A0A096NTK4_PAPAN Loading...

Chromosome 22 open reading frame 15

AlphaFold DB , UniProt , Accession A0A096NTK4, Species PAPAN (Papio anubis, Olive baboon), Gene C22orf15, Length 157 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M76.7Confident76.2Confident64 Ų6448 Ų4832%0.31529%0.287SS..  0127.70-171.8162.180.400107.4N16 T17 S18 N68 E73M1-N16 PolarHBondContact N-OD1 3.25Å; M1-N16 CarbonylContact O-C 3.54Å; M1-N16 WeakPolarHBondContact O-CA 3.2Å; M1-N16 PolarHBondContact O-OD1 3.28Å; M1-T17 WeakPolarHBondContact CB-OG1 3.47Å; M1-T17 WeakPolarHBondContact CE-OG1 3.2Å; M1-T17 WeakPolarHBondContact CG-OG1 3.46Å; M1-T17 PolarHBondContact O-N 2.86Å; M1-T17 PolarHBondContact O-OG1 2.88Å; M1-S18 WeakPolarHBondContact CB-OG 3.47Å; M1-S18 PolarHBondContact N-OG 3.09Å; M1-N68 HydrophobicContact CE-CB 3.21Å; M1-E73 HydrophobicContact CE-CB 4.35Å; M1-E73 HydrophobicContact CG-CB 3.93Å; M1-E73 VanDerWaalsContact CG-CD 3.44Å; M1-E73 HydrophobicContact CG-CG 3.52Å; M1-E73 HydrophobicContact SD-CB 3.8Å; M1-E73 VanDerWaalsContact SD-CD 3.53Å; M1-E73 HydrophobicContact SD-CG 3.87Å
2F77.6Confident76.4Confident121 Ų12148.9 Ų48.953%0.53130%0.297SS..EExtended strand (participates in β ladder)trans-121.7145.7-167.8-59.8-84.4000112.9V15 N16 R74F2-V15 WeakPolarHBondContact CA-O 3.28Å; F2-N16 HydrophobicContact CD1-CB 3.85Å; F2-N16 HydrophobicContact CE1-CB 3.63Å; F2-N16 HydrophobicContact CZ-CB 4.46Å; F2-R74 PolarHBondContact O-N 2.79Å
3I82.4Confident77Confident2 Ų246.3 Ų46.31%0.0128%0.281CS..EExtended strand (participates in β ladder)trans-122.1159.3168.861.3157.6000109.9V5 L14 V15 T17 L42 L71 K72 Y77I3-V5 HydrophobicContact CD1-CG2 3.73Å; I3-V5 HydrophobicContact CG1-CG2 4.29Å; I3-L14 WeakPolarHBondContact O-CA 3.14Å; I3-L14 WeakPolarHBondContact O-CD2 3.48Å; I3-V15 HydrophobicContact CD1-CG2 3.72Å; I3-V15 HydrophobicContact CG1-CG2 3.39Å; I3-V15 PolarHBondContact N-O 2.86Å; I3-V15 PolarHBondContact O-N 2.68Å; I3-T17 HydrophobicContact CB-CG2 4.18Å; I3-T17 HydrophobicContact CD1-CG2 4.19Å; I3-T17 HydrophobicContact CG1-CG2 3.75Å; I3-T17 HydrophobicContact CG2-CG2 3.48Å; I3-T17 VanDerWaalsContact CG2-CG2 3.48Å; I3-L42 HydrophobicContact CD1-CD1 4.43Å; I3-L71 HydrophobicContact CD1-CB 4.24Å; I3-L71 HydrophobicContact CD1-CD1 3.7Å; I3-L71 HydrophobicContact CD1-CD2 4.3Å; I3-L71 HydrophobicContact CD1-CG 4.28Å; I3-K72 WeakPolarHBondContact CG2-O 3.42Å; I3-Y77 HydrophobicContact CB-CD2 4.31Å; I3-Y77 HydrophobicContact CB-CE2 4.46Å; I3-Y77 HydrophobicContact CD1-CD2 3.62Å; I3-Y77 HydrophobicContact CD1-CE2 3.98Å; I3-Y77 HydrophobicContact CD1-CG 4.45Å; I3-Y77 HydrophobicContact CG2-CE2 4.24Å
4K84Confident77.5Confident87 Ų8751.5 Ų51.538%0.37831%0.306SS..EExtended strand (participates in β ladder)trans-104.5118.1175.8-170.7177.1-178.6179.50109.5S12 L14 A75 I76 Y77K4-S12 VanDerWaalsContact CE-CB 3.43Å; K4-S12 WeakPolarHBondContact CE-OG 3.39Å; K4-L14 HydrophobicContact CB-CD2 4Å; K4-L14 HydrophobicContact CG-CD2 4.39Å; K4-A75 PolarHBondContact N-O 3.32Å; K4-I76 WeakPolarHBondContact O-CA 3.44Å; K4-Y77 PolarHBondContact O-N 3.22Å
5V83Confident77.8Confident0 Ų048.5 Ų48.50%029%0.288CS..EExtended strand (participates in β ladder)trans-105.7122176179.30000109.1I3 S12 V13 V15 L28 L42 Y77 L79I3-V5 HydrophobicContact CD1-CG2 3.73Å; I3-V5 HydrophobicContact CG1-CG2 4.29Å; V5-S12 CarbonylContact O-C 3.43Å; V5-S12 VanDerWaalsContact O-CA 3.23Å; V5-S12 WeakPolarHBondContact O-CA 3.25Å; V5-V13 HydrophobicContact CB-CG1 3.95Å; V5-V13 PolarHBondContact N-O 2.89Å; V5-V13 PolarHBondContact O-N 3.36Å; V5-V15 HydrophobicContact CG2-CG2 3.79Å; V5-L28 HydrophobicContact CB-CD2 3.98Å; V5-L28 HydrophobicContact CG1-CD2 3.82Å; V5-L28 HydrophobicContact CG2-CD2 4.13Å; V5-L42 HydrophobicContact CG1-CD2 3.62Å; V5-L42 HydrophobicContact CG2-CD1 4.34Å; V5-L42 HydrophobicContact CG2-CD2 4.11Å; V5-Y77 CarbonylContact C-O 3.59Å; V5-Y77 WeakPolarHBondContact CA-O 3.46Å; V5-L79 HydrophobicContact CG1-CB 3.82Å
6M83.3Confident78.3Confident44 Ų4448.6 Ų48.622%0.21729%0.286CS..EExtended strand (participates in β ladder)trans-97.5137.1178.1-63.8-177.560.300110.6C11 I76 Y77 V78 L79M6-C11 WeakPolarHBondContact CA-O 3.22Å; M6-I76 HydrophobicContact CG-CG2 4.2Å; M6-I76 HydrophobicContact SD-CG2 3.8Å; M6-Y77 PolarHBondContact N-O 3.01Å; M6-V78 WeakPolarHBondContact O-CA 3.43Å; M6-L79 PolarHBondContact O-N 3.31Å
7F79.9Confident78.3Confident36 Ų3645.7 Ų45.716%0.15827%0.27CS..EExtended strand (participates in β ladder)trans-146.4138.7177.259-84.6000110C11 V13 K31 A32 L79F7-C11 HydrophobicContact CD1-CB 4.35Å; F7-C11 HydrophobicContact CD2-CB 3.76Å; F7-C11 HydrophobicContact CE1-CB 4.04Å; F7-C11 HydrophobicContact CE2-CB 3.43Å; F7-C11 VanDerWaalsContact CE2-CB 3.43Å; F7-C11 HydrophobicContact CG-CB 4.22Å; F7-C11 HydrophobicContact CZ-CB 3.58Å; F7-C11 PolarHBondContact N-O 3.18Å; F7-C11 VanDerWaalsContact O-CB 3.23Å; F7-C11 WeakPolarHBondContact O-CB 3.38Å; F7-C11 PolarHBondContact O-N 2.93Å; F7-C11 VanDerWaalsContact O-O 3.1Å; F7-V13 HydrophobicContact CD1-CG1 4.24Å; F7-V13 HydrophobicContact CE1-CB 3.93Å; F7-V13 HydrophobicContact CE1-CG1 3.77Å; F7-K31 WeakPolarHBondContact CE2-O 3.43Å; F7-K31 HydrophobicContact CZ-CB 4.4Å; F7-A32 HydrophobicContact CD2-CB 4.11Å; F7-A32 HydrophobicContact CE2-CB 4.49Å; F7-A32 HydrophobicContact CG-CB 4.39Å; F7-L79 HydrophobicContact CB-CB 3.99Å; F7-L79 HydrophobicContact CB-CD2 4.09Å
8G68.6Low78.3Confident33 Ų3346.3 Ų46.334%0.3428%0.276SS..THydrogen-bonded Turntrans58.4-173.5-17700000113.4G10 W102G8-G10 PolarHBondContact O-N 2.99Å; G8-W102 PolarHBondContact O-NE1 3.16Å; G8-W102 VanDerWaalsContact O-NE1 3.12Å
9A66.5Low78.3Confident23 Ų2346.4 Ų46.419%0.1928%0.279CS..THydrogen-bonded Turntrans-79.186.8-177.600000112.8Y98 I105A9-Y98 WeakPolarHBondContact CA-OH 3.05Å; A9-Y98 HydrophobicContact CB-CD1 3.92Å; A9-Y98 HydrophobicContact CB-CD2 3.57Å; A9-Y98 HydrophobicContact CB-CE1 3.41Å; A9-Y98 VanDerWaalsContact CB-CE1 3.41Å; A9-Y98 HydrophobicContact CB-CE2 3.01Å; A9-Y98 HydrophobicContact CB-CG 4.01Å; A9-Y98 VanDerWaalsContact CB-OH 3.25Å; A9-Y98 WeakPolarHBondContact CB-OH 3.28Å; A9-Y98 PolarHBondContact N-OH 2.92Å; A9-Y98 PolarHBondContact O-OH 3.39Å; A9-I105 HydrophobicContact CB-CD1 4.34Å
10G64.9Low78.4Confident61 Ų6150.8 Ų50.863%0.62929%0.291SS*.THydrogen-bonded Turntrans99.4-2.4166.800000114.4G8G8-G10 PolarHBondContact O-N 2.99Å
11C71.3Confident78.5Confident57 Ų5748.4 Ų48.439%0.38528%0.277SS..EExtended strand (participates in β ladder)trans-75.8133.2173-54.60000109.4M6 F7M6-C11 WeakPolarHBondContact CA-O 3.22Å; F7-C11 HydrophobicContact CD1-CB 4.35Å; F7-C11 HydrophobicContact CD2-CB 3.76Å; F7-C11 HydrophobicContact CE1-CB 4.04Å; F7-C11 HydrophobicContact CE2-CB 3.43Å; F7-C11 VanDerWaalsContact CE2-CB 3.43Å; F7-C11 HydrophobicContact CG-CB 4.22Å; F7-C11 HydrophobicContact CZ-CB 3.58Å; F7-C11 PolarHBondContact N-O 3.18Å; F7-C11 VanDerWaalsContact O-CB 3.23Å; F7-C11 WeakPolarHBondContact O-CB 3.38Å; F7-C11 PolarHBondContact O-N 2.93Å; F7-C11 VanDerWaalsContact O-O 3.1Å
12S78.4Confident78.5Confident59 Ų5947.6 Ų47.641%0.41328%0.276SS..EExtended strand (participates in β ladder)trans-137.6140.9172.568.70000109.9K4 V5K4-S12 VanDerWaalsContact CE-CB 3.43Å; K4-S12 WeakPolarHBondContact CE-OG 3.39Å; V5-S12 CarbonylContact O-C 3.43Å; V5-S12 VanDerWaalsContact O-CA 3.23Å; V5-S12 WeakPolarHBondContact O-CA 3.25Å
13V84.1Confident78.8Confident15 Ų1546.7 Ų46.79%0.09128%0.276CS..EExtended strand (participates in β ladder)trans-121.5136.2175.262.60000109.2V5 F7 V15 L28 K31V5-V13 HydrophobicContact CB-CG1 3.95Å; V5-V13 PolarHBondContact N-O 2.89Å; V5-V13 PolarHBondContact O-N 3.36Å; F7-V13 HydrophobicContact CD1-CG1 4.24Å; F7-V13 HydrophobicContact CE1-CB 3.93Å; F7-V13 HydrophobicContact CE1-CG1 3.77Å; V13-V15 HydrophobicContact CG1-CG1 4.16Å; V13-V15 HydrophobicContact CG2-CG1 4.13Å; V13-L28 HydrophobicContact CG1-CD2 3.57Å; V13-K31 HydrophobicContact CG2-CG 4.27Å
