I7G3A4_MACFA Loading...

Macaca fascicularis brain cDNA clone: QorA-11660, similar to human lymphocyte antigen 6 complex, locus E (LY6E), mRNA, RefSeq: NM_002346.1

AlphaFold DB , UniProt , Accession I7G3A4, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene n/a, Length 131 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
1M50.9Low61.6Low222 Ų222116.3 Ų116.3100%1.09462%0.621SS**  010.90-68.9172.9143.200114.7
2K57.8Low61.4Low193 Ų193117.5 Ų117.584%0.83963%0.627SS**  trans-89.7-17.2-175.3-145.9109.9173.3-177.30114.4P6K2-P6 WeakPolarHBondContact O-CD 3.14Å
3I60Low61.2Low126 Ų126119.5 Ų119.565%0.64664%0.636SS**SBendtrans-96.8-23.2-172-52.4-172.7000112.3L5 P6 V7I3-L5 VanDerWaalsContact C-N 3.34Å; I3-L5 PolarHBondContact O-N 3.46Å; I3-P6 VanDerWaalsContact O-CD 3.23Å; I3-P6 WeakPolarHBondContact O-CD 3.17Å; I3-P6 VanDerWaalsContact O-CG 3.28Å; I3-P6 WeakPolarHBondContact O-CG 3.28Å; I3-V7 HydrophobicContact CG2-CG2 3.97Å; I3-V7 WeakPolarHBondContact O-CB 3.26Å; I3-V7 WeakPolarHBondContact O-CG2 3.23Å; I3-V7 PolarHBondContact O-N 2.89Å
4F60.9Low60.6Low170 Ų170115.1 Ų115.175%0.74663%0.634SS**Hα-helixtrans-65.6-36.7179-76.1-83.6000112.9L8F4-L8 VanDerWaalsContact O-CB 3.27Å; F4-L8 WeakPolarHBondContact O-CB 3.4Å; F4-L8 PolarHBondContact O-N 2.99Å
5L62.2Low60.1Low99 Ų99113.4 Ų113.452%0.51863%0.627SS.*Hα-helixtrans-66.4-49.6179.9-164.875.1000113.1I3 V7 L8 L9 L126I3-L5 VanDerWaalsContact C-N 3.34Å; I3-L5 PolarHBondContact O-N 3.46Å; L5-V7 VanDerWaalsContact C-N 3.31Å; L5-V7 PolarHBondContact O-N 3.41Å; L5-L8 PolarHBondContact O-N 2.76Å; L5-L9 PolarHBondContact O-N 3.17Å; L5-L126 HydrophobicContact CD1-CD1 4.46Å
6P62.5Low59.4Low73 Ų73117.9 Ų117.947%0.47464%0.642SS.*Hα-helixtrans-66.7-32.6175.923.8-32.7000112.5K2 I3 A10K2-P6 WeakPolarHBondContact O-CD 3.14Å; I3-P6 VanDerWaalsContact O-CD 3.23Å; I3-P6 WeakPolarHBondContact O-CD 3.17Å; I3-P6 VanDerWaalsContact O-CG 3.28Å; I3-P6 WeakPolarHBondContact O-CG 3.28Å; P6-A10 VanDerWaalsContact O-CB 3.26Å; P6-A10 WeakPolarHBondContact O-CB 3.43Å; P6-A10 PolarHBondContact O-N 3.18Å
7V67.4Low59Low89 Ų89122.8 Ų122.854%0.53965%0.649SS.*Hα-helixtrans-68-40.9175.7171.30000111.6I3 L5 A10 A11I3-V7 HydrophobicContact CG2-CG2 3.97Å; I3-V7 WeakPolarHBondContact O-CB 3.26Å; I3-V7 WeakPolarHBondContact O-CG2 3.23Å; I3-V7 PolarHBondContact O-N 2.89Å; L5-V7 VanDerWaalsContact C-N 3.31Å; L5-V7 PolarHBondContact O-N 3.41Å; V7-A10 PolarHBondContact O-N 3.4Å; V7-A11 WeakPolarHBondContact O-CB 3.19Å; V7-A11 PolarHBondContact O-N 3.46Å
8L65.1Low58.6Low105 Ų105122.1 Ų122.155%0.5566%0.664SS.*Hα-helixtrans-68.2-40.5176.2-173.665.7000111.9F4 L5 A11 L12F4-L8 VanDerWaalsContact O-CB 3.27Å; F4-L8 WeakPolarHBondContact O-CB 3.4Å; F4-L8 PolarHBondContact O-N 2.99Å; L5-L8 PolarHBondContact O-N 2.76Å; L8-A11 PolarHBondContact O-N 2.98Å; L8-L12 HydrophobicContact CG-CD1 4.4Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 3.38Å
9L62.6Low58.8Low80 Ų80119.9 Ų119.942%0.41966%0.659SS.*Hα-helixtrans-62.5-43.7173-107.876.6000111.4L5 A11 L12 L13L5-L9 PolarHBondContact O-N 3.17Å; L9-A11 VanDerWaalsContact C-N 3.32Å; L9-A11 PolarHBondContact O-N 2.88Å; L9-L12 PolarHBondContact O-N 3.5Å; L9-L13 HydrophobicContact CB-CD1 4.49Å; L9-L13 VanDerWaalsContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CD1 3.43Å; L9-L13 WeakPolarHBondContact O-CG 3.27Å; L9-L13 PolarHBondContact O-N 2.89Å
10A64.2Low59.7Low59 Ų59116.1 Ų116.149%0.48864%0.641SS.*Hα-helixtrans-64-36.4177.100000112.1P6 V7 L13 G14P6-A10 VanDerWaalsContact O-CB 3.26Å; P6-A10 WeakPolarHBondContact O-CB 3.43Å; P6-A10 PolarHBondContact O-N 3.18Å; V7-A10 PolarHBondContact O-N 3.4Å; A10-L13 PolarHBondContact O-N 3.48Å; A10-G14 VanDerWaalsContact O-CA 3.3Å; A10-G14 WeakPolarHBondContact O-CA 3.42Å; A10-G14 PolarHBondContact O-N 3.26Å
11A63.7Low61.2Low63 Ų63111.8 Ų111.852%0.52162%0.617SS.*Hα-helixtrans-68.3-36.2174.700000112.8V7 L8 L9V7-A11 WeakPolarHBondContact O-CB 3.19Å; V7-A11 PolarHBondContact O-N 3.46Å; L8-A11 PolarHBondContact O-N 2.98Å; L9-A11 VanDerWaalsContact C-N 3.32Å; L9-A11 PolarHBondContact O-N 2.88Å
12L59.3Low63.2Low131 Ų131103.1 Ų103.169%0.68657%0.574SS**Hα-helixtrans-73.5-34175.6-71167.7000112.7L8 L9L8-L12 HydrophobicContact CG-CD1 4.4Å; L8-L12 WeakPolarHBondContact O-CG 3.3Å; L8-L12 PolarHBondContact O-N 3.38Å; L9-L12 PolarHBondContact O-N 3.5Å
13L59Low64.9Low144 Ų14494 Ų9475%0.75453%0.534SS*.Hα-helixtrans-84-24.1178.2-68165.8000112.7L9 A10L9-L13 HydrophobicContact CB-CD1 4.49Å; L9-L13 VanDerWaalsContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CB 3.3Å; L9-L13 WeakPolarHBondContact O-CD1 3.43Å; L9-L13 WeakPolarHBondContact O-CG 3.27Å; L9-L13 PolarHBondContact O-N 2.89Å; A10-L13 PolarHBondContact O-N 3.48Å
14G52.6Low66.6Low58 Ų5889 Ų8960%0.59851%0.508SS*.  trans-90.711.2-17400000115.2A10 E16A10-G14 VanDerWaalsContact O-CA 3.3Å; A10-G14 WeakPolarHBondContact O-CA 3.42Å; A10-G14 PolarHBondContact O-N 3.26Å; G14-E16 PolarHBondContact O-N 3.04Å
15V53.9Low68.1Low89 Ų8982.1 Ų82.154%0.53948%0.481SS..  trans-77.881.9166.2176.30000107.6R17V15-R17 HydrophobicContact CG1-CG 4Å; V15-R17 PolarHBondContact O-N 3.03Å
16E48.3Very low69.6Low186 Ų18678.2 Ų78.287%0.86946%0.462SS*.  trans-58.1108.6150.6-98.5-171.683.100106.2G14 A18G14-E16 PolarHBondContact O-N 3.04Å; E16-A18 PolarHBondContact O-N 2.93Å
17R52.9Low71Confident200 Ų20081 Ų8176%0.75547%0.472SS*.  trans-70.580.7177.8-68-81.9-179.5114.6-2.5107.9V15 S19V15-R17 HydrophobicContact CG1-CG 4Å; V15-R17 PolarHBondContact O-N 3.03Å; R17-S19 PolarHBondContact O-N 3.35Å
18A51.9Low72Confident110 Ų11082.5 Ų82.591%0.90948%0.477SS*.  trans-73.238.1163.800000111.2E16E16-A18 PolarHBondContact O-N 2.93Å
19S61.9Low73.1Confident82 Ų8280.8 Ų80.857%0.57347%0.466SS*.SBendtrans-115121.7-178.7-160.60000106.7R17 L21R17-S19 PolarHBondContact O-N 3.35Å; S19-L21 PolarHBondContact O-N 2.93Å
20S77.9Confident74.2Confident42 Ų4285.4 Ų85.429%0.29448%0.483SS..  trans-51.5130.6174.142.20000109.5M22 I40S20-M22 PolarHBondContact O-N 3.09Å; S20-I40 VanDerWaalsContact OG-CG2 3.27Å; S20-I40 WeakPolarHBondContact OG-CG2 3.45Å
21L89.4Confident75.2Confident27 Ų2784.5 Ų84.514%0.14147%0.473CS..  trans-56140.6179.9-17767.6000108.9S19 C41S19-L21 PolarHBondContact O-N 2.93Å; L21-C41 HydrophobicContact CB-CB 4.29Å; L21-C41 WeakPolarHBondContact O-CA 3.39Å; L21-C41 WeakPolarHBondContact O-CB 3.45Å; L21-C41 PolarHBondContact O-N 3.3Å; L21-C41 PolarHBondContact O-SG 2.79Å
