A0A087YHJ0_POEFO Loading...

Homer scaffold protein 2

AlphaFold DB , UniProt , Accession A0A087YHJ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 312 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
1D63.1Low87.1Confident157 Ų15799 Ų9984%0.8455%0.552SS**  0142.40-55.9-27000111.4A71D1-A71 HydrophobicContact CB-CB 4.47Å
2S83.3Confident87.5Confident82 Ų82104.2 Ų104.257%0.57356%0.564SS**  trans-119127.4179.6179.30000109.4T18S2-T18 WeakPolarHBondContact OG-CG2 3.39Å
3Y91.8Very high87.8Confident93 Ų93102.3 Ų102.337%0.36556%0.558SS.*  trans-91.4142.4175.3-63.3-88.3000110.6I19 V64 A67 A68Y3-I19 PolarHBondContact O-N 3.43Å; Y3-V64 HydrophobicContact CD1-CG1 4.08Å; Y3-V64 HydrophobicContact CD2-CG1 4.4Å; Y3-V64 HydrophobicContact CG-CG1 3.72Å; Y3-A67 HydrophobicContact CE2-CB 3.81Å; Y3-A68 HydrophobicContact CD2-CB 3.92Å
4R93.6Very high88.2Confident133 Ų133102 Ų10250%0.50255%0.554SS.*EExtended strand (participates in β ladder)trans-133.5137.7-179.4-55-178.487.4177.97110.7I6 N16 S17 T18R4-I6 HydrophobicContact CB-CD1 4.44Å; R4-I6 HydrophobicContact CB-CG1 4.15Å; R4-N16 PolarHBondContact NE-OD1 3.36Å; R4-N16 VanDerWaalsContact NE-OD1 3.1Å; R4-N16 PolarHBondContact NH2-ND2 2.88Å; R4-N16 PolarHBondContact NH2-OD1 3.03Å; R4-S17 CarbonylContact C-O 3.54Å; R4-S17 VanDerWaalsContact CA-O 3.26Å; R4-S17 WeakPolarHBondContact CA-O 3.44Å; R4-T18 PolarHBondContact NE-OG1 2.76Å
5L93.4Very high88.7Confident44 Ų4496.2 Ų96.223%0.2352%0.522CS..EExtended strand (participates in β ladder)trans-86.1116.4162.1-82.1170.6000108.3N16 S17 I19 W35 F57 F61L5-N16 WeakPolarHBondContact O-CA 3.32Å; L5-S17 PolarHBondContact N-O 2.65Å; L5-S17 PolarHBondContact O-N 3.29Å; L5-I19 HydrophobicContact CD1-CD1 3.6Å; L5-I19 HydrophobicContact CG-CD1 3.91Å; L5-I19 HydrophobicContact CG-CG1 4.34Å; L5-W35 HydrophobicContact CD1-CH2 4Å; L5-W35 HydrophobicContact CD1-CZ2 3.63Å; L5-F57 HydrophobicContact CD1-CZ 4.05Å; L5-F57 HydrophobicContact CD2-CE2 4.07Å; L5-F57 HydrophobicContact CD2-CZ 3.96Å; L5-F61 HydrophobicContact CD1-CD2 3.81Å; L5-F61 HydrophobicContact CD1-CE2 3.56Å
6I93.9Very high89Confident101 Ų10194.5 Ų94.552%0.51851%0.513SS..EExtended strand (participates in β ladder)trans-118.1121.8177.2-57.5177.8000107.5R4 V13 I15R4-I6 HydrophobicContact CB-CD1 4.44Å; R4-I6 HydrophobicContact CB-CG1 4.15Å; I6-V13 HydrophobicContact CG2-CG1 3.95Å; I6-V13 HydrophobicContact CG2-CG2 4.35Å; I6-I15 VanDerWaalsContact CA-O 3.28Å; I6-I15 WeakPolarHBondContact CA-O 3.15Å
7C92.6Very high89.3Confident47 Ų4788.9 Ų88.932%0.31848%0.482SS..EExtended strand (participates in β ladder)trans-118.1125.6170.3-171.40000108.4I14 I15C7-I14 HydrophobicContact CB-CG1 4.08Å; C7-I14 VanDerWaalsContact O-CG1 3.25Å; C7-I14 WeakPolarHBondContact O-CG1 3.3Å; C7-I14 PolarHBondContact O-N 3Å; C7-I15 HydrophobicContact CB-CB 3.67Å; C7-I15 HydrophobicContact CB-CD1 3.89Å; C7-I15 HydrophobicContact CB-CG1 3.85Å; C7-I15 PolarHBondContact N-O 3.3Å; C7-I15 PolarHBondContact O-N 3.05Å
8C92.2Very high89.5Confident80 Ų8084.8 Ų84.854%0.54146%0.46SS..EExtended strand (participates in β ladder)trans-109.9132.6178.4-61.30000109.8K12C8-K12 CarbonylContact C-O 3.58Å; C8-K12 VanDerWaalsContact CA-O 3.27Å; C8-K12 WeakPolarHBondContact CA-O 3.08Å
9F89.4Confident89.7Confident145 Ų14580.7 Ų80.764%0.63644%0.438SS*.EExtended strand (participates in β ladder)trans-123.8122.4169.9-176.7-95.6000108.6S11 K12 I14F9-S11 VanDerWaalsContact C-N 3.34Å; F9-S11 PolarHBondContact O-N 3.16Å; F9-K12 PolarHBondContact N-O 3Å; F9-K12 PolarHBondContact O-N 2.92Å; F9-I14 HydrophobicContact CB-CD1 3.83Å; F9-I14 HydrophobicContact CB-CG1 4.22Å; F9-I14 HydrophobicContact CB-CG2 4.08Å
10A79.1Confident89.8Confident78 Ų7879.5 Ų79.565%0.64543%0.434SS*.THydrogen-bonded Turntrans44.655.1-179.100000113.1K12A10-K12 PolarHBondContact O-N 3.34Å; A10-K12 VanDerWaalsContact O-N 3.08Å
11S86.1Confident89.8Confident129 Ų12977.7 Ų77.790%0.90243%0.426SS*.THydrogen-bonded Turntrans65.43.8-179.8-52.70000116.7F9F9-S11 VanDerWaalsContact C-N 3.34Å; F9-S11 PolarHBondContact O-N 3.16Å
12K91.4Very high91.1Very high161 Ų16177.4 Ų77.470%0.742%0.424SS*.EExtended strand (participates in β ladder)trans-104.4135172-67.7-178.1179.2176.10110.9C8 F9 A10 I14C8-K12 CarbonylContact C-O 3.58Å; C8-K12 VanDerWaalsContact CA-O 3.27Å; C8-K12 WeakPolarHBondContact CA-O 3.08Å; F9-K12 PolarHBondContact N-O 3Å; F9-K12 PolarHBondContact O-N 2.92Å; A10-K12 PolarHBondContact O-N 3.34Å; A10-K12 VanDerWaalsContact O-N 3.08Å; K12-I14 PolarHBondContact O-N 2.94Å
13V92.1Very high91.6Very high80 Ų8074 Ų7449%0.48540%0.399SS..EExtended strand (participates in β ladder)trans-77.4113173.2-178.10000108.7I6 I15 N16I6-V13 HydrophobicContact CG2-CG1 3.95Å; I6-V13 HydrophobicContact CG2-CG2 4.35Å; V13-I15 VanDerWaalsContact CG1-O 3.23Å; V13-I15 WeakPolarHBondContact CG1-O 3.25Å; V13-N16 HydrophobicContact CG1-CB 3.79Å
14I93.1Very high91.8Very high98 Ų9873.6 Ų73.650%0.50341%0.407SS..EExtended strand (participates in β ladder)trans-99.2-27-17954.4163.4000112.7C7 F9 K12C7-I14 HydrophobicContact CB-CG1 4.08Å; C7-I14 VanDerWaalsContact O-CG1 3.25Å; C7-I14 WeakPolarHBondContact O-CG1 3.3Å; C7-I14 PolarHBondContact O-N 3Å; F9-I14 HydrophobicContact CB-CD1 3.83Å; F9-I14 HydrophobicContact CB-CG1 4.22Å; F9-I14 HydrophobicContact CB-CG2 4.08Å; K12-I14 PolarHBondContact O-N 2.94Å
15I94.9Very high92Very high15 Ų1568.6 Ų68.68%0.07739%0.389CS..EExtended strand (participates in β ladder)trans-123.5125.1170.2-56.1177.9000106.7I6 C7 V13 W35 F44 L46I6-I15 VanDerWaalsContact CA-O 3.28Å; I6-I15 WeakPolarHBondContact CA-O 3.15Å; C7-I15 HydrophobicContact CB-CB 3.67Å; C7-I15 HydrophobicContact CB-CD1 3.89Å; C7-I15 HydrophobicContact CB-CG1 3.85Å; C7-I15 PolarHBondContact N-O 3.3Å; C7-I15 PolarHBondContact O-N 3.05Å; V13-I15 VanDerWaalsContact CG1-O 3.23Å; V13-I15 WeakPolarHBondContact CG1-O 3.25Å; I15-W35 HydrophobicContact CD1-CH2 4.22Å; I15-W35 HydrophobicContact CG2-CH2 4.23Å; I15-W35 HydrophobicContact CG2-CZ2 3.89Å; I15-F44 HydrophobicContact CB-CD1 4.43Å; I15-F44 HydrophobicContact CB-CE1 4.41Å; I15-F44 HydrophobicContact CD1-CD1 4.34Å; I15-F44 HydrophobicContact CG1-CD1 3.89Å; I15-F44 HydrophobicContact CG1-CE1 4.17Å; I15-F44 HydrophobicContact CG2-CD1 4.07Å; I15-F44 HydrophobicContact CG2-CD2 4.4Å; I15-F44 HydrophobicContact CG2-CE1 4.17Å; I15-F44 HydrophobicContact CG2-CE2 4.49Å; I15-F44 HydrophobicContact CG2-CG 4.18Å; I15-F44 HydrophobicContact CG2-CZ 4.39Å; I15-L46 HydrophobicContact CD1-CD2 3.84Å
16N93.5Very high92.1Very high69 Ų6969.8 Ų69.837%0.36940%0.398SS..EExtended strand (participates in β ladder)trans-136.774.1172.8-167.6-10.3000109R4 L5 V13R4-N16 PolarHBondContact NE-OD1 3.36Å; R4-N16 VanDerWaalsContact NE-OD1 3.1Å; R4-N16 PolarHBondContact NH2-ND2 2.88Å; R4-N16 PolarHBondContact NH2-OD1 3.03Å; L5-N16 WeakPolarHBondContact O-CA 3.32Å; V13-N16 HydrophobicContact CG1-CB 3.79Å
17S94.4Very high92.3Very high0 Ų069.9 Ų69.90%040%0.395CS..EExtended strand (participates in β ladder)trans-105.6123.3-173.1-176.70000110.1R4 L5 W35 D37R4-S17 CarbonylContact C-O 3.54Å; R4-S17 VanDerWaalsContact CA-O 3.26Å; R4-S17 WeakPolarHBondContact CA-O 3.44Å; L5-S17 PolarHBondContact N-O 2.65Å; L5-S17 PolarHBondContact O-N 3.29Å; S17-W35 PolarHBondContact OG-NE1 3.32Å; S17-D37 VanDerWaalsContact CA-OD2 3.25Å; S17-D37 WeakPolarHBondContact CA-OD2 3.39Å; S17-D37 VanDerWaalsContact CB-OD2 3.27Å; S17-D37 WeakPolarHBondContact CB-OD2 3.27Å; S17-D37 PolarHBondContact OG-OD2 2.85Å
18T93.4Very high92.4Very high14 Ų1471 Ų719%0.08640%0.4CS..EExtended strand (participates in β ladder)trans-85.4118.6175-69.40000109.1S2 R4 T20 M23S2-T18 WeakPolarHBondContact OG-CG2 3.39Å; R4-T18 PolarHBondContact NE-OG1 2.76Å; T18-T20 PolarHBondContact O-N 2.84Å; T18-M23 VanDerWaalsContact O-CE 3.22Å; T18-M23 WeakPolarHBondContact O-CE 3.31Å; T18-M23 VanDerWaalsContact O-SD 3.41Å
19I93.6Very high92.5Very high7 Ų770.8 Ų70.84%0.03640%0.399CS..  trans-70.2126-178.3-58.2-55.8000110.2Y3 L5 M23 F61 V64 K65Y3-I19 PolarHBondContact O-N 3.43Å; L5-I19 HydrophobicContact CD1-CD1 3.6Å; L5-I19 HydrophobicContact CG-CD1 3.91Å; L5-I19 HydrophobicContact CG-CG1 4.34Å; I19-M23 HydrophobicContact CD1-SD 4.3Å; I19-F61 HydrophobicContact CD1-CD2 4.28Å; I19-F61 HydrophobicContact CD1-CE1 4.47Å; I19-F61 HydrophobicContact CD1-CE2 3.54Å; I19-F61 HydrophobicContact CD1-CZ 3.65Å; I19-V64 HydrophobicContact CB-CG1 4.14Å; I19-V64 HydrophobicContact CG1-CG1 4.03Å; I19-V64 HydrophobicContact CG2-CG1 4.14Å; I19-K65 HydrophobicContact CG2-CB 4.21Å
20T91.4Very high92.8Very high57 Ų5771.1 Ų71.135%0.3540%0.403SS..  trans-115.5153.7175.367.80000110.9T18 N22 M23T18-T20 PolarHBondContact O-N 2.84Å; T20-N22 PolarHBondContact O-N 3.33Å; T20-M23 HydrophobicContact CG2-CE 4.48Å; T20-M23 HydrophobicContact CG2-SD 4.48Å; T20-M23 PolarHBondContact N-SD 3.48Å; T20-M23 WeakPolarHBondContact O-CB 3.4Å; T20-M23 PolarHBondContact O-N 2.92Å; T20-M23 WeakPolarHBondContact OG1-CG 3.34Å
21P89.9Confident93.7Very high41 Ų4171.2 Ų71.227%0.26639%0.389SS..THydrogen-bonded Turntrans-58.3-21.8-179.1-2837.2000115.2K65 K69P21-K65 WeakPolarHBondContact O-CD 3.25Å; P21-K69 HydrophobicContact CB-CB 4.03Å; P21-K69 HydrophobicContact CB-CG 4.28Å; P21-K69 HydrophobicContact CG-CB 3.96Å; P21-K69 HydrophobicContact CG-CG 4.41Å
22N89.8Confident94.2Very high151 Ų15168.3 Ų68.381%0.80736%0.36SS*.THydrogen-bonded Turntrans-93.1-4.9-177.4-61.6-12.4000112.9T20T20-N22 PolarHBondContact O-N 3.33Å
23M94.4Very high94.5Very high10 Ų1060.7 Ų60.75%0.04933%0.327CS..  trans-71.4147177.4-80.9166.3166.800111.7T18 I19 T20 D37 F61 K65T18-M23 VanDerWaalsContact O-CE 3.22Å; T18-M23 WeakPolarHBondContact O-CE 3.31Å; T18-M23 VanDerWaalsContact O-SD 3.41Å; I19-M23 HydrophobicContact CD1-SD 4.3Å; T20-M23 HydrophobicContact CG2-CE 4.48Å; T20-M23 HydrophobicContact CG2-SD 4.48Å; T20-M23 PolarHBondContact N-SD 3.48Å; T20-M23 WeakPolarHBondContact O-CB 3.4Å; T20-M23 PolarHBondContact O-N 2.92Å; T20-M23 WeakPolarHBondContact OG1-CG 3.34Å; M23-D37 HydrophobicContact CE-CB 3.71Å; M23-F61 HydrophobicContact CB-CE1 4.13Å; M23-F61 HydrophobicContact CB-CZ 4.14Å; M23-K65 WeakPolarHBondContact O-CD 3.38Å
24T95.2Very high94.8Very high86 Ų8660.2 Ų60.253%0.52832%0.32SS..  trans-131127.3176.9-59.50000109.8W35T24-W35 WeakPolarHBondContact O-CA 3.33Å; T24-W35 VanDerWaalsContact O-CB 3.29Å; T24-W35 WeakPolarHBondContact O-CB 3.31Å
25F97.3Very high95Very high27 Ų2755.8 Ų55.812%0.11830%0.296CS..EExtended strand (participates in β ladder)trans-92.1120.9168.9-177.7-96.6000109.2K27 Q34 W35 F48 L54 F57 A58 F61F25-K27 HydrophobicContact CE1-CG 4.35Å; F25-Q34 WeakPolarHBondContact CA-O 3.4Å; F25-W35 HydrophobicContact CD2-CB 4.43Å; F25-W35 AromaticContact CD2-CE3 3.84Å; F25-W35 HydrophobicContact CD2-CE3 3.84Å; F25-W35 HydrophobicContact CE2-CE3 4.03Å; F25-W35 HydrophobicContact CE2-CZ3 4.4Å; F25-F48 HydrophobicContact CZ-CE2 4.33Å; F25-L54 HydrophobicContact CE1-CD1 3.79Å; F25-L54 HydrophobicContact CZ-CD1 3.74Å; F25-F57 HydrophobicContact CD2-CD1 4.25Å; F25-F57 AromaticContact CD2-CE1 3.87Å; F25-F57 HydrophobicContact CD2-CE1 3.87Å; F25-F57 HydrophobicContact CE1-CD1 4.14Å; F25-F57 AromaticContact CE2-CD1 3.81Å; F25-F57 HydrophobicContact CE2-CD1 3.81Å; F25-F57 AromaticContact CE2-CE1 3.62Å; F25-F57 HydrophobicContact CE2-CE1 3.62Å; F25-F57 AromaticContact CZ-CD1 3.74Å; F25-F57 HydrophobicContact CZ-CD1 3.74Å; F25-F57 HydrophobicContact CZ-CE1 4.06Å; F25-A58 HydrophobicContact CD1-CB 3.7Å; F25-A58 HydrophobicContact CE1-CB 3.86Å; F25-F61 HydrophobicContact CB-CB 4.3Å; F25-F61 HydrophobicContact CB-CD1 3.75Å; F25-F61 HydrophobicContact CB-CD2 4.15Å; F25-F61 HydrophobicContact CB-CE1 4.06Å; F25-F61 HydrophobicContact CB-CE2 4.42Å; F25-F61 HydrophobicContact CB-CG 3.8Å; F25-F61 HydrophobicContact CB-CZ 4.38Å; F25-F61 HydrophobicContact CD2-CD2 4.4Å; F25-F61 HydrophobicContact CG-CG 4.44Å
26T97.2Very high95.1Very high70 Ų7057.6 Ų57.643%0.42931%0.314SS..EExtended strand (participates in β ladder)trans-115126.7-175.9-520000109.9T28 G33 Q34T26-T28 HydrophobicContact CG2-CG2 4.08Å; T26-T28 PolarHBondContact O-N 2.89Å; T26-G33 CarbonylContact O-C 3.55Å; T26-G33 WeakPolarHBondContact O-CA 3.29Å; T26-Q34 PolarHBondContact N-O 2.83Å; T26-Q34 PolarHBondContact O-N 3.4Å
27K97.3Very high95.1Very high103 Ų10354.5 Ų54.545%0.44830%0.297SS..EExtended strand (participates in β ladder)trans-78.7112.6170.6-57.6-177.8-173.1177.80108.1F25 L54 S55F25-K27 HydrophobicContact CE1-CG 4.35Å; K27-L54 HydrophobicContact CB-CD2 4.38Å; K27-L54 HydrophobicContact CD-CD2 4Å; K27-L54 HydrophobicContact CD-CG 4.15Å; K27-L54 HydrophobicContact CG-CD1 4.3Å; K27-L54 HydrophobicContact CG-CD2 4.06Å; K27-L54 HydrophobicContact CG-CG 4.19Å; K27-S55 PolarHBondContact NZ-OG 3Å
28T94.8Very high94.9Very high70 Ų7059.8 Ų59.843%0.42933%0.334SS..EExtended strand (participates in β ladder)trans-104.7-22-173.748.30000113.4T26 F32 Q34T26-T28 HydrophobicContact CG2-CG2 4.08Å; T26-T28 PolarHBondContact O-N 2.89Å; T28-F32 PolarHBondContact N-O 3.05Å; T28-F32 VanDerWaalsContact OG1-CD1 3.26Å; T28-F32 WeakPolarHBondContact OG1-CD1 3.49Å; T28-Q34 HydrophobicContact CG2-CG 3.84Å; T28-Q34 PolarHBondContact OG1-OE1 3.43Å
29S95.3Very high94.8Very high75 Ų7568.7 Ų68.752%0.52437%0.366SS..EExtended strand (participates in β ladder)trans-159.1-178.3174.667.70000111.8K31 F32S29-K31 PolarHBondContact O-N 3.39Å; S29-F32 PolarHBondContact O-N 2.91Å; S29-F32 VanDerWaalsContact O-N 3.16Å; S29-F32 VanDerWaalsContact O-O 3.12Å; S29-F32 WeakPolarHBondContact OG-CB 3.25Å
30Q94.6Very high94.6Very high152 Ų15270.4 Ų70.471%0.7138%0.381SS*.THydrogen-bonded Turntrans-59.6123.5-178.5-161.3-173.836.900111F32 E51Q30-F32 PolarHBondContact O-N 3.39Å; Q30-E51 WeakPolarHBondContact CA-OE1 3.33Å; Q30-E51 WeakPolarHBondContact CG-OE1 3.21Å
31K97.3Very high94.7Very high81 Ų8174.9 Ų74.935%0.35240%0.403SS..THydrogen-bonded Turntrans58.421.2-178.4-58.1174.2-69.5176.30114.1S29 G47 F48 E51S29-K31 PolarHBondContact O-N 3.39Å; K31-G47 CarbonylContact O-C 3.53Å; K31-G47 WeakPolarHBondContact O-CA 3.49Å; K31-F48 WeakPolarHBondContact CB-O 3.27Å; K31-F48 PolarHBondContact O-N 2.73Å; K31-E51 HydrophobicContact CG-CG 4.2Å; K31-E51 PolarHBondContact N-OE1 2.86Å
32F98.2Very high94.9Very high68 Ų6876 Ų7630%0.29841%0.409SS..EExtended strand (participates in β ladder)trans-135.3138.6-177.4-176.1-92.3000112.3T28 S29 Q30 Q34 L46T28-F32 PolarHBondContact N-O 3.05Å; T28-F32 VanDerWaalsContact OG1-CD1 3.26Å; T28-F32 WeakPolarHBondContact OG1-CD1 3.49Å; S29-F32 PolarHBondContact O-N 2.91Å; S29-F32 VanDerWaalsContact O-N 3.16Å; S29-F32 VanDerWaalsContact O-O 3.12Å; S29-F32 WeakPolarHBondContact OG-CB 3.25Å; Q30-F32 PolarHBondContact O-N 3.39Å; F32-Q34 HydrophobicContact CE1-CB 4.45Å; F32-L46 WeakPolarHBondContact CA-O 3.44Å; F32-L46 WeakPolarHBondContact CD2-O 3.35Å
33G97.8Very high95.2Very high0 Ų073.1 Ų73.10%040%0.397CS..EExtended strand (participates in β ladder)trans-149.4162173.300000112.4T26 G45 L46T26-G33 CarbonylContact O-C 3.55Å; T26-G33 WeakPolarHBondContact O-CA 3.29Å; G33-G45 WeakPolarHBondContact O-CA 3.44Å; G33-L46 PolarHBondContact N-O 3.34Å; G33-L46 VanDerWaalsContact N-O 3.09Å; G33-L46 PolarHBondContact O-N 2.86Å
34Q97.8Very high95.3Very high71 Ų7174.1 Ų74.133%0.33240%0.401SS..EExtended strand (participates in β ladder)trans-143.5156.7-171.563.7-174.665.500112.5F25 T26 T28 F32 V43 F44F25-Q34 WeakPolarHBondContact CA-O 3.4Å; T26-Q34 PolarHBondContact N-O 2.83Å; T26-Q34 PolarHBondContact O-N 3.4Å; T28-Q34 HydrophobicContact CG2-CG 3.84Å; T28-Q34 PolarHBondContact OG1-OE1 3.43Å; F32-Q34 HydrophobicContact CE1-CB 4.45Å; Q34-V43 HydrophobicContact CB-CG1 4.36Å; Q34-F44 CarbonylContact C-O 3.53Å; Q34-F44 WeakPolarHBondContact CA-O 3.44Å; Q34-F44 VanDerWaalsContact CB-O 3.28Å; Q34-F44 WeakPolarHBondContact CB-O 3.32Å
35W97.4Very high95.4Very high4 Ų471.8 Ų71.82%0.01539%0.394CS..EExtended strand (participates in β ladder)trans-141.2152.4169.673.2101.5000110.5L5 I15 S17 T24 F25 V43 F44 L46 F61L5-W35 HydrophobicContact CD1-CH2 4Å; L5-W35 HydrophobicContact CD1-CZ2 3.63Å; I15-W35 HydrophobicContact CD1-CH2 4.22Å; I15-W35 HydrophobicContact CG2-CH2 4.23Å; I15-W35 HydrophobicContact CG2-CZ2 3.89Å; S17-W35 PolarHBondContact OG-NE1 3.32Å; T24-W35 WeakPolarHBondContact O-CA 3.33Å; T24-W35 VanDerWaalsContact O-CB 3.29Å; T24-W35 WeakPolarHBondContact O-CB 3.31Å; F25-W35 HydrophobicContact CD2-CB 4.43Å; F25-W35 AromaticContact CD2-CE3 3.84Å; F25-W35 HydrophobicContact CD2-CE3 3.84Å; F25-W35 HydrophobicContact CE2-CE3 4.03Å; F25-W35 HydrophobicContact CE2-CZ3 4.4Å; W35-V43 WeakPolarHBondContact O-CA 3.49Å; W35-F44 HydrophobicContact CD2-CB 4Å; W35-F44 AromaticContact CE2-CD2 3.92Å; W35-F44 HydrophobicContact CE3-CB 4.03Å; W35-F44 HydrophobicContact CH2-CB 3.52Å; W35-F44 HydrophobicContact CH2-CG 4.3Å; W35-F44 HydrophobicContact CZ2-CB 3.45Å; W35-F44 VanDerWaalsContact CZ2-CB 3.45Å; W35-F44 AromaticContact CZ2-CD2 3.89Å; W35-F44 HydrophobicContact CZ2-CD2 3.89Å; W35-F44 AromaticContact CZ2-CG 3.87Å; W35-F44 HydrophobicContact CZ2-CG 3.87Å; W35-F44 HydrophobicContact CZ3-CB 3.81Å; W35-F44 PolarHBondContact N-O 3.32Å; W35-F44 AromaticContact NE1-CD2 3.88Å; W35-F44 PolarHBondContact O-N 3.43Å; W35-L46 HydrophobicContact CH2-CD1 3.94Å; W35-L46 HydrophobicContact CH2-CG 4.2Å; W35-L46 HydrophobicContact CZ3-CD1 3.71Å; W35-L46 HydrophobicContact CZ3-CG 3.85Å; W35-F61 HydrophobicContact CB-CE2 4.36Å; W35-F61 HydrophobicContact CB-CZ 4.09Å; W35-F61 AromaticContact CD2-CE2 3.98Å; W35-F61 HydrophobicContact CD2-CE2 3.98Å; W35-F61 HydrophobicContact CD2-CZ 4.48Å; W35-F61 HydrophobicContact CE3-CE2 4.49Å; W35-F61 AromaticContact CG-CE2 3.91Å; W35-F61 HydrophobicContact CG-CE2 3.91Å; W35-F61 AromaticContact CG-CZ 3.93Å; W35-F61 HydrophobicContact CG-CZ 3.93Å
