A0A087WSC4_MOUSE Loading...

Delta/notch-like EGF repeat containing

AlphaFold DB , UniProt , Accession A0A087WSC4, Species MOUSE (Mus musculus, Mouse), Gene Dner, Length 175 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
1M38.2Very low61.9Low220 Ų220129.7 Ų129.7100%1.08465%0.646SS**  0107.30-68.6167.8-17600106.6F3M1-F3 PolarHBondContact O-N 2.89Å
2Q47.5Very low63.6Low184 Ų184124.8 Ų124.886%0.8664%0.641SS**  trans-79.8109.1176.3-164.275.416.200106.9R4Q2-R4 PolarHBondContact O-N 3.01Å
3F52.7Low65Low182 Ų182123.6 Ų123.680%0.79865%0.65SS**  trans-6899.7169.2-66.8-82.8000107.3M1 T5M1-F3 PolarHBondContact O-N 2.89Å; F3-T5 VanDerWaalsContact C-N 3.35Å; F3-T5 PolarHBondContact O-N 3.3Å; F3-T5 VanDerWaalsContact O-N 3.11Å
4R60Low66.6Low221 Ų221124.1 Ų124.183%0.83465%0.653SS**  trans-70.2100.4161.6-75.2-167.6172.9-144-0.4106Q2 F6Q2-R4 PolarHBondContact O-N 3.01Å; R4-F6 PolarHBondContact O-N 3.14Å; R4-F6 VanDerWaalsContact O-N 3.17Å
5T59.8Low68Low120 Ų120117.3 Ų117.374%0.73662%0.62SS**  trans-57.1116164.833.20000107.9F3 V7F3-T5 VanDerWaalsContact C-N 3.35Å; F3-T5 PolarHBondContact O-N 3.3Å; F3-T5 VanDerWaalsContact O-N 3.11Å; T5-V7 PolarHBondContact O-N 3.49Å; T5-V7 VanDerWaalsContact O-N 3.11Å
6F58.1Low69.6Low202 Ų202111 Ų11189%0.88659%0.588SS**  trans-70.8100.4167.1-74.8-89.1000106.8R4 A8R4-F6 PolarHBondContact O-N 3.14Å; R4-F6 VanDerWaalsContact O-N 3.17Å; F6-A8 PolarHBondContact O-N 3.38Å
7V61.8Low70.9Confident98 Ų98112.4 Ų112.459%0.59459%0.59SS**  trans-70.1109.7166.61780000105.5T5 D9T5-V7 PolarHBondContact O-N 3.49Å; T5-V7 VanDerWaalsContact O-N 3.11Å; V7-D9 PolarHBondContact O-N 3.08Å
8A69.1Low72.1Confident64 Ų64110.2 Ų110.253%0.52958%0.576SS.*  trans-65131.5172.600000107.7F6 P10F6-A8 PolarHBondContact O-N 3.38Å; A8-P10 WeakPolarHBondContact O-CD 3.43Å
9D74.8Confident73.1Confident92 Ų92105.3 Ų105.349%0.49255%0.554SS.*  trans-69.9112.8173.9178.54.9000108.4V7 C11 A12V7-D9 PolarHBondContact O-N 3.08Å; D9-C11 PolarHBondContact O-N 2.88Å; D9-C11 VanDerWaalsContact O-N 3.15Å; D9-C11 WeakPolarHBondContact OD1-CB 2.99Å; D9-C11 PolarHBondContact OD1-N 2.73Å; D9-A12 HydrophobicContact CB-CB 4.29Å; D9-A12 VanDerWaalsContact O-CB 3.24Å; D9-A12 WeakPolarHBondContact O-CB 3.34Å; D9-A12 PolarHBondContact O-N 2.9Å
10P75.5Confident74Confident28 Ų28105.7 Ų105.718%0.18256%0.557CS.*THydrogen-bonded Turntrans-68.9-13-177.433-38.4000112.2A8 Y32A8-P10 WeakPolarHBondContact O-CD 3.43Å; P10-Y32 HydrophobicContact CB-CD1 4.28Å
11C83.6Confident74.7Confident16 Ų16102.4 Ų102.411%0.10854%0.543CS..THydrogen-bonded Turntrans-85.6-9.4172.6-69.40000114.1D9 S13 N14 C21 S22D9-C11 PolarHBondContact O-N 2.88Å; D9-C11 VanDerWaalsContact O-N 3.15Å; D9-C11 WeakPolarHBondContact OD1-CB 2.99Å; D9-C11 PolarHBondContact OD1-N 2.73Å; C11-S13 PolarHBondContact O-N 3.33Å; C11-S13 VanDerWaalsContact O-N 3.16Å; C11-N14 PolarHBondContact O-N 3.48Å; C11-C21 WeakPolarHBondContact CA-SG 3.38Å; C11-C21 HydrophobicContact CB-CB 3.7Å; C11-C21 WeakPolarHBondContact CB-SG 3.25Å; C11-C21 WeakPolarHBondContact SG-CB 3.36Å; C11-C21 CovalentContact SG-SG 2.04Å; C11-C21 PolarHBondContact SG-SG 3.15Å; C11-S22 VanDerWaalsContact SG-C 3.59Å; C11-S22 PolarHBondContact SG-N 3.4Å
12A82Confident76.8Confident71 Ų7194.8 Ų94.859%0.58751%0.511SS*.THydrogen-bonded Turntrans-61.3-27.4-178.100000113.3D9 N14D9-A12 HydrophobicContact CB-CB 4.29Å; D9-A12 VanDerWaalsContact O-CB 3.24Å; D9-A12 WeakPolarHBondContact O-CB 3.34Å; D9-A12 PolarHBondContact O-N 2.9Å; A12-N14 VanDerWaalsContact C-N 3.28Å; A12-N14 PolarHBondContact O-N 2.62Å
13S82.6Confident78.3Confident109 Ų10989.6 Ų89.676%0.76250%0.495SS*.THydrogen-bonded Turntrans-84.13.3176.3-58.90000114.1C11C11-S13 PolarHBondContact O-N 3.33Å; C11-S13 VanDerWaalsContact O-N 3.16Å
14N87.1Confident78.7Confident130 Ų13083 Ų8370%0.69547%0.472SS*.  trans45.261.1-175.1-65.2-61.3000113.2C11 A12 C16C11-N14 PolarHBondContact O-N 3.48Å; A12-N14 VanDerWaalsContact C-N 3.28Å; A12-N14 PolarHBondContact O-N 2.62Å; N14-C16 PolarHBondContact O-N 3.37Å
15P87.6Confident78.5Confident23 Ų2378.6 Ų78.615%0.14947%0.474CS..  trans-69.6-16.1-17629.5-36.1000113.8Y32 N44P15-Y32 HydrophobicContact CB-CD2 4.07Å; P15-Y32 HydrophobicContact CB-CE1 4.16Å; P15-Y32 HydrophobicContact CB-CE2 3.5Å; P15-Y32 HydrophobicContact CG-CD1 4.15Å; P15-Y32 HydrophobicContact CG-CD2 3.42Å; P15-Y32 VanDerWaalsContact CG-CD2 3.42Å; P15-Y32 HydrophobicContact CG-CE1 4.14Å; P15-Y32 HydrophobicContact CG-CE2 3.42Å; P15-Y32 VanDerWaalsContact CG-CE2 3.42Å; P15-Y32 HydrophobicContact CG-CG 3.81Å; P15-N44 WeakPolarHBondContact O-CB 3.05Å; P15-N44 PolarHBondContact O-ND2 3.03Å
16C92.9Very high77.9Confident16 Ų1675.9 Ų75.911%0.10846%0.46CS..  trans-89.9123.3-179.5-46.10000110.9N14 C21 C34N14-C16 PolarHBondContact O-N 3.37Å; C16-C21 VanDerWaalsContact SG-CA 3.53Å; C16-C21 WeakPolarHBondContact SG-CB 3.37Å; C16-C34 WeakPolarHBondContact CA-SG 3.25Å; C16-C34 HydrophobicContact CB-CB 3.79Å; C16-C34 WeakPolarHBondContact CB-SG 3.45Å; C16-C34 WeakPolarHBondContact SG-CA 3.23Å; C16-C34 WeakPolarHBondContact SG-CB 3Å; C16-C34 CovalentContact SG-SG 2.02Å; C16-C34 PolarHBondContact SG-SG 3.01Å
17H92.8Very high77.3Confident134 Ų13472.5 Ų72.562%0.6246%0.462SS*.SBendtrans-78.8-51.5-179.6-68.5-78000112.6N44H17-N44 PolarHBondContact N-O 3.28Å