22M93.1Very high76.2Confident40 Ų4083.1 Ų83.120%0.19746%0.457CS..EExtended strand (participates in β ladder)trans-112.4132.1170.1-161.1-171.6-148.300108.9S20 P38 T39 I40 F96 L97S20-M22 PolarHBondContact O-N 3.09Å; M22-P38 HydrophobicContact CE-CB 3.63Å; M22-P38 HydrophobicContact CE-CG 4.35Å; M22-P38 HydrophobicContact SD-CB 3.98Å; M22-T39 WeakPolarHBondContact CA-O 3.04Å; M22-T39 WeakPolarHBondContact CG-O 3.38Å; M22-I40 HydrophobicContact CE-CG1 4.07Å; M22-I40 HydrophobicContact CG-CG1 4.49Å; M22-F96 HydrophobicContact CB-CD2 3.6Å; M22-F96 HydrophobicContact CB-CE1 4.21Å; M22-F96 HydrophobicContact CB-CE2 3.16Å; M22-F96 HydrophobicContact CB-CG 4.31Å; M22-F96 HydrophobicContact CB-CZ 3.5Å; M22-F96 HydrophobicContact CG-CE2 4.17Å; M22-F96 HydrophobicContact CG-CZ 4.06Å; M22-F96 HydrophobicContact SD-CE1 3.99Å; M22-F96 HydrophobicContact SD-CE2 4.07Å; M22-F96 HydrophobicContact SD-CZ 3.4Å; M22-F96 WeakPolarHBondContact SD-CZ 3.4Å; M22-L97 HydrophobicContact CB-CD2 4.32Å; M22-L97 HydrophobicContact CG-CD2 3.95Å; M22-L97 PolarHBondContact O-N 3.43Å; M22-L97 HydrophobicContact SD-CD2 4.04Å; M22-L97 HydrophobicContact SD-CG 4.47Å
23C94.4Very high77.5Confident0 Ų083.2 Ų83.20%046%0.457CS..EExtended strand (participates in β ladder)trans-128.3161.8178.3-59.30000110P38 T39 C41 C48C23-P38 CarbonylContact O-C 3.59Å; C23-T39 PolarHBondContact N-O 3.11Å; C23-T39 PolarHBondContact O-N 2.03Å; C23-C41 PolarHBondContact SG-SG 3.13Å; C23-C48 HydrophobicContact CB-CB 3.73Å; C23-C48 WeakPolarHBondContact CB-SG 3.04Å; C23-C48 WeakPolarHBondContact SG-CA 3.49Å; C23-C48 WeakPolarHBondContact SG-CB 3.35Å; C23-C48 CovalentContact SG-SG 2.02Å; C23-C48 PolarHBondContact SG-SG 3.46Å
24F95Very high78.9Confident22 Ų2284.5 Ų84.510%0.09645%0.453CS..EExtended strand (participates in β ladder)trans-75.7138.7162.3-66.2-66.8000110.1C35 L36 K37 P38 K69 L97 N99 F100F24-C35 WeakPolarHBondContact CB-O 3.36Å; F24-L36 VanDerWaalsContact CD1-CA 3.5Å; F24-L36 HydrophobicContact CD1-CB 4.2Å; F24-L36 HydrophobicContact CD1-CD2 4.22Å; F24-L36 HydrophobicContact CD2-CD2 4.09Å; F24-L36 HydrophobicContact CE1-CB 4.17Å; F24-L36 HydrophobicContact CE1-CD2 4.22Å; F24-L36 HydrophobicContact CE2-CD2 4.09Å; F24-L36 HydrophobicContact CG-CD2 4.14Å; F24-L36 HydrophobicContact CZ-CD2 4.16Å; F24-K37 CarbonylContact C-O 3.51Å; F24-K37 WeakPolarHBondContact CA-O 3.47Å; F24-P38 HydrophobicContact CD1-CB 4.36Å; F24-P38 HydrophobicContact CE1-CB 4.25Å; F24-K69 HydrophobicContact CB-CD 3.99Å; F24-K69 WeakPolarHBondContact O-CB 3.38Å; F24-L97 HydrophobicContact CD1-CD2 4.22Å; F24-L97 HydrophobicContact CD2-CB 4.33Å; F24-L97 HydrophobicContact CD2-CD2 4.24Å; F24-L97 HydrophobicContact CE1-CD2 4.06Å; F24-L97 HydrophobicContact CE2-CB 3.74Å; F24-L97 HydrophobicContact CE2-CD2 4.07Å; F24-L97 HydrophobicContact CE2-CG 4.34Å; F24-L97 HydrophobicContact CG-CD2 4.33Å; F24-L97 HydrophobicContact CZ-CB 4.14Å; F24-L97 HydrophobicContact CZ-CD1 4.15Å; F24-L97 HydrophobicContact CZ-CD2 3.99Å; F24-L97 HydrophobicContact CZ-CG 4.32Å; F24-N99 PolarHBondContact N-OD1 2.85Å; F24-N99 PolarHBondContact O-ND2 2.84Å; F24-F100 HydrophobicContact CD2-CB 4.32Å; F24-F100 HydrophobicContact CE2-CB 3.84Å; F24-F100 AromaticContact CE2-CD2 3.86Å; F24-F100 HydrophobicContact CE2-CD2 3.86Å; F24-F100 HydrophobicContact CE2-CG 4.36Å; F24-F100 HydrophobicContact CZ-CD2 4.15Å
25S93.3Very high80.7Confident26 Ų2681.8 Ų81.818%0.18243%0.425CS..EExtended strand (participates in β ladder)trans-126.3143.9177.976.60000112.5K37 T39 K69S25-K37 PolarHBondContact N-O 3.32Å; S25-T39 WeakPolarHBondContact CB-OG1 3.2Å; S25-T39 PolarHBondContact OG-OG1 2.82Å; S25-K69 VanDerWaalsContact CA-O 3.27Å; S25-K69 WeakPolarHBondContact CA-O 3.49Å
26C93.8Very high82.5Confident17 Ų1779.9 Ų79.912%0.11541%0.412CS..EExtended strand (participates in β ladder)trans-171.4161.1174.560.60000110.1Q29 C35 S68 K69C26-Q29 HydrophobicContact CB-CG 3.96Å; C26-C35 HydrophobicContact CB-CB 3.8Å; C26-C35 WeakPolarHBondContact CB-SG 3.32Å; C26-C35 VanDerWaalsContact SG-CA 3.59Å; C26-C35 WeakPolarHBondContact SG-CB 3.4Å; C26-C35 CovalentContact SG-SG 2.01Å; C26-C35 PolarHBondContact SG-SG 3.47Å; C26-S68 WeakPolarHBondContact O-CA 3.39Å; C26-K69 PolarHBondContact N-O 3.33Å; C26-K69 PolarHBondContact O-N 2.91Å; C26-K69 VanDerWaalsContact O-O 3.13Å; C26-K69 PolarHBondContact SG-N 3.14Å
27L92.4Very high84.7Confident130 Ų13077.8 Ų77.868%0.68140%0.4SS*.EExtended strand (participates in β ladder)trans-128.5131.9175.4-65.3171.2000109.6Q29L27-Q29 VanDerWaalsContact C-N 3.3Å; L27-Q29 PolarHBondContact O-N 2.92Å
28N87.5Confident86.6Confident121 Ų12171.4 Ų71.465%0.64738%0.384SS*.EExtended strand (participates in β ladder)trans5241.7168.5-60.5-40.3000114.8L67 S68N28-L67 PolarHBondContact N-O 2.97Å; N28-S68 PolarHBondContact N-OG 3.07Å
29Q89.2Confident88.7Confident70 Ų7068.1 Ų68.133%0.32735%0.353SS..EExtended strand (participates in β ladder)trans-91.4148.7176.7-63.7-63.4-21.400111.2C26 L27 C35 S66 L67C26-Q29 HydrophobicContact CB-CG 3.96Å; L27-Q29 VanDerWaalsContact C-N 3.3Å; L27-Q29 PolarHBondContact O-N 2.92Å; Q29-C35 WeakPolarHBondContact CB-SG 3.15Å; Q29-S66 CarbonylContact O-C 3.43Å; Q29-S66 WeakPolarHBondContact O-CA 3.46Å; Q29-L67 PolarHBondContact N-O 3.35Å; Q29-L67 WeakPolarHBondContact O-CB 3.04Å; Q29-L67 PolarHBondContact O-N 2.94Å
30K85.6Confident90.2Very high176 Ų17669.7 Ų69.777%0.76535%0.354SS*.SBendtrans-84.5-15.9178.3-64.6-173.1176.9-178.40113.9
31S83.3Confident90.9Very high40 Ų4068.2 Ų68.228%0.2834%0.343SS..SBendtrans-138.6143.8-175173.50000111.2L33 Y34S31-L33 PolarHBondContact O-N 2.81Å; S31-L33 PolarHBondContact OG-N 3.01Å; S31-Y34 PolarHBondContact O-N 3.13Å
32N86.1Confident91Very high35 Ų3570 Ų7019%0.18736%0.358CS..G310 helixtrans-58-33.6176.6-172.760.7000112.9Y34 C35 L36 L67 K69 F100 A102N32-Y34 VanDerWaalsContact C-N 3.3Å; N32-Y34 PolarHBondContact O-N 2.88Å; N32-C35 CarbonylContact O-C 3.54Å; N32-C35 VanDerWaalsContact O-CA 3.27Å; N32-C35 WeakPolarHBondContact O-CA 3.27Å; N32-C35 VanDerWaalsContact O-CB 3.27Å; N32-C35 WeakPolarHBondContact O-CB 3.49Å; N32-C35 PolarHBondContact O-N 3.38Å; N32-L36 WeakPolarHBondContact O-CG 3.28Å; N32-L67 HydrophobicContact CB-CD2 4.16Å; N32-K69 WeakPolarHBondContact OD1-CE 3.45Å; N32-K69 PolarHBondContact OD1-NZ 2.79Å; N32-F100 PolarHBondContact ND2-O 2.02Å; N32-F100 PolarHBondContact OD1-O 2.98Å; N32-F100 VanDerWaalsContact OD1-O 3.1Å; N32-A102 PolarHBondContact OD1-N 2.84Å