36A96.3Very high95.4Very high53 Ų5372.5 Ų72.544%0.43840%0.399SS..EExtended strand (participates in β ladder)trans-94132.7173.700000110.3V43A36-V43 HydrophobicContact CB-CG2 4.14Å
37D94.7Very high95.3Very high5 Ų572 Ų723%0.02741%0.408CS..EExtended strand (participates in β ladder)trans-111.599.7169-171-24.9000109.8S17 M23 R39 A40 N41 T42 F44S17-D37 VanDerWaalsContact CA-OD2 3.25Å; S17-D37 WeakPolarHBondContact CA-OD2 3.39Å; S17-D37 VanDerWaalsContact CB-OD2 3.27Å; S17-D37 WeakPolarHBondContact CB-OD2 3.27Å; S17-D37 PolarHBondContact OG-OD2 2.85Å; M23-D37 HydrophobicContact CE-CB 3.71Å; D37-R39 PolarHBondContact O-N 3.31Å; D37-R39 WeakPolarHBondContact OD1-CA 3.37Å; D37-R39 WeakPolarHBondContact OD1-CB 3.36Å; D37-R39 PolarHBondContact OD1-N 2.84Å; D37-A40 HydrophobicContact CB-CB 4.07Å; D37-A40 CarbonylContact O-C 3.48Å; D37-A40 PolarHBondContact O-N 2.96Å; D37-A40 PolarHBondContact OD1-N 3.26Å; D37-A40 VanDerWaalsContact OD1-N 3.07Å; D37-N41 WeakPolarHBondContact O-CA 3.33Å; D37-N41 PolarHBondContact O-N 2.88Å; D37-T42 PolarHBondContact N-O 2.86Å; D37-T42 PolarHBondContact O-N 2.95Å; D37-T42 VanDerWaalsContact O-N 3.08Å; D37-F44 HydrophobicContact CB-CD2 4.18Å; D37-F44 HydrophobicContact CB-CE2 3.93Å
38S90.2Very high95.3Very high110 Ų11069 Ų6977%0.76940%0.395SS*.THydrogen-bonded Turntrans-63.2-27.6178.8-51.60000112.9N41S38-N41 PolarHBondContact O-N 2.79Å
39R90.4Very high95.4Very high202 Ų20269.6 Ų69.676%0.76241%0.407SS*.THydrogen-bonded Turntrans-74.5-40179-175-178.3-176.7-178.93.6111D37D37-R39 PolarHBondContact O-N 3.31Å; D37-R39 WeakPolarHBondContact OD1-CA 3.37Å; D37-R39 WeakPolarHBondContact OD1-CB 3.36Å; D37-R39 PolarHBondContact OD1-N 2.84Å
40A89.9Confident95.5Very high43 Ų4367.9 Ų67.936%0.35540%0.395SS..THydrogen-bonded Turntrans-82-2.5173.500000112.9D37 T42 F44D37-A40 HydrophobicContact CB-CB 4.07Å; D37-A40 CarbonylContact O-C 3.48Å; D37-A40 PolarHBondContact O-N 2.96Å; D37-A40 PolarHBondContact OD1-N 3.26Å; D37-A40 VanDerWaalsContact OD1-N 3.07Å; A40-T42 PolarHBondContact O-N 3.02Å; A40-T42 VanDerWaalsContact O-N 3.15Å; A40-T42 PolarHBondContact O-OG1 3.4Å; A40-F44 HydrophobicContact CB-CE2 4.24Å; A40-F44 HydrophobicContact CB-CZ 4.42Å
41N93.3Very high95.6Very high151 Ų15164.2 Ų64.281%0.80738%0.378SS*.THydrogen-bonded Turntrans45.341-171.8-16638.3000112.9D37 S38D37-N41 WeakPolarHBondContact O-CA 3.33Å; D37-N41 PolarHBondContact O-N 2.88Å; S38-N41 PolarHBondContact O-N 2.79Å
42T94.6Very high95.6Very high64 Ų6468.2 Ų68.239%0.39340%0.398SS..EExtended strand (participates in β ladder)trans-141.1144.3-170.3-61.50000110.3D37 A40 F44D37-T42 PolarHBondContact N-O 2.86Å; D37-T42 PolarHBondContact O-N 2.95Å; D37-T42 VanDerWaalsContact O-N 3.08Å; A40-T42 PolarHBondContact O-N 3.02Å; A40-T42 VanDerWaalsContact O-N 3.15Å; A40-T42 PolarHBondContact O-OG1 3.4Å; T42-F44 HydrophobicContact CG2-CD1 4.19Å; T42-F44 HydrophobicContact CG2-CE1 3.86Å; T42-F44 HydrophobicContact CG2-CE2 4.23Å; T42-F44 HydrophobicContact CG2-CZ 3.88Å
43V96Very high95.5Very high91 Ų9169.8 Ų69.855%0.55241%0.406SS*.EExtended strand (participates in β ladder)trans-100.2120.7168.5-1790000108.3Q34 W35 A36Q34-V43 HydrophobicContact CB-CG1 4.36Å; W35-V43 WeakPolarHBondContact O-CA 3.49Å; A36-V43 HydrophobicContact CB-CG2 4.14Å
44F96.8Very high95.5Very high31 Ų3169.8 Ų69.814%0.13641%0.406CS..EExtended strand (participates in β ladder)trans-97.9138.8177.2-64.6-73.4000110.2I15 Q34 W35 D37 A40 T42I15-F44 HydrophobicContact CB-CD1 4.43Å; I15-F44 HydrophobicContact CB-CE1 4.41Å; I15-F44 HydrophobicContact CD1-CD1 4.34Å; I15-F44 HydrophobicContact CG1-CD1 3.89Å; I15-F44 HydrophobicContact CG1-CE1 4.17Å; I15-F44 HydrophobicContact CG2-CD1 4.07Å; I15-F44 HydrophobicContact CG2-CD2 4.4Å; I15-F44 HydrophobicContact CG2-CE1 4.17Å; I15-F44 HydrophobicContact CG2-CE2 4.49Å; I15-F44 HydrophobicContact CG2-CG 4.18Å; I15-F44 HydrophobicContact CG2-CZ 4.39Å; Q34-F44 CarbonylContact C-O 3.53Å; Q34-F44 WeakPolarHBondContact CA-O 3.44Å; Q34-F44 VanDerWaalsContact CB-O 3.28Å; Q34-F44 WeakPolarHBondContact CB-O 3.32Å; W35-F44 HydrophobicContact CD2-CB 4Å; W35-F44 AromaticContact CE2-CD2 3.92Å; W35-F44 HydrophobicContact CE3-CB 4.03Å; W35-F44 HydrophobicContact CH2-CB 3.52Å; W35-F44 HydrophobicContact CH2-CG 4.3Å; W35-F44 HydrophobicContact CZ2-CB 3.45Å; W35-F44 VanDerWaalsContact CZ2-CB 3.45Å; W35-F44 AromaticContact CZ2-CD2 3.89Å; W35-F44 HydrophobicContact CZ2-CD2 3.89Å; W35-F44 AromaticContact CZ2-CG 3.87Å; W35-F44 HydrophobicContact CZ2-CG 3.87Å; W35-F44 HydrophobicContact CZ3-CB 3.81Å; W35-F44 PolarHBondContact N-O 3.32Å; W35-F44 AromaticContact NE1-CD2 3.88Å; W35-F44 PolarHBondContact O-N 3.43Å; D37-F44 HydrophobicContact CB-CD2 4.18Å; D37-F44 HydrophobicContact CB-CE2 3.93Å; A40-F44 HydrophobicContact CB-CE2 4.24Å; A40-F44 HydrophobicContact CB-CZ 4.42Å; T42-F44 HydrophobicContact CG2-CD1 4.19Å; T42-F44 HydrophobicContact CG2-CE1 3.86Å; T42-F44 HydrophobicContact CG2-CE2 4.23Å; T42-F44 HydrophobicContact CG2-CZ 3.88Å
45G96.4Very high95.5Very high37 Ų3768 Ų6838%0.38140%0.402SS..EExtended strand (participates in β ladder)trans-125.4142.5175.600000111.2G33G33-G45 WeakPolarHBondContact O-CA 3.44Å
46L96.5Very high95.5Very high41 Ų4174.8 Ų74.822%0.21543%0.431CS..EExtended strand (participates in β ladder)trans-128.4127.2177.6-69.1175.4000110.4I15 F32 G33 W35 F48 F57I15-L46 HydrophobicContact CD1-CD2 3.84Å; F32-L46 WeakPolarHBondContact CA-O 3.44Å; F32-L46 WeakPolarHBondContact CD2-O 3.35Å; G33-L46 PolarHBondContact N-O 3.34Å; G33-L46 VanDerWaalsContact N-O 3.09Å; G33-L46 PolarHBondContact O-N 2.86Å; W35-L46 HydrophobicContact CH2-CD1 3.94Å; W35-L46 HydrophobicContact CH2-CG 4.2Å; W35-L46 HydrophobicContact CZ3-CD1 3.71Å; W35-L46 HydrophobicContact CZ3-CG 3.85Å; L46-F48 HydrophobicContact CB-CE2 3.71Å; L46-F48 HydrophobicContact CB-CZ 3.83Å; L46-F48 HydrophobicContact CD1-CZ 4.19Å; L46-F48 WeakPolarHBondContact O-CE2 3.43Å; L46-F57 HydrophobicContact CD1-CE1 4.02Å; L46-F57 HydrophobicContact CD1-CE2 3.98Å; L46-F57 HydrophobicContact CD1-CZ 3.61Å
47G96.9Very high95.6Very high61 Ų6174.3 Ų74.363%0.62942%0.419SS*.EExtended strand (participates in β ladder)trans-96138167.800000110.9K31K31-G47 CarbonylContact O-C 3.53Å; K31-G47 WeakPolarHBondContact O-CA 3.49Å
48F97.1Very high95.7Very high40 Ų4075.1 Ų75.118%0.17543%0.427CS..  trans-115.3157.7-177.1-62.9-91.2000111.3F25 K31 L46 S50 Q53 L54 F57F25-F48 HydrophobicContact CZ-CE2 4.33Å; K31-F48 WeakPolarHBondContact CB-O 3.27Å; K31-F48 PolarHBondContact O-N 2.73Å; L46-F48 HydrophobicContact CB-CE2 3.71Å; L46-F48 HydrophobicContact CB-CZ 3.83Å; L46-F48 HydrophobicContact CD1-CZ 4.19Å; L46-F48 WeakPolarHBondContact O-CE2 3.43Å; F48-S50 VanDerWaalsContact C-N 3.3Å; F48-S50 PolarHBondContact O-N 2.91Å; F48-Q53 HydrophobicContact CB-CB 4.06Å; F48-Q53 HydrophobicContact CD1-CB 3.94Å; F48-Q53 HydrophobicContact CG-CB 4.35Å; F48-L54 HydrophobicContact CB-CB 4.29Å; F48-L54 HydrophobicContact CD2-CB 3.76Å; F48-L54 HydrophobicContact CD2-CD1 3.56Å; F48-L54 HydrophobicContact CD2-CG 4.25Å; F48-L54 HydrophobicContact CE2-CB 4.35Å; F48-L54 HydrophobicContact CE2-CD1 3.48Å; F48-L54 VanDerWaalsContact CE2-CD1 3.48Å; F48-L54 HydrophobicContact CG-CB 4.08Å; F48-L54 HydrophobicContact CZ-CD1 4.49Å; F48-F57 HydrophobicContact CE1-CB 3.65Å; F48-F57 HydrophobicContact CE1-CD2 4.09Å; F48-F57 AromaticContact CE1-CG 3.87Å; F48-F57 HydrophobicContact CE1-CG 3.87Å; F48-F57 HydrophobicContact CZ-CB 3.56Å; F48-F57 AromaticContact CZ-CD1 3.78Å; F48-F57 HydrophobicContact CZ-CD1 3.78Å; F48-F57 AromaticContact CZ-CD2 3.99Å; F48-F57 HydrophobicContact CZ-CD2 3.99Å; F48-F57 HydrophobicContact CZ-CE1 4.49Å; F48-F57 AromaticContact CZ-CG 3.49Å; F48-F57 HydrophobicContact CZ-CG 3.49Å; F48-F57 VanDerWaalsContact CZ-CG 3.49Å
49A96.4Very high96Very high81 Ų8176.4 Ų76.467%0.66942%0.42SS*.SBendtrans-72-26.9177.600000112.2
50S96.8Very high96.3Very high40 Ų4071.7 Ų71.728%0.2841%0.406SS..SBendtrans-144.7158.4179.273.70000113.1F48 Q52 Q53 L54F48-S50 VanDerWaalsContact C-N 3.3Å; F48-S50 PolarHBondContact O-N 2.91Å; S50-Q52 PolarHBondContact O-N 3.21Å; S50-Q53 PolarHBondContact O-N 3.08Å; S50-Q53 PolarHBondContact OG-N 2.84Å; S50-L54 PolarHBondContact O-N 2.71Å
51E97.1Very high96.6Very high75 Ų7570 Ų7035%0.3539%0.39SS..Hα-helixtrans-62.1-30.4175.2-76.5-61.9160.100113.2Q30 K31 L54 S55Q30-E51 WeakPolarHBondContact CA-OE1 3.33Å; Q30-E51 WeakPolarHBondContact CG-OE1 3.21Å; K31-E51 HydrophobicContact CG-CG 4.2Å; K31-E51 PolarHBondContact N-OE1 2.86Å; E51-L54 PolarHBondContact O-N 3.33Å; E51-S55 WeakPolarHBondContact O-CB 3.47Å; E51-S55 PolarHBondContact O-N 3.29Å; E51-S55 PolarHBondContact O-OG 3.49Å
52Q96.9Very high96.7Very high165 Ų16566.6 Ų66.677%0.77137%0.369SS*.Hα-helixtrans-65.8-41.3176-68.3179.7-5.700111.2S50 S55 K56S50-Q52 PolarHBondContact O-N 3.21Å; Q52-S55 PolarHBondContact O-N 3.48Å; Q52-K56 WeakPolarHBondContact O-CB 3.32Å; Q52-K56 PolarHBondContact O-N 3.41Å
53Q96.8Very high96.8Very high100 Ų10068.6 Ų68.647%0.46737%0.374SS..Hα-helixtrans-66.2-42.3176.2-73.4-179.6-12.900111.9F48 S50 S55 K56 F57F48-Q53 HydrophobicContact CB-CB 4.06Å; F48-Q53 HydrophobicContact CD1-CB 3.94Å; F48-Q53 HydrophobicContact CG-CB 4.35Å; S50-Q53 PolarHBondContact O-N 3.08Å; S50-Q53 PolarHBondContact OG-N 2.84Å; Q53-S55 VanDerWaalsContact C-N 3.32Å; Q53-S55 PolarHBondContact O-N 3.38Å; Q53-K56 PolarHBondContact O-N 3.29Å; Q53-F57 WeakPolarHBondContact O-CB 3.33Å; Q53-F57 PolarHBondContact O-N 2.92Å
54L97.8Very high96.7Very high1 Ų166.3 Ų66.31%0.00536%0.36CS..Hα-helixtrans-57.8-45.8173.717364.6000111.3F25 K27 F48 S50 E51 F57 A58F25-L54 HydrophobicContact CE1-CD1 3.79Å; F25-L54 HydrophobicContact CZ-CD1 3.74Å; K27-L54 HydrophobicContact CB-CD2 4.38Å; K27-L54 HydrophobicContact CD-CD2 4Å; K27-L54 HydrophobicContact CD-CG 4.15Å; K27-L54 HydrophobicContact CG-CD1 4.3Å; K27-L54 HydrophobicContact CG-CD2 4.06Å; K27-L54 HydrophobicContact CG-CG 4.19Å; F48-L54 HydrophobicContact CB-CB 4.29Å; F48-L54 HydrophobicContact CD2-CB 3.76Å; F48-L54 HydrophobicContact CD2-CD1 3.56Å; F48-L54 HydrophobicContact CD2-CG 4.25Å; F48-L54 HydrophobicContact CE2-CB 4.35Å; F48-L54 HydrophobicContact CE2-CD1 3.48Å; F48-L54 VanDerWaalsContact CE2-CD1 3.48Å; F48-L54 HydrophobicContact CG-CB 4.08Å; F48-L54 HydrophobicContact CZ-CD1 4.49Å; S50-L54 PolarHBondContact O-N 2.71Å; E51-L54 PolarHBondContact O-N 3.33Å; L54-F57 PolarHBondContact O-N 2.87Å; L54-A58 PolarHBondContact O-N 3.29Å
55S97.3Very high96.5Very high34 Ų3466.3 Ų66.324%0.23836%0.36CS..Hα-helixtrans-66.9-43.9-179-61.30000112.1K27 E51 Q52 Q53 F57 A58 E59K27-S55 PolarHBondContact NZ-OG 3Å; E51-S55 WeakPolarHBondContact O-CB 3.47Å; E51-S55 PolarHBondContact O-N 3.29Å; E51-S55 PolarHBondContact O-OG 3.49Å; Q52-S55 PolarHBondContact O-N 3.48Å; Q53-S55 VanDerWaalsContact C-N 3.32Å; Q53-S55 PolarHBondContact O-N 3.38Å; S55-F57 VanDerWaalsContact C-N 3.31Å; S55-F57 PolarHBondContact O-N 3.25Å; S55-A58 PolarHBondContact O-N 3.41Å; S55-E59 WeakPolarHBondContact O-CG 3.45Å; S55-E59 PolarHBondContact O-N 3.03Å
56K97.5Very high96.4Very high146 Ų14668.5 Ų68.564%0.63536%0.363SS*.Hα-helixtrans-61.2-38.3174.6-172.4175.5-176.1177.20112.5Q52 Q53 K60Q52-K56 WeakPolarHBondContact O-CB 3.32Å; Q52-K56 PolarHBondContact O-N 3.41Å; Q53-K56 PolarHBondContact O-N 3.29Å; K56-K60 PolarHBondContact O-N 3.4Å
57F97.6Very high96.2Very high43 Ų4368 Ų6819%0.18937%0.365CS..Hα-helixtrans-66.4-44.4175.4-176-89.5000111.6L5 F25 L46 F48 Q53 L54 S55 E59 K60 F61L5-F57 HydrophobicContact CD1-CZ 4.05Å; L5-F57 HydrophobicContact CD2-CE2 4.07Å; L5-F57 HydrophobicContact CD2-CZ 3.96Å; F25-F57 HydrophobicContact CD2-CD1 4.25Å; F25-F57 AromaticContact CD2-CE1 3.87Å; F25-F57 HydrophobicContact CD2-CE1 3.87Å; F25-F57 HydrophobicContact CE1-CD1 4.14Å; F25-F57 AromaticContact CE2-CD1 3.81Å; F25-F57 HydrophobicContact CE2-CD1 3.81Å; F25-F57 AromaticContact CE2-CE1 3.62Å; F25-F57 HydrophobicContact CE2-CE1 3.62Å; F25-F57 AromaticContact CZ-CD1 3.74Å; F25-F57 HydrophobicContact CZ-CD1 3.74Å; F25-F57 HydrophobicContact CZ-CE1 4.06Å; L46-F57 HydrophobicContact CD1-CE1 4.02Å; L46-F57 HydrophobicContact CD1-CE2 3.98Å; L46-F57 HydrophobicContact CD1-CZ 3.61Å; F48-F57 HydrophobicContact CE1-CB 3.65Å; F48-F57 HydrophobicContact CE1-CD2 4.09Å; F48-F57 AromaticContact CE1-CG 3.87Å; F48-F57 HydrophobicContact CE1-CG 3.87Å; F48-F57 HydrophobicContact CZ-CB 3.56Å; F48-F57 AromaticContact CZ-CD1 3.78Å; F48-F57 HydrophobicContact CZ-CD1 3.78Å; F48-F57 AromaticContact CZ-CD2 3.99Å; F48-F57 HydrophobicContact CZ-CD2 3.99Å; F48-F57 HydrophobicContact CZ-CE1 4.49Å; F48-F57 AromaticContact CZ-CG 3.49Å; F48-F57 HydrophobicContact CZ-CG 3.49Å; F48-F57 VanDerWaalsContact CZ-CG 3.49Å; Q53-F57 WeakPolarHBondContact O-CB 3.33Å; Q53-F57 PolarHBondContact O-N 2.92Å; L54-F57 PolarHBondContact O-N 2.87Å; S55-F57 VanDerWaalsContact C-N 3.31Å; S55-F57 PolarHBondContact O-N 3.25Å; F57-E59 VanDerWaalsContact C-N 3.3Å; F57-E59 PolarHBondContact O-N 3.28Å; F57-K60 PolarHBondContact O-N 2.85Å; F57-F61 HydrophobicContact CE1-CB 4.46Å; F57-F61 AromaticContact CE1-CD2 3.95Å; F57-F61 HydrophobicContact CE1-CD2 3.95Å; F57-F61 HydrophobicContact CZ-CD2 4.28Å; F57-F61 WeakPolarHBondContact O-CB 3.45Å; F57-F61 PolarHBondContact O-N 3.43Å
58A97.4Very high95.9Very high22 Ų2265.5 Ų65.518%0.18234%0.338CS..Hα-helixtrans-58.8-42.2177.500000112F25 L54 S55 F61 Q62F25-A58 HydrophobicContact CD1-CB 3.7Å; F25-A58 HydrophobicContact CE1-CB 3.86Å; L54-A58 PolarHBondContact O-N 3.29Å; S55-A58 PolarHBondContact O-N 3.41Å; A58-F61 PolarHBondContact O-N 2.96Å; A58-Q62 PolarHBondContact O-N 3.42Å; A58-Q62 VanDerWaalsContact O-N 3.08Å
59E97.1Very high95.5Very high136 Ų13669 Ų6964%0.63635%0.353SS*.Hα-helixtrans-62.5-47.5174.7-71.7168-165.300111.8S55 F57 F61 Q62 E63S55-E59 WeakPolarHBondContact O-CG 3.45Å; S55-E59 PolarHBondContact O-N 3.03Å; F57-E59 VanDerWaalsContact C-N 3.3Å; F57-E59 PolarHBondContact O-N 3.28Å; E59-F61 VanDerWaalsContact C-N 3.31Å; E59-F61 PolarHBondContact O-N 2.85Å; E59-Q62 WeakPolarHBondContact O-CB 3.44Å; E59-Q62 PolarHBondContact O-N 2.81Å; E59-Q62 VanDerWaalsContact O-N 3.17Å; E59-E63 PolarHBondContact O-N 3.24Å
60K96.6Very high95.1Very high104 Ų10469.7 Ų69.745%0.45235%0.346SS..Hα-helixtrans-64.1-36.1177.3-80.9-70.7174.3-160.40112.8K56 F57 Q62 E63 V64K56-K60 PolarHBondContact O-N 3.4Å; F57-K60 PolarHBondContact O-N 2.85Å; K60-Q62 VanDerWaalsContact C-N 3.31Å; K60-E63 WeakPolarHBondContact CD-OE2 3.47Å; K60-E63 WeakPolarHBondContact CE-OE2 3.43Å; K60-E63 IonicContact NZ-OE1 2.69Å; K60-E63 PolarHBondContact NZ-OE1 3.4Å; K60-E63 IonicContact NZ-OE2 3.37Å; K60-E63 PolarHBondContact NZ-OE2 3.39Å; K60-E63 PolarHBondContact O-N 2.93Å; K60-V64 VanDerWaalsContact O-CG2 3.31Å; K60-V64 WeakPolarHBondContact O-CG2 3.33Å; K60-V64 PolarHBondContact O-N 3Å
61F96.4Very high94.6Very high8 Ų868.4 Ų68.44%0.03534%0.337CS..Hα-helixtrans-61.6-43.3174.4-166.4-76.6000110.8L5 I19 M23 F25 W35 F57 A58 E59 V64 K65L5-F61 HydrophobicContact CD1-CD2 3.81Å; L5-F61 HydrophobicContact CD1-CE2 3.56Å; I19-F61 HydrophobicContact CD1-CD2 4.28Å; I19-F61 HydrophobicContact CD1-CE1 4.47Å; I19-F61 HydrophobicContact CD1-CE2 3.54Å; I19-F61 HydrophobicContact CD1-CZ 3.65Å; M23-F61 HydrophobicContact CB-CE1 4.13Å; M23-F61 HydrophobicContact CB-CZ 4.14Å; F25-F61 HydrophobicContact CB-CB 4.3Å; F25-F61 HydrophobicContact CB-CD1 3.75Å; F25-F61 HydrophobicContact CB-CD2 4.15Å; F25-F61 HydrophobicContact CB-CE1 4.06Å; F25-F61 HydrophobicContact CB-CE2 4.42Å; F25-F61 HydrophobicContact CB-CG 3.8Å; F25-F61 HydrophobicContact CB-CZ 4.38Å; F25-F61 HydrophobicContact CD2-CD2 4.4Å; F25-F61 HydrophobicContact CG-CG 4.44Å; W35-F61 HydrophobicContact CB-CE2 4.36Å; W35-F61 HydrophobicContact CB-CZ 4.09Å; W35-F61 AromaticContact CD2-CE2 3.98Å; W35-F61 HydrophobicContact CD2-CE2 3.98Å; W35-F61 HydrophobicContact CD2-CZ 4.48Å; W35-F61 HydrophobicContact CE3-CE2 4.49Å; W35-F61 AromaticContact CG-CE2 3.91Å; W35-F61 HydrophobicContact CG-CE2 3.91Å; W35-F61 AromaticContact CG-CZ 3.93Å; W35-F61 HydrophobicContact CG-CZ 3.93Å; F57-F61 HydrophobicContact CE1-CB 4.46Å; F57-F61 AromaticContact CE1-CD2 3.95Å; F57-F61 HydrophobicContact CE1-CD2 3.95Å; F57-F61 HydrophobicContact CZ-CD2 4.28Å; F57-F61 WeakPolarHBondContact O-CB 3.45Å; F57-F61 PolarHBondContact O-N 3.43Å; A58-F61 PolarHBondContact O-N 2.96Å; E59-F61 VanDerWaalsContact C-N 3.31Å; E59-F61 PolarHBondContact O-N 2.85Å; F61-V64 PolarHBondContact O-N 2.87Å; F61-K65 WeakPolarHBondContact O-CB 3.34Å; F61-K65 PolarHBondContact O-N 3.23Å
