A0A060XXM7_ONCMY Loading...

KxDL motif-containing protein 1

AlphaFold DB , UniProt , Accession A0A060XXM7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 187 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
1M58.6Low85.1Confident244 Ų244109.9 Ų109.9100%1.20262%0.623SS**  0116.50-164.7169-166.600106
2E66.1Low85.6Confident181 Ų181116.7 Ų116.785%0.84663%0.631SS**PPolyproline II helixtrans-64.3142.1179-75.9-166.8143.800110.5T4E2-T4 PolarHBondContact O-N 3.06Å
3P79.9Confident85.8Confident88 Ų88116.1 Ų116.157%0.57162%0.624SS**PPolyproline II helixtrans-65.2130.5179.226.7-32.5000110.3M8P3-M8 HydrophobicContact CB-CG 4Å; P3-M8 HydrophobicContact CB-SD 3.75Å; P3-M8 HydrophobicContact CG-CG 4.08Å; P3-M8 HydrophobicContact CG-SD 3.59Å; P3-M8 VanDerWaalsContact CG-SD 3.59Å
4T92.8Very high85.9Confident100 Ų100117.3 Ų117.361%0.61363%0.629SS**PPolyproline II helixtrans-60.9145.6175.8-41.90000110.3E2 S6 G7 M8E2-T4 PolarHBondContact O-N 3.06Å; T4-S6 PolarHBondContact O-N 3.13Å; T4-S6 VanDerWaalsContact O-N 3.17Å; T4-G7 WeakPolarHBondContact O-CA 3.36Å; T4-G7 PolarHBondContact O-N 2.88Å; T4-M8 PolarHBondContact O-N 3.34Å
5A91.1Very high86Confident84 Ų84115.2 Ų115.269%0.69463%0.627SS**Hα-helixtrans-53.2-37.5179.100000113.4M8 F9A5-M8 PolarHBondContact O-N 2.79Å; A5-F9 PolarHBondContact O-N 2.95Å
6S93.1Very high86.3Confident77 Ų77117.4 Ų117.454%0.53863%0.634SS.*Hα-helixtrans-64.9-39.4173.653.60000112.8T4 F9 C10T4-S6 PolarHBondContact O-N 3.13Å; T4-S6 VanDerWaalsContact O-N 3.17Å; S6-F9 PolarHBondContact O-N 3.3Å; S6-C10 PolarHBondContact O-N 2.91Å; S6-C10 PolarHBondContact O-SG 3.1Å; S6-C10 VanDerWaalsContact O-SG 3.33Å
7G91.6Very high86.6Confident28 Ų28116.3 Ų116.329%0.28963%0.632SS.*Hα-helixtrans-64.1-40.6175.300000112.2T4 N11T4-G7 WeakPolarHBondContact O-CA 3.36Å; T4-G7 PolarHBondContact O-N 2.88Å; G7-N11 WeakPolarHBondContact O-CB 3.44Å; G7-N11 VanDerWaalsContact O-CG 3.28Å; G7-N11 PolarHBondContact O-N 3.03Å; G7-N11 PolarHBondContact O-ND2 2.81Å; G7-N11 VanDerWaalsContact O-ND2 3.08Å
8M91.3Very high86.9Confident108 Ų108114.1 Ų114.153%0.53262%0.619SS.*Hα-helixtrans-64.4-41.9175.1-66.9-63.9-74.200112.1P3 T4 A5 R12P3-M8 HydrophobicContact CB-CG 4Å; P3-M8 HydrophobicContact CB-SD 3.75Å; P3-M8 HydrophobicContact CG-CG 4.08Å; P3-M8 HydrophobicContact CG-SD 3.59Å; P3-M8 VanDerWaalsContact CG-SD 3.59Å; T4-M8 PolarHBondContact O-N 3.34Å; A5-M8 PolarHBondContact O-N 2.79Å; M8-R12 WeakPolarHBondContact O-CB 3.32Å; M8-R12 PolarHBondContact O-N 3.29Å
9F91.8Very high87.1Confident133 Ų133111.5 Ų111.558%0.58362%0.615SS**Hα-helixtrans-62.9-49175.6175.3-99.6000112.3A5 S6 N11 R12 M13A5-F9 PolarHBondContact O-N 2.95Å; S6-F9 PolarHBondContact O-N 3.3Å; F9-N11 PolarHBondContact O-N 3.4Å; F9-R12 WeakPolarHBondContact O-CB 3.36Å; F9-R12 PolarHBondContact O-N 2.93Å; F9-M13 HydrophobicContact CD1-SD 4.21Å; F9-M13 HydrophobicContact CE1-CG 4.24Å; F9-M13 HydrophobicContact CE1-SD 3.36Å; F9-M13 WeakPolarHBondContact CE1-SD 3.41Å; F9-M13 HydrophobicContact CE2-CG 4.44Å; F9-M13 HydrophobicContact CE2-SD 4.27Å; F9-M13 HydrophobicContact CZ-CG 4.11Å; F9-M13 HydrophobicContact CZ-SD 3.39Å; F9-M13 WeakPolarHBondContact CZ-SD 3.4Å; F9-M13 PolarHBondContact O-N 3.24Å
10C91.4Very high87.5Confident65 Ų65113.3 Ų113.344%0.43962%0.619SS.*Hα-helixtrans-61.4-42.7177.3-69.40000112S6 R12 M13 L14S6-C10 PolarHBondContact O-N 2.91Å; S6-C10 PolarHBondContact O-SG 3.1Å; S6-C10 VanDerWaalsContact O-SG 3.33Å; C10-R12 VanDerWaalsContact C-N 3.34Å; C10-R12 PolarHBondContact O-N 3.07Å; C10-M13 PolarHBondContact O-N 3.36Å; C10-L14 WeakPolarHBondContact O-CB 3.27Å; C10-L14 VanDerWaalsContact O-CG 3.31Å; C10-L14 WeakPolarHBondContact O-CG 3.42Å; C10-L14 PolarHBondContact O-N 3.28Å
11N88.7Confident87.9Confident101 Ų101112.3 Ų112.354%0.5461%0.613SS.*Hα-helixtrans-62.4-41.2176-78.7-35.9000111.9G7 F9 L14 S15G7-N11 WeakPolarHBondContact O-CB 3.44Å; G7-N11 VanDerWaalsContact O-CG 3.28Å; G7-N11 PolarHBondContact O-N 3.03Å; G7-N11 PolarHBondContact O-ND2 2.81Å; G7-N11 VanDerWaalsContact O-ND2 3.08Å; F9-N11 PolarHBondContact O-N 3.4Å; N11-L14 PolarHBondContact O-N 2.97Å; N11-S15 WeakPolarHBondContact O-CB 3.13Å; N11-S15 PolarHBondContact O-N 3.38Å; N11-S15 PolarHBondContact O-OG 2.97Å
12R90.4Very high89.7Confident191 Ų191103.8 Ų103.872%0.72157%0.574SS**Hα-helixtrans-59.4-49.3174.7-16393.7178.2-170.52.4110.3M8 F9 C10 L14 S15 M16M8-R12 WeakPolarHBondContact O-CB 3.32Å; M8-R12 PolarHBondContact O-N 3.29Å; F9-R12 WeakPolarHBondContact O-CB 3.36Å; F9-R12 PolarHBondContact O-N 2.93Å; C10-R12 VanDerWaalsContact C-N 3.34Å; C10-R12 PolarHBondContact O-N 3.07Å; R12-L14 PolarHBondContact O-N 2.96Å; R12-S15 PolarHBondContact O-N 3.46Å; R12-S15 PolarHBondContact O-OG 3.37Å; R12-M16 WeakPolarHBondContact O-CG 3.46Å; R12-M16 PolarHBondContact O-N 3.27Å
13M88.3Confident91.2Very high109 Ų10999.2 Ų99.254%0.53756%0.556SS.*Hα-helixtrans-60.4-43.3178.1-78.6-169.36500113F9 C10 S15 M16F9-M13 HydrophobicContact CD1-SD 4.21Å; F9-M13 HydrophobicContact CE1-CG 4.24Å; F9-M13 HydrophobicContact CE1-SD 3.36Å; F9-M13 WeakPolarHBondContact CE1-SD 3.41Å; F9-M13 HydrophobicContact CE2-CG 4.44Å; F9-M13 HydrophobicContact CE2-SD 4.27Å; F9-M13 HydrophobicContact CZ-CG 4.11Å; F9-M13 HydrophobicContact CZ-SD 3.39Å; F9-M13 WeakPolarHBondContact CZ-SD 3.4Å; F9-M13 PolarHBondContact O-N 3.24Å; C10-M13 PolarHBondContact O-N 3.36Å; M13-S15 VanDerWaalsContact C-N 3.31Å; M13-S15 PolarHBondContact O-N 2.99Å; M13-M16 WeakPolarHBondContact O-CB 3.39Å; M13-M16 PolarHBondContact O-N 3.34Å
14L87.1Confident92Very high133 Ų13397.6 Ų97.670%0.69655%0.55SS*.Hα-helixtrans-66.6-33.4177.9-70.2169.7000112.1C10 N11 R12 M16C10-L14 WeakPolarHBondContact O-CB 3.27Å; C10-L14 VanDerWaalsContact O-CG 3.31Å; C10-L14 WeakPolarHBondContact O-CG 3.42Å; C10-L14 PolarHBondContact O-N 3.28Å; N11-L14 PolarHBondContact O-N 2.97Å; R12-L14 PolarHBondContact O-N 2.96Å; L14-M16 VanDerWaalsContact C-N 3.3Å; L14-M16 PolarHBondContact O-N 3.26Å
15S87.6Confident92.3Very high86 Ų8697.5 Ų97.560%0.60154%0.544SS*.Hα-helixtrans-76.9-11.4177.571.10000114.6N11 R12 M13 V17N11-S15 WeakPolarHBondContact O-CB 3.13Å; N11-S15 PolarHBondContact O-N 3.38Å; N11-S15 PolarHBondContact O-OG 2.97Å; R12-S15 PolarHBondContact O-N 3.46Å; R12-S15 PolarHBondContact O-OG 3.37Å; M13-S15 VanDerWaalsContact C-N 3.31Å; M13-S15 PolarHBondContact O-N 2.99Å; S15-V17 PolarHBondContact O-N 3.29Å
16M90.9Very high92.6Very high151 Ų15196.4 Ų96.474%0.74453%0.526SS*.THydrogen-bonded Turntrans-69.2-20178.5-73.4175.366.600112.8R12 M13 L14R12-M16 WeakPolarHBondContact O-CG 3.46Å; R12-M16 PolarHBondContact O-N 3.27Å; M13-M16 WeakPolarHBondContact O-CB 3.39Å; M13-M16 PolarHBondContact O-N 3.34Å; L14-M16 VanDerWaalsContact C-N 3.3Å; L14-M16 PolarHBondContact O-N 3.26Å
17V90.8Very high92.9Very high98 Ų9899.1 Ų99.159%0.59453%0.53SS*.SBendtrans-102.4119.4174.8-179.30000108.4S15 A19 V22S15-V17 PolarHBondContact O-N 3.29Å; V17-A19 PolarHBondContact O-N 2.97Å; V17-V22 HydrophobicContact CG1-CG2 3.77Å