33L86.6Confident90.8Very high132 Ų13274.3 Ų74.369%0.69138%0.382SS*.G310 helixtrans-59.5-40-179.8-77148.7000112.2S31 C35S31-L33 PolarHBondContact O-N 2.81Å; S31-L33 PolarHBondContact OG-N 3.01Å; L33-C35 PolarHBondContact O-N 2.91Å
34Y87.6Confident90.6Very high172 Ų17281 Ų8168%0.67541%0.413SS*.G310 helixtrans-77.6-3.1175.4-55.7-60.8000112.9S31 N32S31-Y34 PolarHBondContact O-N 3.13Å; N32-Y34 VanDerWaalsContact C-N 3.3Å; N32-Y34 PolarHBondContact O-N 2.88Å
35C90.1Very high90.4Very high0 Ų081.4 Ų81.40%042%0.416CS..G310 helixtrans-109.222.8178.6-86.70000113.1F24 C26 Q29 N32 L33 L67 K69F24-C35 WeakPolarHBondContact CB-O 3.36Å; C26-C35 HydrophobicContact CB-CB 3.8Å; C26-C35 WeakPolarHBondContact CB-SG 3.32Å; C26-C35 VanDerWaalsContact SG-CA 3.59Å; C26-C35 WeakPolarHBondContact SG-CB 3.4Å; C26-C35 CovalentContact SG-SG 2.01Å; C26-C35 PolarHBondContact SG-SG 3.47Å; Q29-C35 WeakPolarHBondContact CB-SG 3.15Å; N32-C35 CarbonylContact O-C 3.54Å; N32-C35 VanDerWaalsContact O-CA 3.27Å; N32-C35 WeakPolarHBondContact O-CA 3.27Å; N32-C35 VanDerWaalsContact O-CB 3.27Å; N32-C35 WeakPolarHBondContact O-CB 3.49Å; N32-C35 PolarHBondContact O-N 3.38Å; L33-C35 PolarHBondContact O-N 2.91Å; C35-L67 HydrophobicContact CB-CD2 3.98Å; C35-K69 HydrophobicContact CB-CD 4.14Å; C35-K69 PolarHBondContact O-NZ 2.89Å
36L91.9Very high90.2Very high50 Ų5084.3 Ų84.326%0.26243%0.43SS..  trans-105.238177.2-63.8179000112.4F24 N32 P38 F100F24-L36 VanDerWaalsContact CD1-CA 3.5Å; F24-L36 HydrophobicContact CD1-CB 4.2Å; F24-L36 HydrophobicContact CD1-CD2 4.22Å; F24-L36 HydrophobicContact CD2-CD2 4.09Å; F24-L36 HydrophobicContact CE1-CB 4.17Å; F24-L36 HydrophobicContact CE1-CD2 4.22Å; F24-L36 HydrophobicContact CE2-CD2 4.09Å; F24-L36 HydrophobicContact CG-CD2 4.14Å; F24-L36 HydrophobicContact CZ-CD2 4.16Å; N32-L36 WeakPolarHBondContact O-CG 3.28Å; L36-P38 VanDerWaalsContact O-CD 3.31Å; L36-P38 WeakPolarHBondContact O-CD 2.9Å; L36-F100 HydrophobicContact CD1-CD2 4.36Å; L36-F100 HydrophobicContact CD1-CE2 3.73Å; L36-F100 HydrophobicContact CD1-CZ 4.38Å; L36-F100 HydrophobicContact CD2-CD2 3.56Å; L36-F100 HydrophobicContact CD2-CE2 3.81Å; L36-F100 HydrophobicContact CD2-CG 4.34Å; L36-F100 HydrophobicContact CG-CE2 4.43Å
37K94.6Very high90.1Very high141 Ų14186.7 Ų86.761%0.61344%0.437SS*.EExtended strand (participates in β ladder)trans-87.5109.8172.8-174.6-169.6175.3-160.50109.7F24 S25F24-K37 CarbonylContact C-O 3.51Å; F24-K37 WeakPolarHBondContact CA-O 3.47Å; S25-K37 PolarHBondContact N-O 3.32Å
38P93.8Very high90.1Very high67 Ų6780.5 Ų80.544%0.43540%0.404SS..EExtended strand (participates in β ladder)trans-70.1140.1-179.732.7-36.9000110M22 C23 F24 L36 L97M22-P38 HydrophobicContact CE-CB 3.63Å; M22-P38 HydrophobicContact CE-CG 4.35Å; M22-P38 HydrophobicContact SD-CB 3.98Å; C23-P38 CarbonylContact O-C 3.59Å; F24-P38 HydrophobicContact CD1-CB 4.36Å; F24-P38 HydrophobicContact CE1-CB 4.25Å; L36-P38 VanDerWaalsContact O-CD 3.31Å; L36-P38 WeakPolarHBondContact O-CD 2.9Å; P38-L97 HydrophobicContact CB-CD2 4.06Å
39T94.2Very high90.3Very high40 Ų4075 Ų7525%0.24538%0.375CS..EExtended strand (participates in β ladder)trans-144.2129.7-174.7-61.70000109.5M22 C23 S25M22-T39 WeakPolarHBondContact CA-O 3.04Å; M22-T39 WeakPolarHBondContact CG-O 3.38Å; C23-T39 PolarHBondContact N-O 3.11Å; C23-T39 PolarHBondContact O-N 2.03Å; S25-T39 WeakPolarHBondContact CB-OG1 3.2Å; S25-T39 PolarHBondContact OG-OG1 2.82Å
40I94.4Very high90.3Very high116 Ų11671.8 Ų71.860%0.59536%0.36SS*.EExtended strand (participates in β ladder)trans-74.9124.9173.3-59.5167.6000107.1S20 M22S20-I40 VanDerWaalsContact OG-CG2 3.27Å; S20-I40 WeakPolarHBondContact OG-CG2 3.45Å; M22-I40 HydrophobicContact CE-CG1 4.07Å; M22-I40 HydrophobicContact CG-CG1 4.49Å
41C92.8Very high90.5Very high10 Ų1065.3 Ų65.37%0.06834%0.336CS..PPolyproline II helixtrans-82.2165.5179.8-56.70000111.4L21 C23 D45 C71L21-C41 HydrophobicContact CB-CB 4.29Å; L21-C41 WeakPolarHBondContact O-CA 3.39Å; L21-C41 WeakPolarHBondContact O-CB 3.45Å; L21-C41 PolarHBondContact O-N 3.3Å; L21-C41 PolarHBondContact O-SG 2.79Å; C23-C41 PolarHBondContact SG-SG 3.13Å; C41-D45 HydrophobicContact CB-CB 3.72Å; C41-C71 WeakPolarHBondContact CA-SG 2.97Å; C41-C71 HydrophobicContact CB-CB 3.51Å; C41-C71 WeakPolarHBondContact CB-SG 3.02Å; C41-C71 WeakPolarHBondContact SG-CB 3.44Å; C41-C71 CovalentContact SG-SG 2.03Å; C41-C71 PolarHBondContact SG-SG 3.05Å
42S92.3Very high90.6Very high66 Ų6664.5 Ų64.546%0.46233%0.33SS..PPolyproline II helixtrans-66.7157.3171.1-171.80000110.7Q44 D45S42-Q44 PolarHBondContact O-N 2.9Å; S42-Q44 VanDerWaalsContact O-N 3.13Å; S42-D45 VanDerWaalsContact CB-OD2 3.32Å; S42-D45 WeakPolarHBondContact CB-OD2 3.34Å; S42-D45 PolarHBondContact N-OD2 3.02Å; S42-D45 VanDerWaalsContact N-OD2 3.11Å; S42-D45 WeakPolarHBondContact O-CB 3.49Å; S42-D45 PolarHBondContact O-N 3.37Å
43D88.5Confident90.4Very high130 Ų13065 Ų6570%0.69533%0.334SS*.THydrogen-bonded Turntrans-61.8-20.9174.9-59-45.1000112.9
44Q88.8Confident90.1Very high140 Ų14060.5 Ų60.565%0.65431%0.314SS*.THydrogen-bonded Turntrans-82.5-17.7175.2-56.6-60.9-2900112.6S42 N46 P73S42-Q44 PolarHBondContact O-N 2.9Å; S42-Q44 VanDerWaalsContact O-N 3.13Å; Q44-N46 PolarHBondContact O-N 3.47Å; Q44-N46 PolarHBondContact O-ND2 3.35Å; Q44-N46 VanDerWaalsContact O-ND2 3.09Å; Q44-P73 VanDerWaalsContact O-CA 3.28Å; Q44-P73 WeakPolarHBondContact O-CA 3.28Å; Q44-P73 VanDerWaalsContact O-CB 3.27Å; Q44-P73 WeakPolarHBondContact O-CB 3.35Å
45D91.6Very high89.4Confident31 Ų3154 Ų5417%0.16630%0.296CS..  trans-87.9107.3-175.3-69-35.1000111.1C41 S42 C71 S72 P73C41-D45 HydrophobicContact CB-CB 3.72Å; S42-D45 VanDerWaalsContact CB-OD2 3.32Å; S42-D45 WeakPolarHBondContact CB-OD2 3.34Å; S42-D45 PolarHBondContact N-OD2 3.02Å; S42-D45 VanDerWaalsContact N-OD2 3.11Å; S42-D45 WeakPolarHBondContact O-CB 3.49Å; S42-D45 PolarHBondContact O-N 3.37Å; D45-C71 HydrophobicContact CB-CB 3.85Å; D45-C71 WeakPolarHBondContact OD2-CB 3.28Å; D45-S72 WeakPolarHBondContact CA-O 3.36Å; D45-S72 WeakPolarHBondContact OD1-CA 3.25Å; D45-P73 WeakPolarHBondContact OD1-CD 3.27Å
46N89.3Confident88.2Confident87 Ų8754.8 Ų54.847%0.46530%0.303SS..  trans-103.7-0.6-176.5-67.2-71.8000113.4Q44 S72 Q94Q44-N46 PolarHBondContact O-N 3.47Å; Q44-N46 PolarHBondContact O-ND2 3.35Å; Q44-N46 VanDerWaalsContact O-ND2 3.09Å; N46-S72 PolarHBondContact N-O 3.35Å; N46-S72 VanDerWaalsContact N-O 3.13Å; N46-Q94 WeakPolarHBondContact O-CG 3.2Å
