A0A3B3UYI3_9TELE Loading...

NCBP2 antisense 2 (head to head)

AlphaFold DB , UniProt , Accession A0A3B3UYI3, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 101 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
1M69.9Low76.2Confident205 Ų205131 Ų131100%1.0167%0.667SS**  0-62.20-66.5-62.418000111.7S3 R4 M5M1-S3 PolarHBondContact O-N 3.3Å; M1-R4 PolarHBondContact O-N 3.08Å; M1-R4 VanDerWaalsContact O-N 3.12Å; M1-M5 PolarHBondContact O-N 3.01Å; M1-M5 VanDerWaalsContact O-N 3.09Å
2L72.4Confident76.3Confident136 Ų136125 Ų12571%0.71264%0.638SS**Hα-helixtrans-57.5-46-178.1-125.385.7000114.6R4 M5 L6L2-R4 PolarHBondContact O-N 3.28Å; L2-M5 PolarHBondContact O-N 3.11Å; L2-L6 WeakPolarHBondContact O-CB 3.38Å; L2-L6 WeakPolarHBondContact O-CG 3.32Å; L2-L6 PolarHBondContact O-N 3.41Å
3S75.3Confident75.9Confident97 Ų97124.5 Ų124.568%0.67864%0.637SS**Hα-helixtrans-59-34.8178.3166.20000112.4M1 A7M1-S3 PolarHBondContact O-N 3.3Å; S3-A7 WeakPolarHBondContact O-CB 3.4Å; S3-A7 PolarHBondContact O-N 2.89Å
4R80.1Confident75.8Confident213 Ų213125.9 Ų125.980%0.80464%0.639SS**Hα-helixtrans-76.4-36.2178.5-163.4159.7-178.9150.5-3112.1M1 L2 Y8M1-R4 PolarHBondContact O-N 3.08Å; M1-R4 VanDerWaalsContact O-N 3.12Å; L2-R4 PolarHBondContact O-N 3.28Å; R4-Y8 WeakPolarHBondContact O-CB 3.45Å; R4-Y8 PolarHBondContact O-N 2.76Å
5M75.9Confident75.7Confident129 Ų129120.7 Ų120.764%0.63562%0.616SS**Hα-helixtrans-65-44.9170.3-71.6-165.388.800111.5M1 L2 A7 Y8 L9M1-M5 PolarHBondContact O-N 3.01Å; M1-M5 VanDerWaalsContact O-N 3.09Å; L2-M5 PolarHBondContact O-N 3.11Å; M5-A7 VanDerWaalsContact C-N 3.35Å; M5-A7 PolarHBondContact O-N 2.69Å; M5-Y8 WeakPolarHBondContact O-CB 3.36Å; M5-Y8 PolarHBondContact O-N 2.71Å; M5-Y8 VanDerWaalsContact O-N 3.13Å; M5-L9 VanDerWaalsContact O-CG 3.26Å; M5-L9 WeakPolarHBondContact O-CG 3.42Å; M5-L9 PolarHBondContact O-N 2.89Å
6L76.6Confident75.5Confident100 Ų100117.6 Ų117.652%0.52460%0.6SS.*Hα-helixtrans-60.6-44.7175.9-75.6169.2000111.3L2 Y8 L9 V10L2-L6 WeakPolarHBondContact O-CB 3.38Å; L2-L6 WeakPolarHBondContact O-CG 3.32Å; L2-L6 PolarHBondContact O-N 3.41Å; L6-Y8 VanDerWaalsContact C-N 3.26Å; L6-Y8 PolarHBondContact O-N 3.3Å; L6-L9 PolarHBondContact O-N 3.11Å; L6-V10 WeakPolarHBondContact O-CB 3.43Å; L6-V10 VanDerWaalsContact O-CG2 3.22Å; L6-V10 WeakPolarHBondContact O-CG2 3.39Å; L6-V10 PolarHBondContact O-N 3.04Å
7A77.4Confident75.1Confident58 Ų58116.6 Ų116.648%0.47959%0.593SS.*Hα-helixtrans-58.9-39.4174.700000111.8S3 M5 N11S3-A7 WeakPolarHBondContact O-CB 3.4Å; S3-A7 PolarHBondContact O-N 2.89Å; M5-A7 VanDerWaalsContact C-N 3.35Å; M5-A7 PolarHBondContact O-N 2.69Å; A7-N11 VanDerWaalsContact O-CB 3.24Å; A7-N11 WeakPolarHBondContact O-CB 2.94Å; A7-N11 PolarHBondContact O-N 3.48Å
8Y79Confident75.1Confident181 Ų181117.6 Ų117.671%0.7159%0.592SS**Hα-helixtrans-68.4-41177.6-156.6-93.2000112.8R4 M5 L6 N11 N12R4-Y8 WeakPolarHBondContact O-CB 3.45Å; R4-Y8 PolarHBondContact O-N 2.76Å; M5-Y8 WeakPolarHBondContact O-CB 3.36Å; M5-Y8 PolarHBondContact O-N 2.71Å; M5-Y8 VanDerWaalsContact O-N 3.13Å; L6-Y8 VanDerWaalsContact C-N 3.26Å; L6-Y8 PolarHBondContact O-N 3.3Å; Y8-N11 PolarHBondContact O-N 3.1Å; Y8-N12 PolarHBondContact O-N 3.24Å
9L73Confident74.8Confident68 Ų68115.2 Ų115.236%0.35658%0.581SS.*Hα-helixtrans-66.7-39.1176.8-66.6167.8000111.7M5 L6 N11 N12 V15 I16M5-L9 VanDerWaalsContact O-CG 3.26Å; M5-L9 WeakPolarHBondContact O-CG 3.42Å; M5-L9 PolarHBondContact O-N 2.89Å; L6-L9 PolarHBondContact O-N 3.11Å; L9-N11 VanDerWaalsContact C-N 3.32Å; L9-N12 PolarHBondContact O-N 2.91Å; L9-V15 HydrophobicContact CD2-CG1 3.57Å; L9-I16 WeakPolarHBondContact O-CG1 3.45Å
10V78.1Confident74.6Confident105 Ų105112.1 Ų112.164%0.63657%0.574SS**Hα-helixtrans-73.3-24.9177.6173.50000112L6 N12 I16L6-V10 WeakPolarHBondContact O-CB 3.43Å; L6-V10 VanDerWaalsContact O-CG2 3.22Å; L6-V10 WeakPolarHBondContact O-CG2 3.39Å; L6-V10 PolarHBondContact O-N 3.04Å; V10-N12 VanDerWaalsContact C-N 3.29Å; V10-I16 WeakPolarHBondContact O-CD1 3.23Å
11N80.5Confident74.7Confident149 Ų149112 Ų11280%0.79757%0.571SS**THydrogen-bonded Turntrans-872.7178.2-149.5-3.3000112.9A7 Y8 L9A7-N11 VanDerWaalsContact O-CB 3.24Å; A7-N11 WeakPolarHBondContact O-CB 2.94Å; A7-N11 PolarHBondContact O-N 3.48Å; Y8-N11 PolarHBondContact O-N 3.1Å; L9-N11 VanDerWaalsContact C-N 3.32Å
12N77.2Confident75.1Confident59 Ų59104 Ų10432%0.31654%0.535SS..  trans-120.6106177.2-167.4-51.5000111.1Y8 L9 V10 Q14 V15 I16Y8-N12 PolarHBondContact O-N 3.24Å; L9-N12 PolarHBondContact O-N 2.91Å; V10-N12 VanDerWaalsContact C-N 3.29Å; N12-Q14 VanDerWaalsContact C-N 3.35Å; N12-Q14 PolarHBondContact O-N 3.31Å; N12-Q14 PolarHBondContact OD1-N 3.03Å; N12-V15 HydrophobicContact CB-CB 4.25Å; N12-V15 HydrophobicContact CB-CG2 4.02Å; N12-V15 PolarHBondContact O-N 3.03Å; N12-V15 PolarHBondContact OD1-N 3.13Å; N12-I16 WeakPolarHBondContact O-CG1 3.36Å; N12-I16 PolarHBondContact O-N 3.38Å; N12-I16 VanDerWaalsContact O-N 3.16Å
13L72.1Confident75.2Confident118 Ų118107.7 Ų107.762%0.61854%0.539SS*.Hα-helixtrans-58.3-41.8-175.8-176.762.9000113.2V15 I16 E17L13-V15 VanDerWaalsContact C-N 3.28Å; L13-V15 PolarHBondContact O-N 2.78Å; L13-I16 WeakPolarHBondContact O-CB 3.35Å; L13-I16 PolarHBondContact O-N 2.92Å; L13-I16 VanDerWaalsContact O-N 3.17Å; L13-E17 WeakPolarHBondContact O-CG 3.41Å; L13-E17 PolarHBondContact O-N 2.7Å