18N92.6Very high93.2Very high76 Ų76100.4 Ų100.441%0.40654%0.539SS..  trans-76.6106.9174.3-172.6-8.4000109.7E20 D21 V22N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 VanDerWaalsContact OD1-CB 3.27Å; N18-E20 WeakPolarHBondContact OD1-CB 3.29Å; N18-E20 PolarHBondContact OD1-N 3.43Å; N18-D21 HydrophobicContact CB-CB 4.13Å; N18-D21 VanDerWaalsContact CB-OD2 3.29Å; N18-D21 WeakPolarHBondContact CB-OD2 3.4Å; N18-D21 VanDerWaalsContact ND2-CG 3.29Å; N18-D21 PolarHBondContact ND2-OD2 3.01Å; N18-D21 PolarHBondContact O-N 3.32Å; N18-V22 WeakPolarHBondContact O-CG2 3.44Å; N18-V22 PolarHBondContact O-N 3.35Å; N18-V22 VanDerWaalsContact O-N 3.16Å
19A90.6Very high93.6Very high65 Ų65101.1 Ų101.154%0.53754%0.541SS..Hα-helixtrans-62.2-27178.700000112.8V17 N23V17-A19 PolarHBondContact O-N 2.97Å; A19-N23 WeakPolarHBondContact O-CB 3.23Å; A19-N23 PolarHBondContact O-N 3.15Å; A19-N23 PolarHBondContact O-ND2 3.48Å
20E95Very high93.9Very high148 Ų148103.4 Ų103.469%0.69255%0.545SS*.Hα-helixtrans-68.5-48.3177-170173.1-173.300110.9N18 V22 N23 A24N18-E20 PolarHBondContact O-N 2.94Å; N18-E20 VanDerWaalsContact OD1-CB 3.27Å; N18-E20 WeakPolarHBondContact OD1-CB 3.29Å; N18-E20 PolarHBondContact OD1-N 3.43Å; E20-V22 VanDerWaalsContact C-N 3.34Å; E20-V22 PolarHBondContact O-N 2.9Å; E20-N23 PolarHBondContact O-N 3.1Å; E20-A24 WeakPolarHBondContact O-CB 3.35Å; E20-A24 PolarHBondContact O-N 3.04Å
21D95.9Very high94.2Very high92 Ų92105.1 Ų105.149%0.49255%0.547SS..Hα-helixtrans-62.3-41.4178-64.8-28000111.5N18 N23 A24 I25N18-D21 HydrophobicContact CB-CB 4.13Å; N18-D21 VanDerWaalsContact CB-OD2 3.29Å; N18-D21 WeakPolarHBondContact CB-OD2 3.4Å; N18-D21 VanDerWaalsContact ND2-CG 3.29Å; N18-D21 PolarHBondContact ND2-OD2 3.01Å; N18-D21 PolarHBondContact O-N 3.32Å; D21-N23 PolarHBondContact O-N 2.99Å; D21-A24 PolarHBondContact O-N 2.86Å; D21-I25 VanDerWaalsContact O-CG1 3.3Å; D21-I25 WeakPolarHBondContact O-CG1 3.37Å; D21-I25 PolarHBondContact O-N 2.94Å
22V96.3Very high94.7Very high65 Ų65105.3 Ų105.339%0.39455%0.546SS..Hα-helixtrans-61.3-44.4175.61740000110.9V17 N18 E20 I25 I26V17-V22 HydrophobicContact CG1-CG2 3.77Å; N18-V22 WeakPolarHBondContact O-CG2 3.44Å; N18-V22 PolarHBondContact O-N 3.35Å; N18-V22 VanDerWaalsContact O-N 3.16Å; E20-V22 VanDerWaalsContact C-N 3.34Å; E20-V22 PolarHBondContact O-N 2.9Å; V22-I25 PolarHBondContact O-N 3.26Å; V22-I26 HydrophobicContact CG1-CD1 3.98Å; V22-I26 VanDerWaalsContact O-CG1 3.29Å; V22-I26 WeakPolarHBondContact O-CG1 3.46Å; V22-I26 PolarHBondContact O-N 3.46Å
23N97.1Very high95.1Very high86 Ų86100.9 Ų100.946%0.4654%0.536SS..Hα-helixtrans-66.6-36.3176.6-80.9-57.4000112.4A19 E20 D21 I26 Q27A19-N23 WeakPolarHBondContact O-CB 3.23Å; A19-N23 PolarHBondContact O-N 3.15Å; A19-N23 PolarHBondContact O-ND2 3.48Å; E20-N23 PolarHBondContact O-N 3.1Å; D21-N23 PolarHBondContact O-N 2.99Å; N23-I26 PolarHBondContact O-N 3.39Å; N23-Q27 WeakPolarHBondContact O-CG 3.43Å; N23-Q27 PolarHBondContact O-N 3.32Å
24A98.1Very high95.6Very high54 Ų5498.6 Ų98.645%0.44653%0.526SS..Hα-helixtrans-62.9-42.7174.800000111.3E20 D21 Q27 A28E20-A24 WeakPolarHBondContact O-CB 3.35Å; E20-A24 PolarHBondContact O-N 3.04Å; D21-A24 PolarHBondContact O-N 2.86Å; A24-Q27 PolarHBondContact O-N 3.03Å; A24-A28 WeakPolarHBondContact O-CB 3.45Å; A24-A28 PolarHBondContact O-N 3.44Å
25I98.1Very high96.1Very high97 Ų9799.5 Ų99.550%0.49752%0.52SS..Hα-helixtrans-61-47.3174.3-68.2165000110.7D21 V22 Q27 A28 Q29D21-I25 VanDerWaalsContact O-CG1 3.3Å; D21-I25 WeakPolarHBondContact O-CG1 3.37Å; D21-I25 PolarHBondContact O-N 2.94Å; V22-I25 PolarHBondContact O-N 3.26Å; I25-Q27 VanDerWaalsContact C-N 3.31Å; I25-Q27 PolarHBondContact O-N 3.22Å; I25-A28 PolarHBondContact O-N 2.87Å; I25-Q29 HydrophobicContact CG2-CG 4.38Å; I25-Q29 WeakPolarHBondContact O-CB 3.44Å; I25-Q29 WeakPolarHBondContact O-CG 3.3Å; I25-Q29 PolarHBondContact O-N 2.88Å
26I98.2Very high96.7Very high61 Ų61101.5 Ų101.531%0.31352%0.518SS..Hα-helixtrans-59.4-43.8178.9-68.6165.2000110.7V22 N23 Q29 R30V22-I26 HydrophobicContact CG1-CD1 3.98Å; V22-I26 VanDerWaalsContact O-CG1 3.29Å; V22-I26 WeakPolarHBondContact O-CG1 3.46Å; V22-I26 PolarHBondContact O-N 3.46Å; N23-I26 PolarHBondContact O-N 3.39Å; I26-Q29 PolarHBondContact O-N 3.28Å; I26-R30 WeakPolarHBondContact O-CG 3.41Å; I26-R30 PolarHBondContact O-N 3.29Å
27Q98.6Very high97Very high134 Ų13499.8 Ų99.863%0.62651%0.508SS*.Hα-helixtrans-64.7-44177.7-73.6179.453.900112N23 A24 I25 Q29 R30 H31N23-Q27 WeakPolarHBondContact O-CG 3.43Å; N23-Q27 PolarHBondContact O-N 3.32Å; A24-Q27 PolarHBondContact O-N 3.03Å; I25-Q27 VanDerWaalsContact C-N 3.31Å; I25-Q27 PolarHBondContact O-N 3.22Å; Q27-Q29 VanDerWaalsContact C-N 3.33Å; Q27-Q29 PolarHBondContact O-N 2.92Å; Q27-R30 PolarHBondContact O-N 2.96Å; Q27-H31 WeakPolarHBondContact O-CB 3.44Å; Q27-H31 PolarHBondContact O-N 3.29Å
28A98.6Very high97.4Very high56 Ų56100.2 Ų100.246%0.46350%0.502SS..Hα-helixtrans-60.6-42.8176.900000111.8A24 I25 H31 M32A24-A28 WeakPolarHBondContact O-CB 3.45Å; A24-A28 PolarHBondContact O-N 3.44Å; I25-A28 PolarHBondContact O-N 2.87Å; A28-H31 PolarHBondContact O-N 2.95Å; A28-M32 WeakPolarHBondContact O-CB 3.47Å; A28-M32 PolarHBondContact O-N 2.97Å
29Q98.7Very high97.7Very high123 Ų12399.9 Ų99.958%0.57550%0.503SS*.Hα-helixtrans-65.3-42.9177-73.3176.7-19.500112.2I25 I26 Q27 M32 L33I25-Q29 HydrophobicContact CG2-CG 4.38Å; I25-Q29 WeakPolarHBondContact O-CB 3.44Å; I25-Q29 WeakPolarHBondContact O-CG 3.3Å; I25-Q29 PolarHBondContact O-N 2.88Å; I26-Q29 PolarHBondContact O-N 3.28Å; Q27-Q29 VanDerWaalsContact C-N 3.33Å; Q27-Q29 PolarHBondContact O-N 2.92Å; Q29-M32 PolarHBondContact O-N 3.19Å; Q29-L33 PolarHBondContact O-N 3.33Å
30R98.6Very high98.1Very high180 Ų180101.3 Ų101.368%0.67950%0.501SS*.Hα-helixtrans-62.4-44.4176-75.3176.8177.7-174.80112.2I26 Q27 M32 L33 D34I26-R30 WeakPolarHBondContact O-CG 3.41Å; I26-R30 PolarHBondContact O-N 3.29Å; Q27-R30 PolarHBondContact O-N 2.96Å; R30-M32 VanDerWaalsContact C-N 3.31Å; R30-M32 PolarHBondContact O-N 3.39Å; R30-L33 PolarHBondContact O-N 3.31Å; R30-D34 PolarHBondContact O-N 3.13Å
31H98.6Very high98.3Very high102 Ų102100.9 Ų100.947%0.47250%0.5SS..Hα-helixtrans-63-39.4175.8170.7-101.6000111.4Q27 A28 R35Q27-H31 WeakPolarHBondContact O-CB 3.44Å; Q27-H31 PolarHBondContact O-N 3.29Å; A28-H31 PolarHBondContact O-N 2.95Å; H31-R35 PolarHBondContact CE1-NH1 3.47Å; H31-R35 PolarHBondContact NE2-NH1 3.03Å; H31-R35 WeakPolarHBondContact O-CG 3.37Å; H31-R35 PolarHBondContact O-N 3.08Å; H31-R35 VanDerWaalsContact O-N 3.15Å
32M98.8Very high98.4Very high105 Ų105102.6 Ų102.652%0.51751%0.506SS..Hα-helixtrans-64.3-42.4175.7-165.5-174.6-65.400111.9A28 Q29 R30 R35 F36A28-M32 WeakPolarHBondContact O-CB 3.47Å; A28-M32 PolarHBondContact O-N 2.97Å; Q29-M32 PolarHBondContact O-N 3.19Å; R30-M32 VanDerWaalsContact C-N 3.31Å; R30-M32 PolarHBondContact O-N 3.39Å; M32-R35 PolarHBondContact O-N 3.14Å; M32-F36 HydrophobicContact CB-CE2 4.48Å; M32-F36 HydrophobicContact CG-CD2 3.96Å; M32-F36 HydrophobicContact CG-CE2 3.35Å; M32-F36 HydrophobicContact CG-CZ 3.79Å; M32-F36 VanDerWaalsContact O-CD2 3.22Å; M32-F36 WeakPolarHBondContact O-CD2 3.48Å; M32-F36 WeakPolarHBondContact O-CG 3.13Å; M32-F36 PolarHBondContact O-N 2.86Å; M32-F36 HydrophobicContact SD-CE2 3.6Å; M32-F36 HydrophobicContact SD-CZ 3.91Å