47Y90.5Very high86.5Confident67 Ų6757.1 Ų57.126%0.26332%0.315SS..EExtended strand (participates in β ladder)trans-134.1134.3-176-60.5-93.7000111.9C71 S72 P73 C75 C92 C93 Q94Y47-C71 CarbonylContact O-C 3.43Å; Y47-C71 WeakPolarHBondContact O-CA 3.09Å; Y47-S72 PolarHBondContact N-O 3.11Å; Y47-S72 PolarHBondContact O-N 3.08Å; Y47-P73 WeakPolarHBondContact CD2-O 3.05Å; Y47-P73 WeakPolarHBondContact CE2-O 3.02Å; Y47-C75 HydrophobicContact CD1-CB 4.03Å; Y47-C75 HydrophobicContact CE1-CB 4.27Å; Y47-C75 HydrophobicContact CG-CB 4.37Å; Y47-C92 HydrophobicContact CD1-CB 4.4Å; Y47-C93 WeakPolarHBondContact CA-O 3.04Å; Y47-Q94 HydrophobicContact CD1-CG 3.38Å; Y47-Q94 HydrophobicContact CE1-CG 3.4Å; Y47-Q94 VanDerWaalsContact CE1-CG 3.4Å; Y47-Q94 HydrophobicContact CG-CG 4.18Å; Y47-Q94 PolarHBondContact OH-NE2 3.4Å
48C92.6Very high84.7Confident0 Ų053.6 Ų53.60%032%0.319CS..EExtended strand (participates in β ladder)trans-83.3123.1158-52.40000108.2C23 C92 C93 N99C23-C48 HydrophobicContact CB-CB 3.73Å; C23-C48 WeakPolarHBondContact CB-SG 3.04Å; C23-C48 WeakPolarHBondContact SG-CA 3.49Å; C23-C48 WeakPolarHBondContact SG-CB 3.35Å; C23-C48 CovalentContact SG-SG 2.02Å; C23-C48 PolarHBondContact SG-SG 3.46Å; C48-C92 VanDerWaalsContact O-CA 3.28Å; C48-C92 WeakPolarHBondContact O-CA 3.48Å; C48-C93 PolarHBondContact N-O 3.24Å; C48-C93 PolarHBondContact O-N 2.84Å; C48-N99 HydrophobicContact CB-CB 3.89Å
49V91.9Very high82.9Confident4 Ų459 Ų592%0.02434%0.344CS..EExtended strand (participates in β ladder)trans-111.4132.3179.7-175.70000109.2V51 K69 T70 P76 I90V49-V51 HydrophobicContact CG1-CG2 4.11Å; V49-K69 CarbonylContact O-C 3.6Å; V49-K69 VanDerWaalsContact O-CA 3.28Å; V49-K69 WeakPolarHBondContact O-CA 3.12Å; V49-T70 HydrophobicContact CB-CG2 4.01Å; V49-T70 PolarHBondContact N-O 2.01Å; V49-T70 PolarHBondContact O-N 2.81Å; V49-P76 HydrophobicContact CG1-CG 4.26Å; V49-I90 HydrophobicContact CG1-CG2 4.22Å
50T90.4Very high81Confident4 Ų464.9 Ų64.93%0.02537%0.373CS..EExtended strand (participates in β ladder)trans-118.5122.7173.2-57.60000108.7L67 S68 K69 I90 S91 N99 A103T50-L67 HydrophobicContact CG2-CD1 3.59Å; T50-S68 WeakPolarHBondContact CA-O 3.49Å; T50-K69 HydrophobicContact CG2-CG 4Å; T50-I90 WeakPolarHBondContact O-CA 3.19Å; T50-S91 PolarHBondContact N-O 2.84Å; T50-S91 PolarHBondContact O-N 2.95Å; T50-N99 WeakPolarHBondContact OG1-CB 3.27Å; T50-A103 HydrophobicContact CG2-CB 4Å
51V88.4Confident79.1Confident40 Ų4062.4 Ų62.424%0.24236%0.363CS..EExtended strand (participates in β ladder)trans-114.1121.2175.7-175.90000108.2V49 T53 L67 S68 M88 G89 I90V49-V51 HydrophobicContact CG1-CG2 4.11Å; V51-T53 HydrophobicContact CG1-CG2 4.44Å; V51-L67 WeakPolarHBondContact O-CA 3.49Å; V51-S68 PolarHBondContact N-O 3.1Å; V51-S68 PolarHBondContact O-N 3.43Å; V51-M88 HydrophobicContact CG1-CG 4.37Å; V51-M88 HydrophobicContact CG1-SD 4.48Å; V51-G89 WeakPolarHBondContact CA-O 3.35Å; V51-I90 HydrophobicContact CG1-CG1 4.49Å; V51-I90 HydrophobicContact CG2-CG1 4.39Å
52S86.6Confident77.7Confident23 Ų2366.9 Ų66.916%0.16139%0.391CS..EExtended strand (participates in β ladder)trans-113.6128.9173179.70000108.4H65 S66 M88 G89S52-H65 PolarHBondContact OG-CE1 3.46Å; S52-S66 WeakPolarHBondContact CA-O 3.19Å; S52-M88 CarbonylContact O-C 3.54Å; S52-M88 WeakPolarHBondContact O-CA 3.39Å; S52-G89 PolarHBondContact N-O 3.01Å; S52-G89 PolarHBondContact O-N 2.79Å
53T82.3Confident76.3Confident46 Ų4670.1 Ų70.128%0.28240%0.397SS..EExtended strand (participates in β ladder)trans-121132.1171.253.10000108V51 H65 S66 S87 M88V51-T53 HydrophobicContact CG1-CG2 4.44Å; T53-H65 CarbonylContact O-C 3.55Å; T53-H65 VanDerWaalsContact O-CA 3.31Å; T53-H65 WeakPolarHBondContact O-CA 3.45Å; T53-H65 PolarHBondContact O-ND1 3.03Å; T53-H65 VanDerWaalsContact O-ND1 3.07Å; T53-S66 PolarHBondContact N-O 3.13Å; T53-S66 PolarHBondContact O-N 3Å; T53-S66 PolarHBondContact OG1-O 3.02Å; T53-S66 PolarHBondContact OG1-OG 3.03Å; T53-S87 CarbonylContact C-O 3.59Å; T53-S87 WeakPolarHBondContact CA-O 3.42Å; T53-M88 HydrophobicContact CG2-CB 4.22Å; T53-M88 HydrophobicContact CG2-CG 3.74Å; T53-M88 HydrophobicContact CG2-SD 3.86Å
54S80.1Confident75.5Confident37 Ų3765.6 Ų65.626%0.25938%0.381SS..EExtended strand (participates in β ladder)trans-128.8142.1170.171.70000109.8G64 A86 S87S54-G64 CarbonylContact C-O 3.36Å; S54-G64 VanDerWaalsContact CA-O 3.26Å; S54-G64 WeakPolarHBondContact CA-O 3.4Å; S54-A86 CarbonylContact O-C 3.52Å; S54-A86 WeakPolarHBondContact O-CA 3.5Å; S54-S87 PolarHBondContact N-O 3.13Å; S54-S87 PolarHBondContact O-N 3.15Å; S54-S87 PolarHBondContact OG-OG 3.04Å
55A72.9Confident75.2Confident36 Ų3662 Ų6230%0.29836%0.364SS..EExtended strand (participates in β ladder)trans-113.7128.1171.100000108.3T62 F63 G64 V85A55-T62 CarbonylContact O-C 3.39Å; A55-F63 PolarHBondContact O-N 3.04Å; A55-G64 PolarHBondContact N-O 2.88Å; A55-G64 PolarHBondContact O-N 2.85Å; A55-V85 CarbonylContact C-O 3.55Å; A55-V85 WeakPolarHBondContact CA-O 3.43Å
56G64.1Low75Confident15 Ų1562.2 Ų62.216%0.15537%0.368CS..EExtended strand (participates in β ladder)trans-164.8155.7-176.600000113.4V61 V85G56-V61 CarbonylContact C-O 3.52Å; G56-V61 WeakPolarHBondContact CA-O 3.37Å; G56-V85 PolarHBondContact N-O 2.96Å; G56-V85 CarbonylContact O-C 3.57Å; G56-V85 VanDerWaalsContact O-CA 3.24Å; G56-V85 WeakPolarHBondContact O-CA 3.42Å; G56-V85 VanDerWaalsContact O-O 3.12Å
57I55.8Low75Confident100 Ų10058.1 Ų58.151%0.51335%0.346SS..EExtended strand (participates in β ladder)trans-99.6105.7170.8-64.2162.6000107.3V61 F63 V85I57-V61 PolarHBondContact N-O 3.32Å; I57-F63 HydrophobicContact CB-CE2 4.31Å; I57-F63 HydrophobicContact CD1-CE2 3.55Å; I57-F63 HydrophobicContact CD1-CZ 3.83Å; I57-F63 HydrophobicContact CG1-CE2 3.7Å; I57-F63 HydrophobicContact CG1-CZ 4.47Å; I57-V85 HydrophobicContact CG1-CG1 4.31Å
58G57.1Low75Confident67 Ų6756.2 Ų56.269%0.69134%0.342SS*.THydrogen-bonded Turntrans57.3-156-174.600000112.7L60G58-L60 PolarHBondContact O-N 2.87Å
59N57.5Low75.1Confident180 Ų18056.3 Ų56.396%0.96334%0.342SS*.THydrogen-bonded Turntrans-87.211.6178.8-140.45.7000113.1
60L52.4Low75.1Confident164 Ų16459.5 Ų59.586%0.85936%0.362SS*.THydrogen-bonded Turntrans-108.4-29.2-165.3-160.768.8000113.1G58G58-L60 PolarHBondContact O-N 2.87Å