14Q73.4Confident75.4Confident144 Ų144107.6 Ų107.667%0.67354%0.536SS*.Hα-helixtrans-64.2-35.3-179.6-72.3-180-39.400112.1N12 E17 K18N12-Q14 VanDerWaalsContact C-N 3.35Å; N12-Q14 PolarHBondContact O-N 3.31Å; N12-Q14 PolarHBondContact OD1-N 3.03Å; Q14-E17 PolarHBondContact O-N 2.83Å; Q14-K18 VanDerWaalsContact O-CG 3.28Å; Q14-K18 WeakPolarHBondContact O-CG 3.34Å; Q14-K18 PolarHBondContact O-N 3.48Å; Q14-K18 VanDerWaalsContact O-N 3.1Å
15V74.3Confident75.4Confident48 Ų48100.6 Ų100.629%0.29151%0.514SS..Hα-helixtrans-69.6-41.1176.4178.50000110.4L9 N12 L13 E17 K18 L19L9-V15 HydrophobicContact CD2-CG1 3.57Å; N12-V15 HydrophobicContact CB-CB 4.25Å; N12-V15 HydrophobicContact CB-CG2 4.02Å; N12-V15 PolarHBondContact O-N 3.03Å; N12-V15 PolarHBondContact OD1-N 3.13Å; L13-V15 VanDerWaalsContact C-N 3.28Å; L13-V15 PolarHBondContact O-N 2.78Å; V15-E17 VanDerWaalsContact C-N 3.34Å; V15-E17 PolarHBondContact O-N 3.35Å; V15-K18 PolarHBondContact O-N 2.89Å; V15-L19 HydrophobicContact CG1-CD1 3.83Å; V15-L19 HydrophobicContact CG1-CG 4.2Å; V15-L19 WeakPolarHBondContact O-CB 3.39Å; V15-L19 WeakPolarHBondContact O-CG 3.35Å; V15-L19 PolarHBondContact O-N 3.3Å
16I72.6Confident75.2Confident71 Ų71101 Ų10136%0.36451%0.509SS..Hα-helixtrans-60.9-43.3175.1-62.1166.2000110.9L9 V10 N12 L13 L19 A20L9-I16 WeakPolarHBondContact O-CG1 3.45Å; V10-I16 WeakPolarHBondContact O-CD1 3.23Å; N12-I16 WeakPolarHBondContact O-CG1 3.36Å; N12-I16 PolarHBondContact O-N 3.38Å; N12-I16 VanDerWaalsContact O-N 3.16Å; L13-I16 WeakPolarHBondContact O-CB 3.35Å; L13-I16 PolarHBondContact O-N 2.92Å; L13-I16 VanDerWaalsContact O-N 3.17Å; I16-L19 CarbonylContact O-C 3.42Å; I16-L19 WeakPolarHBondContact O-CB 3.41Å; I16-L19 PolarHBondContact O-N 3.2Å; I16-A20 WeakPolarHBondContact O-CB 3.29Å; I16-A20 PolarHBondContact O-N 3.31Å
17E69.1Low75.4Confident102 Ų102104.3 Ų104.348%0.47751%0.514SS..Hα-helixtrans-61.5-47.9177.8-74.6175.2167.100111.6L13 Q14 V15 L19 A20 E21L13-E17 WeakPolarHBondContact O-CG 3.41Å; L13-E17 PolarHBondContact O-N 2.7Å; Q14-E17 PolarHBondContact O-N 2.83Å; V15-E17 VanDerWaalsContact C-N 3.34Å; V15-E17 PolarHBondContact O-N 3.35Å; E17-L19 VanDerWaalsContact C-N 3.29Å; E17-L19 PolarHBondContact O-N 3.48Å; E17-A20 PolarHBondContact O-N 3.36Å; E17-E21 WeakPolarHBondContact O-CG 3.5Å; E17-E21 PolarHBondContact O-N 3.44Å
18K74.6Confident75.5Confident134 Ų134103.9 Ų103.958%0.58351%0.511SS*.Hα-helixtrans-64.1-35.8177-68.1-73151.4-146.80112.5Q14 V15 E21 S22Q14-K18 VanDerWaalsContact O-CG 3.28Å; Q14-K18 WeakPolarHBondContact O-CG 3.34Å; Q14-K18 PolarHBondContact O-N 3.48Å; Q14-K18 VanDerWaalsContact O-N 3.1Å; V15-K18 PolarHBondContact O-N 2.89Å; K18-E21 IonicContact NZ-OE1 2.86Å; K18-E21 IonicContact NZ-OE2 3.51Å; K18-E21 PolarHBondContact NZ-OE2 2.9Å; K18-S22 PolarHBondContact O-N 3.49Å
19L70.4Confident75.5Confident71 Ų7198 Ų9837%0.37250%0.5SS..Hα-helixtrans-67.6-43173.6-81.4179.7000111.2V15 I16 E17 E21 S22 I25V15-L19 HydrophobicContact CG1-CD1 3.83Å; V15-L19 HydrophobicContact CG1-CG 4.2Å; V15-L19 WeakPolarHBondContact O-CB 3.39Å; V15-L19 WeakPolarHBondContact O-CG 3.35Å; V15-L19 PolarHBondContact O-N 3.3Å; I16-L19 CarbonylContact O-C 3.42Å; I16-L19 WeakPolarHBondContact O-CB 3.41Å; I16-L19 PolarHBondContact O-N 3.2Å; E17-L19 VanDerWaalsContact C-N 3.29Å; E17-L19 PolarHBondContact O-N 3.48Å; L19-E21 VanDerWaalsContact C-N 3.3Å; L19-E21 PolarHBondContact O-N 3.11Å; L19-S22 WeakPolarHBondContact O-CB 3.44Å; L19-S22 PolarHBondContact O-N 2.78Å; L19-S22 PolarHBondContact O-OG 2.95Å; L19-I25 VanDerWaalsContact C-CD1 3.48Å; L19-I25 HydrophobicContact CB-CD1 3.41Å; L19-I25 VanDerWaalsContact CB-CD1 3.41Å; L19-I25 HydrophobicContact CD1-CD1 4.48Å; L19-I25 HydrophobicContact CD2-CD1 3.91Å; L19-I25 HydrophobicContact CG-CD1 4.11Å; L19-I25 VanDerWaalsContact O-CB 3.29Å; L19-I25 WeakPolarHBondContact O-CB 3.31Å; L19-I25 WeakPolarHBondContact O-CD1 3.45Å
20A69.8Low75.9Confident53 Ų5399.4 Ų99.444%0.43850%0.504SS..Hα-helixtrans-64.9-33.7175.600000112.7I16 E17 S22I16-A20 WeakPolarHBondContact O-CB 3.29Å; I16-A20 PolarHBondContact O-N 3.31Å; E17-A20 PolarHBondContact O-N 3.36Å; A20-S22 PolarHBondContact O-N 3.46Å
21E76.2Confident76.1Confident112 Ų112100.1 Ų100.152%0.52350%0.504SS..Hα-helixtrans-64.4-27.7171.7-74.5175.8169.800112.2E17 K18 L19 R26E17-E21 WeakPolarHBondContact O-CG 3.5Å; E17-E21 PolarHBondContact O-N 3.44Å; K18-E21 IonicContact NZ-OE1 2.86Å; K18-E21 IonicContact NZ-OE2 3.51Å; K18-E21 PolarHBondContact NZ-OE2 2.9Å; L19-E21 VanDerWaalsContact C-N 3.3Å; L19-E21 PolarHBondContact O-N 3.11Å; E21-R26 PolarHBondContact O-NH2 3.09Å
22S80.1Confident76.1Confident35 Ų3597.4 Ų97.425%0.24549%0.493CS..SBendtrans-63.8145.4-178.684.70000113.1K18 L19 A20 I25 R26K18-S22 PolarHBondContact O-N 3.49Å; L19-S22 WeakPolarHBondContact O-CB 3.44Å; L19-S22 PolarHBondContact O-N 2.78Å; L19-S22 PolarHBondContact O-OG 2.95Å; A20-S22 PolarHBondContact O-N 3.46Å; S22-I25 PolarHBondContact O-N 3.36Å; S22-R26 PolarHBondContact O-N 2.98Å
23R74.1Confident76.4Confident215 Ų21597.2 Ų97.281%0.81150%0.499SS*.Hα-helixtrans-59.4-41.8177.9-64.5-176177.6-165.2-0.6113.3I25 R26 R27R23-I25 PolarHBondContact O-N 3.27Å; R23-R26 PolarHBondContact O-N 3.43Å; R23-R27 WeakPolarHBondContact O-CG 3.38Å; R23-R27 PolarHBondContact O-N 2.99Å
24P79.4Confident76.9Confident94 Ų9498.2 Ų98.261%0.6150%0.496SS*.Hα-helixtrans-61.9-42-179.4-25.135.5000113.8R27 A28P24-R27 PolarHBondContact O-N 3.18Å; P24-A28 PolarHBondContact O-N 3.45Å