33L98.8Very high98.5Very high97 Ų97103.7 Ų103.751%0.50851%0.509SS..Hα-helixtrans-60.8-48.1176.7-177.262000111.9Q29 R30 R35 F36 E37Q29-L33 PolarHBondContact O-N 3.33Å; R30-L33 PolarHBondContact O-N 3.31Å; L33-R35 VanDerWaalsContact C-N 3.26Å; L33-R35 PolarHBondContact O-N 2.87Å; L33-F36 PolarHBondContact O-N 2.92Å; L33-E37 HydrophobicContact CD1-CG 4.39Å; L33-E37 WeakPolarHBondContact O-CG 3.49Å; L33-E37 PolarHBondContact O-N 2.67Å
34D98.7Very high98.6Very high62 Ų62104.9 Ų104.933%0.33252%0.515SS..Hα-helixtrans-56.6-40.2176.2169.979000112R30 E37 K38R30-D34 PolarHBondContact O-N 3.13Å; D34-E37 PolarHBondContact O-N 2.96Å; D34-K38 WeakPolarHBondContact O-CB 3.29Å; D34-K38 WeakPolarHBondContact O-CG 3.39Å; D34-K38 PolarHBondContact O-N 2.93Å; D34-K38 WeakPolarHBondContact OD1-CE 3.39Å; D34-K38 IonicContact OD1-NZ 2.93Å; D34-K38 PolarHBondContact OD1-NZ 3.3Å; D34-K38 WeakPolarHBondContact OD2-CE 3.48Å; D34-K38 IonicContact OD2-NZ 3.33Å; D34-K38 PolarHBondContact OD2-NZ 3.16Å
35R98.7Very high98.6Very high152 Ų152107.1 Ų107.157%0.57452%0.519SS*.Hα-helixtrans-68.4-38.9175.9-67.8-168.3101.4127.6-1.2112.7H31 M32 L33 T39H31-R35 PolarHBondContact CE1-NH1 3.47Å; H31-R35 PolarHBondContact NE2-NH1 3.03Å; H31-R35 WeakPolarHBondContact O-CG 3.37Å; H31-R35 PolarHBondContact O-N 3.08Å; H31-R35 VanDerWaalsContact O-N 3.15Å; M32-R35 PolarHBondContact O-N 3.14Å; L33-R35 VanDerWaalsContact C-N 3.26Å; L33-R35 PolarHBondContact O-N 2.87Å; R35-T39 WeakPolarHBondContact O-CB 3.4Å; R35-T39 PolarHBondContact O-N 3.19Å; R35-T39 PolarHBondContact O-OG1 3.34Å
36F98.7Very high98.6Very high128 Ų128108.6 Ų108.656%0.56152%0.522SS*.Hα-helixtrans-64.2-44175.5-71.7-45.8000111.4M32 L33 T39 N40M32-F36 HydrophobicContact CB-CE2 4.48Å; M32-F36 HydrophobicContact CG-CD2 3.96Å; M32-F36 HydrophobicContact CG-CE2 3.35Å; M32-F36 HydrophobicContact CG-CZ 3.79Å; M32-F36 VanDerWaalsContact O-CD2 3.22Å; M32-F36 WeakPolarHBondContact O-CD2 3.48Å; M32-F36 WeakPolarHBondContact O-CG 3.13Å; M32-F36 PolarHBondContact O-N 2.86Å; M32-F36 HydrophobicContact SD-CE2 3.6Å; M32-F36 HydrophobicContact SD-CZ 3.91Å; L33-F36 PolarHBondContact O-N 2.92Å; F36-T39 PolarHBondContact O-N 3.34Å; F36-N40 VanDerWaalsContact O-CB 3.29Å; F36-N40 WeakPolarHBondContact O-CB 3.36Å; F36-N40 PolarHBondContact O-N 2.95Å
37E98.7Very high98.7Very high115 Ų115110.5 Ų110.554%0.53753%0.533SS..Hα-helixtrans-61.1-48.8178.5-71.8174.3163.500111.2L33 D34 T39 N40 E41L33-E37 HydrophobicContact CD1-CG 4.39Å; L33-E37 WeakPolarHBondContact O-CG 3.49Å; L33-E37 PolarHBondContact O-N 2.67Å; D34-E37 PolarHBondContact O-N 2.96Å; E37-T39 VanDerWaalsContact C-N 3.35Å; E37-T39 PolarHBondContact O-N 3.16Å; E37-N40 PolarHBondContact O-N 3.49Å; E37-E41 PolarHBondContact O-N 3.49Å
38K98.8Very high98.7Very high106 Ų106106 Ų10646%0.46152%0.522SS..Hα-helixtrans-60.4-42.6176.5-73.8170.2179.81620112.8D34 N40 E41 M42D34-K38 WeakPolarHBondContact O-CB 3.29Å; D34-K38 WeakPolarHBondContact O-CG 3.39Å; D34-K38 PolarHBondContact O-N 2.93Å; D34-K38 WeakPolarHBondContact OD1-CE 3.39Å; D34-K38 IonicContact OD1-NZ 2.93Å; D34-K38 PolarHBondContact OD1-NZ 3.3Å; D34-K38 WeakPolarHBondContact OD2-CE 3.48Å; D34-K38 IonicContact OD2-NZ 3.33Å; D34-K38 PolarHBondContact OD2-NZ 3.16Å; K38-N40 VanDerWaalsContact C-N 3.33Å; K38-E41 PolarHBondContact O-N 2.96Å; K38-M42 WeakPolarHBondContact O-CG 3.22Å; K38-M42 PolarHBondContact O-N 2.77Å
39T98.6Very high98.7Very high69 Ų69108 Ų10842%0.42352%0.524SS..Hα-helixtrans-66.3-40.3179-54.20000110.7R35 F36 E37 M42 L43R35-T39 WeakPolarHBondContact O-CB 3.4Å; R35-T39 PolarHBondContact O-N 3.19Å; R35-T39 PolarHBondContact O-OG1 3.34Å; F36-T39 PolarHBondContact O-N 3.34Å; E37-T39 VanDerWaalsContact C-N 3.35Å; E37-T39 PolarHBondContact O-N 3.16Å; T39-M42 PolarHBondContact O-N 3.43Å; T39-L43 HydrophobicContact CG2-CD1 4.31Å; T39-L43 WeakPolarHBondContact O-CG 3.4Å; T39-L43 PolarHBondContact O-N 3.48Å
40N98.7Very high98.7Very high95 Ų95104.8 Ų104.851%0.50852%0.516SS..Hα-helixtrans-66.2-41178.3-163.444.8000111.6F36 E37 K38 L43 I44F36-N40 VanDerWaalsContact O-CB 3.29Å; F36-N40 WeakPolarHBondContact O-CB 3.36Å; F36-N40 PolarHBondContact O-N 2.95Å; E37-N40 PolarHBondContact O-N 3.49Å; K38-N40 VanDerWaalsContact C-N 3.33Å; N40-L43 PolarHBondContact O-N 3.44Å; N40-I44 VanDerWaalsContact O-CG1 3.27Å; N40-I44 WeakPolarHBondContact O-CG1 3.19Å; N40-I44 PolarHBondContact O-N 2.96Å
41E98.7Very high98.7Very high140 Ų140100.4 Ų100.465%0.65451%0.506SS*.Hα-helixtrans-61.8-45.8174.4-170.8-177.5177.400111.8E37 K38 L43 I44 N45E37-E41 PolarHBondContact O-N 3.49Å; K38-E41 PolarHBondContact O-N 2.96Å; E41-L43 VanDerWaalsContact C-N 3.3Å; E41-L43 PolarHBondContact O-N 3.33Å; E41-I44 PolarHBondContact O-N 3.16Å; E41-N45 WeakPolarHBondContact O-CB 3.2Å; E41-N45 PolarHBondContact O-N 2.98Å
42M98.7Very high98.7Very high127 Ų12799.2 Ų99.263%0.62651%0.505SS*.Hα-helixtrans-60.1-39.4175.1-75.4-170-69.400112.2K38 T39 N45 F46K38-M42 WeakPolarHBondContact O-CG 3.22Å; K38-M42 PolarHBondContact O-N 2.77Å; T39-M42 PolarHBondContact O-N 3.43Å; M42-N45 PolarHBondContact O-N 2.98Å; M42-F46 VanDerWaalsContact O-CB 3.29Å; M42-F46 WeakPolarHBondContact O-CB 3.33Å; M42-F46 PolarHBondContact O-N 3.41Å
43L98.8Very high98.7Very high89 Ų89103.2 Ų103.247%0.46652%0.515SS..Hα-helixtrans-67.4-42.1176.6-75.6171.7000112.3T39 N40 E41 N45 F46 N47T39-L43 HydrophobicContact CG2-CD1 4.31Å; T39-L43 WeakPolarHBondContact O-CG 3.4Å; T39-L43 PolarHBondContact O-N 3.48Å; N40-L43 PolarHBondContact O-N 3.44Å; E41-L43 VanDerWaalsContact C-N 3.3Å; E41-L43 PolarHBondContact O-N 3.33Å; L43-N45 VanDerWaalsContact C-N 3.33Å; L43-F46 PolarHBondContact O-N 2.94Å; L43-N47 WeakPolarHBondContact O-CB 3.39Å; L43-N47 VanDerWaalsContact O-CG 3.23Å; L43-N47 PolarHBondContact O-N 3.44Å; L43-N47 PolarHBondContact O-ND2 2.9Å
44I98.7Very high98.6Very high111 Ų111104 Ų10457%0.56952%0.519SS*.Hα-helixtrans-60.7-46.6175.7-71.1164.7000109.9N40 E41 N47 G48N40-I44 VanDerWaalsContact O-CG1 3.27Å; N40-I44 WeakPolarHBondContact O-CG1 3.19Å; N40-I44 PolarHBondContact O-N 2.96Å; E41-I44 PolarHBondContact O-N 3.16Å; I44-N47 PolarHBondContact O-N 3.27Å; I44-G48 PolarHBondContact O-N 2.81Å
45N98.6Very high98.6Very high100 Ų100105.7 Ų105.754%0.53553%0.527SS..Hα-helixtrans-62.6-46.3177.7-171.8-87.3000111.7E41 M42 L43 N47 G48 L49E41-N45 WeakPolarHBondContact O-CB 3.2Å; E41-N45 PolarHBondContact O-N 2.98Å; M42-N45 PolarHBondContact O-N 2.98Å; L43-N45 VanDerWaalsContact C-N 3.33Å; N45-N47 PolarHBondContact O-N 3.39Å; N45-G48 PolarHBondContact O-N 3.02Å; N45-L49 WeakPolarHBondContact O-CG 3.44Å; N45-L49 PolarHBondContact O-N 3.33Å; N45-L49 WeakPolarHBondContact OD1-CD1 3.47Å
46F98.7Very high98.6Very high129 Ų129103.5 Ų103.557%0.56652%0.524SS*.Hα-helixtrans-58.9-47.2177.2178.3-95.7000112M42 L43 G48 L49 S50M42-F46 VanDerWaalsContact O-CB 3.29Å; M42-F46 WeakPolarHBondContact O-CB 3.33Å; M42-F46 PolarHBondContact O-N 3.41Å; L43-F46 PolarHBondContact O-N 2.94Å; F46-G48 VanDerWaalsContact C-N 3.3Å; F46-G48 PolarHBondContact O-N 2.69Å; F46-L49 PolarHBondContact O-N 3.04Å; F46-S50 WeakPolarHBondContact O-CB 3.34Å; F46-S50 PolarHBondContact O-N 3.37Å