61V55.6Low75.3Confident64 Ų6460.2 Ų60.239%0.38837%0.367SS..EExtended strand (participates in β ladder)trans-139.9116.7-176.8-156.40000110.5G56 I57 F63G56-V61 CarbonylContact C-O 3.52Å; G56-V61 WeakPolarHBondContact CA-O 3.37Å; I57-V61 PolarHBondContact N-O 3.32Å; V61-F63 HydrophobicContact CB-CE2 4.11Å; V61-F63 HydrophobicContact CB-CZ 4.26Å; V61-F63 HydrophobicContact CG1-CE1 4.14Å; V61-F63 HydrophobicContact CG1-CE2 4Å; V61-F63 HydrophobicContact CG1-CZ 3.76Å
62T63.8Low75.5Confident104 Ų10459.7 Ų59.764%0.63837%0.365SS*.EExtended strand (participates in β ladder)trans-102109.6172.9-50.30000109.3A55A55-T62 CarbonylContact O-C 3.39Å
63F62.9Low75.7Confident134 Ų13462.2 Ų62.259%0.58838%0.381SS*.EExtended strand (participates in β ladder)trans-79.8-25.3179.1-67.7-78.2000113A55 I57 V61A55-F63 PolarHBondContact O-N 3.04Å; I57-F63 HydrophobicContact CB-CE2 4.31Å; I57-F63 HydrophobicContact CD1-CE2 3.55Å; I57-F63 HydrophobicContact CD1-CZ 3.83Å; I57-F63 HydrophobicContact CG1-CE2 3.7Å; I57-F63 HydrophobicContact CG1-CZ 4.47Å; V61-F63 HydrophobicContact CB-CE2 4.11Å; V61-F63 HydrophobicContact CB-CZ 4.26Å; V61-F63 HydrophobicContact CG1-CE1 4.14Å; V61-F63 HydrophobicContact CG1-CE2 4Å; V61-F63 HydrophobicContact CG1-CZ 3.76Å
64G71.7Confident76.1Confident35 Ų3562.8 Ų62.836%0.36139%0.39SS..EExtended strand (participates in β ladder)trans-171.1145177.200000112S54 A55S54-G64 CarbonylContact C-O 3.36Å; S54-G64 VanDerWaalsContact CA-O 3.26Å; S54-G64 WeakPolarHBondContact CA-O 3.4Å; A55-G64 PolarHBondContact N-O 2.88Å; A55-G64 PolarHBondContact O-N 2.85Å
65H82.4Confident76.4Confident65 Ų6563.5 Ų63.530%0.30140%0.395SS..EExtended strand (participates in β ladder)trans-132.1129.1169.4174.716.8000108.2S52 T53S52-H65 PolarHBondContact OG-CE1 3.46Å; T53-H65 CarbonylContact O-C 3.55Å; T53-H65 VanDerWaalsContact O-CA 3.31Å; T53-H65 WeakPolarHBondContact O-CA 3.45Å; T53-H65 PolarHBondContact O-ND1 3.03Å; T53-H65 VanDerWaalsContact O-ND1 3.07Å
66S86.8Confident76.7Confident35 Ų3564.6 Ų64.625%0.24540%0.398CS..EExtended strand (participates in β ladder)trans-124.4143.9168.737.10000110.9Q29 S52 T53Q29-S66 CarbonylContact O-C 3.43Å; Q29-S66 WeakPolarHBondContact O-CA 3.46Å; S52-S66 WeakPolarHBondContact CA-O 3.19Å; T53-S66 PolarHBondContact N-O 3.13Å; T53-S66 PolarHBondContact O-N 3Å; T53-S66 PolarHBondContact OG1-O 3.02Å; T53-S66 PolarHBondContact OG1-OG 3.03Å
67L89.4Confident76.9Confident1 Ų171.3 Ų71.31%0.00543%0.43CS..EExtended strand (participates in β ladder)trans-128.2130.3-179.2-177.569.8000108.2N28 Q29 N32 C35 T50 V51N28-L67 PolarHBondContact N-O 2.97Å; Q29-L67 PolarHBondContact N-O 3.35Å; Q29-L67 WeakPolarHBondContact O-CB 3.04Å; Q29-L67 PolarHBondContact O-N 2.94Å; N32-L67 HydrophobicContact CB-CD2 4.16Å; C35-L67 HydrophobicContact CB-CD2 3.98Å; T50-L67 HydrophobicContact CG2-CD1 3.59Å; V51-L67 WeakPolarHBondContact O-CA 3.49Å
68S91.2Very high77.2Confident26 Ų2670.4 Ų70.418%0.18243%0.431CS..EExtended strand (participates in β ladder)trans-130.6138.1176.1-66.90000109C26 N28 T50 V51C26-S68 WeakPolarHBondContact O-CA 3.39Å; N28-S68 PolarHBondContact N-OG 3.07Å; T50-S68 WeakPolarHBondContact CA-O 3.49Å; V51-S68 PolarHBondContact N-O 3.1Å; V51-S68 PolarHBondContact O-N 3.43Å
69K93.4Very high77Confident3 Ų374.5 Ų74.51%0.01343%0.432CS..EExtended strand (participates in β ladder)trans-129.9135.3177.4-65.6-178.3-174.9174.10109.4F24 S25 C26 N32 C35 V49 T50 N99 F100F24-K69 HydrophobicContact CB-CD 3.99Å; F24-K69 WeakPolarHBondContact O-CB 3.38Å; S25-K69 VanDerWaalsContact CA-O 3.27Å; S25-K69 WeakPolarHBondContact CA-O 3.49Å; C26-K69 PolarHBondContact N-O 3.33Å; C26-K69 PolarHBondContact O-N 2.91Å; C26-K69 VanDerWaalsContact O-O 3.13Å; C26-K69 PolarHBondContact SG-N 3.14Å; N32-K69 WeakPolarHBondContact OD1-CE 3.45Å; N32-K69 PolarHBondContact OD1-NZ 2.79Å; C35-K69 HydrophobicContact CB-CD 4.14Å; C35-K69 PolarHBondContact O-NZ 2.89Å; V49-K69 CarbonylContact O-C 3.6Å; V49-K69 VanDerWaalsContact O-CA 3.28Å; V49-K69 WeakPolarHBondContact O-CA 3.12Å; T50-K69 HydrophobicContact CG2-CG 4Å; K69-N99 WeakPolarHBondContact CD-O 3.49Å; K69-N99 WeakPolarHBondContact CE-O 3.47Å; K69-N99 PolarHBondContact NZ-O 2.92Å; K69-F100 PolarHBondContact NZ-O 3.03Å
70T93.4Very high76.8Confident70 Ų7068.5 Ų68.543%0.42941%0.413SS..EExtended strand (participates in β ladder)trans-148162.4-176.7-1680000112V49V49-T70 HydrophobicContact CB-CG2 4.01Å; V49-T70 PolarHBondContact N-O 2.01Å; V49-T70 PolarHBondContact O-N 2.81Å
71C93.9Very high76.7Confident19 Ų1965 Ų6513%0.12839%0.394CS..EExtended strand (participates in β ladder)trans-82.4149.1161.4-53.60000109.2C41 D45 Y47C41-C71 WeakPolarHBondContact CA-SG 2.97Å; C41-C71 HydrophobicContact CB-CB 3.51Å; C41-C71 WeakPolarHBondContact CB-SG 3.02Å; C41-C71 WeakPolarHBondContact SG-CB 3.44Å; C41-C71 CovalentContact SG-SG 2.03Å; C41-C71 PolarHBondContact SG-SG 3.05Å; D45-C71 HydrophobicContact CB-CB 3.85Å; D45-C71 WeakPolarHBondContact OD2-CB 3.28Å; Y47-C71 CarbonylContact O-C 3.43Å; Y47-C71 WeakPolarHBondContact O-CA 3.09Å
72S92.8Very high76.7Confident30 Ų3068.1 Ų68.121%0.2141%0.408CS..EExtended strand (participates in β ladder)trans-153.7148.6175.7-162.80000111.9D45 N46 Y47 A74D45-S72 WeakPolarHBondContact CA-O 3.36Å; D45-S72 WeakPolarHBondContact OD1-CA 3.25Å; N46-S72 PolarHBondContact N-O 3.35Å; N46-S72 VanDerWaalsContact N-O 3.13Å; Y47-S72 PolarHBondContact N-O 3.11Å; Y47-S72 PolarHBondContact O-N 3.08Å; S72-A74 VanDerWaalsContact C-N 3.27Å; S72-A74 WeakPolarHBondContact CB-O 3.48Å; S72-A74 PolarHBondContact O-N 3.18Å; S72-A74 PolarHBondContact OG-O 2.81Å
73P91.1Very high76.2Confident76 Ų7667.8 Ų67.849%0.49441%0.406SS..SBendtrans-72.2-22.4174.229.9-36.4000112.7Q44 D45 Y47Q44-P73 VanDerWaalsContact O-CA 3.28Å; Q44-P73 WeakPolarHBondContact O-CA 3.28Å; Q44-P73 VanDerWaalsContact O-CB 3.27Å; Q44-P73 WeakPolarHBondContact O-CB 3.35Å; D45-P73 WeakPolarHBondContact OD1-CD 3.27Å; Y47-P73 WeakPolarHBondContact CD2-O 3.05Å; Y47-P73 WeakPolarHBondContact CE2-O 3.02Å
74A89.8Confident75.8Confident58 Ų5865 Ų6548%0.47942%0.415SS..SBendtrans-137.9149.2-179.200000110.8S72 P76S72-A74 VanDerWaalsContact C-N 3.27Å; S72-A74 WeakPolarHBondContact CB-O 3.48Å; S72-A74 PolarHBondContact O-N 3.18Å; S72-A74 PolarHBondContact OG-O 2.81Å; A74-P76 WeakPolarHBondContact O-CD 3.4Å