14L84.5Confident78.8Confident119 Ų11946.8 Ų46.862%0.62328%0.277SS*.EExtended strand (participates in β ladder)trans-87.8123.3168.7-74.7169.6000108.2I3 K4I3-L14 WeakPolarHBondContact O-CA 3.14Å; I3-L14 WeakPolarHBondContact O-CD2 3.48Å; K4-L14 HydrophobicContact CB-CD2 4Å; K4-L14 HydrophobicContact CG-CD2 4.39Å
15V82.7Confident78.7Confident6 Ų643.2 Ų43.24%0.03626%0.262CS..EExtended strand (participates in β ladder)trans-119142.2177.5-65.60000110.5F2 I3 V5 V13 L24 L28F2-V15 WeakPolarHBondContact CA-O 3.28Å; I3-V15 HydrophobicContact CD1-CG2 3.72Å; I3-V15 HydrophobicContact CG1-CG2 3.39Å; I3-V15 PolarHBondContact N-O 2.86Å; I3-V15 PolarHBondContact O-N 2.68Å; V5-V15 HydrophobicContact CG2-CG2 3.79Å; V13-V15 HydrophobicContact CG1-CG1 4.16Å; V13-V15 HydrophobicContact CG2-CG1 4.13Å; V15-L24 HydrophobicContact CB-CD1 4.09Å; V15-L24 HydrophobicContact CB-CG 4.34Å; V15-L24 HydrophobicContact CG2-CD1 3.8Å; V15-L24 HydrophobicContact CG2-CG 4.23Å; V15-L28 HydrophobicContact CG1-CD2 3.84Å; V15-L28 HydrophobicContact CG1-CG 4.37Å
16N84.6Confident78.6Confident50 Ų5045.8 Ų45.827%0.26728%0.284SS..EExtended strand (participates in β ladder)trans-83116.2178.9-170.6-9000109.6M1 F2 S18 C19M1-N16 PolarHBondContact N-OD1 3.25Å; M1-N16 CarbonylContact O-C 3.54Å; M1-N16 WeakPolarHBondContact O-CA 3.2Å; M1-N16 PolarHBondContact O-OD1 3.28Å; F2-N16 HydrophobicContact CD1-CB 3.85Å; F2-N16 HydrophobicContact CE1-CB 3.63Å; F2-N16 HydrophobicContact CZ-CB 4.46Å; N16-S18 PolarHBondContact O-N 3.24Å; N16-S18 WeakPolarHBondContact OD1-CA 3.42Å; N16-S18 WeakPolarHBondContact OD1-CB 3.4Å; N16-S18 PolarHBondContact OD1-N 3.27Å; N16-S18 PolarHBondContact OD1-OG 2.75Å; N16-C19 WeakPolarHBondContact O-CB 3.31Å; N16-C19 PolarHBondContact O-N 3.36Å
17T78.8Confident78.6Confident0 Ų047 Ų470%029%0.289CS..THydrogen-bonded Turntrans-74.6-12.1176.855.10000112.7M1 I3 C19 G67 N68 L71M1-T17 WeakPolarHBondContact CB-OG1 3.47Å; M1-T17 WeakPolarHBondContact CE-OG1 3.2Å; M1-T17 WeakPolarHBondContact CG-OG1 3.46Å; M1-T17 PolarHBondContact O-N 2.86Å; M1-T17 PolarHBondContact O-OG1 2.88Å; I3-T17 HydrophobicContact CB-CG2 4.18Å; I3-T17 HydrophobicContact CD1-CG2 4.19Å; I3-T17 HydrophobicContact CG1-CG2 3.75Å; I3-T17 HydrophobicContact CG2-CG2 3.48Å; I3-T17 VanDerWaalsContact CG2-CG2 3.48Å; T17-C19 PolarHBondContact O-N 3.03Å; T17-G67 CarbonylContact O-C 3.42Å; T17-G67 WeakPolarHBondContact O-CA 3.43Å; T17-G67 PolarHBondContact O-N 2.85Å; T17-N68 PolarHBondContact O-N 2.81Å; T17-L71 HydrophobicContact CG2-CB 3.86Å; T17-L71 HydrophobicContact CG2-CD1 4.2Å
18S78.5Confident78.7Confident56 Ų5645.4 Ų45.439%0.39228%0.281SS..THydrogen-bonded Turntrans-76.81.5169.6-48.30000112.7M1 N16 M66M1-S18 WeakPolarHBondContact CB-OG 3.47Å; M1-S18 PolarHBondContact N-OG 3.09Å; N16-S18 PolarHBondContact O-N 3.24Å; N16-S18 WeakPolarHBondContact OD1-CA 3.42Å; N16-S18 WeakPolarHBondContact OD1-CB 3.4Å; N16-S18 PolarHBondContact OD1-N 3.27Å; N16-S18 PolarHBondContact OD1-OG 2.75Å; S18-M66 WeakPolarHBondContact O-CE 3.23Å
19C77.3Confident79.2Confident49 Ų4946.4 Ų46.433%0.33128%0.275SS..SBendtrans-90.9156.8171.8-64.10000111N16 T17 G67N16-C19 WeakPolarHBondContact O-CB 3.31Å; N16-C19 PolarHBondContact O-N 3.36Å; T17-C19 PolarHBondContact O-N 3.03Å; C19-G67 PolarHBondContact O-N 3.41Å
20R80.9Confident79.8Confident134 Ų13452.4 Ų52.451%0.50630%0.299SS..BIsolated β-bridgetrans-58.8143.9171.1-68-176.3176.9-166.92.3110.3V22 N23 L24 T63 M66R20-V22 VanDerWaalsContact C-N 3.26Å; R20-V22 HydrophobicContact CB-CG2 3.95Å; R20-V22 PolarHBondContact O-N 2.9Å; R20-N23 PolarHBondContact O-N 3.35Å; R20-L24 PolarHBondContact O-N 3.04Å; R20-L24 VanDerWaalsContact O-N 3.08Å; R20-T63 WeakPolarHBondContact CD-O 3.46Å; R20-M66 HydrophobicContact CG-SD 4.09Å
21L80Confident80.5Confident0 Ų055.1 Ų55.10%029%0.294CS..Hα-helixtrans-59.7-38.1-176.4-165.352.5000112.2N23 L24 T25 L52 W62 T65 L70L21-N23 VanDerWaalsContact C-N 3.32Å; L21-N23 PolarHBondContact O-N 2.83Å; L21-L24 HydrophobicContact CD1-CD2 4.23Å; L21-L24 WeakPolarHBondContact O-CB 3.43Å; L21-L24 PolarHBondContact O-N 2.84Å; L21-L24 VanDerWaalsContact O-N 3.15Å; L21-T25 WeakPolarHBondContact O-CB 3.05Å; L21-T25 PolarHBondContact O-N 2.8Å; L21-T25 PolarHBondContact O-OG1 3.12Å; L21-L52 HydrophobicContact CD1-CD2 3.63Å; L21-W62 HydrophobicContact CD2-CD2 3.92Å; L21-W62 HydrophobicContact CD2-CE3 4.18Å; L21-W62 HydrophobicContact CD2-CH2 3.43Å; L21-W62 VanDerWaalsContact CD2-CH2 3.43Å; L21-W62 HydrophobicContact CD2-CZ2 3.08Å; L21-W62 HydrophobicContact CD2-CZ3 3.95Å; L21-W62 HydrophobicContact CG-CZ2 3.92Å; L21-T65 WeakPolarHBondContact CB-O 3.42Å; L21-T65 HydrophobicContact CD2-CG2 3.86Å; L21-T65 PolarHBondContact N-O 2.77Å; L21-L70 HydrophobicContact CD2-CD1 3.4Å; L21-L70 VanDerWaalsContact CD2-CD1 3.4Å
22V78.3Confident80.6Confident48 Ų4853.7 Ų53.729%0.29129%0.286SS..Hα-helixtrans-57.9-39.8174.2-66.70000113.7R20 A26 T63R20-V22 VanDerWaalsContact C-N 3.26Å; R20-V22 HydrophobicContact CB-CG2 3.95Å; R20-V22 PolarHBondContact O-N 2.9Å; V22-A26 VanDerWaalsContact O-CB 3.32Å; V22-A26 WeakPolarHBondContact O-CB 3.25Å; V22-A26 PolarHBondContact O-N 3.25Å; V22-T63 HydrophobicContact CG1-CG2 3.92Å
23N83.3Confident80.4Confident101 Ų10153.6 Ų53.654%0.5429%0.294SS..Hα-helixtrans-73.3-37.5178.2-68.71.6000110.6R20 L21 H27R20-N23 PolarHBondContact O-N 3.35Å; L21-N23 VanDerWaalsContact C-N 3.32Å; L21-N23 PolarHBondContact O-N 2.83Å; N23-H27 VanDerWaalsContact O-CB 3.27Å; N23-H27 WeakPolarHBondContact O-CB 3.37Å; N23-H27 PolarHBondContact O-N 3Å
24L82.2Confident79.9Confident5 Ų555 Ų553%0.02630%0.301CS..Hα-helixtrans-64.5-48.2176.4-175.5142.8000110.9V15 R20 L21 H27 L28 L52 L71V15-L24 HydrophobicContact CB-CD1 4.09Å; V15-L24 HydrophobicContact CB-CG 4.34Å; V15-L24 HydrophobicContact CG2-CD1 3.8Å; V15-L24 HydrophobicContact CG2-CG 4.23Å; R20-L24 PolarHBondContact O-N 3.04Å; R20-L24 VanDerWaalsContact O-N 3.08Å; L21-L24 HydrophobicContact CD1-CD2 4.23Å; L21-L24 WeakPolarHBondContact O-CB 3.43Å; L21-L24 PolarHBondContact O-N 2.84Å; L21-L24 VanDerWaalsContact O-N 3.15Å; L24-H27 PolarHBondContact O-N 3.3Å; L24-L28 HydrophobicContact CD2-CD1 3.61Å; L24-L28 HydrophobicContact CD2-CG 4.4Å; L24-L28 HydrophobicContact CG-CD1 4.41Å; L24-L28 VanDerWaalsContact O-CG 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.42Å; L24-L28 PolarHBondContact O-N 2.88Å; L24-L52 HydrophobicContact CD2-CD1 4.15Å; L24-L52 HydrophobicContact CD2-CD2 4.2Å; L24-L71 HydrophobicContact CD1-CD1 3.94Å; L24-L71 HydrophobicContact CD2-CD1 4.15Å
25T81.2Confident79.3Confident11 Ų1152 Ų527%0.06729%0.288CS..Hα-helixtrans-59.9-47.4176.3-59.90000111.3L21 H27 L28 R29 I40 L52L21-T25 WeakPolarHBondContact O-CB 3.05Å; L21-T25 PolarHBondContact O-N 2.8Å; L21-T25 PolarHBondContact O-OG1 3.12Å; T25-H27 PolarHBondContact O-N 3.33Å; T25-L28 PolarHBondContact O-N 3.2Å; T25-R29 VanDerWaalsContact O-CG 3.3Å; T25-R29 WeakPolarHBondContact O-CG 3.23Å; T25-R29 PolarHBondContact O-N 3.06Å; T25-I40 HydrophobicContact CG2-CD1 3.84Å; T25-I40 HydrophobicContact CG2-CG1 4.09Å; T25-L52 HydrophobicContact CG2-CB 4.49Å
26A81.8Confident78.5Confident55 Ų5556.1 Ų56.146%0.45532%0.315SS..Hα-helixtrans-61.2-42.7176.600000112.3V22 R29 Q30V22-A26 VanDerWaalsContact O-CB 3.32Å; V22-A26 WeakPolarHBondContact O-CB 3.25Å; V22-A26 PolarHBondContact O-N 3.25Å; A26-R29 PolarHBondContact O-N 3.43Å; A26-Q30 WeakPolarHBondContact O-CB 3.47Å; A26-Q30 PolarHBondContact O-N 3.32Å
27H83.1Confident77.8Confident70 Ų7060.8 Ų60.832%0.32434%0.34SS..Hα-helixtrans-65.2-41.1178.3-168.771.3000112.3N23 L24 T25 Q30 K31N23-H27 VanDerWaalsContact O-CB 3.27Å; N23-H27 WeakPolarHBondContact O-CB 3.37Å; N23-H27 PolarHBondContact O-N 3Å; L24-H27 PolarHBondContact O-N 3.3Å; T25-H27 PolarHBondContact O-N 3.33Å; H27-Q30 PolarHBondContact O-N 3.31Å; H27-K31 WeakPolarHBondContact O-CB 3.19Å; H27-K31 WeakPolarHBondContact O-CG 3.46Å; H27-K31 PolarHBondContact O-N 2.67Å
