CG-CE 4.04Å; T16-M86 VanDerWaalsContact O-CE 3.29Å; T16-M86 WeakPolarHBondContact O-CE 3.48Å; C17-M86 HydrophobicContact CB-CB 4.14Å; L18-M86 HydrophobicContact CB-SD 4.16Å; L18-M86 PolarHBondContact N-SD 2.82Å; L18-M86 VanDerWaalsContact N-SD 3.39Å; H71-M86 PolarHBondContact CE1-SD 3.13Å; E72-M86 CarbonylContact O-C 3.55Å; E72-M86 WeakPolarHBondContact O-CA 3.29Å; M86-C91 HydrophobicContact CE-CB 4.42Å; M86-C91 HydrophobicContact SD-CB 4.31Å; M86-K93 VanDerWaalsContact O-CA 3.27Å; M86-K93 WeakPolarHBondContact O-CA 3.25Å; M86-A94 HydrophobicContact CE-CB 4.21Å; M86-A94 PolarHBondContact N-O 2.87Å; M86-A94 PolarHBondContact O-N 3.01Å; M86-A94 VanDerWaalsContact O-N 3.07Å
87L97.9Very high94.6Very high82 Ų8252.4 Ų52.443%0.42927%0.272SS..EExtended strand (participates in β ladder)trans-134.1111.8175.9-168.967.6000110.8Y10 E72 K93Y10-L87 HydrophobicContact CD1-CD1 3.72Å; Y10-L87 HydrophobicContact CD1-CG 4.24Å; Y10-L87 HydrophobicContact CE1-CD1 3.97Å; Y10-L87 HydrophobicContact CE1-CG 4.05Å; E72-L87 PolarHBondContact N-O 2.88Å; E72-L87 PolarHBondContact O-N 2.89Å; L87-K93 HydrophobicContact CD1-CB 4.15Å
88C97.9Very high94.6Very high0 Ų052.4 Ų52.40%027%0.269CS..EExtended strand (participates in β ladder)trans-151.8133.5176.7179.40000110.8Y10 H59 H71 L90 C91 G92Y10-C88 VanDerWaalsContact CD1-C 3.48Å; Y10-C88 WeakPolarHBondContact CD1-O 3.3Å; H59-C88 VanDerWaalsContact CD2-SG 3.53Å; H59-C88 PolarHBondContact NE2-SG 3.06Å; H59-C88 VanDerWaalsContact NE2-SG 3.38Å; H71-C88 HydrophobicContact CB-CB 4.16Å; H71-C88 WeakPolarHBondContact ND1-CB 3.38Å; C88-L90 PolarHBondContact O-N 3.21Å; C88-L90 PolarHBondContact SG-N 3.45Å; C88-L90 VanDerWaalsContact SG-N 3.43Å; C88-C91 HydrophobicContact CB-CB 3.75Å; C88-C91 PolarHBondContact SG-N 2.81Å; C88-G92 PolarHBondContact N-O 2.86Å; C88-G92 CarbonylContact O-C 3.58Å; C88-G92 VanDerWaalsContact O-CA 3.31Å; C88-G92 WeakPolarHBondContact O-CA 3.41Å; C88-G92 PolarHBondContact O-N 2.89Å
89M96.8Very high94.6Very high11 Ų1149.9 Ų49.95%0.05425%0.254CS..THydrogen-bonded Turntrans-62.7-31.9178.3-175.4-179.5-79.900112.1M1 N3 V6 E9 Y10 N26 A69M1-M89 HydrophobicContact CB-CE 3.77Å; M1-M89 HydrophobicContact CB-SD 3.68Å; M1-M89 HydrophobicContact SD-CB 4.25Å; M1-M89 HydrophobicContact SD-CE 3.99Å; N3-M89 WeakPolarHBondContact OD1-CE 3.5Å; N3-M89 PolarHBondContact OD1-SD 3Å; N3-M89 VanDerWaalsContact OD1-SD 3.38Å; V6-M89 HydrophobicContact CG2-CG 4.13Å; V6-M89 HydrophobicContact CG2-SD 4.45Å; E9-M89 HydrophobicContact CB-CG 4.42Å; E9-M89 HydrophobicContact CG-CE 4.5Å; E9-M89 HydrophobicContact CG-CG 4.33Å; Y10-M89 HydrophobicContact CD1-CB 4.45Å; Y10-M89 HydrophobicContact CE1-CB 4.04Å; Y10-M89 HydrophobicContact CE2-CB 4.27Å; Y10-M89 HydrophobicContact CE2-CE 3.9Å; Y10-M89 HydrophobicContact CE2-CG 4.34Å; Y10-M89 PolarHBondContact N-O 3.31Å; N26-M89 PolarHBondContact ND2-O 3.32Å; A69-M89 HydrophobicContact CB-CB 4.01Å
