A0A096LVN9_POEFO Loading...

Ring finger protein 130

AlphaFold DB , UniProt , Accession A0A096LVN9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 168 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M41.9Very low49.3Very low246 Ų246134.5 Ų134.5100%1.21269%0.688SS**  097.20-139.6164.4-17700106.2
2L43.2Very low49.6Very low153 Ų153129.8 Ų129.880%0.80167%0.67SS**  trans18.3105.4178.1-50.4-179.2000119.8L4L2-L4 HydrophobicContact CB-CD1 4.24Å; L2-L4 HydrophobicContact CD2-CD1 4.06Å
3H49.9Very low50Low205 Ų205124.8 Ų124.895%0.94965%0.654SS**  trans-101.575.6165.1-150.3-125.9000107.1
4L48.9Very low50.5Low126 Ų126121.7 Ų121.766%0.6664%0.643SS**  trans-135.2123.7178.5-88.589000106.2L2L2-L4 HydrophobicContact CB-CD1 4.24Å; L2-L4 HydrophobicContact CD2-CD1 4.06Å
5D50.6Low50.7Low81 Ų81119.8 Ų119.843%0.43363%0.632SS.*  cis-160.2105.43.7-83.8-75000107.3T7 L8D5-T7 PolarHBondContact O-N 2.85Å; D5-L8 HydrophobicContact CB-CB 4.01Å; D5-L8 HydrophobicContact CB-CD1 3.72Å; D5-L8 HydrophobicContact CB-CG 4.45Å; D5-L8 PolarHBondContact O-N 3.5Å
6W48.9Very low51.1Low230 Ų230119.3 Ų119.387%0.87163%0.626SS**Hα-helixtrans-63.9-23174.8171.6-92.3000112.6T9W6-T9 PolarHBondContact O-OG1 2.91Å
7T52.1Low51.6Low87 Ų87123.5 Ų123.553%0.53463%0.631SS.*Hα-helixtrans-74.1-25178.153.10000113.1D5 S10 V11D5-T7 PolarHBondContact O-N 2.85Å; T7-S10 PolarHBondContact O-N 2.8Å; T7-S10 VanDerWaalsContact O-N 3.17Å; T7-V11 PolarHBondContact O-N 3.2Å
8L50.7Low52Low103 Ų103127.1 Ų127.154%0.53964%0.635SS.*Hα-helixtrans-64.7-42.9176.4-115.889.5000111.1D5 S10 V11 V12D5-L8 HydrophobicContact CB-CB 4.01Å; D5-L8 HydrophobicContact CB-CD1 3.72Å; D5-L8 HydrophobicContact CB-CG 4.45Å; D5-L8 PolarHBondContact O-N 3.5Å; L8-S10 VanDerWaalsContact C-N 3.25Å; L8-S10 PolarHBondContact O-N 3.02Å; L8-V11 WeakPolarHBondContact O-CG2 3.16Å; L8-V11 PolarHBondContact O-N 3.02Å; L8-V12 VanDerWaalsContact O-CB 3.24Å; L8-V12 WeakPolarHBondContact O-CB 3.27Å; L8-V12 WeakPolarHBondContact O-CG2 3.11Å; L8-V12 PolarHBondContact O-N 2.72Å
9T51.8Low52.5Low85 Ų85122.6 Ų122.652%0.52161%0.613SS.*Hα-helixtrans-59.2-35.8172.613.70000112.4W6 S13W6-T9 PolarHBondContact O-OG1 2.91Å; T9-S13 WeakPolarHBondContact O-CB 3.02Å; T9-S13 PolarHBondContact O-N 3.48Å; T9-S13 PolarHBondContact O-OG 3.26Å
10S51.5Low53.3Low69 Ų69117.2 Ų117.248%0.48359%0.59SS.*Hα-helixtrans-74.6-39-179.1-164.60000113T7 L8 V14T7-S10 PolarHBondContact O-N 2.8Å; T7-S10 VanDerWaalsContact O-N 3.17Å; L8-S10 VanDerWaalsContact C-N 3.25Å; L8-S10 PolarHBondContact O-N 3.02Å; S10-V14 WeakPolarHBondContact O-CG2 3.24Å; S10-V14 PolarHBondContact O-N 3.37Å; S10-V14 VanDerWaalsContact O-N 3.11Å
11V52.4Low54.3Low94 Ų94116 Ų11657%0.5759%0.585SS**Hα-helixtrans-76.7-36.3177.1-61.40000112.3T7 L8 S13 V14 L15T7-V11 PolarHBondContact O-N 3.2Å; L8-V11 WeakPolarHBondContact O-CG2 3.16Å; L8-V11 PolarHBondContact O-N 3.02Å; V11-S13 VanDerWaalsContact C-N 3.31Å; V11-V14 PolarHBondContact O-N 3.22Å; V11-L15 WeakPolarHBondContact O-CB 3.31Å; V11-L15 PolarHBondContact O-N 2.7Å
12V53.7Low55.9Low78 Ų78106.7 Ų106.747%0.47355%0.548SS..Hα-helixtrans-60.1-44.4170171.50000109.4L8 V14 L15 Q16L8-V12 VanDerWaalsContact O-CB 3.24Å; L8-V12 WeakPolarHBondContact O-CB 3.27Å; L8-V12 WeakPolarHBondContact O-CG2 3.11Å; L8-V12 PolarHBondContact O-N 2.72Å; V12-V14 PolarHBondContact O-N 2.96Å; V12-L15 PolarHBondContact O-N 3.27Å; V12-Q16 WeakPolarHBondContact O-CB 3.38Å; V12-Q16 PolarHBondContact O-N 3.04Å
13S54Low57.5Low66 Ų6699.5 Ų99.546%0.46251%0.51SS..Hα-helixtrans-63.2-40.3177.3-63.80000113.6T9 V11 R17T9-S13 WeakPolarHBondContact O-CB 3.02Å; T9-S13 PolarHBondContact O-N 3.48Å; T9-S13 PolarHBondContact O-OG 3.26Å; V11-S13 VanDerWaalsContact C-N 3.31Å; S13-R17 WeakPolarHBondContact O-CB 3.09Å; S13-R17 PolarHBondContact O-N 2.77Å
14V57.8Low59Low81 Ų8195.1 Ų95.149%0.49149%0.488SS..Hα-helixtrans-71.2-40.9178.2172.10000111.5S10 V11 V12 R17 R18S10-V14 WeakPolarHBondContact O-CG2 3.24Å; S10-V14 PolarHBondContact O-N 3.37Å; S10-V14 VanDerWaalsContact O-N 3.11Å; V11-V14 PolarHBondContact O-N 3.22Å; V12-V14 PolarHBondContact O-N 2.96Å; V14-R17 PolarHBondContact O-N 3.44Å; V14-R18 WeakPolarHBondContact O-CG 2.95Å; V14-R18 PolarHBondContact O-N 3Å
15L52.9Low60.8Low93 Ų9396.5 Ų96.549%0.48749%0.489SS..Hα-helixtrans-67.6-42.2176.3-176.560.9000111.6V11 V12 R17 R18 L19 L103V11-L15 WeakPolarHBondContact O-CB 3.31Å; V11-L15 PolarHBondContact O-N 2.7Å; V12-L15 PolarHBondContact O-N 3.27Å; L15-R17 VanDerWaalsContact C-N 3.27Å; L15-R17 PolarHBondContact O-N 3.18Å; L15-R18 PolarHBondContact O-N 3.36Å; L15-L19 WeakPolarHBondContact O-CB 3.24Å; L15-L19 PolarHBondContact O-N 2.78Å; L15-L103 HydrophobicContact CD1-CD2 3.78Å; L15-L103 HydrophobicContact CD2-CD1 4.41Å; L15-L103 HydrophobicContact CD2-CD2 4.14Å; L15-L103 HydrophobicContact CG-CD2 3.89Å
16Q56.9Low62.4Low112 Ų11292.8 Ų92.852%0.52347%0.47SS..Hα-helixtrans-61.5-35.8173.1-169.2173.50.500111.3V12 G20V12-Q16 WeakPolarHBondContact O-CB 3.38Å; V12-Q16 PolarHBondContact O-N 3.04Å; Q16-G20 PolarHBondContact O-N 3.42Å
17R60.2Low64.2Low191 Ų19182.1 Ų82.172%0.72143%0.43SS*.Hα-helixtrans-70.7-43.4175.1-167.4170.4165.5-167.5-3.6112.8S13 V14 L15 G20 D21S13-R17 WeakPolarHBondContact O-CB 3.09Å; S13-R17 PolarHBondContact O-N 2.77Å; V14-R17 PolarHBondContact O-N 3.44Å; L15-R17 VanDerWaalsContact C-N 3.27Å; L15-R17 PolarHBondContact O-N 3.18Å; R17-G20 PolarHBondContact O-N 3.35Å; R17-D21 PolarHBondContact O-N 3.28Å
18R58.7Low65.9Low188 Ų18880.5 Ų80.571%0.70943%0.43SS*.Hα-helixtrans-68.2-39.5176.7-67.9179.293.5-1717.1112.6V14 L15 G20 D21 A22V14-R18 WeakPolarHBondContact O-CG 2.95Å; V14-R18 PolarHBondContact O-N 3Å; L15-R18 PolarHBondContact O-N 3.36Å; R18-G20 VanDerWaalsContact C-N 3.32Å; R18-D21 PolarHBondContact O-N 2.88Å; R18-A22 PolarHBondContact O-N 2.78Å
19L61.7Low67.6Low41 Ų4182.9 Ų82.922%0.21544%0.436CS..Hα-helixtrans-65.7-39.5173-170.464000110.6L15 D21 A22 A23 T101 L103L15-L19 WeakPolarHBondContact O-CB 3.24Å; L15-L19 PolarHBondContact O-N 2.78Å; L19-D21 VanDerWaalsContact C-N 3.32Å; L19-D21 PolarHBondContact O-N 2.74Å; L19-A22 PolarHBondContact O-N 3.08Å; L19-A23 VanDerWaalsContact O-CB 3.26Å; L19-A23 WeakPolarHBondContact O-CB 3.49Å; L19-A23 PolarHBondContact O-N 3.43Å; L19-T101 HydrophobicContact CD1-CG2 4.07Å; L19-L103 HydrophobicContact CB-CD2 4.25Å; L19-L103 HydrophobicContact CD1-CB 4.17Å; L19-L103 HydrophobicContact CD1-CD2 4.01Å; L19-L103 HydrophobicContact CD2-CB 4.36Å; L19-L103 HydrophobicContact CD2-CD2 3.79Å; L19-L103 HydrophobicContact CD2-CG 4.13Å; L19-L103 HydrophobicContact CG-CD2 4.21Å
20G67.5Low69.4Low14 Ų1479.3 Ų79.314%0.14441%0.414CS..Hα-helixtrans-57.6-40173.800000113.2Q16 R17 R18 K24Q16-G20 PolarHBondContact O-N 3.42Å; R17-G20 PolarHBondContact O-N 3.35Å; R18-G20 VanDerWaalsContact C-N 3.32Å; G20-K24 WeakPolarHBondContact O-CB 3.45Å; G20-K24 WeakPolarHBondContact O-CD 3.22Å; G20-K24 WeakPolarHBondContact O-CG 3.32Å; G20-K24 PolarHBondContact O-N 2.84Å