28L81.8Confident77.3Confident1 Ų160.9 Ų60.91%0.00534%0.341CS..Hα-helixtrans-64.1-42.1175.4-72.1176.6000111.6V5 V13 V15 L24 T25 K31 A32 I40 L42 L52 L79V5-L28 HydrophobicContact CB-CD2 3.98Å; V5-L28 HydrophobicContact CG1-CD2 3.82Å; V5-L28 HydrophobicContact CG2-CD2 4.13Å; V13-L28 HydrophobicContact CG1-CD2 3.57Å; V15-L28 HydrophobicContact CG1-CD2 3.84Å; V15-L28 HydrophobicContact CG1-CG 4.37Å; L24-L28 HydrophobicContact CD2-CD1 3.61Å; L24-L28 HydrophobicContact CD2-CG 4.4Å; L24-L28 HydrophobicContact CG-CD1 4.41Å; L24-L28 VanDerWaalsContact O-CG 3.32Å; L24-L28 WeakPolarHBondContact O-CG 3.42Å; L24-L28 PolarHBondContact O-N 2.88Å; T25-L28 PolarHBondContact O-N 3.2Å; L28-K31 PolarHBondContact O-N 2.88Å; L28-A32 WeakPolarHBondContact O-CB 3.48Å; L28-A32 PolarHBondContact O-N 3.14Å; L28-I40 HydrophobicContact CB-CD1 4.18Å; L28-L42 HydrophobicContact CD1-CD1 4.41Å; L28-L42 HydrophobicContact CD1-CD2 4.24Å; L28-L52 HydrophobicContact CD1-CD1 3.61Å; L28-L79 HydrophobicContact CD1-CD1 4.41Å
29R79.3Confident77Confident55 Ų5560.8 Ų60.821%0.20834%0.338CS..Hα-helixtrans-60.7-46.9175.1-72.5170.3171.4-160.3-9.8111.7T25 A26 K31 A32 G33 L34 P36 A38 I40 E53T25-R29 VanDerWaalsContact O-CG 3.3Å; T25-R29 WeakPolarHBondContact O-CG 3.23Å; T25-R29 PolarHBondContact O-N 3.06Å; A26-R29 PolarHBondContact O-N 3.43Å; R29-K31 PolarHBondContact O-N 2.82Å; R29-A32 PolarHBondContact O-N 3.49Å; R29-G33 PolarHBondContact O-N 3.28Å; R29-L34 PolarHBondContact O-N 3.4Å; R29-P36 VanDerWaalsContact CZ-O 3.23Å; R29-P36 PolarHBondContact NH1-O 2.78Å; R29-P36 PolarHBondContact NH2-O 2.99Å; R29-A38 PolarHBondContact NH2-O 2.85Å; R29-I40 HydrophobicContact CG-CD1 3.97Å; R29-E53 IonicContact CZ-OE1 2.64Å; R29-E53 IonicContact NE-OE1 3.63Å; R29-E53 IonicContact NH2-OE1 3.73Å; R29-E53 PolarHBondContact NH2-OE1 2.82Å; R29-E53 IonicContact NH2-OE2 3.68Å
30Q79Confident77.1Confident149 Ų14958.4 Ų58.470%0.69632%0.322SS*.Hα-helixtrans-60.1-46.5177.5-171.9-171.211.900111.4A26 H27 G33A26-Q30 WeakPolarHBondContact O-CB 3.47Å; A26-Q30 PolarHBondContact O-N 3.32Å; H27-Q30 PolarHBondContact O-N 3.31Å; Q30-G33 PolarHBondContact O-N 2.79Å
31K79.9Confident77.3Confident118 Ų11852.5 Ų52.551%0.51330%0.302SS..Hα-helixtrans-71.6-34.4-178.1-73.8-70.2-175.5-174.90113.4F7 V13 H27 L28 R29 G33F7-K31 WeakPolarHBondContact CE2-O 3.43Å; F7-K31 HydrophobicContact CZ-CB 4.4Å; V13-K31 HydrophobicContact CG2-CG 4.27Å; H27-K31 WeakPolarHBondContact O-CB 3.19Å; H27-K31 WeakPolarHBondContact O-CG 3.46Å; H27-K31 PolarHBondContact O-N 2.67Å; L28-K31 PolarHBondContact O-N 2.88Å; R29-K31 PolarHBondContact O-N 2.82Å; K31-G33 VanDerWaalsContact C-N 3.32Å
32A73.3Confident77.5Confident27 Ų2752.5 Ų52.522%0.22330%0.302CS..Hα-helixtrans-85.8-4177.800000113.2F7 L28 R29 L34 L79F7-A32 HydrophobicContact CD2-CB 4.11Å; F7-A32 HydrophobicContact CE2-CB 4.49Å; F7-A32 HydrophobicContact CG-CB 4.39Å; L28-A32 WeakPolarHBondContact O-CB 3.48Å; L28-A32 PolarHBondContact O-N 3.14Å; R29-A32 PolarHBondContact O-N 3.49Å; A32-L34 VanDerWaalsContact C-N 3.26Å; A32-L34 HydrophobicContact CB-CD1 3.8Å; A32-L34 HydrophobicContact CB-CG 3.72Å; A32-L34 PolarHBondContact O-N 3.26Å; A32-L79 HydrophobicContact CB-CD2 3.53Å
33G73.3Confident77.7Confident57 Ų5751.6 Ų51.659%0.58830%0.295SS*.THydrogen-bonded Turntrans62.932.1-177.800000113R29 Q30 K31R29-G33 PolarHBondContact O-N 3.28Å; Q30-G33 PolarHBondContact O-N 2.79Å; K31-G33 VanDerWaalsContact C-N 3.32Å
34L74.6Confident77.7Confident44 Ų4447.1 Ų47.123%0.2327%0.273CS..  trans-85.4145.7-175.9-64174.5000111.2R29 A32 A38 I40 L79R29-L34 PolarHBondContact O-N 3.4Å; A32-L34 VanDerWaalsContact C-N 3.26Å; A32-L34 HydrophobicContact CB-CD1 3.8Å; A32-L34 HydrophobicContact CB-CG 3.72Å; A32-L34 PolarHBondContact O-N 3.26Å; L34-A38 HydrophobicContact CB-CB 4.47Å; L34-I40 HydrophobicContact CD1-CG2 3.44Å; L34-I40 VanDerWaalsContact CD1-CG2 3.44Å; L34-L79 HydrophobicContact CD1-CD2 4.02Å
35P71.4Confident77.4Confident55 Ų5551.5 Ų51.536%0.35729%0.293SS..  trans-58.1150.6173.7-10.317.1000111.6D37 A38P35-D37 PolarHBondContact O-N 3.05Å; P35-A38 HydrophobicContact CB-CB 4.21Å; P35-A38 HydrophobicContact CG-CB 4.04Å; P35-A38 VanDerWaalsContact O-CB 3.32Å; P35-A38 WeakPolarHBondContact O-CB 3.32Å; P35-A38 PolarHBondContact O-N 3.14Å; P35-A38 VanDerWaalsContact O-N 3.1Å
36P65.6Low77.1Confident93 Ų9354.9 Ų54.960%0.60431%0.311SS*.THydrogen-bonded Turntrans-64.3-21.817926.4-34000113.5R29R29-P36 VanDerWaalsContact CZ-O 3.23Å; R29-P36 PolarHBondContact NH1-O 2.78Å; R29-P36 PolarHBondContact NH2-O 2.99Å
37D69.4Low76.6Confident148 Ų14854.3 Ų54.379%0.79131%0.31SS*.THydrogen-bonded Turntrans-97.34.4179.1-53.6-41.3000112.9P35P35-D37 PolarHBondContact O-N 3.05Å
38A69.4Low76.5Confident2 Ų255.5 Ų55.52%0.01732%0.319CS..  trans-81.1124.3-179.700000110.8R29 L34 P35 I40 R81R29-A38 PolarHBondContact NH2-O 2.85Å; L34-A38 HydrophobicContact CB-CB 4.47Å; P35-A38 HydrophobicContact CB-CB 4.21Å; P35-A38 HydrophobicContact CG-CB 4.04Å; P35-A38 VanDerWaalsContact O-CB 3.32Å; P35-A38 WeakPolarHBondContact O-CB 3.32Å; P35-A38 PolarHBondContact O-N 3.14Å; P35-A38 VanDerWaalsContact O-N 3.1Å; A38-I40 PolarHBondContact O-N 2.97Å; A38-R81 HydrophobicContact CB-CG 4.31Å
39T72.9Confident76.4Confident54 Ų5461.1 Ų61.133%0.33135%0.349SS..EExtended strand (participates in β ladder)trans-71121.7172.9-52.80000111.7E53 R81 T82T39-E53 WeakPolarHBondContact CA-OE1 3.25Å; T39-E53 WeakPolarHBondContact CA-OE2 3.05Å; T39-E53 HydrophobicContact CG2-CB 4.16Å; T39-E53 PolarHBondContact OG1-OE2 3.26Å; T39-R81 WeakPolarHBondContact O-CA 3.45Å; T39-T82 PolarHBondContact O-N 3.43Å; T39-T82 PolarHBondContact O-OG1 3.4Å
40I79.3Confident76.4Confident0 Ų059.7 Ų59.70%035%0.346CS..EExtended strand (participates in β ladder)trans-116.5142.4-179.965.5162.4000113.1T25 L28 R29 L34 A38 L52 E53 L79T25-I40 HydrophobicContact CG2-CD1 3.84Å; T25-I40 HydrophobicContact CG2-CG1 4.09Å; L28-I40 HydrophobicContact CB-CD1 4.18Å; R29-I40 HydrophobicContact CG-CD1 3.97Å; L34-I40 HydrophobicContact CD1-CG2 3.44Å; L34-I40 VanDerWaalsContact CD1-CG2 3.44Å; A38-I40 PolarHBondContact O-N 2.97Å; I40-L52 HydrophobicContact CD1-CD1 3.89Å; I40-L52 HydrophobicContact CG1-CB 4.19Å; I40-L52 HydrophobicContact CG1-CD1 4.28Å; I40-L52 PolarHBondContact O-N 3.31Å; I40-L52 VanDerWaalsContact O-N 3.17Å; I40-E53 PolarHBondContact N-OE1 3.43Å; I40-L79 HydrophobicContact CB-CD1 4.13Å; I40-L79 HydrophobicContact CD1-CD1 4.09Å
41A83.9Confident76.4Confident10 Ų1055.1 Ų55.18%0.08333%0.33CS..EExtended strand (participates in β ladder)trans-135.5156.5175.400000110.3V50 V80A41-V50 CarbonylContact C-O 3.5Å; A41-V50 WeakPolarHBondContact CA-O 3.24Å; A41-V80 PolarHBondContact N-O 3.34Å; A41-V80 PolarHBondContact O-N 3.34Å; A41-V80 VanDerWaalsContact O-O 3.12Å
42L85.4Confident76.3Confident0 Ų049.5 Ų49.50%031%0.306CS..EExtended strand (participates in β ladder)trans-107.7119.5173.5-68.2-179.7000109.5I3 V5 L28 V50 L52 L71 Y77 L79I3-L42 HydrophobicContact CD1-CD1 4.43Å; V5-L42 HydrophobicContact CG1-CD2 3.62Å; V5-L42 HydrophobicContact CG2-CD1 4.34Å; V5-L42 HydrophobicContact CG2-CD2 4.11Å; L28-L42 HydrophobicContact CD1-CD1 4.41Å; L28-L42 HydrophobicContact CD1-CD2 4.24Å; L42-V50 HydrophobicContact CB-CB 4.47Å; L42-V50 PolarHBondContact N-O 2.77Å; L42-V50 PolarHBondContact O-N 2.84Å; L42-L52 HydrophobicContact CD1-CD1 3.82Å; L42-L52 HydrophobicContact CD1-CD2 4Å; L42-L52 HydrophobicContact CD1-CG 4.19Å; L42-L52 HydrophobicContact CD2-CD1 4.27Å; L42-L52 HydrophobicContact CG-CD1 3.63Å; L42-L52 HydrophobicContact CG-CD2 4.31Å; L42-L52 HydrophobicContact CG-CG 3.98Å; L42-L71 HydrophobicContact CD1-CD1 4.08Å; L42-L71 HydrophobicContact CD1-CD2 3.55Å; L42-L71 HydrophobicContact CD1-CG 4.47Å; L42-Y77 HydrophobicContact CB-CD1 3.77Å; L42-Y77 HydrophobicContact CB-CG 4.22Å; L42-Y77 HydrophobicContact CD1-CG 4.39Å; L42-L79 HydrophobicContact CD2-CB 4.27Å; L42-L79 HydrophobicContact CD2-CD1 3.77Å
43L81.9Confident76Confident28 Ų2850.5 Ų50.515%0.14731%0.306CS..EExtended strand (participates in β ladder)trans-84.3118.2169.9-178.867.9000108.9G47 L49 Y77 V78 V80L43-G47 WeakPolarHBondContact CD1-O 3.31Å; L43-L49 HydrophobicContact CB-CD2 3.87Å; L43-L49 HydrophobicContact CD1-CD2 3.68Å; L43-L49 HydrophobicContact CD1-CG 3.8Å; L43-L49 HydrophobicContact CG-CD2 4.37Å; L43-Y77 CarbonylContact O-C 3.59Å; L43-Y77 VanDerWaalsContact O-CA 3.31Å; L43-Y77 WeakPolarHBondContact O-CA 3.22Å; L43-V78 HydrophobicContact CB-CB 4.32Å; L43-V78 PolarHBondContact N-O 3.14Å; L43-V78 PolarHBondContact O-N 2.83Å; L43-V80 HydrophobicContact CB-CG2 3.99Å