47N98.5Very high98.6Very high101 Ų101103.7 Ų103.754%0.5453%0.528SS..Hα-helixtrans-61.4-41177.8-74.3-21.2000111.3L43 I44 N45 N51L43-N47 WeakPolarHBondContact O-CB 3.39Å; L43-N47 VanDerWaalsContact O-CG 3.23Å; L43-N47 PolarHBondContact O-N 3.44Å; L43-N47 PolarHBondContact O-ND2 2.9Å; I44-N47 PolarHBondContact O-N 3.27Å; N45-N47 PolarHBondContact O-N 3.39Å; N47-N51 WeakPolarHBondContact O-CB 3.4Å; N47-N51 PolarHBondContact O-N 3.05Å
48G98.6Very high98.6Very high38 Ų38102 Ų10239%0.39252%0.522SS..Hα-helixtrans-60.1-52.3174.300000112.6I44 N45 F46 N51 V52I44-G48 PolarHBondContact O-N 2.81Å; N45-G48 PolarHBondContact O-N 3.02Å; F46-G48 VanDerWaalsContact C-N 3.3Å; F46-G48 PolarHBondContact O-N 2.69Å; G48-N51 PolarHBondContact O-N 2.89Å; G48-V52 WeakPolarHBondContact O-CG2 3.29Å; G48-V52 PolarHBondContact O-N 3.43Å
49L98.6Very high98.6Very high99 Ų99103.5 Ų103.552%0.51853%0.531SS..Hα-helixtrans-63.7-42.9-179.8-69177.1000112.5N45 F46 V52 R53N45-L49 WeakPolarHBondContact O-CG 3.44Å; N45-L49 PolarHBondContact O-N 3.33Å; N45-L49 WeakPolarHBondContact OD1-CD1 3.47Å; F46-L49 PolarHBondContact O-N 3.04Å; L49-V52 PolarHBondContact O-N 3Å; L49-R53 PolarHBondContact O-N 3.37Å
50S98.6Very high98.6Very high56 Ų56105 Ų10539%0.39253%0.533SS..Hα-helixtrans-62.6-44.6177.9-176.90000111.1F46 V52 R53 L54F46-S50 WeakPolarHBondContact O-CB 3.34Å; F46-S50 PolarHBondContact O-N 3.37Å; S50-V52 PolarHBondContact O-N 3.29Å; S50-R53 PolarHBondContact O-N 2.87Å; S50-L54 WeakPolarHBondContact O-CB 3.2Å; S50-L54 PolarHBondContact O-N 3.48Å
51N98.7Very high98.6Very high87 Ų87106.8 Ų106.847%0.46554%0.537SS..Hα-helixtrans-62.8-43.6177.6-175.257.6000112.2N47 G48 R53 L54 L55N47-N51 WeakPolarHBondContact O-CB 3.4Å; N47-N51 PolarHBondContact O-N 3.05Å; G48-N51 PolarHBondContact O-N 2.89Å; N51-R53 PolarHBondContact O-N 2.91Å; N51-L54 PolarHBondContact O-N 3.09Å; N51-L55 WeakPolarHBondContact O-CG 3.33Å; N51-L55 PolarHBondContact O-N 3.41Å
52V98.6Very high98.6Very high77 Ų77104.9 Ų104.947%0.46753%0.53SS..Hα-helixtrans-60.3-47.4176.21710000111.1G48 L49 S50 L54 L55 Q56G48-V52 WeakPolarHBondContact O-CG2 3.29Å; G48-V52 PolarHBondContact O-N 3.43Å; L49-V52 PolarHBondContact O-N 3Å; S50-V52 PolarHBondContact O-N 3.29Å; V52-L54 VanDerWaalsContact C-N 3.32Å; V52-L54 PolarHBondContact O-N 3.3Å; V52-L55 PolarHBondContact O-N 3.3Å; V52-Q56 WeakPolarHBondContact O-CG 3.27Å; V52-Q56 PolarHBondContact O-N 2.95Å
53R98.5Very high98.6Very high190 Ų190103.3 Ų103.372%0.71752%0.524SS*.Hα-helixtrans-61.4-40.8177.5-78.1-180173.7171.9-1112.3L49 S50 N51 M57L49-R53 PolarHBondContact O-N 3.37Å; S50-R53 PolarHBondContact O-N 2.87Å; N51-R53 PolarHBondContact O-N 2.91Å; R53-M57 WeakPolarHBondContact O-CB 3.17Å; R53-M57 PolarHBondContact O-N 3.5Å
54L98.6Very high98.6Very high112 Ų112104.7 Ų104.759%0.58653%0.528SS*.Hα-helixtrans-62.7-47.1177.6179.464.1000111.3S50 N51 V52 Q56 M57 N58S50-L54 WeakPolarHBondContact O-CB 3.2Å; S50-L54 PolarHBondContact O-N 3.48Å; N51-L54 PolarHBondContact O-N 3.09Å; V52-L54 VanDerWaalsContact C-N 3.32Å; V52-L54 PolarHBondContact O-N 3.3Å; L54-Q56 PolarHBondContact O-N 3.33Å; L54-M57 PolarHBondContact O-N 3.43Å; L54-N58 VanDerWaalsContact O-CB 3.22Å; L54-N58 WeakPolarHBondContact O-CB 3.48Å; L54-N58 PolarHBondContact O-N 2.83Å
55L98.6Very high98.6Very high99 Ų99102.2 Ų102.252%0.51852%0.518SS..Hα-helixtrans-62.4-43.2179.6-71.3174000111.9N51 V52 N58 E59N51-L55 WeakPolarHBondContact O-CG 3.33Å; N51-L55 PolarHBondContact O-N 3.41Å; V52-L55 PolarHBondContact O-N 3.3Å; L55-N58 PolarHBondContact O-N 2.91Å; L55-E59 PolarHBondContact O-N 2.98Å
56Q98.4Very high98.6Very high106 Ų106105.2 Ų105.250%0.49552%0.522SS..Hα-helixtrans-60.3-49.8175.4-73.1175-20.400111.8V52 L54 N58 E59 H60V52-Q56 WeakPolarHBondContact O-CG 3.27Å; V52-Q56 PolarHBondContact O-N 2.95Å; L54-Q56 PolarHBondContact O-N 3.33Å; Q56-N58 VanDerWaalsContact C-N 3.31Å; Q56-N58 PolarHBondContact O-N 3.06Å; Q56-E59 PolarHBondContact O-N 3.33Å; Q56-H60 PolarHBondContact O-CD2 2.9Å; Q56-H60 PolarHBondContact O-N 2.95Å
57M98.5Very high98.6Very high132 Ų132101.7 Ų101.765%0.6551%0.511SS*.Hα-helixtrans-62.3-40.8178.8-173.163.769.800111.7R53 L54 E59 H60 F61R53-M57 WeakPolarHBondContact O-CB 3.17Å; R53-M57 PolarHBondContact O-N 3.5Å; L54-M57 PolarHBondContact O-N 3.43Å; M57-E59 PolarHBondContact O-N 3.06Å; M57-H60 PolarHBondContact O-N 3.49Å; M57-F61 WeakPolarHBondContact O-CB 3.42Å; M57-F61 PolarHBondContact O-N 2.82Å
58N98.6Very high98.6Very high78 Ų78102.4 Ų102.442%0.41751%0.514SS..Hα-helixtrans-64.2-39.5178.7-175.358.7000111.9L54 L55 Q56 F61 L62L54-N58 VanDerWaalsContact O-CB 3.22Å; L54-N58 WeakPolarHBondContact O-CB 3.48Å; L54-N58 PolarHBondContact O-N 2.83Å; L55-N58 PolarHBondContact O-N 2.91Å; Q56-N58 VanDerWaalsContact C-N 3.31Å; Q56-N58 PolarHBondContact O-N 3.06Å; N58-F61 PolarHBondContact O-N 3.43Å; N58-L62 WeakPolarHBondContact O-CB 3.36Å; N58-L62 VanDerWaalsContact O-CG 3.29Å; N58-L62 WeakPolarHBondContact O-CG 3.43Å; N58-L62 PolarHBondContact O-N 3.38Å
59E98.6Very high98.6Very high138 Ų138104 Ų10465%0.64552%0.516SS*.Hα-helixtrans-59.6-48.7174.3-173.4-176.8169.200111.5L55 Q56 M57 F61 L62 L63L55-E59 PolarHBondContact O-N 2.98Å; Q56-E59 PolarHBondContact O-N 3.33Å; M57-E59 PolarHBondContact O-N 3.06Å; E59-F61 VanDerWaalsContact C-N 3.33Å; E59-F61 PolarHBondContact O-N 3.39Å; E59-L62 PolarHBondContact O-N 2.93Å; E59-L63 WeakPolarHBondContact O-CB 3.34Å; E59-L63 PolarHBondContact O-N 3.42Å
60H98.4Very high98.6Very high102 Ų102103.9 Ų103.947%0.47251%0.513SS..Hα-helixtrans-61.3-42176.4-69.7-59000112.3Q56 M57 L62 L63 H64Q56-H60 PolarHBondContact O-CD2 2.9Å; Q56-H60 PolarHBondContact O-N 2.95Å; M57-H60 PolarHBondContact O-N 3.49Å; H60-L62 PolarHBondContact O-N 3.26Å; H60-L63 PolarHBondContact O-N 3.46Å; H60-H64 PolarHBondContact O-CD2 2.92Å; H60-H64 VanDerWaalsContact O-CD2 3.3Å; H60-H64 VanDerWaalsContact O-CG 3.3Å; H60-H64 PolarHBondContact O-N 3.21Å
61F98.7Very high98.6Very high132 Ų132106.2 Ų106.258%0.57952%0.519SS*.Hα-helixtrans-61.4-45177.9-177.2-95.8000112.2M57 N58 E59 L63 H64 T65M57-F61 WeakPolarHBondContact O-CB 3.42Å; M57-F61 PolarHBondContact O-N 2.82Å; N58-F61 PolarHBondContact O-N 3.43Å; E59-F61 VanDerWaalsContact C-N 3.33Å; E59-F61 PolarHBondContact O-N 3.39Å; F61-L63 VanDerWaalsContact C-N 3.35Å; F61-H64 PolarHBondContact O-N 3.45Å; F61-T65 WeakPolarHBondContact O-CB 3.29Å; F61-T65 PolarHBondContact O-N 3.27Å; F61-T65 PolarHBondContact O-OG1 3.24Å
62L98.6Very high98.6Very high99 Ų99108.4 Ų108.452%0.51853%0.525SS..Hα-helixtrans-64.2-40.3176.2-70.9174.8000111.8N58 E59 H60 T65 R66N58-L62 WeakPolarHBondContact O-CB 3.36Å; N58-L62 VanDerWaalsContact O-CG 3.29Å; N58-L62 WeakPolarHBondContact O-CG 3.43Å; N58-L62 PolarHBondContact O-N 3.38Å; E59-L62 PolarHBondContact O-N 2.93Å; H60-L62 PolarHBondContact O-N 3.26Å; L62-T65 PolarHBondContact O-N 2.9Å; L62-R66 WeakPolarHBondContact O-CB 3.45Å; L62-R66 PolarHBondContact O-N 3.34Å