21D75.3Confident71.5Confident93 Ų9380.4 Ų80.450%0.49742%0.418SS..Hα-helixtrans-71.9-39.8179.8-67.2-28000112.8R17 R18 L19 K25R17-D21 PolarHBondContact O-N 3.28Å; R18-D21 PolarHBondContact O-N 2.88Å; L19-D21 VanDerWaalsContact C-N 3.32Å; L19-D21 PolarHBondContact O-N 2.74Å; D21-K25 WeakPolarHBondContact O-CB 3.28Å; D21-K25 PolarHBondContact O-N 3.07Å
22A75.4Confident73.5Confident51 Ų5178.8 Ų78.842%0.42141%0.408SS..Hα-helixtrans-66.3-43.2174.500000111.6R18 L19 K25 A26R18-A22 PolarHBondContact O-N 2.78Å; L19-A22 PolarHBondContact O-N 3.08Å; A22-K25 PolarHBondContact O-N 3.3Å; A22-A26 WeakPolarHBondContact O-CB 3.37Å; A22-A26 PolarHBondContact O-N 3.09Å
23A76.6Confident75.4Confident2 Ų279.4 Ų79.42%0.01740%0.402CS..Hα-helixtrans-62.6-48.3174.900000111.3L19 K25 A26 I27L19-A23 VanDerWaalsContact O-CB 3.26Å; L19-A23 WeakPolarHBondContact O-CB 3.49Å; L19-A23 PolarHBondContact O-N 3.43Å; A23-K25 VanDerWaalsContact C-N 3.3Å; A23-K25 PolarHBondContact O-N 3.41Å; A23-A26 CarbonylContact O-C 3.55Å; A23-A26 WeakPolarHBondContact O-CB 3.41Å; A23-A26 PolarHBondContact O-N 3.46Å; A23-I27 HydrophobicContact CB-CD1 4.42Å; A23-I27 WeakPolarHBondContact O-CB 3.4Å; A23-I27 WeakPolarHBondContact O-CD1 3.18Å; A23-I27 WeakPolarHBondContact O-CG1 3.36Å; A23-I27 PolarHBondContact O-N 3.11Å
24K82.4Confident77.3Confident112 Ų11279.4 Ų79.449%0.48740%0.399SS..Hα-helixtrans-54.2-45.3174.6-79.7168.1-171.8176.60112.1G20 A26 I27 G28 N81G20-K24 WeakPolarHBondContact O-CB 3.45Å; G20-K24 WeakPolarHBondContact O-CD 3.22Å; G20-K24 WeakPolarHBondContact O-CG 3.32Å; G20-K24 PolarHBondContact O-N 2.84Å; K24-A26 VanDerWaalsContact C-N 3.35Å; K24-I27 PolarHBondContact O-N 3Å; K24-G28 PolarHBondContact O-N 3.38Å; K24-N81 WeakPolarHBondContact CG-OD1 3.4Å
25K85.2Confident79Confident155 Ų15575.5 Ų75.567%0.67438%0.376SS*.Hα-helixtrans-64.7-39.2177.6-172.4173.8-176.6177.20111.9D21 A22 A23D21-K25 WeakPolarHBondContact O-CB 3.28Å; D21-K25 PolarHBondContact O-N 3.07Å; A22-K25 PolarHBondContact O-N 3.3Å; A23-K25 VanDerWaalsContact C-N 3.3Å; A23-K25 PolarHBondContact O-N 3.41Å
26A84.9Confident80.7Confident4 Ų477.9 Ų77.93%0.03338%0.382CS..Hα-helixtrans-66.7-47.5175.800000111.9A22 A23 K24 G28 K29 L94 L97 I99A22-A26 WeakPolarHBondContact O-CB 3.37Å; A22-A26 PolarHBondContact O-N 3.09Å; A23-A26 CarbonylContact O-C 3.55Å; A23-A26 WeakPolarHBondContact O-CB 3.41Å; A23-A26 PolarHBondContact O-N 3.46Å; K24-A26 VanDerWaalsContact C-N 3.35Å; A26-G28 VanDerWaalsContact C-N 3.28Å; A26-G28 PolarHBondContact O-N 3.43Å; A26-K29 WeakPolarHBondContact O-CB 3.44Å; A26-K29 PolarHBondContact O-N 3.39Å; A26-L94 HydrophobicContact CB-CD2 3.53Å; A26-L97 HydrophobicContact CB-CD1 4.4Å; A26-I99 HydrophobicContact CB-CD1 3.4Å
27I87.2Confident82Confident6 Ų681.7 Ų81.73%0.03140%0.397CS..Hα-helixtrans-59.1-42.8176.7-66.2158.1000109.6A23 K24 K29 L30 R63 L80 N81A23-I27 HydrophobicContact CB-CD1 4.42Å; A23-I27 WeakPolarHBondContact O-CB 3.4Å; A23-I27 WeakPolarHBondContact O-CD1 3.18Å; A23-I27 WeakPolarHBondContact O-CG1 3.36Å; A23-I27 PolarHBondContact O-N 3.11Å; K24-I27 PolarHBondContact O-N 3Å; I27-K29 PolarHBondContact O-N 3.28Å; I27-L30 HydrophobicContact CB-CD1 4.41Å; I27-L30 HydrophobicContact CG2-CD1 4.15Å; I27-L30 VanDerWaalsContact O-CB 3.31Å; I27-L30 WeakPolarHBondContact O-CB 3.47Å; I27-L30 WeakPolarHBondContact O-CG 3.34Å; I27-L30 PolarHBondContact O-N 2.93Å; I27-R63 PolarHBondContact O-NH1 2.84Å; I27-L80 VanDerWaalsContact CD1-C 3.47Å; I27-L80 HydrophobicContact CD1-CB 3.52Å; I27-L80 WeakPolarHBondContact CD1-O 3.22Å; I27-L80 HydrophobicContact CG1-CB 3.88Å; I27-L80 HydrophobicContact CG1-CD1 4.42Å; I27-L80 HydrophobicContact CG2-CB 4.29Å; I27-L80 HydrophobicContact CG2-CD1 3.88Å; I27-N81 WeakPolarHBondContact CD1-OD1 3.45Å
28G87.5Confident82.9Confident52 Ų5276 Ų7654%0.53640%0.397SS..Hα-helixtrans-54.2-23.7175.400000114.9K24 A26K24-G28 PolarHBondContact O-N 3.38Å; A26-G28 VanDerWaalsContact C-N 3.28Å; A26-G28 PolarHBondContact O-N 3.43Å
29K86.3Confident84Confident153 Ų15369.1 Ų69.167%0.66538%0.375SS*.THydrogen-bonded Turntrans-85.9-9.7177.5-64176.8176.7-1750114.2A26 I27A26-K29 WeakPolarHBondContact O-CB 3.44Å; A26-K29 PolarHBondContact O-N 3.39Å; I27-K29 PolarHBondContact O-N 3.28Å
30L90.4Very high84.8Confident10 Ų1074.5 Ų74.55%0.05240%0.396CS..SBendtrans-65.1146178.3-65.5167.3000110.7I27 T32 R63 L65 P66 L80 I93 L97I27-L30 HydrophobicContact CB-CD1 4.41Å; I27-L30 HydrophobicContact CG2-CD1 4.15Å; I27-L30 VanDerWaalsContact O-CB 3.31Å; I27-L30 WeakPolarHBondContact O-CB 3.47Å; I27-L30 WeakPolarHBondContact O-CG 3.34Å; I27-L30 PolarHBondContact O-N 2.93Å; L30-T32 PolarHBondContact O-N 3.2Å; L30-T32 VanDerWaalsContact O-N 3.11Å; L30-T32 PolarHBondContact O-OG1 3.4Å; L30-R63 HydrophobicContact CB-CG 4.12Å; L30-L65 HydrophobicContact CD1-CD2 3.92Å; L30-P66 HydrophobicContact CD2-CG 3.87Å; L30-L80 HydrophobicContact CD1-CD1 3.94Å; L30-I93 HydrophobicContact CD1-CG2 3.82Å; L30-I93 HydrophobicContact CD2-CG2 3.74Å; L30-I93 HydrophobicContact CG-CG2 4.32Å; L30-L97 HydrophobicContact CD2-CD1 3.87Å; L30-L97 HydrophobicContact CD2-CD2 4.04Å; L30-L97 HydrophobicContact CD2-CG 4.27Å; L30-L97 HydrophobicContact CG-CD1 4.36Å
31T94.1Very high85.1Confident92 Ų9274.5 Ų74.556%0.56439%0.393SS*.  trans-54.7119.9178.5-54.70000109.9I64T31-I64 HydrophobicContact CG2-CB 4.4Å; T31-I64 HydrophobicContact CG2-CD1 4.16Å; T31-I64 PolarHBondContact O-N 3.26Å
32T94.9Very high84.8Confident61 Ų6172.8 Ų72.837%0.37439%0.386SS..EExtended strand (participates in β ladder)trans-121.8134.5175.7-56.80000107.1L30 V61 V62 K73L30-T32 PolarHBondContact O-N 3.2Å; L30-T32 VanDerWaalsContact O-N 3.11Å; L30-T32 PolarHBondContact O-OG1 3.4Å; T32-V61 HydrophobicContact CG2-CG1 3.43Å; T32-V61 VanDerWaalsContact CG2-CG1 3.43Å; T32-V62 WeakPolarHBondContact CA-O 3.18Å; T32-K73 HydrophobicContact CG2-CD 4.22Å
33R93.7Very high84.8Confident90 Ų9074 Ų7434%0.3439%0.385SS..EExtended strand (participates in β ladder)trans-135.8159.3174.869.9168.5-178.5-174.4-8.3110.7E41 V62 I64R33-E41 IonicContact CZ-OE1 3.76Å; R33-E41 IonicContact CZ-OE2 3.37Å; R33-E41 IonicContact NE-OE1 3.97Å; R33-E41 IonicContact NE-OE2 3.28Å; R33-E41 PolarHBondContact NE-OE2 3.36Å; R33-E41 IonicContact NH2-OE1 2.74Å; R33-E41 PolarHBondContact NH2-OE1 3.44Å; R33-E41 IonicContact NH2-OE2 2.88Å; R33-E41 PolarHBondContact NH2-OE2 3.17Å; R33-V62 HydrophobicContact CG-CG2 3.49Å; R33-V62 VanDerWaalsContact CG-CG2 3.49Å; R33-V62 PolarHBondContact N-O 3.26Å; R33-V62 PolarHBondContact O-N 2.83Å; R33-I64 HydrophobicContact CG-CD1 4.27Å
34T94.5Very high84.4Confident66 Ų6678.8 Ų78.841%0.40542%0.416SS..EExtended strand (participates in β ladder)trans-98.7128.4170-57.30000108.2K36 N59 D60T34-K36 PolarHBondContact O-N 2.92Å; T34-N59 HydrophobicContact CG2-CB 4.37Å; T34-D60 CarbonylContact C-O 3.55Å; T34-D60 WeakPolarHBondContact CA-O 3.45Å
35V91.9Very high83.9Confident0 Ų080.6 Ų80.60%043%0.431CS..  trans-64.6125.1176.8178.10000109.1T42 Q57 N59 D60 V62V35-T42 HydrophobicContact CG1-CG2 3.45Å; V35-T42 VanDerWaalsContact CG1-CG2 3.45Å; V35-Q57 WeakPolarHBondContact CB-O 3.41Å; V35-Q57 WeakPolarHBondContact CG1-O 2.97Å; V35-N59 WeakPolarHBondContact O-CA 3.26Å; V35-N59 PolarHBondContact O-N 3.19Å; V35-D60 HydrophobicContact CB-CB 4.39Å; V35-D60 HydrophobicContact CG2-CB 4.07Å; V35-D60 PolarHBondContact N-O 3.17Å; V35-V62 HydrophobicContact CG2-CG1 3.76Å; V35-V62 HydrophobicContact CG2-CG2 4.02Å