44A82.6Confident75.3Confident8 Ų853.4 Ų53.47%0.06630%0.304CS..EExtended strand (participates in β ladder)trans-76.7163.5174.500000111.9D46 G47 N48 Y77A44-D46 WeakPolarHBondContact CB-OD1 3.19Å; A44-D46 PolarHBondContact O-N 3.19Å; A44-G47 PolarHBondContact O-N 2.81Å; A44-N48 HydrophobicContact CB-CB 4.39Å; A44-N48 WeakPolarHBondContact CB-O 3.46Å; A44-N48 PolarHBondContact N-O 3.34Å; A44-Y77 HydrophobicContact CB-CD1 3.94Å; A44-Y77 HydrophobicContact CB-CE1 3.58Å
45E76.1Confident74.1Confident97 Ų9757.5 Ų57.545%0.45333%0.326SS..THydrogen-bonded Turntrans-59.3-32.1176-166.4175.696.200114.2G47 W109 C113E45-G47 PolarHBondContact O-N 2.9Å; E45-W109 HydrophobicContact CB-CH2 4.04Å; E45-W109 HydrophobicContact CB-CZ2 3.87Å; E45-W109 HydrophobicContact CG-CH2 4.24Å; E45-W109 HydrophobicContact CG-CZ2 3.83Å; E45-C113 HydrophobicContact CG-CB 3.76Å; E45-C113 WeakPolarHBondContact CG-SG 3.47Å
46D75.8Confident72.9Confident81 Ų8163.6 Ų63.643%0.43336%0.355SS..THydrogen-bonded Turntrans-76.62.1175.958.110.2000113.1A44 N48 K72A44-D46 WeakPolarHBondContact CB-OD1 3.19Å; A44-D46 PolarHBondContact O-N 3.19Å; D46-N48 VanDerWaalsContact C-N 3.29Å; D46-N48 VanDerWaalsContact OD1-CB 3.25Å; D46-N48 WeakPolarHBondContact OD1-CB 3.47Å; D46-N48 PolarHBondContact OD1-N 2.87Å; D46-N48 PolarHBondContact OD1-ND2 3.36Å; D46-N48 VanDerWaalsContact OD1-ND2 3.14Å; D46-N48 PolarHBondContact OD2-ND2 3.41Å; D46-K72 IonicContact OD2-NZ 2.73Å; D46-K72 PolarHBondContact OD2-NZ 3.08Å
47G71.7Confident71.9Confident43 Ų4368.4 Ų68.444%0.44337%0.366SS..SBendtrans82.22.1-177.700000114.1L43 A44 E45L43-G47 WeakPolarHBondContact CD1-O 3.31Å; A44-G47 PolarHBondContact O-N 2.81Å; E45-G47 PolarHBondContact O-N 2.9Å
48N80.7Confident71Confident96 Ų9666.9 Ų66.951%0.51335%0.354SS..  trans-75.1128.1176.5-68.6-45.4000110.9A44 D46A44-N48 HydrophobicContact CB-CB 4.39Å; A44-N48 WeakPolarHBondContact CB-O 3.46Å; A44-N48 PolarHBondContact N-O 3.34Å; D46-N48 VanDerWaalsContact C-N 3.29Å; D46-N48 VanDerWaalsContact OD1-CB 3.25Å; D46-N48 WeakPolarHBondContact OD1-CB 3.47Å; D46-N48 PolarHBondContact OD1-N 2.87Å; D46-N48 PolarHBondContact OD1-ND2 3.36Å; D46-N48 VanDerWaalsContact OD1-ND2 3.14Å; D46-N48 PolarHBondContact OD2-ND2 3.41Å
49L78.2Confident70.2Confident119 Ų11969 Ų6962%0.62338%0.377SS*.EExtended strand (participates in β ladder)trans-86.7118.4172.3-77.5165.6000109.7L43L43-L49 HydrophobicContact CB-CD2 3.87Å; L43-L49 HydrophobicContact CD1-CD2 3.68Å; L43-L49 HydrophobicContact CD1-CG 3.8Å; L43-L49 HydrophobicContact CG-CD2 4.37Å
50V80.8Confident69.3Low25 Ų2570.1 Ų70.115%0.15239%0.391CS..EExtended strand (participates in β ladder)trans-100.5108173.4-178.30000107.8A41 L42 L52 L70 L71 Y77A41-V50 CarbonylContact C-O 3.5Å; A41-V50 WeakPolarHBondContact CA-O 3.24Å; L42-V50 HydrophobicContact CB-CB 4.47Å; L42-V50 PolarHBondContact N-O 2.77Å; L42-V50 PolarHBondContact O-N 2.84Å; V50-L52 PolarHBondContact O-N 2.9Å; V50-L70 HydrophobicContact CG1-CB 3.94Å; V50-L70 HydrophobicContact CG1-CD1 4.39Å; V50-L71 HydrophobicContact CG1-CD2 4.36Å; V50-Y77 HydrophobicContact CG2-CE1 4.39Å
51S79Confident68.1Low52 Ų5272.9 Ų72.936%0.36441%0.414SS..EExtended strand (participates in β ladder)trans-69.2131174-161.50000109.9E53S51-E53 VanDerWaalsContact C-N 3.34Å; S51-E53 PolarHBondContact OG-N 3.4Å; S51-E53 PolarHBondContact OG-O 3.49Å
52L76.3Confident67Low1 Ų174 Ų741%0.00542%0.416CS..SBendtrans-93.8-2.7172.7-65.6-179.1000112.4L21 L24 T25 L28 I40 L42 V50 W62L21-L52 HydrophobicContact CD1-CD2 3.63Å; L24-L52 HydrophobicContact CD2-CD1 4.15Å; L24-L52 HydrophobicContact CD2-CD2 4.2Å; T25-L52 HydrophobicContact CG2-CB 4.49Å; L28-L52 HydrophobicContact CD1-CD1 3.61Å; I40-L52 HydrophobicContact CD1-CD1 3.89Å; I40-L52 HydrophobicContact CG1-CB 4.19Å; I40-L52 HydrophobicContact CG1-CD1 4.28Å; I40-L52 PolarHBondContact O-N 3.31Å; I40-L52 VanDerWaalsContact O-N 3.17Å; L42-L52 HydrophobicContact CD1-CD1 3.82Å; L42-L52 HydrophobicContact CD1-CD2 4Å; L42-L52 HydrophobicContact CD1-CG 4.19Å; L42-L52 HydrophobicContact CD2-CD1 4.27Å; L42-L52 HydrophobicContact CG-CD1 3.63Å; L42-L52 HydrophobicContact CG-CD2 4.31Å; L42-L52 HydrophobicContact CG-CG 3.98Å; V50-L52 PolarHBondContact O-N 2.9Å; L52-W62 VanDerWaalsContact O-CZ2 3.32Å; L52-W62 WeakPolarHBondContact O-CZ2 3.37Å; L52-W62 PolarHBondContact O-NE1 3.37Å
53E67.3Low65.8Low48 Ų4876.9 Ų76.922%0.22443%0.434CS..  trans-123.5101.3170.9-77.9167.5-131.400106.9R29 T39 I40 S51R29-E53 IonicContact CZ-OE1 2.64Å; R29-E53 IonicContact NE-OE1 3.63Å; R29-E53 IonicContact NH2-OE1 3.73Å; R29-E53 PolarHBondContact NH2-OE1 2.82Å; R29-E53 IonicContact NH2-OE2 3.68Å; T39-E53 WeakPolarHBondContact CA-OE1 3.25Å; T39-E53 WeakPolarHBondContact CA-OE2 3.05Å; T39-E53 HydrophobicContact CG2-CB 4.16Å; T39-E53 PolarHBondContact OG1-OE2 3.26Å; I40-E53 PolarHBondContact N-OE1 3.43Å; S51-E53 VanDerWaalsContact C-N 3.34Å; S51-E53 PolarHBondContact OG-N 3.4Å; S51-E53 PolarHBondContact OG-O 3.49Å
54E59Low65Low117 Ų11782.5 Ų82.555%0.54746%0.46SS..  trans-93135.3166.3-163.6157-13100107.7W62E54-W62 HydrophobicContact CB-CD2 4.3Å; E54-W62 HydrophobicContact CB-CE3 3.91Å; E54-W62 HydrophobicContact CB-CH2 3.88Å; E54-W62 HydrophobicContact CB-CZ2 4.26Å; E54-W62 HydrophobicContact CB-CZ3 3.7Å; E54-W62 VanDerWaalsContact OE2-CZ3 3.28Å; E54-W62 WeakPolarHBondContact OE2-CZ3 3.23Å
55D48.7Very low64.6Low130 Ų13083.7 Ų83.770%0.69547%0.466SS*.  trans-41.9144.4-167-64.4-87.5000113.4K57 E58D55-K57 PolarHBondContact O-N 2.9Å; D55-E58 PolarHBondContact O-N 2.94Å
56L46.4Very low64.7Low184 Ų18482.4 Ų82.496%0.96346%0.461SS*.G310 helixtrans-44.5-8.1-179.4-95.584000116.7
57K44.9Very low64.6Low193 Ų19378.5 Ų78.584%0.83944%0.44SS*.G310 helixtrans-70.5-33176.8-102.2-174.8164.8-1710114.6D55D55-K57 PolarHBondContact O-N 2.9Å
58E51.3Low65Low116 Ų11680 Ų8054%0.54244%0.438SS..G310 helixtrans-108.128.3-174.8-100.778.2-155.700113.4D55 A60 A61 W62D55-E58 PolarHBondContact O-N 2.94Å; E58-A60 PolarHBondContact O-N 3.46Å; E58-A61 PolarHBondContact O-N 2.79Å; E58-W62 PolarHBondContact O-N 2.79Å
59G52.1Low64.9Low48 Ų4879.3 Ų79.350%0.49544%0.441SS..Hα-helixtrans-55.2-23.3-170.500000116.8T63G59-T63 PolarHBondContact O-OG1 2.83Å; G59-T63 VanDerWaalsContact O-OG1 3.08Å
60A53.2Low64.8Low76 Ų7676.8 Ų76.863%0.62843%0.427SS*.Hα-helixtrans-84.1-30.8179.100000114E58 T63E58-A60 PolarHBondContact O-N 3.46Å; A60-T63 PolarHBondContact O-OG1 3.43Å
61A55.8Low64.7Low59 Ų5975.7 Ų75.749%0.48842%0.421SS..Hα-helixtrans-80.2-38.2178.200000110.8E58 T63 Q64 T65E58-A61 PolarHBondContact O-N 2.79Å; A61-T63 PolarHBondContact O-N 3.31Å; A61-Q64 PolarHBondContact O-N 2.93Å; A61-T65 PolarHBondContact O-N 3.12Å; A61-T65 VanDerWaalsContact O-N 3.07Å; A61-T65 PolarHBondContact O-OG1 2.91Å; A61-T65 VanDerWaalsContact O-OG1 3.13Å
62W59.4Low64.7Low33 Ų3379.4 Ų79.413%0.12543%0.431CS..Hα-helixtrans-65.3-34.7-176.3-162.8-109.1000114.5L21 L52 E54 E58 Q64 T65 L70L21-W62 HydrophobicContact CD2-CD2 3.92Å; L21-W62 HydrophobicContact CD2-CE3 4.18Å; L21-W62 HydrophobicContact CD2-CH2 3.43Å; L21-W62 VanDerWaalsContact CD2-CH2 3.43Å; L21-W62 HydrophobicContact CD2-CZ2 3.08Å; L21-W62 HydrophobicContact CD2-CZ3 3.95Å; L21-W62 HydrophobicContact CG-CZ2 3.92Å; L52-W62 VanDerWaalsContact O-CZ2 3.32Å; L52-W62 WeakPolarHBondContact O-CZ2 3.37Å; L52-W62 PolarHBondContact O-NE1 3.37Å; E54-W62 HydrophobicContact CB-CD2 4.3Å; E54-W62 HydrophobicContact CB-CE3 3.91Å; E54-W62 HydrophobicContact CB-CH2 3.88Å; E54-W62 HydrophobicContact CB-CZ2 4.26Å; E54-W62 HydrophobicContact CB-CZ3 3.7Å; E54-W62 VanDerWaalsContact OE2-CZ3 3.28Å; E54-W62 WeakPolarHBondContact OE2-CZ3 3.23Å; E58-W62 PolarHBondContact O-N 2.79Å; W62-Q64 PolarHBondContact O-N 2.7Å; W62-T65 PolarHBondContact O-N 2.73Å; W62-L70 HydrophobicContact CH2-CD1 3.45Å; W62-L70 VanDerWaalsContact CH2-CD1 3.45Å; W62-L70 HydrophobicContact CZ2-CD1 4.25Å; W62-L70 HydrophobicContact CZ3-CD1 3.92Å