62Q95.7Very high94Very high78 Ų7870.6 Ų70.636%0.36435%0.346SS..Hα-helixtrans-64.3-44.7176.3-176.15751.700111.8A58 E59 K60 V64 K65 D66A58-Q62 PolarHBondContact O-N 3.42Å; A58-Q62 VanDerWaalsContact O-N 3.08Å; E59-Q62 WeakPolarHBondContact O-CB 3.44Å; E59-Q62 PolarHBondContact O-N 2.81Å; E59-Q62 VanDerWaalsContact O-N 3.17Å; K60-Q62 VanDerWaalsContact C-N 3.31Å; Q62-V64 PolarHBondContact O-N 2.94Å; Q62-K65 VanDerWaalsContact CD-CE 3.48Å; Q62-K65 WeakPolarHBondContact O-CB 3.39Å; Q62-K65 PolarHBondContact O-N 3.3Å; Q62-D66 VanDerWaalsContact NE2-CG 3.26Å; Q62-D66 PolarHBondContact NE2-OD1 2.99Å; Q62-D66 PolarHBondContact NE2-OD2 2.89Å; Q62-D66 PolarHBondContact O-N 3.31Å
63E94.9Very high93.3Very high107 Ų10766.7 Ų66.750%0.533%0.33SS..Hα-helixtrans-58.1-46.3176.1-175.9-174146.200112.2E59 K60 K65 D66 A67E59-E63 PolarHBondContact O-N 3.24Å; K60-E63 WeakPolarHBondContact CD-OE2 3.47Å; K60-E63 WeakPolarHBondContact CE-OE2 3.43Å; K60-E63 IonicContact NZ-OE1 2.69Å; K60-E63 PolarHBondContact NZ-OE1 3.4Å; K60-E63 IonicContact NZ-OE2 3.37Å; K60-E63 PolarHBondContact NZ-OE2 3.39Å; K60-E63 PolarHBondContact O-N 2.93Å; E63-K65 VanDerWaalsContact C-N 3.34Å; E63-K65 PolarHBondContact O-N 3.44Å; E63-D66 PolarHBondContact O-N 3.32Å; E63-A67 WeakPolarHBondContact O-CB 3.47Å; E63-A67 PolarHBondContact O-N 3.31Å
64V94.6Very high92.5Very high43 Ų4368 Ų6826%0.26133%0.334SS..Hα-helixtrans-67.5-35.9178.31740000111.4Y3 I19 K60 F61 Q62 A67 A68Y3-V64 HydrophobicContact CD1-CG1 4.08Å; Y3-V64 HydrophobicContact CD2-CG1 4.4Å; Y3-V64 HydrophobicContact CG-CG1 3.72Å; I19-V64 HydrophobicContact CB-CG1 4.14Å; I19-V64 HydrophobicContact CG1-CG1 4.03Å; I19-V64 HydrophobicContact CG2-CG1 4.14Å; K60-V64 VanDerWaalsContact O-CG2 3.31Å; K60-V64 WeakPolarHBondContact O-CG2 3.33Å; K60-V64 PolarHBondContact O-N 3Å; F61-V64 PolarHBondContact O-N 2.87Å; Q62-V64 PolarHBondContact O-N 2.94Å; V64-A67 PolarHBondContact O-N 3.38Å; V64-A68 VanDerWaalsContact O-CB 3.32Å; V64-A68 WeakPolarHBondContact O-CB 3.46Å; V64-A68 PolarHBondContact O-N 2.92Å
65K93.9Very high91Very high31 Ų3171.4 Ų71.414%0.13536%0.358CS..Hα-helixtrans-63-43.4174.6-173.6-177.971.1177.50111.5I19 P21 M23 F61 Q62 E63 A68 K69I19-K65 HydrophobicContact CG2-CB 4.21Å; P21-K65 WeakPolarHBondContact O-CD 3.25Å; M23-K65 WeakPolarHBondContact O-CD 3.38Å; F61-K65 WeakPolarHBondContact O-CB 3.34Å; F61-K65 PolarHBondContact O-N 3.23Å; Q62-K65 VanDerWaalsContact CD-CE 3.48Å; Q62-K65 WeakPolarHBondContact O-CB 3.39Å; Q62-K65 PolarHBondContact O-N 3.3Å; E63-K65 VanDerWaalsContact C-N 3.34Å; E63-K65 PolarHBondContact O-N 3.44Å; K65-A68 PolarHBondContact O-N 3.4Å; K65-K69 PolarHBondContact O-N 3.38Å
66D93.4Very high89.3Confident83 Ų8375.9 Ų75.944%0.44438%0.375SS..Hα-helixtrans-68.1-38.6177.7-66-28.4000111.3Q62 E63 K69 L70Q62-D66 VanDerWaalsContact NE2-CG 3.26Å; Q62-D66 PolarHBondContact NE2-OD1 2.99Å; Q62-D66 PolarHBondContact NE2-OD2 2.89Å; Q62-D66 PolarHBondContact O-N 3.31Å; E63-D66 PolarHBondContact O-N 3.32Å; D66-K69 WeakPolarHBondContact O-CB 3.48Å; D66-K69 PolarHBondContact O-N 3.48Å; D66-L70 PolarHBondContact O-N 3.22Å
67A91.6Very high87.2Confident30 Ų3076.8 Ų76.825%0.24838%0.381CS..Hα-helixtrans-63.6-40.5171.900000112.4Y3 E63 V64 K69 L70 A71Y3-A67 HydrophobicContact CE2-CB 3.81Å; E63-A67 WeakPolarHBondContact O-CB 3.47Å; E63-A67 PolarHBondContact O-N 3.31Å; V64-A67 PolarHBondContact O-N 3.38Å; A67-K69 VanDerWaalsContact C-N 3.33Å; A67-L70 PolarHBondContact O-N 3.18Å; A67-A71 WeakPolarHBondContact O-CB 3.48Å; A67-A71 PolarHBondContact O-N 2.93Å
68A90.3Very high85Confident8 Ų883.3 Ų83.37%0.06641%0.41CS..Hα-helixtrans-65.1-37175.700000112Y3 V64 K65 K72Y3-A68 HydrophobicContact CD2-CB 3.92Å; V64-A68 VanDerWaalsContact O-CB 3.32Å; V64-A68 WeakPolarHBondContact O-CB 3.46Å; V64-A68 PolarHBondContact O-N 2.92Å; K65-A68 PolarHBondContact O-N 3.4Å; A68-K72 WeakPolarHBondContact O-CB 3.45Å; A68-K72 PolarHBondContact O-N 3.05Å
69K90.3Very high82.6Confident113 Ų11384.7 Ų84.749%0.49143%0.426SS..Hα-helixtrans-62.4-51.1172.9-173.1-177.2174.9-1730110.7P21 K65 D66 A67 A71 K72 D73P21-K69 HydrophobicContact CB-CB 4.03Å; P21-K69 HydrophobicContact CB-CG 4.28Å; P21-K69 HydrophobicContact CG-CB 3.96Å; P21-K69 HydrophobicContact CG-CG 4.41Å; K65-K69 PolarHBondContact O-N 3.38Å; D66-K69 WeakPolarHBondContact O-CB 3.48Å; D66-K69 PolarHBondContact O-N 3.48Å; A67-K69 VanDerWaalsContact C-N 3.33Å; K69-A71 VanDerWaalsContact C-N 3.32Å; K69-A71 PolarHBondContact O-N 2.93Å; K69-K72 WeakPolarHBondContact O-CB 3.35Å; K69-K72 PolarHBondContact O-N 2.96Å; K69-K72 VanDerWaalsContact O-N 3.14Å; K69-D73 VanDerWaalsContact O-CG 3.28Å; K69-D73 PolarHBondContact O-N 3.08Å
70L88.3Confident79.9Confident97 Ų9785.5 Ų85.551%0.50844%0.435SS..Hα-helixtrans-61.7-38.8179.3-171.966.9000112.6D66 A67 D73 K74D66-L70 PolarHBondContact O-N 3.22Å; A67-L70 PolarHBondContact O-N 3.18Å; L70-D73 PolarHBondContact O-N 3.36Å; L70-K74 WeakPolarHBondContact O-CB 3.45Å; L70-K74 WeakPolarHBondContact O-CG 3.5Å; L70-K74 PolarHBondContact O-N 3Å
71A85.6Confident77.4Confident13 Ų1386.2 Ų86.211%0.10745%0.448CS..Hα-helixtrans-65.6-38.9176.200000112D1 A67 K69 S75D1-A71 HydrophobicContact CB-CB 4.47Å; A67-A71 WeakPolarHBondContact O-CB 3.48Å; A67-A71 PolarHBondContact O-N 2.93Å; K69-A71 VanDerWaalsContact C-N 3.32Å; K69-A71 PolarHBondContact O-N 2.93Å; A71-S75 WeakPolarHBondContact O-CB 3.39Å; A71-S75 PolarHBondContact O-N 3.39Å; A71-S75 VanDerWaalsContact O-N 3.07Å; A71-S75 PolarHBondContact O-OG 3.44Å; A71-S75 VanDerWaalsContact O-OG 3.13Å
72K84Confident74.9Confident121 Ų12193.8 Ų93.853%0.52649%0.488SS..Hα-helixtrans-65.6-45.9175.2-170.5-173.9174.7-168.20111.2A68 K69 K74 S75 Q76A68-K72 WeakPolarHBondContact O-CB 3.45Å; A68-K72 PolarHBondContact O-N 3.05Å; K69-K72 WeakPolarHBondContact O-CB 3.35Å; K69-K72 PolarHBondContact O-N 2.96Å; K69-K72 VanDerWaalsContact O-N 3.14Å; K72-K74 VanDerWaalsContact C-N 3.34Å; K72-K74 PolarHBondContact O-N 3.24Å; K72-S75 PolarHBondContact O-N 3.46Å; K72-Q76 PolarHBondContact O-N 3.32Å
73D82Confident72.1Confident82 Ų8295.7 Ų95.744%0.43951%0.51SS..Hα-helixtrans-61.2-42.9179.5-64.2-15.6000110.9K69 L70 S75 Q76 E77K69-D73 VanDerWaalsContact O-CG 3.28Å; K69-D73 PolarHBondContact O-N 3.08Å; L70-D73 PolarHBondContact O-N 3.36Å; D73-S75 PolarHBondContact O-N 2.96Å; D73-Q76 PolarHBondContact O-N 3.48Å; D73-E77 PolarHBondContact O-N 3.46Å
74K79.4Confident69.3Low129 Ų12998.5 Ų98.556%0.56153%0.529SS*.Hα-helixtrans-65.5-33.5174.6-76-178.9178.9-177.50114.5L70 K72L70-K74 WeakPolarHBondContact O-CB 3.45Å; L70-K74 WeakPolarHBondContact O-CG 3.5Å; L70-K74 PolarHBondContact O-N 3Å; K72-K74 VanDerWaalsContact C-N 3.34Å; K72-K74 PolarHBondContact O-N 3.24Å
75S67.8Low66.5Low71 Ų71104.9 Ų104.950%0.49756%0.555SS.*Hα-helixtrans-76.6-27.9177.5-67.80000112.2A71 K72 D73A71-S75 WeakPolarHBondContact O-CB 3.39Å; A71-S75 PolarHBondContact O-N 3.39Å; A71-S75 VanDerWaalsContact O-N 3.07Å; A71-S75 PolarHBondContact O-OG 3.44Å; A71-S75 VanDerWaalsContact O-OG 3.13Å; K72-S75 PolarHBondContact O-N 3.46Å; D73-S75 PolarHBondContact O-N 2.96Å
76Q60.5Low63.8Low128 Ų128106.8 Ų106.860%0.59857%0.572SS**Hα-helixtrans-76.3-34.3178.3-158.5161.4-33.800111.9K72 D73 K78 G79K72-Q76 PolarHBondContact O-N 3.32Å; D73-Q76 PolarHBondContact O-N 3.48Å; Q76-K78 VanDerWaalsContact C-N 3.27Å; Q76-K78 PolarHBondContact O-N 2.95Å; Q76-G79 PolarHBondContact O-N 3.03Å
77E54.8Low61.2Low165 Ų165110.8 Ų110.877%0.77159%0.588SS**Hα-helixtrans-64.1-24.9171.4-94.4-172154.200114.3D73D73-E77 PolarHBondContact O-N 3.46Å
78K50.3Low58.6Low181 Ų181117.5 Ų117.579%0.78762%0.615SS**THydrogen-bonded Turntrans-87.4-9.3178.5-81-173.4174.4-176.10114.5Q76Q76-K78 VanDerWaalsContact C-N 3.27Å; Q76-K78 PolarHBondContact O-N 2.95Å
79G46.1Very low55.8Low51 Ų51126 Ų12653%0.52665%0.653SS.*THydrogen-bonded Turntrans-84-21.1-173.900000115Q76 T81Q76-G79 PolarHBondContact O-N 3.03Å; G79-T81 VanDerWaalsContact C-N 3.29Å; G79-T81 PolarHBondContact O-N 3.18Å
80D42Very low53Low153 Ų153126.1 Ų126.182%0.81867%0.668SS**THydrogen-bonded Turntrans-85.811.2-171.4-70.5-24.8000114.3
81T44Very low50.4Low119 Ų119124.7 Ų124.773%0.7368%0.677SS**THydrogen-bonded Turntrans-117.4-3.3-175.6-25.70000115.7G79G79-T81 VanDerWaalsContact C-N 3.29Å; G79-T81 PolarHBondContact O-N 3.18Å
82L44.2Very low48Very low167 Ų167134.4 Ų134.487%0.87471%0.711SS**  trans-141.582.9-175.8-73.5165.3000111.9
83S35.3Very low45.6Very low118 Ų118136 Ų13683%0.82572%0.72SS**  trans-143.896.4160.8-171.30000110.2
84N36.3Very low43.4Very low166 Ų166138.5 Ų138.589%0.88874%0.738SS**  trans-171.3113.3150.2-120.4-1.3000108.6
85H36.5Very low41.7Very low176 Ų176138 Ų13882%0.81575%0.749SS**  trans167.6111.3132.5-156.962.1000112.7
86S37.1Very low40.1Very low72 Ų72140.1 Ų140.150%0.50376%0.763SS.*  trans40122.8133.1-52.50000121.9
87Q39.7Very low38.7Very low166 Ų166139 Ų13978%0.77678%0.776SS**  105.3120.191.9-84.1177.9-14.300111.2
88Q35.7Very low37.7Very low171 Ų171137.9 Ų137.980%0.79978%0.775SS**  66.3121.993.8-149.7166.310.800111.5
89E32.3Very low36.9Very low186 Ų186137.8 Ų137.887%0.86978%0.778SS**  -179148.675.7-167.6171.1-168.200111
90S31.7Very low36.1Very low116 Ų116140.1 Ų140.181%0.81179%0.792SS**  trans-110.9135.9179-178.50000108.7
91G34.1Very low35.6Very low67 Ų67141.1 Ų141.169%0.69179%0.792SS**  trans-84.5173.7-171.500000116.3
92R35.2Very low35Very low217 Ų217141.3 Ų141.382%0.81980%0.798SS**  trans175.4134.8133.5-104.3-176.5156.2149.4-1.7112.8
93E33.3Very low34.5Very low154 Ų154142.1 Ų142.172%0.7280%0.795SS**  trans63.6112.6132.1-66.1168-161.500121.6
94T34Very low34.4Very low135 Ų135144.8 Ų144.883%0.82880%0.8SS**  trans-100.8150.814443.80000109.1
95P44.2Very low34.1Very low120 Ų120139.6 Ų139.678%0.77979%0.786SS**  -150.8145.792.133.5-13.1000117.8
96S35.2Very low34Very low115 Ų115137.8 Ų137.880%0.80479%0.787SS**  47.6122129.8-136.20000122.1
97A31.6Very low34Very low105 Ų105141.4 Ų141.487%0.86880%0.801SS**  trans-146126.7147.900000110.1
98N32.7Very low33.8Very low141 Ų141140.2 Ų140.275%0.75480%0.8SS**  trans-111.3144.8-173.6-126.1-7000109.9
99Q33.4Very low34.1Very low178 Ų178140.1 Ų140.183%0.83280%0.799SS**  trans75.7114.5154.3-63.4-177.815.600120.7
100A29.3Very low34.2Very low100 Ų100141.3 Ų141.383%0.82680%0.802SS**  trans-123.2124.2147.100000108.1
101Q32.6Very low34.8Very low175 Ų175143.5 Ų143.582%0.81880%0.803SS**  trans-135.1128.3159.6-75-161.7-46.200108.4
102S31.2Very low34.8Very low123 Ų123144.9 Ų144.986%0.8680%0.802SS**  trans-129.2123.1170.9-1730000106.3
103F32.6Very low34.7Very low183 Ų183144 Ų14480%0.80380%0.804SS**  trans-121.9135.3175.3-97.1-89.3000107.7
104N34.1Very low35.7Very low174 Ų174141.6 Ų141.693%0.9381%0.805SS**  trans-149.9151.6162.5-158.430.9000111.9
105G29.6Very low36.4Very low58 Ų58139 Ų13960%0.59879%0.79SS**  trans110.5133.6176.200000111.8
106T35Very low37Very low137 Ų137139.9 Ų139.984%0.8478%0.784SS**  cis-170.7124.710.325.10000104.8
107D36.3Very low38.2Very low148 Ų148138.2 Ų138.279%0.79178%0.777SS**  45.5114.4109.9-152.826.7000117
108D34.9Very low39.8Very low142 Ų142136.4 Ų136.476%0.75976%0.762SS**  163.8150.6109.6-146.5-6.5000112.8
109E42Very low41.7Very low168 Ų168135.9 Ų135.979%0.78576%0.755SS**  trans-71.5148.7-161.3-61.5178.7136.600117.6
110K34.6Very low43.6Very low212 Ų212132.6 Ų132.692%0.92274%0.742SS**  trans-163.7122.7133.6-124.1177.2-175.9179.60114.2
111I44.7Very low45.9Very low161 Ų161135 Ų13583%0.82673%0.734SS**  trans-72.2126174-62.4160.3000109.9
112S33.8Very low48.1Very low97 Ų97130.2 Ų130.268%0.67872%0.72SS**  trans-169.7102.7150.61770000112
113F34.2Very low50.5Low198 Ų198128 Ų12887%0.86870%0.696SS**SBendtrans5594.6146.7-64.3-86.7000119.9
114S53.1Low52.9Low104 Ų104124.5 Ų124.573%0.72769%0.686SS**  trans59.195.9153.4-156.70000121
115P49.7Very low55.3Low81 Ų81121.4 Ų121.453%0.52667%0.666SS.*  trans-115.92216741-28.7000113.3A117 A118 Q119P115-A117 PolarHBondContact O-N 3.07Å; P115-A117 VanDerWaalsContact O-N 3.16Å; P115-A118 PolarHBondContact O-N 3.44Å; P115-Q119 WeakPolarHBondContact O-CB 3.27Å; P115-Q119 PolarHBondContact O-N 3.36Å
116E55.7Low58.2Low137 Ų137124.4 Ų124.464%0.6466%0.659SS**Hα-helixtrans-57.4-37.7-170.6-150.4165.3-155.200111.7L120E116-L120 HydrophobicContact CG-CD1 4.28Å; E116-L120 WeakPolarHBondContact O-CB 3.25Å; E116-L120 VanDerWaalsContact O-CD1 3.3Å; E116-L120 WeakPolarHBondContact O-CD1 3.18Å; E116-L120 WeakPolarHBondContact O-CG 3.22Å; E116-L120 PolarHBondContact O-N 3.06Å
117A60.6Low60.7Low81 Ų81121.8 Ų121.867%0.66964%0.64SS**Hα-helixtrans-69.5-35.717600000114.4P115 K121P115-A117 PolarHBondContact O-N 3.07Å; P115-A117 VanDerWaalsContact O-N 3.16Å; A117-K121 VanDerWaalsContact O-CB 3.25Å; A117-K121 WeakPolarHBondContact O-CB 3.48Å; A117-K121 PolarHBondContact O-N 3.14Å
118A66.6Low63.3Low66 Ų66120.4 Ų120.455%0.54563%0.627SS.*Hα-helixtrans-77-37.8178.900000111.3P115 K121 S122P115-A118 PolarHBondContact O-N 3.44Å; A118-K121 PolarHBondContact O-N 3.05Å; A118-S122 PolarHBondContact O-N 3.13Å
119Q71.3Confident65.8Low131 Ų131116.9 Ų116.961%0.61261%0.613SS**Hα-helixtrans-67.2-46.2174.7-157.7172.8-12.400110.8P115 K121 S122 E123P115-Q119 WeakPolarHBondContact O-CB 3.27Å; P115-Q119 PolarHBondContact O-N 3.36Å; Q119-K121 VanDerWaalsContact C-N 3.28Å; Q119-K121 PolarHBondContact O-N 3.04Å; Q119-S122 PolarHBondContact O-N 3.26Å; Q119-S122 PolarHBondContact O-OG 3.38Å; Q119-S122 VanDerWaalsContact O-OG 3.05Å; Q119-E123 VanDerWaalsContact O-CB 3.32Å; Q119-E123 WeakPolarHBondContact O-CB 3.36Å; Q119-E123 PolarHBondContact O-N 3.36Å
120L74.4Confident68.1Low108 Ų108112.2 Ų112.257%0.56560%0.596SS**Hα-helixtrans-60-34.6171.9-76.4165.9000112.6E116 N124E116-L120 HydrophobicContact CG-CD1 4.28Å; E116-L120 WeakPolarHBondContact O-CB 3.25Å; E116-L120 VanDerWaalsContact O-CD1 3.3Å; E116-L120 WeakPolarHBondContact O-CD1 3.18Å; E116-L120 WeakPolarHBondContact O-CG 3.22Å; E116-L120 PolarHBondContact O-N 3.06Å; L120-N124 WeakPolarHBondContact O-CB 3.39Å; L120-N124 PolarHBondContact O-N 2.84Å
121K77.7Confident70.7Confident150 Ų150106.6 Ų106.665%0.65258%0.579SS**Hα-helixtrans-70.6-42.7177-169.9177.4-178.1-176.80112.3A117 A118 Q119 E123 N124 E125A117-K121 VanDerWaalsContact O-CB 3.25Å; A117-K121 WeakPolarHBondContact O-CB 3.48Å; A117-K121 PolarHBondContact O-N 3.14Å; A118-K121 PolarHBondContact O-N 3.05Å; Q119-K121 VanDerWaalsContact C-N 3.28Å; Q119-K121 PolarHBondContact O-N 3.04Å; K121-E123 VanDerWaalsContact C-N 3.3Å; K121-N124 PolarHBondContact O-N 2.58Å; K121-E125 PolarHBondContact O-N 3.07Å
122S78.2Confident72.9Confident75 Ų75104.9 Ų104.952%0.52457%0.568SS.*Hα-helixtrans-65.4-37.3174.483.70000111.7A118 Q119 E125 R126A118-S122 PolarHBondContact O-N 3.13Å; Q119-S122 PolarHBondContact O-N 3.26Å; Q119-S122 PolarHBondContact O-OG 3.38Å; Q119-S122 VanDerWaalsContact O-OG 3.05Å; S122-E125 PolarHBondContact O-N 3.15Å; S122-R126 WeakPolarHBondContact O-CB 3.36Å; S122-R126 PolarHBondContact O-N 3.32Å
123E82.7Confident75.7Confident76 Ų76106.2 Ų106.236%0.35556%0.563SS.*Hα-helixtrans-68.8-37.3176.2-176.165.7177.500111.3Q119 K121 R126 L127Q119-E123 VanDerWaalsContact O-CB 3.32Å; Q119-E123 WeakPolarHBondContact O-CB 3.36Å; Q119-E123 PolarHBondContact O-N 3.36Å; K121-E123 VanDerWaalsContact C-N 3.3Å; E123-R126 VanDerWaalsContact CD-NH2 3.27Å; E123-R126 PolarHBondContact O-N 2.79Å; E123-R126 IonicContact OE1-CZ 3.58Å; E123-R126 IonicContact OE1-NE 3.7Å; E123-R126 IonicContact OE1-NH2 2.65Å; E123-R126 PolarHBondContact OE1-NH2 3.46Å; E123-R126 IonicContact OE2-CZ 3.44Å; E123-R126 IonicContact OE2-NE 2.76Å; E123-R126 PolarHBondContact OE2-NE 3.24Å; E123-R126 IonicContact OE2-NH2 3.29Å; E123-R126 PolarHBondContact OE2-NH2 2.97Å; E123-L127 HydrophobicContact CG-CD1 4.22Å; E123-L127 WeakPolarHBondContact O-CB 3.41Å; E123-L127 VanDerWaalsContact O-CG 3.25Å; E123-L127 WeakPolarHBondContact O-CG 3.36Å; E123-L127 PolarHBondContact O-N 2.9Å
124N82.1Confident78.4Confident110 Ų110100.4 Ų100.459%0.58855%0.547SS*.Hα-helixtrans-62.1-45.7172.6-123.9-57.6000112L120 K121 L127 K128L120-N124 WeakPolarHBondContact O-CB 3.39Å; L120-N124 PolarHBondContact O-N 2.84Å; K121-N124 PolarHBondContact O-N 2.58Å; N124-L127 PolarHBondContact O-N 3.23Å; N124-K128 WeakPolarHBondContact O-CB 3.34Å; N124-K128 PolarHBondContact O-N 2.98Å
125E85.3Confident80.2Confident110 Ų11099.7 Ų99.751%0.51454%0.535SS..Hα-helixtrans-65.9-38.5176.8-76.7-63.8159.300111.9K121 S122 K128 S129K121-E125 PolarHBondContact O-N 3.07Å; S122-E125 PolarHBondContact O-N 3.15Å; E125-K128 PolarHBondContact O-N 3.08Å; E125-S129 WeakPolarHBondContact O-CB 3.5Å; E125-S129 PolarHBondContact O-N 2.82Å
126R90.2Very high82.3Confident121 Ų12199.9 Ų99.946%0.45754%0.535SS..Hα-helixtrans-63.3-47.6173.9-169.3-168.767.772.7-0.8111.5S122 E123 K128 S129 V130S122-R126 WeakPolarHBondContact O-CB 3.36Å; S122-R126 PolarHBondContact O-N 3.32Å; E123-R126 VanDerWaalsContact CD-NH2 3.27Å; E123-R126 PolarHBondContact O-N 2.79Å; E123-R126 IonicContact OE1-CZ 3.58Å; E123-R126 IonicContact OE1-NE 3.7Å; E123-R126 IonicContact OE1-NH2 2.65Å; E123-R126 PolarHBondContact OE1-NH2 3.46Å; E123-R126 IonicContact OE2-CZ 3.44Å; E123-R126 IonicContact OE2-NE 2.76Å; E123-R126 PolarHBondContact OE2-NE 3.24Å; E123-R126 IonicContact OE2-NH2 3.29Å; E123-R126 PolarHBondContact OE2-NH2 2.97Å; R126-K128 VanDerWaalsContact C-N 3.32Å; R126-K128 PolarHBondContact O-N 3.43Å; R126-S129 PolarHBondContact O-N 2.91Å; R126-V130 VanDerWaalsContact O-CG2 3.31Å; R126-V130 WeakPolarHBondContact O-CG2 3.06Å; R126-V130 PolarHBondContact O-N 3.4Å