18H91.6Very high76.6Confident74 Ų7471.6 Ų71.634%0.34346%0.46SS..SBendtrans-124.361.7-178.3-55.499000111.1N37 Y40 C45H18-N37 PolarHBondContact O-N 3.38Å; H18-Y40 HydrophobicContact CB-CD1 3.75Å; H18-Y40 HydrophobicContact CB-CD2 3.78Å; H18-Y40 HydrophobicContact CB-CE1 4.12Å; H18-Y40 HydrophobicContact CB-CE2 4.15Å; H18-Y40 HydrophobicContact CB-CG 3.56Å; H18-Y40 AromaticContact CD2-CE1 3.84Å; H18-Y40 AromaticContact CD2-CZ 3.76Å; H18-Y40 AromaticContact CE1-CE1 3.58Å; H18-Y40 AromaticContact CG-CD1 3.59Å; H18-Y40 AromaticContact CG-CE1 3.53Å; H18-Y40 AromaticContact CG-CG 3.93Å; H18-Y40 AromaticContact CG-CZ 3.81Å; H18-Y40 AromaticContact ND1-CD1 3.43Å; H18-Y40 WeakPolarHBondContact ND1-CD1 3.42Å; H18-Y40 AromaticContact ND1-CE1 3.37Å; H18-Y40 WeakPolarHBondContact ND1-CE1 3.34Å; H18-Y40 AromaticContact NE2-CE1 3.88Å; H18-C45 HydrophobicContact CB-CB 4.22Å; H18-C45 PolarHBondContact ND1-O 2.91Å; H18-C45 WeakPolarHBondContact O-CB 3.46Å
19G91.1Very high75.7Confident16 Ų1672.4 Ų72.417%0.16546%0.462CS..EExtended strand (participates in β ladder)trans178.3-178.8-17800000113.7I35G19-I35 CarbonylContact C-O 3.6Å; G19-I35 WeakPolarHBondContact CA-O 3.35Å
20N90.9Very high75Confident113 Ų11373.4 Ų73.460%0.60447%0.467SS*.EExtended strand (participates in β ladder)trans-97.3133.9177.2-72.6-23.3000110.8I35N20-I35 PolarHBondContact N-O 3.47Å; N20-I35 PolarHBondContact O-N 2.77Å
21C88.5Confident74.7Confident38 Ų3873.7 Ų73.726%0.25747%0.469SS..EExtended strand (participates in β ladder)trans-86.4134.5173.7-168.40000110.9C11 C16C11-C21 WeakPolarHBondContact CA-SG 3.38Å; C11-C21 HydrophobicContact CB-CB 3.7Å; C11-C21 WeakPolarHBondContact CB-SG 3.25Å; C11-C21 WeakPolarHBondContact SG-CB 3.36Å; C11-C21 CovalentContact SG-SG 2.04Å; C11-C21 PolarHBondContact SG-SG 3.15Å; C16-C21 VanDerWaalsContact SG-CA 3.53Å; C16-C21 WeakPolarHBondContact SG-CB 3.37Å
22S83.9Confident74.5Confident59 Ų5976.5 Ų76.541%0.41348%0.478SS..EExtended strand (participates in β ladder)trans-129133.1172.3-165.60000109.8C11 S24 Y32 L33C11-S22 VanDerWaalsContact SG-C 3.59Å; C11-S22 PolarHBondContact SG-N 3.4Å; S22-S24 PolarHBondContact O-N 3.27Å; S22-Y32 CarbonylContact O-C 3.44Å; S22-L33 PolarHBondContact N-O 3.36Å; S22-L33 PolarHBondContact O-N 2.87Å
23S77.4Confident74.7Confident75 Ų7578.1 Ų78.152%0.52448%0.476SS..EExtended strand (participates in β ladder)trans-72.4122.1174.949.20000109.6
24S62.9Low75Confident45 Ų4573.6 Ų73.632%0.31545%0.445SS..  trans-84122.7177.4178.20000109.2S22 S26 S31S22-S24 PolarHBondContact O-N 3.27Å; S24-S26 PolarHBondContact O-N 3.04Å; S24-S26 PolarHBondContact OG-N 2.9Å; S24-S26 PolarHBondContact OG-OG 2.98Å; S24-S31 PolarHBondContact N-O 3.23Å; S24-S31 PolarHBondContact O-OG 2.84Å; S24-S31 VanDerWaalsContact O-OG 3.07Å
25S54.2Low75.1Confident127 Ų12772.2 Ų72.289%0.88844%0.437SS*.  trans-82.915.9177.657.30000113.8S27S25-S27 PolarHBondContact O-N 3.2Å; S25-S27 VanDerWaalsContact O-N 3.08Å
26S47.5Very low75.4Confident63 Ų6373.1 Ų73.144%0.44144%0.443SS..SBendtrans-79.188.9178.958.30000111.8S24 S28S24-S26 PolarHBondContact O-N 3.04Å; S24-S26 PolarHBondContact OG-N 2.9Å; S24-S26 PolarHBondContact OG-OG 2.98Å; S26-S28 PolarHBondContact O-N 3.43Å
27S44.8Very low75.3Confident132 Ų13276.6 Ų76.692%0.92346%0.46SS*.SBendtrans59.4-11.3155.2-390000119.5S25S25-S27 PolarHBondContact O-N 3.2Å; S25-S27 VanDerWaalsContact O-N 3.08Å
28S48.2Very low75.2Confident78 Ų7878.1 Ų78.155%0.54547%0.473SS..SBendtrans-125.9116.3176.6-41.20000106.3S26 D30 S31S26-S28 PolarHBondContact O-N 3.43Å; S28-D30 PolarHBondContact O-N 2.96Å; S28-S31 PolarHBondContact O-N 2.85Å; S28-S31 PolarHBondContact O-OG 3.19Å
29S50.9Low75Confident82 Ų8276.2 Ų76.257%0.57347%0.473SS*.THydrogen-bonded Turntrans-62.89.9-172.329.80000116.2
30D59.3Low75Confident112 Ų11279.3 Ų79.360%0.59948%0.48SS*.THydrogen-bonded Turntrans-133.811.6-173.9-61.2-48.3000114.2S28S28-D30 PolarHBondContact O-N 2.96Å
31S69.4Low74.8Confident34 Ų3478.1 Ų78.124%0.23847%0.471CS..  trans-89129.5-178.6580000113.6S24 S28S24-S31 PolarHBondContact N-O 3.23Å; S24-S31 PolarHBondContact O-OG 2.84Å; S24-S31 VanDerWaalsContact O-OG 3.07Å; S28-S31 PolarHBondContact O-N 2.85Å; S28-S31 PolarHBondContact O-OG 3.19Å
32Y79.8Confident74.7Confident76 Ų7677.7 Ų77.730%0.29847%0.474SS..EExtended strand (participates in β ladder)trans-111.1160169.468.6-83.8000111.7P10 P15 S22 N44P10-Y32 HydrophobicContact CB-CD1 4.28Å; P15-Y32 HydrophobicContact CB-CD2 4.07Å; P15-Y32 HydrophobicContact CB-CE1 4.16Å; P15-Y32 HydrophobicContact CB-CE2 3.5Å; P15-Y32 HydrophobicContact CG-CD1 4.15Å; P15-Y32 HydrophobicContact CG-CD2 3.42Å; P15-Y32 VanDerWaalsContact CG-CD2 3.42Å; P15-Y32 HydrophobicContact CG-CE1 4.14Å; P15-Y32 HydrophobicContact CG-CE2 3.42Å; P15-Y32 VanDerWaalsContact CG-CE2 3.42Å; P15-Y32 HydrophobicContact CG-CG 3.81Å; S22-Y32 CarbonylContact O-C 3.44Å; Y32-N44 PolarHBondContact OH-ND2 3.05Å
33L84.4Confident74.9Confident104 Ų10481.1 Ų81.155%0.54549%0.487SS..EExtended strand (participates in β ladder)trans-130.2133.3174.2179.168.2000109.6S22S22-L33 PolarHBondContact N-O 3.36Å; S22-L33 PolarHBondContact O-N 2.87Å
34C89.4Confident75.5Confident15 Ų1579 Ų7910%0.10147%0.469CS..EExtended strand (participates in β ladder)trans-97.3128.2172.4-65.20000111.3C16 L43C16-C34 WeakPolarHBondContact CA-SG 3.25Å; C16-C34 HydrophobicContact CB-CB 3.79Å; C16-C34 WeakPolarHBondContact CB-SG 3.45Å; C16-C34 WeakPolarHBondContact SG-CA 3.23Å; C16-C34 WeakPolarHBondContact SG-CB 3Å; C16-C34 CovalentContact SG-SG 2.02Å; C16-C34 PolarHBondContact SG-SG 3.01Å; C34-L43 WeakPolarHBondContact CB-O 3.03Å; C34-L43 PolarHBondContact SG-O 3.41Å