75C86.4Confident75.2Confident52 Ų5267.2 Ų67.235%0.35142%0.422SS..PPolyproline II helixtrans-83.4118.3170178.70000109.7Y47 L77 C92Y47-C75 HydrophobicContact CD1-CB 4.03Å; Y47-C75 HydrophobicContact CE1-CB 4.27Å; Y47-C75 HydrophobicContact CG-CB 4.37Å; C75-L77 PolarHBondContact O-N 2.02Å; C75-C92 VanDerWaalsContact CA-SG 3.55Å; C75-C92 HydrophobicContact CB-CB 3.58Å; C75-C92 WeakPolarHBondContact CB-SG 3.16Å; C75-C92 WeakPolarHBondContact SG-CB 3.34Å; C75-C92 CovalentContact SG-SG 2.02Å; C75-C92 PolarHBondContact SG-SG 2.89Å
76P79.3Confident74.2Confident58 Ų5866.5 Ų66.538%0.37743%0.427SS..PPolyproline II helixtrans-63.3130.7172.521.1-25.4000109.6V49 A74 I90V49-P76 HydrophobicContact CG1-CG 4.26Å; A74-P76 WeakPolarHBondContact O-CD 3.4Å; P76-I90 HydrophobicContact CG-CG2 4.01Å
77L67.9Low73.5Confident156 Ų15666.9 Ų66.982%0.81743%0.43SS*.PPolyproline II helixtrans-66.3129.6177.5-154.671.8000108.3C75 E79C75-L77 PolarHBondContact O-N 2.02Å; L77-E79 PolarHBondContact O-N 3.33Å
78P61.8Low72.9Confident81 Ų8170.4 Ų70.453%0.52645%0.447SS..  trans-68.598.6-177.324.8-31.5000109.9G80 I90P78-G80 PolarHBondContact O-N 2.78Å; P78-I90 HydrophobicContact CB-CB 4.36Å
79E53.1Low72.4Confident154 Ų15470.6 Ų70.672%0.7245%0.453SS*.  trans-73.482.7153.2-61.9-160.4152.400106.2L77 I81L77-E79 PolarHBondContact O-N 3.33Å; E79-I81 HydrophobicContact CB-CG1 4.32Å; E79-I81 WeakPolarHBondContact O-CG1 3.37Å; E79-I81 PolarHBondContact O-N 2.94Å
80G54.3Low72Confident54 Ų5472.5 Ų72.556%0.55746%0.463SS*.  trans-65.982.8176.500000109.9P78 N82P78-G80 PolarHBondContact O-N 2.78Å; G80-N82 PolarHBondContact O-N 3.01Å; G80-N82 VanDerWaalsContact O-N 3.13Å
81I50.9Low71.7Confident91 Ų9171.3 Ų71.347%0.46746%0.457SS..  trans-84.388.5179.4-16.5-177.4000107.9E79 V83E79-I81 HydrophobicContact CB-CG1 4.32Å; E79-I81 WeakPolarHBondContact O-CG1 3.37Å; E79-I81 PolarHBondContact O-N 2.94Å; I81-V83 HydrophobicContact CB-CG2 3.98Å; I81-V83 HydrophobicContact CG2-CG2 3.37Å; I81-V83 PolarHBondContact O-N 3.28Å
82N53.7Low71.4Confident128 Ų12872.1 Ų72.168%0.68446%0.463SS*.  trans-75.781.1164-83.7-35.3000108.3G80 G84 S87G80-N82 PolarHBondContact O-N 3.01Å; G80-N82 VanDerWaalsContact O-N 3.13Å; N82-G84 PolarHBondContact O-N 2.77Å; N82-S87 VanDerWaalsContact OD1-CB 3.28Å; N82-S87 WeakPolarHBondContact OD1-CB 3.5Å
83V54.8Low71.3Confident98 Ų9872.4 Ų72.459%0.59446%0.464SS*.BIsolated β-bridgetrans-87.680.5175.3-174.60000107.9I81 V85 A86I81-V83 HydrophobicContact CB-CG2 3.98Å; I81-V83 HydrophobicContact CG2-CG2 3.37Å; I81-V83 PolarHBondContact O-N 3.28Å; V83-V85 PolarHBondContact O-N 3.18Å; V83-A86 PolarHBondContact N-O 3.15Å; V83-A86 VanDerWaalsContact N-O 3.13Å; V83-A86 PolarHBondContact O-N 2.79Å
84G54.6Low71.1Confident76 Ų7674 Ų7478%0.78447%0.465SS*.THydrogen-bonded Turntrans53.6-50.5164.800000119.1N82N82-G84 PolarHBondContact O-N 2.77Å
85V58.4Low71Confident81 Ų8175 Ų7549%0.49147%0.469SS..THydrogen-bonded Turntrans-119.5-7.8-177.6-170.40000111.8A55 G56 I57 V83A55-V85 CarbonylContact C-O 3.55Å; A55-V85 WeakPolarHBondContact CA-O 3.43Å; G56-V85 PolarHBondContact N-O 2.96Å; G56-V85 CarbonylContact O-C 3.57Å; G56-V85 VanDerWaalsContact O-CA 3.24Å; G56-V85 WeakPolarHBondContact O-CA 3.42Å; G56-V85 VanDerWaalsContact O-O 3.12Å; I57-V85 HydrophobicContact CG1-CG1 4.31Å; V83-V85 PolarHBondContact O-N 3.18Å
86A60.5Low71.1Confident49 Ų4978 Ų7841%0.40548%0.476SS..EExtended strand (participates in β ladder)trans-133.1136.4178.800000112.1S54 V83S54-A86 CarbonylContact O-C 3.52Å; S54-A86 WeakPolarHBondContact O-CA 3.5Å; V83-A86 PolarHBondContact N-O 3.15Å; V83-A86 VanDerWaalsContact N-O 3.13Å; V83-A86 PolarHBondContact O-N 2.79Å
87S72.8Confident71.6Confident44 Ų4477.5 Ų77.531%0.30847%0.47SS..EExtended strand (participates in β ladder)trans-118.7140.4172.581.10000110.1T53 S54 N82T53-S87 CarbonylContact C-O 3.59Å; T53-S87 WeakPolarHBondContact CA-O 3.42Å; S54-S87 PolarHBondContact N-O 3.13Å; S54-S87 PolarHBondContact O-N 3.15Å; S54-S87 PolarHBondContact OG-OG 3.04Å; N82-S87 VanDerWaalsContact OD1-CB 3.28Å; N82-S87 WeakPolarHBondContact OD1-CB 3.5Å
88M75.9Confident72.7Confident75 Ų7572.2 Ų72.237%0.36945%0.445SS..EExtended strand (participates in β ladder)trans-130.1123.2176.7-174163.471.400109.5V51 S52 T53V51-M88 HydrophobicContact CG1-CG 4.37Å; V51-M88 HydrophobicContact CG1-SD 4.48Å; S52-M88 CarbonylContact O-C 3.54Å; S52-M88 WeakPolarHBondContact O-CA 3.39Å; T53-M88 HydrophobicContact CG2-CB 4.22Å; T53-M88 HydrophobicContact CG2-CG 3.74Å; T53-M88 HydrophobicContact CG2-SD 3.86Å
89G80.7Confident74.1Confident30 Ų3068.5 Ų68.531%0.30942%0.421SS..EExtended strand (participates in β ladder)trans-113.1130.4176.300000110.8V51 S52V51-G89 WeakPolarHBondContact CA-O 3.35Å; S52-G89 PolarHBondContact N-O 3.01Å; S52-G89 PolarHBondContact O-N 2.79Å
90I85.3Confident75.8Confident42 Ų4266.6 Ų66.622%0.21541%0.411CS..EExtended strand (participates in β ladder)trans-118.3129174.9-58.8177.9000107.8V49 T50 V51 P76 P78V49-I90 HydrophobicContact CG1-CG2 4.22Å; T50-I90 WeakPolarHBondContact O-CA 3.19Å; V51-I90 HydrophobicContact CG1-CG1 4.49Å; V51-I90 HydrophobicContact CG2-CG1 4.39Å; P76-I90 HydrophobicContact CG-CG2 4.01Å; P78-I90 HydrophobicContact CB-CB 4.36Å
91S86.8Confident77Confident45 Ų4566.9 Ų66.932%0.31540%0.404SS..EExtended strand (participates in β ladder)trans-131.9138.9176.6-179.40000110.3T50T50-S91 PolarHBondContact N-O 2.84Å; T50-S91 PolarHBondContact O-N 2.95Å
92C89.6Confident77.9Confident36 Ų3663.8 Ų63.824%0.24339%0.392CS..EExtended strand (participates in β ladder)trans-130.6147.4-178.3-550000111.9Y47 C48 C75Y47-C92 HydrophobicContact CD1-CB 4.4Å; C48-C92 VanDerWaalsContact O-CA 3.28Å; C48-C92 WeakPolarHBondContact O-CA 3.48Å; C75-C92 VanDerWaalsContact CA-SG 3.55Å; C75-C92 HydrophobicContact CB-CB 3.58Å; C75-C92 WeakPolarHBondContact CB-SG 3.16Å; C75-C92 WeakPolarHBondContact SG-CB 3.34Å; C75-C92 CovalentContact SG-SG 2.02Å; C75-C92 PolarHBondContact SG-SG 2.89Å
93C89Confident78.4Confident36 Ų3658.8 Ų58.824%0.24337%0.368CS..EExtended strand (participates in β ladder)trans-152.9160174.6570000111.2Y47 C48 C98Y47-C93 WeakPolarHBondContact CA-O 3.04Å; C48-C93 PolarHBondContact N-O 3.24Å; C48-C93 PolarHBondContact O-N 2.84Å; C93-C98 HydrophobicContact CB-CB 3.76Å; C93-C98 WeakPolarHBondContact CB-SG 3.28Å; C93-C98 WeakPolarHBondContact SG-CB 3.31Å; C93-C98 CovalentContact SG-SG 2.01Å; C93-C98 PolarHBondContact SG-SG 3.22Å