63T60.7Low64.5Low61 Ų6184 Ų8437%0.37445%0.452SS..THydrogen-bonded Turntrans-65.6-18.8175.732.20000112.9R20 V22 G59 A60 A61R20-T63 WeakPolarHBondContact CD-O 3.46Å; V22-T63 HydrophobicContact CG1-CG2 3.92Å; G59-T63 PolarHBondContact O-OG1 2.83Å; G59-T63 VanDerWaalsContact O-OG1 3.08Å; A60-T63 PolarHBondContact O-OG1 3.43Å; A61-T63 PolarHBondContact O-N 3.31Å
64Q64.1Low64.5Low145 Ų14591.7 Ų91.768%0.67848%0.479SS*.THydrogen-bonded Turntrans-103.1-14.9176.8-56-17118.800112.9A61 W62 M66A61-Q64 PolarHBondContact O-N 2.93Å; W62-Q64 PolarHBondContact O-N 2.7Å; Q64-M66 PolarHBondContact O-N 2.84Å
65T75.5Confident65.3Low33 Ų3387.4 Ų87.420%0.20246%0.463CS..  trans-60.9126.8176.3-58.20000110.6L21 A61 W62 L70L21-T65 WeakPolarHBondContact CB-O 3.42Å; L21-T65 HydrophobicContact CD2-CG2 3.86Å; L21-T65 PolarHBondContact N-O 2.77Å; A61-T65 PolarHBondContact O-N 3.12Å; A61-T65 VanDerWaalsContact O-N 3.07Å; A61-T65 PolarHBondContact O-OG1 2.91Å; A61-T65 VanDerWaalsContact O-OG1 3.13Å; W62-T65 PolarHBondContact O-N 2.73Å; T65-L70 HydrophobicContact CG2-CD1 4.44Å
66M77.6Confident66.8Low70 Ų7083.7 Ų83.735%0.34544%0.443SS..BIsolated β-bridgetrans-85.5143.6175.9-67.5-66.6-83.600109.6S18 R20 Q64 N68 S69S18-M66 WeakPolarHBondContact O-CE 3.23Å; R20-M66 HydrophobicContact CG-SD 4.09Å; Q64-M66 PolarHBondContact O-N 2.84Å; M66-N68 WeakPolarHBondContact CB-OD1 3.48Å; M66-N68 PolarHBondContact O-N 2.76Å; M66-N68 VanDerWaalsContact O-N 3.14Å; M66-S69 VanDerWaalsContact O-CB 3.32Å; M66-S69 WeakPolarHBondContact O-CB 3.33Å; M66-S69 PolarHBondContact O-N 2.8Å; M66-S69 PolarHBondContact O-OG 2.98Å
67G74.9Confident68.4Low0 Ų075.1 Ų75.10%040%0.398CS..Hα-helixtrans-59-29.4-178.700000113.3T17 C19 S69 L70 L71T17-G67 CarbonylContact O-C 3.42Å; T17-G67 WeakPolarHBondContact O-CA 3.43Å; T17-G67 PolarHBondContact O-N 2.85Å; C19-G67 PolarHBondContact O-N 3.41Å; G67-S69 PolarHBondContact O-N 2.83Å; G67-L70 PolarHBondContact O-N 2.78Å; G67-L71 VanDerWaalsContact O-CB 3.24Å; G67-L71 WeakPolarHBondContact O-CB 3.18Å; G67-L71 WeakPolarHBondContact O-CG 3.33Å; G67-L71 PolarHBondContact O-N 3.02Å
68N78.8Confident70.2Confident73 Ų7366.2 Ų66.239%0.3936%0.36SS..Hα-helixtrans-69.4-16.2176.868.5-8.7000114.7M1 T17 M66 L70M1-N68 HydrophobicContact CE-CB 3.21Å; T17-N68 PolarHBondContact O-N 2.81Å; M66-N68 WeakPolarHBondContact CB-OD1 3.48Å; M66-N68 PolarHBondContact O-N 2.76Å; M66-N68 VanDerWaalsContact O-N 3.14Å; N68-L70 VanDerWaalsContact C-N 3.28Å
69S78.8Confident71.7Confident83 Ų8361.4 Ų61.458%0.5834%0.337SS*.Hα-helixtrans-70.8-29.3176-55.70000111.5M66 G67M66-S69 VanDerWaalsContact O-CB 3.32Å; M66-S69 WeakPolarHBondContact O-CB 3.33Å; M66-S69 PolarHBondContact O-N 2.8Å; M66-S69 PolarHBondContact O-OG 2.98Å; G67-S69 PolarHBondContact O-N 2.83Å
70L75.2Confident73Confident65 Ų6561.3 Ų61.334%0.3433%0.327SS..Hα-helixtrans-110-27.6-177.5-60.5177.2000113.2L21 V50 W62 T65 G67 N68L21-L70 HydrophobicContact CD2-CD1 3.4Å; L21-L70 VanDerWaalsContact CD2-CD1 3.4Å; V50-L70 HydrophobicContact CG1-CB 3.94Å; V50-L70 HydrophobicContact CG1-CD1 4.39Å; W62-L70 HydrophobicContact CH2-CD1 3.45Å; W62-L70 VanDerWaalsContact CH2-CD1 3.45Å; W62-L70 HydrophobicContact CZ2-CD1 4.25Å; W62-L70 HydrophobicContact CZ3-CD1 3.92Å; T65-L70 HydrophobicContact CG2-CD1 4.44Å; G67-L70 PolarHBondContact O-N 2.78Å; N68-L70 VanDerWaalsContact C-N 3.28Å
71L80.3Confident74.1Confident3 Ų361.3 Ų61.32%0.01631%0.311CS..SBendtrans-107.4122.4-171.6-56.7166.4000110.4I3 T17 L24 L42 V50 G67 Y77I3-L71 HydrophobicContact CD1-CB 4.24Å; I3-L71 HydrophobicContact CD1-CD1 3.7Å; I3-L71 HydrophobicContact CD1-CD2 4.3Å; I3-L71 HydrophobicContact CD1-CG 4.28Å; T17-L71 HydrophobicContact CG2-CB 3.86Å; T17-L71 HydrophobicContact CG2-CD1 4.2Å; L24-L71 HydrophobicContact CD1-CD1 3.94Å; L24-L71 HydrophobicContact CD2-CD1 4.15Å; L42-L71 HydrophobicContact CD1-CD1 4.08Å; L42-L71 HydrophobicContact CD1-CD2 3.55Å; L42-L71 HydrophobicContact CD1-CG 4.47Å; V50-L71 HydrophobicContact CG1-CD2 4.36Å; G67-L71 VanDerWaalsContact O-CB 3.24Å; G67-L71 WeakPolarHBondContact O-CB 3.18Å; G67-L71 WeakPolarHBondContact O-CG 3.33Å; G67-L71 PolarHBondContact O-N 3.02Å; L71-Y77 WeakPolarHBondContact CA-OH 3.38Å; L71-Y77 HydrophobicContact CB-CE2 4.26Å; L71-Y77 HydrophobicContact CD2-CD1 4.22Å; L71-Y77 HydrophobicContact CD2-CD2 4.38Å; L71-Y77 HydrophobicContact CD2-CE1 3.76Å; L71-Y77 HydrophobicContact CD2-CE2 3.94Å
72K77.8Confident74.4Confident130 Ų13062.2 Ų62.257%0.56531%0.31SS*.  trans-68.3132.7175.3-68.5176.7-177.3166.80109.1I3 D46 A75 Y77I3-K72 WeakPolarHBondContact CG2-O 3.42Å; D46-K72 IonicContact OD2-NZ 2.73Å; D46-K72 PolarHBondContact OD2-NZ 3.08Å; K72-A75 HydrophobicContact CB-CB 4.05Å; K72-A75 WeakPolarHBondContact O-CB 3.18Å; K72-A75 PolarHBondContact O-N 2.79Å; K72-Y77 PolarHBondContact N-OH 2.84Å
73E72.5Confident74.4Confident98 Ų9866.1 Ų66.146%0.45833%0.332SS..THydrogen-bonded Turntrans-58.6143176.1177.5176.7-178.900111M1 A75M1-E73 HydrophobicContact CE-CB 4.35Å; M1-E73 HydrophobicContact CG-CB 3.93Å; M1-E73 VanDerWaalsContact CG-CD 3.44Å; M1-E73 HydrophobicContact CG-CG 3.52Å; M1-E73 HydrophobicContact SD-CB 3.8Å; M1-E73 VanDerWaalsContact SD-CD 3.53Å; M1-E73 HydrophobicContact SD-CG 3.87Å; E73-A75 PolarHBondContact O-N 3.19Å
74R67.3Low73.8Confident209 Ų20966.5 Ų66.579%0.78934%0.338SS*.THydrogen-bonded Turntrans5911.5177.9-65.6156.9-169.6-140.33.3114.9F2F2-R74 PolarHBondContact O-N 2.79Å
75A76.8Confident72.8Confident26 Ų2667.6 Ų67.622%0.21534%0.34CS..  trans-80.6153.1172.700000111.7K4 K72 E73 Y77K4-A75 PolarHBondContact N-O 3.32Å; K72-A75 HydrophobicContact CB-CB 4.05Å; K72-A75 WeakPolarHBondContact O-CB 3.18Å; K72-A75 PolarHBondContact O-N 2.79Å; E73-A75 PolarHBondContact O-N 3.19Å; A75-Y77 HydrophobicContact CB-CD2 4.24Å; A75-Y77 HydrophobicContact CB-CE2 3.58Å
76I78.8Confident71.2Confident53 Ų5376.9 Ų76.927%0.27237%0.372SS..EExtended strand (participates in β ladder)trans-98.4128.5172.8-58.3174.9000107.5K4 M6 W109K4-I76 WeakPolarHBondContact O-CA 3.44Å; M6-I76 HydrophobicContact CG-CG2 4.2Å; M6-I76 HydrophobicContact SD-CG2 3.8Å; I76-W109 HydrophobicContact CB-CZ2 4.49Å; I76-W109 HydrophobicContact CG2-CZ2 4.26Å
77Y81.6Confident69.4Low4 Ų477.3 Ų77.32%0.01637%0.373CS..EExtended strand (participates in β ladder)trans-120147.8177.7-69.8-90000110.3I3 K4 V5 M6 L42 L43 A44 V50 L71 K72 A75I3-Y77 HydrophobicContact CB-CD2 4.31Å; I3-Y77 HydrophobicContact CB-CE2 4.46Å; I3-Y77 HydrophobicContact CD1-CD2 3.62Å; I3-Y77 HydrophobicContact CD1-CE2 3.98Å; I3-Y77 HydrophobicContact CD1-CG 4.45Å; I3-Y77 HydrophobicContact CG2-CE2 4.24Å; K4-Y77 PolarHBondContact O-N 3.22Å; V5-Y77 CarbonylContact C-O 3.59Å; V5-Y77 WeakPolarHBondContact CA-O 3.46Å; M6-Y77 PolarHBondContact N-O 3.01Å; L42-Y77 HydrophobicContact CB-CD1 3.77Å; L42-Y77 HydrophobicContact CB-CG 4.22Å; L42-Y77 HydrophobicContact CD1-CG 4.39Å; L43-Y77 CarbonylContact O-C 3.59Å; L43-Y77 VanDerWaalsContact O-CA 3.31Å; L43-Y77 WeakPolarHBondContact O-CA 3.22Å; A44-Y77 HydrophobicContact CB-CD1 3.94Å; A44-Y77 HydrophobicContact CB-CE1 3.58Å; V50-Y77 HydrophobicContact CG2-CE1 4.39Å; L71-Y77 WeakPolarHBondContact CA-OH 3.38Å; L71-Y77 HydrophobicContact CB-CE2 4.26Å; L71-Y77 HydrophobicContact CD2-CD1 4.22Å; L71-Y77 HydrophobicContact CD2-CD2 4.38Å; L71-Y77 HydrophobicContact CD2-CE1 3.76Å; L71-Y77 HydrophobicContact CD2-CE2 3.94Å; K72-Y77 PolarHBondContact N-OH 2.84Å; A75-Y77 HydrophobicContact CB-CD2 4.24Å; A75-Y77 HydrophobicContact CB-CE2 3.58Å
78V82.7Confident67.6Low6 Ų686.2 Ų86.24%0.03641%0.407CS..EExtended strand (participates in β ladder)trans-105.5125170.8-178.80000108.6M6 L43 V80 W102 W109M6-V78 WeakPolarHBondContact O-CA 3.43Å; L43-V78 HydrophobicContact CB-CB 4.32Å; L43-V78 PolarHBondContact N-O 3.14Å; L43-V78 PolarHBondContact O-N 2.83Å; V78-V80 HydrophobicContact CG1-CG2 4.49Å; V78-V80 PolarHBondContact O-N 3.34Å; V78-W102 HydrophobicContact CG1-CH2 4.3Å; V78-W102 HydrophobicContact CG1-CZ2 3.67Å; V78-W109 HydrophobicContact CG2-CE3 4.39Å; V78-W109 HydrophobicContact CG2-CH2 4.11Å; V78-W109 HydrophobicContact CG2-CZ3 4.08Å