35I90.3Very high76.9Confident101 Ų10176.9 Ų76.952%0.51845%0.454SS..EExtended strand (participates in β ladder)trans-98.2104.3170.4-57172000107.1G19 N20G19-I35 CarbonylContact C-O 3.6Å; G19-I35 WeakPolarHBondContact CA-O 3.35Å; N20-I35 PolarHBondContact N-O 3.47Å; N20-I35 PolarHBondContact O-N 2.77Å
36C92.9Very high78.8Confident41 Ų4175.1 Ų75.128%0.27743%0.432SS..EExtended strand (participates in β ladder)trans-74.7144.5-174.7-53.90000113.1Y40 C45C36-Y40 VanDerWaalsContact CB-O 3.25Å; C36-Y40 WeakPolarHBondContact CB-O 3.02Å; C36-C45 WeakPolarHBondContact CA-SG 3.4Å; C36-C45 HydrophobicContact CB-CB 3.69Å; C36-C45 WeakPolarHBondContact CB-SG 3.45Å; C36-C45 PolarHBondContact N-SG 3.18Å; C36-C45 WeakPolarHBondContact SG-CA 3.33Å; C36-C45 WeakPolarHBondContact SG-CB 3.22Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.97Å
37N91.8Very high80.8Confident89 Ų8976.8 Ų76.848%0.47643%0.433SS..PPolyproline II helixtrans-70.3158.9171.6-66.3-23.9000110.7H18 G39 Y40H18-N37 PolarHBondContact O-N 3.38Å; N37-G39 PolarHBondContact O-N 2.81Å; N37-Y40 PolarHBondContact O-N 3.34Å
38D89.9Confident82.8Confident167 Ų16774.8 Ų74.889%0.89342%0.417SS*.THydrogen-bonded Turntrans-52.1130.1177.3-69.5-37.1000111.4
39G88.3Confident84.5Confident33 Ų3374.7 Ų74.734%0.3441%0.41SS..THydrogen-bonded Turntrans85.79.5-178.200000114.9N37 P48 L49N37-G39 PolarHBondContact O-N 2.81Å; G39-P48 CarbonylContact O-C 3.43Å; G39-P48 WeakPolarHBondContact O-CA 3.37Å; G39-L49 PolarHBondContact O-N 3.34Å
40Y90.7Very high85.8Confident82 Ų8275.9 Ų75.932%0.32242%0.416SS..EExtended strand (participates in β ladder)trans-130.5146.9174-66-91.3000112.6H18 C36 N37 Q47 P48H18-Y40 HydrophobicContact CB-CD1 3.75Å; H18-Y40 HydrophobicContact CB-CD2 3.78Å; H18-Y40 HydrophobicContact CB-CE1 4.12Å; H18-Y40 HydrophobicContact CB-CE2 4.15Å; H18-Y40 HydrophobicContact CB-CG 3.56Å; H18-Y40 AromaticContact CD2-CE1 3.84Å; H18-Y40 AromaticContact CD2-CZ 3.76Å; H18-Y40 AromaticContact CE1-CE1 3.58Å; H18-Y40 AromaticContact CG-CD1 3.59Å; H18-Y40 AromaticContact CG-CE1 3.53Å; H18-Y40 AromaticContact CG-CG 3.93Å; H18-Y40 AromaticContact CG-CZ 3.81Å; H18-Y40 AromaticContact ND1-CD1 3.43Å; H18-Y40 WeakPolarHBondContact ND1-CD1 3.42Å; H18-Y40 AromaticContact ND1-CE1 3.37Å; H18-Y40 WeakPolarHBondContact ND1-CE1 3.34Å; H18-Y40 AromaticContact NE2-CE1 3.88Å; C36-Y40 VanDerWaalsContact CB-O 3.25Å; C36-Y40 WeakPolarHBondContact CB-O 3.02Å; N37-Y40 PolarHBondContact O-N 3.34Å; Y40-Q47 CarbonylContact C-O 3.49Å; Y40-Q47 VanDerWaalsContact CA-O 3.22Å; Y40-Q47 WeakPolarHBondContact CA-O 3.41Å; Y40-P48 HydrophobicContact CD1-CB 4.37Å; Y40-P48 HydrophobicContact CE1-CB 4.21Å
41E87Confident86.4Confident87 Ų8775.8 Ų75.841%0.40742%0.424SS..EExtended strand (participates in β ladder)trans-141.8178.7177.770178.3170.400111.2C45 E46 Q47 L49E41-C45 CarbonylContact O-C 3.48Å; E41-C45 WeakPolarHBondContact O-CA 3.41Å; E41-E46 PolarHBondContact O-N 3.31Å; E41-Q47 HydrophobicContact CG-CB 3.92Å; E41-Q47 PolarHBondContact N-O 2.92Å; E41-Q47 WeakPolarHBondContact O-CB 3.17Å; E41-Q47 PolarHBondContact O-N 3.26Å; E41-L49 HydrophobicContact CB-CD2 3.9Å; E41-L49 HydrophobicContact CB-CG 4.15Å; E41-L49 HydrophobicContact CG-CD2 3.79Å; E41-L49 HydrophobicContact CG-CG 4.22Å; E41-L49 VanDerWaalsContact OE2-CD2 3.25Å; E41-L49 WeakPolarHBondContact OE2-CD2 3.43Å
42G86Confident86.1Confident30 Ų3081.4 Ų81.431%0.30945%0.45SS..SBendtrans105.7167.7-175.100000112.8N44 C45G42-N44 PolarHBondContact O-N 3.3Å; G42-C45 PolarHBondContact O-N 2.66Å
43L86.9Confident84.7Confident131 Ų13183 Ų8369%0.68647%0.469SS*.THydrogen-bonded Turntrans-63.5-30.4-179.1-175.669000111.5C34C34-L43 WeakPolarHBondContact CB-O 3.03Å; C34-L43 PolarHBondContact SG-O 3.41Å
44N90.7Very high82.9Confident31 Ų3184.5 Ų84.517%0.16648%0.483CS..THydrogen-bonded Turntrans-118.713.1-176-66.993.8000112.1P15 H17 Y32 G42 E46P15-N44 WeakPolarHBondContact O-CB 3.05Å; P15-N44 PolarHBondContact O-ND2 3.03Å; H17-N44 PolarHBondContact N-O 3.28Å; Y32-N44 PolarHBondContact OH-ND2 3.05Å; G42-N44 PolarHBondContact O-N 3.3Å; N44-E46 VanDerWaalsContact C-OE2 3.3Å; N44-E46 WeakPolarHBondContact CA-OE2 2.99Å; N44-E46 WeakPolarHBondContact CB-OE2 3.49Å; N44-E46 PolarHBondContact N-OE2 2.91Å; N44-E46 PolarHBondContact O-N 3.14Å
45C92.9Very high80.9Confident0 Ų088.4 Ų88.40%051%0.51CS..SBendtrans5637.2-175.2-46.20000112.7H18 C36 E41 G42H18-C45 HydrophobicContact CB-CB 4.22Å; H18-C45 PolarHBondContact ND1-O 2.91Å; H18-C45 WeakPolarHBondContact O-CB 3.46Å; C36-C45 WeakPolarHBondContact CA-SG 3.4Å; C36-C45 HydrophobicContact CB-CB 3.69Å; C36-C45 WeakPolarHBondContact CB-SG 3.45Å; C36-C45 PolarHBondContact N-SG 3.18Å; C36-C45 WeakPolarHBondContact SG-CA 3.33Å; C36-C45 WeakPolarHBondContact SG-CB 3.22Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.97Å; E41-C45 CarbonylContact O-C 3.48Å; E41-C45 WeakPolarHBondContact O-CA 3.41Å; G42-C45 PolarHBondContact O-N 2.66Å
46E93.4Very high79Confident89 Ų8986.9 Ų86.942%0.41652%0.52SS..  trans-87-17.8-177.974-78.1-170.100112.9E41 N44E41-E46 PolarHBondContact O-N 3.31Å; N44-E46 VanDerWaalsContact C-OE2 3.3Å; N44-E46 WeakPolarHBondContact CA-OE2 2.99Å; N44-E46 WeakPolarHBondContact CB-OE2 3.49Å; N44-E46 PolarHBondContact N-OE2 2.91Å; N44-E46 PolarHBondContact O-N 3.14Å
47Q89.5Confident76.4Confident99 Ų9996.5 Ų96.546%0.46355%0.55SS.*EExtended strand (participates in β ladder)trans-103126.6-174.5-51.7-175.4-72.400110.1Y40 E41Y40-Q47 CarbonylContact C-O 3.49Å; Y40-Q47 VanDerWaalsContact CA-O 3.22Å; Y40-Q47 WeakPolarHBondContact CA-O 3.41Å; E41-Q47 HydrophobicContact CG-CB 3.92Å; E41-Q47 PolarHBondContact N-O 2.92Å; E41-Q47 WeakPolarHBondContact O-CB 3.17Å; E41-Q47 PolarHBondContact O-N 3.26Å