127L87.6Confident84.1Confident82 Ų8296 Ų9643%0.42952%0.521SS..Hα-helixtrans-62.3-40.7176.6-74.8171.1000111.4E123 N124 V130 V131E123-L127 HydrophobicContact CG-CD1 4.22Å; E123-L127 WeakPolarHBondContact O-CB 3.41Å; E123-L127 VanDerWaalsContact O-CG 3.25Å; E123-L127 WeakPolarHBondContact O-CG 3.36Å; E123-L127 PolarHBondContact O-N 2.9Å; N124-L127 PolarHBondContact O-N 3.23Å; L127-V130 PolarHBondContact O-N 3.44Å; L127-V131 WeakPolarHBondContact O-CB 3.41Å; L127-V131 VanDerWaalsContact O-CG2 3.25Å; L127-V131 WeakPolarHBondContact O-CG2 3.48Å; L127-V131 PolarHBondContact O-N 3.02Å
128K90.1Very high85.7Confident119 Ų11994.6 Ų94.652%0.51751%0.509SS..Hα-helixtrans-62.4-45175.9-168.7179.9177.9-1690111.6N124 E125 R126 V131 E132N124-K128 WeakPolarHBondContact O-CB 3.34Å; N124-K128 PolarHBondContact O-N 2.98Å; E125-K128 PolarHBondContact O-N 3.08Å; R126-K128 VanDerWaalsContact C-N 3.32Å; R126-K128 PolarHBondContact O-N 3.43Å; K128-V131 PolarHBondContact O-N 2.79Å; K128-E132 WeakPolarHBondContact O-CB 3.32Å; K128-E132 PolarHBondContact O-N 3.28Å
129S88.2Confident87.1Confident68 Ų6897.7 Ų97.748%0.47651%0.51SS..Hα-helixtrans-62-42174.4-1790000112.4E125 R126 E132 Q133E125-S129 WeakPolarHBondContact O-CB 3.5Å; E125-S129 PolarHBondContact O-N 2.82Å; R126-S129 PolarHBondContact O-N 2.91Å; S129-E132 PolarHBondContact O-N 2.89Å; S129-Q133 VanDerWaalsContact O-CB 3.31Å; S129-Q133 WeakPolarHBondContact O-CB 3.49Å; S129-Q133 PolarHBondContact O-N 2.94Å
130V90Very high88.3Confident69 Ų6998 Ų9842%0.41851%0.51SS..Hα-helixtrans-64.9-39.3175.1170.90000111.5R126 L127 Q133 S134R126-V130 VanDerWaalsContact O-CG2 3.31Å; R126-V130 WeakPolarHBondContact O-CG2 3.06Å; R126-V130 PolarHBondContact O-N 3.4Å; L127-V130 PolarHBondContact O-N 3.44Å; V130-Q133 PolarHBondContact O-N 2.99Å; V130-S134 VanDerWaalsContact O-CB 3.27Å; V130-S134 WeakPolarHBondContact O-CB 3.26Å; V130-S134 PolarHBondContact O-N 2.95Å
131V89.6Confident89.3Confident95 Ų95100 Ų10058%0.57651%0.511SS*.Hα-helixtrans-65.5-43.2174.8167.90000110.8L127 K128 S134 N135L127-V131 WeakPolarHBondContact O-CB 3.41Å; L127-V131 VanDerWaalsContact O-CG2 3.25Å; L127-V131 WeakPolarHBondContact O-CG2 3.48Å; L127-V131 PolarHBondContact O-N 3.02Å; K128-V131 PolarHBondContact O-N 2.79Å; V131-S134 PolarHBondContact O-N 2.89Å; V131-N135 VanDerWaalsContact O-CB 3.27Å; V131-N135 WeakPolarHBondContact O-CB 3.26Å; V131-N135 PolarHBondContact O-N 3.36Å
132E89.9Confident90.2Very high124 Ų12499.5 Ų99.558%0.57951%0.511SS*.Hα-helixtrans-63.2-41.5175.2-118.2161.4-175.600112K128 S129 N135 T136K128-E132 WeakPolarHBondContact O-CB 3.32Å; K128-E132 PolarHBondContact O-N 3.28Å; S129-E132 PolarHBondContact O-N 2.89Å; E132-N135 PolarHBondContact O-N 2.91Å; E132-T136 WeakPolarHBondContact O-CG2 3.35Å; E132-T136 PolarHBondContact O-N 2.98Å; E132-T136 PolarHBondContact O-OG1 2.84Å
133Q91.8Very high91.1Very high125 Ų125100.2 Ų100.258%0.58451%0.512SS*.Hα-helixtrans-66.3-39.4174.6-169.2173.315.400112S129 V130 N135 T136 T137S129-Q133 VanDerWaalsContact O-CB 3.31Å; S129-Q133 WeakPolarHBondContact O-CB 3.49Å; S129-Q133 PolarHBondContact O-N 2.94Å; V130-Q133 PolarHBondContact O-N 2.99Å; Q133-N135 VanDerWaalsContact C-N 3.35Å; Q133-T136 VanDerWaalsContact CA-OG1 3.29Å; Q133-T136 WeakPolarHBondContact CA-OG1 3.29Å; Q133-T136 PolarHBondContact O-OG1 3.31Å; Q133-T137 WeakPolarHBondContact O-CB 3.28Å; Q133-T137 PolarHBondContact O-N 3.42Å; Q133-T137 PolarHBondContact O-OG1 3.33Å
134S90.9Very high91.7Very high76 Ų76101.2 Ų101.253%0.53152%0.517SS..Hα-helixtrans-64.7-40.5173.7-174.80000111.3V130 V131 T137 A138V130-S134 VanDerWaalsContact O-CB 3.27Å; V130-S134 WeakPolarHBondContact O-CB 3.26Å; V130-S134 PolarHBondContact O-N 2.95Å; V131-S134 PolarHBondContact O-N 2.89Å; S134-T137 PolarHBondContact O-N 2.93Å; S134-A138 WeakPolarHBondContact O-CB 3.13Å; S134-A138 PolarHBondContact O-N 2.93Å
135N92Very high92.5Very high90 Ų90100.6 Ų100.648%0.48151%0.513SS..Hα-helixtrans-71.2-38.5-178.8-155.93.6000111.7V131 E132 Q133 K139V131-N135 VanDerWaalsContact O-CB 3.27Å; V131-N135 WeakPolarHBondContact O-CB 3.26Å; V131-N135 PolarHBondContact O-N 3.36Å; E132-N135 PolarHBondContact O-N 2.91Å; Q133-N135 VanDerWaalsContact C-N 3.35Å; N135-K139 WeakPolarHBondContact O-CG 3.46Å; N135-K139 PolarHBondContact O-N 2.82Å
136T93.3Very high93Very high85 Ų8599.7 Ų99.752%0.52151%0.508SS..Hα-helixtrans-66.4-39.5171.847.70000112.1E132 Q133 K139 K140E132-T136 WeakPolarHBondContact O-CG2 3.35Å; E132-T136 PolarHBondContact O-N 2.98Å; E132-T136 PolarHBondContact O-OG1 2.84Å; Q133-T136 VanDerWaalsContact CA-OG1 3.29Å; Q133-T136 WeakPolarHBondContact CA-OG1 3.29Å; Q133-T136 PolarHBondContact O-OG1 3.31Å; T136-K139 PolarHBondContact O-N 3.31Å; T136-K140 PolarHBondContact O-N 2.95Å
137T92.8Very high93.3Very high56 Ų5698.2 Ų98.234%0.34451%0.513SS..Hα-helixtrans-65.4-43.5175.1-56.70000111.8Q133 S134 K139 K140 Y141Q133-T137 WeakPolarHBondContact O-CB 3.28Å; Q133-T137 PolarHBondContact O-N 3.42Å; Q133-T137 PolarHBondContact O-OG1 3.33Å; S134-T137 PolarHBondContact O-N 2.93Å; T137-K139 PolarHBondContact O-N 3.2Å; T137-K140 WeakPolarHBondContact O-CB 3.31Å; T137-K140 PolarHBondContact O-N 2.97Å; T137-Y141 HydrophobicContact CG2-CD2 4.01Å; T137-Y141 HydrophobicContact CG2-CE2 3.5Å; T137-Y141 VanDerWaalsContact CG2-CE2 3.5Å; T137-Y141 WeakPolarHBondContact O-CD2 3.47Å; T137-Y141 PolarHBondContact O-N 2.91Å; T137-Y141 VanDerWaalsContact O-N 3.08Å
138A95.1Very high93.8Very high51 Ų5199.4 Ų99.442%0.42152%0.52SS..Hα-helixtrans-59.6-45.2174.900000111.8S134 K140 Y141 E142S134-A138 WeakPolarHBondContact O-CB 3.13Å; S134-A138 PolarHBondContact O-N 2.93Å; A138-K140 VanDerWaalsContact C-N 3.33Å; A138-K140 PolarHBondContact O-N 2.77Å; A138-Y141 PolarHBondContact O-N 2.83Å; A138-E142 WeakPolarHBondContact O-CB 3.46Å; A138-E142 PolarHBondContact O-N 3.36Å
139K95.5Very high94.2Very high131 Ų13199.6 Ų99.657%0.5752%0.52SS*.Hα-helixtrans-59.1-41.4174.3-75.9177.6-178.6-178.50112.5N135 T136 T137 E142 T143N135-K139 WeakPolarHBondContact O-CG 3.46Å; N135-K139 PolarHBondContact O-N 2.82Å; T136-K139 PolarHBondContact O-N 3.31Å; T137-K139 PolarHBondContact O-N 3.2Å; K139-E142 PolarHBondContact O-N 3.38Å; K139-T143 WeakPolarHBondContact O-CG2 3.19Å; K139-T143 PolarHBondContact O-N 3.05Å; K139-T143 PolarHBondContact O-OG1 3.23Å
140K96.1Very high94.6Very high138 Ų138100.8 Ų100.860%0.652%0.518SS*.Hα-helixtrans-59.5-49176.4-173.5-174.7175-171.50110.9T136 T137 A138 E142 T143 E144T136-K140 PolarHBondContact O-N 2.95Å; T137-K140 WeakPolarHBondContact O-CB 3.31Å; T137-K140 PolarHBondContact O-N 2.97Å; A138-K140 VanDerWaalsContact C-N 3.33Å; A138-K140 PolarHBondContact O-N 2.77Å; K140-E142 VanDerWaalsContact C-N 3.3Å; K140-E142 PolarHBondContact O-N 2.9Å; K140-T143 PolarHBondContact O-N 2.94Å; K140-T143 PolarHBondContact O-OG1 3.33Å; K140-E144 PolarHBondContact O-N 3.35Å
141Y97.1Very high94.9Very high149 Ų149100.4 Ų100.458%0.58452%0.518SS*.Hα-helixtrans-63.5-36.2177.3-68.5-45.3000112.9T137 A138 E144 L145T137-Y141 HydrophobicContact CG2-CD2 4.01Å; T137-Y141 HydrophobicContact CG2-CE2 3.5Å; T137-Y141 VanDerWaalsContact CG2-CE2 3.5Å; T137-Y141 WeakPolarHBondContact O-CD2 3.47Å; T137-Y141 PolarHBondContact O-N 2.91Å; T137-Y141 VanDerWaalsContact O-N 3.08Å; A138-Y141 PolarHBondContact O-N 2.83Å; Y141-E144 PolarHBondContact O-N 2.98Å; Y141-L145 WeakPolarHBondContact O-CB 3.41Å; Y141-L145 PolarHBondContact O-N 3.1Å
142E96.6Very high95.3Very high139 Ų139100.7 Ų100.765%0.6552%0.517SS*.Hα-helixtrans-65.5-42.4176.3-171.2153.1-149.700112.1A138 K139 K140 E144 L145 Q146A138-E142 WeakPolarHBondContact O-CB 3.46Å; A138-E142 PolarHBondContact O-N 3.36Å; K139-E142 PolarHBondContact O-N 3.38Å; K140-E142 VanDerWaalsContact C-N 3.3Å; K140-E142 PolarHBondContact O-N 2.9Å; E142-E144 PolarHBondContact O-N 3.35Å; E142-L145 PolarHBondContact O-N 3.13Å; E142-Q146 WeakPolarHBondContact O-CB 3.41Å; E142-Q146 PolarHBondContact O-N 3.43Å
143T96Very high95.7Very high90 Ų9097.2 Ų97.255%0.55251%0.509SS*.Hα-helixtrans-64.6-38.1174.155.40000113K139 K140 Q146 T147K139-T143 WeakPolarHBondContact O-CG2 3.19Å; K139-T143 PolarHBondContact O-N 3.05Å; K139-T143 PolarHBondContact O-OG1 3.23Å; K140-T143 PolarHBondContact O-N 2.94Å; K140-T143 PolarHBondContact O-OG1 3.33Å; T143-Q146 PolarHBondContact O-N 2.89Å; T143-T147 WeakPolarHBondContact O-CB 3.23Å; T143-T147 PolarHBondContact O-N 3.12Å; T143-T147 PolarHBondContact O-OG1 2.72Å
144E96.5Very high96Very high98 Ų9899.6 Ų99.646%0.45851%0.513SS..Hα-helixtrans-69.4-42.1178.1-171.7170.4-172.800111.2K140 Y141 E142 Q146 T147 L148K140-E144 PolarHBondContact O-N 3.35Å; Y141-E144 PolarHBondContact O-N 2.98Å; E142-E144 PolarHBondContact O-N 3.35Å; E144-Q146 VanDerWaalsContact C-N 3.29Å; E144-Q146 PolarHBondContact O-N 3.29Å; E144-T147 PolarHBondContact O-N 3.47Å; E144-L148 HydrophobicContact CG-CD1 4.37Å; E144-L148 WeakPolarHBondContact O-CB 3.28Å; E144-L148 WeakPolarHBondContact O-CG 3.49Å; E144-L148 PolarHBondContact O-N 3.49Å
145L97.1Very high96.3Very high97 Ų97101.2 Ų101.251%0.50852%0.515SS..Hα-helixtrans-58.1-43.7172.8-173.780.3000111.1Y141 E142 L148 K149Y141-L145 WeakPolarHBondContact O-CB 3.41Å; Y141-L145 PolarHBondContact O-N 3.1Å; E142-L145 PolarHBondContact O-N 3.13Å; L145-L148 PolarHBondContact O-N 3.44Å; L145-K149 WeakPolarHBondContact O-CG 3.26Å; L145-K149 PolarHBondContact O-N 3.38Å
146Q97.3Very high96.6Very high90 Ų90100.6 Ų100.642%0.42152%0.515SS..Hα-helixtrans-64.9-44.1177.8-175.758.323.900111.7E142 T143 E144 L148 K149 E150E142-Q146 WeakPolarHBondContact O-CB 3.41Å; E142-Q146 PolarHBondContact O-N 3.43Å; T143-Q146 PolarHBondContact O-N 2.89Å; E144-Q146 VanDerWaalsContact C-N 3.29Å; E144-Q146 PolarHBondContact O-N 3.29Å; Q146-L148 VanDerWaalsContact C-N 3.33Å; Q146-L148 PolarHBondContact O-N 3.5Å; Q146-K149 WeakPolarHBondContact O-CB 3.44Å; Q146-K149 PolarHBondContact O-N 3.3Å; Q146-E150 PolarHBondContact NE2-OE1 3.41Å; Q146-E150 WeakPolarHBondContact O-CG 3.38Å; Q146-E150 PolarHBondContact O-N 2.91Å
147T96.7Very high96.8Very high91 Ų91101.4 Ų101.456%0.55852%0.516SS*.Hα-helixtrans-61-42176.1-54.80000111.5T143 E144 E150 S151T143-T147 WeakPolarHBondContact O-CB 3.23Å; T143-T147 PolarHBondContact O-N 3.12Å; T143-T147 PolarHBondContact O-OG1 2.72Å; E144-T147 PolarHBondContact O-N 3.47Å; T147-E150 PolarHBondContact O-N 2.98Å; T147-S151 WeakPolarHBondContact O-CB 3.4Å; T147-S151 PolarHBondContact O-N 2.93Å
148L97.2Very high97Very high107 Ų107102 Ų10256%0.5652%0.522SS*.Hα-helixtrans-65.3-40.5176.1-74.1172000112E144 L145 Q146 S151 N152E144-L148 HydrophobicContact CG-CD1 4.37Å; E144-L148 WeakPolarHBondContact O-CB 3.28Å; E144-L148 WeakPolarHBondContact O-CG 3.49Å; E144-L148 PolarHBondContact O-N 3.49Å; L145-L148 PolarHBondContact O-N 3.44Å; Q146-L148 VanDerWaalsContact C-N 3.33Å; Q146-L148 PolarHBondContact O-N 3.5Å; L148-S151 PolarHBondContact O-N 3.41Å; L148-N152 WeakPolarHBondContact O-CB 3.25Å; L148-N152 PolarHBondContact O-N 2.98Å
149K97.7Very high97.1Very high122 Ų122105.1 Ų105.153%0.5353%0.531SS..Hα-helixtrans-60.8-46.5174.3-77174.1178.2177.70111.5L145 Q146 N152 A153L145-K149 WeakPolarHBondContact O-CG 3.26Å; L145-K149 PolarHBondContact O-N 3.38Å; Q146-K149 WeakPolarHBondContact O-CB 3.44Å; Q146-K149 PolarHBondContact O-N 3.3Å; K149-N152 PolarHBondContact O-N 2.89Å; K149-A153 PolarHBondContact O-N 3.44Å
150E97.3Very high97.2Very high94 Ų94105.4 Ų105.444%0.43953%0.534SS..Hα-helixtrans-64.6-41.7177.3-72.8172.3-161.300112Q146 T147 N152 A153 R154Q146-E150 PolarHBondContact NE2-OE1 3.41Å; Q146-E150 WeakPolarHBondContact O-CG 3.38Å; Q146-E150 PolarHBondContact O-N 2.91Å; T147-E150 PolarHBondContact O-N 2.98Å; E150-N152 VanDerWaalsContact C-N 3.33Å; E150-N152 PolarHBondContact O-N 2.94Å; E150-A153 PolarHBondContact O-N 3.17Å; E150-R154 WeakPolarHBondContact O-CG 3.42Å; E150-R154 PolarHBondContact O-N 3.08Å
151S97.4Very high97.3Very high60 Ų60105 Ų10542%0.4253%0.534SS..Hα-helixtrans-61.5-42.3174.5-174.10000111.7T147 L148 R154 L155T147-S151 WeakPolarHBondContact O-CB 3.4Å; T147-S151 PolarHBondContact O-N 2.93Å; L148-S151 PolarHBondContact O-N 3.41Å; S151-R154 PolarHBondContact O-N 2.82Å; S151-L155 WeakPolarHBondContact O-CG 3.44Å; S151-L155 PolarHBondContact O-N 2.85Å; S151-L155 VanDerWaalsContact O-N 3.08Å
152N97.2Very high97.3Very high101 Ų101100.9 Ų100.954%0.5453%0.528SS..Hα-helixtrans-67.1-40.4179.2-158.53.4000111.3L148 K149 E150 R154 L155 V156L148-N152 WeakPolarHBondContact O-CB 3.25Å; L148-N152 PolarHBondContact O-N 2.98Å; K149-N152 PolarHBondContact O-N 2.89Å; E150-N152 VanDerWaalsContact C-N 3.33Å; E150-N152 PolarHBondContact O-N 2.94Å; N152-R154 PolarHBondContact O-N 3.26Å; N152-L155 PolarHBondContact O-N 3.09Å; N152-V156 WeakPolarHBondContact O-CG2 3.34Å; N152-V156 PolarHBondContact O-N 3.34Å
153A97.8Very high97.3Very high51 Ų5197.3 Ų97.342%0.42152%0.518SS..Hα-helixtrans-57.8-47.1173.100000111.9K149 E150 L155 V156 D157K149-A153 PolarHBondContact O-N 3.44Å; E150-A153 PolarHBondContact O-N 3.17Å; A153-L155 VanDerWaalsContact C-N 3.32Å; A153-L155 PolarHBondContact O-N 2.96Å; A153-V156 PolarHBondContact O-N 2.85Å; A153-D157 PolarHBondContact O-N 3.46Å
154R97.8Very high97.4Very high176 Ų17696 Ų9666%0.66452%0.516SS*.Hα-helixtrans-62.3-36.3176.9-69.2-178.5-170.4-163.54.5113.3E150 S151 N152 S158E150-R154 WeakPolarHBondContact O-CG 3.42Å; E150-R154 PolarHBondContact O-N 3.08Å; S151-R154 PolarHBondContact O-N 2.82Å; N152-R154 PolarHBondContact O-N 3.26Å; R154-S158 WeakPolarHBondContact O-CB 3.49Å; R154-S158 PolarHBondContact O-N 3.23Å; R154-S158 PolarHBondContact O-OG 2.91Å
155L97.9Very high97.5Very high109 Ų10995.2 Ų95.257%0.57152%0.515SS*.Hα-helixtrans-67-40.1175.9-74.6172.4000111.6S151 N152 A153 S158 L159S151-L155 WeakPolarHBondContact O-CG 3.44Å; S151-L155 PolarHBondContact O-N 2.85Å; S151-L155 VanDerWaalsContact O-N 3.08Å; N152-L155 PolarHBondContact O-N 3.09Å; A153-L155 VanDerWaalsContact C-N 3.32Å; A153-L155 PolarHBondContact O-N 2.96Å; L155-S158 PolarHBondContact O-N 3.26Å; L155-L159 WeakPolarHBondContact O-CB 3.4Å; L155-L159 PolarHBondContact O-N 2.84Å
156V97.9Very high97.5Very high78 Ų7894 Ų9447%0.47351%0.511SS..Hα-helixtrans-62.4-46.5174.5171.50000110.7N152 A153 S158 L159 Q160N152-V156 WeakPolarHBondContact O-CG2 3.34Å; N152-V156 PolarHBondContact O-N 3.34Å; A153-V156 PolarHBondContact O-N 2.85Å; V156-S158 PolarHBondContact O-N 3.39Å; V156-L159 PolarHBondContact O-N 3.34Å; V156-Q160 WeakPolarHBondContact O-CB 3.45Å; V156-Q160 PolarHBondContact O-N 2.89Å
157D97.9Very high97.5Very high102 Ų10294.2 Ų94.255%0.54551%0.512SS..Hα-helixtrans-60.2-46177.2-67.7-19.7000111.4A153 L159 Q160 E161A153-D157 PolarHBondContact O-N 3.46Å; D157-L159 VanDerWaalsContact C-N 3.32Å; D157-L159 PolarHBondContact O-N 3.45Å; D157-Q160 PolarHBondContact O-N 2.94Å; D157-E161 PolarHBondContact O-N 3.41Å
158S97.3Very high97.6Very high68 Ų6892.5 Ų92.548%0.47650%0.504SS..Hα-helixtrans-62.7-37.5177.9-56.80000112.2R154 L155 V156 S162R154-S158 WeakPolarHBondContact O-CB 3.49Å; R154-S158 PolarHBondContact O-N 3.23Å; R154-S158 PolarHBondContact O-OG 2.91Å; L155-S158 PolarHBondContact O-N 3.26Å; V156-S158 PolarHBondContact O-N 3.39Å; S158-S162 WeakPolarHBondContact O-CB 3.41Å; S158-S162 PolarHBondContact O-N 2.71Å
159L97.6Very high97.6Very high117 Ų11795.5 Ų95.561%0.61351%0.508SS*.Hα-helixtrans-69.3-40.1176.6-177.466.1000111.5L155 V156 D157 S162 S163L155-L159 WeakPolarHBondContact O-CB 3.4Å; L155-L159 PolarHBondContact O-N 2.84Å; V156-L159 PolarHBondContact O-N 3.34Å; D157-L159 VanDerWaalsContact C-N 3.32Å; D157-L159 PolarHBondContact O-N 3.45Å; L159-S162 PolarHBondContact O-N 2.97Å; L159-S163 WeakPolarHBondContact O-CB 3.46Å; L159-S163 PolarHBondContact O-N 3.19Å; L159-S163 PolarHBondContact O-OG 3.02Å
160Q97.9Very high97.6Very high136 Ų13694.8 Ų94.864%0.63651%0.505SS*.Hα-helixtrans-65.1-43176.2-174.8175.2-23.700111V156 D157 S163 A164V156-Q160 WeakPolarHBondContact O-CB 3.45Å; V156-Q160 PolarHBondContact O-N 2.89Å; D157-Q160 PolarHBondContact O-N 2.94Å; Q160-S163 PolarHBondContact O-N 3.42Å; Q160-A164 PolarHBondContact O-N 3.26Å
161E97.6Very high97.7Very high129 Ų12997.3 Ų97.360%0.60352%0.515SS*.Hα-helixtrans-62.4-46.1173.9-173.8178.5-172.800111.5D157 S163 A164 N165D157-E161 PolarHBondContact O-N 3.41Å; E161-S163 VanDerWaalsContact C-N 3.26Å; E161-S163 PolarHBondContact O-N 3.36Å; E161-A164 PolarHBondContact O-N 3.41Å; E161-N165 PolarHBondContact O-N 2.99Å
162S96.6Very high97.7Very high64 Ų6499.3 Ų99.345%0.44852%0.517SS..Hα-helixtrans-60.1-38.1175.4-175.20000112S158 L159 N165 V166S158-S162 WeakPolarHBondContact O-CB 3.41Å; S158-S162 PolarHBondContact O-N 2.71Å; L159-S162 PolarHBondContact O-N 2.97Å; S162-N165 PolarHBondContact O-N 3.27Å; S162-V166 WeakPolarHBondContact O-CG2 3.46Å; S162-V166 PolarHBondContact O-N 3.08Å