63L98.7Very high98.6Very high95 Ų95111 Ų11150%0.49753%0.529SS..Hα-helixtrans-61.2-51175.617964000111.1E59 H60 F61 T65 R66 T67E59-L63 WeakPolarHBondContact O-CB 3.34Å; E59-L63 PolarHBondContact O-N 3.42Å; H60-L63 PolarHBondContact O-N 3.46Å; F61-L63 VanDerWaalsContact C-N 3.35Å; L63-T65 VanDerWaalsContact C-N 3.33Å; L63-T65 PolarHBondContact O-N 3.48Å; L63-R66 WeakPolarHBondContact O-CB 3.14Å; L63-R66 PolarHBondContact O-N 2.87Å; L63-R66 VanDerWaalsContact O-N 3.16Å; L63-T67 PolarHBondContact O-N 2.9Å; L63-T67 PolarHBondContact O-OG1 3.33Å
64H98.8Very high98.6Very high117 Ų117106.9 Ų106.954%0.54252%0.522SS..Hα-helixtrans-61.1-41.7178.7-67.9-31000112.3H60 F61 R66 T67 L68H60-H64 PolarHBondContact O-CD2 2.92Å; H60-H64 VanDerWaalsContact O-CD2 3.3Å; H60-H64 VanDerWaalsContact O-CG 3.3Å; H60-H64 PolarHBondContact O-N 3.21Å; F61-H64 PolarHBondContact O-N 3.45Å; H64-R66 VanDerWaalsContact C-N 3.31Å; H64-R66 PolarHBondContact O-N 3.38Å; H64-T67 PolarHBondContact O-N 3.22Å; H64-L68 WeakPolarHBondContact O-CG 3.45Å; H64-L68 PolarHBondContact O-N 2.99Å
65T98.8Very high98.6Very high60 Ų60105.8 Ų105.837%0.36852%0.516SS..Hα-helixtrans-60.5-43175.7-58.40000111.2F61 L62 L63 L68 V69F61-T65 WeakPolarHBondContact O-CB 3.29Å; F61-T65 PolarHBondContact O-N 3.27Å; F61-T65 PolarHBondContact O-OG1 3.24Å; L62-T65 PolarHBondContact O-N 2.9Å; L63-T65 VanDerWaalsContact C-N 3.33Å; L63-T65 PolarHBondContact O-N 3.48Å; T65-L68 PolarHBondContact O-N 3.02Å; T65-V69 WeakPolarHBondContact O-CG2 3.38Å; T65-V69 PolarHBondContact O-N 3.04Å; T65-V69 VanDerWaalsContact O-N 3.08Å
66R98.8Very high98.6Very high162 Ų162104.7 Ų104.761%0.61151%0.511SS*.Hα-helixtrans-62.1-47.2176.2-175.9-173.3-57.3-147.91111.7L62 L63 H64 L68 V69 E70L62-R66 WeakPolarHBondContact O-CB 3.45Å; L62-R66 PolarHBondContact O-N 3.34Å; L63-R66 WeakPolarHBondContact O-CB 3.14Å; L63-R66 PolarHBondContact O-N 2.87Å; L63-R66 VanDerWaalsContact O-N 3.16Å; H64-R66 VanDerWaalsContact C-N 3.31Å; H64-R66 PolarHBondContact O-N 3.38Å; R66-L68 VanDerWaalsContact C-N 3.3Å; R66-L68 PolarHBondContact O-N 2.87Å; R66-V69 PolarHBondContact O-N 3.49Å; R66-V69 VanDerWaalsContact O-N 3.13Å; R66-E70 WeakPolarHBondContact CG-OE1 3.29Å; R66-E70 WeakPolarHBondContact O-CG 3.46Å; R66-E70 PolarHBondContact O-N 2.96Å
67T98.8Very high98.6Very high56 Ų56103.1 Ų103.134%0.34451%0.511SS..Hα-helixtrans-57.9-43.7177.9-58.50000111.4L63 H64 V69 E70 M71L63-T67 PolarHBondContact O-N 2.9Å; L63-T67 PolarHBondContact O-OG1 3.33Å; H64-T67 PolarHBondContact O-N 3.22Å; T67-V69 VanDerWaalsContact C-N 3.34Å; T67-V69 PolarHBondContact O-N 2.87Å; T67-E70 PolarHBondContact O-N 3.39Å; T67-M71 HydrophobicContact CG2-CG 4.4Å; T67-M71 HydrophobicContact CG2-SD 4.08Å; T67-M71 VanDerWaalsContact O-CG 3.3Å; T67-M71 WeakPolarHBondContact O-CG 3.33Å; T67-M71 PolarHBondContact O-N 3.4Å
68L98.8Very high98.6Very high116 Ų116101.1 Ų101.161%0.60750%0.502SS*.Hα-helixtrans-62.2-40.5176.4-70.6173.3000112.4H64 T65 R66 E70 M71 K72H64-L68 WeakPolarHBondContact O-CG 3.45Å; H64-L68 PolarHBondContact O-N 2.99Å; T65-L68 PolarHBondContact O-N 3.02Å; R66-L68 VanDerWaalsContact C-N 3.3Å; R66-L68 PolarHBondContact O-N 2.87Å; L68-E70 VanDerWaalsContact C-N 3.34Å; L68-M71 PolarHBondContact O-N 2.7Å; L68-K72 WeakPolarHBondContact O-CB 3.22Å; L68-K72 PolarHBondContact O-N 2.94Å
69V98.7Very high98.6Very high72 Ų72103.2 Ų103.244%0.43651%0.508SS..Hα-helixtrans-65.2-38.3175.8170.40000111.6T65 R66 T67 K73T65-V69 WeakPolarHBondContact O-CG2 3.38Å; T65-V69 PolarHBondContact O-N 3.04Å; T65-V69 VanDerWaalsContact O-N 3.08Å; R66-V69 PolarHBondContact O-N 3.49Å; R66-V69 VanDerWaalsContact O-N 3.13Å; T67-V69 VanDerWaalsContact C-N 3.34Å; T67-V69 PolarHBondContact O-N 2.87Å; V69-K73 WeakPolarHBondContact O-CG 3.35Å; V69-K73 PolarHBondContact O-N 2.9Å; V69-K73 VanDerWaalsContact O-N 3.14Å
70E98.8Very high98.6Very high95 Ų95105.1 Ų105.144%0.44451%0.509SS..Hα-helixtrans-66.5-48175.6-72.6171.3-17600111.3R66 T67 L68 K72 K73 D74R66-E70 WeakPolarHBondContact CG-OE1 3.29Å; R66-E70 WeakPolarHBondContact O-CG 3.46Å; R66-E70 PolarHBondContact O-N 2.96Å; T67-E70 PolarHBondContact O-N 3.39Å; L68-E70 VanDerWaalsContact C-N 3.34Å; E70-K72 VanDerWaalsContact C-N 3.27Å; E70-K72 PolarHBondContact O-N 3.3Å; E70-K73 WeakPolarHBondContact O-CB 3.34Å; E70-K73 PolarHBondContact O-N 3.23Å; E70-D74 PolarHBondContact O-N 3.01Å
71M98.8Very high98.5Very high106 Ų106108.9 Ų108.952%0.52252%0.519SS..Hα-helixtrans-58-39.8175.5-70.2175.869.400112.1T67 L68 D74 L75T67-M71 HydrophobicContact CG2-CG 4.4Å; T67-M71 HydrophobicContact CG2-SD 4.08Å; T67-M71 VanDerWaalsContact O-CG 3.3Å; T67-M71 WeakPolarHBondContact O-CG 3.33Å; T67-M71 PolarHBondContact O-N 3.4Å; L68-M71 PolarHBondContact O-N 2.7Å; M71-D74 PolarHBondContact O-N 3.32Å; M71-L75 WeakPolarHBondContact O-CG 3.4Å; M71-L75 PolarHBondContact O-N 3.29Å
72K98.3Very high98.5Very high133 Ų133107.2 Ų107.258%0.57852%0.515SS*.Hα-helixtrans-59.1-48.7173.6-174-163.8170.8-171.50111.2L68 E70 D74 L75 D76L68-K72 WeakPolarHBondContact O-CB 3.22Å; L68-K72 PolarHBondContact O-N 2.94Å; E70-K72 VanDerWaalsContact C-N 3.27Å; E70-K72 PolarHBondContact O-N 3.3Å; K72-D74 VanDerWaalsContact C-N 3.26Å; K72-D74 PolarHBondContact O-N 2.98Å; K72-L75 PolarHBondContact O-N 3.28Å; K72-D76 VanDerWaalsContact O-CG 3.27Å; K72-D76 PolarHBondContact O-N 3.15Å
73K98.6Very high98.3Very high130 Ų130108.8 Ų108.857%0.56551%0.514SS*.Hα-helixtrans-59.6-39178.7-71170.3-178173.90111.9V69 E70 D76 S77V69-K73 WeakPolarHBondContact O-CG 3.35Å; V69-K73 PolarHBondContact O-N 2.9Å; V69-K73 VanDerWaalsContact O-N 3.14Å; E70-K73 WeakPolarHBondContact O-CB 3.34Å; E70-K73 PolarHBondContact O-N 3.23Å; K73-D76 PolarHBondContact O-N 3.47Å; K73-S77 WeakPolarHBondContact O-CB 3.43Å; K73-S77 PolarHBondContact O-N 2.72Å
74D98.5Very high98.2Very high104 Ų104107.5 Ų107.556%0.55651%0.511SS*.Hα-helixtrans-65.1-44.6177.1-69.6-19.3000111.3E70 M71 K72 S77 I78E70-D74 PolarHBondContact O-N 3.01Å; M71-D74 PolarHBondContact O-N 3.32Å; K72-D74 VanDerWaalsContact C-N 3.26Å; K72-D74 PolarHBondContact O-N 2.98Å; D74-S77 WeakPolarHBondContact O-CB 3.5Å; D74-S77 PolarHBondContact O-N 3.06Å; D74-I78 VanDerWaalsContact O-CG1 3.29Å; D74-I78 WeakPolarHBondContact O-CG1 3.49Å; D74-I78 PolarHBondContact O-N 2.97Å
75L98.6Very high98.1Very high90 Ų90106 Ų10647%0.47151%0.506SS..Hα-helixtrans-61.3-46.5174.1-71.3-178000111.8M71 K72 S77 I78 F79M71-L75 WeakPolarHBondContact O-CG 3.4Å; M71-L75 PolarHBondContact O-N 3.29Å; K72-L75 PolarHBondContact O-N 3.28Å; L75-S77 PolarHBondContact O-N 2.91Å; L75-I78 PolarHBondContact O-N 3.25Å; L75-I78 VanDerWaalsContact O-N 3.1Å; L75-F79 HydrophobicContact CB-CD2 4.27Å; L75-F79 HydrophobicContact CB-CE2 4.18Å; L75-F79 HydrophobicContact CD2-CE2 4.45Å; L75-F79 WeakPolarHBondContact O-CD2 3.45Å; L75-F79 PolarHBondContact O-N 3.44Å
76D97.9Very high97.8Very high75 Ų75106.1 Ų106.140%0.40150%0.502SS..Hα-helixtrans-56.5-40.2176.9-68.9-18.7000111.2K72 K73 R80K72-D76 VanDerWaalsContact O-CG 3.27Å; K72-D76 PolarHBondContact O-N 3.15Å; K73-D76 PolarHBondContact O-N 3.47Å; D76-R80 VanDerWaalsContact O-CB 3.23Å; D76-R80 WeakPolarHBondContact O-CB 3.3Å; D76-R80 PolarHBondContact O-N 2.94Å