48P86.8Confident74Confident90 Ų9098.2 Ų98.258%0.58456%0.564SS**EExtended strand (participates in β ladder)trans-73.7134.5169.329.3-31.8000109.9G39 Y40G39-P48 CarbonylContact O-C 3.43Å; G39-P48 WeakPolarHBondContact O-CA 3.37Å; Y40-P48 HydrophobicContact CD1-CB 4.37Å; Y40-P48 HydrophobicContact CE1-CB 4.21Å
49L84.5Confident71.9Confident75 Ų7598.9 Ų98.939%0.39356%0.562SS.*PPolyproline II helixtrans-64.2134.9170-75.8168.5000109.1G39 E41 S51G39-L49 PolarHBondContact O-N 3.34Å; E41-L49 HydrophobicContact CB-CD2 3.9Å; E41-L49 HydrophobicContact CB-CG 4.15Å; E41-L49 HydrophobicContact CG-CD2 3.79Å; E41-L49 HydrophobicContact CG-CG 4.22Å; E41-L49 VanDerWaalsContact OE2-CD2 3.25Å; E41-L49 WeakPolarHBondContact OE2-CD2 3.43Å; L49-S51 PolarHBondContact O-N 3.13Å
50P78.8Confident69.5Low108 Ų108102.1 Ų102.170%0.70158%0.579SS**  trans-62.5107.1172.522.9-29000108.6I52P50-I52 PolarHBondContact O-N 3.04Å
51S70.8Confident67.4Low110 Ų110104.6 Ų104.677%0.76960%0.603SS**  trans-63.6105.8171.643.50000107.8L49 P53L49-S51 PolarHBondContact O-N 3.13Å; S51-P53 VanDerWaalsContact O-CD 3.23Å; S51-P53 WeakPolarHBondContact O-CD 3.38Å
52I62.3Low65.2Low152 Ų152104.4 Ų104.478%0.77962%0.616SS**  trans-61.4118.4159.7-58.8-179.9000104.4P50 T54P50-I52 PolarHBondContact O-N 3.04Å; I52-T54 PolarHBondContact O-N 3.22Å
53P51.8Low63.1Low110 Ų110108.9 Ų108.971%0.71464%0.64SS**  trans-60.5113.4174.223-29.6000106.6S51 S55S51-P53 VanDerWaalsContact O-CD 3.23Å; S51-P53 WeakPolarHBondContact O-CD 3.38Å; P53-S55 VanDerWaalsContact C-N 3.27Å; P53-S55 PolarHBondContact O-N 3.35Å
54T46.3Very low61Low135 Ų135113.9 Ų113.983%0.82865%0.65SS**  trans-53.798.8167.4-39.50000106.1I52 G56I52-T54 PolarHBondContact O-N 3.22Å; T54-G56 PolarHBondContact O-N 2.79Å
55S47.7Very low58.7Low96 Ų96120.4 Ų120.467%0.67168%0.679SS**  trans-54.2117.3171.654.50000106.6P53 W57P53-S55 VanDerWaalsContact C-N 3.27Å; P53-S55 PolarHBondContact O-N 3.35Å; S55-W57 PolarHBondContact O-N 3.13Å
56G50.2Low56.3Low70 Ų70128.1 Ų128.172%0.72272%0.719SS**  trans-53.6123.5-166.600000113T54T54-G56 PolarHBondContact O-N 2.79Å
57W37Very low54.1Low243 Ų243131.5 Ų131.592%0.9274%0.735SS**  trans-102.3106.8140.2-70.990.8000105.5S55 E59S55-W57 PolarHBondContact O-N 3.13Å; W57-E59 PolarHBondContact O-N 3.34Å
58T43Very low52Low124 Ų124132.9 Ų132.976%0.76175%0.753SS**  trans-48.5107.1165.729.10000109.2S60T58-S60 PolarHBondContact O-N 3.23Å
59E45.1Very low49.7Very low182 Ų182135 Ų13585%0.8576%0.764SS**  trans-56.791.5159.3-175.9134.387.700107.4W57 T61W57-E59 PolarHBondContact O-N 3.34Å; E59-T61 VanDerWaalsContact C-N 3.33Å; E59-T61 PolarHBondContact O-N 3.04Å
60S38.9Very low47.8Very low101 Ų101136.4 Ų136.471%0.70678%0.778SS**  trans-74.795.4171-60.20000106.4T58 A62T58-S60 PolarHBondContact O-N 3.23Å; S60-A62 VanDerWaalsContact C-N 3.26Å; S60-A62 PolarHBondContact O-N 3.23Å
61T45.2Very low46Very low134 Ų134136.5 Ų136.582%0.82279%0.787SS**  trans-55.393.5158.332.50000108.7E59E59-T61 VanDerWaalsContact C-N 3.33Å; E59-T61 PolarHBondContact O-N 3.04Å
62A42Very low44.5Very low82 Ų82137.7 Ų137.768%0.67879%0.79SS**  trans-86.7127.8162.300000108.2S60 R64S60-A62 VanDerWaalsContact C-N 3.26Å; S60-A62 PolarHBondContact O-N 3.23Å; A62-R64 PolarHBondContact O-N 3.28Å
63P40.9Very low43.8Very low124 Ų124139.1 Ų139.181%0.80579%0.793SS**  trans-64.2122.8176-1628.3000110.2Q65P63-Q65 PolarHBondContact O-N 2.99Å
64R42.8Very low43.5Very low236 Ų236141.4 Ų141.489%0.89180%0.795SS**  trans-67.597.4163.1-88.4-163.7-170.2-872.4108.4A62 L66A62-R64 PolarHBondContact O-N 3.28Å; R64-L66 PolarHBondContact O-N 2.92Å
65Q42.4Very low43.5Very low168 Ų168140.9 Ų140.979%0.78579%0.794SS**  trans-77.5113.1160.8-163155.1-4800107.8P63 Q67P63-Q65 PolarHBondContact O-N 2.99Å; Q65-Q67 PolarHBondContact O-N 2.79Å
66L43Very low43.3Very low162 Ų162142.2 Ų142.285%0.84879%0.793SS**  trans-68.3105.8174.8-70.6164000108.8R64R64-L66 PolarHBondContact O-N 2.92Å
67Q47.8Very low42.9Very low161 Ų161145.6 Ų145.675%0.75279%0.793SS**PPolyproline II helixtrans-103.4128.4161-79.9179.9-100.700109.1Q65 V69Q65-Q67 PolarHBondContact O-N 2.79Å; Q67-V69 PolarHBondContact O-N 2.83Å
68P44.5Very low43.2Very low127 Ų127140.6 Ų140.683%0.82578%0.783SS**PPolyproline II helixtrans-72.9121.9173.7-8.824.4000109.9
69V38.1Very low43Very low134 Ų134142.1 Ų142.181%0.81279%0.786SS**PPolyproline II helixtrans-87.8127.6170.2179.10000108.4Q67Q67-V69 PolarHBondContact O-N 2.83Å
70P44.1Very low43Very low106 Ų106138.6 Ų138.669%0.68878%0.779SS**PPolyproline II helixtrans-68.7138.9176.3-12.727.1000111.3T72P70-T72 PolarHBondContact O-N 3.01Å; P70-T72 PolarHBondContact O-OG1 3.08Å
71A42.1Very low43.5Very low109 Ų109145.6 Ų145.690%0.90179%0.789SS**PPolyproline II helixtrans-55.7123.1172.700000110.4
72T39.5Very low43.5Very low136 Ų136144.2 Ų144.283%0.83479%0.785SS**  trans-123.9130.6169.1-420000108.4P70P70-T72 PolarHBondContact O-N 3.01Å; P70-T72 PolarHBondContact O-OG1 3.08Å
73Q46.4Very low44Very low181 Ų181148.9 Ų148.985%0.84679%0.793SS**  trans-64.1146.9-161.7-67.4160.8-70.800114
74E47.1Very low43.9Very low159 Ų159147.4 Ų147.474%0.74379%0.792SS**  trans-59.3139.4164.1-173178.5122.100111.5
75P46.1Very low43.8Very low124 Ų124140.9 Ų140.981%0.80578%0.778SS**  trans-110.2131.8148.8162.3000110.7
76D42.8Very low43.7Very low123 Ų123139 Ų13966%0.65878%0.778SS**  trans-81.5138.9-173.1-131.8-27000112.2