79L82.6Confident65.2Low14 Ų1489 Ų897%0.07343%0.426CS..EExtended strand (participates in β ladder)trans-73.3123.1174.8-174.265.2000109.7V5 M6 F7 L28 A32 L34 I40 L42V5-L79 HydrophobicContact CG1-CB 3.82Å; M6-L79 PolarHBondContact O-N 3.31Å; F7-L79 HydrophobicContact CB-CB 3.99Å; F7-L79 HydrophobicContact CB-CD2 4.09Å; L28-L79 HydrophobicContact CD1-CD1 4.41Å; A32-L79 HydrophobicContact CB-CD2 3.53Å; L34-L79 HydrophobicContact CD1-CD2 4.02Å; I40-L79 HydrophobicContact CB-CD1 4.13Å; I40-L79 HydrophobicContact CD1-CD1 4.09Å; L42-L79 HydrophobicContact CD2-CB 4.27Å; L42-L79 HydrophobicContact CD2-CD1 3.77Å
80V79.5Confident62.9Low46 Ų4694.9 Ų94.928%0.27944%0.436SS..EExtended strand (participates in β ladder)trans-120.2133.7178.1-174.20000108.7A41 L43 V78A41-V80 PolarHBondContact N-O 3.34Å; A41-V80 PolarHBondContact O-N 3.34Å; A41-V80 VanDerWaalsContact O-O 3.12Å; L43-V80 HydrophobicContact CB-CG2 3.99Å; V78-V80 HydrophobicContact CG1-CG2 4.49Å; V78-V80 PolarHBondContact O-N 3.34Å
81R76.1Confident60.9Low77 Ų7796.3 Ų96.329%0.29145%0.451SS..EExtended strand (participates in β ladder)trans-93.6127169.2-178.4-172.8179.8-147.2-1.4108.9A38 T39 I83 E87A38-R81 HydrophobicContact CB-CG 4.31Å; T39-R81 WeakPolarHBondContact O-CA 3.45Å; R81-I83 PolarHBondContact O-N 2.85Å; R81-E87 IonicContact CZ-OE1 3.74Å; R81-E87 IonicContact NH1-OE1 3.56Å; R81-E87 IonicContact NH2-OE1 2.97Å; R81-E87 PolarHBondContact NH2-OE1 2.99Å; R81-E87 IonicContact NH2-OE2 3.31Å; R81-E87 PolarHBondContact NH2-OE2 3.33Å
82T62.1Low58.9Low77 Ų77101.6 Ų101.647%0.47249%0.486SS..EExtended strand (participates in β ladder)trans-83.5109.9173-15.40000108.6T39 S84T39-T82 PolarHBondContact O-N 3.43Å; T39-T82 PolarHBondContact O-OG1 3.4Å; T82-S84 PolarHBondContact O-N 2.86Å
83I59.6Low57.4Low115 Ų115100.6 Ų100.659%0.5949%0.492SS*.  trans-87.1108.4174.9-54173.8000107.3R81 E87R81-I83 PolarHBondContact O-N 2.85Å; I83-E87 HydrophobicContact CG2-CB 4.22Å
84S46.8Very low55.9Low70 Ų70100.6 Ų100.649%0.4951%0.509SS..  trans-71.6150.8175.878.40000110.6T82 R86 E87T82-S84 PolarHBondContact O-N 2.86Å; S84-R86 PolarHBondContact O-N 3.17Å; S84-E87 PolarHBondContact O-N 3.32Å
85K43.9Very low54.6Low167 Ų16795.9 Ų95.973%0.72650%0.498SS*.G310 helixtrans-55.1-21.3-178.9-163.9-178.6179.6-177.30113.5E87K85-E87 VanDerWaalsContact C-N 3.3Å
86R40.8Very low53.1Low228 Ų22898.1 Ų98.186%0.8651%0.512SS*.G310 helixtrans-70.6-25.3178.2-161.3176.3-156.7-179.55.4112.7S84 R88S84-R86 PolarHBondContact O-N 3.17Å; R86-R88 VanDerWaalsContact C-N 3.27Å; R86-R88 PolarHBondContact O-N 2.95Å
87E41.2Very low51.9Low79 Ų79100.6 Ų100.637%0.36953%0.531SS..G310 helixtrans-94.242.9177.6-156.3164.1161.400111.3R81 I83 S84 K85R81-E87 IonicContact CZ-OE1 3.74Å; R81-E87 IonicContact NH1-OE1 3.56Å; R81-E87 IonicContact NH2-OE1 2.97Å; R81-E87 PolarHBondContact NH2-OE1 2.99Å; R81-E87 IonicContact NH2-OE2 3.31Å; R81-E87 PolarHBondContact NH2-OE2 3.33Å; I83-E87 HydrophobicContact CG2-CB 4.22Å; S84-E87 PolarHBondContact O-N 3.32Å; K85-E87 VanDerWaalsContact C-N 3.3Å
88R36.4Very low50.3Low188 Ų188105.7 Ų105.771%0.70955%0.551SS**G310 helixtrans-96.2-0.7168.7-82.1-173.6-177.1155.62.1113.2R86 W90R86-R88 VanDerWaalsContact C-N 3.27Å; R86-R88 PolarHBondContact O-N 2.95Å; R88-W90 VanDerWaalsContact C-N 3.28Å
89T27.9Very low48.5Very low131 Ų131108.9 Ų108.980%0.80456%0.563SS**SBendtrans-78.8-14.9179.3-340000112.4
90W30.8Very low46.9Very low207 Ų207116.3 Ų116.378%0.78459%0.589SS**SBendtrans-87.2120.2166.6-85.1109.2000109.3R88R88-W90 VanDerWaalsContact C-N 3.28Å
91S33.1Very low45.7Very low95 Ų95117.6 Ų117.666%0.66460%0.598SS**  trans-39.5133.6166.2-580000109.1
92P39.4Very low44.5Very low114 Ų114117.5 Ų117.574%0.7460%0.597SS**  trans-50.8122.3177.620.4-30.4000106.8A94P92-A94 PolarHBondContact O-N 2.95Å
93P44.7Very low43.9Very low108 Ų108118 Ų11870%0.70160%0.595SS**  trans-54.1124.2178.820.7-29.6000105.3M95P93-M95 WeakPolarHBondContact O-CA 3.32Å; P93-M95 PolarHBondContact O-N 3.46Å
94A42.7Very low43.7Very low98 Ų98116.9 Ų116.981%0.8159%0.594SS**  trans-43.3109.6178.400000106.6P92 S96P92-A94 PolarHBondContact O-N 2.95Å; A94-S96 VanDerWaalsContact C-N 3.33Å; A94-S96 PolarHBondContact O-N 2.68Å
95M40.1Very low44Very low111 Ų111116.8 Ų116.855%0.54759%0.588SS.*  trans-71.796.8-153.4-136.3-176.5151.700105.4P93 W99P93-M95 WeakPolarHBondContact O-CA 3.32Å; P93-M95 PolarHBondContact O-N 3.46Å; M95-W99 VanDerWaalsContact CB-CD1 3.44Å; M95-W99 HydrophobicContact CB-CG 4.39Å; M95-W99 HydrophobicContact CE-CD2 3.23Å; M95-W99 HydrophobicContact CE-CE3 3.26Å; M95-W99 HydrophobicContact CE-CG 3.85Å; M95-W99 HydrophobicContact CE-CH2 3.56Å; M95-W99 HydrophobicContact CE-CZ2 3.54Å; M95-W99 HydrophobicContact CE-CZ3 3.43Å; M95-W99 VanDerWaalsContact CE-CZ3 3.43Å; M95-W99 HydrophobicContact CG-CD2 4.02Å; M95-W99 HydrophobicContact CG-CG 3.83Å; M95-W99 HydrophobicContact CG-CZ2 4.34Å; M95-W99 VanDerWaalsContact CG-NE1 3.34Å; M95-W99 PolarHBondContact O-NE1 3.39Å; M95-W99 VanDerWaalsContact O-NE1 3.08Å; M95-W99 HydrophobicContact SD-CD2 3.9Å; M95-W99 HydrophobicContact SD-CE3 4.4Å; M95-W99 HydrophobicContact SD-CG 4.37Å; M95-W99 HydrophobicContact SD-CH2 4.02Å; M95-W99 HydrophobicContact SD-CZ2 3.46Å; M95-W99 WeakPolarHBondContact SD-CZ2 3.48Å; M95-W99 HydrophobicContact SD-CZ3 4.46Å
96S44.5Very low44.3Very low73 Ų73110 Ų11051%0.5156%0.56SS.*  trans-52132.4-173.4165.70000110.5A94 Y98 W99A94-S96 VanDerWaalsContact C-N 3.33Å; A94-S96 PolarHBondContact O-N 2.68Å; S96-Y98 CarbonylContact O-C 3.5Å; S96-Y98 PolarHBondContact O-N 3.46Å; S96-W99 PolarHBondContact O-N 3.21Å
97P53.6Low44.8Very low105 Ų105104.7 Ų104.768%0.68255%0.545SS*.THydrogen-bonded Turntrans-44-27.3-176.5-29.533.7000115.4W99 R100P97-W99 VanDerWaalsContact C-N 3.32Å; P97-W99 PolarHBondContact O-N 3.47Å; P97-R100 PolarHBondContact O-N 3.39Å
98Y48.3Very low45.3Very low111 Ų111104.6 Ų104.644%0.43555%0.553SS.*Hα-helixtrans-53.5-32.4170.7-168-107.7000116.1A9 S96 R100 T101 W102A9-Y98 WeakPolarHBondContact CA-OH 3.05Å; A9-Y98 HydrophobicContact CB-CD1 3.92Å; A9-Y98 HydrophobicContact CB-CD2 3.57Å; A9-Y98 HydrophobicContact CB-CE1 3.41Å; A9-Y98 VanDerWaalsContact CB-CE1 3.41Å; A9-Y98 HydrophobicContact CB-CE2 3.01Å; A9-Y98 HydrophobicContact CB-CG 4.01Å; A9-Y98 VanDerWaalsContact CB-OH 3.25Å; A9-Y98 WeakPolarHBondContact CB-OH 3.28Å; A9-Y98 PolarHBondContact N-OH 2.92Å; A9-Y98 PolarHBondContact O-OH 3.39Å; S96-Y98 CarbonylContact O-C 3.5Å; S96-Y98 PolarHBondContact O-N 3.46Å; Y98-R100 VanDerWaalsContact C-N 3.28Å; Y98-R100 PolarHBondContact O-N 2.85Å; Y98-T101 WeakPolarHBondContact O-CB 3.5Å; Y98-T101 PolarHBondContact O-N 3.29Å; Y98-W102 PolarHBondContact O-N 3.08Å
99W44.8Very low45.8Very low73 Ų7397.5 Ų97.528%0.27753%0.526SS..Hα-helixtrans-67.4-29.9177.477.1-99.1000112.1M95 S96 P97 W102 M103M95-W99 VanDerWaalsContact CB-CD1 3.44Å; M95-W99 HydrophobicContact CB-CG 4.39Å; M95-W99 HydrophobicContact CE-CD2 3.23Å; M95-W99 HydrophobicContact CE-CE3 3.26Å; M95-W99 HydrophobicContact CE-CG 3.85Å; M95-W99 HydrophobicContact CE-CH2 3.56Å; M95-W99 HydrophobicContact CE-CZ2 3.54Å; M95-W99 HydrophobicContact CE-CZ3 3.43Å; M95-W99 VanDerWaalsContact CE-CZ3 3.43Å; M95-W99 HydrophobicContact CG-CD2 4.02Å; M95-W99 HydrophobicContact CG-CG 3.83Å; M95-W99 HydrophobicContact CG-CZ2 4.34Å; M95-W99 VanDerWaalsContact CG-NE1 3.34Å; M95-W99 PolarHBondContact O-NE1 3.39Å; M95-W99 VanDerWaalsContact O-NE1 3.08Å; M95-W99 HydrophobicContact SD-CD2 3.9Å; M95-W99 HydrophobicContact SD-CE3 4.4Å; M95-W99 HydrophobicContact SD-CG 4.37Å; M95-W99 HydrophobicContact SD-CH2 4.02Å; M95-W99 HydrophobicContact SD-CZ2 3.46Å; M95-W99 WeakPolarHBondContact SD-CZ2 3.48Å; M95-W99 HydrophobicContact SD-CZ3 4.46Å; S96-W99 PolarHBondContact O-N 3.21Å; P97-W99 VanDerWaalsContact C-N 3.32Å; P97-W99 PolarHBondContact O-N 3.47Å; W99-W102 PolarHBondContact O-N 3.15Å; W99-M103 HydrophobicContact CE3-CE 3.88Å; W99-M103 HydrophobicContact CE3-CG 3.97Å; W99-M103 HydrophobicContact CE3-SD 4.05Å; W99-M103 HydrophobicContact CZ3-CE 3.6Å; W99-M103 HydrophobicContact CZ3-CG 4.15Å; W99-M103 HydrophobicContact CZ3-SD 3.64Å; W99-M103 PolarHBondContact O-N 3.28Å