36K89.9Confident83.4Confident143 Ų14377 Ų7762%0.62242%0.416SS*.  trans-110.1162.6-179.7-63.9-177.1-177.5-178.10111.2T34 G38 D39T34-K36 PolarHBondContact O-N 2.92Å; K36-G38 PolarHBondContact O-N 2.75Å; K36-D39 PolarHBondContact N-OD2 2.84Å; K36-D39 WeakPolarHBondContact O-CB 3.22Å; K36-D39 PolarHBondContact O-N 3.06Å; K36-D39 VanDerWaalsContact O-N 3.09Å
37K83.9Confident82.9Confident192 Ų19282.8 Ų82.884%0.83545%0.446SS*.THydrogen-bonded Turntrans-65.2125.3177.2-165175.6-177.4-1780108.7L58K37-L58 VanDerWaalsContact CA-CD1 3.46Å; K37-L58 HydrophobicContact CB-CD1 3.56Å; K37-L58 HydrophobicContact CG-CD1 4.38Å
38G79.4Confident83.1Confident70 Ų7087.1 Ų87.172%0.72247%0.466SS*.THydrogen-bonded Turntrans911.4-176.500000114.5K36K36-G38 PolarHBondContact O-N 2.75Å
39D82.1Confident83.4Confident45 Ų4584.6 Ų84.624%0.24144%0.44CS..  trans-69.7143.2165.8-77.5-28.5000109.9K36 E41 T42K36-D39 PolarHBondContact N-OD2 2.84Å; K36-D39 WeakPolarHBondContact O-CB 3.22Å; K36-D39 PolarHBondContact O-N 3.06Å; K36-D39 VanDerWaalsContact O-N 3.09Å; D39-E41 PolarHBondContact O-N 2.86Å; D39-T42 PolarHBondContact O-N 2.96Å; D39-T42 PolarHBondContact O-OG1 3.28Å
40K77Confident83.7Confident153 Ų15379.9 Ų79.967%0.66543%0.429SS*.G310 helixtrans-52.2-30.6177.2-65.7178.2177.1-740113.3T42 D43 F46K40-T42 PolarHBondContact O-N 3.44Å; K40-D43 VanDerWaalsContact O-CB 3.31Å; K40-D43 WeakPolarHBondContact O-CB 3.23Å; K40-D43 PolarHBondContact O-N 3.28Å; K40-F46 HydrophobicContact CB-CD1 4.13Å; K40-F46 HydrophobicContact CB-CD2 4.15Å; K40-F46 HydrophobicContact CB-CE1 3.69Å; K40-F46 HydrophobicContact CB-CE2 3.7Å; K40-F46 HydrophobicContact CB-CG 4.37Å; K40-F46 HydrophobicContact CB-CZ 3.48Å; K40-F46 VanDerWaalsContact CB-CZ 3.48Å; K40-F46 HydrophobicContact CD-CE1 4.44Å; K40-F46 HydrophobicContact CD-CE2 4.41Å; K40-F46 HydrophobicContact CD-CZ 3.82Å; K40-F46 HydrophobicContact CG-CE2 4.34Å; K40-F46 HydrophobicContact CG-CZ 4.12Å; K40-F46 VanDerWaalsContact O-CB 3.24Å; K40-F46 WeakPolarHBondContact O-CB 3.31Å; K40-F46 WeakPolarHBondContact O-CD2 3.33Å; K40-F46 WeakPolarHBondContact O-CG 3.49Å
41E73.9Confident83.9Confident15 Ų1582.4 Ų82.47%0.0745%0.445CS..G310 helixtrans-68.6-15179.4-66.9177.6165.800114.5R33 D39 D43 Y56 V70R33-E41 IonicContact CZ-OE1 3.76Å; R33-E41 IonicContact CZ-OE2 3.37Å; R33-E41 IonicContact NE-OE1 3.97Å; R33-E41 IonicContact NE-OE2 3.28Å; R33-E41 PolarHBondContact NE-OE2 3.36Å; R33-E41 IonicContact NH2-OE1 2.74Å; R33-E41 PolarHBondContact NH2-OE1 3.44Å; R33-E41 IonicContact NH2-OE2 2.88Å; R33-E41 PolarHBondContact NH2-OE2 3.17Å; D39-E41 PolarHBondContact O-N 2.86Å; E41-D43 VanDerWaalsContact C-N 3.3Å; E41-Y56 HydrophobicContact CB-CD2 4.12Å; E41-Y56 HydrophobicContact CB-CG 4.47Å; E41-Y56 HydrophobicContact CG-CD2 4.37Å; E41-V70 WeakPolarHBondContact OE1-CG1 3.44Å
42T70.2Confident84Confident57 Ų5780 Ų8035%0.3543%0.432SS..G310 helixtrans-86.6-3.417657.50000113.3V35 D39 K40V35-T42 HydrophobicContact CG1-CG2 3.45Å; V35-T42 VanDerWaalsContact CG1-CG2 3.45Å; D39-T42 PolarHBondContact O-N 2.96Å; D39-T42 PolarHBondContact O-OG1 3.28Å; K40-T42 PolarHBondContact O-N 3.44Å
43D73.8Confident83.8Confident76 Ų7683.6 Ų83.641%0.40645%0.447SS..SBendtrans-79.6134.6174.9-167.4-75.7000110.4K40 E41 D45 F46K40-D43 VanDerWaalsContact O-CB 3.31Å; K40-D43 WeakPolarHBondContact O-CB 3.23Å; K40-D43 PolarHBondContact O-N 3.28Å; E41-D43 VanDerWaalsContact C-N 3.3Å; D43-D45 PolarHBondContact O-N 3.45Å; D43-D45 VanDerWaalsContact OD1-CB 3.27Å; D43-D45 WeakPolarHBondContact OD1-CB 3.32Å; D43-D45 PolarHBondContact OD1-N 2.91Å; D43-F46 HydrophobicContact CB-CB 4.39Å; D43-F46 HydrophobicContact CB-CD2 4.14Å; D43-F46 WeakPolarHBondContact O-CB 3.45Å; D43-F46 PolarHBondContact O-N 3.45Å
44P69Low83.8Confident103 Ų10384.8 Ų84.867%0.66946%0.457SS*.THydrogen-bonded Turntrans-62.7-21.2179.926.2-34.9000113.7F46P44-F46 VanDerWaalsContact C-N 3.28Å
45D72.5Confident83.6Confident149 Ų14984 Ų8480%0.79746%0.457SS*.THydrogen-bonded Turntrans-84.4-0.9176.5-60.6-41000112.6D43D43-D45 PolarHBondContact O-N 3.45Å; D43-D45 VanDerWaalsContact OD1-CB 3.27Å; D43-D45 WeakPolarHBondContact OD1-CB 3.32Å; D43-D45 PolarHBondContact OD1-N 2.91Å
46F73.4Confident83.7Confident80 Ų8084.6 Ų84.635%0.35146%0.459SS..SBendtrans-88.5163.5-179.2-110.7-100.7000114.5K40 D43 P44 H48K40-F46 HydrophobicContact CB-CD1 4.13Å; K40-F46 HydrophobicContact CB-CD2 4.15Å; K40-F46 HydrophobicContact CB-CE1 3.69Å; K40-F46 HydrophobicContact CB-CE2 3.7Å; K40-F46 HydrophobicContact CB-CG 4.37Å; K40-F46 HydrophobicContact CB-CZ 3.48Å; K40-F46 VanDerWaalsContact CB-CZ 3.48Å; K40-F46 HydrophobicContact CD-CE1 4.44Å; K40-F46 HydrophobicContact CD-CE2 4.41Å; K40-F46 HydrophobicContact CD-CZ 3.82Å; K40-F46 HydrophobicContact CG-CE2 4.34Å; K40-F46 HydrophobicContact CG-CZ 4.12Å; K40-F46 VanDerWaalsContact O-CB 3.24Å; K40-F46 WeakPolarHBondContact O-CB 3.31Å; K40-F46 WeakPolarHBondContact O-CD2 3.33Å; K40-F46 WeakPolarHBondContact O-CG 3.49Å; D43-F46 HydrophobicContact CB-CB 4.39Å; D43-F46 HydrophobicContact CB-CD2 4.14Å; D43-F46 WeakPolarHBondContact O-CB 3.45Å; D43-F46 PolarHBondContact O-N 3.45Å; P44-F46 VanDerWaalsContact C-N 3.28Å; F46-H48 PolarHBondContact O-CE1 3.33Å; F46-H48 PolarHBondContact O-N 2.9Å; F46-H48 PolarHBondContact O-ND1 3.41Å
47N75.9Confident83.7Confident126 Ų12683.9 Ų83.967%0.67446%0.458SS*.PPolyproline II helixtrans-56.2131.2-176.9-69.8-74.9000111.8Y56N47-Y56 WeakPolarHBondContact O-CD2 3.23Å; N47-Y56 WeakPolarHBondContact O-CE2 3.49Å
48H90.9Very high84Confident96 Ų9678.9 Ų78.944%0.44444%0.44SS..PPolyproline II helixtrans-85.9162.8174.7-61.250.3000110.2F46 A50F46-H48 PolarHBondContact O-CE1 3.33Å; F46-H48 PolarHBondContact O-N 2.9Å; F46-H48 PolarHBondContact O-ND1 3.41Å; H48-A50 PolarHBondContact O-N 2.96Å
49C93.9Very high84.6Confident0 Ų080.8 Ų80.80%043%0.434CS..  trans-69.7114.6171.8-177.10000110V51 C52 I53 E54 Y56 H72C49-V51 PolarHBondContact O-N 3.07Å; C49-C52 VanDerWaalsContact CB-SG 3.54Å; C49-I53 WeakPolarHBondContact O-CA 3.36Å; C49-I53 PolarHBondContact O-N 2.87Å; C49-E54 PolarHBondContact N-O 2.63Å; C49-Y56 WeakPolarHBondContact CA-OH 3.42Å; C49-Y56 HydrophobicContact CB-CE1 3.84Å; C49-H72 WeakPolarHBondContact CB-ND1 3.19Å
50A93Very high85.2Confident53 Ų5380.4 Ų80.444%0.43843%0.432SS..THydrogen-bonded Turntrans-70.7-0.4-177.600000115H48 F71 M88H48-A50 PolarHBondContact O-N 2.96Å; A50-F71 HydrophobicContact CB-CE1 4.1Å; A50-M88 HydrophobicContact CB-CG 4.23Å; A50-M88 HydrophobicContact CB-SD 3.45Å; A50-M88 WeakPolarHBondContact CB-SD 3.29Å
51V94.3Very high86.1Confident63 Ų6376.1 Ų76.138%0.38242%0.418SS..THydrogen-bonded Turntrans-95.2-51176.8-179.90000111.2C49 F71 C75 P87C49-V51 PolarHBondContact O-N 3.07Å; V51-F71 HydrophobicContact CG2-CD1 3.88Å; V51-F71 HydrophobicContact CG2-CE1 4.31Å; V51-C75 HydrophobicContact CB-CB 3.83Å; V51-C75 HydrophobicContact CG1-CB 3.78Å; V51-C75 HydrophobicContact CG2-CB 4.45Å; V51-P87 HydrophobicContact CG2-CG 4.33Å