77I41.2Very low43.4Very low142 Ų142137 Ų13773%0.72877%0.773SS**  trans65.9135.9156.2-14.3-172.7000118
78I43.2Very low42.8Very low138 Ų138136.3 Ų136.371%0.70877%0.773SS**  cis-169.4135.348.9-68.8179.3000113.2
79L39.8Very low42.6Very low156 Ų156136 Ų13682%0.81777%0.771SS**  trans66.8158.4156.8-9484.1000122.8
80P44.1Very low43.1Very low108 Ų108135.2 Ų135.270%0.70177%0.767SS**  cis-128.9164.61037.7-18.6000117.7
81R51.2Low43.7Very low247 Ų247135.2 Ų135.293%0.93275%0.753SS**  trans-71.1118.1169.9-176-177.2-170164.52.6111
82S45.1Very low44.2Very low105 Ų105137.3 Ų137.373%0.73474%0.744SS**  trans-173.2127.6150.146.50000111.8A84S82-A84 PolarHBondContact O-N 3.49Å
83Q50.8Low44.7Very low180 Ų180133.9 Ų133.984%0.84173%0.725SS**  trans-37.7119.3168.1-90.9146.4-116.300112.9T85Q83-T85 VanDerWaalsContact C-N 3.26Å; Q83-T85 PolarHBondContact O-N 2.7Å
84A39.4Very low45.1Very low94 Ų94133.1 Ų133.178%0.77772%0.718SS**  trans-80.586.4150.300000107S82 V86S82-A84 PolarHBondContact O-N 3.49Å; A84-V86 PolarHBondContact O-N 3.07Å
85T41.2Very low45.3Very low98 Ų98133 Ų13360%0.60173%0.729SS**  trans-56111.1159-64.50000106.2Q83 T87Q83-T85 VanDerWaalsContact C-N 3.26Å; Q83-T85 PolarHBondContact O-N 2.7Å; T85-T87 VanDerWaalsContact C-N 3.26Å; T85-T87 PolarHBondContact O-N 3.29Å; T85-T87 PolarHBondContact O-OG1 2.82Å
86V39.3Very low45.4Very low128 Ų128131.1 Ų131.178%0.77673%0.732SS**  trans-67.194170.4177.90000106.4A84 L88A84-V86 PolarHBondContact O-N 3.07Å; V86-L88 PolarHBondContact O-N 3.28Å
87T38.5Very low45.3Very low122 Ų122127.5 Ų127.575%0.74871%0.711SS**  trans-70.9100175.5-30.10000107.2T85T85-T87 VanDerWaalsContact C-N 3.26Å; T85-T87 PolarHBondContact O-N 3.29Å; T85-T87 PolarHBondContact O-OG1 2.82Å
88L33.9Very low45.2Very low145 Ų145128.5 Ų128.576%0.75971%0.71SS**  trans-49.9135.9168.2-80.3151.8000108.9V86 T90V86-L88 PolarHBondContact O-N 3.28Å; L88-T90 PolarHBondContact O-N 2.79Å
89P40Very low45.2Very low121 Ų121124.9 Ų124.979%0.78669%0.694SS**  trans-58.4127.3-179.822.9-31.7000109.4W91P89-W91 PolarHBondContact O-N 3.44Å
90T49.3Very low45.3Very low117 Ų117122.5 Ų122.572%0.71869%0.686SS**  trans-61.3111175.541.10000109.4L88 Q92L88-T90 PolarHBondContact O-N 2.79Å; T90-Q92 PolarHBondContact O-N 3.39Å
91W56.2Low45.2Very low107 Ų107123.6 Ų123.641%0.40568%0.681SS.*  trans-55.1133.4176177.893.9000111.5P89 P93 V99 K140P89-W91 PolarHBondContact O-N 3.44Å; W91-P93 HydrophobicContact CH2-CB 3.81Å; W91-P93 HydrophobicContact CZ2-CB 4.48Å; W91-P93 HydrophobicContact CZ3-CB 4.18Å; W91-V99 HydrophobicContact CH2-CG2 4.05Å; W91-V99 HydrophobicContact CZ3-CG2 4.06Å; W91-K140 HydrophobicContact CE3-CD 3.76Å; W91-K140 HydrophobicContact CZ3-CB 4.32Å; W91-K140 HydrophobicContact CZ3-CD 3.92Å; W91-K140 PolarHBondContact O-NZ 2.02Å
92Q52.6Low44.7Very low152 Ų152117.9 Ų117.971%0.7167%0.667SS**  trans-119.8143.3174-62.6-164.53.600110.6T90T90-Q92 PolarHBondContact O-N 3.39Å
93P50.2Low44.3Very low65 Ų65121 Ų12142%0.42267%0.667SS.*  trans-67.2143.3177.127.7-33.8000111.9W91 Q97 V99W91-P93 HydrophobicContact CH2-CB 3.81Å; W91-P93 HydrophobicContact CZ2-CB 4.48Å; W91-P93 HydrophobicContact CZ3-CB 4.18Å; P93-Q97 HydrophobicContact CB-CB 4.16Å; P93-V99 HydrophobicContact CB-CG2 3.47Å; P93-V99 VanDerWaalsContact CB-CG2 3.47Å; P93-V99 HydrophobicContact CG-CG2 3.65Å
94K56.1Low44Very low164 Ų164119.5 Ų119.571%0.71365%0.654SS**  trans-72.7154172.7-62.7-179.5-179.8179.90110.5G96 Q97K94-G96 PolarHBondContact O-N 3.49Å; K94-G96 VanDerWaalsContact O-N 3.08Å; K94-Q97 HydrophobicContact CB-CG 4.31Å; K94-Q97 WeakPolarHBondContact O-CB 3.18Å; K94-Q97 PolarHBondContact O-N 3.42Å
95T49.4Very low44Very low158 Ų158120.8 Ų120.897%0.96965%0.648SS**THydrogen-bonded Turntrans-52.6115.8176.1-46.40000110.5
96G49.9Very low44.1Very low84 Ų84125.5 Ų125.587%0.86666%0.663SS**THydrogen-bonded Turntrans101-7.8-176.300000115.8K94K94-G96 PolarHBondContact O-N 3.49Å; K94-G96 VanDerWaalsContact O-N 3.08Å
97Q39.1Very low44.1Very low47 Ų47123.8 Ų123.822%0.2265%0.653CS.*PPolyproline II helixtrans-85.2119173.3-72.9-173.1-43.400111.5P93 K94 V99 S138P93-Q97 HydrophobicContact CB-CB 4.16Å; K94-Q97 HydrophobicContact CB-CG 4.31Å; K94-Q97 WeakPolarHBondContact O-CB 3.18Å; K94-Q97 PolarHBondContact O-N 3.42Å; Q97-V99 PolarHBondContact O-N 3.3Å; Q97-S138 PolarHBondContact NE2-OG 3.03Å
98K41Very low43.9Very low163 Ų163126.2 Ų126.271%0.70966%0.655SS**PPolyproline II helixtrans-80.3116.1173.2-170.1179.7179.9-175.10109.6
99V42.5Very low44.1Very low62 Ų62126.1 Ų126.138%0.37666%0.661SS.*PPolyproline II helixtrans-90.1125.2172.6-176.50000108.4W91 P93 Q97W91-V99 HydrophobicContact CH2-CG2 4.05Å; W91-V99 HydrophobicContact CZ3-CG2 4.06Å; P93-V99 HydrophobicContact CB-CG2 3.47Å; P93-V99 VanDerWaalsContact CB-CG2 3.47Å; P93-V99 HydrophobicContact CG-CG2 3.65Å; Q97-V99 PolarHBondContact O-N 3.3Å
100V42.4Very low43.8Very low105 Ų105126 Ų12664%0.63666%0.657SS**  trans-106.5117.4173.1-1790000107.5
101E41.2Very low43.2Very low131 Ų131125.3 Ų125.361%0.61266%0.655SS**PPolyproline II helixtrans-91.5119.6175.8-171.8164.6-13800108.7R142E101-R142 IonicContact OE1-NH1 3.72Å
102M40.9Very low42.3Very low128 Ų128126.9 Ų126.963%0.63167%0.671SS**PPolyproline II helixtrans-95.9117.6179.8-169.5171.2-174.200109.4V129M102-V129 HydrophobicContact CE-CG1 4.26Å
103K36.2Very low41.8Very low169 Ų169124.6 Ų124.674%0.73567%0.667SS**PPolyproline II helixtrans-85.3121.1168.1-69.4-173.3176-174.70108.5D105K103-D105 PolarHBondContact O-N 3.36Å