100R48.7Very low46.5Very low169 Ų16996.4 Ų96.464%0.63851%0.512SS*.Hα-helixtrans-68.9-44175.6-67.1-166.6-177.2-1793.6109.8P97 Y98 W102 M103 T104P97-R100 PolarHBondContact O-N 3.39Å; Y98-R100 VanDerWaalsContact C-N 3.28Å; Y98-R100 PolarHBondContact O-N 2.85Å; R100-W102 VanDerWaalsContact C-N 3.27Å; R100-W102 PolarHBondContact O-N 2.99Å; R100-M103 PolarHBondContact O-N 2.92Å; R100-T104 WeakPolarHBondContact O-CB 3.17Å; R100-T104 PolarHBondContact O-N 3.35Å; R100-T104 PolarHBondContact O-OG1 2.81Å
101T53.2Low47.1Very low74 Ų7496.2 Ų96.245%0.45451%0.511SS..Hα-helixtrans-58.9-43.2172.6-48.30000110.4Y98 T104 I105Y98-T101 WeakPolarHBondContact O-CB 3.5Å; Y98-T101 PolarHBondContact O-N 3.29Å; T101-T104 PolarHBondContact O-N 2.97Å; T101-I105 HydrophobicContact CG2-CD1 3.95Å; T101-I105 WeakPolarHBondContact O-CB 3.4Å; T101-I105 VanDerWaalsContact O-CG1 3.23Å; T101-I105 WeakPolarHBondContact O-CG1 3.15Å; T101-I105 PolarHBondContact O-N 2.64Å
102W52.1Low47.6Very low74 Ų7496.7 Ų96.728%0.2851%0.506SS..Hα-helixtrans-62.8-48.8175.6-168.671.1000112.7G8 V78 Y98 W99 R100 T104 I105 T106G8-W102 PolarHBondContact O-NE1 3.16Å; G8-W102 VanDerWaalsContact O-NE1 3.12Å; V78-W102 HydrophobicContact CG1-CH2 4.3Å; V78-W102 HydrophobicContact CG1-CZ2 3.67Å; Y98-W102 PolarHBondContact O-N 3.08Å; W99-W102 PolarHBondContact O-N 3.15Å; R100-W102 VanDerWaalsContact C-N 3.27Å; R100-W102 PolarHBondContact O-N 2.99Å; W102-T104 PolarHBondContact O-N 3.39Å; W102-I105 CarbonylContact O-C 3.55Å; W102-I105 PolarHBondContact O-N 3.41Å; W102-I105 VanDerWaalsContact O-N 3.14Å; W102-T106 WeakPolarHBondContact O-CB 3.48Å; W102-T106 PolarHBondContact O-N 3.29Å; W102-T106 PolarHBondContact O-OG1 3.03Å
103M49.6Very low47.5Very low88 Ų8891.9 Ų91.943%0.43348%0.475SS..Hα-helixtrans-58.1-37.9174.3-86.7-152.9-165.500112.1W99 R100 T106 Q107W99-M103 HydrophobicContact CE3-CE 3.88Å; W99-M103 HydrophobicContact CE3-CG 3.97Å; W99-M103 HydrophobicContact CE3-SD 4.05Å; W99-M103 HydrophobicContact CZ3-CE 3.6Å; W99-M103 HydrophobicContact CZ3-CG 4.15Å; W99-M103 HydrophobicContact CZ3-SD 3.64Å; W99-M103 PolarHBondContact O-N 3.28Å; R100-M103 PolarHBondContact O-N 2.92Å; M103-T106 PolarHBondContact O-N 3Å; M103-Q107 VanDerWaalsContact O-CB 3.31Å; M103-Q107 WeakPolarHBondContact O-CB 2.99Å; M103-Q107 VanDerWaalsContact O-CG 3.28Å; M103-Q107 WeakPolarHBondContact O-CG 3.32Å; M103-Q107 PolarHBondContact O-N 2.73Å
104T54.3Low47.1Very low92 Ų9289.5 Ų89.556%0.56446%0.464SS*.Hα-helixtrans-69.6-39.4177.8-44.10000111.1R100 T101 W102 Q107 S108R100-T104 WeakPolarHBondContact O-CB 3.17Å; R100-T104 PolarHBondContact O-N 3.35Å; R100-T104 PolarHBondContact O-OG1 2.81Å; T101-T104 PolarHBondContact O-N 2.97Å; W102-T104 PolarHBondContact O-N 3.39Å; T104-Q107 PolarHBondContact O-N 3.06Å; T104-S108 WeakPolarHBondContact O-CB 3.33Å; T104-S108 PolarHBondContact O-N 3.25Å
105I54.5Low46.7Very low68 Ų6886.7 Ų86.735%0.34945%0.445SS..Hα-helixtrans-63.9-43.9172.9-70.2164.5000110A9 T101 W102 S108 W109A9-I105 HydrophobicContact CB-CD1 4.34Å; T101-I105 HydrophobicContact CG2-CD1 3.95Å; T101-I105 WeakPolarHBondContact O-CB 3.4Å; T101-I105 VanDerWaalsContact O-CG1 3.23Å; T101-I105 WeakPolarHBondContact O-CG1 3.15Å; T101-I105 PolarHBondContact O-N 2.64Å; W102-I105 CarbonylContact O-C 3.55Å; W102-I105 PolarHBondContact O-N 3.41Å; W102-I105 VanDerWaalsContact O-N 3.14Å; I105-S108 PolarHBondContact O-N 2.97Å; I105-W109 WeakPolarHBondContact O-CB 3.32Å; I105-W109 PolarHBondContact O-N 2.95Å
106T50.7Low46.5Very low25 Ų2585.3 Ų85.315%0.15345%0.445CS..Hα-helixtrans-66.3-41178.2-52.80000111.5W102 M103 W109 Q110W102-T106 WeakPolarHBondContact O-CB 3.48Å; W102-T106 PolarHBondContact O-N 3.29Å; W102-T106 PolarHBondContact O-OG1 3.03Å; M103-T106 PolarHBondContact O-N 3Å; T106-W109 PolarHBondContact O-N 3.33Å; T106-Q110 WeakPolarHBondContact O-CB 3.4Å; T106-Q110 PolarHBondContact O-N 3.31Å
107Q50.7Low46Very low116 Ų11690.4 Ų90.454%0.54246%0.461SS..Hα-helixtrans-68.7-38.6173.8-76.5-172.635.100112.2M103 T104 W109 R111M103-Q107 VanDerWaalsContact O-CB 3.31Å; M103-Q107 WeakPolarHBondContact O-CB 2.99Å; M103-Q107 VanDerWaalsContact O-CG 3.28Å; M103-Q107 WeakPolarHBondContact O-CG 3.32Å; M103-Q107 PolarHBondContact O-N 2.73Å; T104-Q107 PolarHBondContact O-N 3.06Å; Q107-W109 VanDerWaalsContact C-N 3.33Å; Q107-R111 WeakPolarHBondContact O-CB 3.33Å; Q107-R111 PolarHBondContact O-N 3.25Å
108S51.6Low44.8Very low76 Ų7689 Ų8953%0.53146%0.458SS..Hα-helixtrans-64.7-40.3173.7-179.40000110.9T104 I105 N112T104-S108 WeakPolarHBondContact O-CB 3.33Å; T104-S108 PolarHBondContact O-N 3.25Å; I105-S108 PolarHBondContact O-N 2.97Å; S108-N112 VanDerWaalsContact O-CB 3.25Å; S108-N112 WeakPolarHBondContact O-CB 3.32Å; S108-N112 PolarHBondContact O-N 3.34Å
109W46Very low43.8Very low39 Ų3987.7 Ų87.715%0.14847%0.465CS..Hα-helixtrans-66.4-50.3175.1-178.377.9000110.4E45 I76 V78 I105 T106 Q107 R111 N112 C113E45-W109 HydrophobicContact CB-CH2 4.04Å; E45-W109 HydrophobicContact CB-CZ2 3.87Å; E45-W109 HydrophobicContact CG-CH2 4.24Å; E45-W109 HydrophobicContact CG-CZ2 3.83Å; I76-W109 HydrophobicContact CB-CZ2 4.49Å; I76-W109 HydrophobicContact CG2-CZ2 4.26Å; V78-W109 HydrophobicContact CG2-CE3 4.39Å; V78-W109 HydrophobicContact CG2-CH2 4.11Å; V78-W109 HydrophobicContact CG2-CZ3 4.08Å; I105-W109 WeakPolarHBondContact O-CB 3.32Å; I105-W109 PolarHBondContact O-N 2.95Å; T106-W109 PolarHBondContact O-N 3.33Å; Q107-W109 VanDerWaalsContact C-N 3.33Å; W109-R111 VanDerWaalsContact C-N 3.32Å; W109-R111 PolarHBondContact O-N 3.22Å; W109-N112 WeakPolarHBondContact O-CB 3.21Å; W109-N112 PolarHBondContact O-N 3.13Å; W109-C113 VanDerWaalsContact CE2-SG 3.6Å; W109-C113 WeakPolarHBondContact O-CB 3.39Å; W109-C113 PolarHBondContact O-N 2.63Å; W109-C113 PolarHBondContact O-SG 3.23Å
110Q43.2Very low43.1Very low108 Ų10889.6 Ų89.651%0.50549%0.487SS..Hα-helixtrans-55.2-43.7173.3-84.3-168.4-56.900112.7T106 A114T106-Q110 WeakPolarHBondContact O-CB 3.4Å; T106-Q110 PolarHBondContact O-N 3.31Å; Q110-A114 WeakPolarHBondContact O-CB 3.34Å; Q110-A114 PolarHBondContact O-N 2.95Å
111R43.3Very low42.5Very low204 Ų20490.1 Ų90.177%0.7750%0.502SS*.Hα-helixtrans-64.8-38.7175.2-85.1-157.4-167.1-179.45.5112.5Q107 W109 G115Q107-R111 WeakPolarHBondContact O-CB 3.33Å; Q107-R111 PolarHBondContact O-N 3.25Å; W109-R111 VanDerWaalsContact C-N 3.32Å; W109-R111 PolarHBondContact O-N 3.22Å; R111-G115 PolarHBondContact O-N 3.23Å
112N43Very low41.5Very low105 Ų10597.3 Ų97.356%0.56152%0.521SS*.Hα-helixtrans-67.4-45178.3-168.5-77.3000110.6S108 W109 G115 C116S108-N112 VanDerWaalsContact O-CB 3.25Å; S108-N112 WeakPolarHBondContact O-CB 3.32Å; S108-N112 PolarHBondContact O-N 3.34Å; W109-N112 WeakPolarHBondContact O-CB 3.21Å; W109-N112 PolarHBondContact O-N 3.13Å; N112-G115 CarbonylContact O-C 3.59Å; N112-G115 PolarHBondContact O-N 3.07Å; N112-C116 PolarHBondContact O-N 3.06Å; N112-C116 PolarHBondContact O-SG 3.37Å; N112-C116 VanDerWaalsContact O-SG 3.36Å
113C38.4Very low40.8Very low12 Ų1298.4 Ų98.48%0.08155%0.545CS..Hα-helixtrans-65.2-40.4176.2-58.70000112E45 W109 G115 C116 Q117E45-C113 HydrophobicContact CG-CB 3.76Å; E45-C113 WeakPolarHBondContact CG-SG 3.47Å; W109-C113 VanDerWaalsContact CE2-SG 3.6Å; W109-C113 WeakPolarHBondContact O-CB 3.39Å; W109-C113 PolarHBondContact O-N 2.63Å; W109-C113 PolarHBondContact O-SG 3.23Å; C113-G115 VanDerWaalsContact C-N 3.35Å; C113-C116 WeakPolarHBondContact O-CB 3.27Å; C113-C116 PolarHBondContact O-N 3.19Å; C113-Q117 PolarHBondContact O-N 2.92Å
114A36.7Very low39.9Very low58 Ų5899.9 Ų99.948%0.47956%0.559SS.*Hα-helixtrans-65.7-35.9172.200000112.4Q110 C116 Q117 A118Q110-A114 WeakPolarHBondContact O-CB 3.34Å; Q110-A114 PolarHBondContact O-N 2.95Å; A114-C116 VanDerWaalsContact C-N 3.33Å; A114-Q117 PolarHBondContact O-N 3.28Å; A114-A118 WeakPolarHBondContact O-CB 3.3Å; A114-A118 PolarHBondContact O-N 2.97Å