52C95.1Very high87.1Confident42 Ų4275.4 Ų75.428%0.28442%0.415SS..THydrogen-bonded Turntrans-94.8-10.6176.260.80000113.7C49 E54 H72C49-C52 VanDerWaalsContact CB-SG 3.54Å; C52-E54 HydrophobicContact CB-CG 4.33Å; C52-E54 PolarHBondContact O-N 2.78Å; C52-H72 PolarHBondContact SG-ND1 3.38Å; C52-H72 VanDerWaalsContact SG-ND1 3.42Å
53I92.4Very high88.3Confident136 Ų13673 Ų7370%0.69740%0.399SS*.  trans6614.6-179.1-41.2175.8000112.3C49C49-I53 WeakPolarHBondContact O-CA 3.36Å; C49-I53 PolarHBondContact O-N 2.87Å
54E92.5Very high89.3Confident116 Ų11670.8 Ų70.854%0.54239%0.387SS..PPolyproline II helixtrans-94.4150.1179.2-61.2-179.8155.400111.9C49 C52C49-E54 PolarHBondContact N-O 2.63Å; C52-E54 HydrophobicContact CB-CG 4.33Å; C52-E54 PolarHBondContact O-N 2.78Å
55A91.4Very high90.5Very high50 Ų5066 Ų6641%0.41336%0.356SS..PPolyproline II helixtrans-68.6151.917100000111
56Y92.2Very high91.5Very high12 Ų1261.3 Ų61.35%0.04733%0.334CS..PPolyproline II helixtrans-76.8135.2177.1-63.7-64.7000111.4E41 N47 C49 V62 V70 F71 H72E41-Y56 HydrophobicContact CB-CD2 4.12Å; E41-Y56 HydrophobicContact CB-CG 4.47Å; E41-Y56 HydrophobicContact CG-CD2 4.37Å; N47-Y56 WeakPolarHBondContact O-CD2 3.23Å; N47-Y56 WeakPolarHBondContact O-CE2 3.49Å; C49-Y56 WeakPolarHBondContact CA-OH 3.42Å; C49-Y56 HydrophobicContact CB-CE1 3.84Å; Y56-V62 HydrophobicContact CD1-CG1 3.48Å; Y56-V62 VanDerWaalsContact CD1-CG1 3.48Å; Y56-V62 HydrophobicContact CE1-CG1 3.55Å; Y56-V62 HydrophobicContact CG-CG1 4.32Å; Y56-V70 PolarHBondContact OH-O 2.79Å; Y56-F71 WeakPolarHBondContact OH-CA 3.4Å; Y56-F71 PolarHBondContact OH-N 3.03Å; Y56-H72 AromaticContact CD1-CD2 3.92Å; Y56-H72 AromaticContact CD1-CE1 3.74Å; Y56-H72 AromaticContact CD1-NE2 3.49Å; Y56-H72 WeakPolarHBondContact CD1-NE2 3.02Å; Y56-H72 AromaticContact CE1-CE1 3.79Å; Y56-H72 AromaticContact CE1-ND1 3.89Å; Y56-H72 AromaticContact CE1-NE2 3.88Å
57Q90.9Very high92.5Very high127 Ų12759 Ų5959%0.59333%0.327SS*.  trans-109.3162.1-179.1-60.9-17446.500111.8V35 N59 D60V35-Q57 WeakPolarHBondContact CB-O 3.41Å; V35-Q57 WeakPolarHBondContact CG1-O 2.97Å; Q57-N59 PolarHBondContact O-N 2.92Å; Q57-D60 PolarHBondContact N-OD2 2.93Å; Q57-D60 VanDerWaalsContact O-CB 3.28Å; Q57-D60 WeakPolarHBondContact O-CB 3.4Å; Q57-D60 PolarHBondContact O-N 2.97Å; Q57-D60 VanDerWaalsContact O-N 3.08Å
58L90.9Very high93.3Very high88 Ų8861.1 Ų61.146%0.46133%0.331SS..THydrogen-bonded Turntrans-55.8133.2172.9-170.384.6000110K37 D60K37-L58 VanDerWaalsContact CA-CD1 3.46Å; K37-L58 HydrophobicContact CB-CD1 3.56Å; K37-L58 HydrophobicContact CG-CD1 4.38Å; L58-D60 PolarHBondContact O-N 2.82Å
59N91.9Very high93.5Very high109 Ų10959.5 Ų59.558%0.58332%0.323SS*.THydrogen-bonded Turntrans72.65.7-178-46.1-57.9000115.5T34 V35 Q57 V61T34-N59 HydrophobicContact CG2-CB 4.37Å; V35-N59 WeakPolarHBondContact O-CA 3.26Å; V35-N59 PolarHBondContact O-N 3.19Å; Q57-N59 PolarHBondContact O-N 2.92Å; N59-V61 PolarHBondContact O-N 3.28Å
60D93.8Very high93.5Very high38 Ų3861 Ų6120%0.20333%0.332CS..  trans-61.5136.6170.4-82.5-11.4000110.7T34 V35 Q57 L58 V62 H72T34-D60 CarbonylContact C-O 3.55Å; T34-D60 WeakPolarHBondContact CA-O 3.45Å; V35-D60 HydrophobicContact CB-CB 4.39Å; V35-D60 HydrophobicContact CG2-CB 4.07Å; V35-D60 PolarHBondContact N-O 3.17Å; Q57-D60 PolarHBondContact N-OD2 2.93Å; Q57-D60 VanDerWaalsContact O-CB 3.28Å; Q57-D60 WeakPolarHBondContact O-CB 3.4Å; Q57-D60 PolarHBondContact O-N 2.97Å; Q57-D60 VanDerWaalsContact O-N 3.08Å; L58-D60 PolarHBondContact O-N 2.82Å; D60-V62 HydrophobicContact CB-CG1 4.38Å; D60-H72 IonicContact OD2-CD2 3.44Å; D60-H72 PolarHBondContact OD2-CD2 2.87Å; D60-H72 IonicContact OD2-CE1 3.94Å; D60-H72 IonicContact OD2-NE2 2.77Å; D60-H72 PolarHBondContact OD2-NE2 2.83Å
61V95.4Very high93.6Very high62 Ų6258.5 Ų58.538%0.37631%0.311SS..EExtended strand (participates in β ladder)trans-91.1108.5173.5-175.10000108T32 N59 K73T32-V61 HydrophobicContact CG2-CG1 3.43Å; T32-V61 VanDerWaalsContact CG2-CG1 3.43Å; N59-V61 PolarHBondContact O-N 3.28Å; V61-K73 HydrophobicContact CB-CB 4.41Å; V61-K73 HydrophobicContact CG1-CB 3.95Å; V61-K73 HydrophobicContact CG1-CD 3.79Å; V61-K73 WeakPolarHBondContact O-CB 3.34Å; V61-K73 PolarHBondContact O-N 3.36Å
62V95Very high93.7Very high0 Ų056.2 Ų56.20%030%0.296CS..EExtended strand (participates in β ladder)trans-107.4146.5-179.6-60.50000111T32 R33 V35 Y56 D60 V70 F71T32-V62 WeakPolarHBondContact CA-O 3.18Å; R33-V62 HydrophobicContact CG-CG2 3.49Å; R33-V62 VanDerWaalsContact CG-CG2 3.49Å; R33-V62 PolarHBondContact N-O 3.26Å; R33-V62 PolarHBondContact O-N 2.83Å; V35-V62 HydrophobicContact CG2-CG1 3.76Å; V35-V62 HydrophobicContact CG2-CG2 4.02Å; Y56-V62 HydrophobicContact CD1-CG1 3.48Å; Y56-V62 VanDerWaalsContact CD1-CG1 3.48Å; Y56-V62 HydrophobicContact CE1-CG1 3.55Å; Y56-V62 HydrophobicContact CG-CG1 4.32Å; D60-V62 HydrophobicContact CB-CG1 4.38Å; V62-V70 HydrophobicContact CB-CG1 3.65Å; V62-V70 HydrophobicContact CG1-CG1 4.26Å; V62-V70 HydrophobicContact CG2-CG1 3.83Å; V62-F71 CarbonylContact C-O 3.47Å; V62-F71 VanDerWaalsContact CA-O 3.23Å; V62-F71 WeakPolarHBondContact CA-O 3.39Å; V62-F71 WeakPolarHBondContact CB-O 3.31Å
63R95.8Very high93.7Very high6 Ų657.6 Ų57.62%0.02330%0.298CS..EExtended strand (participates in β ladder)trans-110132.3174.7-172178.1-63.3-96.317.9109.4I27 L30 L65 V70 F71 V76 D77I27-R63 PolarHBondContact O-NH1 2.84Å; L30-R63 HydrophobicContact CB-CG 4.12Å; R63-L65 HydrophobicContact CG-CD2 4.43Å; R63-V70 WeakPolarHBondContact O-CA 3.43Å; R63-F71 PolarHBondContact N-O 2.97Å; R63-F71 PolarHBondContact O-N 3.25Å; R63-V76 HydrophobicContact CB-CG1 3.89Å; R63-V76 HydrophobicContact CG-CG1 4.38Å; R63-D77 IonicContact CZ-OD1 3.04Å; R63-D77 IonicContact CZ-OD2 3.86Å; R63-D77 IonicContact NE-OD1 2.63Å; R63-D77 PolarHBondContact NE-OD1 3.15Å; R63-D77 IonicContact NH2-OD1 2.79Å; R63-D77 PolarHBondContact NH2-OD1 3.06Å; R63-D77 IonicContact NH2-OD2 2.87Å; R63-D77 PolarHBondContact NH2-OD2 3.35Å
64I94.3Very high93.9Very high31 Ų3156.6 Ų56.616%0.15930%0.298CS..EExtended strand (participates in β ladder)trans-106119.1178.1-51.4175.8000107.5T31 R33 V70T31-I64 HydrophobicContact CG2-CB 4.4Å; T31-I64 HydrophobicContact CG2-CD1 4.16Å; T31-I64 PolarHBondContact O-N 3.26Å; R33-I64 HydrophobicContact CG-CD1 4.27Å; I64-V70 HydrophobicContact CG1-CG1 4.34Å; I64-V70 HydrophobicContact CG1-CG2 4.11Å; I64-V70 HydrophobicContact CG2-CG2 4.47Å
65L94.8Very high94Very high3 Ų352.5 Ų52.52%0.01628%0.281CS..  trans-78.4164.2177.3-58.6-170.2000111L30 R63 C67 K68 H69 F71 L80 C86 I93L30-L65 HydrophobicContact CD1-CD2 3.92Å; R63-L65 HydrophobicContact CG-CD2 4.43Å; L65-C67 PolarHBondContact O-N 3.39Å; L65-K68 WeakPolarHBondContact O-CA 3.46Å; L65-K68 PolarHBondContact O-N 2.87Å; L65-H69 PolarHBondContact N-O 3.22Å; L65-F71 HydrophobicContact CD1-CD2 4.13Å; L65-F71 HydrophobicContact CD1-CE2 3.65Å; L65-F71 HydrophobicContact CG-CD2 4.22Å; L65-F71 HydrophobicContact CG-CE2 4.1Å; L65-L80 HydrophobicContact CD2-CD1 3.81Å; L65-L80 HydrophobicContact CD2-CD2 4.4Å; L65-C86 HydrophobicContact CD1-CB 3.77Å; L65-I93 HydrophobicContact CB-CD1 4.09Å; L65-I93 HydrophobicContact CD1-CD1 3.9Å; L65-I93 HydrophobicContact CD2-CD1 4.46Å; L65-I93 HydrophobicContact CG-CD1 4.37Å