94Q88.4Confident78.4Confident111 Ų11160.8 Ų60.852%0.51938%0.376SS..  trans-122.227.9-170-55.9-175.3-74.100113N46 Y47N46-Q94 WeakPolarHBondContact O-CG 3.2Å; Y47-Q94 HydrophobicContact CD1-CG 3.38Å; Y47-Q94 HydrophobicContact CE1-CG 3.4Å; Y47-Q94 VanDerWaalsContact CE1-CG 3.4Å; Y47-Q94 HydrophobicContact CG-CG 4.18Å; Y47-Q94 PolarHBondContact OH-NE2 3.4Å
95S86Confident78.4Confident78 Ų7860.6 Ų60.655%0.54537%0.374SS..SBendtrans-121.9155.7-178.4-57.10000110.8L97 C98S95-L97 PolarHBondContact O-N 2.79Å; S95-C98 VanDerWaalsContact O-CB 3.25Å; S95-C98 WeakPolarHBondContact O-CB 3.32Å; S95-C98 PolarHBondContact O-N 3.12Å; S95-C98 VanDerWaalsContact O-N 3.11Å; S95-C98 PolarHBondContact O-SG 3.05Å
96F88.9Confident77.8Confident116 Ų11658.8 Ų58.851%0.50937%0.372SS..THydrogen-bonded Turntrans-55122.6-179.1-163.8-91.6000110.9M22 C98M22-F96 HydrophobicContact CB-CD2 3.6Å; M22-F96 HydrophobicContact CB-CE1 4.21Å; M22-F96 HydrophobicContact CB-CE2 3.16Å; M22-F96 HydrophobicContact CB-CG 4.31Å; M22-F96 HydrophobicContact CB-CZ 3.5Å; M22-F96 HydrophobicContact CG-CE2 4.17Å; M22-F96 HydrophobicContact CG-CZ 4.06Å; M22-F96 HydrophobicContact SD-CE1 3.99Å; M22-F96 HydrophobicContact SD-CE2 4.07Å; M22-F96 HydrophobicContact SD-CZ 3.4Å; M22-F96 WeakPolarHBondContact SD-CZ 3.4Å; F96-C98 PolarHBondContact O-N 3.41Å; F96-C98 VanDerWaalsContact O-N 3.08Å
97L91.3Very high77Confident46 Ų4664.5 Ų64.524%0.24140%0.395CS..THydrogen-bonded Turntrans52.627.8-179.9-58.7176.5000114.4M22 F24 P38 S95 N99 F100M22-L97 HydrophobicContact CB-CD2 4.32Å; M22-L97 HydrophobicContact CG-CD2 3.95Å; M22-L97 PolarHBondContact O-N 3.43Å; M22-L97 HydrophobicContact SD-CD2 4.04Å; M22-L97 HydrophobicContact SD-CG 4.47Å; F24-L97 HydrophobicContact CD1-CD2 4.22Å; F24-L97 HydrophobicContact CD2-CB 4.33Å; F24-L97 HydrophobicContact CD2-CD2 4.24Å; F24-L97 HydrophobicContact CE1-CD2 4.06Å; F24-L97 HydrophobicContact CE2-CB 3.74Å; F24-L97 HydrophobicContact CE2-CD2 4.07Å; F24-L97 HydrophobicContact CE2-CG 4.34Å; F24-L97 HydrophobicContact CG-CD2 4.33Å; F24-L97 HydrophobicContact CZ-CB 4.14Å; F24-L97 HydrophobicContact CZ-CD1 4.15Å; F24-L97 HydrophobicContact CZ-CD2 3.99Å; F24-L97 HydrophobicContact CZ-CG 4.32Å; P38-L97 HydrophobicContact CB-CD2 4.06Å; S95-L97 PolarHBondContact O-N 2.79Å; L97-N99 PolarHBondContact O-N 3.47Å; L97-F100 PolarHBondContact O-N 2.75Å
98C90.3Very high75.8Confident45 Ų4573.7 Ų73.730%0.30442%0.423SS..G310 helixtrans-65.7-23.6-175.462.10000113.8C93 S95 F96 F100C93-C98 HydrophobicContact CB-CB 3.76Å; C93-C98 WeakPolarHBondContact CB-SG 3.28Å; C93-C98 WeakPolarHBondContact SG-CB 3.31Å; C93-C98 CovalentContact SG-SG 2.01Å; C93-C98 PolarHBondContact SG-SG 3.22Å; S95-C98 VanDerWaalsContact O-CB 3.25Å; S95-C98 WeakPolarHBondContact O-CB 3.32Å; S95-C98 PolarHBondContact O-N 3.12Å; S95-C98 VanDerWaalsContact O-N 3.11Å; S95-C98 PolarHBondContact O-SG 3.05Å; F96-C98 PolarHBondContact O-N 3.41Å; F96-C98 VanDerWaalsContact O-N 3.08Å; C98-F100 PolarHBondContact O-N 2.67Å; C98-F100 VanDerWaalsContact O-N 3.12Å
99N90.8Very high74.5Confident4 Ų473.4 Ų73.42%0.02143%0.432CS..G310 helixtrans-84.936.1178.369.3-23.9000112.9F24 C48 T50 K69 L97F24-N99 PolarHBondContact N-OD1 2.85Å; F24-N99 PolarHBondContact O-ND2 2.84Å; C48-N99 HydrophobicContact CB-CB 3.89Å; T50-N99 WeakPolarHBondContact OG1-CB 3.27Å; K69-N99 WeakPolarHBondContact CD-O 3.49Å; K69-N99 WeakPolarHBondContact CE-O 3.47Å; K69-N99 PolarHBondContact NZ-O 2.92Å; L97-N99 PolarHBondContact O-N 3.47Å
100F88.3Confident73.3Confident114 Ų11474.4 Ų74.450%0.543%0.434SS..G310 helixtrans-62.2-42.2176.1174.6-97.4000112.1F24 N32 L36 K69 L97 C98F24-F100 HydrophobicContact CD2-CB 4.32Å; F24-F100 HydrophobicContact CE2-CB 3.84Å; F24-F100 AromaticContact CE2-CD2 3.86Å; F24-F100 HydrophobicContact CE2-CD2 3.86Å; F24-F100 HydrophobicContact CE2-CG 4.36Å; F24-F100 HydrophobicContact CZ-CD2 4.15Å; N32-F100 PolarHBondContact ND2-O 2.02Å; N32-F100 PolarHBondContact OD1-O 2.98Å; N32-F100 VanDerWaalsContact OD1-O 3.1Å; L36-F100 HydrophobicContact CD1-CD2 4.36Å; L36-F100 HydrophobicContact CD1-CE2 3.73Å; L36-F100 HydrophobicContact CD1-CZ 4.38Å; L36-F100 HydrophobicContact CD2-CD2 3.56Å; L36-F100 HydrophobicContact CD2-CE2 3.81Å; L36-F100 HydrophobicContact CD2-CG 4.34Å; L36-F100 HydrophobicContact CG-CE2 4.43Å; K69-F100 PolarHBondContact NZ-O 3.03Å; L97-F100 PolarHBondContact O-N 2.75Å; C98-F100 PolarHBondContact O-N 2.67Å; C98-F100 VanDerWaalsContact O-N 3.12Å
101S80.8Confident72Confident59 Ų5976.2 Ų76.241%0.41346%0.456SS..SBendtrans-79.3162.2178.2-105.30000112.8
102A70.1Confident70.5Confident27 Ų2779.4 Ų79.422%0.22347%0.473CS..  trans-61.6168.8162.300000110.5N32 D104N32-A102 PolarHBondContact OD1-N 2.84Å; A102-D104 PolarHBondContact O-N 2.75Å
103A64Low69.1Low22 Ų2283.6 Ų83.618%0.18249%0.493CS..SBendtrans-60.91.8-177.300000115T50 G105T50-A103 HydrophobicContact CG2-CB 4Å; A103-G105 PolarHBondContact O-N 2.99Å
104D54.8Low68Low140 Ų14087.6 Ų87.675%0.74951%0.511SS*.SBendtrans-7387.6169.9-65.9-42.8000110.3A102 G106A102-D104 PolarHBondContact O-N 2.75Å; D104-G106 PolarHBondContact O-N 2.59Å
105G53Low66.9Low73 Ų7383.8 Ų83.875%0.75350%0.502SS*.  trans25.567.9157.500000115.7A103A103-G105 PolarHBondContact O-N 2.99Å
106G46.4Very low66.2Low43 Ų4382.1 Ų82.144%0.44349%0.493SS..  trans-56.2144.5176.200000111.5D104 R108D104-G106 PolarHBondContact O-N 2.59Å; G106-R108 PolarHBondContact O-N 2.87Å
107L43.6Very low65.4Low169 Ų16978.5 Ų78.589%0.88549%0.488SS*.  trans-55.4108.1178.6-166.472.4000109.5A109L107-A109 PolarHBondContact O-N 2.78Å
108R48.1Very low64.5Low237 Ų23781.7 Ų81.789%0.89451%0.505SS*.  trans-68.480.5169.2-70.7177.392.3-147.29.6107.7G106 S110G106-R108 PolarHBondContact O-N 2.87Å; R108-S110 PolarHBondContact O-N 2.81Å
109A48Very low63.5Low68 Ų6884.3 Ų84.356%0.56252%0.515SS*.  trans-67.8101.6167.100000107.1L107 A111L107-A109 PolarHBondContact O-N 2.78Å; A109-A111 PolarHBondContact O-N 2.68Å
110S55.3Low62.5Low52 Ų5290.2 Ų90.236%0.36455%0.546SS..  trans-60.7111.3178.5-35.70000108.4R108 T112 L113 L114R108-S110 PolarHBondContact O-N 2.81Å; S110-T112 WeakPolarHBondContact CB-OG1 3.17Å; S110-T112 PolarHBondContact O-N 3.07Å; S110-L113 WeakPolarHBondContact O-CB 3.24Å; S110-L113 PolarHBondContact O-N 2.63Å; S110-L114 PolarHBondContact O-N 2.82Å
111A58.3Low61.7Low80 Ų8088.4 Ų88.466%0.66155%0.547SS*.Hα-helixtrans-54-26.8174.500000111.9A109 G115A109-A111 PolarHBondContact O-N 2.68Å; A111-G115 PolarHBondContact O-N 2.99Å