25I78.5Confident77.5Confident67 Ų6794.1 Ų94.134%0.34449%0.487SS..Hα-helixtrans-73.8-36.6-178.5-72.2171.1000111L19 S22 R23 R27 A28 A29L19-I25 VanDerWaalsContact C-CD1 3.48Å; L19-I25 HydrophobicContact CB-CD1 3.41Å; L19-I25 VanDerWaalsContact CB-CD1 3.41Å; L19-I25 HydrophobicContact CD1-CD1 4.48Å; L19-I25 HydrophobicContact CD2-CD1 3.91Å; L19-I25 HydrophobicContact CG-CD1 4.11Å; L19-I25 VanDerWaalsContact O-CB 3.29Å; L19-I25 WeakPolarHBondContact O-CB 3.31Å; L19-I25 WeakPolarHBondContact O-CD1 3.45Å; S22-I25 PolarHBondContact O-N 3.36Å; R23-I25 PolarHBondContact O-N 3.27Å; I25-R27 VanDerWaalsContact C-N 3.28Å; I25-R27 PolarHBondContact O-N 2.91Å; I25-A28 PolarHBondContact O-N 3.3Å; I25-A29 WeakPolarHBondContact O-CB 3.25Å; I25-A29 PolarHBondContact O-N 3.46Å
26R73.6Confident77.9Confident138 Ų13896.5 Ų96.552%0.52150%0.498SS..Hα-helixtrans-56.9-42.8170-165.5177.9-52.4-131.30.5112E21 S22 R23 Q30E21-R26 PolarHBondContact O-NH2 3.09Å; S22-R26 PolarHBondContact O-N 2.98Å; R23-R26 PolarHBondContact O-N 3.43Å; R26-Q30 WeakPolarHBondContact O-CB 3.49Å; R26-Q30 WeakPolarHBondContact O-CG 3.37Å; R26-Q30 PolarHBondContact O-N 2.81Å
27R79.8Confident78.2Confident168 Ų16896.6 Ų96.663%0.63450%0.501SS*.Hα-helixtrans-66.3-43.2175.1-68.6-59.4-172-173.95.7112.1R23 P24 I25 A29 Q30 L31R23-R27 WeakPolarHBondContact O-CG 3.38Å; R23-R27 PolarHBondContact O-N 2.99Å; P24-R27 PolarHBondContact O-N 3.18Å; I25-R27 VanDerWaalsContact C-N 3.28Å; I25-R27 PolarHBondContact O-N 2.91Å; R27-A29 PolarHBondContact O-N 2.86Å; R27-Q30 VanDerWaalsContact NH1-OE1 3.11Å; R27-Q30 PolarHBondContact O-N 3.37Å; R27-L31 WeakPolarHBondContact O-CB 3.44Å; R27-L31 VanDerWaalsContact O-CG 3.29Å; R27-L31 WeakPolarHBondContact O-CG 3.25Å; R27-L31 PolarHBondContact O-N 2.95Å
28A78.9Confident78.9Confident50 Ų5096.8 Ų96.841%0.41350%0.501SS..Hα-helixtrans-62.2-42.817700000112.3P24 I25 L31 T32P24-A28 PolarHBondContact O-N 3.45Å; I25-A28 PolarHBondContact O-N 3.3Å; A28-L31 PolarHBondContact O-N 3.48Å; A28-T32 WeakPolarHBondContact O-CB 3.09Å; A28-T32 PolarHBondContact O-N 3.32Å; A28-T32 PolarHBondContact O-OG1 3.44Å
29A80.1Confident78.8Confident58 Ų5893.3 Ų93.348%0.47950%0.497SS..Hα-helixtrans-63.3-44175.300000111.6I25 R27 T32 A33I25-A29 WeakPolarHBondContact O-CB 3.25Å; I25-A29 PolarHBondContact O-N 3.46Å; R27-A29 PolarHBondContact O-N 2.86Å; A29-T32 PolarHBondContact O-N 2.87Å; A29-A33 VanDerWaalsContact O-CB 3.3Å; A29-A33 WeakPolarHBondContact O-CB 3.27Å; A29-A33 PolarHBondContact O-N 3.39Å
30Q81.7Confident79.1Confident96 Ų9694.4 Ų94.445%0.44950%0.5SS..Hα-helixtrans-60.6-44.9174.9-75.8172.4-7.100112.1R26 R27 T32 A33 Y34R26-Q30 WeakPolarHBondContact O-CB 3.49Å; R26-Q30 WeakPolarHBondContact O-CG 3.37Å; R26-Q30 PolarHBondContact O-N 2.81Å; R27-Q30 VanDerWaalsContact NH1-OE1 3.11Å; R27-Q30 PolarHBondContact O-N 3.37Å; Q30-T32 VanDerWaalsContact C-N 3.33Å; Q30-T32 PolarHBondContact O-N 3.05Å; Q30-A33 PolarHBondContact O-N 3.22Å; Q30-Y34 WeakPolarHBondContact O-CB 3.37Å; Q30-Y34 PolarHBondContact O-N 3.4Å
31L82.6Confident79.3Confident120 Ų12096.9 Ų96.963%0.62851%0.505SS*.Hα-helixtrans-62.6-41.8176.5-72.7170.8000111.4R27 A28 Y34 A35R27-L31 WeakPolarHBondContact O-CB 3.44Å; R27-L31 VanDerWaalsContact O-CG 3.29Å; R27-L31 WeakPolarHBondContact O-CG 3.25Å; R27-L31 PolarHBondContact O-N 2.95Å; A28-L31 PolarHBondContact O-N 3.48Å; L31-Y34 PolarHBondContact O-N 2.95Å; L31-A35 WeakPolarHBondContact O-CB 3.19Å; L31-A35 PolarHBondContact O-N 3.16Å
32T80.2Confident78.9Confident93 Ų9395.9 Ų95.957%0.57151%0.506SS*.Hα-helixtrans-66.5-48.2178.5-55.30000111.1A28 A29 Q30 Y34 A35 L36A28-T32 WeakPolarHBondContact O-CB 3.09Å; A28-T32 PolarHBondContact O-N 3.32Å; A28-T32 PolarHBondContact O-OG1 3.44Å; A29-T32 PolarHBondContact O-N 2.87Å; Q30-T32 VanDerWaalsContact C-N 3.33Å; Q30-T32 PolarHBondContact O-N 3.05Å; T32-Y34 VanDerWaalsContact C-N 3.31Å; T32-Y34 PolarHBondContact O-N 2.85Å; T32-A35 PolarHBondContact O-N 2.81Å; T32-L36 VanDerWaalsContact O-CB 3.26Å; T32-L36 WeakPolarHBondContact O-CB 3.37Å; T32-L36 PolarHBondContact O-N 3.35Å
33A83Confident78Confident54 Ų5495.6 Ų95.645%0.44651%0.509SS..Hα-helixtrans-61.4-40.8176.900000111.5A29 Q30 T37A29-A33 VanDerWaalsContact O-CB 3.3Å; A29-A33 WeakPolarHBondContact O-CB 3.27Å; A29-A33 PolarHBondContact O-N 3.39Å; Q30-A33 PolarHBondContact O-N 3.22Å; A33-T37 WeakPolarHBondContact O-CB 3.23Å; A33-T37 PolarHBondContact O-N 2.97Å; A33-T37 PolarHBondContact O-OG1 2.85Å
34Y82.4Confident77.4Confident139 Ų13993.6 Ų93.655%0.54550%0.501SS..Hα-helixtrans-66-46.8176.4-178.6-101000112Q30 L31 T32 T37 K38Q30-Y34 WeakPolarHBondContact O-CB 3.37Å; Q30-Y34 PolarHBondContact O-N 3.4Å; L31-Y34 PolarHBondContact O-N 2.95Å; T32-Y34 VanDerWaalsContact C-N 3.31Å; T32-Y34 PolarHBondContact O-N 2.85Å; Y34-T37 PolarHBondContact O-N 3.49Å; Y34-K38 HydrophobicContact CD1-CD 4.24Å; Y34-K38 HydrophobicContact CE1-CD 3.58Å; Y34-K38 HydrophobicContact CE1-CG 4.3Å; Y34-K38 HydrophobicContact CE2-CD 4.18Å; Y34-K38 HydrophobicContact CE2-CG 4.42Å; Y34-K38 VanDerWaalsContact O-CB 3.31Å; Y34-K38 WeakPolarHBondContact O-CB 3.19Å; Y34-K38 WeakPolarHBondContact O-CG 3.4Å; Y34-K38 PolarHBondContact O-N 2.98Å; Y34-K38 WeakPolarHBondContact OH-CE 3.36Å; Y34-K38 PolarHBondContact OH-NZ 3.45Å
35A86.2Confident76.6Confident58 Ų5892.5 Ų92.548%0.47949%0.49SS..Hα-helixtrans-62.6-45.5177.700000111.3L31 T32 K38 A39L31-A35 WeakPolarHBondContact O-CB 3.19Å; L31-A35 PolarHBondContact O-N 3.16Å; T32-A35 PolarHBondContact O-N 2.81Å; A35-K38 PolarHBondContact O-N 3.44Å; A35-A39 WeakPolarHBondContact O-CB 3.4Å; A35-A39 PolarHBondContact O-N 2.76Å