77S98.4Very high97.5Very high73 Ų73100 Ų10051%0.5149%0.489SS..Hα-helixtrans-66-45.4175.9-175.10000112.2K73 D74 L75 R80 R81K73-S77 WeakPolarHBondContact O-CB 3.43Å; K73-S77 PolarHBondContact O-N 2.72Å; D74-S77 WeakPolarHBondContact O-CB 3.5Å; D74-S77 PolarHBondContact O-N 3.06Å; L75-S77 PolarHBondContact O-N 2.91Å; S77-R80 PolarHBondContact O-N 3.26Å; S77-R81 WeakPolarHBondContact O-CB 3.31Å; S77-R81 PolarHBondContact O-N 2.94Å
78I98.5Very high97.4Very high90 Ų90103.3 Ų103.346%0.46250%0.498SS..Hα-helixtrans-61.6-51.4178.1-70.5164.4000110.4D74 L75 R80 R81 I82D74-I78 VanDerWaalsContact O-CG1 3.29Å; D74-I78 WeakPolarHBondContact O-CG1 3.49Å; D74-I78 PolarHBondContact O-N 2.97Å; L75-I78 PolarHBondContact O-N 3.25Å; L75-I78 VanDerWaalsContact O-N 3.1Å; I78-R80 PolarHBondContact O-N 3.35Å; I78-R81 PolarHBondContact O-N 2.94Å; I78-R81 VanDerWaalsContact O-N 3.15Å; I78-I82 HydrophobicContact CG2-CD1 3.76Å; I78-I82 HydrophobicContact CG2-CG1 4.44Å; I78-I82 WeakPolarHBondContact O-CG1 3.41Å; I78-I82 PolarHBondContact O-N 3.39Å
79F98.4Very high97.1Very high122 Ų122101.9 Ų101.954%0.53549%0.49SS..Hα-helixtrans-62-41.9180-75-63.7000112L75 R81 I82 R83L75-F79 HydrophobicContact CB-CD2 4.27Å; L75-F79 HydrophobicContact CB-CE2 4.18Å; L75-F79 HydrophobicContact CD2-CE2 4.45Å; L75-F79 WeakPolarHBondContact O-CD2 3.45Å; L75-F79 PolarHBondContact O-N 3.44Å; F79-R81 VanDerWaalsContact C-N 3.32Å; F79-R81 PolarHBondContact O-N 3.47Å; F79-I82 PolarHBondContact O-N 3.36Å; F79-R83 WeakPolarHBondContact O-CB 3.48Å; F79-R83 PolarHBondContact O-N 3.43Å
80R98Very high96.8Very high179 Ų179100 Ų10068%0.67548%0.482SS*.Hα-helixtrans-59.3-42.9174.3-173.3-172.7-55.5-171.61.1112.1D76 S77 I78 T84D76-R80 VanDerWaalsContact O-CB 3.23Å; D76-R80 WeakPolarHBondContact O-CB 3.3Å; D76-R80 PolarHBondContact O-N 2.94Å; S77-R80 PolarHBondContact O-N 3.26Å; I78-R80 PolarHBondContact O-N 3.35Å; R80-T84 WeakPolarHBondContact O-CB 3.46Å; R80-T84 PolarHBondContact O-N 3.35Å; R80-T84 PolarHBondContact O-OG1 3.46Å
81R98.1Very high96.5Very high181 Ų181104.1 Ų104.168%0.68350%0.499SS*.Hα-helixtrans-66-44178.1-175170.5178.9174.4-1111S77 I78 F79 T84 L85S77-R81 WeakPolarHBondContact O-CB 3.31Å; S77-R81 PolarHBondContact O-N 2.94Å; I78-R81 PolarHBondContact O-N 2.94Å; I78-R81 VanDerWaalsContact O-N 3.15Å; F79-R81 VanDerWaalsContact C-N 3.32Å; F79-R81 PolarHBondContact O-N 3.47Å; R81-T84 WeakPolarHBondContact O-CB 3.36Å; R81-T84 PolarHBondContact O-N 3.01Å; R81-L85 HydrophobicContact CG-CD1 3.8Å; R81-L85 WeakPolarHBondContact O-CD1 3.39Å; R81-L85 PolarHBondContact O-N 3.44Å
82I96.9Very high96.3Very high96 Ų96105.4 Ų105.449%0.49250%0.504SS..Hα-helixtrans-58.3-52175.1-68.5168.2000110.4I78 F79 T84 L85 K86I78-I82 HydrophobicContact CG2-CD1 3.76Å; I78-I82 HydrophobicContact CG2-CG1 4.44Å; I78-I82 WeakPolarHBondContact O-CG1 3.41Å; I78-I82 PolarHBondContact O-N 3.39Å; F79-I82 PolarHBondContact O-N 3.36Å; I82-T84 VanDerWaalsContact C-N 3.27Å; I82-T84 PolarHBondContact O-N 2.91Å; I82-L85 PolarHBondContact O-N 2.82Å; I82-K86 WeakPolarHBondContact O-CB 3.27Å; I82-K86 PolarHBondContact O-N 3.26Å
83R96Very high96Very high132 Ų132106 Ų10650%0.49850%0.503SS..Hα-helixtrans-58.1-40.1178.5-171.7173.9-100.4129.4-13.3111.7F79 G87 D110F79-R83 WeakPolarHBondContact O-CB 3.48Å; F79-R83 PolarHBondContact O-N 3.43Å; R83-G87 PolarHBondContact O-N 3.07Å; R83-D110 IonicContact CZ-OD2 2.77Å; R83-D110 IonicContact NH1-OD2 2.94Å; R83-D110 PolarHBondContact NH1-OD2 3.24Å; R83-D110 IonicContact NH2-OD2 2.7Å; R83-D110 PolarHBondContact NH2-OD2 2.94Å
84T96.3Very high95.5Very high69 Ų69103.4 Ų103.442%0.42350%0.5SS..Hα-helixtrans-63.1-44.4174.4-58.80000112.4R80 R81 I82 K88R80-T84 WeakPolarHBondContact O-CB 3.46Å; R80-T84 PolarHBondContact O-N 3.35Å; R80-T84 PolarHBondContact O-OG1 3.46Å; R81-T84 WeakPolarHBondContact O-CB 3.36Å; R81-T84 PolarHBondContact O-N 3.01Å; I82-T84 VanDerWaalsContact C-N 3.27Å; I82-T84 PolarHBondContact O-N 2.91Å; T84-K88 HydrophobicContact CG2-CD 4.39Å; T84-K88 WeakPolarHBondContact O-CG 3.29Å; T84-K88 PolarHBondContact O-N 3.27Å
85L96.3Very high94.8Very high86 Ų86105.6 Ų105.645%0.4551%0.506SS..Hα-helixtrans-67.8-45.9178.2-92.374.5000111.3R81 I82 G87 K88 I89R81-L85 HydrophobicContact CG-CD1 3.8Å; R81-L85 WeakPolarHBondContact O-CD1 3.39Å; R81-L85 PolarHBondContact O-N 3.44Å; I82-L85 PolarHBondContact O-N 2.82Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.21Å; L85-K88 PolarHBondContact O-N 3.31Å; L85-K88 VanDerWaalsContact O-N 3.1Å; L85-I89 WeakPolarHBondContact O-CG1 3.41Å; L85-I89 PolarHBondContact O-N 2.85Å
86K93.3Very high94.1Very high62 Ų62104.3 Ų104.327%0.2751%0.509SS..Hα-helixtrans-52-50.9174.4-169179.5171.3176.70109.7I82 K88 I89 A90 F97 E102 E107I82-K86 WeakPolarHBondContact O-CB 3.27Å; I82-K86 PolarHBondContact O-N 3.26Å; K86-K88 PolarHBondContact O-N 3.16Å; K86-I89 PolarHBondContact O-N 2.93Å; K86-A90 WeakPolarHBondContact O-CB 3.47Å; K86-A90 PolarHBondContact O-N 3.33Å; K86-F97 HydrophobicContact CD-CZ 4.3Å; K86-F97 HydrophobicContact CG-CE2 4.05Å; K86-F97 HydrophobicContact CG-CZ 3.51Å; K86-E102 IonicContact NZ-OE1 2.67Å; K86-E102 PolarHBondContact NZ-OE1 3.17Å; K86-E102 IonicContact NZ-OE2 2.92Å; K86-E102 PolarHBondContact NZ-OE2 3.42Å; K86-E107 IonicContact NZ-OE1 2.86Å; K86-E107 PolarHBondContact NZ-OE1 3.34Å
87G91.9Very high93.5Very high33 Ų33103.9 Ų103.934%0.3450%0.504SS..Hα-helixtrans-63.7-34.7177.700000114.8R83 L85 K91R83-G87 PolarHBondContact O-N 3.07Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.21Å; G87-K91 VanDerWaalsContact O-CG 3.32Å; G87-K91 WeakPolarHBondContact O-CG 3.33Å; G87-K91 PolarHBondContact O-N 3.39Å
88K95.6Very high92.6Very high125 Ų125104.2 Ų104.254%0.54351%0.506SS..Hα-helixtrans-69.5-44.3175-76.9176.9-179.4-179.30112.1T84 L85 K86 K91 Q92T84-K88 HydrophobicContact CG2-CD 4.39Å; T84-K88 WeakPolarHBondContact O-CG 3.29Å; T84-K88 PolarHBondContact O-N 3.27Å; L85-K88 PolarHBondContact O-N 3.31Å; L85-K88 VanDerWaalsContact O-N 3.1Å; K86-K88 PolarHBondContact O-N 3.16Å; K88-K91 PolarHBondContact O-N 3.48Å; K88-Q92 WeakPolarHBondContact O-CG 3.45Å; K88-Q92 PolarHBondContact O-N 3.47Å
89I93.6Very high91.6Very high86 Ų86106 Ų10644%0.44152%0.516SS..Hα-helixtrans-66.4-44.5-179.1-64.1167.5000110.1L85 K86 K91 Q92 Y93 F97L85-I89 WeakPolarHBondContact O-CG1 3.41Å; L85-I89 PolarHBondContact O-N 2.85Å; K86-I89 PolarHBondContact O-N 2.93Å; I89-K91 PolarHBondContact O-N 2.89Å; I89-Q92 PolarHBondContact O-N 3.46Å; I89-Q92 VanDerWaalsContact O-N 3.13Å; I89-Y93 PolarHBondContact O-N 3.29Å; I89-F97 HydrophobicContact CB-CD2 4.31Å; I89-F97 HydrophobicContact CG2-CD2 3.76Å; I89-F97 HydrophobicContact CG2-CE2 4.35Å
90A91Very high90.5Very high32 Ų32105.2 Ų105.226%0.26452%0.522SS..Hα-helixtrans-56.1-37.3176.300000112.8K86 F97K86-A90 WeakPolarHBondContact O-CB 3.47Å; K86-A90 PolarHBondContact O-N 3.33Å; A90-F97 HydrophobicContact CB-CD1 3.62Å; A90-F97 HydrophobicContact CB-CD2 4.34Å; A90-F97 HydrophobicContact CB-CE1 3.72Å; A90-F97 HydrophobicContact CB-CE2 4.42Å; A90-F97 HydrophobicContact CB-CG 3.95Å; A90-F97 HydrophobicContact CB-CZ 4.14Å