163S97.2Very high97.7Very high63 Ų63100.1 Ų100.144%0.44152%0.521SS..Hα-helixtrans-67.8-42.8177.4-59.50000111.5L159 Q160 E161 N165 V166 E167L159-S163 WeakPolarHBondContact O-CB 3.46Å; L159-S163 PolarHBondContact O-N 3.19Å; L159-S163 PolarHBondContact O-OG 3.02Å; Q160-S163 PolarHBondContact O-N 3.42Å; E161-S163 VanDerWaalsContact C-N 3.26Å; E161-S163 PolarHBondContact O-N 3.36Å; S163-N165 VanDerWaalsContact C-N 3.32Å; S163-N165 PolarHBondContact O-N 2.69Å; S163-V166 PolarHBondContact O-N 2.93Å; S163-E167 PolarHBondContact O-N 3.04Å; S163-E167 VanDerWaalsContact O-N 3.13Å
164A97.6Very high97.7Very high62 Ų62101.2 Ų101.251%0.51252%0.522SS..Hα-helixtrans-62-40.4174.400000111.9Q160 E161 E167 S168Q160-A164 PolarHBondContact O-N 3.26Å; E161-A164 PolarHBondContact O-N 3.41Å; A164-E167 PolarHBondContact O-N 3.39Å; A164-S168 PolarHBondContact O-N 2.97Å
165N97.9Very high97.7Very high83 Ų8395.3 Ų95.344%0.44451%0.512SS..Hα-helixtrans-62-45.3175-80.8-10.7000111.8E161 S162 S163 E167 S168 W169E161-N165 PolarHBondContact O-N 2.99Å; S162-N165 PolarHBondContact O-N 3.27Å; S163-N165 VanDerWaalsContact C-N 3.32Å; S163-N165 PolarHBondContact O-N 2.69Å; N165-E167 VanDerWaalsContact C-N 3.28Å; N165-E167 PolarHBondContact O-N 3.21Å; N165-S168 WeakPolarHBondContact O-CB 3.39Å; N165-S168 PolarHBondContact O-N 3.22Å; N165-S168 VanDerWaalsContact O-N 3.12Å; N165-W169 PolarHBondContact O-N 3.05Å
166V98.3Very high97.7Very high70 Ų7093.8 Ų93.842%0.42451%0.509SS..Hα-helixtrans-57.2-42.6176.1167.70000111.3S162 S163 W169 K170S162-V166 WeakPolarHBondContact O-CG2 3.46Å; S162-V166 PolarHBondContact O-N 3.08Å; S163-V166 PolarHBondContact O-N 2.93Å; V166-W169 PolarHBondContact O-N 2.97Å; V166-K170 HydrophobicContact CG1-CD 4.4Å; V166-K170 WeakPolarHBondContact O-CG 3.43Å; V166-K170 PolarHBondContact O-N 2.99Å
167E97.6Very high97.7Very high95 Ų9595.6 Ų95.644%0.44451%0.512SS..Hα-helixtrans-67.8-34.8177-67.5-54.5131.800112.9S163 A164 N165 K170 K171S163-E167 PolarHBondContact O-N 3.04Å; S163-E167 VanDerWaalsContact O-N 3.13Å; A164-E167 PolarHBondContact O-N 3.39Å; N165-E167 VanDerWaalsContact C-N 3.28Å; N165-E167 PolarHBondContact O-N 3.21Å; E167-K170 IonicContact OE1-NZ 2.72Å; E167-K170 PolarHBondContact OE1-NZ 2.93Å; E167-K171 WeakPolarHBondContact O-CG 3.44Å; E167-K171 PolarHBondContact O-N 3.38Å
168S97.4Very high97.7Very high55 Ų5596.9 Ų96.939%0.38552%0.515SS..Hα-helixtrans-63.9-48.3172.3-164.10000111.8A164 N165 K170 K171 E172A164-S168 PolarHBondContact O-N 2.97Å; N165-S168 WeakPolarHBondContact O-CB 3.39Å; N165-S168 PolarHBondContact O-N 3.22Å; N165-S168 VanDerWaalsContact O-N 3.12Å; S168-K170 VanDerWaalsContact C-N 3.3Å; S168-K170 PolarHBondContact O-N 3.39Å; S168-K171 WeakPolarHBondContact O-CB 3.38Å; S168-K171 PolarHBondContact O-N 2.93Å; S168-K171 VanDerWaalsContact O-N 3.08Å; S168-E172 PolarHBondContact O-N 2.67Å
169W98Very high97.7Very high171 Ų17199.4 Ų99.465%0.64852%0.52SS*.Hα-helixtrans-61.6-36.9178-73.4116000112.6N165 V166 E172 L173N165-W169 PolarHBondContact O-N 3.05Å; V166-W169 PolarHBondContact O-N 2.97Å; W169-E172 VanDerWaalsContact CZ3-OE2 3.26Å; W169-E172 WeakPolarHBondContact CZ3-OE2 3.01Å; W169-E172 PolarHBondContact O-N 3.21Å; W169-L173 WeakPolarHBondContact O-CB 3.42Å; W169-L173 PolarHBondContact O-N 2.8Å
170K98.3Very high97.7Very high106 Ų10695.8 Ų95.846%0.46150%0.504SS..Hα-helixtrans-60.6-43.9173.1-77.5175.5-175.4169.80111.7V166 E167 S168 L173 T174V166-K170 HydrophobicContact CG1-CD 4.4Å; V166-K170 WeakPolarHBondContact O-CG 3.43Å; V166-K170 PolarHBondContact O-N 2.99Å; E167-K170 IonicContact OE1-NZ 2.72Å; E167-K170 PolarHBondContact OE1-NZ 2.93Å; S168-K170 VanDerWaalsContact C-N 3.3Å; S168-K170 PolarHBondContact O-N 3.39Å; K170-L173 PolarHBondContact O-N 3.08Å; K170-T174 PolarHBondContact O-N 2.91Å; K170-T174 PolarHBondContact O-OG1 3.38Å
171K98Very high97.7Very high148 Ų14892.4 Ų92.464%0.64349%0.49SS*.Hα-helixtrans-63.1-45.2177.1-71.3175.2-176.7177.10111.7E167 S168 L173 T174 A175E167-K171 WeakPolarHBondContact O-CG 3.44Å; E167-K171 PolarHBondContact O-N 3.38Å; S168-K171 WeakPolarHBondContact O-CB 3.38Å; S168-K171 PolarHBondContact O-N 2.93Å; S168-K171 VanDerWaalsContact O-N 3.08Å; K171-L173 VanDerWaalsContact C-N 3.32Å; K171-L173 PolarHBondContact O-N 2.96Å; K171-T174 WeakPolarHBondContact CA-OG1 3.21Å; K171-T174 PolarHBondContact O-N 3.42Å; K171-T174 PolarHBondContact O-OG1 3.45Å; K171-A175 PolarHBondContact O-N 2.97Å
172E97.9Very high97.7Very high102 Ų10290.6 Ų90.648%0.47749%0.488SS..Hα-helixtrans-62-40.3176.6-72.3178.5-160.900112.1S168 W169 A175 C176S168-E172 PolarHBondContact O-N 2.67Å; W169-E172 VanDerWaalsContact CZ3-OE2 3.26Å; W169-E172 WeakPolarHBondContact CZ3-OE2 3.01Å; W169-E172 PolarHBondContact O-N 3.21Å; E172-A175 PolarHBondContact O-N 3.16Å; E172-C176 WeakPolarHBondContact O-CB 3.27Å; E172-C176 PolarHBondContact O-N 3.25Å
173L97.9Very high97.8Very high118 Ų11891.9 Ų91.962%0.61849%0.489SS*.Hα-helixtrans-61.4-45.2175.4-179.164.1000111.6W169 K170 K171 C176 Q177W169-L173 WeakPolarHBondContact O-CB 3.42Å; W169-L173 PolarHBondContact O-N 2.8Å; K170-L173 PolarHBondContact O-N 3.08Å; K171-L173 VanDerWaalsContact C-N 3.32Å; K171-L173 PolarHBondContact O-N 2.96Å; L173-C176 PolarHBondContact O-N 3.27Å; L173-Q177 WeakPolarHBondContact O-CB 3.44Å; L173-Q177 PolarHBondContact O-N 3.49Å
174T97.6Very high97.8Very high73 Ų7396.4 Ų96.445%0.44850%0.497SS..Hα-helixtrans-63-42.5176.949.10000112.1K170 K171 C176 Q177 E178K170-T174 PolarHBondContact O-N 2.91Å; K170-T174 PolarHBondContact O-OG1 3.38Å; K171-T174 WeakPolarHBondContact CA-OG1 3.21Å; K171-T174 PolarHBondContact O-N 3.42Å; K171-T174 PolarHBondContact O-OG1 3.45Å; T174-C176 PolarHBondContact O-N 3.15Å; T174-Q177 WeakPolarHBondContact O-CB 3.48Å; T174-Q177 PolarHBondContact O-N 2.95Å; T174-E178 WeakPolarHBondContact O-CG 3.39Å; T174-E178 PolarHBondContact O-N 3.4Å
175A97.4Very high97.9Very high53 Ų53100.3 Ų100.344%0.43850%0.502SS..Hα-helixtrans-62.8-44.117700000111.7K171 E172 Q177 E178 E179K171-A175 PolarHBondContact O-N 2.97Å; E172-A175 PolarHBondContact O-N 3.16Å; A175-Q177 VanDerWaalsContact C-N 3.3Å; A175-Q177 PolarHBondContact O-N 3.29Å; A175-E178 PolarHBondContact O-N 3.32Å; A175-E179 PolarHBondContact O-N 2.86Å
176C97.1Very high97.9Very high77 Ų77100.7 Ų100.752%0.5250%0.5SS..Hα-helixtrans-63.5-37.2176.4-172.90000111.9E172 L173 T174 S180E172-C176 WeakPolarHBondContact O-CB 3.27Å; E172-C176 PolarHBondContact O-N 3.25Å; L173-C176 PolarHBondContact O-N 3.27Å; T174-C176 PolarHBondContact O-N 3.15Å; C176-S180 WeakPolarHBondContact O-CB 3.41Å; C176-S180 PolarHBondContact O-N 3.02Å
177Q98.2Very high97.9Very high115 Ų115101.5 Ų101.554%0.53750%0.501SS..Hα-helixtrans-66.2-42.8175.9-175.9176.2-6.800112L173 T174 A175 S180 N181L173-Q177 WeakPolarHBondContact O-CB 3.44Å; L173-Q177 PolarHBondContact O-N 3.49Å; T174-Q177 WeakPolarHBondContact O-CB 3.48Å; T174-Q177 PolarHBondContact O-N 2.95Å; A175-Q177 VanDerWaalsContact C-N 3.3Å; A175-Q177 PolarHBondContact O-N 3.29Å; Q177-S180 PolarHBondContact O-N 3.27Å; Q177-N181 WeakPolarHBondContact O-CB 3.47Å; Q177-N181 VanDerWaalsContact O-CG 3.23Å; Q177-N181 PolarHBondContact O-N 2.86Å; Q177-N181 PolarHBondContact O-ND2 3.04Å
178E98Very high97.9Very high129 Ų12999.6 Ų99.660%0.60350%0.501SS*.Hα-helixtrans-63.5-43.1175.6-72.9175.3176.800112.1T174 A175 N181 T182T174-E178 WeakPolarHBondContact O-CG 3.39Å; T174-E178 PolarHBondContact O-N 3.4Å; A175-E178 PolarHBondContact O-N 3.32Å; E178-N181 PolarHBondContact O-N 2.95Å; E178-T182 WeakPolarHBondContact O-CB 3.31Å; E178-T182 PolarHBondContact O-N 3.38Å; E178-T182 PolarHBondContact O-OG1 3.4Å
179E97.9Very high98Very high122 Ų122101.6 Ų101.657%0.5751%0.505SS*.Hα-helixtrans-61.6-46.7174.4-171.3-174.2174.600110.8A175 N181 T182 L183A175-E179 PolarHBondContact O-N 2.86Å; E179-N181 VanDerWaalsContact C-N 3.28Å; E179-N181 PolarHBondContact O-N 3.02Å; E179-T182 PolarHBondContact O-N 3.46Å; E179-T182 VanDerWaalsContact O-N 3.15Å; E179-L183 HydrophobicContact CG-CD1 4.26Å; E179-L183 WeakPolarHBondContact O-CG 3.29Å; E179-L183 PolarHBondContact O-N 2.91Å
180S96.8Very high98Very high41 Ų4197.7 Ų97.729%0.28750%0.496SS..Hα-helixtrans-60.8-37.8176.7-177.50000112.2C176 Q177 R184C176-S180 WeakPolarHBondContact O-CB 3.41Å; C176-S180 PolarHBondContact O-N 3.02Å; Q177-S180 PolarHBondContact O-N 3.27Å; S180-R184 VanDerWaalsContact O-CG 3.29Å; S180-R184 WeakPolarHBondContact O-CG 3.41Å; S180-R184 PolarHBondContact O-N 3.19Å; S180-R184 PolarHBondContact OG-NH2 2.94Å
181N97.8Very high98Very high65 Ų6598.2 Ų98.235%0.34850%0.5SS..Hα-helixtrans-68.5-39.6176.8-73.5-24.2000111.4Q177 E178 E179 R184 K185Q177-N181 WeakPolarHBondContact O-CB 3.47Å; Q177-N181 VanDerWaalsContact O-CG 3.23Å; Q177-N181 PolarHBondContact O-N 2.86Å; Q177-N181 PolarHBondContact O-ND2 3.04Å; E178-N181 PolarHBondContact O-N 2.95Å; E179-N181 VanDerWaalsContact C-N 3.28Å; E179-N181 PolarHBondContact O-N 3.02Å; N181-R184 PolarHBondContact O-N 3.33Å; N181-R184 PolarHBondContact OD1-NH1 3.47Å; N181-K185 WeakPolarHBondContact O-CG 3.48Å; N181-K185 PolarHBondContact O-N 3.31Å
182T98.3Very high98Very high91 Ų9194 Ų9456%0.55849%0.489SS*.Hα-helixtrans-64.3-45.4176.3-57.40000111E178 E179 R184 K185 K186E178-T182 WeakPolarHBondContact O-CB 3.31Å; E178-T182 PolarHBondContact O-N 3.38Å; E178-T182 PolarHBondContact O-OG1 3.4Å; E179-T182 PolarHBondContact O-N 3.46Å; E179-T182 VanDerWaalsContact O-N 3.15Å; T182-R184 PolarHBondContact O-N 3.49Å; T182-K185 PolarHBondContact O-N 3.14Å; T182-K186 PolarHBondContact O-N 3.02Å
183L98.4Very high98Very high90 Ų9094 Ų9447%0.47149%0.489SS..Hα-helixtrans-62.4-41.8175.9-70.5174000112E179 K185 K186 I187E179-L183 HydrophobicContact CG-CD1 4.26Å; E179-L183 WeakPolarHBondContact O-CG 3.29Å; E179-L183 PolarHBondContact O-N 2.91Å; L183-K185 PolarHBondContact O-N 3.34Å; L183-K186 PolarHBondContact O-N 3.46Å; L183-I187 VanDerWaalsContact O-CG1 3.31Å; L183-I187 WeakPolarHBondContact O-CG1 3.48Å; L183-I187 PolarHBondContact O-N 3.21Å
184R98.5Very high98Very high159 Ų15992.2 Ų92.260%0.649%0.486SS*.Hα-helixtrans-60.8-43175.1-76.5178.6-159.5153.44.4112.2S180 N181 T182 K186 I187 A188S180-R184 VanDerWaalsContact O-CG 3.29Å; S180-R184 WeakPolarHBondContact O-CG 3.41Å; S180-R184 PolarHBondContact O-N 3.19Å; S180-R184 PolarHBondContact OG-NH2 2.94Å; N181-R184 PolarHBondContact O-N 3.33Å; N181-R184 PolarHBondContact OD1-NH1 3.47Å; T182-R184 PolarHBondContact O-N 3.49Å; R184-K186 VanDerWaalsContact C-N 3.33Å; R184-I187 PolarHBondContact O-N 2.88Å; R184-A188 PolarHBondContact O-N 3.21Å
185K98.4Very high98Very high144 Ų14493.6 Ų93.663%0.62649%0.49SS*.Hα-helixtrans-60.2-45.2174.2-72.6176.8-178.7-179.40110.9N181 T182 L183 I187 A188 E189N181-K185 WeakPolarHBondContact O-CG 3.48Å; N181-K185 PolarHBondContact O-N 3.31Å; T182-K185 PolarHBondContact O-N 3.14Å; L183-K185 PolarHBondContact O-N 3.34Å; K185-I187 VanDerWaalsContact C-N 3.34Å; K185-I187 PolarHBondContact O-N 3.45Å; K185-A188 PolarHBondContact O-N 3.14Å; K185-E189 WeakPolarHBondContact O-CG 3.36Å; K185-E189 PolarHBondContact O-N 3.48Å
186K98.4Very high98Very high90 Ų9096.7 Ų96.739%0.39150%0.496SS..Hα-helixtrans-65.7-37-179.9-170.659.9-170.1163.30113.1T182 L183 R184 E189 L190T182-K186 PolarHBondContact O-N 3.02Å; L183-K186 PolarHBondContact O-N 3.46Å; R184-K186 VanDerWaalsContact C-N 3.33Å; K186-E189 WeakPolarHBondContact CD-OE2 3.38Å; K186-E189 IonicContact NZ-OE2 2.64Å; K186-E189 PolarHBondContact NZ-OE2 3.41Å; K186-E189 VanDerWaalsContact NZ-OE2 3.17Å; K186-E189 PolarHBondContact O-N 2.86Å; K186-L190 HydrophobicContact CG-CD1 4.23Å; K186-L190 WeakPolarHBondContact O-CB 3.31Å; K186-L190 VanDerWaalsContact O-CG 3.3Å; K186-L190 WeakPolarHBondContact O-CG 3.45Å; K186-L190 PolarHBondContact O-N 3.23Å
187I98.4Very high98.1Very high88 Ų8895.9 Ų95.945%0.45150%0.495SS..Hα-helixtrans-61.1-48.1173-70.9165.8000110.1L183 R184 K185 E189 L190 E191L183-I187 VanDerWaalsContact O-CG1 3.31Å; L183-I187 WeakPolarHBondContact O-CG1 3.48Å; L183-I187 PolarHBondContact O-N 3.21Å; R184-I187 PolarHBondContact O-N 2.88Å; K185-I187 VanDerWaalsContact C-N 3.34Å; K185-I187 PolarHBondContact O-N 3.45Å; I187-E189 VanDerWaalsContact C-N 3.34Å; I187-E189 PolarHBondContact O-N 3.02Å; I187-L190 PolarHBondContact O-N 3Å; I187-E191 HydrophobicContact CG2-CG 4.28Å; I187-E191 WeakPolarHBondContact CG2-OE1 3.24Å; I187-E191 WeakPolarHBondContact O-CB 3.45Å; I187-E191 VanDerWaalsContact O-CG 3.31Å; I187-E191 WeakPolarHBondContact O-CG 3.35Å; I187-E191 PolarHBondContact O-N 3.41Å
188A98.1Very high98Very high54 Ų5495 Ų9545%0.44649%0.494SS..Hα-helixtrans-61.8-39.717900000112.8R184 K185 E191 S192R184-A188 PolarHBondContact O-N 3.21Å; K185-A188 PolarHBondContact O-N 3.14Å; A188-E191 PolarHBondContact O-N 3.46Å; A188-S192 PolarHBondContact O-N 2.94Å
189E98.3Very high98Very high98 Ų9894 Ų9446%0.45849%0.489SS..Hα-helixtrans-61-49.6173.3-72.7169.5-16600111.6K185 K186 I187 E191 S192 E193K185-E189 WeakPolarHBondContact O-CG 3.36Å; K185-E189 PolarHBondContact O-N 3.48Å; K186-E189 WeakPolarHBondContact CD-OE2 3.38Å; K186-E189 IonicContact NZ-OE2 2.64Å; K186-E189 PolarHBondContact NZ-OE2 3.41Å; K186-E189 VanDerWaalsContact NZ-OE2 3.17Å; K186-E189 PolarHBondContact O-N 2.86Å; I187-E189 VanDerWaalsContact C-N 3.34Å; I187-E189 PolarHBondContact O-N 3.02Å; E189-E191 VanDerWaalsContact C-N 3.31Å; E189-E191 PolarHBondContact O-N 2.96Å; E189-S192 WeakPolarHBondContact O-CB 3.46Å; E189-S192 PolarHBondContact O-N 3.26Å; E189-S192 VanDerWaalsContact O-N 3.14Å; E189-E193 WeakPolarHBondContact O-CG 3.3Å; E189-E193 PolarHBondContact O-N 3Å
190L98.1Very high98.1Very high88 Ų8892.3 Ų92.346%0.46148%0.481SS..Hα-helixtrans-64.3-35.3179.3-71.9172.5000112.5K186 I187 C194K186-L190 HydrophobicContact CG-CD1 4.23Å; K186-L190 WeakPolarHBondContact O-CB 3.31Å; K186-L190 VanDerWaalsContact O-CG 3.3Å; K186-L190 WeakPolarHBondContact O-CG 3.45Å; K186-L190 PolarHBondContact O-N 3.23Å; I187-L190 PolarHBondContact O-N 3Å; L190-C194 VanDerWaalsContact O-CB 3.24Å; L190-C194 WeakPolarHBondContact O-CB 3.36Å; L190-C194 PolarHBondContact O-N 3.4Å
191E98.1Very high98.1Very high118 Ų11897.5 Ų97.555%0.55150%0.498SS*.Hα-helixtrans-64.6-40.8173.2-75.1173.8170.200111.3I187 A188 E189 C194 N195I187-E191 HydrophobicContact CG2-CG 4.28Å; I187-E191 WeakPolarHBondContact CG2-OE1 3.24Å; I187-E191 WeakPolarHBondContact O-CB 3.45Å; I187-E191 VanDerWaalsContact O-CG 3.31Å; I187-E191 WeakPolarHBondContact O-CG 3.35Å; I187-E191 PolarHBondContact O-N 3.41Å; A188-E191 PolarHBondContact O-N 3.46Å; E189-E191 VanDerWaalsContact C-N 3.31Å; E189-E191 PolarHBondContact O-N 2.96Å; E191-C194 PolarHBondContact O-N 3.2Å; E191-N195 VanDerWaalsContact O-CG 3.23Å; E191-N195 PolarHBondContact O-N 3.43Å; E191-N195 PolarHBondContact O-ND2 3.2Å; E191-N195 VanDerWaalsContact O-ND2 3.14Å
192S97.9Very high98.2Very high58 Ų5899.8 Ų99.841%0.40651%0.507SS..Hα-helixtrans-63.3-49.5174.1-165.40000111.7A188 E189 C194 N195 E196A188-S192 PolarHBondContact O-N 2.94Å; E189-S192 WeakPolarHBondContact O-CB 3.46Å; E189-S192 PolarHBondContact O-N 3.26Å; E189-S192 VanDerWaalsContact O-N 3.14Å; S192-C194 VanDerWaalsContact C-N 3.28Å; S192-C194 PolarHBondContact O-N 3.18Å; S192-N195 WeakPolarHBondContact O-CB 3.46Å; S192-N195 PolarHBondContact O-N 3.4Å; S192-N195 VanDerWaalsContact O-N 3.13Å; S192-E196 PolarHBondContact O-N 2.96Å
193E98.3Very high98.2Very high102 Ų102100.2 Ų100.248%0.47750%0.501SS..Hα-helixtrans-58.6-40.2177.2-71.9173.7-16000111.6E189 E196 A197E189-E193 WeakPolarHBondContact O-CG 3.3Å; E189-E193 PolarHBondContact O-N 3Å; E193-E196 PolarHBondContact O-N 3.32Å; E193-A197 WeakPolarHBondContact O-CB 3.38Å; E193-A197 PolarHBondContact O-N 2.93Å
194C97.4Very high98.2Very high82 Ų82100 Ų10055%0.55450%0.501SS*.Hα-helixtrans-64.9-41176.6-169.90000112L190 E191 S192 A197 N198L190-C194 VanDerWaalsContact O-CB 3.24Å; L190-C194 WeakPolarHBondContact O-CB 3.36Å; L190-C194 PolarHBondContact O-N 3.4Å; E191-C194 PolarHBondContact O-N 3.2Å; S192-C194 VanDerWaalsContact C-N 3.28Å; S192-C194 PolarHBondContact O-N 3.18Å; C194-A197 PolarHBondContact O-N 3.44Å; C194-N198 WeakPolarHBondContact O-CB 3.46Å; C194-N198 PolarHBondContact O-N 2.9Å
195N97.7Very high98.2Very high101 Ų10195 Ų9554%0.5449%0.494SS..Hα-helixtrans-64-43.9175.9-72.8-31.9000111.7E191 S192 N198 Q199E191-N195 VanDerWaalsContact O-CG 3.23Å; E191-N195 PolarHBondContact O-N 3.43Å; E191-N195 PolarHBondContact O-ND2 3.2Å; E191-N195 VanDerWaalsContact O-ND2 3.14Å; S192-N195 WeakPolarHBondContact O-CB 3.46Å; S192-N195 PolarHBondContact O-N 3.4Å; S192-N195 VanDerWaalsContact O-N 3.13Å; N195-N198 PolarHBondContact O-N 2.91Å; N195-Q199 WeakPolarHBondContact O-CG 3.39Å; N195-Q199 PolarHBondContact O-N 3.13Å
196E98.1Very high98.2Very high118 Ų11893.9 Ų93.955%0.55149%0.49SS*.Hα-helixtrans-61.6-47175.2-72.7174.7-155.600111.5S192 E193 N198 Q199 E200S192-E196 PolarHBondContact O-N 2.96Å; E193-E196 PolarHBondContact O-N 3.32Å; E196-N198 VanDerWaalsContact C-N 3.27Å; E196-N198 PolarHBondContact O-N 3.41Å; E196-Q199 PolarHBondContact O-N 3.34Å; E196-E200 PolarHBondContact O-N 3.29Å
197A98Very high98.2Very high61 Ų6194.5 Ų94.550%0.50450%0.498SS..Hα-helixtrans-59.9-37.7176.300000112.2E193 C194 E200 K201E193-A197 WeakPolarHBondContact O-CB 3.38Å; E193-A197 PolarHBondContact O-N 2.93Å; C194-A197 PolarHBondContact O-N 3.44Å; A197-E200 PolarHBondContact O-N 2.92Å; A197-K201 VanDerWaalsContact O-CB 3.32Å; A197-K201 WeakPolarHBondContact O-CB 3.5Å; A197-K201 PolarHBondContact O-N 2.91Å