66P93.3Very high94.2Very high49 Ų4950.1 Ų50.132%0.31826%0.262SS..THydrogen-bonded Turntrans-60.2-28.2177.6-24.337.5000113L30 K68 I93 A96 L97L30-P66 HydrophobicContact CD2-CG 3.87Å; P66-K68 PolarHBondContact O-N 2.88Å; P66-I93 HydrophobicContact CG-CG2 4.07Å; P66-A96 HydrophobicContact CB-CB 3.75Å; P66-A96 HydrophobicContact CG-CB 3.93Å; P66-L97 HydrophobicContact CG-CD2 4.36Å
67C94.8Very high94.2Very high33 Ų3350.7 Ų50.722%0.22327%0.266CS..THydrogen-bonded Turntrans-75.26.5171.262.30000114.5L65 H69 L91L65-C67 PolarHBondContact O-N 3.39Å; C67-H69 PolarHBondContact O-N 2.97Å; C67-H69 VanDerWaalsContact O-N 3.17Å; C67-H69 PolarHBondContact SG-ND1 2.79Å; C67-H69 VanDerWaalsContact SG-ND1 3.36Å; C67-L91 HydrophobicContact CB-CB 4.39Å; C67-L91 HydrophobicContact CB-CD2 3.65Å
68K92.8Very high94.2Very high170 Ų17048.4 Ų48.474%0.73926%0.262SS*.  trans68.51.7-180-49.4-63.6-179.2166.50116.6L65 P66L65-K68 WeakPolarHBondContact O-CA 3.46Å; L65-K68 PolarHBondContact O-N 2.87Å; P66-K68 PolarHBondContact O-N 2.88Å
69H94.1Very high94.2Very high61 Ų6148.6 Ų48.628%0.28226%0.256SS..  trans-67.5138.7168.8-69.6118.9000110.9L65 C67 F71 C86L65-H69 PolarHBondContact N-O 3.22Å; C67-H69 PolarHBondContact O-N 2.97Å; C67-H69 VanDerWaalsContact O-N 3.17Å; C67-H69 PolarHBondContact SG-ND1 2.79Å; C67-H69 VanDerWaalsContact SG-ND1 3.36Å; H69-F71 HydrophobicContact CB-CD2 4.5Å; H69-F71 HydrophobicContact CB-CE2 3.52Å; H69-F71 HydrophobicContact CB-CZ 3.86Å; H69-C86 PolarHBondContact ND1-SG 2.78Å; H69-C86 VanDerWaalsContact ND1-SG 3.44Å
70V94Very high94.1Very high31 Ų3143.4 Ų43.419%0.18823%0.229CC..EExtended strand (participates in β ladder)trans-111.4140.2-177.6-169.80000109.3E41 Y56 V62 R63 I64E41-V70 WeakPolarHBondContact OE1-CG1 3.44Å; Y56-V70 PolarHBondContact OH-O 2.79Å; V62-V70 HydrophobicContact CB-CG1 3.65Å; V62-V70 HydrophobicContact CG1-CG1 4.26Å; V62-V70 HydrophobicContact CG2-CG1 3.83Å; R63-V70 WeakPolarHBondContact O-CA 3.43Å; I64-V70 HydrophobicContact CG1-CG1 4.34Å; I64-V70 HydrophobicContact CG1-CG2 4.11Å; I64-V70 HydrophobicContact CG2-CG2 4.47Å
71F95.9Very high93.7Very high2 Ų244.2 Ų44.21%0.00923%0.233CC..EExtended strand (participates in β ladder)trans-145.8158.6176.3-54.6-88.9000109.6A50 V51 Y56 V62 R63 L65 H69 K73 V76 P87 M88A50-F71 HydrophobicContact CB-CE1 4.1Å; V51-F71 HydrophobicContact CG2-CD1 3.88Å; V51-F71 HydrophobicContact CG2-CE1 4.31Å; Y56-F71 WeakPolarHBondContact OH-CA 3.4Å; Y56-F71 PolarHBondContact OH-N 3.03Å; V62-F71 CarbonylContact C-O 3.47Å; V62-F71 VanDerWaalsContact CA-O 3.23Å; V62-F71 WeakPolarHBondContact CA-O 3.39Å; V62-F71 WeakPolarHBondContact CB-O 3.31Å; R63-F71 PolarHBondContact N-O 2.97Å; R63-F71 PolarHBondContact O-N 3.25Å; L65-F71 HydrophobicContact CD1-CD2 4.13Å; L65-F71 HydrophobicContact CD1-CE2 3.65Å; L65-F71 HydrophobicContact CG-CD2 4.22Å; L65-F71 HydrophobicContact CG-CE2 4.1Å; H69-F71 HydrophobicContact CB-CD2 4.5Å; H69-F71 HydrophobicContact CB-CE2 3.52Å; H69-F71 HydrophobicContact CB-CZ 3.86Å; F71-K73 PolarHBondContact O-N 2.96Å; F71-V76 HydrophobicContact CB-CB 3.6Å; F71-V76 HydrophobicContact CB-CG1 3.93Å; F71-V76 HydrophobicContact CB-CG2 4.04Å; F71-V76 HydrophobicContact CD2-CB 4.3Å; F71-V76 HydrophobicContact CD2-CG2 3.79Å; F71-V76 HydrophobicContact CE2-CG2 4.42Å; F71-V76 HydrophobicContact CG-CB 4.02Å; F71-V76 HydrophobicContact CG-CG2 3.89Å; F71-P87 HydrophobicContact CE1-CB 4.21Å; F71-P87 HydrophobicContact CE1-CG 4.11Å; F71-P87 HydrophobicContact CZ-CB 4.27Å; F71-P87 HydrophobicContact CZ-CG 4.09Å; F71-M88 HydrophobicContact CE1-CG 3.92Å; F71-M88 HydrophobicContact CZ-CB 4.37Å; F71-M88 HydrophobicContact CZ-CG 3.6Å
72H96.4Very high93.1Very high14 Ų1447.3 Ų47.37%0.06524%0.243CC..EExtended strand (participates in β ladder)trans-58.7136.2163.7-63.7105.7000110.1C49 C52 Y56 D60 V74 C75 V76C49-H72 WeakPolarHBondContact CB-ND1 3.19Å; C52-H72 PolarHBondContact SG-ND1 3.38Å; C52-H72 VanDerWaalsContact SG-ND1 3.42Å; Y56-H72 AromaticContact CD1-CD2 3.92Å; Y56-H72 AromaticContact CD1-CE1 3.74Å; Y56-H72 AromaticContact CD1-NE2 3.49Å; Y56-H72 WeakPolarHBondContact CD1-NE2 3.02Å; Y56-H72 AromaticContact CE1-CE1 3.79Å; Y56-H72 AromaticContact CE1-ND1 3.89Å; Y56-H72 AromaticContact CE1-NE2 3.88Å; D60-H72 IonicContact OD2-CD2 3.44Å; D60-H72 PolarHBondContact OD2-CD2 2.87Å; D60-H72 IonicContact OD2-CE1 3.94Å; D60-H72 IonicContact OD2-NE2 2.77Å; D60-H72 PolarHBondContact OD2-NE2 2.83Å; H72-V74 HydrophobicContact CB-CG2 4.18Å; H72-V74 PolarHBondContact O-N 2.95Å; H72-C75 HydrophobicContact CB-CB 4.01Å; H72-C75 PolarHBondContact O-N 3.08Å; H72-C75 VanDerWaalsContact O-N 3.07Å; H72-V76 WeakPolarHBondContact O-CG1 3.27Å; H72-V76 PolarHBondContact O-N 3.01Å
73K95.8Very high92.6Very high72 Ų7250.4 Ų50.431%0.31326%0.258SS..Hα-helixtrans-54.5-44.6178.2179.8-172.7177.6-56.80111T32 V61 F71 C75 D77T32-K73 HydrophobicContact CG2-CD 4.22Å; V61-K73 HydrophobicContact CB-CB 4.41Å; V61-K73 HydrophobicContact CG1-CB 3.95Å; V61-K73 HydrophobicContact CG1-CD 3.79Å; V61-K73 WeakPolarHBondContact O-CB 3.34Å; V61-K73 PolarHBondContact O-N 3.36Å; F71-K73 PolarHBondContact O-N 2.96Å; K73-C75 VanDerWaalsContact C-N 3.28Å; K73-C75 PolarHBondContact O-N 2.93Å; K73-D77 WeakPolarHBondContact CG-OD2 3.4Å; K73-D77 IonicContact NZ-OD2 2.78Å; K73-D77 PolarHBondContact NZ-OD2 2.81Å; K73-D77 VanDerWaalsContact O-CB 3.23Å; K73-D77 WeakPolarHBondContact O-CB 3.37Å; K73-D77 PolarHBondContact O-N 2.67Å
74V95.4Very high92.2Very high115 Ų11550.5 Ų50.570%0.69726%0.259SS*.Hα-helixtrans-65.6-31.1-179.2-60.80000112.8H72 P78H72-V74 HydrophobicContact CB-CG2 4.18Å; H72-V74 PolarHBondContact O-N 2.95Å; V74-P78 WeakPolarHBondContact O-CD 3.15Å
75C95.8Very high92.1Very high30 Ų3050.4 Ų50.420%0.20326%0.26CS..Hα-helixtrans-81-39.9-178.8-61.70000112V51 H72 K73V51-C75 HydrophobicContact CB-CB 3.83Å; V51-C75 HydrophobicContact CG1-CB 3.78Å; V51-C75 HydrophobicContact CG2-CB 4.45Å; H72-C75 HydrophobicContact CB-CB 4.01Å; H72-C75 PolarHBondContact O-N 3.08Å; H72-C75 VanDerWaalsContact O-N 3.07Å; K73-C75 VanDerWaalsContact C-N 3.28Å; K73-C75 PolarHBondContact O-N 2.93Å
76V95Very high92.1Very high0 Ų050.3 Ų50.30%026%0.26CS..Hα-helixtrans-90.1-26.4-173.677.70000113.7R63 F71 H72 W79 L80 P87R63-V76 HydrophobicContact CB-CG1 3.89Å; R63-V76 HydrophobicContact CG-CG1 4.38Å; F71-V76 HydrophobicContact CB-CB 3.6Å; F71-V76 HydrophobicContact CB-CG1 3.93Å; F71-V76 HydrophobicContact CB-CG2 4.04Å; F71-V76 HydrophobicContact CD2-CB 4.3Å; F71-V76 HydrophobicContact CD2-CG2 3.79Å; F71-V76 HydrophobicContact CE2-CG2 4.42Å; F71-V76 HydrophobicContact CG-CB 4.02Å; F71-V76 HydrophobicContact CG-CG2 3.89Å; H72-V76 WeakPolarHBondContact O-CG1 3.27Å; H72-V76 PolarHBondContact O-N 3.01Å; V76-W79 WeakPolarHBondContact O-CB 3.09Å; V76-W79 PolarHBondContact O-N 3.41Å; V76-L80 HydrophobicContact CG1-CD1 4.27Å; V76-L80 HydrophobicContact CG2-CD1 4.05Å; V76-L80 HydrophobicContact CG2-CG 4.01Å; V76-L80 VanDerWaalsContact O-CG 3.31Å; V76-L80 WeakPolarHBondContact O-CG 3.26Å; V76-L80 PolarHBondContact O-N 2.91Å; V76-P87 HydrophobicContact CG2-CG 4.34Å