115G34.1Very low39.1Very low39 Ų39102.6 Ų102.640%0.40258%0.576SS.*Hα-helixtrans-66-33.2172.100000113.2R111 N112 C113 A118 S119R111-G115 PolarHBondContact O-N 3.23Å; N112-G115 CarbonylContact O-C 3.59Å; N112-G115 PolarHBondContact O-N 3.07Å; C113-G115 VanDerWaalsContact C-N 3.35Å; G115-A118 PolarHBondContact O-N 3.07Å; G115-S119 PolarHBondContact O-OG 3.41Å
116C34.2Very low37.9Very low82 Ų82102.8 Ų102.855%0.55460%0.595SS**Hα-helixtrans-68.7-36.3171.4-70.90000112.1N112 C113 A114 A118N112-C116 PolarHBondContact O-N 3.06Å; N112-C116 PolarHBondContact O-SG 3.37Å; N112-C116 VanDerWaalsContact O-SG 3.36Å; C113-C116 WeakPolarHBondContact O-CB 3.27Å; C113-C116 PolarHBondContact O-N 3.19Å; A114-C116 VanDerWaalsContact C-N 3.33Å; C116-A118 VanDerWaalsContact C-N 3.34Å
117Q35Very low37Very low180 Ų180104.9 Ų104.984%0.84162%0.622SS**Hα-helixtrans-71.8-25.1172.1-86.8-143.4-40.200113.8C113 A114C113-Q117 PolarHBondContact O-N 2.92Å; A114-Q117 PolarHBondContact O-N 3.28Å
118A27.4Very low36.2Very low76 Ų76105.1 Ų105.163%0.62864%0.636SS**THydrogen-bonded Turntrans-89.95.8-176.900000114.5A114 G115 C116 P120A114-A118 WeakPolarHBondContact O-CB 3.3Å; A114-A118 PolarHBondContact O-N 2.97Å; G115-A118 PolarHBondContact O-N 3.07Å; C116-A118 VanDerWaalsContact C-N 3.34Å; A118-P120 WeakPolarHBondContact O-CD 3.32Å
119S27.9Very low35.1Very low83 Ų83106.1 Ų106.158%0.5865%0.649SS**  trans-84.9106.3174.2-670000109.8G115 L121G115-S119 PolarHBondContact O-OG 3.41Å; S119-L121 PolarHBondContact O-N 3.48Å
120P31.4Very low34.5Very low113 Ų113116.7 Ų116.773%0.73469%0.689SS**  trans-65.8129.3165.1-220.8000105.7A118 R122A118-P120 WeakPolarHBondContact O-CD 3.32Å; P120-R122 PolarHBondContact O-N 3.37Å
121L35.2Very low33.7Very low181 Ų181115.7 Ų115.795%0.94870%0.699SS**  trans-56.587.8164.4-94.8100.3000108.1S119 A123S119-L121 PolarHBondContact O-N 3.48Å; L121-A123 PolarHBondContact O-N 3.41Å
122R32Very low33.1Very low225 Ų225111.8 Ų111.885%0.84970%0.7SS**  trans-8890.3164.9-121.2-166171.8-151.7-2.7106.8P120 T124P120-R122 PolarHBondContact O-N 3.37Å; R122-T124 PolarHBondContact O-N 2.93Å
123A37.2Very low32.3Very low96 Ų96110.4 Ų110.479%0.79371%0.711SS**  trans-58.7118.3161.300000107.8L121L121-A123 PolarHBondContact O-N 3.41Å
124T30.5Very low31.7Very low119 Ų119115.7 Ų115.773%0.7374%0.743SS**  trans-133.2106.7160.5-35.30000107.4R122R122-T124 PolarHBondContact O-N 2.93Å
125T37.5Very low31.3Very low149 Ų149117.8 Ų117.891%0.91476%0.76SS**  trans-41.7128.5170-580000112.1
126G30.2Very low30.9Very low73 Ų73120 Ų12075%0.75378%0.775SS**  trans145.5101.1157.800000115.5
127G31.4Very low30.5Very low69 Ų69124.7 Ų124.771%0.71179%0.791SS**  trans81.997.2137.400000119.2
128S33.8Very low30.3Very low121 Ų121121.6 Ų121.685%0.84679%0.789SS**  trans64.5137.5138.3620000121.5
129A29.6Very low30.6Very low97 Ų97127.2 Ų127.280%0.80280%0.799SS**  trans81.787.2166.200000117A131A129-A131 PolarHBondContact O-N 2.97Å; A129-A131 VanDerWaalsContact O-N 3.16Å
130W31.6Very low30.6Very low260 Ų260127 Ų12799%0.98580%0.802SS**  trans-71.1100.1160.7-63.685.2000109.2
131A27.7Very low30.5Very low88 Ų88127 Ų12773%0.72780%0.803SS**  trans-88.1124.6155.400000107.6A129 G133A129-A131 PolarHBondContact O-N 2.97Å; A129-A131 VanDerWaalsContact O-N 3.16Å; A131-G133 PolarHBondContact O-N 2.95Å
132P31Very low30.3Very low121 Ų121126.7 Ų126.779%0.78680%0.801SS**  trans-67.3100.6170.7-13.227.5000108.4V134P132-V134 VanDerWaalsContact C-N 3.28Å; P132-V134 PolarHBondContact O-N 3.34Å
133G25.7Very low30.3Very low77 Ų77125.2 Ų125.279%0.79480%0.803SS**  trans-64.490.9167.300000109.1A131 A135A131-G133 PolarHBondContact O-N 2.95Å; G133-A135 PolarHBondContact O-N 3.45Å; G133-A135 VanDerWaalsContact O-N 3.09Å
134V26.7Very low29.8Very low123 Ų123124 Ų12475%0.74580%0.8SS**  trans-60.3109.2166.7170.30000107.1P132 A136P132-V134 VanDerWaalsContact C-N 3.28Å; P132-V134 PolarHBondContact O-N 3.34Å; V134-A136 PolarHBondContact O-N 2.96Å
135A26.9Very low30.3Very low101 Ų101124.4 Ų124.484%0.83581%0.805SS**  trans-65.689.716100000107.4G133 M137G133-A135 PolarHBondContact O-N 3.45Å; G133-A135 VanDerWaalsContact O-N 3.09Å; A135-M137 PolarHBondContact O-N 2.94Å
136A25.2Very low30Very low87 Ų87126.4 Ų126.472%0.71980%0.804SS**  trans-66.2103.917300000108.1V134 S138V134-A136 PolarHBondContact O-N 2.96Å; A136-S138 PolarHBondContact O-N 3Å
137M27.4Very low30.4Very low180 Ų180135.4 Ų135.489%0.88782%0.815SS**  trans-63.4117.1161-170.6177.3-7200106.6A135 K139A135-M137 PolarHBondContact O-N 2.94Å; M137-K139 PolarHBondContact O-N 3.1Å
138S30.3Very low30.1Very low114 Ų114136.1 Ų136.180%0.79781%0.814SS**  trans-48.2109.5-176.9-1750000110.9A136 A140A136-S138 PolarHBondContact O-N 3Å; S138-A140 PolarHBondContact O-N 3.2Å
139K34.1Very low29.8Very low195 Ų195138.9 Ų138.985%0.84882%0.819SS**  trans-83.391.3173.4-165.1178.6-172-177.90106.6M137 P141M137-K139 PolarHBondContact O-N 3.1Å; K139-P141 WeakPolarHBondContact O-CD 3.49Å
140A26.6Very low29.6Very low78 Ų78141 Ų14165%0.64582%0.815SS**  trans-73.6121.9165.600000108.4S138 L142S138-A140 PolarHBondContact O-N 3.2Å; A140-L142 PolarHBondContact O-N 3.29Å
141P29.7Very low29.4Very low114 Ų114138.3 Ų138.374%0.7481%0.81SS**  trans-86103.6173.531.8-25.1000108K139 Q143K139-P141 WeakPolarHBondContact O-CD 3.49Å; P141-Q143 PolarHBondContact O-N 2.73Å
142L30.8Very low29.4Very low174 Ų174139.3 Ų139.391%0.91181%0.807SS**  trans-89.587.1165.7-70.5176.2000108.3A140A140-L142 PolarHBondContact O-N 3.29Å
143Q33.4Very low29.2Very low193 Ų193141.3 Ų141.390%0.90281%0.808SS**  trans-81.8127.1155.2-79.7-168.6-37.300108.4P141P141-Q143 PolarHBondContact O-N 2.73Å
144G25.7Very low29.2Very low70 Ų70143.5 Ų143.572%0.72280%0.802SS**  trans147.7140.8164.300000114
145P41.5Very low29.1Very low129 Ų129144 Ų14484%0.83881%0.809SS**  trans-105.1107.8-154.335.1-22.1000112.2
146E29.9Very low29.1Very low190 Ų190144.6 Ų144.689%0.88880%0.802SS**  trans-138110.1160.1-88.2-170105.100110.6A148E146-A148 PolarHBondContact O-N 3.19Å
147R38.7Very low29.2Very low262 Ų262152 Ų15299%0.98983%0.829SS**  trans-60.9108.1163.1-77.6171.7160.5173.7-6.3108.1
148A26.6Very low29.3Very low84 Ų84150.7 Ų150.769%0.69483%0.826SS**  trans-128.6125.5160.900000108.4E146 I150E146-A148 PolarHBondContact O-N 3.19Å; A148-I150 PolarHBondContact O-N 3.08Å
149L27.6Very low29.3Very low180 Ų180152.6 Ų152.694%0.94283%0.827SS**  trans-52.797.3-170.4-90.8116.7000113
150I25.2Very low29Very low142 Ų142150.2 Ų150.273%0.72883%0.826SS**  trans-85.2120149.2-60.3173.1000104.4A148 V152A148-I150 PolarHBondContact O-N 3.08Å; I150-V152 HydrophobicContact CB-CG2 4.48Å; I150-V152 HydrophobicContact CG2-CG2 4.25Å; I150-V152 PolarHBondContact O-N 2.74Å
151K26.7Very low29.2Very low202 Ų202154.5 Ų154.588%0.87884%0.837SS**  trans-68.281.2166.1-166.9166.2-177.7171.60106.9M153K151-M153 PolarHBondContact O-N 3.05Å; K151-M153 VanDerWaalsContact O-N 3.13Å
152V27Very low29.1Very low110 Ų110157 Ų15767%0.66784%0.843SS**  trans-56.7111.3163.3175.60000104.5I150 D154I150-V152 HydrophobicContact CB-CG2 4.48Å; I150-V152 HydrophobicContact CG2-CG2 4.25Å; I150-V152 PolarHBondContact O-N 2.74Å; V152-D154 PolarHBondContact O-N 3.13Å
153M27.7Very low29Very low163 Ų163155.9 Ų155.980%0.80384%0.838SS**  trans-70.7105169.1-157.1143.169.400105.4K151 C155K151-M153 PolarHBondContact O-N 3.05Å; K151-M153 VanDerWaalsContact O-N 3.13Å; M153-C155 PolarHBondContact O-N 3.47Å
154D24.8Very low28.7Very low123 Ų123153.2 Ų153.266%0.65883%0.834SS**  trans-54.1114.1-173.7-157.6-80.2000110.2V152 T156V152-D154 PolarHBondContact O-N 3.13Å; D154-T156 PolarHBondContact O-N 3.19Å; D154-T156 PolarHBondContact OD1-N 2.63Å; D154-T156 PolarHBondContact OD1-OG1 3.4Å
155C24.6Very low28.9Very low132 Ų132159.6 Ų159.689%0.89284%0.843SS**  trans-87.288165.9-70.30000107.4M153M153-C155 PolarHBondContact O-N 3.47Å
156T27Very low27.9Very low114 Ų114162.2 Ų162.270%0.69984%0.843SS**  trans-95.4128.1161.9-69.10000108.8D154D154-T156 PolarHBondContact O-N 3.19Å; D154-T156 PolarHBondContact OD1-N 2.63Å; D154-T156 PolarHBondContact OD1-OG1 3.4Å
157L28.6Very low27.7Very low244 Ų244159.6 Ų159.6100%1.27784%0.839SS**  trans-3.10174.2-100.3128.8000119.6

Retrieved 157 of 157 residues in 44.5 ms (Link to these results)

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