91K92.4Very high88.7Confident182 Ų182105.4 Ų105.479%0.79153%0.53SS*.Hα-helixtrans-75.3-36.6176.9-72.2176.5-177.5-177.60113.5G87 K88 I89G87-K91 VanDerWaalsContact O-CG 3.32Å; G87-K91 WeakPolarHBondContact O-CG 3.33Å; G87-K91 PolarHBondContact O-N 3.39Å; K88-K91 PolarHBondContact O-N 3.48Å; I89-K91 PolarHBondContact O-N 2.89Å
92Q95.7Very high86.9Confident134 Ų134102.6 Ų102.663%0.62652%0.524SS*.Hα-helixtrans-82.4-31.5-176.6-70.6-16240.400113.2K88 I89K88-Q92 WeakPolarHBondContact O-CG 3.45Å; K88-Q92 PolarHBondContact O-N 3.47Å; I89-Q92 PolarHBondContact O-N 3.46Å; I89-Q92 VanDerWaalsContact O-N 3.13Å
93Y92.5Very high85.1Confident145 Ų145102.3 Ų102.357%0.56953%0.531SS*.  trans-13766.3-175-57.3-77.4000111.6I89 E95 A96 F97I89-Y93 PolarHBondContact O-N 3.29Å; Y93-E95 PolarHBondContact O-N 3.46Å; Y93-A96 PolarHBondContact O-N 3.08Å; Y93-F97 VanDerWaalsContact O-CB 3.27Å; Y93-F97 WeakPolarHBondContact O-CB 3.36Å; Y93-F97 PolarHBondContact O-N 3.17Å
94P86.8Confident82.9Confident76 Ų76102 Ų10249%0.49455%0.546SS..Hα-helixtrans-58.5-46.3-172.520.4-31.4000113.1A96 F97 S98P94-A96 PolarHBondContact O-N 2.97Å; P94-F97 PolarHBondContact O-N 3.04Å; P94-S98 PolarHBondContact O-N 2.86Å; P94-S98 PolarHBondContact O-OG 2.89Å
95E84.9Confident80.6Confident149 Ų149105.6 Ų105.670%0.69656%0.561SS**Hα-helixtrans-66-35.9-179.2-60.2-61.4146.800113.3Y93 S98 N99Y93-E95 PolarHBondContact O-N 3.46Å; E95-S98 PolarHBondContact O-OG 3.46Å; E95-N99 VanDerWaalsContact O-CG 3.25Å; E95-N99 PolarHBondContact O-ND2 2.95Å
96A83.8Confident78.3Confident63 Ų63109 Ų10952%0.52158%0.579SS.*Hα-helixtrans-76-32.9177.600000111.4Y93 P94Y93-A96 PolarHBondContact O-N 3.08Å; P94-A96 PolarHBondContact O-N 2.97Å
97F84.4Confident76.3Confident66 Ų66112.2 Ų112.229%0.28960%0.595SS.*Hα-helixtrans-74.7-37-179.7-166.2-95.7000112.2K86 I89 A90 Y93 P94 N99 V100K86-F97 HydrophobicContact CD-CZ 4.3Å; K86-F97 HydrophobicContact CG-CE2 4.05Å; K86-F97 HydrophobicContact CG-CZ 3.51Å; I89-F97 HydrophobicContact CB-CD2 4.31Å; I89-F97 HydrophobicContact CG2-CD2 3.76Å; I89-F97 HydrophobicContact CG2-CE2 4.35Å; A90-F97 HydrophobicContact CB-CD1 3.62Å; A90-F97 HydrophobicContact CB-CD2 4.34Å; A90-F97 HydrophobicContact CB-CE1 3.72Å; A90-F97 HydrophobicContact CB-CE2 4.42Å; A90-F97 HydrophobicContact CB-CG 3.95Å; A90-F97 HydrophobicContact CB-CZ 4.14Å; Y93-F97 VanDerWaalsContact O-CB 3.27Å; Y93-F97 WeakPolarHBondContact O-CB 3.36Å; Y93-F97 PolarHBondContact O-N 3.17Å; P94-F97 PolarHBondContact O-N 3.04Å; F97-N99 PolarHBondContact O-N 2.95Å; F97-V100 PolarHBondContact O-N 3.35Å
98S79.7Confident74.3Confident80 Ų80118.8 Ų118.856%0.55962%0.617SS**Hα-helixtrans-66.3-22.6176.6580000114.2P94 E95 V100P94-S98 PolarHBondContact O-N 2.86Å; P94-S98 PolarHBondContact O-OG 2.89Å; E95-S98 PolarHBondContact O-OG 3.46Å; S98-V100 VanDerWaalsContact C-N 3.32Å
99N77.3Confident71.9Confident128 Ų128119.3 Ų119.368%0.68463%0.626SS**THydrogen-bonded Turntrans-83.8-6.8-179.5-67-23.1000113.4E95 F97 H101E95-N99 VanDerWaalsContact O-CG 3.25Å; E95-N99 PolarHBondContact O-ND2 2.95Å; F97-N99 PolarHBondContact O-N 2.95Å; N99-H101 PolarHBondContact O-N 3.06Å
100V76.6Confident70Confident106 Ų106119.8 Ų119.864%0.64263%0.629SS**SBendtrans-83.1103.2173.2-175.50000107.3F97 S98 E102F97-V100 PolarHBondContact O-N 3.35Å; S98-V100 VanDerWaalsContact C-N 3.32Å; V100-E102 PolarHBondContact O-N 3.41Å
101H59Low68.2Low182 Ų182125.8 Ų125.884%0.84366%0.657SS**  trans-60.6106.1169.8-98.9-79.6000108.8N99 S103N99-H101 PolarHBondContact O-N 3.06Å; H101-S103 PolarHBondContact O-N 2.98Å
102E61.5Low66.2Low122 Ų122124.9 Ų124.957%0.5766%0.655SS**  trans-58.1110167.6-164.3120.2-134.800106.4K86 V100K86-E102 IonicContact NZ-OE1 2.67Å; K86-E102 PolarHBondContact NZ-OE1 3.17Å; K86-E102 IonicContact NZ-OE2 2.92Å; K86-E102 PolarHBondContact NZ-OE2 3.42Å; V100-E102 PolarHBondContact O-N 3.41Å
103S58.3Low63.9Low91 Ų91127.5 Ų127.564%0.63667%0.665SS**  trans-58.6136.5166.9-61.40000106.5H101 I105H101-S103 PolarHBondContact O-N 2.98Å; S103-I105 PolarHBondContact O-N 3.27Å
104P49.1Very low62Low126 Ų126127.4 Ų127.482%0.81867%0.674SS**  trans-70.184.7-170.827-32.4000109.9
105I48.8Very low60.1Low144 Ų144131.2 Ų131.274%0.73869%0.69SS**  trans-99.9110.3157.7-58.5176.3000103S103 E107S103-I105 PolarHBondContact O-N 3.27Å; I105-E107 PolarHBondContact O-N 2.97Å
106L49Very low58.2Low157 Ų157132 Ų13282%0.82270%0.697SS**  trans-47113.1-176.1-59.1170.8000109.1E108L106-E108 PolarHBondContact O-N 3.47Å
107E49.7Very low56.3Low129 Ų129133.2 Ų133.260%0.60370%0.699SS**  trans-66.483.8158.1-64.2-105.2179.100104.8K86 I105K86-E107 IonicContact NZ-OE1 2.86Å; K86-E107 PolarHBondContact NZ-OE1 3.34Å; I105-E107 PolarHBondContact O-N 2.97Å
108E49.6Very low54.7Low172 Ų172136.7 Ų136.780%0.80473%0.729SS**  trans-75.6118.4164.7-163.7168.3-146.200105.9L106 D110L106-E108 PolarHBondContact O-N 3.47Å; E108-D110 PolarHBondContact O-N 3.23Å; E108-D110 VanDerWaalsContact O-N 3.16Å
109D46.9Very low53.1Low136 Ų136137.4 Ų137.473%0.72773%0.734SS**  trans-42.4115.1178.8-93-39.1000111.8D111D109-D111 PolarHBondContact O-N 3.22Å
110D52.5Low51.8Low95 Ų95136.9 Ų136.951%0.50874%0.735SS.*THydrogen-bonded Turntrans-79.48.9173.3-101.9-29.2000112.6R83 E108R83-D110 IonicContact CZ-OD2 2.77Å; R83-D110 IonicContact NH1-OD2 2.94Å; R83-D110 PolarHBondContact NH1-OD2 3.24Å; R83-D110 IonicContact NH2-OD2 2.7Å; R83-D110 PolarHBondContact NH2-OD2 2.94Å; E108-D110 PolarHBondContact O-N 3.23Å; E108-D110 VanDerWaalsContact O-N 3.16Å
111D54.2Low50.4Low158 Ų158136.5 Ų136.585%0.84574%0.743SS**THydrogen-bonded Turntrans-98.16.7-176.4-73.6-29.1000114.2D109D109-D111 PolarHBondContact O-N 3.22Å
112E50.9Low49.8Very low164 Ų164131.4 Ų131.477%0.76673%0.732SS**  trans-131.955.8177-159.3169.6-169.500113.5
113F46.2Very low48.8Very low189 Ų189131 Ų13183%0.82974%0.738SS**  trans-106.615.9163.1-94.4-81.1000113.4
114D52.8Low48.2Very low142 Ų142134.3 Ų134.376%0.75975%0.747SS**  trans-95.7136.4161.2-91.9-27.8000108.4
115L47Very low47.9Very low157 Ų157134.3 Ų134.382%0.82275%0.745SS**  trans96.166.1179.1-46180000116.2P117L115-P117 WeakPolarHBondContact O-CD 3.37Å
116I44.4Very low47.7Very low166 Ų166133.4 Ų133.485%0.85175%0.746SS**  trans-78.8110.7145.6-56.7173000107
117P44.5Very low47.3Very low87 Ų87130.8 Ų130.857%0.56575%0.747SS**  trans-68.6144.5174.826.1-32.3000111.1L115 S119L115-P117 WeakPolarHBondContact O-CD 3.37Å; P117-S119 PolarHBondContact O-N 2.73Å
118P50.1Low47Very low140 Ų140133.5 Ų133.591%0.90976%0.762SS**THydrogen-bonded Turntrans-79.860.6-174.435.1-36.8000111.8
119S46.6Very low46.7Very low95 Ų95129.8 Ų129.866%0.66476%0.755SS**THydrogen-bonded Turntrans-125.9-13.7-179.8-1600000114.8P117P117-S119 PolarHBondContact O-N 2.73Å
120V49.8Very low46.8Very low116 Ų116132 Ų13270%0.70376%0.761SS**G310 helixtrans-96.2-4.2-176.8-162.40000113.3A122V120-A122 PolarHBondContact O-N 3.35Å
121A47.9Very low46.2Very low99 Ų99136.9 Ų136.982%0.81878%0.781SS**G310 helixtrans-75.1-2.1177.800000114.6
122A46.1Very low45.9Very low75 Ų75134.1 Ų134.162%0.6277%0.774SS**G310 helixtrans-104.3-5-172.600000116V120V120-A122 PolarHBondContact O-N 3.35Å
123T40.2Very low45.6Very low113 Ų113132.6 Ų132.669%0.69378%0.776SS**SBendtrans-100.5-6.8-168.2-49.30000115
124I45.8Very low45.1Very low161 Ų161132.1 Ų132.183%0.82678%0.776SS**SBendtrans-95-1-176-28.6-179000113.4