90L97Very high94.6Very high0 Ų046.1 Ų46.10%024%0.236CC..THydrogen-bonded Turntrans-86.1-53.5176.5174.964.3000112.1V6 N26 Y27 V39 H59 V68 A69 C88V6-L90 HydrophobicContact CG1-CB 4.19Å; V6-L90 HydrophobicContact CG1-CD1 3.91Å; N26-L90 HydrophobicContact CB-CD1 4.37Å; N26-L90 PolarHBondContact ND2-O 3.37Å; Y27-L90 HydrophobicContact CD2-CD1 4.33Å; V39-L90 HydrophobicContact CG1-CD2 4.37Å; H59-L90 HydrophobicContact CB-CD2 4.17Å; V68-L90 HydrophobicContact CG1-CD2 4.38Å; A69-L90 HydrophobicContact CB-CB 3.65Å; C88-L90 PolarHBondContact O-N 3.21Å; C88-L90 PolarHBondContact SG-N 3.45Å; C88-L90 VanDerWaalsContact SG-N 3.43Å
91C97.4Very high94.4Very high7 Ų746 Ų465%0.04724%0.235CC..THydrogen-bonded Turntrans-75.9-36.7-172.2-63.20000113.4R13 H59 M86 C88R13-C91 WeakPolarHBondContact CD-O 3.45Å; R13-C91 WeakPolarHBondContact CG-O 3.5Å; H59-C91 VanDerWaalsContact CE1-SG 3.55Å; H59-C91 PolarHBondContact NE2-SG 3.48Å; M86-C91 HydrophobicContact CE-CB 4.42Å; M86-C91 HydrophobicContact SD-CB 4.31Å; C88-C91 HydrophobicContact CB-CB 3.75Å; C88-C91 PolarHBondContact SG-N 2.81Å
92G97.1Very high93.8Very high0 Ų051 Ų510%027%0.272CS..EExtended strand (participates in β ladder)trans126.2-175.5179.400000114.5P11 C88P11-G92 CarbonylContact O-C 3.42Å; P11-G92 WeakPolarHBondContact O-CA 3.29Å; C88-G92 PolarHBondContact N-O 2.86Å; C88-G92 CarbonylContact O-C 3.58Å; C88-G92 VanDerWaalsContact O-CA 3.31Å; C88-G92 WeakPolarHBondContact O-CA 3.41Å; C88-G92 PolarHBondContact O-N 2.89Å
93K97.4Very high92.9Very high102 Ų10253.8 Ų53.844%0.44329%0.288SS..EExtended strand (participates in β ladder)trans-112.4133.9168.564.8176.7-170.5161.60109.6P11 D12 R13 M86 L87P11-K93 PolarHBondContact O-N 3.35Å; D12-K93 WeakPolarHBondContact OD2-CE 3.24Å; R13-K93 PolarHBondContact N-O 3.02Å; M86-K93 VanDerWaalsContact O-CA 3.27Å; M86-K93 WeakPolarHBondContact O-CA 3.25Å; L87-K93 HydrophobicContact CD1-CB 4.15Å
94A97.3Very high91.6Very high4 Ų451.1 Ų51.13%0.03328%0.276CS..EExtended strand (participates in β ladder)trans-150.6152.2174.400000110.3R13 G14 T16 C17 T85 M86R13-A94 HydrophobicContact CB-CB 3.86Å; G14-A94 VanDerWaalsContact O-CA 3.31Å; G14-A94 WeakPolarHBondContact O-CA 3.33Å; G14-A94 WeakPolarHBondContact O-CB 3.2Å; T16-A94 VanDerWaalsContact O-CB 3.28Å; T16-A94 WeakPolarHBondContact O-CB 3.47Å; C17-A94 VanDerWaalsContact SG-C 3.51Å; C17-A94 WeakPolarHBondContact SG-CB 3.49Å; C17-A94 PolarHBondContact SG-O 2.84Å; T85-A94 WeakPolarHBondContact CA-O 3.31Å; M86-A94 HydrophobicContact CE-CB 4.21Å; M86-A94 PolarHBondContact N-O 2.87Å; M86-A94 PolarHBondContact O-N 3.01Å; M86-A94 VanDerWaalsContact O-N 3.07Å
95E96.8Very high90.3Very high156 Ų15652.1 Ų52.173%0.72929%0.288SS*.EExtended strand (participates in β ladder)trans-139.9134.1175.5-64.7167.390.800107G14 Y84 T85G14-E95 PolarHBondContact O-N 3.05Å; Y84-E95 CarbonylContact O-C 3.59Å; Y84-E95 WeakPolarHBondContact O-CA 3.41Å; T85-E95 HydrophobicContact CG2-CG 4.21Å