77D92.8Very high92Very high24 Ų2449.1 Ų49.113%0.12825%0.252CS..Hα-helixtrans-58.1-46.7-179.4-76.14.5000113R63 K73 W79 L80 N81R63-D77 IonicContact CZ-OD1 3.04Å; R63-D77 IonicContact CZ-OD2 3.86Å; R63-D77 IonicContact NE-OD1 2.63Å; R63-D77 PolarHBondContact NE-OD1 3.15Å; R63-D77 IonicContact NH2-OD1 2.79Å; R63-D77 PolarHBondContact NH2-OD1 3.06Å; R63-D77 IonicContact NH2-OD2 2.87Å; R63-D77 PolarHBondContact NH2-OD2 3.35Å; K73-D77 WeakPolarHBondContact CG-OD2 3.4Å; K73-D77 IonicContact NZ-OD2 2.78Å; K73-D77 PolarHBondContact NZ-OD2 2.81Å; K73-D77 VanDerWaalsContact O-CB 3.23Å; K73-D77 WeakPolarHBondContact O-CB 3.37Å; K73-D77 PolarHBondContact O-N 2.67Å; D77-W79 VanDerWaalsContact C-N 3.34Å; D77-W79 PolarHBondContact O-N 3.46Å; D77-L80 PolarHBondContact O-N 3.39Å; D77-N81 VanDerWaalsContact O-CG 3.29Å; D77-N81 PolarHBondContact O-N 3.11Å; D77-N81 VanDerWaalsContact O-N 3.07Å; D77-N81 PolarHBondContact O-ND2 3.05Å
78P90.9Very high92Very high79 Ų7952.5 Ų52.551%0.51327%0.266SS..Hα-helixtrans-59.1-45.1177.3-23.334.6000112.2V74 L80 N81 E82V74-P78 WeakPolarHBondContact O-CD 3.15Å; P78-L80 PolarHBondContact O-N 2.96Å; P78-N81 PolarHBondContact O-N 2.62Å; P78-E82 PolarHBondContact O-N 2.81Å
79W90.3Very high92Very high91 Ų9147.3 Ų47.335%0.34525%0.25SC..Hα-helixtrans-59.4-46.5177.6179.1-83.4000112.3V76 D77 N81 E82 H83 T85 P87V76-W79 WeakPolarHBondContact O-CB 3.09Å; V76-W79 PolarHBondContact O-N 3.41Å; D77-W79 VanDerWaalsContact C-N 3.34Å; D77-W79 PolarHBondContact O-N 3.46Å; W79-N81 VanDerWaalsContact C-N 3.3Å; W79-N81 PolarHBondContact O-N 2.93Å; W79-E82 PolarHBondContact O-N 3.39Å; W79-H83 AromaticContact CD2-CD2 3.83Å; W79-H83 AromaticContact CE2-CD2 3.83Å; W79-H83 AromaticContact CE3-CD2 3.95Å; W79-H83 AromaticContact CZ2-CD2 3.97Å; W79-H83 PolarHBondContact O-N 3.33Å; W79-T85 PolarHBondContact NE1-O 3.41Å; W79-P87 HydrophobicContact CD2-CG 4.24Å; W79-P87 HydrophobicContact CG-CG 4.03Å
80L89.8Confident91.9Very high0 Ų050.5 Ų50.50%026%0.263CS..Hα-helixtrans-66.7-32.2-178.9-67.8174000112.6I27 L30 L65 V76 D77 P78 E82 C84 T85 I93I27-L80 VanDerWaalsContact CD1-C 3.47Å; I27-L80 HydrophobicContact CD1-CB 3.52Å; I27-L80 WeakPolarHBondContact CD1-O 3.22Å; I27-L80 HydrophobicContact CG1-CB 3.88Å; I27-L80 HydrophobicContact CG1-CD1 4.42Å; I27-L80 HydrophobicContact CG2-CB 4.29Å; I27-L80 HydrophobicContact CG2-CD1 3.88Å; L30-L80 HydrophobicContact CD1-CD1 3.94Å; L65-L80 HydrophobicContact CD2-CD1 3.81Å; L65-L80 HydrophobicContact CD2-CD2 4.4Å; V76-L80 HydrophobicContact CG1-CD1 4.27Å; V76-L80 HydrophobicContact CG2-CD1 4.05Å; V76-L80 HydrophobicContact CG2-CG 4.01Å; V76-L80 VanDerWaalsContact O-CG 3.31Å; V76-L80 WeakPolarHBondContact O-CG 3.26Å; V76-L80 PolarHBondContact O-N 2.91Å; D77-L80 PolarHBondContact O-N 3.39Å; P78-L80 PolarHBondContact O-N 2.96Å; L80-E82 PolarHBondContact O-N 2.83Å; L80-C84 VanDerWaalsContact O-CA 3.26Å; L80-C84 WeakPolarHBondContact O-CA 3.39Å; L80-C84 PolarHBondContact O-N 3.36Å; L80-C84 PolarHBondContact O-SG 2.89Å; L80-T85 WeakPolarHBondContact CD2-O 3.24Å; L80-I93 HydrophobicContact CD2-CG1 3.75Å
81N85.1Confident91.8Very high55 Ų5552.5 Ų52.529%0.29427%0.272SS..Hα-helixtrans-65.4-29.6177.6-74.2-46.1000112.7K24 I27 D77 P78 W79K24-N81 WeakPolarHBondContact CG-OD1 3.4Å; I27-N81 WeakPolarHBondContact CD1-OD1 3.45Å; D77-N81 VanDerWaalsContact O-CG 3.29Å; D77-N81 PolarHBondContact O-N 3.11Å; D77-N81 VanDerWaalsContact O-N 3.07Å; D77-N81 PolarHBondContact O-ND2 3.05Å; P78-N81 PolarHBondContact O-N 2.62Å; W79-N81 VanDerWaalsContact C-N 3.3Å; W79-N81 PolarHBondContact O-N 2.93Å
82E82.3Confident91.5Very high127 Ų12754.6 Ų54.659%0.59328%0.283SS*.Hα-helixtrans-95.9-45.5-177.6-166.7136.8-127.900112.2P78 W79 L80P78-E82 PolarHBondContact O-N 2.81Å; W79-E82 PolarHBondContact O-N 3.39Å; L80-E82 PolarHBondContact O-N 2.83Å
83H84.6Confident91.2Very high65 Ų6554 Ų5430%0.30128%0.281SS..Hα-helixtrans-106.8-18.9-171.4-61.5-63.6000114.3W79 T85W79-H83 AromaticContact CD2-CD2 3.83Å; W79-H83 AromaticContact CE2-CD2 3.83Å; W79-H83 AromaticContact CE3-CD2 3.95Å; W79-H83 AromaticContact CZ2-CD2 3.97Å; W79-H83 PolarHBondContact O-N 3.33Å; H83-T85 WeakPolarHBondContact O-CG2 3.41Å; H83-T85 PolarHBondContact O-N 3.31Å
84C88.9Confident90.7Very high8 Ų850.8 Ų50.85%0.05427%0.267CS..  trans5221.9-176.5-66.20000114.6L80 I93 L94 C105L80-C84 VanDerWaalsContact O-CA 3.26Å; L80-C84 WeakPolarHBondContact O-CA 3.39Å; L80-C84 PolarHBondContact O-N 3.36Å; L80-C84 PolarHBondContact O-SG 2.89Å; C84-I93 WeakPolarHBondContact O-CG1 3.36Å; C84-I93 PolarHBondContact O-N 3.3Å; C84-L94 HydrophobicContact CB-CD1 4.09Å; C84-L94 HydrophobicContact CB-CG 4.01Å; C84-C105 HydrophobicContact CB-CB 4.05Å
85T91.7Very high90.2Very high30 Ų3053.5 Ų53.518%0.18427%0.27CS..BIsolated β-bridgetrans-123.6153.1-176520000111.7W79 L80 H83 L91W79-T85 PolarHBondContact NE1-O 3.41Å; L80-T85 WeakPolarHBondContact CD2-O 3.24Å; H83-T85 WeakPolarHBondContact O-CG2 3.41Å; H83-T85 PolarHBondContact O-N 3.31Å; T85-L91 CarbonylContact C-O 3.59Å; T85-L91 VanDerWaalsContact CA-O 3.29Å; T85-L91 WeakPolarHBondContact CA-O 3.11Å
86C93.9Very high89.7Confident0 Ų054.4 Ų54.40%028%0.279CS..  trans-67.6129.1171.4178.80000110.9L65 H69 M88 C89 K90 L91 I93L65-C86 HydrophobicContact CD1-CB 3.77Å; H69-C86 PolarHBondContact ND1-SG 2.78Å; H69-C86 VanDerWaalsContact ND1-SG 3.44Å; C86-M88 PolarHBondContact O-N 3.06Å; C86-M88 PolarHBondContact SG-N 3.31Å; C86-M88 VanDerWaalsContact SG-N 3.4Å; C86-C89 VanDerWaalsContact CB-SG 3.59Å; C86-K90 WeakPolarHBondContact O-CA 3.39Å; C86-K90 PolarHBondContact O-N 3.18Å; C86-L91 HydrophobicContact CB-CB 4.47Å; C86-L91 PolarHBondContact N-O 3.41Å; C86-I93 HydrophobicContact CB-CD1 4.26Å
87P92.9Very high89.1Confident24 Ų2457.5 Ų57.516%0.15630%0.295CS..THydrogen-bonded Turntrans-56-34.9175.4-26.633.8000113.6V51 F71 V76 W79 K90V51-P87 HydrophobicContact CG2-CG 4.33Å; F71-P87 HydrophobicContact CE1-CB 4.21Å; F71-P87 HydrophobicContact CE1-CG 4.11Å; F71-P87 HydrophobicContact CZ-CB 4.27Å; F71-P87 HydrophobicContact CZ-CG 4.09Å; V76-P87 HydrophobicContact CG2-CG 4.34Å; W79-P87 HydrophobicContact CD2-CG 4.24Å; W79-P87 HydrophobicContact CG-CG 4.03Å; P87-K90 PolarHBondContact O-NZ 3.01Å
88M92.8Very high88.5Confident105 Ų10559.5 Ų59.552%0.51732%0.322SS..THydrogen-bonded Turntrans-82.9-53.8-174.4-68-71-7600113.5A50 F71 C86A50-M88 HydrophobicContact CB-CG 4.23Å; A50-M88 HydrophobicContact CB-SD 3.45Å; A50-M88 WeakPolarHBondContact CB-SD 3.29Å; F71-M88 HydrophobicContact CE1-CG 3.92Å; F71-M88 HydrophobicContact CZ-CB 4.37Å; F71-M88 HydrophobicContact CZ-CG 3.6Å; C86-M88 PolarHBondContact O-N 3.06Å; C86-M88 PolarHBondContact SG-N 3.31Å; C86-M88 VanDerWaalsContact SG-N 3.4Å