125T42.9Very low45.2Very low126 Ų126130 Ų13077%0.77377%0.773SS**SBendtrans-104.9-0.3-175.6-32.40000114.6
126T44.3Very low44.8Very low125 Ų125128.3 Ų128.377%0.76777%0.773SS**  trans-127.632.7-171.5-300000114.5
127A41.2Very low44.8Very low101 Ų101127 Ų12784%0.83577%0.768SS**  trans-110.632.3169.900000112.5
128M43.1Very low44.7Very low186 Ų186129.3 Ų129.392%0.91678%0.78SS**  trans-123.359.3169.5-137.3179.67600108.8
129S44Very low44.6Very low95 Ų95127.3 Ų127.366%0.66477%0.769SS**SBendtrans-157.2110.9164.3-1320000110.4
130E47.9Very low44.8Very low181 Ų181129 Ų12985%0.84678%0.778SS**  trans8282.5144.5-28.2-147.6158.500118.2
131Q41.4Very low44.1Very low198 Ų198130.8 Ų130.893%0.92578%0.784SS**  trans-142.798132.2-154.5172.26.400110.2
132S47.2Very low43.8Very low100 Ų100131.4 Ų131.470%0.69978%0.777SS**  trans-66.7138.6163.7-66.10000110.1
133T45.4Very low43.7Very low133 Ų133135.1 Ų135.182%0.81679%0.785SS**  152.1143.1110.451.80000111.6
134E33.8Very low43.3Very low178 Ų178135.1 Ų135.183%0.83279%0.789SS**  trans102.897.9153.6-161.7168156.400118.1
135S56.2Low43.3Very low98 Ų98133 Ų13369%0.68579%0.787SS**  58.2109.3129.9-173.20000118.9
136C37.7Very low42.9Very low121 Ų121133.4 Ų133.482%0.81879%0.789SS**  -161.5125.9107.8-94.90000110.8
137D44.5Very low42.9Very low139 Ų139134.7 Ų134.774%0.74380%0.796SS**  trans-48.4123.6169.7-177.421.9000112.6
138T43.6Very low43Very low136 Ų136135.3 Ų135.383%0.83479%0.794SS**  trans-144.4107.5152.143.10000109.2
139S46.6Very low42.7Very low97 Ų97137.7 Ų137.768%0.67879%0.793SS**  trans-59.7152171.1-660000111.6D141S139-D141 PolarHBondContact O-N 3.22Å
140P52.5Low42Very low130 Ų130139 Ų13984%0.84480%0.801SS**  trans-88.4106.1171.132.8-25.8000109.1
141D34.7Very low41.4Very low154 Ų154136.2 Ų136.282%0.82480%0.801SS**  trans-95.7119.7171.2-131.7-11.5000111.2S139S139-D141 PolarHBondContact O-N 3.22Å
142V40.3Very low41.2Very low112 Ų112135.9 Ų135.968%0.67980%0.8SS**  trans0.8121.3154.4-166.50000118.2
143I43.9Very low40.7Very low153 Ų153138.6 Ų138.679%0.78581%0.806SS**  trans16.4112.8140.2-36.2169.7000116.8
144S32.3Very low40.1Very low113 Ų113139.8 Ų139.879%0.7981%0.807SS**  trans-169.4144.2130.6-860000113.3
145P45.5Very low40.2Very low118 Ų118136.2 Ų136.277%0.76680%0.802SS**  trans-90.7136.4-175.434.8-30.3000111.8
146T34.3Very low39.1Very low133 Ų133140.2 Ų140.282%0.81681%0.81SS**  trans-133.3113.3163.9420000110.6S148T146-S148 PolarHBondContact O-N 3.4Å
147V45.8Very low38.7Very low152 Ų152142.2 Ų142.292%0.92181%0.807SS**  trans-39.1115.9160-93.20000110.7
148S43.4Very low38.1Very low114 Ų114144.3 Ų144.380%0.79781%0.812SS**  trans-126.7126.8165.8-167.90000109.1T146T146-S148 PolarHBondContact O-N 3.4Å
149R36.2Very low37.5Very low237 Ų237141.4 Ų141.489%0.89480%0.802SS**PPolyproline II helixtrans-70.9123.7-163.6-64.2178.3166.3-177.9-5.9110.8
150C30Very low36.7Very low123 Ų123144.4 Ų144.483%0.83181%0.81SS**PPolyproline II helixtrans-82.1120.8160-73.80000108.4
151S35.1Very low35.7Very low121 Ų121144.6 Ų144.685%0.84681%0.809SS**PPolyproline II helixtrans-64.9124.4172.6-33.50000109.5
152E37.4Very low36.2Very low192 Ų192142.7 Ų142.790%0.89781%0.805SS**PPolyproline II helixtrans-97.4137.5167.5-67.2-178.4116.500109.5
153D35.4Very low35.6Very low156 Ų156143.1 Ų143.183%0.83481%0.808SS**PPolyproline II helixtrans-70.4140.8-175.2-172.130.2000111.7
154L32.9Very low35.2Very low159 Ų159141.1 Ų141.183%0.83281%0.808SS**  trans-84.4112.6-179.7-83.7159.8000109.4
155S36.8Very low35.2Very low103 Ų103142.9 Ų142.972%0.7281%0.809SS**  trans-164140.5155.1-76.20000111.9
156Q33.1Very low35.2Very low182 Ų182142.7 Ų142.785%0.8581%0.807SS**  trans78.8106.5173.5-90.2154.3-2800117.1
157E28.9Very low35Very low163 Ų163140.9 Ų140.976%0.76281%0.806SS**  113.1108.251.1-177.6173.1105.100108.3
158Q30.9Very low34.6Very low183 Ų183141 Ų14186%0.85580%0.801SS**  trans74.3136.9144.9-150154.4-15.200121.8
159A31.8Very low34.6Very low74 Ų74141.4 Ų141.461%0.61280%0.8SS**  trans-71.4149.9-169.300000114.6
160D29.4Very low34.5Very low161 Ų161134.9 Ų134.986%0.86179%0.791SS**  -175.9137.6106.6-86.6-28.3000111.3
161T31.6Very low35.2Very low134 Ų134134.5 Ų134.582%0.82279%0.787SS**  trans-122.4168.2161.325.20000106.8
162P45.3Very low35.2Very low113 Ų113137.7 Ų137.773%0.73479%0.788SS**  cis-136.2-179.910.730.6-7.9000114
163T28.6Very low35.3Very low121 Ų121137.8 Ų137.874%0.74279%0.791SS**  160.6120122.4-67.50000113.1
164S34.2Very low35.3Very low112 Ų112133.8 Ų133.878%0.78379%0.787SS**  trans68107.1147.9-59.30000122.9
165D32.9Very low35.7Very low150 Ų150132.7 Ų132.780%0.80279%0.786SS**  trans-65.6165.5134.9-142.417.7000109.2
166P44.3Very low36Very low114 Ų114135.7 Ų135.774%0.7479%0.793SS**  cis-142.915226.839.3-18.4000117.4
167A31.9Very low36.6Very low95 Ų95137.4 Ų137.479%0.78579%0.792SS**  trans-174.199.2145.600000113.2
168L36.3Very low37.1Very low155 Ų155136.9 Ų136.981%0.81280%0.795SS**  trans-82149.2149.4-95.9164.2000108.5
169P42.7Very low37.9Very low122 Ų122136.4 Ų136.479%0.79279%0.792SS**  -145.9144.18534.7-16000115.9
170S35.1Very low38.6Very low99 Ų99135.7 Ų135.769%0.69279%0.792SS**  trans-86.1153.7146.5-48.40000107.8
171P45.3Very low40.1Very low115 Ų115134.5 Ų134.575%0.74779%0.793SS**  -141.9168.16829.3-5.2000112.1
172E34.2Very low41.1Very low188 Ų188135.6 Ų135.688%0.87979%0.794SS**  -173.2152.387.3-82.2-162.7122.500112.4
173M39.2Very low41.5Very low195 Ų195135.5 Ų135.596%0.96180%0.796SS**  trans-60148.1171.9-78.2-170.8-82.900113.9
174G36.4Very low43Very low72 Ų72136.2 Ų136.274%0.74280%0.8SS**  trans-158.574.6170.800000114.9
175V40.5Very low44.1Very low135 Ų135136.6 Ų136.682%0.81880%0.8SS**  trans53.9117.2132.3-1780000119.8
176L43.2Very low44.9Very low166 Ų166134.2 Ų134.287%0.86980%0.801SS**  trans-52.1138.3159.3-78.6100.7000112
177R45Very low45.2Very low218 Ų218141.8 Ų141.882%0.82383%0.827SS**  trans-124.9112.6154.8-61.3-167.488.4-163.93.1109.9
178D39.8Very low45.9Very low153 Ų153144.2 Ų144.282%0.81883%0.829SS**  trans-73.4124.7165.6177.766.6000108.2
179E48.7Very low46.4Very low173 Ų173143.6 Ų143.681%0.80883%0.83SS**  trans-110.598.1174.2-67.4-97.8120.100107.3
180G45.1Very low46.6Very low59 Ų59144.8 Ų144.861%0.60883%0.832SS**PPolyproline II helixtrans-79148.5170.500000111.7
181P61.8Low47.3Very low135 Ų135147.5 Ų147.588%0.87784%0.84SS**PPolyproline II helixtrans-79.2140.4-176.529.9-32.8000113.5
182D52Low47.4Very low158 Ų158149.5 Ų149.585%0.84585%0.846SS**PPolyproline II helixtrans-64.9150.5-175.7-156.20.5000113.9
183S54.7Low48.3Very low110 Ų110146.9 Ų146.977%0.76984%0.843SS**PPolyproline II helixtrans-81137-177-63.70000111.9
184V58.8Low48.9Very low137 Ų137143.5 Ų143.583%0.8384%0.835SS**PPolyproline II helixtrans-90.5133.4170.5-176.30000109.2
185P58.8Low49.9Very low119 Ų119149 Ų14977%0.77384%0.842SS**PPolyproline II helixtrans-83.4148.3174.333.1-30.4000111.5
186A48.6Very low50.7Low101 Ų101150.2 Ų150.284%0.83584%0.844SS**PPolyproline II helixtrans-74.3141.4177.800000112.6
187E52Low51.4Low273 Ų273148.7 Ų148.7100%1.27684%0.842SS**  trans-121.50147-78-164.8118.700108.9

Retrieved 187 of 187 residues in 88.6 ms (Link to these results)