198N97.7Very high98.2Very high96 Ų9694 Ų9451%0.51350%0.499SS..Hα-helixtrans-69.7-40.2176.8-17262.1000112.4C194 N195 E196 E200 K201 Q202C194-N198 WeakPolarHBondContact O-CB 3.46Å; C194-N198 PolarHBondContact O-N 2.9Å; N195-N198 PolarHBondContact O-N 2.91Å; E196-N198 VanDerWaalsContact C-N 3.27Å; E196-N198 PolarHBondContact O-N 3.41Å; N198-E200 VanDerWaalsContact C-N 3.33Å; N198-K201 PolarHBondContact O-N 2.95Å; N198-Q202 PolarHBondContact O-N 2.98Å
199Q98.3Very high98.2Very high109 Ų10995.4 Ų95.451%0.50950%0.502SS..Hα-helixtrans-61.5-43.8173-71.7177.321.600111.1N195 E196 Q202 K203N195-Q199 WeakPolarHBondContact O-CG 3.39Å; N195-Q199 PolarHBondContact O-N 3.13Å; E196-Q199 PolarHBondContact O-N 3.34Å; Q199-Q202 WeakPolarHBondContact O-CB 3.49Å; Q199-Q202 PolarHBondContact O-N 2.93Å; Q199-K203 WeakPolarHBondContact O-CG 3.4Å; Q199-K203 PolarHBondContact O-N 3.43Å
200E98.2Very high98.2Very high86 Ų8696.4 Ų96.440%0.40250%0.501SS..Hα-helixtrans-67.1-38.5179.3-160.155.7-143.700111.8E196 A197 N198 Q202 K203 N204E196-E200 PolarHBondContact O-N 3.29Å; A197-E200 PolarHBondContact O-N 2.92Å; N198-E200 VanDerWaalsContact C-N 3.33Å; E200-Q202 VanDerWaalsContact C-N 3.3Å; E200-Q202 PolarHBondContact O-N 3.21Å; E200-K203 PolarHBondContact O-N 3.11Å; E200-K203 IonicContact OE2-NZ 2.97Å; E200-K203 PolarHBondContact OE2-NZ 3.12Å; E200-N204 WeakPolarHBondContact O-CB 3.46Å; E200-N204 PolarHBondContact O-N 3.03Å
201K98.4Very high98.2Very high149 Ų14995.7 Ų95.765%0.64850%0.5SS*.Hα-helixtrans-59-41.1171-176-178.1177.2-175.50112A197 N198 N204 A205A197-K201 VanDerWaalsContact O-CB 3.32Å; A197-K201 WeakPolarHBondContact O-CB 3.5Å; A197-K201 PolarHBondContact O-N 2.91Å; N198-K201 PolarHBondContact O-N 2.95Å; K201-N204 PolarHBondContact O-N 3.17Å; K201-A205 WeakPolarHBondContact O-CB 3.43Å; K201-A205 PolarHBondContact O-N 3.48Å
202Q98.3Very high98.3Very high114 Ų11496.7 Ų96.753%0.53350%0.503SS..Hα-helixtrans-66.2-43.9177.3-172.9179.26.500111.7N198 Q199 E200 A205 Q206N198-Q202 PolarHBondContact O-N 2.98Å; Q199-Q202 WeakPolarHBondContact O-CB 3.49Å; Q199-Q202 PolarHBondContact O-N 2.93Å; E200-Q202 VanDerWaalsContact C-N 3.3Å; E200-Q202 PolarHBondContact O-N 3.21Å; Q202-A205 WeakPolarHBondContact O-CB 3.46Å; Q202-A205 PolarHBondContact O-N 3.37Å; Q202-Q206 WeakPolarHBondContact O-CG 3.43Å; Q202-Q206 PolarHBondContact O-N 3.3Å
203K98.4Very high98.3Very high100 Ų10098.6 Ų98.644%0.43551%0.505SS..Hα-helixtrans-60.7-45.5174.3-67.6177.2-160.3156.80111.6Q199 E200 A205 Q206 L207Q199-K203 WeakPolarHBondContact O-CG 3.4Å; Q199-K203 PolarHBondContact O-N 3.43Å; E200-K203 PolarHBondContact O-N 3.11Å; E200-K203 IonicContact OE2-NZ 2.97Å; E200-K203 PolarHBondContact OE2-NZ 3.12Å; K203-A205 VanDerWaalsContact C-N 3.3Å; K203-A205 PolarHBondContact O-N 3.28Å; K203-Q206 WeakPolarHBondContact O-CB 3.43Å; K203-Q206 PolarHBondContact O-N 2.98Å; K203-Q206 VanDerWaalsContact O-N 3.12Å; K203-L207 WeakPolarHBondContact O-CG 3.32Å; K203-L207 PolarHBondContact O-N 3.36Å
204N98.4Very high98.3Very high85 Ų8597.5 Ų97.546%0.45550%0.502SS..Hα-helixtrans-61.3-38176.8-84.4-26.2000112.5E200 K201 L207 T208E200-N204 WeakPolarHBondContact O-CB 3.46Å; E200-N204 PolarHBondContact O-N 3.03Å; K201-N204 PolarHBondContact O-N 3.17Å; N204-L207 PolarHBondContact O-N 3.06Å; N204-T208 WeakPolarHBondContact O-CB 3.49Å; N204-T208 PolarHBondContact O-N 3.13Å; N204-T208 PolarHBondContact O-OG1 3.25Å
205A98.4Very high98.4Very high55 Ų5599.3 Ų99.346%0.45550%0.503SS..Hα-helixtrans-63.2-43.1173.500000111.8K201 Q202 K203 T208 V209K201-A205 WeakPolarHBondContact O-CB 3.43Å; K201-A205 PolarHBondContact O-N 3.48Å; Q202-A205 WeakPolarHBondContact O-CB 3.46Å; Q202-A205 PolarHBondContact O-N 3.37Å; K203-A205 VanDerWaalsContact C-N 3.3Å; K203-A205 PolarHBondContact O-N 3.28Å; A205-T208 PolarHBondContact O-N 2.85Å; A205-V209 WeakPolarHBondContact O-CG2 3.39Å; A205-V209 PolarHBondContact O-N 2.88Å; A205-V209 VanDerWaalsContact O-N 3.11Å
206Q98.5Very high98.4Very high119 Ų11997.1 Ų97.156%0.55650%0.499SS*.Hα-helixtrans-63.8-44.7175.7-69.41732.800112.1Q202 K203 T208 V209 R210Q202-Q206 WeakPolarHBondContact O-CG 3.43Å; Q202-Q206 PolarHBondContact O-N 3.3Å; K203-Q206 WeakPolarHBondContact O-CB 3.43Å; K203-Q206 PolarHBondContact O-N 2.98Å; K203-Q206 VanDerWaalsContact O-N 3.12Å; Q206-T208 VanDerWaalsContact C-N 3.31Å; Q206-T208 PolarHBondContact O-N 2.9Å; Q206-V209 PolarHBondContact O-N 3.48Å; Q206-R210 PolarHBondContact O-N 3.02Å
207L98.6Very high98.4Very high104 Ų10496.3 Ų96.355%0.54550%0.495SS..Hα-helixtrans-61.1-40.8175.8-72.1173.9000111.6K203 N204 V209 R210 V211K203-L207 WeakPolarHBondContact O-CG 3.32Å; K203-L207 PolarHBondContact O-N 3.36Å; N204-L207 PolarHBondContact O-N 3.06Å; L207-V209 VanDerWaalsContact C-N 3.31Å; L207-V209 PolarHBondContact O-N 2.75Å; L207-R210 PolarHBondContact O-N 3.44Å; L207-V211 WeakPolarHBondContact O-CG2 3.47Å; L207-V211 PolarHBondContact O-N 3.37Å
208T98.6Very high98.4Very high78 Ų7898.3 Ų98.348%0.47950%0.497SS..Hα-helixtrans-60.7-41.3176.3-58.60000111.6N204 A205 Q206 K212N204-T208 WeakPolarHBondContact O-CB 3.49Å; N204-T208 PolarHBondContact O-N 3.13Å; N204-T208 PolarHBondContact O-OG1 3.25Å; A205-T208 PolarHBondContact O-N 2.85Å; Q206-T208 VanDerWaalsContact C-N 3.31Å; Q206-T208 PolarHBondContact O-N 2.9Å; T208-K212 WeakPolarHBondContact O-CG 3.48Å; T208-K212 PolarHBondContact O-N 3.04Å
209V98.6Very high98.5Very high83 Ų83100.4 Ų100.450%0.50350%0.503SS..Hα-helixtrans-65-46.4174.8172.90000110.5A205 Q206 L207 V211 K212 E213A205-V209 WeakPolarHBondContact O-CG2 3.39Å; A205-V209 PolarHBondContact O-N 2.88Å; A205-V209 VanDerWaalsContact O-N 3.11Å; Q206-V209 PolarHBondContact O-N 3.48Å; L207-V209 VanDerWaalsContact C-N 3.31Å; L207-V209 PolarHBondContact O-N 2.75Å; V209-V211 VanDerWaalsContact C-N 3.3Å; V209-V211 PolarHBondContact O-N 3.3Å; V209-K212 PolarHBondContact O-N 3.34Å; V209-K212 VanDerWaalsContact O-N 3.13Å; V209-E213 HydrophobicContact CG1-CG 4.49Å; V209-E213 WeakPolarHBondContact O-CG 3.35Å; V209-E213 PolarHBondContact O-N 3.2Å
210R98.6Very high98.5Very high118 Ų118101.5 Ų101.545%0.44551%0.509SS..Hα-helixtrans-61.1-37.8179.9-175.858.8-177.4144.94.6112.8Q206 L207 E213 L214Q206-R210 PolarHBondContact O-N 3.02Å; L207-R210 PolarHBondContact O-N 3.44Å; R210-E213 WeakPolarHBondContact CD-OE2 3.33Å; R210-E213 IonicContact NH1-OE2 3.84Å; R210-E213 PolarHBondContact NH1-OE2 3.46Å; R210-E213 PolarHBondContact O-N 3.42Å; R210-L214 HydrophobicContact CG-CD1 4.27Å; R210-L214 WeakPolarHBondContact O-CG 3.49Å; R210-L214 PolarHBondContact O-N 3.01Å
211V98.6Very high98.5Very high74 Ų74102.1 Ų102.145%0.44851%0.51SS..Hα-helixtrans-61.8-47.7174.6168.10000110.5L207 V209 E213 L214 E215L207-V211 WeakPolarHBondContact O-CG2 3.47Å; L207-V211 PolarHBondContact O-N 3.37Å; V209-V211 VanDerWaalsContact C-N 3.3Å; V209-V211 PolarHBondContact O-N 3.3Å; V211-E213 VanDerWaalsContact C-N 3.31Å; V211-E213 PolarHBondContact O-N 2.9Å; V211-L214 PolarHBondContact O-N 3.28Å; V211-E215 HydrophobicContact CG1-CG 4.32Å; V211-E215 WeakPolarHBondContact O-CG 3.32Å; V211-E215 PolarHBondContact O-N 2.99Å
212K98.5Very high98.5Very high138 Ų138100.4 Ų100.460%0.650%0.504SS*.Hα-helixtrans-61.8-38.2178.3-72-178.3177.3-174.80113.1T208 V209 A216T208-K212 WeakPolarHBondContact O-CG 3.48Å; T208-K212 PolarHBondContact O-N 3.04Å; V209-K212 PolarHBondContact O-N 3.34Å; V209-K212 VanDerWaalsContact O-N 3.13Å; K212-A216 PolarHBondContact O-N 2.88Å
213E98.5Very high98.5Very high98 Ų9899.8 Ų99.846%0.45850%0.501SS..Hα-helixtrans-63-45.8174.6-70.5171.117700111.5V209 R210 V211 A216 E217V209-E213 HydrophobicContact CG1-CG 4.49Å; V209-E213 WeakPolarHBondContact O-CG 3.35Å; V209-E213 PolarHBondContact O-N 3.2Å; R210-E213 WeakPolarHBondContact CD-OE2 3.33Å; R210-E213 IonicContact NH1-OE2 3.84Å; R210-E213 PolarHBondContact NH1-OE2 3.46Å; R210-E213 PolarHBondContact O-N 3.42Å; V211-E213 VanDerWaalsContact C-N 3.31Å; V211-E213 PolarHBondContact O-N 2.9Å; E213-A216 PolarHBondContact O-N 3.38Å; E213-E217 PolarHBondContact O-N 3.5Å
214L98.6Very high98.5Very high80 Ų8099.3 Ų99.342%0.41950%0.5SS..Hα-helixtrans-65.5-37.8178-74.2172.3000112.3R210 V211 A216 E217 L218R210-L214 HydrophobicContact CG-CD1 4.27Å; R210-L214 WeakPolarHBondContact O-CG 3.49Å; R210-L214 PolarHBondContact O-N 3.01Å; V211-L214 PolarHBondContact O-N 3.28Å; L214-A216 VanDerWaalsContact C-N 3.35Å; L214-E217 PolarHBondContact O-N 2.91Å; L214-L218 VanDerWaalsContact O-CB 3.32Å; L214-L218 WeakPolarHBondContact O-CB 3.47Å; L214-L218 PolarHBondContact O-N 2.95Å
215E98.6Very high98.5Very high119 Ų11999.8 Ų99.856%0.55650%0.503SS*.Hα-helixtrans-62.3-42173.7-73.7171.5165.100111.5V211 L218 Q219V211-E215 HydrophobicContact CG1-CG 4.32Å; V211-E215 WeakPolarHBondContact O-CG 3.32Å; V211-E215 PolarHBondContact O-N 2.99Å; E215-L218 PolarHBondContact O-N 3.45Å; E215-Q219 WeakPolarHBondContact O-CB 3.35Å; E215-Q219 PolarHBondContact O-N 3.41Å
216A98.5Very high98.5Very high56 Ų56100.8 Ų100.846%0.46350%0.498SS..Hα-helixtrans-66.7-43.1176.800000112.2K212 E213 L214 L218 Q219 E220K212-A216 PolarHBondContact O-N 2.88Å; E213-A216 PolarHBondContact O-N 3.38Å; L214-A216 VanDerWaalsContact C-N 3.35Å; A216-L218 VanDerWaalsContact C-N 3.33Å; A216-L218 PolarHBondContact O-N 3.46Å; A216-Q219 PolarHBondContact O-N 2.99Å; A216-E220 PolarHBondContact O-N 3.18Å
217E98.6Very high98.5Very high100 Ų10098.7 Ų98.747%0.46749%0.491SS..Hα-helixtrans-62.8-41.1175.9-17417717900111.3E213 L214 E220 K221E213-E217 PolarHBondContact O-N 3.5Å; L214-E217 PolarHBondContact O-N 2.91Å; E217-E220 PolarHBondContact O-N 2.74Å; E217-K221 WeakPolarHBondContact O-CG 3.32Å; E217-K221 PolarHBondContact O-N 3.01Å
218L98.6Very high98.5Very high104 Ų10498 Ų9855%0.54549%0.487SS..Hα-helixtrans-61.5-46.6175.1-176.268.1000111.2L214 E215 A216 E220 K221 E222L214-L218 VanDerWaalsContact O-CB 3.32Å; L214-L218 WeakPolarHBondContact O-CB 3.47Å; L214-L218 PolarHBondContact O-N 2.95Å; E215-L218 PolarHBondContact O-N 3.45Å; A216-L218 VanDerWaalsContact C-N 3.33Å; A216-L218 PolarHBondContact O-N 3.46Å; L218-E220 VanDerWaalsContact C-N 3.32Å; L218-E220 PolarHBondContact O-N 3.26Å; L218-K221 PolarHBondContact O-N 3.42Å; L218-E222 WeakPolarHBondContact O-CG 3.47Å; L218-E222 PolarHBondContact O-N 3.4Å
219Q98.6Very high98.4Very high139 Ų139101.9 Ų101.965%0.6549%0.493SS*.Hα-helixtrans-61.8-39.4178.9-172.6-179.6-3.300112E215 A216 E222 Q223E215-Q219 WeakPolarHBondContact O-CB 3.35Å; E215-Q219 PolarHBondContact O-N 3.41Å; A216-Q219 PolarHBondContact O-N 2.99Å; Q219-E222 PolarHBondContact O-N 3.31Å; Q219-Q223 PolarHBondContact O-N 2.87Å
220E98.6Very high98.3Very high133 Ų133103.9 Ų103.962%0.62149%0.491SS*.Hα-helixtrans-62.3-45.6174.3-175.1179.4-177.300111.3A216 E217 L218 E222 Q223 E224A216-E220 PolarHBondContact O-N 3.18Å; E217-E220 PolarHBondContact O-N 2.74Å; L218-E220 VanDerWaalsContact C-N 3.32Å; L218-E220 PolarHBondContact O-N 3.26Å; E220-E222 PolarHBondContact O-N 2.92Å; E220-Q223 PolarHBondContact O-N 3.06Å; E220-E224 PolarHBondContact O-N 2.86Å
221K98.4Very high98.3Very high98 Ų98104.2 Ų104.243%0.42650%0.498SS..Hα-helixtrans-65.2-37.4178-70.4-72.5157.1-157.10112.6E217 L218 E224 L225E217-K221 WeakPolarHBondContact O-CG 3.32Å; E217-K221 PolarHBondContact O-N 3.01Å; L218-K221 PolarHBondContact O-N 3.42Å; K221-E224 IonicContact NZ-OE2 2.69Å; K221-E224 PolarHBondContact NZ-OE2 3.46Å; K221-E224 PolarHBondContact O-N 2.93Å; K221-L225 WeakPolarHBondContact O-CB 3.37Å; K221-L225 WeakPolarHBondContact O-CG 3.37Å; K221-L225 PolarHBondContact O-N 3.02Å
222E98.6Very high98.2Very high114 Ų114103.7 Ų103.753%0.53350%0.501SS..Hα-helixtrans-62.9-42.4172.8-74.4177.5163.300111.5L218 Q219 E220 L225 E226L218-E222 WeakPolarHBondContact O-CG 3.47Å; L218-E222 PolarHBondContact O-N 3.4Å; Q219-E222 PolarHBondContact O-N 3.31Å; E220-E222 PolarHBondContact O-N 2.92Å; E222-L225 PolarHBondContact O-N 3.18Å; E222-E226 WeakPolarHBondContact O-CB 3.46Å; E222-E226 PolarHBondContact O-N 3.32Å
223Q98.5Very high98.1Very high100 Ų100102.5 Ų102.547%0.46750%0.498SS..Hα-helixtrans-66.2-38.4176.9-173.357.174.500112.4Q219 E220 E226 N227Q219-Q223 PolarHBondContact O-N 2.87Å; E220-Q223 PolarHBondContact O-N 3.06Å; Q223-E226 PolarHBondContact O-N 3.46Å; Q223-N227 PolarHBondContact NE2-OD1 3.48Å; Q223-N227 VanDerWaalsContact O-CG 3.25Å; Q223-N227 PolarHBondContact O-N 3.21Å; Q223-N227 PolarHBondContact O-ND2 3.41Å
224E98.4Very high98.1Very high90 Ų90101.7 Ų101.742%0.42150%0.496SS..Hα-helixtrans-62.4-47.2173.7-173.3-179.9-175.300111.1E220 K221 E226 N227 L228E220-E224 PolarHBondContact O-N 2.86Å; K221-E224 IonicContact NZ-OE2 2.69Å; K221-E224 PolarHBondContact NZ-OE2 3.46Å; K221-E224 PolarHBondContact O-N 2.93Å; E224-E226 VanDerWaalsContact C-N 3.32Å; E224-E226 PolarHBondContact O-N 2.95Å; E224-N227 PolarHBondContact O-N 3.49Å; E224-L228 HydrophobicContact CG-CD1 4.43Å; E224-L228 WeakPolarHBondContact O-CG 3.49Å; E224-L228 PolarHBondContact O-N 2.96Å
225L98.3Very high97.9Very high96 Ų96103.4 Ų103.450%0.50350%0.504SS..Hα-helixtrans-59.9-42176.3-78.4173.8000112.2K221 E222 N227 L228 R229K221-L225 WeakPolarHBondContact O-CB 3.37Å; K221-L225 WeakPolarHBondContact O-CG 3.37Å; K221-L225 PolarHBondContact O-N 3.02Å; E222-L225 PolarHBondContact O-N 3.18Å; L225-N227 VanDerWaalsContact C-N 3.34Å; L225-N227 PolarHBondContact O-N 3.5Å; L225-L228 PolarHBondContact O-N 2.89Å; L225-R229 WeakPolarHBondContact O-CG 3.33Å; L225-R229 PolarHBondContact O-N 2.85Å
226E98.1Very high97.8Very high76 Ų76101.6 Ų101.636%0.35550%0.503SS..Hα-helixtrans-64.2-39.8177.4-175.656.1-152.600111.9E222 Q223 E224 R229 R230E222-E226 WeakPolarHBondContact O-CB 3.46Å; E222-E226 PolarHBondContact O-N 3.32Å; Q223-E226 PolarHBondContact O-N 3.46Å; E224-E226 VanDerWaalsContact C-N 3.32Å; E224-E226 PolarHBondContact O-N 2.95Å; E226-R229 PolarHBondContact O-N 2.96Å; E226-R229 IonicContact OE2-NH1 2.68Å; E226-R230 WeakPolarHBondContact O-CG 3.35Å; E226-R230 PolarHBondContact O-N 3.32Å; E226-R230 IonicContact OE1-NE 3.17Å
227N98Very high97.8Very high75 Ų75104.3 Ų104.340%0.40151%0.506SS..Hα-helixtrans-64.6-42.6174.8-69.8-25.5000111.9Q223 E224 L225 R229 R230 Q231Q223-N227 PolarHBondContact NE2-OD1 3.48Å; Q223-N227 VanDerWaalsContact O-CG 3.25Å; Q223-N227 PolarHBondContact O-N 3.21Å; Q223-N227 PolarHBondContact O-ND2 3.41Å; E224-N227 PolarHBondContact O-N 3.49Å; L225-N227 VanDerWaalsContact C-N 3.34Å; L225-N227 PolarHBondContact O-N 3.5Å; N227-R229 VanDerWaalsContact C-N 3.33Å; N227-R229 PolarHBondContact O-N 3.21Å; N227-R230 PolarHBondContact O-N 3.35Å; N227-R230 PolarHBondContact OD1-NH1 3.36Å; N227-Q231 PolarHBondContact O-N 3.04Å
228L98.1Very high97.7Very high88 Ų88103.8 Ų103.846%0.46151%0.506SS..Hα-helixtrans-63.9-38175.9-72.7172.6000111.9E224 L225 Q231 A232E224-L228 HydrophobicContact CG-CD1 4.43Å; E224-L228 WeakPolarHBondContact O-CG 3.49Å; E224-L228 PolarHBondContact O-N 2.96Å; L225-L228 PolarHBondContact O-N 2.89Å; L228-Q231 PolarHBondContact O-N 3.17Å; L228-A232 WeakPolarHBondContact O-CB 3.5Å; L228-A232 PolarHBondContact O-N 3.29Å
229R97.4Very high97.6Very high161 Ų161104 Ų10461%0.60851%0.506SS*.Hα-helixtrans-60.8-47.6173.4-76.1174.2-179.9174.70.5111.7L225 E226 N227 Q231 A232 E233L225-R229 WeakPolarHBondContact O-CG 3.33Å; L225-R229 PolarHBondContact O-N 2.85Å; E226-R229 PolarHBondContact O-N 2.96Å; E226-R229 IonicContact OE2-NH1 2.68Å; N227-R229 VanDerWaalsContact C-N 3.33Å; N227-R229 PolarHBondContact O-N 3.21Å; R229-Q231 VanDerWaalsContact C-N 3.28Å; R229-Q231 PolarHBondContact O-N 3.41Å; R229-A232 WeakPolarHBondContact O-CB 3.41Å; R229-A232 PolarHBondContact O-N 3.25Å; R229-A232 VanDerWaalsContact O-N 3.12Å; R229-E233 PolarHBondContact O-N 3.12Å
230R97.1Very high97.5Very high125 Ų12599.1 Ų99.147%0.47249%0.492SS..Hα-helixtrans-59.5-39.7174.5-69-172.9-136.7128.81.2112E226 N227 A232 E233E226-R230 WeakPolarHBondContact O-CG 3.35Å; E226-R230 PolarHBondContact O-N 3.32Å; E226-R230 IonicContact OE1-NE 3.17Å; N227-R230 PolarHBondContact O-N 3.35Å; N227-R230 PolarHBondContact OD1-NH1 3.36Å; R230-A232 VanDerWaalsContact C-N 3.33Å; R230-A232 PolarHBondContact O-N 3.49Å; R230-E233 PolarHBondContact O-N 2.89Å
231Q97.3Very high97.5Very high124 Ų12498.3 Ų98.358%0.57949%0.488SS*.Hα-helixtrans-65.6-37.6176.8-167.3177.423.400111.9N227 L228 R229 E233 I234N227-Q231 PolarHBondContact O-N 3.04Å; L228-Q231 PolarHBondContact O-N 3.17Å; R229-Q231 VanDerWaalsContact C-N 3.28Å; R229-Q231 PolarHBondContact O-N 3.41Å; Q231-E233 PolarHBondContact O-N 3.31Å; Q231-I234 HydrophobicContact CG-CD1 4.16Å; Q231-I234 WeakPolarHBondContact O-CB 3.42Å; Q231-I234 WeakPolarHBondContact O-CG1 3.5Å; Q231-I234 PolarHBondContact O-N 3.36Å; Q231-I234 VanDerWaalsContact O-N 3.17Å
232A96.8Very high97.5Very high63 Ų6397.3 Ų97.352%0.52149%0.492SS..Hα-helixtrans-63.9-26.6177.200000112.9L228 R229 R230 I234 P236L228-A232 WeakPolarHBondContact O-CB 3.5Å; L228-A232 PolarHBondContact O-N 3.29Å; R229-A232 WeakPolarHBondContact O-CB 3.41Å; R229-A232 PolarHBondContact O-N 3.25Å; R229-A232 VanDerWaalsContact O-N 3.12Å; R230-A232 VanDerWaalsContact C-N 3.33Å; R230-A232 PolarHBondContact O-N 3.49Å; A232-I234 VanDerWaalsContact C-N 3.27Å; A232-I234 PolarHBondContact O-N 3.26Å; A232-P236 WeakPolarHBondContact O-CD 3.37Å