104W44.7Very low41.5Very low150 Ų150124.1 Ų124.157%0.56867%0.669SS**  trans-90.481.4174.8-167.1-80.7000109R127 V129W104-R127 VanDerWaalsContact CZ2-CD 3.49Å; W104-V129 HydrophobicContact CH2-CG2 3.56Å; W104-V129 HydrophobicContact CZ3-CG2 3.73Å
105D39.4Very low41.1Very low121 Ų121118 Ų11865%0.64765%0.647SS**  trans-79.1129.3167.3-69.4-48.2000108.3K103 V107K103-D105 PolarHBondContact O-N 3.36Å; D105-V107 PolarHBondContact O-N 2.98Å
106Q42.4Very low40.7Very low196 Ų196112 Ų11292%0.91662%0.616SS**  trans-61.196.8-176.8-174.3174.657.900109.8
107V39.9Very low40.1Very low92 Ų92112 Ų11256%0.55860%0.596SS**  trans-119112.2176.6-179.90000109.3D105 R127D105-V107 PolarHBondContact O-N 2.98Å; V107-R127 PolarHBondContact O-NH2 2.03Å
108E35Very low40Very low173 Ų173115 Ų11581%0.80863%0.629SS**  trans25.8113.9163.4-101.8173.3156.500118V110E108-V110 PolarHBondContact O-N 2.74Å
109V36.9Very low40.1Very low143 Ų143111.9 Ų111.987%0.86763%0.628SS**  trans-77.7107.9170.5-179.50000108.2
110V35.2Very low40.1Very low119 Ų119111.9 Ų111.972%0.72163%0.631SS**  trans-88.8125.4166.6-169.80000107.5E108 D112E108-V110 PolarHBondContact O-N 2.74Å; V110-D112 VanDerWaalsContact C-N 3.35Å; V110-D112 PolarHBondContact O-N 2.76Å; V110-D112 VanDerWaalsContact O-N 3.14Å
111P36.2Very low40.1Very low103 Ų103115.1 Ų115.167%0.66964%0.644SS**SBendtrans-84.818.8-155.833.8-37.1000116.7
112D37.1Very low40.1Very low140 Ų140115.5 Ų115.575%0.74965%0.651SS**  trans-112.920.7-164.6-69.6-34.7000116.7V110V110-D112 VanDerWaalsContact C-N 3.35Å; V110-D112 PolarHBondContact O-N 2.76Å; V110-D112 VanDerWaalsContact O-N 3.14Å
113V42.3Very low40.3Very low103 Ų103113.7 Ų113.762%0.62465%0.651SS**  trans-133.670.2169.3-156.80000110.9L128V113-L128 HydrophobicContact CG1-CD1 3.62Å
114A44.2Very low40.7Very low55 Ų55109 Ų10946%0.45564%0.643SS.*  trans-86.2115.9174.300000110.8G116A114-G116 PolarHBondContact O-N 2.91Å
115C46.3Very low40.4Very low36 Ų36105 Ų10524%0.24365%0.648CS.*  trans-87.784.4157172.90000107.6C163C115-C163 HydrophobicContact CB-CB 4.08Å; C115-C163 VanDerWaalsContact SG-CA 3.55Å; C115-C163 WeakPolarHBondContact SG-CB 3.39Å
116G41.5Very low40.6Very low31 Ų31101.4 Ų101.432%0.3264%0.64SS.*  trans-127.7141.4-18000000111.1A114 A118A114-G116 PolarHBondContact O-N 2.91Å; G116-A118 PolarHBondContact O-N 3.33Å
117N37.3Very low40.6Very low85 Ų8598.9 Ų98.946%0.45562%0.622SS.*  trans-62.5113.8170.6178.65.9000109.3S119 S120N117-S119 PolarHBondContact ND2-OG 3.5Å; N117-S119 PolarHBondContact O-N 2.94Å; N117-S119 PolarHBondContact OD1-N 3.27Å; N117-S119 VanDerWaalsContact OD1-N 3.14Å; N117-S119 PolarHBondContact OD1-OG 3.05Å; N117-S120 PolarHBondContact O-N 2.87Å
118A38.2Very low40.8Very low111 Ų11199.2 Ų99.292%0.91762%0.62SS**THydrogen-bonded Turntrans-60.4-10.3179.700000114.2G116G116-A118 PolarHBondContact O-N 3.33Å
119S42.7Very low41.2Very low97 Ų9793.8 Ų93.868%0.67860%0.599SS**THydrogen-bonded Turntrans-90.4-8.617665.80000114.6N117N117-S119 PolarHBondContact ND2-OG 3.5Å; N117-S119 PolarHBondContact O-N 2.94Å; N117-S119 PolarHBondContact OD1-N 3.27Å; N117-S119 VanDerWaalsContact OD1-N 3.14Å; N117-S119 PolarHBondContact OD1-OG 3.05Å
120S41.3Very low41.5Very low62 Ų6292.5 Ų92.543%0.43460%0.596SS.*SBendtrans-113122.8176.1-62.40000108.8N117 N122N117-S120 PolarHBondContact O-N 2.87Å; S120-N122 PolarHBondContact O-N 2.87Å
121N43.5Very low42Very low172 Ų17292.4 Ų92.492%0.9259%0.586SS**SBendtrans-63.89.3179.8-138.815.9000114.2
122N41.6Very low42.1Very low140 Ų14096.9 Ų96.975%0.74960%0.598SS**  trans-115.391.1176.3-70.3-3.4000108.1S120 A124S120-N122 PolarHBondContact O-N 2.87Å; N122-A124 PolarHBondContact O-N 3.4Å
123S43.4Very low42.6Very low90 Ų9093.3 Ų93.363%0.62958%0.581SS**  trans-63.2102.5165.2-62.40000108.1G125S123-G125 PolarHBondContact O-N 2.79Å
124A44.5Very low42.6Very low71 Ų7192.6 Ų92.659%0.58758%0.579SS**  trans-68.990.5164.500000107.1N122 G126N122-A124 PolarHBondContact O-N 3.4Å; A124-G126 PolarHBondContact O-N 2.84Å
125G40.2Very low42.6Very low65 Ų6598.7 Ų98.767%0.6760%0.598SS**  trans-65.698.2176.400000109.9S123S123-G125 PolarHBondContact O-N 2.79Å
126G42.6Very low42.5Very low46 Ų46104.2 Ų104.247%0.47463%0.625SS.*PPolyproline II helixtrans-80.8135.616900000110.6A124A124-G126 PolarHBondContact O-N 2.84Å
127R43Very low42.5Very low143 Ų143104.8 Ų104.854%0.5462%0.622SS.*PPolyproline II helixtrans-83.6119.1170.7-167.4-178.1-168.5168.914.2109W104 V107 V129W104-R127 VanDerWaalsContact CZ2-CD 3.49Å; V107-R127 PolarHBondContact O-NH2 2.03Å; R127-V129 HydrophobicContact CG-CG2 4.14Å; R127-V129 PolarHBondContact O-N 3.47Å
128L43.9Very low42.5Very low99 Ų99102.8 Ų102.852%0.51862%0.615SS.*PPolyproline II helixtrans-72.9123.7168.1-92.3127000109.6V113 F160V113-L128 HydrophobicContact CG1-CD1 3.62Å; L128-F160 HydrophobicContact CD2-CE1 4.43Å; L128-F160 HydrophobicContact CD2-CE2 3.31Å; L128-F160 HydrophobicContact CD2-CZ 3.26Å
129V43.8Very low43Very low58 Ų58101.3 Ų101.335%0.35259%0.594SS.*  trans-126.4106.7172.5-175.50000107.9M102 W104 R127M102-V129 HydrophobicContact CE-CG1 4.26Å; W104-V129 HydrophobicContact CH2-CG2 3.56Å; W104-V129 HydrophobicContact CZ3-CG2 3.73Å; R127-V129 HydrophobicContact CG-CG2 4.14Å; R127-V129 PolarHBondContact O-N 3.47Å
130S42.3Very low43.2Very low117 Ų117100.1 Ų100.182%0.81858%0.577SS**  trans-97.9134.3171.457.30000109.5