36L83.1Confident75.5Confident99 Ų9992.8 Ų92.852%0.51850%0.495SS..Hα-helixtrans-63.8-47.8177.9-177.463.2000111.3T32 K38 A39 Q40T32-L36 VanDerWaalsContact O-CB 3.26Å; T32-L36 WeakPolarHBondContact O-CB 3.37Å; T32-L36 PolarHBondContact O-N 3.35Å; L36-K38 VanDerWaalsContact C-N 3.35Å; L36-K38 PolarHBondContact O-N 2.89Å; L36-A39 PolarHBondContact O-N 3.3Å; L36-Q40 HydrophobicContact CD1-CG 4.49Å; L36-Q40 WeakPolarHBondContact O-CB 3.29Å; L36-Q40 VanDerWaalsContact O-CG 3.3Å; L36-Q40 WeakPolarHBondContact O-CG 3.31Å; L36-Q40 PolarHBondContact O-N 2.82Å
37T79.4Confident74.7Confident72 Ų7289.5 Ų89.544%0.44249%0.494SS..Hα-helixtrans-61.5-44.2178.2-58.30000110.9A33 Y34 Q40 I41A33-T37 WeakPolarHBondContact O-CB 3.23Å; A33-T37 PolarHBondContact O-N 2.97Å; A33-T37 PolarHBondContact O-OG1 2.85Å; Y34-T37 PolarHBondContact O-N 3.49Å; T37-Q40 PolarHBondContact O-N 3.17Å; T37-I41 HydrophobicContact CG2-CD1 3.85Å; T37-I41 VanDerWaalsContact O-CG1 3.26Å; T37-I41 WeakPolarHBondContact O-CG1 3.37Å; T37-I41 PolarHBondContact O-N 2.99Å
38K81.9Confident73.6Confident106 Ų10686 Ų8646%0.46148%0.484SS..Hα-helixtrans-65.4-40.9175.4-80.9-158.4160.3-172.40112.7Y34 A35 L36 Q40 I41 V42Y34-K38 HydrophobicContact CD1-CD 4.24Å; Y34-K38 HydrophobicContact CE1-CD 3.58Å; Y34-K38 HydrophobicContact CE1-CG 4.3Å; Y34-K38 HydrophobicContact CE2-CD 4.18Å; Y34-K38 HydrophobicContact CE2-CG 4.42Å; Y34-K38 VanDerWaalsContact O-CB 3.31Å; Y34-K38 WeakPolarHBondContact O-CB 3.19Å; Y34-K38 WeakPolarHBondContact O-CG 3.4Å; Y34-K38 PolarHBondContact O-N 2.98Å; Y34-K38 WeakPolarHBondContact OH-CE 3.36Å; Y34-K38 PolarHBondContact OH-NZ 3.45Å; A35-K38 PolarHBondContact O-N 3.44Å; L36-K38 VanDerWaalsContact C-N 3.35Å; L36-K38 PolarHBondContact O-N 2.89Å; K38-Q40 VanDerWaalsContact C-N 3.3Å; K38-Q40 PolarHBondContact O-N 2.95Å; K38-I41 PolarHBondContact O-N 2.83Å; K38-V42 WeakPolarHBondContact O-CB 3.46Å; K38-V42 VanDerWaalsContact O-CG2 3.28Å; K38-V42 WeakPolarHBondContact O-CG2 3.4Å; K38-V42 PolarHBondContact O-N 3.41Å
39A73.6Confident72.5Confident61 Ų6191.3 Ų91.350%0.50449%0.494SS..Hα-helixtrans-63.3-38.917600000111.3A35 L36 G43A35-A39 WeakPolarHBondContact O-CB 3.4Å; A35-A39 PolarHBondContact O-N 2.76Å; L36-A39 PolarHBondContact O-N 3.3Å; A39-G43 WeakPolarHBondContact O-CA 3.23Å; A39-G43 PolarHBondContact O-N 2.78Å
40Q75.7Confident71.3Confident95 Ų9592.1 Ų92.144%0.44449%0.492SS..Hα-helixtrans-66.9-41.8174.4-74.2178.1-4.600112.1L36 T37 K38 R44L36-Q40 HydrophobicContact CD1-CG 4.49Å; L36-Q40 WeakPolarHBondContact O-CB 3.29Å; L36-Q40 VanDerWaalsContact O-CG 3.3Å; L36-Q40 WeakPolarHBondContact O-CG 3.31Å; L36-Q40 PolarHBondContact O-N 2.82Å; T37-Q40 PolarHBondContact O-N 3.17Å; K38-Q40 VanDerWaalsContact C-N 3.3Å; K38-Q40 PolarHBondContact O-N 2.95Å; Q40-R44 VanDerWaalsContact O-CB 3.23Å; Q40-R44 WeakPolarHBondContact O-CB 3.36Å; Q40-R44 WeakPolarHBondContact O-CG 3.31Å; Q40-R44 PolarHBondContact O-N 2.77Å
41I74.3Confident69.9Low104 Ų10495.1 Ų95.153%0.53351%0.508SS..Hα-helixtrans-66.9-49177.6-67.6164.3000110.7T37 K38 G43 R44 D45T37-I41 HydrophobicContact CG2-CD1 3.85Å; T37-I41 VanDerWaalsContact O-CG1 3.26Å; T37-I41 WeakPolarHBondContact O-CG1 3.37Å; T37-I41 PolarHBondContact O-N 2.99Å; K38-I41 PolarHBondContact O-N 2.83Å; I41-G43 VanDerWaalsContact C-N 3.32Å; I41-G43 PolarHBondContact O-N 3.29Å; I41-R44 PolarHBondContact O-N 2.88Å; I41-D45 WeakPolarHBondContact O-CB 3.37Å; I41-D45 PolarHBondContact O-N 2.83Å
42V69.4Low68.7Low91 Ų9198.2 Ų98.255%0.55251%0.512SS*.Hα-helixtrans-63.9-40.3177.4173.10000110.6K38 T46K38-V42 WeakPolarHBondContact O-CB 3.46Å; K38-V42 VanDerWaalsContact O-CG2 3.28Å; K38-V42 WeakPolarHBondContact O-CG2 3.4Å; K38-V42 PolarHBondContact O-N 3.41Å; V42-T46 HydrophobicContact CG1-CG2 4.36Å; V42-T46 VanDerWaalsContact O-CB 3.31Å; V42-T46 WeakPolarHBondContact O-CB 3.3Å; V42-T46 VanDerWaalsContact O-CG2 3.29Å; V42-T46 WeakPolarHBondContact O-CG2 3.44Å; V42-T46 PolarHBondContact O-N 3.45Å; V42-T46 PolarHBondContact O-OG1 2.96Å
43G61.2Low67.2Low29 Ų2996 Ų9630%0.29950%0.5SS..Hα-helixtrans-66-37.3176.200000113.1A39 I41 T46 S47A39-G43 WeakPolarHBondContact O-CA 3.23Å; A39-G43 PolarHBondContact O-N 2.78Å; I41-G43 VanDerWaalsContact C-N 3.32Å; I41-G43 PolarHBondContact O-N 3.29Å; G43-T46 WeakPolarHBondContact CA-OG1 3.21Å; G43-T46 PolarHBondContact O-OG1 2.62Å; G43-S47 WeakPolarHBondContact O-CB 3.23Å; G43-S47 PolarHBondContact O-N 3.46Å; G43-S47 PolarHBondContact O-OG 2.95Å
44R61.6Low65.7Low174 Ų174102.8 Ų102.866%0.65752%0.523SS*.Hα-helixtrans-72.4-43.4174-77.1179.5-176.3176.22.7112.2Q40 I41 S47 E48Q40-R44 VanDerWaalsContact O-CB 3.23Å; Q40-R44 WeakPolarHBondContact O-CB 3.36Å; Q40-R44 WeakPolarHBondContact O-CG 3.31Å; Q40-R44 PolarHBondContact O-N 2.77Å; I41-R44 PolarHBondContact O-N 2.88Å; R44-S47 PolarHBondContact O-N 2.9Å; R44-E48 WeakPolarHBondContact O-CB 3.32Å; R44-E48 WeakPolarHBondContact O-CG 3.48Å; R44-E48 PolarHBondContact O-N 3.17Å
45D61.4Low64.4Low70 Ų7099 Ų9937%0.37451%0.514SS..Hα-helixtrans-69.7-36.3-179.9-16524.2000111.5I41 R49I41-D45 WeakPolarHBondContact O-CB 3.37Å; I41-D45 PolarHBondContact O-N 2.83Å; D45-R49 WeakPolarHBondContact O-CB 3.25Å; D45-R49 VanDerWaalsContact O-CG 3.23Å; D45-R49 WeakPolarHBondContact O-CG 3.41Å; D45-R49 PolarHBondContact O-N 3.33Å; D45-R49 IonicContact OD1-CZ 2.79Å; D45-R49 IonicContact OD1-NE 3.32Å; D45-R49 PolarHBondContact OD1-NE 3.1Å; D45-R49 IonicContact OD1-NH2 3.7Å; D45-R49 IonicContact OD2-CZ 3.97Å; D45-R49 IonicContact OD2-NE 3.55Å; D45-R49 IonicContact OD2-NH2 3.71Å; D45-R49 PolarHBondContact OD2-NH2 3.32Å