89C94.1Very high87.7Confident60 Ų6058.6 Ų58.641%0.40531%0.312SS..THydrogen-bonded Turntrans-112.13.8-172.963.40000114.6C86 L91C86-C89 VanDerWaalsContact CB-SG 3.59Å; C89-L91 PolarHBondContact O-N 2.96Å
90K92.1Very high86.3Confident129 Ų12963 Ų6356%0.56134%0.338SS*.  trans59.19.9-179.6-47.9-52.8-175.8-165.30115.4C86 P87 N92C86-K90 WeakPolarHBondContact O-CA 3.39Å; C86-K90 PolarHBondContact O-N 3.18Å; P87-K90 PolarHBondContact O-NZ 3.01Å; K90-N92 PolarHBondContact O-N 3.38Å
91L91.3Very high84.8Confident72 Ų7265.2 Ų65.238%0.37735%0.352SS..  trans-57.7128.1175.5-177.970.1000110.5C67 T85 C86 C89 I93 A96C67-L91 HydrophobicContact CB-CB 4.39Å; C67-L91 HydrophobicContact CB-CD2 3.65Å; T85-L91 CarbonylContact C-O 3.59Å; T85-L91 VanDerWaalsContact CA-O 3.29Å; T85-L91 WeakPolarHBondContact CA-O 3.11Å; C86-L91 HydrophobicContact CB-CB 4.47Å; C86-L91 PolarHBondContact N-O 3.41Å; C89-L91 PolarHBondContact O-N 2.96Å; L91-I93 WeakPolarHBondContact O-CD1 3.38Å; L91-I93 PolarHBondContact O-N 3.31Å; L91-A96 HydrophobicContact CD2-CB 4.17Å
92N89.9Confident83.3Confident46 Ų4668.5 Ų68.525%0.24638%0.38CS..BIsolated β-bridgetrans-71.3118.4173.1-172.8-60.8000110.5K90 L94 K95 A96K90-N92 PolarHBondContact O-N 3.38Å; N92-L94 PolarHBondContact OD1-N 3.03Å; N92-L94 VanDerWaalsContact OD1-N 3.08Å; N92-K95 HydrophobicContact CB-CB 4.08Å; N92-K95 PolarHBondContact OD1-N 3.06Å; N92-A96 PolarHBondContact O-N 3.45Å; N92-A96 VanDerWaalsContact O-N 3.15Å
93I89.9Confident82Confident2 Ų265.2 Ų65.21%0.0137%0.366CS..Hα-helixtrans-77.5-34.2-171.6-51.6-59.6000111.5L30 L65 P66 L80 C84 C86 L91 A96 L97L30-I93 HydrophobicContact CD1-CG2 3.82Å; L30-I93 HydrophobicContact CD2-CG2 3.74Å; L30-I93 HydrophobicContact CG-CG2 4.32Å; L65-I93 HydrophobicContact CB-CD1 4.09Å; L65-I93 HydrophobicContact CD1-CD1 3.9Å; L65-I93 HydrophobicContact CD2-CD1 4.46Å; L65-I93 HydrophobicContact CG-CD1 4.37Å; P66-I93 HydrophobicContact CG-CG2 4.07Å; L80-I93 HydrophobicContact CD2-CG1 3.75Å; C84-I93 WeakPolarHBondContact O-CG1 3.36Å; C84-I93 PolarHBondContact O-N 3.3Å; C86-I93 HydrophobicContact CB-CD1 4.26Å; L91-I93 WeakPolarHBondContact O-CD1 3.38Å; L91-I93 PolarHBondContact O-N 3.31Å; I93-A96 PolarHBondContact O-N 3.37Å; I93-L97 HydrophobicContact CG2-CD1 4.25Å; I93-L97 VanDerWaalsContact O-CG 3.27Å; I93-L97 WeakPolarHBondContact O-CG 3.4Å; I93-L97 PolarHBondContact O-N 3.2Å
94L85Confident80.4Confident4 Ų466.5 Ų66.52%0.02138%0.38CS..Hα-helixtrans-66.1-42.1176.3-61-175.7000111.2A26 C84 N92 L97 G98 I99A26-L94 HydrophobicContact CB-CD2 3.53Å; C84-L94 HydrophobicContact CB-CD1 4.09Å; C84-L94 HydrophobicContact CB-CG 4.01Å; N92-L94 PolarHBondContact OD1-N 3.03Å; N92-L94 VanDerWaalsContact OD1-N 3.08Å; L94-L97 PolarHBondContact O-N 3.41Å; L94-G98 PolarHBondContact O-N 3.32Å; L94-I99 PolarHBondContact O-N 3.01Å
95K84.4Confident78.5Confident173 Ų17367.2 Ų67.275%0.75239%0.385SS*.Hα-helixtrans-60.8-45.1174-172.7175.2-178.11760111.4N92 L97 G98N92-K95 HydrophobicContact CB-CB 4.08Å; N92-K95 PolarHBondContact OD1-N 3.06Å; K95-L97 PolarHBondContact O-N 3.25Å; K95-G98 PolarHBondContact O-N 3.26Å
96A85.6Confident76.4Confident49 Ų4970.4 Ų70.441%0.40540%0.404SS..Hα-helixtrans-64.7-25.5178.200000113.3P66 L91 N92 I93 G98P66-A96 HydrophobicContact CB-CB 3.75Å; P66-A96 HydrophobicContact CG-CB 3.93Å; L91-A96 HydrophobicContact CD2-CB 4.17Å; N92-A96 PolarHBondContact O-N 3.45Å; N92-A96 VanDerWaalsContact O-N 3.15Å; I93-A96 PolarHBondContact O-N 3.37Å; A96-G98 VanDerWaalsContact C-N 3.34Å
97L82.2Confident74Confident65 Ų6576.3 Ų76.334%0.3444%0.435SS..THydrogen-bonded Turntrans-87.61.9174.9-67.4174.5000113.7A26 L30 P66 I93 L94 K95 I99A26-L97 HydrophobicContact CB-CD1 4.4Å; L30-L97 HydrophobicContact CD2-CD1 3.87Å; L30-L97 HydrophobicContact CD2-CD2 4.04Å; L30-L97 HydrophobicContact CD2-CG 4.27Å; L30-L97 HydrophobicContact CG-CD1 4.36Å; P66-L97 HydrophobicContact CG-CD2 4.36Å; I93-L97 HydrophobicContact CG2-CD1 4.25Å; I93-L97 VanDerWaalsContact O-CG 3.27Å; I93-L97 WeakPolarHBondContact O-CG 3.4Å; I93-L97 PolarHBondContact O-N 3.2Å; L94-L97 PolarHBondContact O-N 3.41Å; K95-L97 PolarHBondContact O-N 3.25Å; L97-I99 HydrophobicContact CB-CD1 4.04Å; L97-I99 HydrophobicContact CB-CG1 4.18Å; L97-I99 HydrophobicContact CD1-CD1 4.44Å; L97-I99 PolarHBondContact O-N 3.07Å
98G80.1Confident72Confident66 Ų6679.7 Ų79.768%0.6847%0.466SS*.THydrogen-bonded Turntrans71.116.4-177.800000114L94 K95 A96 M100L94-G98 PolarHBondContact O-N 3.32Å; K95-G98 PolarHBondContact O-N 3.26Å; A96-G98 VanDerWaalsContact C-N 3.34Å; G98-M100 PolarHBondContact O-N 3.17Å
99I75.7Confident69.9Low59 Ų5980.6 Ų80.630%0.30348%0.477SS..  trans-93.787.4178.6-56.9169.7000106.7A26 L94 L97 T101A26-I99 HydrophobicContact CB-CD1 3.4Å; L94-I99 PolarHBondContact O-N 3.01Å; L97-I99 HydrophobicContact CB-CD1 4.04Å; L97-I99 HydrophobicContact CB-CG1 4.18Å; L97-I99 HydrophobicContact CD1-CD1 4.44Å; L97-I99 PolarHBondContact O-N 3.07Å; I99-T101 VanDerWaalsContact C-N 3.34Å; I99-T101 HydrophobicContact CG2-CG2 4.36Å; I99-T101 PolarHBondContact O-N 2.94Å
100M61.1Low67.6Low183 Ų18382.6 Ų82.690%0.90149%0.487SS*.  trans-69.492.9174.4-171.1179.7-59.400108.8G98G98-M100 PolarHBondContact O-N 3.17Å
101T57.7Low65.5Low48 Ų4884.7 Ų84.729%0.29450%0.503SS..  trans-86.9116.3162.937.20000106.2L19 I99 L103L19-T101 HydrophobicContact CD1-CG2 4.07Å; I99-T101 VanDerWaalsContact C-N 3.34Å; I99-T101 HydrophobicContact CG2-CG2 4.36Å; I99-T101 PolarHBondContact O-N 2.94Å; T101-L103 PolarHBondContact O-N 3.11Å
102S53.5Low63.4Low124 Ų12488.2 Ų88.287%0.86752%0.522SS*.SBendtrans-6923.617251.40000112.6
103L54.9Low61.5Low58 Ų5892.4 Ų92.430%0.30455%0.549SS..SBendtrans-126121.7-174.1-156.261.8000108.6L15 L19 T101 C105L15-L103 HydrophobicContact CD1-CD2 3.78Å; L15-L103 HydrophobicContact CD2-CD1 4.41Å; L15-L103 HydrophobicContact CD2-CD2 4.14Å; L15-L103 HydrophobicContact CG-CD2 3.89Å; L19-L103 HydrophobicContact CB-CD2 4.25Å; L19-L103 HydrophobicContact CD1-CB 4.17Å; L19-L103 HydrophobicContact CD1-CD2 4.01Å; L19-L103 HydrophobicContact CD2-CB 4.36Å; L19-L103 HydrophobicContact CD2-CD2 3.79Å; L19-L103 HydrophobicContact CD2-CG 4.13Å; L19-L103 HydrophobicContact CG-CD2 4.21Å; T101-L103 PolarHBondContact O-N 3.11Å; L103-C105 PolarHBondContact O-N 2.98Å
104P50.6Low59.9Low91 Ų91100.8 Ų100.859%0.59159%0.588SS**  trans-64.6123.8-171.626.7-31.9000108.4V106P104-V106 PolarHBondContact O-N 3.37Å
105C48.8Very low58.2Low24 Ų24111.8 Ų111.816%0.16263%0.63CS.*SBendtrans-70.169.4159.8-46.60000106.3C84 L103 D107C84-C105 HydrophobicContact CB-CB 4.05Å; L103-C105 PolarHBondContact O-N 2.98Å; C105-D107 PolarHBondContact O-N 2.95Å
106V47.6Very low56.4Low97 Ų97111.9 Ų111.959%0.58864%0.637SS**  trans24.573.4-178.3-64.20000115.7P104 A108P104-V106 PolarHBondContact O-N 3.37Å; V106-A108 PolarHBondContact O-N 3.32Å
107D44Very low54.6Low123 Ų123113.2 Ų113.266%0.65866%0.656SS**  trans-70.581.1144.6-84.8-61.4000106.9C105 V109C105-D107 PolarHBondContact O-N 2.95Å; D107-V109 PolarHBondContact O-N 2.89Å