131F46.6Very low44Very low117 Ų117101.8 Ų101.851%0.51358%0.58SS.*  trans-135.3135.4172.454.3-86.4000109.8V133 V139F131-V133 HydrophobicContact CD2-CG2 3.31Å; F131-V133 HydrophobicContact CE2-CG2 3.35Å; F131-V139 HydrophobicContact CE2-CB 4.39Å; F131-V139 HydrophobicContact CE2-CG1 3.67Å; F131-V139 HydrophobicContact CE2-CG2 3.84Å; F131-V139 HydrophobicContact CZ-CG1 3.88Å
132E38.6Very low44.1Very low197 Ų197101.8 Ų101.892%0.92157%0.567SS**  trans-82.3122.4176.1-69.5-179.3-179.500109.4
133V46.1Very low44.7Very low64 Ų6499.3 Ų99.339%0.38855%0.551SS.*  trans-109.2119.7-178.1-177.70000108F131 T137 V139F131-V133 HydrophobicContact CD2-CG2 3.31Å; F131-V133 HydrophobicContact CE2-CG2 3.35Å; V133-T137 WeakPolarHBondContact CG1-OG1 3.38Å; V133-V139 HydrophobicContact CB-CG2 4.33Å; V133-V139 HydrophobicContact CG1-CG2 3.72Å; V133-V139 HydrophobicContact CG2-CG2 3.57Å
134P43.7Very low44.7Very low88 Ų88101.8 Ų101.857%0.57156%0.557SS**  trans-56.4150174.9-24.432.2000112.4N136 T137P134-N136 PolarHBondContact O-N 2.83Å; P134-T137 HydrophobicContact CB-CG2 3.99Å; P134-T137 WeakPolarHBondContact CD-OG1 3.24Å; P134-T137 HydrophobicContact CG-CG2 4.32Å; P134-T137 PolarHBondContact O-N 2.88Å; P134-T137 VanDerWaalsContact O-N 3.15Å; P134-T137 PolarHBondContact O-OG1 2.87Å
135Q42.7Very low44.7Very low184 Ų184102.9 Ų102.986%0.8657%0.567SS**THydrogen-bonded Turntrans-54.9137.4175.1-64-176.1-1.200110.3T137Q135-T137 VanDerWaalsContact C-N 3.33Å; Q135-T137 PolarHBondContact O-N 3.47Å
136N44.4Very low45.4Very low152 Ų152107 Ų10781%0.81357%0.573SS**THydrogen-bonded Turntrans67.515.3-177.4-53.2-42.4000117P134P134-N136 PolarHBondContact O-N 2.83Å
137T42.1Very low45.7Very low42 Ų42109 Ų10926%0.25858%0.58SS.*PPolyproline II helixtrans-95.8139.4172.851.70000112.5V133 P134 Q135V133-T137 WeakPolarHBondContact CG1-OG1 3.38Å; P134-T137 HydrophobicContact CB-CG2 3.99Å; P134-T137 WeakPolarHBondContact CD-OG1 3.24Å; P134-T137 HydrophobicContact CG-CG2 4.32Å; P134-T137 PolarHBondContact O-N 2.88Å; P134-T137 VanDerWaalsContact O-N 3.15Å; P134-T137 PolarHBondContact O-OG1 2.87Å; Q135-T137 VanDerWaalsContact C-N 3.33Å; Q135-T137 PolarHBondContact O-N 3.47Å
138S38.3Very low46.1Very low44 Ų44110.1 Ų110.131%0.30860%0.596SS.*PPolyproline II helixtrans-96.1128.3177.3-690000110.1Q97Q97-S138 PolarHBondContact NE2-OG 3.03Å
139V46.9Very low46.3Very low79 Ų79112.8 Ų112.848%0.47961%0.61SS.*PPolyproline II helixtrans-92.3125.2179.3-174.90000108.4F131 V133 I141F131-V139 HydrophobicContact CE2-CB 4.39Å; F131-V139 HydrophobicContact CE2-CG1 3.67Å; F131-V139 HydrophobicContact CE2-CG2 3.84Å; F131-V139 HydrophobicContact CZ-CG1 3.88Å; V133-V139 HydrophobicContact CB-CG2 4.33Å; V133-V139 HydrophobicContact CG1-CG2 3.72Å; V133-V139 HydrophobicContact CG2-CG2 3.57Å; V139-I141 HydrophobicContact CG1-CG1 4.17Å
140K46.7Very low46.6Very low73 Ų73114.5 Ų114.532%0.31762%0.616SS.*  trans-117112.2174.8-173.2179.4-172.9171.50109.1W91 R142W91-K140 HydrophobicContact CE3-CD 3.76Å; W91-K140 HydrophobicContact CZ3-CB 4.32Å; W91-K140 HydrophobicContact CZ3-CD 3.92Å; W91-K140 PolarHBondContact O-NZ 2.02Å; K140-R142 HydrophobicContact CG-CG 4.33Å
141I59.3Low46.9Very low97 Ų97114.7 Ų114.750%0.49761%0.607SS.*  trans-94.9126.1175.5-59.6169.4000107V139 L152V139-I141 HydrophobicContact CG1-CG1 4.17Å; I141-L152 HydrophobicContact CD1-CD2 3.57Å
142R46.4Very low47Very low171 Ų171114.8 Ų114.865%0.64561%0.612SS**  trans-114.4138.3175.6-57.3-172.496.8-176.63.5108.7E101 K140E101-R142 IonicContact OE1-NH1 3.72Å; K140-R142 HydrophobicContact CG-CG 4.33Å
143Q52.4Low47.3Very low89 Ų89114.2 Ų114.242%0.41660%0.602SS.*  trans-111.3133.5174.7-179177.77.200108.5S147 L148 I150Q143-S147 PolarHBondContact NE2-O 2.99Å; Q143-L148 PolarHBondContact NE2-O 2.86Å; Q143-I150 HydrophobicContact CB-CD1 4.2Å; Q143-I150 HydrophobicContact CG-CD1 4.09Å; Q143-I150 HydrophobicContact CG-CG1 4.31Å
144D44.5Very low47Very low141 Ų141121.5 Ų121.575%0.75463%0.628SS**  trans-82.9135.6170.7-154.2-18.5000109.2N146D144-N146 PolarHBondContact O-N 3.25Å
145A44.9Very low47Very low95 Ų95120.5 Ų120.579%0.78562%0.62SS**THydrogen-bonded Turntrans-70.75.1-158.900000115.2
146N54.9Low47.1Very low150 Ų150116.2 Ų116.280%0.80261%0.607SS**THydrogen-bonded Turntrans-100.90.5-173-7223000114.4D144D144-N146 PolarHBondContact O-N 3.25Å
147S48.6Very low47.1Very low89 Ų89113 Ų11362%0.62260%0.602SS**SBendtrans-149.7109-178.6-69.40000112.3Q143Q143-S147 PolarHBondContact NE2-O 2.99Å
148L51.5Low47.2Very low167 Ų167115.8 Ų115.887%0.87462%0.618SS**  trans32.2117.2157.5-67.2163.3000117.8Q143 I150Q143-L148 PolarHBondContact NE2-O 2.86Å; L148-I150 PolarHBondContact O-N 2.84Å
149L48.1Very low47.7Very low154 Ų154114.7 Ų114.781%0.80661%0.614SS**  trans-28.2114173.1-66.3163000113.5L151L149-L151 PolarHBondContact O-N 2.79Å
150I50.2Low47.7Very low95 Ų95116 Ų11649%0.48761%0.614SS.*  trans-78.8108.9170.1-55.9175.4000107.3Q143 L148 L152Q143-I150 HydrophobicContact CB-CD1 4.2Å; Q143-I150 HydrophobicContact CG-CD1 4.09Å; Q143-I150 HydrophobicContact CG-CG1 4.31Å; L148-I150 PolarHBondContact O-N 2.84Å; I150-L152 HydrophobicContact CB-CD1 4.3Å; I150-L152 HydrophobicContact CG2-CD1 3.6Å; I150-L152 HydrophobicContact CG2-CG 4.47Å; I150-L152 PolarHBondContact O-N 3.44Å
151L48.2Very low47.5Very low120 Ų120120 Ų12063%0.62863%0.633SS**  trans-83.7109.8171.8-66.1168.7000108.7L149 W153L149-L151 PolarHBondContact O-N 2.79Å; L151-W153 HydrophobicContact CB-CZ2 4.1Å; L151-W153 HydrophobicContact CD1-CZ2 3.97Å; L151-W153 HydrophobicContact CG-CZ2 4.5Å