46T56.2Low62.9Low74 Ų74100.4 Ų100.445%0.45451%0.513SS..Hα-helixtrans-69.4-40.8170.350.50000111.9V42 G43 R49 V50V42-T46 HydrophobicContact CG1-CG2 4.36Å; V42-T46 VanDerWaalsContact O-CB 3.31Å; V42-T46 WeakPolarHBondContact O-CB 3.3Å; V42-T46 VanDerWaalsContact O-CG2 3.29Å; V42-T46 WeakPolarHBondContact O-CG2 3.44Å; V42-T46 PolarHBondContact O-N 3.45Å; V42-T46 PolarHBondContact O-OG1 2.96Å; G43-T46 WeakPolarHBondContact CA-OG1 3.21Å; G43-T46 PolarHBondContact O-OG1 2.62Å; T46-R49 PolarHBondContact O-N 3.29Å; T46-V50 VanDerWaalsContact O-CB 3.25Å; T46-V50 WeakPolarHBondContact O-CB 3.2Å; T46-V50 WeakPolarHBondContact O-CG2 3.28Å; T46-V50 PolarHBondContact O-N 2.76Å
47S55.3Low61.5Low69 Ų69106.1 Ų106.148%0.48353%0.528SS..Hα-helixtrans-63.9-43.1174.6-66.50000112.2G43 R44 V50 M51G43-S47 WeakPolarHBondContact O-CB 3.23Å; G43-S47 PolarHBondContact O-N 3.46Å; G43-S47 PolarHBondContact O-OG 2.95Å; R44-S47 PolarHBondContact O-N 2.9Å; S47-V50 PolarHBondContact O-N 2.9Å; S47-M51 WeakPolarHBondContact O-CB 3.36Å; S47-M51 VanDerWaalsContact O-CG 3.25Å; S47-M51 WeakPolarHBondContact O-CG 3.34Å; S47-M51 PolarHBondContact O-N 3.47Å
48E57.2Low60.3Low94 Ų94108.6 Ų108.644%0.43953%0.534SS..Hα-helixtrans-66.7-38.8177.5-79.1-168.3-172.500112.3R44 M51 R52R44-E48 WeakPolarHBondContact O-CB 3.32Å; R44-E48 WeakPolarHBondContact O-CG 3.48Å; R44-E48 PolarHBondContact O-N 3.17Å; E48-M51 PolarHBondContact O-N 3.19Å; E48-R52 WeakPolarHBondContact O-CB 3.44Å; E48-R52 WeakPolarHBondContact O-CG 3.22Å; E48-R52 PolarHBondContact O-N 3.09Å; E48-R52 IonicContact OE2-CZ 3.59Å; E48-R52 IonicContact OE2-NH1 3.85Å; E48-R52 IonicContact OE2-NH2 2.76Å; E48-R52 PolarHBondContact OE2-NH2 3.27Å
49R56.5Low59Low162 Ų162106.9 Ų106.961%0.61153%0.532SS*.Hα-helixtrans-68.2-36.1173.2-72.8176.6-161.1-160.17.7112.5D45 T46 S53D45-R49 WeakPolarHBondContact O-CB 3.25Å; D45-R49 VanDerWaalsContact O-CG 3.23Å; D45-R49 WeakPolarHBondContact O-CG 3.41Å; D45-R49 PolarHBondContact O-N 3.33Å; D45-R49 IonicContact OD1-CZ 2.79Å; D45-R49 IonicContact OD1-NE 3.32Å; D45-R49 PolarHBondContact OD1-NE 3.1Å; D45-R49 IonicContact OD1-NH2 3.7Å; D45-R49 IonicContact OD2-CZ 3.97Å; D45-R49 IonicContact OD2-NE 3.55Å; D45-R49 IonicContact OD2-NH2 3.71Å; D45-R49 PolarHBondContact OD2-NH2 3.32Å; T46-R49 PolarHBondContact O-N 3.29Å; R49-S53 VanDerWaalsContact O-CB 3.27Å; R49-S53 WeakPolarHBondContact O-CB 3.31Å; R49-S53 PolarHBondContact O-N 3.12Å; R49-S53 PolarHBondContact O-OG 2.83Å
50V53.9Low58Low74 Ų74114.1 Ų114.145%0.44855%0.547SS..Hα-helixtrans-68.7-35.5173.9169.40000111.1T46 S47 L56T46-V50 VanDerWaalsContact O-CB 3.25Å; T46-V50 WeakPolarHBondContact O-CB 3.2Å; T46-V50 WeakPolarHBondContact O-CG2 3.28Å; T46-V50 PolarHBondContact O-N 2.76Å; S47-V50 PolarHBondContact O-N 2.9Å; V50-L56 HydrophobicContact CG1-CD1 4.28Å; V50-L56 HydrophobicContact CG1-CD2 3.73Å; V50-L56 HydrophobicContact CG1-CG 4.14Å; V50-L56 VanDerWaalsContact O-CD1 3.29Å; V50-L56 WeakPolarHBondContact O-CD1 3.2Å; V50-L56 WeakPolarHBondContact O-CG 3.24Å
51M53.9Low57Low159 Ų159116.8 Ų116.878%0.78356%0.559SS**Hα-helixtrans-78.3-32.8176.8-71.5-16582.500113.7S47 E48S47-M51 WeakPolarHBondContact O-CB 3.36Å; S47-M51 VanDerWaalsContact O-CG 3.25Å; S47-M51 WeakPolarHBondContact O-CG 3.34Å; S47-M51 PolarHBondContact O-N 3.47Å; E48-M51 PolarHBondContact O-N 3.19Å
52R57.2Low55.9Low185 Ų185117.8 Ų117.870%0.69856%0.561SS**Hα-helixtrans-81.8-24.5178-74.8-173-162.8132.917113.7E48 Q54E48-R52 WeakPolarHBondContact O-CB 3.44Å; E48-R52 WeakPolarHBondContact O-CG 3.22Å; E48-R52 PolarHBondContact O-N 3.09Å; E48-R52 IonicContact OE2-CZ 3.59Å; E48-R52 IonicContact OE2-NH1 3.85Å; E48-R52 IonicContact OE2-NH2 2.76Å; E48-R52 PolarHBondContact OE2-NH2 3.27Å; R52-Q54 PolarHBondContact O-N 3.47Å
53S47.4Very low55Low47 Ų47116.6 Ų116.633%0.32956%0.561SS.*SBendtrans-83.4119.3178.763.70000109.7R49 T55 L56R49-S53 VanDerWaalsContact O-CB 3.27Å; R49-S53 WeakPolarHBondContact O-CB 3.31Å; R49-S53 PolarHBondContact O-N 3.12Å; R49-S53 PolarHBondContact O-OG 2.83Å; S53-T55 WeakPolarHBondContact CB-OG1 3.26Å; S53-T55 PolarHBondContact O-N 2.83Å; S53-L56 PolarHBondContact O-N 3.26Å
54Q52.5Low54.4Low197 Ų197118.5 Ų118.592%0.92158%0.581SS**THydrogen-bonded Turntrans-57.98.8167.5-69.6170.1-18.800113.3R52R52-Q54 PolarHBondContact O-N 3.47Å
55T55.3Low54.3Low59 Ų59120.9 Ų120.936%0.36259%0.59SS.*THydrogen-bonded Turntrans-79.3-10.6178-32.80000113S53 R57 Q58 V59S53-T55 WeakPolarHBondContact CB-OG1 3.26Å; S53-T55 PolarHBondContact O-N 2.83Å; T55-R57 PolarHBondContact O-N 2.8Å; T55-R57 VanDerWaalsContact O-N 3.13Å; T55-Q58 HydrophobicContact CG2-CB 4.24Å; T55-Q58 PolarHBondContact O-N 2.84Å; T55-V59 HydrophobicContact CG2-CG2 4.07Å; T55-V59 WeakPolarHBondContact O-CG2 3.42Å; T55-V59 PolarHBondContact O-N 3.34Å
56L53.2Low53.9Low88 Ų88122.7 Ų122.746%0.46160%0.603SS.*Hα-helixtrans-58.9-24.9175.7-84.8172.3000114.1V50 S53 R60V50-L56 HydrophobicContact CG1-CD1 4.28Å; V50-L56 HydrophobicContact CG1-CD2 3.73Å; V50-L56 HydrophobicContact CG1-CG 4.14Å; V50-L56 VanDerWaalsContact O-CD1 3.29Å; V50-L56 WeakPolarHBondContact O-CD1 3.2Å; V50-L56 WeakPolarHBondContact O-CG 3.24Å; S53-L56 PolarHBondContact O-N 3.26Å; L56-R60 VanDerWaalsContact O-CB 3.23Å; L56-R60 WeakPolarHBondContact O-CB 3.4Å; L56-R60 PolarHBondContact O-N 3.3Å
57R54Low53.8Low219 Ų219123.9 Ų123.983%0.82661%0.612SS**Hα-helixtrans-78.6-34.2173.3-76.4-174.1175-172.7-0.9113T55 Q61T55-R57 PolarHBondContact O-N 2.8Å; T55-R57 VanDerWaalsContact O-N 3.13Å; R57-Q61 PolarHBondContact O-N 2.86Å
58Q53.7Low53.8Low123 Ų123124.3 Ų124.358%0.57563%0.628SS**Hα-helixtrans-73.5-43.5172.6-91.6174.5-10.600111.3T55 R60 Q61 E62T55-Q58 HydrophobicContact CG2-CB 4.24Å; T55-Q58 PolarHBondContact O-N 2.84Å; Q58-R60 VanDerWaalsContact C-N 3.31Å; Q58-R60 PolarHBondContact O-N 3.46Å; Q58-Q61 CarbonylContact O-C 3.57Å; Q58-Q61 PolarHBondContact O-N 3.38Å; Q58-Q61 VanDerWaalsContact O-N 3.08Å; Q58-E62 WeakPolarHBondContact O-CB 3.45Å; Q58-E62 WeakPolarHBondContact O-CG 3.47Å; Q58-E62 PolarHBondContact O-N 3.15Å