233E97.1Very high97.4Very high114 Ų11498 Ų9853%0.53350%0.496SS..THydrogen-bonded Turntrans-72.1-16.3176-69.3-179.9178.100114R229 R230 Q231 I235 P236 Q237R229-E233 PolarHBondContact O-N 3.12Å; R230-E233 PolarHBondContact O-N 2.89Å; Q231-E233 PolarHBondContact O-N 3.31Å; E233-I235 PolarHBondContact O-N 3.28Å; E233-P236 WeakPolarHBondContact O-CD 3.37Å; E233-Q237 VanDerWaalsContact O-CG 3.28Å; E233-Q237 WeakPolarHBondContact O-CG 3.16Å; E233-Q237 PolarHBondContact O-N 3.3Å
234I96.9Very high97.4Very high81 Ų8196 Ų9642%0.41549%0.493SS..Hα-helixtrans-64.3-40.9179.8-62174.3000111.1Q231 A232 Q237 L238Q231-I234 HydrophobicContact CG-CD1 4.16Å; Q231-I234 WeakPolarHBondContact O-CB 3.42Å; Q231-I234 WeakPolarHBondContact O-CG1 3.5Å; Q231-I234 PolarHBondContact O-N 3.36Å; Q231-I234 VanDerWaalsContact O-N 3.17Å; A232-I234 VanDerWaalsContact C-N 3.27Å; A232-I234 PolarHBondContact O-N 3.26Å; I234-Q237 PolarHBondContact O-N 2.94Å; I234-L238 HydrophobicContact CG2-CD1 3.81Å; I234-L238 HydrophobicContact CG2-CG 4.16Å; I234-L238 WeakPolarHBondContact O-CG 3.34Å; I234-L238 PolarHBondContact O-N 3.35Å
235I95.5Very high97.4Very high115 Ų11597 Ų9759%0.5950%0.5SS*.Hα-helixtrans-63.8-51.1-177.4-66.2171.8000111.3E233 Q237 L238 M239E233-I235 PolarHBondContact O-N 3.28Å; I235-Q237 VanDerWaalsContact C-N 3.29Å; I235-Q237 PolarHBondContact O-N 3.24Å; I235-L238 PolarHBondContact O-N 3.46Å; I235-M239 HydrophobicContact CG2-CG 4.46Å; I235-M239 HydrophobicContact CG2-SD 4.26Å; I235-M239 WeakPolarHBondContact O-CG 3.28Å; I235-M239 PolarHBondContact O-N 3.43Å
236P96.8Very high97.4Very high81 Ų8195.7 Ų95.753%0.52650%0.496SS..Hα-helixtrans-55.7-40173.1-2733.4000114A232 E233 M239 G240A232-P236 WeakPolarHBondContact O-CD 3.37Å; E233-P236 WeakPolarHBondContact O-CD 3.37Å; P236-M239 PolarHBondContact O-N 2.93Å; P236-G240 PolarHBondContact O-N 2.9Å
237Q97.1Very high97.4Very high114 Ų11495 Ų9553%0.53350%0.503SS..Hα-helixtrans-62.4-49.5177.1-71.5171.911.800111.3E233 I234 I235 M239 G240 E241E233-Q237 VanDerWaalsContact O-CG 3.28Å; E233-Q237 WeakPolarHBondContact O-CG 3.16Å; E233-Q237 PolarHBondContact O-N 3.3Å; I234-Q237 PolarHBondContact O-N 2.94Å; I235-Q237 VanDerWaalsContact C-N 3.29Å; I235-Q237 PolarHBondContact O-N 3.24Å; Q237-M239 VanDerWaalsContact C-N 3.29Å; Q237-M239 PolarHBondContact O-N 3.47Å; Q237-G240 PolarHBondContact O-N 2.74Å; Q237-G240 VanDerWaalsContact O-N 3.15Å; Q237-E241 PolarHBondContact O-N 2.93Å
238L96.8Very high97.4Very high89 Ų8998.4 Ų98.447%0.46651%0.514SS..Hα-helixtrans-62.5-35.4176.6-70.6175.7000112.5I234 I235 E241 C242I234-L238 HydrophobicContact CG2-CD1 3.81Å; I234-L238 HydrophobicContact CG2-CG 4.16Å; I234-L238 WeakPolarHBondContact O-CG 3.34Å; I234-L238 PolarHBondContact O-N 3.35Å; I235-L238 PolarHBondContact O-N 3.46Å; L238-E241 PolarHBondContact O-N 2.9Å; L238-C242 WeakPolarHBondContact O-CB 3.39Å; L238-C242 PolarHBondContact O-N 2.98Å; L238-C242 PolarHBondContact O-SG 3.41Å
239M97Very high97.4Very high109 Ų10999 Ų9954%0.53752%0.517SS..Hα-helixtrans-62.5-46173.1-76.2-177.864.700111.4I235 P236 Q237 E241 C242 E243I235-M239 HydrophobicContact CG2-CG 4.46Å; I235-M239 HydrophobicContact CG2-SD 4.26Å; I235-M239 WeakPolarHBondContact O-CG 3.28Å; I235-M239 PolarHBondContact O-N 3.43Å; P236-M239 PolarHBondContact O-N 2.93Å; Q237-M239 VanDerWaalsContact C-N 3.29Å; Q237-M239 PolarHBondContact O-N 3.47Å; M239-E241 VanDerWaalsContact C-N 3.33Å; M239-E241 PolarHBondContact O-N 3.23Å; M239-C242 WeakPolarHBondContact O-CB 3.32Å; M239-C242 PolarHBondContact O-N 2.97Å; M239-E243 WeakPolarHBondContact O-CG 3.42Å; M239-E243 PolarHBondContact O-N 2.89Å
240G97.6Very high97.4Very high35 Ų3597.9 Ų97.936%0.36152%0.517SS..Hα-helixtrans-62.2-38.1176.300000113.1P236 Q237 E243 S244P236-G240 PolarHBondContact O-N 2.9Å; Q237-G240 PolarHBondContact O-N 2.74Å; Q237-G240 VanDerWaalsContact O-N 3.15Å; G240-E243 PolarHBondContact O-N 3.35Å; G240-S244 WeakPolarHBondContact O-CB 3.43Å; G240-S244 PolarHBondContact O-N 3.22Å
241E97.8Very high97.4Very high116 Ų11694.5 Ų94.554%0.54252%0.516SS..Hα-helixtrans-64-45.4172.7-71.2-177.3-176.700112Q237 L238 M239 E243 S244 I245Q237-E241 PolarHBondContact O-N 2.93Å; L238-E241 PolarHBondContact O-N 2.9Å; M239-E241 VanDerWaalsContact C-N 3.33Å; M239-E241 PolarHBondContact O-N 3.23Å; E241-E243 VanDerWaalsContact C-N 3.32Å; E241-E243 PolarHBondContact O-N 3.18Å; E241-S244 WeakPolarHBondContact O-CB 3.5Å; E241-S244 PolarHBondContact O-N 3.43Å; E241-I245 WeakPolarHBondContact O-CG1 3.48Å; E241-I245 PolarHBondContact O-N 3.43Å
242C97.8Very high97.5Very high77 Ų7790.5 Ų90.552%0.5250%0.504SS..Hα-helixtrans-57.8-43.5175-71.90000111.8L238 M239 I245 T246L238-C242 WeakPolarHBondContact O-CB 3.39Å; L238-C242 PolarHBondContact O-N 2.98Å; L238-C242 PolarHBondContact O-SG 3.41Å; M239-C242 WeakPolarHBondContact O-CB 3.32Å; M239-C242 PolarHBondContact O-N 2.97Å; C242-I245 PolarHBondContact O-N 3.15Å; C242-T246 VanDerWaalsContact O-CB 3.32Å; C242-T246 WeakPolarHBondContact O-CB 3.44Å; C242-T246 PolarHBondContact O-N 2.99Å; C242-T246 PolarHBondContact O-OG1 3.38Å
243E97.9Very high97.5Very high130 Ų13092.7 Ų92.761%0.60750%0.504SS*.Hα-helixtrans-63.2-44.1176.4-73.7175.7-175.500111.8M239 G240 E241 T246 A247M239-E243 WeakPolarHBondContact O-CG 3.42Å; M239-E243 PolarHBondContact O-N 2.89Å; G240-E243 PolarHBondContact O-N 3.35Å; E241-E243 VanDerWaalsContact C-N 3.32Å; E241-E243 PolarHBondContact O-N 3.18Å; E243-T246 PolarHBondContact O-N 2.97Å; E243-A247 WeakPolarHBondContact O-CB 3.47Å; E243-A247 PolarHBondContact O-N 3.41Å
244S98.1Very high97.6Very high57 Ų5791.1 Ų91.140%0.39951%0.505SS..Hα-helixtrans-61.3-45.7176.5-171.60000112.3G240 E241 A247 K248G240-S244 WeakPolarHBondContact O-CB 3.43Å; G240-S244 PolarHBondContact O-N 3.22Å; E241-S244 WeakPolarHBondContact O-CB 3.5Å; E241-S244 PolarHBondContact O-N 3.43Å; S244-A247 PolarHBondContact O-N 3Å; S244-K248 WeakPolarHBondContact O-CG 3.45Å; S244-K248 PolarHBondContact O-N 3.33Å
245I98.1Very high97.6Very high110 Ų11093.2 Ų93.256%0.56451%0.513SS*.Hα-helixtrans-63.2-44.2176.8-68.9168.6000110.2E241 C242 A247 K248 L249E241-I245 WeakPolarHBondContact O-CG1 3.48Å; E241-I245 PolarHBondContact O-N 3.43Å; C242-I245 PolarHBondContact O-N 3.15Å; I245-A247 VanDerWaalsContact C-N 3.31Å; I245-A247 PolarHBondContact O-N 2.85Å; I245-K248 PolarHBondContact O-N 3.22Å; I245-L249 WeakPolarHBondContact O-CB 3.47Å; I245-L249 PolarHBondContact O-N 3.01Å
246T97.8Very high97.7Very high69 Ų6992.1 Ų92.142%0.42351%0.509SS..Hα-helixtrans-60.5-41.5177.4-59.50000111.4C242 E243 L249 K250C242-T246 VanDerWaalsContact O-CB 3.32Å; C242-T246 WeakPolarHBondContact O-CB 3.44Å; C242-T246 PolarHBondContact O-N 2.99Å; C242-T246 PolarHBondContact O-OG1 3.38Å; E243-T246 PolarHBondContact O-N 2.97Å; T246-L249 PolarHBondContact O-N 3.31Å; T246-K250 WeakPolarHBondContact O-CG 3.45Å; T246-K250 PolarHBondContact O-N 3.33Å
247A97.9Very high97.8Very high61 Ų6195.9 Ų95.950%0.50452%0.516SS..Hα-helixtrans-64.3-43.5176.100000112.1E243 S244 I245 K250 A251E243-A247 WeakPolarHBondContact O-CB 3.47Å; E243-A247 PolarHBondContact O-N 3.41Å; S244-A247 PolarHBondContact O-N 3Å; I245-A247 VanDerWaalsContact C-N 3.31Å; I245-A247 PolarHBondContact O-N 2.85Å; A247-K250 PolarHBondContact O-N 3.36Å; A247-A251 PolarHBondContact O-N 3.37Å
248K98.3Very high97.8Very high148 Ų14895.3 Ų95.364%0.64351%0.514SS*.Hα-helixtrans-62.2-41.9175-73.1175.2-177.5173.60112S244 I245 A251 A252S244-K248 WeakPolarHBondContact O-CG 3.45Å; S244-K248 PolarHBondContact O-N 3.33Å; I245-K248 PolarHBondContact O-N 3.22Å; K248-A251 PolarHBondContact O-N 3.41Å; K248-A252 PolarHBondContact O-N 2.89Å
249L98.1Very high97.8Very high99 Ų9995.4 Ų95.452%0.51851%0.514SS..Hα-helixtrans-60.7-50177-179.264.1000110.8I245 T246 A251 A252 E253I245-L249 WeakPolarHBondContact O-CB 3.47Å; I245-L249 PolarHBondContact O-N 3.01Å; T246-L249 PolarHBondContact O-N 3.31Å; L249-A251 VanDerWaalsContact C-N 3.3Å; L249-A251 PolarHBondContact O-N 2.86Å; L249-A252 PolarHBondContact O-N 3.28Å; L249-A252 VanDerWaalsContact O-N 3.15Å; L249-E253 HydrophobicContact CD1-CG 4.48Å; L249-E253 HydrophobicContact CG-CG 4.5Å; L249-E253 WeakPolarHBondContact O-CG 3.39Å; L249-E253 PolarHBondContact O-N 2.85Å
250K97.8Very high97.8Very high138 Ų13895.8 Ų95.860%0.652%0.515SS*.Hα-helixtrans-58.7-39.9176.6-75.1-179.7178.7178.90112.8T246 A247 E253 S254T246-K250 WeakPolarHBondContact O-CG 3.45Å; T246-K250 PolarHBondContact O-N 3.33Å; A247-K250 PolarHBondContact O-N 3.36Å; K250-E253 PolarHBondContact O-N 3.15Å; K250-S254 PolarHBondContact O-N 3.02Å
251A98Very high97.9Very high54 Ų5495.9 Ų95.945%0.44652%0.516SS..Hα-helixtrans-63.6-45.1176.300000111.4A247 K248 L249 S254 Q255A247-A251 PolarHBondContact O-N 3.37Å; K248-A251 PolarHBondContact O-N 3.41Å; L249-A251 VanDerWaalsContact C-N 3.3Å; L249-A251 PolarHBondContact O-N 2.86Å; A251-S254 PolarHBondContact O-N 2.94Å; A251-Q255 WeakPolarHBondContact O-CG 3.46Å; A251-Q255 PolarHBondContact O-N 3.5Å
252A97.8Very high97.8Very high41 Ų4197.6 Ų97.634%0.33952%0.518SS..Hα-helixtrans-64.2-41176.300000112.3K248 L249 S254 Q255 N256K248-A252 PolarHBondContact O-N 2.89Å; L249-A252 PolarHBondContact O-N 3.28Å; L249-A252 VanDerWaalsContact O-N 3.15Å; A252-S254 PolarHBondContact O-N 3.49Å; A252-Q255 PolarHBondContact O-N 3.46Å; A252-N256 PolarHBondContact O-N 3.14Å
253E98Very high97.8Very high109 Ų10999.6 Ų99.651%0.50952%0.523SS..Hα-helixtrans-60.8-43.3174.8-74.3173.8166.600111.9L249 K250 Q255 N256 K257L249-E253 HydrophobicContact CD1-CG 4.48Å; L249-E253 HydrophobicContact CG-CG 4.5Å; L249-E253 WeakPolarHBondContact O-CG 3.39Å; L249-E253 PolarHBondContact O-N 2.85Å; K250-E253 PolarHBondContact O-N 3.15Å; E253-Q255 VanDerWaalsContact C-N 3.35Å; E253-Q255 PolarHBondContact O-N 3.34Å; E253-N256 PolarHBondContact O-N 2.94Å; E253-K257 WeakPolarHBondContact O-CB 3.38Å; E253-K257 PolarHBondContact O-N 3.02Å
254S97.7Very high97.8Very high80 Ų8099.9 Ų99.956%0.55952%0.524SS*.Hα-helixtrans-64.8-39.4176.6-169.60000112K250 A251 A252 K257 E258K250-S254 PolarHBondContact O-N 3.02Å; A251-S254 PolarHBondContact O-N 2.94Å; A252-S254 PolarHBondContact O-N 3.49Å; S254-K257 PolarHBondContact O-N 3.46Å; S254-E258 PolarHBondContact O-N 3.13Å
255Q98.1Very high97.8Very high125 Ų12598.7 Ų98.758%0.58452%0.52SS*.Hα-helixtrans-65.9-43.1175.2-74.5179.6-21.700111.8A251 A252 E253 K257 E258 L259A251-Q255 WeakPolarHBondContact O-CG 3.46Å; A251-Q255 PolarHBondContact O-N 3.5Å; A252-Q255 PolarHBondContact O-N 3.46Å; E253-Q255 VanDerWaalsContact C-N 3.35Å; E253-Q255 PolarHBondContact O-N 3.34Å; Q255-K257 VanDerWaalsContact C-N 3.33Å; Q255-K257 PolarHBondContact O-N 3Å; Q255-E258 WeakPolarHBondContact O-CB 3.41Å; Q255-E258 PolarHBondContact O-N 3.42Å; Q255-L259 WeakPolarHBondContact O-CG 3.41Å; Q255-L259 PolarHBondContact O-N 3.37Å
256N97.6Very high97.7Very high93 Ų9398.4 Ų98.450%0.49752%0.519SS..Hα-helixtrans-59.7-45.4174.9-82.3-5.5000111.1A252 E253 E258 L259 E260A252-N256 PolarHBondContact O-N 3.14Å; E253-N256 PolarHBondContact O-N 2.94Å; N256-E258 VanDerWaalsContact C-N 3.29Å; N256-E258 PolarHBondContact O-N 3.22Å; N256-L259 PolarHBondContact O-N 2.82Å; N256-L259 VanDerWaalsContact O-N 3.14Å; N256-E260 WeakPolarHBondContact O-CB 3.47Å; N256-E260 WeakPolarHBondContact O-CG 3.47Å; N256-E260 PolarHBondContact O-N 3.09Å
257K97.9Very high97.7Very high159 Ų159100 Ų10069%0.69152%0.522SS*.Hα-helixtrans-60.4-38.3176.6-171177-178.3178.70112.5E253 S254 Q255 G261E253-K257 WeakPolarHBondContact O-CB 3.38Å; E253-K257 PolarHBondContact O-N 3.02Å; S254-K257 PolarHBondContact O-N 3.46Å; Q255-K257 VanDerWaalsContact C-N 3.33Å; Q255-K257 PolarHBondContact O-N 3Å; K257-G261 PolarHBondContact O-N 2.9Å; K257-G261 VanDerWaalsContact O-N 3.09Å
258E97.8Very high97.6Very high102 Ų102103.7 Ų103.748%0.47753%0.531SS..Hα-helixtrans-64.9-44.6174.2-171.2-172.4162.600111.6S254 Q255 N256 G261 R262S254-E258 PolarHBondContact O-N 3.13Å; Q255-E258 WeakPolarHBondContact O-CB 3.41Å; Q255-E258 PolarHBondContact O-N 3.42Å; N256-E258 VanDerWaalsContact C-N 3.29Å; N256-E258 PolarHBondContact O-N 3.22Å; E258-G261 PolarHBondContact O-N 2.69Å; E258-R262 WeakPolarHBondContact O-CG 3.37Å; E258-R262 PolarHBondContact O-N 3.38Å; E258-R262 IonicContact OE1-CZ 3.02Å; E258-R262 IonicContact OE1-NE 2.74Å; E258-R262 PolarHBondContact OE1-NE 2.98Å; E258-R262 IonicContact OE1-NH2 3.3Å; E258-R262 PolarHBondContact OE1-NH2 3.39Å
259L97.5Very high97.6Very high92 Ų92101.8 Ų101.848%0.48253%0.527SS..Hα-helixtrans-65.3-40.4177.9-70.7174.4000112.3Q255 N256 R262 L263Q255-L259 WeakPolarHBondContact O-CG 3.41Å; Q255-L259 PolarHBondContact O-N 3.37Å; N256-L259 PolarHBondContact O-N 2.82Å; N256-L259 VanDerWaalsContact O-N 3.14Å; L259-R262 PolarHBondContact O-N 3.25Å; L259-L263 WeakPolarHBondContact O-CG 3.28Å; L259-L263 PolarHBondContact O-N 2.87Å
260E97.4Very high97.5Very high116 Ų116101.8 Ų101.854%0.54253%0.527SS..Hα-helixtrans-58.1-48172.8-75.7172.2176.500110.9N256 R262 L263 E264N256-E260 WeakPolarHBondContact O-CB 3.47Å; N256-E260 WeakPolarHBondContact O-CG 3.47Å; N256-E260 PolarHBondContact O-N 3.09Å; E260-R262 VanDerWaalsContact C-N 3.32Å; E260-R262 PolarHBondContact O-N 3.36Å; E260-L263 WeakPolarHBondContact O-CB 3.5Å; E260-L263 PolarHBondContact O-N 3.04Å; E260-L263 VanDerWaalsContact O-N 3.13Å; E260-E264 WeakPolarHBondContact O-CG 3.45Å; E260-E264 PolarHBondContact O-N 3.46Å
261G97.7Very high97.5Very high38 Ų3899.2 Ų99.239%0.39252%0.52SS..Hα-helixtrans-61.6-37.5175.900000113.3K257 E258 E264 G265K257-G261 PolarHBondContact O-N 2.9Å; K257-G261 VanDerWaalsContact O-N 3.09Å; E258-G261 PolarHBondContact O-N 2.69Å; G261-E264 PolarHBondContact O-N 3.41Å; G261-G265 PolarHBondContact O-N 3.37Å
262R97.7Very high97.4Very high151 Ų15199.8 Ų99.857%0.5752%0.515SS*.Hα-helixtrans-65.7-40.8173.2-71.8178.5-175.6-159.33.4112E258 L259 E260 G265 L266E258-R262 WeakPolarHBondContact O-CG 3.37Å; E258-R262 PolarHBondContact O-N 3.38Å; E258-R262 IonicContact OE1-CZ 3.02Å; E258-R262 IonicContact OE1-NE 2.74Å; E258-R262 PolarHBondContact OE1-NE 2.98Å; E258-R262 IonicContact OE1-NH2 3.3Å; E258-R262 PolarHBondContact OE1-NH2 3.39Å; L259-R262 PolarHBondContact O-N 3.25Å; E260-R262 VanDerWaalsContact C-N 3.32Å; E260-R262 PolarHBondContact O-N 3.36Å; R262-G265 PolarHBondContact O-N 2.96Å; R262-L266 WeakPolarHBondContact O-CG 3.41Å; R262-L266 PolarHBondContact O-N 2.94Å
263L97.2Very high97.4Very high120 Ų120101.3 Ų101.363%0.62852%0.523SS*.Hα-helixtrans-63.4-43.7176.2-77.7169.9000111.4L259 E260 L266 Q267L259-L263 WeakPolarHBondContact O-CG 3.28Å; L259-L263 PolarHBondContact O-N 2.87Å; E260-L263 WeakPolarHBondContact O-CB 3.5Å; E260-L263 PolarHBondContact O-N 3.04Å; E260-L263 VanDerWaalsContact O-N 3.13Å; L263-L266 PolarHBondContact O-N 3.17Å; L263-Q267 VanDerWaalsContact O-CB 3.29Å; L263-Q267 WeakPolarHBondContact O-CB 3.45Å; L263-Q267 PolarHBondContact O-N 3.21Å
264E97.4Very high97.3Very high136 Ų136105 Ų10564%0.63653%0.533SS*.Hα-helixtrans-59.6-45.9174.9-73.2178.4175.800111.8E260 G261 Q267 M268E260-E264 WeakPolarHBondContact O-CG 3.45Å; E260-E264 PolarHBondContact O-N 3.46Å; G261-E264 PolarHBondContact O-N 3.41Å; E264-Q267 WeakPolarHBondContact O-CB 3.29Å; E264-Q267 PolarHBondContact O-N 3.35Å; E264-M268 WeakPolarHBondContact O-CG 3.38Å; E264-M268 PolarHBondContact O-N 2.99Å
265G97.4Very high97.3Very high31 Ų31107.1 Ų107.132%0.3253%0.534SS..Hα-helixtrans-58.8-49.7175.900000112.5G261 R262 Q267 M268 D269G261-G265 PolarHBondContact O-N 3.37Å; R262-G265 PolarHBondContact O-N 2.96Å; G265-Q267 VanDerWaalsContact C-N 3.28Å; G265-Q267 PolarHBondContact O-N 2.86Å; G265-M268 WeakPolarHBondContact O-CB 3.45Å; G265-M268 PolarHBondContact O-N 3.35Å; G265-M268 VanDerWaalsContact O-N 3.17Å; G265-D269 PolarHBondContact O-N 3.41Å
266L97.2Very high97.2Very high104 Ų104107.1 Ų107.155%0.54553%0.532SS..Hα-helixtrans-61.3-36.9175.9-72173.6000112.2R262 L263 D269 I270R262-L266 WeakPolarHBondContact O-CG 3.41Å; R262-L266 PolarHBondContact O-N 2.94Å; L263-L266 PolarHBondContact O-N 3.17Å; L266-D269 PolarHBondContact O-N 3.09Å; L266-I270 VanDerWaalsContact O-CG1 3.28Å; L266-I270 WeakPolarHBondContact O-CG1 3.27Å; L266-I270 PolarHBondContact O-N 3.34Å
267Q97.5Very high97.2Very high104 Ų104109.3 Ų109.349%0.48654%0.539SS..Hα-helixtrans-65.9-38.1176.8-173.86258.100111.8L263 E264 G265 N271L263-Q267 VanDerWaalsContact O-CB 3.29Å; L263-Q267 WeakPolarHBondContact O-CB 3.45Å; L263-Q267 PolarHBondContact O-N 3.21Å; E264-Q267 WeakPolarHBondContact O-CB 3.29Å; E264-Q267 PolarHBondContact O-N 3.35Å; G265-Q267 VanDerWaalsContact C-N 3.28Å; G265-Q267 PolarHBondContact O-N 2.86Å; Q267-N271 PolarHBondContact O-N 3.04Å; Q267-N271 VanDerWaalsContact O-N 3.09Å; Q267-N271 PolarHBondContact O-ND2 3.49Å
268M96.4Very high97Very high138 Ų138103.6 Ų103.668%0.6853%0.526SS*.Hα-helixtrans-63.9-46.8172.8-71.1-178.168.100111.5E264 G265 I270 N271 D272E264-M268 WeakPolarHBondContact O-CG 3.38Å; E264-M268 PolarHBondContact O-N 2.99Å; G265-M268 WeakPolarHBondContact O-CB 3.45Å; G265-M268 PolarHBondContact O-N 3.35Å; G265-M268 VanDerWaalsContact O-N 3.17Å; M268-I270 VanDerWaalsContact C-N 3.33Å; M268-I270 PolarHBondContact O-N 2.89Å; M268-N271 PolarHBondContact O-N 2.85Å; M268-N271 VanDerWaalsContact O-N 3.13Å; M268-D272 PolarHBondContact O-N 3.39Å