112T55.5Low61Low111 Ų11189.9 Ų89.968%0.68155%0.55SS*.Hα-helixtrans-63.3-38.6172.753.20000113.5S110 A116S110-T112 WeakPolarHBondContact CB-OG1 3.17Å; S110-T112 PolarHBondContact O-N 3.07Å; T112-A116 WeakPolarHBondContact O-CB 3.38Å; T112-A116 PolarHBondContact O-N 3.5Å
113L61.4Low61Low125 Ų12593.1 Ų93.165%0.65456%0.563SS**Hα-helixtrans-72.7-40.6178.1-70.7172.2000111.2S110 G117S110-L113 WeakPolarHBondContact O-CB 3.24Å; S110-L113 PolarHBondContact O-N 2.63Å; L113-G117 PolarHBondContact O-N 3.39Å
114L65.4Low61.2Low119 Ų11995.8 Ų95.862%0.62358%0.579SS**Hα-helixtrans-65.8-42.5174.9-66.2172.9000111.1S110 G117 L118S110-L114 PolarHBondContact O-N 2.82Å; L114-G117 PolarHBondContact O-N 2.86Å; L114-L118 PolarHBondContact O-N 2.84Å
115G65.6Low61.7Low32 Ų3291.9 Ų91.933%0.3357%0.566SS.*Hα-helixtrans-64.4-43.9175.500000112.9A111 L118 L119A111-G115 PolarHBondContact O-N 2.99Å; G115-L118 PolarHBondContact O-N 3.3Å; G115-L119 WeakPolarHBondContact O-CB 3.26Å; G115-L119 WeakPolarHBondContact O-CG 3.31Å; G115-L119 PolarHBondContact O-N 2.69Å
116A69.6Low62Low43 Ų4393.1 Ų93.136%0.35556%0.555SS.*Hα-helixtrans-64.4-40.4176.400000112.1T112 L119 L120T112-A116 WeakPolarHBondContact O-CB 3.38Å; T112-A116 PolarHBondContact O-N 3.5Å; A116-L119 PolarHBondContact O-N 2.75Å; A116-L120 WeakPolarHBondContact O-CB 3.46Å; A116-L120 WeakPolarHBondContact O-CD1 3.27Å; A116-L120 WeakPolarHBondContact O-CG 3.02Å; A116-L120 PolarHBondContact O-N 2.81Å
117G73.6Confident62.7Low39 Ų3997.9 Ų97.940%0.40257%0.569SS.*Hα-helixtrans-64.4-38.4175.600000113.1L113 L114 S121L113-G117 PolarHBondContact O-N 3.39Å; L114-G117 PolarHBondContact O-N 2.86Å; G117-S121 PolarHBondContact O-N 2.87Å; G117-S121 VanDerWaalsContact O-N 3.15Å; G117-S121 PolarHBondContact O-OG 2.94Å
118L72.4Confident63.5Low114 Ų114100.7 Ų100.760%0.59757%0.568SS**Hα-helixtrans-66.1-45.6174.1-13686.3000111.1L114 G115 L120 S121 L122L114-L118 PolarHBondContact O-N 2.84Å; G115-L118 PolarHBondContact O-N 3.3Å; L118-L120 PolarHBondContact O-N 3.36Å; L118-S121 PolarHBondContact O-N 3.21Å; L118-S121 PolarHBondContact O-OG 2.01Å; L118-L122 HydrophobicContact CD2-CD1 4.14Å; L118-L122 HydrophobicContact CG-CD1 4.1Å; L118-L122 WeakPolarHBondContact O-CB 2.97Å; L118-L122 WeakPolarHBondContact O-CD1 3.36Å; L118-L122 PolarHBondContact O-N 3.32Å; L118-L122 VanDerWaalsContact O-N 3.07Å
119L68.9Low63.7Low99 Ų9998.6 Ų98.652%0.51857%0.565SS.*Hα-helixtrans-59.9-46.1177.4-81.3159.3000111.9G115 A116 S121 L122 L123G115-L119 WeakPolarHBondContact O-CB 3.26Å; G115-L119 WeakPolarHBondContact O-CG 3.31Å; G115-L119 PolarHBondContact O-N 2.69Å; A116-L119 PolarHBondContact O-N 2.75Å; L119-S121 VanDerWaalsContact C-N 3.29Å; L119-S121 PolarHBondContact O-N 3.33Å; L119-L122 PolarHBondContact O-N 3.21Å; L119-L123 HydrophobicContact CD2-CD1 4.35Å; L119-L123 WeakPolarHBondContact O-CB 3.27Å; L119-L123 WeakPolarHBondContact O-CD1 3.46Å; L119-L123 PolarHBondContact O-N 3.1Å
120L69.4Low63.8Low129 Ų12997.6 Ų97.668%0.67556%0.562SS**Hα-helixtrans-65.2-28.9179.3-80.6159000113.5A116 L118 P124A116-L120 WeakPolarHBondContact O-CB 3.46Å; A116-L120 WeakPolarHBondContact O-CD1 3.27Å; A116-L120 WeakPolarHBondContact O-CG 3.02Å; A116-L120 PolarHBondContact O-N 2.81Å; L118-L120 PolarHBondContact O-N 3.36Å; L120-P124 WeakPolarHBondContact O-CD 3.47Å; L120-P124 WeakPolarHBondContact O-CG 3.39Å
121S70.5Confident63.5Low76 Ų76105 Ų10553%0.53161%0.609SS.*Hα-helixtrans-82.5-31.4177.161.10000113.2G117 L118 L119G117-S121 PolarHBondContact O-N 2.87Å; G117-S121 VanDerWaalsContact O-N 3.15Å; G117-S121 PolarHBondContact O-OG 2.94Å; L118-S121 PolarHBondContact O-N 3.21Å; L118-S121 PolarHBondContact O-OG 2.01Å; L119-S121 VanDerWaalsContact C-N 3.29Å; L119-S121 PolarHBondContact O-N 3.33Å
122L67.6Low63.8Low89 Ų89106.3 Ų106.347%0.46661%0.606SS.*Hα-helixtrans-82.7-31.6180-82.2150.1000113.6L118 L119 A125 L126L118-L122 HydrophobicContact CD2-CD1 4.14Å; L118-L122 HydrophobicContact CG-CD1 4.1Å; L118-L122 WeakPolarHBondContact O-CB 2.97Å; L118-L122 WeakPolarHBondContact O-CD1 3.36Å; L118-L122 PolarHBondContact O-N 3.32Å; L118-L122 VanDerWaalsContact O-N 3.07Å; L119-L122 PolarHBondContact O-N 3.21Å; L122-A125 PolarHBondContact O-N 2.75Å; L122-L126 WeakPolarHBondContact O-CG 2.92Å; L122-L126 PolarHBondContact O-N 3.38Å; L122-L126 VanDerWaalsContact O-N 3.14Å
123L70.3Confident64.2Low96 Ų96106 Ų10650%0.50360%0.602SS.*Hα-helixtrans-57.5-47.4-180-106.676.7000114.1L119 L126 L127L119-L123 HydrophobicContact CD2-CD1 4.35Å; L119-L123 WeakPolarHBondContact O-CB 3.27Å; L119-L123 WeakPolarHBondContact O-CD1 3.46Å; L119-L123 PolarHBondContact O-N 3.1Å; L123-L126 PolarHBondContact O-N 3.41Å; L123-L127 PolarHBondContact O-N 3.01Å; L123-L127 VanDerWaalsContact O-N 3.1Å
124P67.5Low64.4Low78 Ų78104.9 Ų104.951%0.50660%0.599SS.*Hα-helixtrans-68.6-34.9-179.9-18.330.3000113.1L120 R128L120-P124 WeakPolarHBondContact O-CD 3.47Å; L120-P124 WeakPolarHBondContact O-CG 3.39Å; P124-R128 PolarHBondContact O-N 3.31Å
125A65.4Low64.3Low57 Ų57104.1 Ų104.147%0.47160%0.598SS.*Hα-helixtrans-67.2-37.2178.100000111.8L122L122-A125 PolarHBondContact O-N 2.75Å
126L59.3Low64.2Low100 Ų100108.6 Ų108.652%0.52462%0.615SS.*Hα-helixtrans-74.4-35.1176.9-75.2163.8000112.9L5 L122 L123 R128 F129L5-L126 HydrophobicContact CD1-CD1 4.46Å; L122-L126 WeakPolarHBondContact O-CG 2.92Å; L122-L126 PolarHBondContact O-N 3.38Å; L122-L126 VanDerWaalsContact O-N 3.14Å; L123-L126 PolarHBondContact O-N 3.41Å; L126-R128 VanDerWaalsContact C-N 3.26Å; L126-R128 PolarHBondContact O-N 3.28Å; L126-F129 PolarHBondContact O-N 3.26Å
127L61.4Low63.9Low142 Ų142113 Ų11374%0.74363%0.632SS**Hα-helixtrans-67.8-25.5174.6-81.7165000113L123 F129L123-L127 PolarHBondContact O-N 3.01Å; L123-L127 VanDerWaalsContact O-N 3.1Å; L127-F129 VanDerWaalsContact C-N 3.32Å
128R59.8Low63.2Low229 Ų229118.3 Ų118.386%0.86465%0.649SS**THydrogen-bonded Turntrans-81.1-10.5177.6-145.3177.7-179.4-161-0.4113.8P124 L126P124-R128 PolarHBondContact O-N 3.31Å; L126-R128 VanDerWaalsContact C-N 3.26Å; L126-R128 PolarHBondContact O-N 3.28Å
129F51.8Low62.5Low192 Ų192118.6 Ų118.684%0.84265%0.653SS**THydrogen-bonded Turntrans-109.38.6178-96.3-86.5000113.4L126 L127L126-F129 PolarHBondContact O-N 3.26Å; L127-F129 VanDerWaalsContact C-N 3.32Å
130G51.1Low61.9Low48 Ų48120.3 Ų120.350%0.49566%0.664SS.*  trans-79.6139.1167.100000110.8
131P48.9Very low61.2Low207 Ų207119.5 Ų119.5100%1.34466%0.663SS**  trans-64.7017830.3-35.8000113

Retrieved 131 of 131 residues in 95.3 ms (Link to these results)