59V55.8Low54Low70 Ų70123.9 Ų123.942%0.42463%0.628SS.*Hα-helixtrans-65.8-32175.7178.10000111.3T55 Q61 E62 A63T55-V59 HydrophobicContact CG2-CG2 4.07Å; T55-V59 WeakPolarHBondContact O-CG2 3.42Å; T55-V59 PolarHBondContact O-N 3.34Å; V59-Q61 VanDerWaalsContact C-N 3.34Å; V59-E62 PolarHBondContact O-N 3.24Å; V59-A63 WeakPolarHBondContact O-CA 3.26Å; V59-A63 WeakPolarHBondContact O-CB 3.22Å; V59-A63 PolarHBondContact O-N 3.01Å
60R52.3Low54.4Low214 Ų214123.8 Ų123.881%0.80864%0.639SS**Hα-helixtrans-69.7-31.2172.3-169.6172.5-174.2-177.81.2112.8L56 Q58 G64L56-R60 VanDerWaalsContact O-CB 3.23Å; L56-R60 WeakPolarHBondContact O-CB 3.4Å; L56-R60 PolarHBondContact O-N 3.3Å; Q58-R60 VanDerWaalsContact C-N 3.31Å; Q58-R60 PolarHBondContact O-N 3.46Å; R60-G64 PolarHBondContact O-N 2.92Å
61Q54.3Low54.9Low150 Ų150126.7 Ų126.770%0.70165%0.648SS**Hα-helixtrans-79.4-31173.8-76.2-179.82.600112.7R57 Q58 V59R57-Q61 PolarHBondContact O-N 2.86Å; Q58-Q61 CarbonylContact O-C 3.57Å; Q58-Q61 PolarHBondContact O-N 3.38Å; Q58-Q61 VanDerWaalsContact O-N 3.08Å; V59-Q61 VanDerWaalsContact C-N 3.34Å
62E52.5Low55.7Low125 Ų125125 Ų12558%0.58464%0.638SS**Hα-helixtrans-84.6-30.6176.1-72.5-178.3175.100113.1Q58 V59 G64 R65 V66Q58-E62 WeakPolarHBondContact O-CB 3.45Å; Q58-E62 WeakPolarHBondContact O-CG 3.47Å; Q58-E62 PolarHBondContact O-N 3.15Å; V59-E62 PolarHBondContact O-N 3.24Å; E62-G64 VanDerWaalsContact C-N 3.26Å; E62-R65 CarbonylContact O-C 3.53Å; E62-R65 WeakPolarHBondContact O-CA 3.26Å; E62-R65 WeakPolarHBondContact O-CB 3.18Å; E62-R65 PolarHBondContact O-N 3.37Å; E62-V66 PolarHBondContact O-N 3.26Å; E62-V66 VanDerWaalsContact O-N 3.11Å
63A49.3Very low56.7Low66 Ų66121 Ų12155%0.54563%0.634SS.*THydrogen-bonded Turntrans-74.2-18.7169.200000111.9V59 R65V59-A63 WeakPolarHBondContact O-CA 3.26Å; V59-A63 WeakPolarHBondContact O-CB 3.22Å; V59-A63 PolarHBondContact O-N 3.01Å; A63-R65 PolarHBondContact O-N 2.9Å
64G49.6Very low58Low69 Ų69121.8 Ų121.871%0.71164%0.639SS**THydrogen-bonded Turntrans-69.6-9.9160.900000113.3R60 E62R60-G64 PolarHBondContact O-N 2.92Å; E62-G64 VanDerWaalsContact C-N 3.26Å
65R57.8Low59.3Low224 Ų224115.1 Ų115.185%0.84561%0.61SS**THydrogen-bonded Turntrans-118.6-5-177.8-93.2-175172.9143.3-0.7115.5E62 A63E62-R65 CarbonylContact O-C 3.53Å; E62-R65 WeakPolarHBondContact O-CA 3.26Å; E62-R65 WeakPolarHBondContact O-CB 3.18Å; E62-R65 PolarHBondContact O-N 3.37Å; A63-R65 PolarHBondContact O-N 2.9Å
66V54.3Low60.6Low109 Ų109121.4 Ų121.466%0.66163%0.627SS**SBendtrans-151.3124.2179.9-174.90000112E62E62-V66 PolarHBondContact O-N 3.26Å; E62-V66 VanDerWaalsContact O-N 3.11Å
67P53.7Low62.2Low98 Ų98123.2 Ų123.264%0.63664%0.637SS**  -127158.2-56.130.6-10.8000111.8D69P67-D69 PolarHBondContact O-N 3.13Å
68G54.6Low63.7Low79 Ų79119.2 Ų119.281%0.81462%0.622SS**  trans-73.726.6-178.100000116.9
69D62.8Low65.4Low84 Ų84120.7 Ų120.745%0.44962%0.622SS.*  trans-117.772.1-177.1-72.6-33.4000112.2P67 E71 E72 V73P67-D69 PolarHBondContact O-N 3.13Å; D69-E71 PolarHBondContact O-N 3.35Å; D69-E71 VanDerWaalsContact O-N 3.1Å; D69-E72 HydrophobicContact CB-CB 3.66Å; D69-E72 PolarHBondContact O-N 3.49Å; D69-V73 PolarHBondContact O-N 3.03Å
70L63.5Low67.1Low160 Ų160122 Ų12284%0.83863%0.63SS**Hα-helixtrans-48.5-31.5159.7-107.497.1000111.1S74L70-S74 WeakPolarHBondContact O-CB 3.45Å; L70-S74 PolarHBondContact O-N 3.43Å
71E65.6Low68.8Low135 Ų135120.6 Ų120.663%0.63163%0.625SS**Hα-helixtrans-65.8-41.3177.8-162.2171.4167.100112.4D69 S74 N75D69-E71 PolarHBondContact O-N 3.35Å; D69-E71 VanDerWaalsContact O-N 3.1Å; E71-S74 PolarHBondContact O-N 2.84Å; E71-S74 PolarHBondContact O-OG 2.88Å; E71-N75 WeakPolarHBondContact O-CB 3.26Å; E71-N75 VanDerWaalsContact O-CG 3.28Å; E71-N75 PolarHBondContact O-N 2.69Å; E71-N75 PolarHBondContact O-ND2 2.88Å; E71-N75 VanDerWaalsContact O-ND2 3.11Å
72E71Confident70.6Confident123 Ų123118 Ų11858%0.57561%0.613SS**Hα-helixtrans-71.1-38.3178.9-164.4174.4-156.200111.8D69 N75 R76D69-E72 HydrophobicContact CB-CB 3.66Å; D69-E72 PolarHBondContact O-N 3.49Å; E72-N75 PolarHBondContact O-N 2.81Å; E72-R76 WeakPolarHBondContact O-CB 3.39Å; E72-R76 PolarHBondContact O-N 3.34Å
73V77.3Confident72.4Confident101 Ų101116 Ų11661%0.61261%0.609SS**Hα-helixtrans-63.2-43171.4179.20000110.5D69 N75 R76 L77D69-V73 PolarHBondContact O-N 3.03Å; V73-N75 VanDerWaalsContact C-N 3.32Å; V73-N75 PolarHBondContact O-N 2.86Å; V73-R76 PolarHBondContact O-N 2.76Å; V73-L77 WeakPolarHBondContact O-CB 3.17Å; V73-L77 PolarHBondContact O-N 3.28Å
74S74.4Confident74.3Confident64 Ų64119.8 Ų119.845%0.44861%0.614SS.*Hα-helixtrans-62.4-39.7176.385.20000112.1L70 E71 L77 R78L70-S74 WeakPolarHBondContact O-CB 3.45Å; L70-S74 PolarHBondContact O-N 3.43Å; E71-S74 PolarHBondContact O-N 2.84Å; E71-S74 PolarHBondContact O-OG 2.88Å; S74-L77 PolarHBondContact O-N 3.49Å; S74-R78 WeakPolarHBondContact O-CB 3.43Å; S74-R78 PolarHBondContact O-N 3.47Å
75N81.1Confident76.4Confident58 Ų58120.5 Ų120.531%0.3160%0.604SS.*Hα-helixtrans-70.5-33.4179-80.1-37.8000112.2E71 E72 V73 R79E71-N75 WeakPolarHBondContact O-CB 3.26Å; E71-N75 VanDerWaalsContact O-CG 3.28Å; E71-N75 PolarHBondContact O-N 2.69Å; E71-N75 PolarHBondContact O-ND2 2.88Å; E71-N75 VanDerWaalsContact O-ND2 3.11Å; E72-N75 PolarHBondContact O-N 2.81Å; V73-N75 VanDerWaalsContact C-N 3.32Å; V73-N75 PolarHBondContact O-N 2.86Å; N75-R79 PolarHBondContact O-N 3.44Å; N75-R79 PolarHBondContact O-NE 3.48Å