108A51.8Low52.7Low96 Ų96116.8 Ų116.879%0.79368%0.68SS**THydrogen-bonded Turntrans-68.726.9170.600000112.6V106V106-A108 PolarHBondContact O-N 3.32Å
109V46.8Very low50.7Low124 Ų124116.9 Ų116.975%0.75268%0.681SS**THydrogen-bonded Turntrans-126.4-0.8-179-119.30000114D107D107-V109 PolarHBondContact O-N 2.89Å
110V47.3Very low49.2Very low101 Ų101123.3 Ų123.361%0.61271%0.71SS**SBendtrans-135.457177.8-161.70000112.2
111L48Very low47.9Very low174 Ų174121.4 Ų121.491%0.91171%0.709SS**SBendtrans-134.553.5150-68.3179.2000108.6
112D46Very low47.5Very low145 Ų145125.2 Ų125.278%0.77574%0.738SS**  trans-141.355.9164.7-124.6-56.6000109.5
113V50Low46.7Very low134 Ų134123 Ų12381%0.81274%0.735SS**  trans-12549.5160.4-1680000108.7
114E55.9Low46.1Very low178 Ų178125.7 Ų125.783%0.83276%0.758SS**SBendtrans-131.8132.8150.3-74.2-167.794.200106.3
115R49.5Very low46Very low236 Ų236129.7 Ų129.789%0.89177%0.769SS**  trans100.243.3163.1-146.6168.465.8172.63.3119.2
116L46.7Very low45.6Very low174 Ų174140.2 Ų140.291%0.91181%0.805SS**  trans-103.698.2131.5-72.3178.7000107.8V118L116-V118 PolarHBondContact O-N 3.32Å
117G47.5Very low45.2Very low77 Ų77139.8 Ų139.879%0.79481%0.811SS**  trans-63.5126.6166.600000109.7
118V43.8Very low45.5Very low141 Ų141139 Ų13986%0.85581%0.813SS**  trans-123.697.8157.6178.40000106.6L116L116-V118 PolarHBondContact O-N 3.32Å
119G37.1Very low45Very low68 Ų68141.5 Ų141.570%0.70181%0.813SS**  trans-63.6144.8162.300000110.2
120Q44.3Very low44.7Very low193 Ų193140.6 Ų140.690%0.90281%0.812SS**  trans-53138.3176-60.1163.347.100111.9
121T34.3Very low44.4Very low144 Ų144143.1 Ų143.188%0.88382%0.822SS**  trans-151.2145.1131.952.90000111.8
122S48.1Very low44.7Very low128 Ų128143.2 Ų143.290%0.89582%0.817SS**  trans-44.2150.3-177.8-41.60000119.1
123G37.8Very low44.4Very low78 Ų78143.1 Ų143.180%0.80482%0.817SS**  trans150.6100.9144.300000119.8
124S42.1Very low44.3Very low114 Ų114144.6 Ų144.680%0.79782%0.815SS**  trans83.893.8135.9-142.70000122.6
125Q49.1Very low43.8Very low175 Ų175141.1 Ų141.182%0.81881%0.808SS**  32.2123128.8-55.4179.72.200120.9
126R40.1Very low43.7Very low245 Ų245134.6 Ų134.693%0.92580%0.798SS**  -179.8126.7107.5-98.3174.1-179172.20.6111.8
127A38.3Very low43.3Very low87 Ų87133.9 Ų133.972%0.71979%0.794SS**  trans-93.5-178.4149.700000107.2
128P51.6Low42.7Very low107 Ų107134.4 Ų134.470%0.69579%0.785SS**  cis-152.9-172.214.440.3-15.5000117.3
129L40.3Very low42.5Very low149 Ų149135.4 Ų135.478%0.7879%0.785SS**  trans78.2113.3149.1-56.4-172.8000121.8
130S41.1Very low42.6Very low105 Ų105140.7 Ų140.773%0.73479%0.791SS**  92.2133.5112.5-61.60000112
131D41.3Very low42.8Very low153 Ų153137 Ų13782%0.81878%0.784SS**  -167.515171.6-164.3-114.1000111.5
132Q53Low43Very low176 Ų176133.9 Ų133.982%0.82277%0.773SS**  trans-82.1129.6-177.7-58.3165.211.700109.4
133N40.1Very low42.5Very low144 Ų144136.3 Ų136.377%0.7777%0.77SS**  trans-157.1107.2150.5-151.41.9000113.2
134Q47.8Very low42.3Very low165 Ų165139 Ų13977%0.77177%0.771SS**  trans-105.9139152.9-96.8-80.2-23.400106.4
135P45.6Very low42.8Very low105 Ų105137.7 Ų137.768%0.68277%0.767SS**  trans-135135.2131.328-11.9000113
136S47.7Very low42.7Very low98 Ų98135 Ų13569%0.68577%0.765SS**  trans-57.8145.9156.8-49.20000111
137I38.7Very low42.6Very low159 Ų159135.1 Ų135.182%0.81577%0.765SS**  164.5133.6115.354.2134000113.3
138S35.3Very low43.6Very low88 Ų88137 Ų13762%0.61577%0.768SS**  trans72.4118.1136.7-760000124.6
139L38.4Very low43.5Very low162 Ų162138.1 Ų138.185%0.84878%0.776SS**  75.5117.1121.8-60.2162.7000120.2
140E39.8Very low43.8Very low179 Ų179135.2 Ų135.284%0.83677%0.773SS**  trans-34.2162.7150.6-98.7177.685.500115.7
141P49.1Very low44.1Very low116 Ų116136.5 Ų136.575%0.75377%0.771SS**  -157174.956.638.7-15.4000120.6
142A37.8Very low44.5Very low78 Ų78136.5 Ų136.565%0.64577%0.77SS**  trans70.3146.7149.700000118.6
143E37Very low44.5Very low179 Ų179133.9 Ų133.984%0.83677%0.766SS**  cis-165.3148-4.1-113.1177.990.200104.1
144T34.6Very low45Very low136 Ų136133.2 Ų133.283%0.83477%0.767SS**  -175.6118.6102.2-62.20000108.2
145A51.5Low45Very low85 Ų85129.9 Ų129.970%0.70277%0.767SS**  trans-86.9-168.7167.900000110
146P46.8Very low45.1Very low120 Ų120131.9 Ų131.978%0.77978%0.778SS**  cis-130.5172.5-2528.8-8.2000112.3
147R38.2Very low45Very low246 Ų246132.7 Ų132.793%0.92878%0.778SS**  trans-146.3117.414550.9-176.1166.1-120.3-2.8110.6
148T59.9Low45.7Very low126 Ų126130.2 Ų130.277%0.77378%0.775SS**  trans-73.7161.6168.351.40000109.6
149P49.6Very low46.7Very low132 Ų132136.1 Ų136.186%0.85779%0.79SS**  -136.4149.5101.317.73.1000113.9
150A47Very low47.3Very low87 Ų87137.6 Ų137.672%0.71979%0.789SS**  trans-74.1149.2-175.300000114
151D46.1Very low47.9Very low132 Ų132134.8 Ų134.871%0.70679%0.786SS**  trans23.9114.4135.9-120.7-81.8000118.7T153D151-T153 PolarHBondContact OD1-OG1 2.89Å; D151-T153 VanDerWaalsContact OD1-OG1 3.11Å
152I50Low48.4Very low154 Ų154137.5 Ų137.579%0.7979%0.789SS**  trans-122.392.4154.4-52.3171.9000107.1V154I152-V154 HydrophobicContact CG2-CG1 4.27Å; I152-V154 PolarHBondContact O-N 2.94Å
153T53.7Low49Very low121 Ų121141.9 Ų141.974%0.74280%0.796SS**  trans-70.2116.3167.4-5.60000108.2D151D151-T153 PolarHBondContact OD1-OG1 2.89Å; D151-T153 VanDerWaalsContact OD1-OG1 3.11Å
154V50.7Low50.1Low130 Ų130141 Ų14179%0.78879%0.792SS**  trans-100.2102171.8-71.30000110.2I152 V156I152-V154 HydrophobicContact CG2-CG1 4.27Å; I152-V154 PolarHBondContact O-N 2.94Å; V154-V156 PolarHBondContact O-N 3.31Å
155A48.3Very low50.7Low94 Ų94140 Ų14078%0.77778%0.781SS**  trans-70.9117.1164.800000109.3
156V46.2Very low51Low148 Ų148144.9 Ų144.990%0.89779%0.787SS**  trans-91.3100168.260.50000108.7V154V154-V156 PolarHBondContact O-N 3.31Å
157T46Very low51.8Low114 Ų114144.9 Ų144.970%0.69979%0.785SS**  trans-104.8115.4167.4158.90000108.7
158S54.6Low52.3Low107 Ų107144.4 Ų144.475%0.74880%0.801SS**  trans34.9112.2141.6-55.70000119.2
159K55Low51.9Low213 Ų213145.4 Ų145.493%0.92680%0.803SS**  trans-134.7112.9139.8-71.2-163.8177.9-178.80110.7
160K51.3Low52.1Low192 Ų192146.1 Ų146.184%0.83580%0.8SS**PPolyproline II helixtrans-64.4138.3168.8174.2-179.1-179.8-172.80109.7
161P53.4Low52.3Low120 Ų120149.3 Ų149.378%0.77980%0.804SS**PPolyproline II helixtrans-81.1133.6162.828.5-26.3000110.7
162E59.3Low52.7Low173 Ų173150.4 Ų150.481%0.80881%0.81SS**PPolyproline II helixtrans-75.1142.5-176.6-169.217282.300111.6
163E49.2Very low52.9Low170 Ų170150.1 Ų150.179%0.79481%0.811SS**PPolyproline II helixtrans-68.1122.9174.9-175.6-178.1109.300109.6
164Q60.2Low52.8Low162 Ų162152.1 Ų152.176%0.75782%0.816SS**  trans-109.892.3164.9-68.3-166.98.900108.9
165N47.7Very low53Low113 Ų113153.6 Ų153.660%0.60482%0.818SS**  trans-74.4121.4160.4-175.90.8000108.2
166F58Low53.3Low189 Ų189158.2 Ų158.283%0.82982%0.821SS**  trans-122.7101.3160.5-98.8-86.8000107.8
167T62.7Low53.9Low120 Ų120159.1 Ų159.174%0.73682%0.815SS**  trans-79.8120.8158.213.50000109.2
168N49.6Very low54.6Low236 Ų236163.2 Ų163.2100%1.26283%0.825SS**  -168.70120.2-147.4-4.5000109.3

Retrieved 168 of 168 residues in 785 ms (Link to these results)