152L47.8Very low46.8Very low119 Ų119121.9 Ų121.962%0.62364%0.64SS**  trans-91.3126.6170.9-78.790.4000109.7I141 I150I141-L152 HydrophobicContact CD1-CD2 3.57Å; I150-L152 HydrophobicContact CB-CD1 4.3Å; I150-L152 HydrophobicContact CG2-CD1 3.6Å; I150-L152 HydrophobicContact CG2-CG 4.47Å; I150-L152 PolarHBondContact O-N 3.44Å
153W45.3Very low46.6Very low185 Ų185117.1 Ų117.170%0.70163%0.632SS**  trans-112.4130.7177.4-51.689.5000109.1L151 V155L151-W153 HydrophobicContact CB-CZ2 4.1Å; L151-W153 HydrophobicContact CD1-CZ2 3.97Å; L151-W153 HydrophobicContact CG-CZ2 4.5Å; W153-V155 HydrophobicContact CB-CG1 4.46Å; W153-V155 PolarHBondContact O-N 3.17Å
154K39.9Very low46.5Very low218 Ų218115.5 Ų115.595%0.94863%0.631SS**  trans-76.9112.3170.2-177.3-178177.3-177.10108
155V44.4Very low46.5Very low66 Ų66114 Ų11440%0.462%0.622SS.*  trans-108.5140.4177.3-62.90000110.2W153 F160 S164W153-V155 HydrophobicContact CB-CG1 4.46Å; W153-V155 PolarHBondContact O-N 3.17Å; V155-F160 HydrophobicContact CG2-CB 4.3Å; V155-F160 HydrophobicContact CG2-CD2 4.4Å; V155-S164 WeakPolarHBondContact CG1-OG 3.06Å
156T43.4Very low46Very low95 Ų95116.1 Ų116.158%0.58362%0.619SS**  trans-74.7160.5170.759.70000109.8T158 G159 F160T156-T158 PolarHBondContact O-N 2.98Å; T156-G159 PolarHBondContact O-N 3.26Å; T156-G159 PolarHBondContact OG1-N 3.38Å; T156-G159 VanDerWaalsContact OG1-N 3.13Å; T156-F160 PolarHBondContact O-N 3.11Å
157A44.6Very low45.2Very low85 Ų85116.6 Ų116.670%0.70262%0.621SS**Hα-helixtrans-55.6-37.8177.400000112.1Q161A157-Q161 WeakPolarHBondContact O-CG 3Å; A157-Q161 PolarHBondContact O-N 2.97Å
158T45.9Very low44.8Very low99 Ų99115.4 Ų115.461%0.60762%0.623SS**Hα-helixtrans-68.5-42.3174.7-15.90000112.2T156 F160 Q161 Q162T156-T158 PolarHBondContact O-N 2.98Å; T158-F160 VanDerWaalsContact C-N 3.29Å; T158-F160 PolarHBondContact O-N 3.17Å; T158-Q161 PolarHBondContact O-N 3.11Å; T158-Q162 PolarHBondContact O-N 3.21Å
159G47.8Very low44Very low21 Ų21118.1 Ų118.122%0.21662%0.622CS.*Hα-helixtrans-67.8-26.3177.100000113.9T156 S164T156-G159 PolarHBondContact O-N 3.26Å; T156-G159 PolarHBondContact OG1-N 3.38Å; T156-G159 VanDerWaalsContact OG1-N 3.13Å; G159-S164 PolarHBondContact O-OG 3.02Å
160F47.6Very low43.2Very low107 Ų107115.8 Ų115.847%0.46962%0.618SS.*Hα-helixtrans-70.7-41.4171.9-178.6-97.9000112L128 V155 T156 T158 Q162L128-F160 HydrophobicContact CD2-CE1 4.43Å; L128-F160 HydrophobicContact CD2-CE2 3.31Å; L128-F160 HydrophobicContact CD2-CZ 3.26Å; V155-F160 HydrophobicContact CG2-CB 4.3Å; V155-F160 HydrophobicContact CG2-CD2 4.4Å; T156-F160 PolarHBondContact O-N 3.11Å; T158-F160 VanDerWaalsContact C-N 3.29Å; T158-F160 PolarHBondContact O-N 3.17Å; F160-Q162 PolarHBondContact O-N 3.48Å
161Q42.6Very low42Very low157 Ų157117.9 Ų117.973%0.73464%0.635SS**Hα-helixtrans-69.8-18.8178.9-68-68.3-46.900113.5A157 T158A157-Q161 WeakPolarHBondContact O-CG 3Å; A157-Q161 PolarHBondContact O-N 2.97Å; T158-Q161 PolarHBondContact O-N 3.11Å
162Q44Very low41.1Very low137 Ų137117.2 Ų117.264%0.6464%0.637SS**THydrogen-bonded Turntrans-99.66.1-175.6-76-177.1-15.400115.3T158 F160T158-Q162 PolarHBondContact O-N 3.21Å; F160-Q162 PolarHBondContact O-N 3.48Å
163C43.1Very low40.1Very low71 Ų71117.4 Ų117.448%0.4865%0.645SS.*  trans60.696.5-170.7-830000111.6C115 L165C115-C163 HydrophobicContact CB-CB 4.08Å; C115-C163 VanDerWaalsContact SG-CA 3.55Å; C115-C163 WeakPolarHBondContact SG-CB 3.39Å; C163-L165 PolarHBondContact O-N 2.93Å
164S49.1Very low39.3Very low54 Ų54116.9 Ų116.938%0.37866%0.655SS.*SBendtrans-66.292.4-171.7-590000113.7V155 G159V155-S164 WeakPolarHBondContact CG1-OG 3.06Å; G159-S164 PolarHBondContact O-OG 3.02Å
165L44Very low39Very low110 Ų110119.2 Ų119.258%0.57667%0.669SS**  trans-145.623.6159.1-100.1172.8000112.7C163C163-L165 PolarHBondContact O-N 2.93Å
166I34.4Very low38.8Very low139 Ų139121.9 Ų121.971%0.71368%0.683SS**SBendtrans-100.4-13.1-176.2-49.6-178.1000113.3
167D39.7Very low38.5Very low160 Ų160123.3 Ų123.386%0.85669%0.688SS**  trans-114.738.7171.3-79.4-41.7000113.4R169D167-R169 PolarHBondContact O-N 2.04Å
168G40.3Very low38.2Very low65 Ų65125.4 Ų125.467%0.6769%0.687SS**  trans-67.556.9169.700000113.6S170G168-S170 PolarHBondContact O-N 3.15Å
169R33.3Very low37.7Very low223 Ų223126.9 Ų126.984%0.84269%0.692SS**  trans-80.5105.6163.9-89.1-167.5-175.1-172.53.9109.1D167 V171D167-R169 PolarHBondContact O-N 2.04Å; R169-V171 PolarHBondContact O-N 2.94Å; R169-V171 VanDerWaalsContact O-N 3.13Å
170S31.3Very low37.1Very low105 Ų105133.6 Ų133.673%0.73472%0.721SS**  trans-56.6111.2159.253.10000109G168 T172G168-S170 PolarHBondContact O-N 3.15Å; S170-T172 PolarHBondContact O-N 3.16Å
171V26.1Very low36.4Very low139 Ų139135.3 Ų135.384%0.84274%0.738SS**  trans-76.9104164.8-172.80000106.2R169R169-V171 PolarHBondContact O-N 2.94Å; R169-V171 VanDerWaalsContact O-N 3.13Å
172T28.7Very low35.9Very low107 Ų107133.8 Ų133.866%0.65674%0.739SS**PPolyproline II helixtrans-61.3135.617133.60000109.7S170 L174S170-T172 PolarHBondContact O-N 3.16Å; T172-L174 PolarHBondContact O-N 3.49Å
173P27.1Very low35.3Very low123 Ų123133.5 Ų133.580%0.79975%0.746SS**PPolyproline II helixtrans-66.8119.8168.528-30000108Q175P173-Q175 PolarHBondContact O-N 3.46Å
174L28.5Very low34.7Very low174 Ų174138.8 Ų138.891%0.91177%0.768SS**PPolyproline II helixtrans-61123.6166.6-76.3157000107.8T172T172-L174 PolarHBondContact O-N 3.49Å
175Q33.7Very low33.4Very low266 Ų266146.5 Ų146.5100%1.24380%0.804SS**  trans-77.50163.9-80.5-176.2-68.800110.4P173P173-Q175 PolarHBondContact O-N 3.46Å

Retrieved 175 of 175 residues in 177.9 ms (Link to these results)