76R82.6Confident78Confident190 Ų190116.3 Ų116.372%0.71759%0.592SS**Hα-helixtrans-72-41.4173.4-157.4167.1-171.2173.91.4111.2E72 V73 R78 R79 V80E72-R76 WeakPolarHBondContact O-CB 3.39Å; E72-R76 PolarHBondContact O-N 3.34Å; V73-R76 PolarHBondContact O-N 2.76Å; R76-R78 VanDerWaalsContact C-N 3.34Å; R76-R78 PolarHBondContact O-N 2.87Å; R76-R79 PolarHBondContact O-N 3.18Å; R76-V80 WeakPolarHBondContact O-CG2 3.02Å; R76-V80 PolarHBondContact O-N 2.89Å; R76-V80 VanDerWaalsContact O-N 3.11Å
77L86.3Confident79.6Confident127 Ų127117.8 Ų117.867%0.66559%0.591SS**Hα-helixtrans-62.4-41.2174.8-148.293.3000111.6V73 S74 V80 R81V73-L77 WeakPolarHBondContact O-CB 3.17Å; V73-L77 PolarHBondContact O-N 3.28Å; S74-L77 PolarHBondContact O-N 3.49Å; L77-V80 PolarHBondContact O-N 3.38Å; L77-R81 WeakPolarHBondContact O-CB 3.3Å; L77-R81 PolarHBondContact O-N 2.85Å
78R85.8Confident81.4Confident134 Ų134117 Ų11751%0.50658%0.584SS.*Hα-helixtrans-61-45.6176.9-173.5172.773.195.9-10.8111.7S74 R76 R81 E82S74-R78 WeakPolarHBondContact O-CB 3.43Å; S74-R78 PolarHBondContact O-N 3.47Å; R76-R78 VanDerWaalsContact C-N 3.34Å; R76-R78 PolarHBondContact O-N 2.87Å; R78-R81 WeakPolarHBondContact O-CB 3.18Å; R78-R81 PolarHBondContact O-N 2.76Å; R78-E82 WeakPolarHBondContact CG-OE1 3.49Å; R78-E82 IonicContact CZ-OE1 3.66Å; R78-E82 IonicContact NH1-OE1 2.7Å; R78-E82 PolarHBondContact NH1-OE1 3.16Å; R78-E82 IonicContact NH1-OE2 3.94Å; R78-E82 WeakPolarHBondContact O-CG 3.29Å; R78-E82 PolarHBondContact O-N 3.35Å
79R88Confident83Confident155 Ų155120.2 Ų120.259%0.58558%0.576SS**Hα-helixtrans-61-45176-85-177.2-87.1-177.4-8.1112.5N75 R76 R81 E82 T83N75-R79 PolarHBondContact O-N 3.44Å; N75-R79 PolarHBondContact O-NE 3.48Å; R76-R79 PolarHBondContact O-N 3.18Å; R79-R81 VanDerWaalsContact C-N 3.33Å; R79-R81 PolarHBondContact O-N 2.83Å; R79-E82 PolarHBondContact O-N 3.5Å; R79-T83 PolarHBondContact O-N 3.44Å; R79-T83 PolarHBondContact O-OG1 3.45Å; R79-T83 VanDerWaalsContact O-OG1 3.09Å
80V92.6Very high84.1Confident98 Ų98119.6 Ų119.659%0.59457%0.573SS**Hα-helixtrans-62.4-42.7177.5174.60000111.1R76 L77 T83 F84R76-V80 WeakPolarHBondContact O-CG2 3.02Å; R76-V80 PolarHBondContact O-N 2.89Å; R76-V80 VanDerWaalsContact O-N 3.11Å; L77-V80 PolarHBondContact O-N 3.38Å; V80-T83 PolarHBondContact O-N 3.19Å; V80-F84 WeakPolarHBondContact O-CB 3.38Å; V80-F84 PolarHBondContact O-N 3.45Å
81R88.6Confident85Confident183 Ų183114.2 Ų114.269%0.69156%0.556SS**Hα-helixtrans-60.4-45.5175179.5-172.6172.4-152.8-1.8111.7L77 R78 R79 F84 V85L77-R81 WeakPolarHBondContact O-CB 3.3Å; L77-R81 PolarHBondContact O-N 2.85Å; R78-R81 WeakPolarHBondContact O-CB 3.18Å; R78-R81 PolarHBondContact O-N 2.76Å; R79-R81 VanDerWaalsContact C-N 3.33Å; R79-R81 PolarHBondContact O-N 2.83Å; R81-F84 PolarHBondContact O-N 3.19Å; R81-V85 HydrophobicContact CG-CG2 4.45Å; R81-V85 VanDerWaalsContact O-CG2 3.31Å; R81-V85 WeakPolarHBondContact O-CG2 3.29Å; R81-V85 PolarHBondContact O-N 3.37Å
82E91.3Very high85.8Confident96 Ų96117.5 Ų117.545%0.44956%0.563SS.*Hα-helixtrans-62.3-44.4179.8-76.7171.3-170.800111.7R78 R79 F84 V85 K86R78-E82 WeakPolarHBondContact CG-OE1 3.49Å; R78-E82 IonicContact CZ-OE1 3.66Å; R78-E82 IonicContact NH1-OE1 2.7Å; R78-E82 PolarHBondContact NH1-OE1 3.16Å; R78-E82 IonicContact NH1-OE2 3.94Å; R78-E82 WeakPolarHBondContact O-CG 3.29Å; R78-E82 PolarHBondContact O-N 3.35Å; R79-E82 PolarHBondContact O-N 3.5Å; E82-F84 VanDerWaalsContact C-N 3.35Å; E82-F84 PolarHBondContact O-N 3.32Å; E82-V85 PolarHBondContact O-N 2.99Å; E82-K86 WeakPolarHBondContact O-CB 3.36Å; E82-K86 PolarHBondContact O-N 2.93Å
83T90.8Very high86.2Confident83 Ų83116.7 Ų116.751%0.50956%0.558SS.*Hα-helixtrans-60-46.3174.3-550000111R79 V80 V85 K86 E87R79-T83 PolarHBondContact O-N 3.44Å; R79-T83 PolarHBondContact O-OG1 3.45Å; R79-T83 VanDerWaalsContact O-OG1 3.09Å; V80-T83 PolarHBondContact O-N 3.19Å; T83-V85 PolarHBondContact O-N 3.49Å; T83-K86 WeakPolarHBondContact O-CB 3.46Å; T83-K86 PolarHBondContact O-N 2.9Å; T83-E87 WeakPolarHBondContact O-CB 3.48Å; T83-E87 PolarHBondContact O-N 3.48Å
84F88.6Confident86.2Confident146 Ų146116 Ų11664%0.6455%0.55SS**Hα-helixtrans-62.8-43-179.9-157.5-91.9000112.4V80 R81 E82 K86 E87 V88V80-F84 WeakPolarHBondContact O-CB 3.38Å; V80-F84 PolarHBondContact O-N 3.45Å; R81-F84 PolarHBondContact O-N 3.19Å; E82-F84 VanDerWaalsContact C-N 3.35Å; E82-F84 PolarHBondContact O-N 3.32Å; F84-K86 VanDerWaalsContact C-N 3.31Å; F84-K86 PolarHBondContact O-N 3.05Å; F84-E87 PolarHBondContact O-N 3.23Å; F84-V88 HydrophobicContact CD1-CG2 3.89Å; F84-V88 HydrophobicContact CE1-CG2 3.78Å; F84-V88 WeakPolarHBondContact O-CB 3.21Å; F84-V88 WeakPolarHBondContact O-CG2 3.43Å; F84-V88 PolarHBondContact O-N 3.35Å
85V94.9Very high86Confident83 Ų83114.3 Ų114.350%0.50354%0.543SS..Hα-helixtrans-62.7-40.3175.8169.50000111R81 E82 T83 K89R81-V85 HydrophobicContact CG-CG2 4.45Å; R81-V85 VanDerWaalsContact O-CG2 3.31Å; R81-V85 WeakPolarHBondContact O-CG2 3.29Å; R81-V85 PolarHBondContact O-N 3.37Å; E82-V85 PolarHBondContact O-N 2.99Å; T83-V85 PolarHBondContact O-N 3.49Å; V85-K89 VanDerWaalsContact O-CB 3.23Å; V85-K89 WeakPolarHBondContact O-CB 3.17Å; V85-K89 PolarHBondContact O-N 2.88Å
86K89.7Confident85.3Confident137 Ų137114.4 Ų114.460%0.59655%0.548SS*.Hα-helixtrans-65.4-49.2177.9-168.2-176.5177.1-165.70111.2E82 T83 F84 V88 K89 D90E82-K86 WeakPolarHBondContact O-CB 3.36Å; E82-K86 PolarHBondContact O-N 2.93Å; T83-K86 WeakPolarHBondContact O-CB 3.46Å; T83-K86 PolarHBondContact O-N 2.9Å; F84-K86 VanDerWaalsContact C-N 3.31Å; F84-K86 PolarHBondContact O-N 3.05Å; K86-V88 VanDerWaalsContact C-N 3.34Å; K86-V88 PolarHBondContact O-N 3.28Å; K86-K89 PolarHBondContact O-N 3.4Å; K86-D90 WeakPolarHBondContact O-CB 3.44Å; K86-D90 PolarHBondContact O-N 3.4Å