96D95.4Very high88.9Confident47 Ų4757.2 Ų57.225%0.25130%0.301SS..EExtended strand (participates in β ladder)trans-142.5149.8175.6-165.7-132.7000110.8N15 Y84 I98N15-D96 HydrophobicContact CB-CB 3.87Å; N15-D96 VanDerWaalsContact CB-OD2 3.24Å; N15-D96 WeakPolarHBondContact CB-OD2 3.32Å; Y84-D96 HydrophobicContact CD2-CB 4.37Å; Y84-D96 PolarHBondContact N-O 2.78Å; Y84-D96 PolarHBondContact O-N 2.81Å; D96-I98 WeakPolarHBondContact OD1-CD1 3.19Å; D96-I98 WeakPolarHBondContact OD1-CG1 3.28Å
97S93.4Very high87.4Confident51 Ų5164.3 Ų64.336%0.35733%0.334SS..EExtended strand (participates in β ladder)trans-138.3121.7178.170.50000110Q82Q82-S97 CarbonylContact O-C 3.56Å; Q82-S97 VanDerWaalsContact O-CA 3.29Å; Q82-S97 WeakPolarHBondContact O-CA 3.49Å
98I90.7Very high85.5Confident75 Ų7564.3 Ų64.339%0.38534%0.338SS..EExtended strand (participates in β ladder)trans-124.9127.3-175.4-51.2179000109.1Y81 Q82 Y84 D96 V100Y81-I98 WeakPolarHBondContact CA-O 3.33Å; Q82-I98 PolarHBondContact N-O 3.23Å; Q82-I98 PolarHBondContact O-N 2.93Å; Y84-I98 HydrophobicContact CD2-CD1 4.43Å; Y84-I98 HydrophobicContact CE2-CB 4.47Å; Y84-I98 HydrophobicContact CE2-CD1 3.82Å; Y84-I98 HydrophobicContact CE2-CG1 4.07Å; D96-I98 WeakPolarHBondContact OD1-CD1 3.19Å; D96-I98 WeakPolarHBondContact OD1-CG1 3.28Å; I98-V100 PolarHBondContact O-N 2.95Å
99S89.8Confident83.6Confident11 Ų1167.9 Ų67.98%0.07737%0.368CS..EExtended strand (participates in β ladder)trans-62.1139.2174.1-173.30000111.4D80 L101 D104D80-S99 WeakPolarHBondContact O-CA 3.42Å; D80-S99 PolarHBondContact O-OG 2.84Å; S99-L101 WeakPolarHBondContact OG-CB 3.4Å; S99-L101 PolarHBondContact OG-N 3.31Å; S99-L101 VanDerWaalsContact OG-N 3.13Å; S99-D104 WeakPolarHBondContact CB-OD2 3.38Å; S99-D104 PolarHBondContact N-OD2 3.13Å
100V85.6Confident81.7Confident70 Ų7072.8 Ų72.842%0.42440%0.4SS..SBendtrans-76.4-14.1170.2-56.70000112.2D80 Q82 I98D80-V100 HydrophobicContact CB-CG2 4.1Å; D80-V100 WeakPolarHBondContact O-CG2 3.48Å; D80-V100 PolarHBondContact O-N 2.88Å; Q82-V100 HydrophobicContact CG-CG1 3.71Å; I98-V100 PolarHBondContact O-N 2.95Å
101L83.8Confident79.9Confident77 Ų7780 Ų8040%0.40344%0.438SS..SBendtrans-76.4150.4180-60.3177.3000110.6D80 S99 D103 P105D80-L101 HydrophobicContact CB-CD1 4.44Å; D80-L101 HydrophobicContact CB-CG 4.36Å; S99-L101 WeakPolarHBondContact OG-CB 3.4Å; S99-L101 PolarHBondContact OG-N 3.31Å; S99-L101 VanDerWaalsContact OG-N 3.13Å; L101-D103 PolarHBondContact O-N 3.35Å; L101-P105 HydrophobicContact CD1-CG 4.46Å
102P77.4Confident77.9Confident139 Ų13992.4 Ų92.490%0.90349%0.492SS*.SBendtrans-64.7-21.5177.824.4-32.9000113.6
103D72.6Confident77Confident111 Ų11197.1 Ų97.159%0.59452%0.516SS*.SBendtrans-127.6116.2174.8-147.8-84000107.2L101 P105 T108L101-D103 PolarHBondContact O-N 3.35Å; D103-P105 VanDerWaalsContact O-CD 3.28Å; D103-P105 WeakPolarHBondContact O-CD 3.43Å; D103-T108 WeakPolarHBondContact OD1-CG2 3.33Å