87E89.1Confident84.4Confident140 Ų140112.5 Ų112.565%0.65454%0.541SS*.Hα-helixtrans-57.6-45.5177.4-154.195.6-16400111.6T83 F84 D90 G91T83-E87 WeakPolarHBondContact O-CB 3.48Å; T83-E87 PolarHBondContact O-N 3.48Å; F84-E87 PolarHBondContact O-N 3.23Å; E87-D90 PolarHBondContact O-N 3.5Å; E87-G91 PolarHBondContact O-N 3.17Å
88V91.2Very high83.1Confident80 Ų80116.6 Ų116.649%0.48555%0.548SS..Hα-helixtrans-66.2-41.5179.1170.10000111.2F84 K86 W92F84-V88 HydrophobicContact CD1-CG2 3.89Å; F84-V88 HydrophobicContact CE1-CG2 3.78Å; F84-V88 WeakPolarHBondContact O-CB 3.21Å; F84-V88 WeakPolarHBondContact O-CG2 3.43Å; F84-V88 PolarHBondContact O-N 3.35Å; K86-V88 VanDerWaalsContact C-N 3.34Å; K86-V88 PolarHBondContact O-N 3.28Å; V88-W92 VanDerWaalsContact O-CB 3.31Å; V88-W92 WeakPolarHBondContact O-CB 3.15Å; V88-W92 PolarHBondContact O-N 2.92Å
89K87.8Confident81.8Confident148 Ų148117.1 Ų117.164%0.64356%0.559SS**Hα-helixtrans-67.1-43.2178.6-176.2179178.6-178.20111.7V85 K86 W92 K93V85-K89 VanDerWaalsContact O-CB 3.23Å; V85-K89 WeakPolarHBondContact O-CB 3.17Å; V85-K89 PolarHBondContact O-N 2.88Å; K86-K89 PolarHBondContact O-N 3.4Å; K89-W92 PolarHBondContact O-N 3.49Å; K89-K93 WeakPolarHBondContact O-CB 3.28Å; K89-K93 PolarHBondContact O-N 3.1Å
90D86.3Confident80.1Confident70 Ų70118.7 Ų118.737%0.37457%0.57SS.*Hα-helixtrans-69.7-43.7179.7-70.8-19.8000110.4K86 E87 W92 K93 D94K86-D90 WeakPolarHBondContact O-CB 3.44Å; K86-D90 PolarHBondContact O-N 3.4Å; E87-D90 PolarHBondContact O-N 3.5Å; D90-W92 VanDerWaalsContact C-N 3.31Å; D90-W92 PolarHBondContact O-N 3.18Å; D90-K93 PolarHBondContact O-N 2.76Å; D90-K93 VanDerWaalsContact O-N 3.16Å; D90-D94 PolarHBondContact O-N 2.92Å
91G83Confident77.7Confident48 Ų48126.2 Ų126.250%0.49560%0.595SS.*Hα-helixtrans-58.9-39.1172.600000113.2E87 G95E87-G91 PolarHBondContact O-N 3.17Å; G91-G95 PolarHBondContact O-N 3.38Å
92W82.1Confident77.2Confident204 Ų204123.4 Ų123.477%0.77359%0.59SS**Hα-helixtrans-68.1-41.6175-167.8-72000112.4V88 K89 D90 S96V88-W92 VanDerWaalsContact O-CB 3.31Å; V88-W92 WeakPolarHBondContact O-CB 3.15Å; V88-W92 PolarHBondContact O-N 2.92Å; K89-W92 PolarHBondContact O-N 3.49Å; D90-W92 VanDerWaalsContact C-N 3.31Å; D90-W92 PolarHBondContact O-N 3.18Å; W92-S96 VanDerWaalsContact O-CB 3.25Å; W92-S96 WeakPolarHBondContact O-CB 3.48Å; W92-S96 PolarHBondContact O-N 3.3Å
93K79.6Confident76.4Confident106 Ų106124.8 Ų124.846%0.46160%0.597SS.*Hα-helixtrans-68.3-38.7-179.5-170.7178-179.1-176.30112K89 D90 R97K89-K93 WeakPolarHBondContact O-CB 3.28Å; K89-K93 PolarHBondContact O-N 3.1Å; D90-K93 PolarHBondContact O-N 2.76Å; D90-K93 VanDerWaalsContact O-N 3.16Å; K93-R97 WeakPolarHBondContact O-CG 3.35Å; K93-R97 PolarHBondContact O-N 3.02Å; K93-R97 VanDerWaalsContact O-N 3.17Å
94D76.1Confident75.6Confident85 Ų85127.1 Ų127.146%0.45560%0.602SS.*Hα-helixtrans-76.2-36.1176.9-75.4-15.6000112.3D90 S96 R97 R98D90-D94 PolarHBondContact O-N 2.92Å; D94-S96 VanDerWaalsContact C-N 3.35Å; D94-R97 PolarHBondContact O-N 3.28Å; D94-R97 IonicContact OD1-NH1 3.41Å; D94-R97 PolarHBondContact OD1-NH1 3.42Å; D94-R98 PolarHBondContact O-N 2.57Å; D94-R98 VanDerWaalsContact O-N 3.1Å
95G71Confident74.9Confident30 Ų30126 Ų12631%0.30960%0.6SS.*Hα-helixtrans-59.4-45.2168.500000112G91 R97 R98 I99G91-G95 PolarHBondContact O-N 3.38Å; G95-R97 VanDerWaalsContact C-N 3.3Å; G95-R97 PolarHBondContact O-N 3.37Å; G95-R98 PolarHBondContact O-N 2.79Å; G95-I99 WeakPolarHBondContact O-CD1 3.14Å; G95-I99 VanDerWaalsContact O-CG1 3.26Å; G95-I99 WeakPolarHBondContact O-CG1 3.41Å; G95-I99 PolarHBondContact O-N 3.07Å; G95-I99 VanDerWaalsContact O-N 3.15Å
96S65.7Low73.6Confident59 Ų59128.7 Ų128.741%0.41361%0.606SS.*Hα-helixtrans-60.9-33.7176.4161.90000113.7W92 D94W92-S96 VanDerWaalsContact O-CB 3.25Å; W92-S96 WeakPolarHBondContact O-CB 3.48Å; W92-S96 PolarHBondContact O-N 3.3Å; D94-S96 VanDerWaalsContact C-N 3.35Å
97R64.3Low72.6Confident150 Ų150128.1 Ų128.157%0.56661%0.607SS**Hα-helixtrans-77.3-32.4177.8-75.9170.7175.2164.6-12112.7K93 D94 G95K93-R97 WeakPolarHBondContact O-CG 3.35Å; K93-R97 PolarHBondContact O-N 3.02Å; K93-R97 VanDerWaalsContact O-N 3.17Å; D94-R97 PolarHBondContact O-N 3.28Å; D94-R97 IonicContact OD1-NH1 3.41Å; D94-R97 PolarHBondContact OD1-NH1 3.42Å; G95-R97 VanDerWaalsContact C-N 3.3Å; G95-R97 PolarHBondContact O-N 3.37Å
98R58.4Low71.4Confident214 Ų214127.3 Ų127.381%0.80860%0.604SS**Hα-helixtrans-73.1-26.8175.5-73.4-172.8-179.8-131.13.1113.3D94 G95 K100D94-R98 PolarHBondContact O-N 2.57Å; D94-R98 VanDerWaalsContact O-N 3.1Å; G95-R98 PolarHBondContact O-N 2.79Å; R98-K100 VanDerWaalsContact C-N 3.29Å
99I58.4Low69.9Low144 Ų144130.9 Ų130.974%0.73861%0.613SS**THydrogen-bonded Turntrans-78.6-12.2177.7-62.7163.2000112.3G95G95-I99 WeakPolarHBondContact O-CD1 3.14Å; G95-I99 VanDerWaalsContact O-CG1 3.26Å; G95-I99 WeakPolarHBondContact O-CG1 3.41Å; G95-I99 PolarHBondContact O-N 3.07Å; G95-I99 VanDerWaalsContact O-N 3.15Å
100K52.5Low68.4Low189 Ų189129.5 Ų129.582%0.82261%0.61SS**THydrogen-bonded Turntrans-988.6179.7-90.6-170.4173.8-173.50115R98R98-K100 VanDerWaalsContact C-N 3.29Å
101K43Very low66.7Low255 Ų255134.9 Ų134.9100%1.10963%0.632SS**  trans-111.20165.8-94.2-169.6174.5-172.30108.8

Retrieved 101 of 101 residues in 224.4 ms (Link to these results)