104D69.4Low75.9Confident26 Ų2696.8 Ų96.814%0.13952%0.52CS..  trans-72.2114.8-177.9-176.3-70.2000108.7S99 R106 Q107 T108S99-D104 WeakPolarHBondContact CB-OD2 3.38Å; S99-D104 PolarHBondContact N-OD2 3.13Å; D104-R106 PolarHBondContact O-N 2.93Å; D104-R106 WeakPolarHBondContact OD1-CA 3.48Å; D104-R106 WeakPolarHBondContact OD1-CB 3.42Å; D104-R106 PolarHBondContact OD1-N 2.98Å; D104-Q107 HydrophobicContact CB-CB 4.06Å; D104-Q107 HydrophobicContact CB-CG 3.96Å; D104-Q107 PolarHBondContact O-N 3.03Å; D104-Q107 PolarHBondContact OD1-N 2.76Å; D104-Q107 VanDerWaalsContact OD1-N 3.13Å; D104-T108 PolarHBondContact O-N 2.8Å
105P67.2Low74.7Confident64 Ų64101.9 Ų101.942%0.41655%0.547SS..THydrogen-bonded Turntrans-65.7-17.2-173.225.1-32000112.6Y81 L101 D103 T108Y81-P105 WeakPolarHBondContact OH-CG 3.19Å; L101-P105 HydrophobicContact CD1-CG 4.46Å; D103-P105 VanDerWaalsContact O-CD 3.28Å; D103-P105 WeakPolarHBondContact O-CD 3.43Å; P105-T108 PolarHBondContact O-OG1 3Å
106R68.8Low73.4Confident162 Ų16298.8 Ų98.861%0.61154%0.536SS*.THydrogen-bonded Turntrans-82.6-22.4173.8-48.4174.6-176.1174.82.4112Y81 D104Y81-R106 HydrophobicContact CE1-CG 4.44Å; Y81-R106 VanDerWaalsContact CE1-NE 3.3Å; Y81-R106 VanDerWaalsContact CE2-NH2 3.33Å; Y81-R106 VanDerWaalsContact CZ-CZ 3.43Å; Y81-R106 VanDerWaalsContact CZ-NH2 3.3Å; Y81-R106 WeakPolarHBondContact OH-CG 3.43Å; Y81-R106 PolarHBondContact OH-NE 3.02Å; D104-R106 PolarHBondContact O-N 2.93Å; D104-R106 WeakPolarHBondContact OD1-CA 3.48Å; D104-R106 WeakPolarHBondContact OD1-CB 3.42Å; D104-R106 PolarHBondContact OD1-N 2.98Å
107Q65.7Low72.1Confident155 Ų155102 Ų10272%0.72455%0.554SS**THydrogen-bonded Turntrans-93.1-4.3176.5-60.6-173.828.900113.4D104 A109D104-Q107 HydrophobicContact CB-CB 4.06Å; D104-Q107 HydrophobicContact CB-CG 3.96Å; D104-Q107 PolarHBondContact O-N 3.03Å; D104-Q107 PolarHBondContact OD1-N 2.76Å; D104-Q107 VanDerWaalsContact OD1-N 3.13Å; Q107-A109 PolarHBondContact O-N 2.88Å
108T58.8Low70.6Confident82 Ų82105.4 Ų105.450%0.50357%0.567SS.*  trans-64.184.616860.20000110.3D103 D104 P105D103-T108 WeakPolarHBondContact OD1-CG2 3.33Å; D104-T108 PolarHBondContact O-N 2.8Å; P105-T108 PolarHBondContact O-OG1 3Å
109A57.8Low69.2Low76 Ų76107.6 Ų107.663%0.62858%0.581SS**  trans-58.8135.6163.800000107.5Q107 L111Q107-A109 PolarHBondContact O-N 2.88Å; A109-L111 VanDerWaalsContact C-N 3.32Å; A109-L111 PolarHBondContact O-N 2.89Å
110P55.7Low67.6Low114 Ų114115 Ų11574%0.7462%0.619SS**  trans-62105.4164.425.7-27.8000106.1F112P110-F112 PolarHBondContact O-N 2.96Å
111L59Low66.1Low150 Ų150118.8 Ų118.879%0.78564%0.636SS**  trans-59.4121.4150.5-65.6169.1000103.5A109A109-L111 VanDerWaalsContact C-N 3.32Å; A109-L111 PolarHBondContact O-N 2.89Å
112F57.1Low64.5Low269 Ų269122.5 Ų122.5100%1.1866%0.657SS**  trans99.30-176-44.5-61.1000115.8P110P110-F112 PolarHBondContact O-N 2.96Å

Retrieved 112 of 112 residues in 600.8 ms (Link to these results)

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