269D97.3Very high96.9Very high107 Ų107103.3 Ų103.357%0.57253%0.527SS*.Hα-helixtrans-60.3-42.1178.3-71.6-18.8000111.9G265 L266 D272 S273G265-D269 PolarHBondContact O-N 3.41Å; L266-D269 PolarHBondContact O-N 3.09Å; D269-D272 PolarHBondContact O-N 3.28Å; D269-S273 VanDerWaalsContact O-CB 3.27Å; D269-S273 WeakPolarHBondContact O-CB 3.5Å; D269-S273 PolarHBondContact O-N 3.5Å
270I97.1Very high96.9Very high100 Ų100104.8 Ų104.851%0.51353%0.533SS..Hα-helixtrans-61.1-44.6174.6-72.3168.4000110.7L266 M268 S273 R274L266-I270 VanDerWaalsContact O-CG1 3.28Å; L266-I270 WeakPolarHBondContact O-CG1 3.27Å; L266-I270 PolarHBondContact O-N 3.34Å; M268-I270 VanDerWaalsContact C-N 3.33Å; M268-I270 PolarHBondContact O-N 2.89Å; I270-S273 PolarHBondContact O-N 3.48Å; I270-R274 WeakPolarHBondContact O-CB 3.32Å; I270-R274 PolarHBondContact O-N 3.23Å
271N96.4Very high96.8Very high84 Ų84106.9 Ų106.945%0.44954%0.54SS..Hα-helixtrans-65.7-43.5179.5-76.6-23.3000112.2Q267 M268 R274 Q275Q267-N271 PolarHBondContact O-N 3.04Å; Q267-N271 VanDerWaalsContact O-N 3.09Å; Q267-N271 PolarHBondContact O-ND2 3.49Å; M268-N271 PolarHBondContact O-N 2.85Å; M268-N271 VanDerWaalsContact O-N 3.13Å; N271-R274 WeakPolarHBondContact O-CB 3.49Å; N271-R274 PolarHBondContact O-N 2.88Å; N271-Q275 WeakPolarHBondContact O-CB 3.32Å; N271-Q275 PolarHBondContact O-N 3.13Å
272D97.2Very high96.8Very high66 Ų66106.7 Ų106.735%0.35354%0.538SS..Hα-helixtrans-62.4-45.2175.417956.4000111.3M268 D269 R274 Q275 K276M268-D272 PolarHBondContact O-N 3.39Å; D269-D272 PolarHBondContact O-N 3.28Å; D272-R274 VanDerWaalsContact C-N 3.33Å; D272-R274 PolarHBondContact O-N 2.92Å; D272-Q275 PolarHBondContact O-N 3.01Å; D272-K276 WeakPolarHBondContact O-CB 3.46Å; D272-K276 WeakPolarHBondContact O-CG 3.5Å; D272-K276 PolarHBondContact O-N 3.33Å; D272-K276 IonicContact OD1-NZ 3.95Å; D272-K276 WeakPolarHBondContact OD2-CE 3.38Å; D272-K276 IonicContact OD2-NZ 3.81Å; D272-K276 PolarHBondContact OD2-NZ 3.4Å
273S96.8Very high96.7Very high72 Ų72104.3 Ų104.350%0.50353%0.533SS..Hα-helixtrans-58.5-43.7173.5-175.50000111.9D269 I270 Q275 K276 Q277D269-S273 VanDerWaalsContact O-CB 3.27Å; D269-S273 WeakPolarHBondContact O-CB 3.5Å; D269-S273 PolarHBondContact O-N 3.5Å; I270-S273 PolarHBondContact O-N 3.48Å; S273-Q275 PolarHBondContact O-N 2.9Å; S273-K276 PolarHBondContact O-N 3.42Å; S273-Q277 WeakPolarHBondContact O-CB 3.42Å; S273-Q277 PolarHBondContact O-N 3.47Å
274R96.8Very high96.6Very high188 Ų188104 Ų10471%0.70953%0.532SS*.Hα-helixtrans-64.3-39.7176.7-164.2-179.6-159.4-165.75.4112.3I270 N271 D272 G278I270-R274 WeakPolarHBondContact O-CB 3.32Å; I270-R274 PolarHBondContact O-N 3.23Å; N271-R274 WeakPolarHBondContact O-CB 3.49Å; N271-R274 PolarHBondContact O-N 2.88Å; D272-R274 VanDerWaalsContact C-N 3.33Å; D272-R274 PolarHBondContact O-N 2.92Å; R274-G278 PolarHBondContact O-N 2.89Å
275Q97Very high96.6Very high124 Ų124104 Ų10458%0.57953%0.53SS*.Hα-helixtrans-65.4-47.9175.4-177179.9-3.500111.1N271 D272 S273 Q277 G278 N279N271-Q275 WeakPolarHBondContact O-CB 3.32Å; N271-Q275 PolarHBondContact O-N 3.13Å; D272-Q275 PolarHBondContact O-N 3.01Å; S273-Q275 PolarHBondContact O-N 2.9Å; Q275-Q277 VanDerWaalsContact C-N 3.33Å; Q275-Q277 PolarHBondContact O-N 3.36Å; Q275-G278 WeakPolarHBondContact O-CA 3.48Å; Q275-G278 PolarHBondContact O-N 2.91Å; Q275-G278 VanDerWaalsContact O-N 3.11Å; Q275-N279 PolarHBondContact O-N 2.9Å
276K96.7Very high96.5Very high125 Ų125109.3 Ų109.354%0.54354%0.544SS..Hα-helixtrans-57.8-45174.8-74.8171176.81650111.7D272 S273 G278 N279 M280D272-K276 WeakPolarHBondContact O-CB 3.46Å; D272-K276 WeakPolarHBondContact O-CG 3.5Å; D272-K276 PolarHBondContact O-N 3.33Å; D272-K276 IonicContact OD1-NZ 3.95Å; D272-K276 WeakPolarHBondContact OD2-CE 3.38Å; D272-K276 IonicContact OD2-NZ 3.81Å; D272-K276 PolarHBondContact OD2-NZ 3.4Å; S273-K276 PolarHBondContact O-N 3.42Å; K276-G278 VanDerWaalsContact C-N 3.33Å; K276-G278 PolarHBondContact O-N 3.35Å; K276-N279 PolarHBondContact O-N 2.98Å; K276-M280 WeakPolarHBondContact O-CB 3.35Å; K276-M280 PolarHBondContact O-N 3.42Å
277Q96.1Very high96.5Very high138 Ų138110.8 Ų110.865%0.64555%0.546SS*.Hα-helixtrans-60.9-41.4174.6-171.9-173.23.400111.7S273 Q275 M280 K281S273-Q277 WeakPolarHBondContact O-CB 3.42Å; S273-Q277 PolarHBondContact O-N 3.47Å; Q275-Q277 VanDerWaalsContact C-N 3.33Å; Q275-Q277 PolarHBondContact O-N 3.36Å; Q277-M280 PolarHBondContact O-N 3.48Å; Q277-K281 WeakPolarHBondContact O-CB 3.43Å; Q277-K281 PolarHBondContact O-N 3.44Å
278G95.7Very high96.3Very high40 Ų40110.5 Ų110.541%0.41255%0.546SS..Hα-helixtrans-61.6-45.5175.100000112.9R274 Q275 K276 K281 G282R274-G278 PolarHBondContact O-N 2.89Å; Q275-G278 WeakPolarHBondContact O-CA 3.48Å; Q275-G278 PolarHBondContact O-N 2.91Å; Q275-G278 VanDerWaalsContact O-N 3.11Å; K276-G278 VanDerWaalsContact C-N 3.33Å; K276-G278 PolarHBondContact O-N 3.35Å; G278-K281 PolarHBondContact O-N 2.64Å; G278-G282 PolarHBondContact O-N 2.94Å
279N95.5Very high96.3Very high96 Ų96108.2 Ų108.251%0.51354%0.537SS..Hα-helixtrans-60.4-49.5175.5-69.2-7.1000111.2Q275 K276 K281 G282 E283Q275-N279 PolarHBondContact O-N 2.9Å; K276-N279 PolarHBondContact O-N 2.98Å; N279-K281 VanDerWaalsContact C-N 3.33Å; N279-K281 PolarHBondContact O-N 3.05Å; N279-G282 WeakPolarHBondContact O-CA 3.47Å; N279-G282 PolarHBondContact O-N 2.89Å; N279-E283 PolarHBondContact O-N 3.33Å
280M96.4Very high96.2Very high122 Ų122108 Ų10860%0.60153%0.534SS*.Hα-helixtrans-58-44.1177.1-175.863.163.700111.8K276 Q277 G282 E283 L284K276-M280 WeakPolarHBondContact O-CB 3.35Å; K276-M280 PolarHBondContact O-N 3.42Å; Q277-M280 PolarHBondContact O-N 3.48Å; M280-G282 VanDerWaalsContact C-N 3.29Å; M280-G282 PolarHBondContact O-N 2.94Å; M280-E283 PolarHBondContact O-N 3.32Å; M280-L284 WeakPolarHBondContact O-CB 3.44Å; M280-L284 PolarHBondContact O-N 3.46Å
281K96.2Very high96.1Very high161 Ų161108.1 Ų108.170%0.754%0.536SS*.Hα-helixtrans-62.2-38.2175.3-173.8178.5180179.90111.8Q277 G278 N279 K285Q277-K281 WeakPolarHBondContact O-CB 3.43Å; Q277-K281 PolarHBondContact O-N 3.44Å; G278-K281 PolarHBondContact O-N 2.64Å; N279-K281 VanDerWaalsContact C-N 3.33Å; N279-K281 PolarHBondContact O-N 3.05Å; K281-K285 WeakPolarHBondContact O-CB 3.38Å; K281-K285 PolarHBondContact O-N 3.11Å
282G96.1Very high96Very high33 Ų33107.8 Ų107.834%0.3453%0.534SS..Hα-helixtrans-65.8-43.2175.400000113G278 N279 M280 K285 K286G278-G282 PolarHBondContact O-N 2.94Å; N279-G282 WeakPolarHBondContact O-CA 3.47Å; N279-G282 PolarHBondContact O-N 2.89Å; M280-G282 VanDerWaalsContact C-N 3.29Å; M280-G282 PolarHBondContact O-N 2.94Å; G282-K285 PolarHBondContact O-N 2.87Å; G282-K286 WeakPolarHBondContact O-CG 3.39Å; G282-K286 PolarHBondContact O-N 3.37Å
283E96.1Very high95.9Very high101 Ų101106 Ų10647%0.47253%0.531SS..Hα-helixtrans-62.3-46.1173.3-71.3179.4176.600111.5N279 M280 K285 K286 F287N279-E283 PolarHBondContact O-N 3.33Å; M280-E283 PolarHBondContact O-N 3.32Å; E283-K285 VanDerWaalsContact C-N 3.26Å; E283-K285 PolarHBondContact O-N 3.34Å; E283-K286 WeakPolarHBondContact O-CB 3.14Å; E283-K286 PolarHBondContact O-N 2.89Å; E283-K286 VanDerWaalsContact O-N 3.11Å; E283-F287 VanDerWaalsContact O-CD2 3.27Å; E283-F287 WeakPolarHBondContact O-CD2 3.4Å; E283-F287 PolarHBondContact O-N 2.93Å
284L96.2Very high95.7Very high113 Ų113107.3 Ų107.359%0.59253%0.528SS*.Hα-helixtrans-59.5-39176.7-17067.9000111.7M280 F287 M288M280-L284 WeakPolarHBondContact O-CB 3.44Å; M280-L284 PolarHBondContact O-N 3.46Å; L284-F287 PolarHBondContact O-N 3.39Å; L284-M288 WeakPolarHBondContact O-CB 3.38Å; L284-M288 PolarHBondContact O-N 3.1Å
285K96.4Very high95.6Very high138 Ų138102.7 Ų102.760%0.652%0.517SS*.Hα-helixtrans-62.4-46.8173.8-178.6169.7-179.71660111.8K281 G282 E283 F287 M288 D289K281-K285 WeakPolarHBondContact O-CB 3.38Å; K281-K285 PolarHBondContact O-N 3.11Å; G282-K285 PolarHBondContact O-N 2.87Å; E283-K285 VanDerWaalsContact C-N 3.26Å; E283-K285 PolarHBondContact O-N 3.34Å; K285-F287 VanDerWaalsContact C-N 3.32Å; K285-F287 PolarHBondContact O-N 3.03Å; K285-M288 WeakPolarHBondContact O-CB 3.47Å; K285-M288 PolarHBondContact O-N 3.34Å; K285-M288 VanDerWaalsContact O-N 3.13Å; K285-D289 VanDerWaalsContact O-CG 3.22Å; K285-D289 PolarHBondContact O-N 2.83Å
286K96.1Very high95.3Very high141 Ų141101.8 Ų101.861%0.61352%0.516SS*.Hα-helixtrans-59.3-43176-69.4174.8-177.2176.30111.9G282 E283 M288 D289 I290G282-K286 WeakPolarHBondContact O-CG 3.39Å; G282-K286 PolarHBondContact O-N 3.37Å; E283-K286 WeakPolarHBondContact O-CB 3.14Å; E283-K286 PolarHBondContact O-N 2.89Å; E283-K286 VanDerWaalsContact O-N 3.11Å; K286-M288 VanDerWaalsContact C-N 3.33Å; K286-D289 PolarHBondContact O-N 2.82Å; K286-I290 VanDerWaalsContact O-CG1 3.26Å; K286-I290 WeakPolarHBondContact O-CG1 3.49Å; K286-I290 PolarHBondContact O-N 3.18Å
287F95.9Very high95.2Very high136 Ų136100.7 Ų100.760%0.59651%0.513SS*.Hα-helixtrans-60.9-42.6174.6-84-68.1000111.8E283 L284 K285 I290 L291E283-F287 VanDerWaalsContact O-CD2 3.27Å; E283-F287 WeakPolarHBondContact O-CD2 3.4Å; E283-F287 PolarHBondContact O-N 2.93Å; L284-F287 PolarHBondContact O-N 3.39Å; K285-F287 VanDerWaalsContact C-N 3.32Å; K285-F287 PolarHBondContact O-N 3.03Å; F287-I290 PolarHBondContact O-N 3.04Å; F287-L291 WeakPolarHBondContact O-CG 3.42Å; F287-L291 PolarHBondContact O-N 3.28Å
288M94.7Very high94.9Very high97 Ų9799 Ų9948%0.47851%0.507SS..Hα-helixtrans-60.9-49.2175-163.570.470.900111.4L284 K285 K286 I290 L291 D292L284-M288 WeakPolarHBondContact O-CB 3.38Å; L284-M288 PolarHBondContact O-N 3.1Å; K285-M288 WeakPolarHBondContact O-CB 3.47Å; K285-M288 PolarHBondContact O-N 3.34Å; K285-M288 VanDerWaalsContact O-N 3.13Å; K286-M288 VanDerWaalsContact C-N 3.33Å; M288-I290 VanDerWaalsContact C-N 3.27Å; M288-I290 PolarHBondContact O-N 2.96Å; M288-L291 WeakPolarHBondContact O-CB 3.41Å; M288-L291 PolarHBondContact O-N 3.38Å; M288-D292 PolarHBondContact O-N 2.85Å
289D94.9Very high94.6Very high90 Ų90101.9 Ų101.948%0.48151%0.51SS..Hα-helixtrans-59.2-37.7178.9-61.7-25.2000111.5K285 K286 G293K285-D289 VanDerWaalsContact O-CG 3.22Å; K285-D289 PolarHBondContact O-N 2.83Å; K286-D289 PolarHBondContact O-N 2.82Å; D289-G293 PolarHBondContact O-N 3.41Å
290I95.8Very high94.3Very high102 Ų102104.2 Ų104.252%0.52352%0.518SS..Hα-helixtrans-66.6-43.9174-68.4164.4000111.3K286 F287 M288 G293 K294K286-I290 VanDerWaalsContact O-CG1 3.26Å; K286-I290 WeakPolarHBondContact O-CG1 3.49Å; K286-I290 PolarHBondContact O-N 3.18Å; F287-I290 PolarHBondContact O-N 3.04Å; M288-I290 VanDerWaalsContact C-N 3.27Å; M288-I290 PolarHBondContact O-N 2.96Å; I290-G293 PolarHBondContact O-N 3.41Å; I290-K294 HydrophobicContact CG2-CG 4.44Å; I290-K294 WeakPolarHBondContact O-CB 3.27Å; I290-K294 VanDerWaalsContact O-CG 3.31Å; I290-K294 WeakPolarHBondContact O-CG 3.47Å; I290-K294 PolarHBondContact O-N 2.92Å
291L94.8Very high93.8Very high104 Ų104104.8 Ų104.855%0.54552%0.517SS..Hα-helixtrans-63.9-42.7178-76172.3000111.5F287 M288 K294 L295F287-L291 WeakPolarHBondContact O-CG 3.42Å; F287-L291 PolarHBondContact O-N 3.28Å; M288-L291 WeakPolarHBondContact O-CB 3.41Å; M288-L291 PolarHBondContact O-N 3.38Å; L291-K294 CarbonylContact O-C 3.52Å; L291-K294 PolarHBondContact O-N 2.99Å; L291-L295 WeakPolarHBondContact O-CG 3.26Å; L291-L295 PolarHBondContact O-N 3.38Å
292D95.3Very high93.4Very high76 Ų76104.9 Ų104.941%0.40651%0.513SS..Hα-helixtrans-59.5-47.7174.6-72.5-24.3000110.4M288 K294 L295 D296M288-D292 PolarHBondContact O-N 2.85Å; D292-K294 VanDerWaalsContact C-N 3.31Å; D292-K294 PolarHBondContact O-N 2.92Å; D292-L295 WeakPolarHBondContact O-CB 3.47Å; D292-L295 PolarHBondContact O-N 3.13Å; D292-L295 VanDerWaalsContact O-N 3.1Å; D292-D296 PolarHBondContact O-N 3.04Å
293G93.9Very high92.8Very high29 Ų29109.1 Ų109.130%0.29952%0.524SS..Hα-helixtrans-60.1-38.1174.100000113.4D289 I290 D296 E297D289-G293 PolarHBondContact O-N 3.41Å; I290-G293 PolarHBondContact O-N 3.41Å; G293-D296 PolarHBondContact O-N 3.49Å; G293-E297 WeakPolarHBondContact O-CG 3.41Å; G293-E297 PolarHBondContact O-N 3.21Å
294K94.3Very high92.1Very high100 Ų100105.8 Ų105.844%0.43552%0.516SS..Hα-helixtrans-68.4-34.4174.4-74.2-74.5166.8-127.90112.8I290 L291 D292 E297 L298I290-K294 HydrophobicContact CG2-CG 4.44Å; I290-K294 WeakPolarHBondContact O-CB 3.27Å; I290-K294 VanDerWaalsContact O-CG 3.31Å; I290-K294 WeakPolarHBondContact O-CG 3.47Å; I290-K294 PolarHBondContact O-N 2.92Å; L291-K294 CarbonylContact O-C 3.52Å; L291-K294 PolarHBondContact O-N 2.99Å; D292-K294 VanDerWaalsContact C-N 3.31Å; D292-K294 PolarHBondContact O-N 2.92Å; K294-E297 IonicContact NZ-OE1 3.36Å; K294-E297 PolarHBondContact NZ-OE1 3.11Å; K294-E297 IonicContact NZ-OE2 2.83Å; K294-E297 PolarHBondContact NZ-OE2 2.94Å; K294-L298 WeakPolarHBondContact O-CB 3.5Å; K294-L298 WeakPolarHBondContact O-CG 3.32Å; K294-L298 PolarHBondContact O-N 2.92Å
295L93.1Very high91.3Very high91 Ų91105 Ų10548%0.47651%0.512SS..Hα-helixtrans-65.9-41.2173-76.9168.5000111L291 D292 L298 H299L291-L295 WeakPolarHBondContact O-CG 3.26Å; L291-L295 PolarHBondContact O-N 3.38Å; D292-L295 WeakPolarHBondContact O-CB 3.47Å; D292-L295 PolarHBondContact O-N 3.13Å; D292-L295 VanDerWaalsContact O-N 3.1Å; L295-L298 PolarHBondContact O-N 2.91Å; L295-H299 WeakPolarHBondContact O-CB 3.42Å; L295-H299 PolarHBondContact O-CD2 2.84Å; L295-H299 PolarHBondContact O-N 3.35Å
296D92.3Very high90.5Very high105 Ų105102.2 Ų102.256%0.56151%0.51SS*.Hα-helixtrans-61.6-48.7174.9-71.7-24.4000111.2D292 G293 L298 H299 E300D292-D296 PolarHBondContact O-N 3.04Å; G293-D296 PolarHBondContact O-N 3.49Å; D296-L298 VanDerWaalsContact C-N 3.34Å; D296-L298 PolarHBondContact O-N 3.44Å; D296-H299 WeakPolarHBondContact O-CA 3.5Å; D296-H299 WeakPolarHBondContact O-CB 3.43Å; D296-H299 PolarHBondContact O-N 3.49Å; D296-H299 VanDerWaalsContact O-N 3.09Å; D296-E300 PolarHBondContact O-N 2.88Å
297E92.7Very high89.4Confident102 Ų102102.8 Ų102.848%0.47751%0.513SS..Hα-helixtrans-56.2-45.1174.2-73.4174.2-153.700112G293 K294 H299 E300 F301G293-E297 WeakPolarHBondContact O-CG 3.41Å; G293-E297 PolarHBondContact O-N 3.21Å; K294-E297 IonicContact NZ-OE1 3.36Å; K294-E297 PolarHBondContact NZ-OE1 3.11Å; K294-E297 IonicContact NZ-OE2 2.83Å; K294-E297 PolarHBondContact NZ-OE2 2.94Å; E297-H299 VanDerWaalsContact C-N 3.33Å; E297-H299 PolarHBondContact O-N 3.09Å; E297-E300 PolarHBondContact O-N 2.81Å; E297-F301 WeakPolarHBondContact O-CB 3.38Å; E297-F301 PolarHBondContact O-N 2.86Å
298L91.2Very high87.9Confident102 Ų102102.7 Ų102.753%0.53452%0.518SS..Hα-helixtrans-64.7-36.8176.3-82.3169.2000112.2K294 L295 D296 R302K294-L298 WeakPolarHBondContact O-CB 3.5Å; K294-L298 WeakPolarHBondContact O-CG 3.32Å; K294-L298 PolarHBondContact O-N 2.92Å; L295-L298 PolarHBondContact O-N 2.91Å; D296-L298 VanDerWaalsContact C-N 3.34Å; D296-L298 PolarHBondContact O-N 3.44Å; L298-R302 VanDerWaalsContact O-CB 3.32Å; L298-R302 WeakPolarHBondContact O-CB 3.37Å; L298-R302 PolarHBondContact O-N 3.35Å
299H89.1Confident86.2Confident100 Ų100100.8 Ų100.846%0.46352%0.523SS..Hα-helixtrans-65.2-44.8174.3-94.2-64.7000111.5L295 D296 E297 R302 Q303L295-H299 WeakPolarHBondContact O-CB 3.42Å; L295-H299 PolarHBondContact O-CD2 2.84Å; L295-H299 PolarHBondContact O-N 3.35Å; D296-H299 WeakPolarHBondContact O-CA 3.5Å; D296-H299 WeakPolarHBondContact O-CB 3.43Å; D296-H299 PolarHBondContact O-N 3.49Å; D296-H299 VanDerWaalsContact O-N 3.09Å; E297-H299 VanDerWaalsContact C-N 3.33Å; E297-H299 PolarHBondContact O-N 3.09Å; H299-R302 PolarHBondContact O-N 3.01Å; H299-Q303 WeakPolarHBondContact O-CG 3.45Å; H299-Q303 PolarHBondContact O-N 3.5Å
300E88.4Confident84.4Confident145 Ų145102 Ų10268%0.67853%0.533SS*.Hα-helixtrans-60.4-45.7173.4-72.2-168.5163.900111.5D296 E297 R302 Q303 G304D296-E300 PolarHBondContact O-N 2.88Å; E297-E300 PolarHBondContact O-N 2.81Å; E300-R302 PolarHBondContact O-N 3.01Å; E300-Q303 PolarHBondContact O-N 3.25Å; E300-G304 PolarHBondContact O-N 3.37Å
301F87.5Confident82.2Confident134 Ų134103.9 Ų103.959%0.58854%0.544SS*.Hα-helixtrans-60.7-43.6177.1-174.7-105000111.9E297 Q303 G304 L305E297-F301 WeakPolarHBondContact O-CB 3.38Å; E297-F301 PolarHBondContact O-N 2.86Å; F301-Q303 PolarHBondContact O-N 3.4Å; F301-G304 PolarHBondContact O-N 3.38Å; F301-L305 HydrophobicContact CD1-CD1 3.77Å; F301-L305 HydrophobicContact CD1-CG 4.3Å; F301-L305 HydrophobicContact CE1-CD1 3.31Å; F301-L305 HydrophobicContact CE1-CG 3.94Å; F301-L305 HydrophobicContact CZ-CD1 3.88Å; F301-L305 HydrophobicContact CZ-CD2 4.34Å; F301-L305 HydrophobicContact CZ-CG 4.09Å; F301-L305 PolarHBondContact O-N 2.98Å
302R86.8Confident79.5Confident163 Ų163109.3 Ų109.362%0.61557%0.574SS**Hα-helixtrans-61.5-42.6175-170.8-168.8-52.4-94.6-1.4111.8L298 H299 E300 S306L298-R302 VanDerWaalsContact O-CB 3.32Å; L298-R302 WeakPolarHBondContact O-CB 3.37Å; L298-R302 PolarHBondContact O-N 3.35Å; H299-R302 PolarHBondContact O-N 3.01Å; E300-R302 PolarHBondContact O-N 3.01Å; R302-S306 WeakPolarHBondContact O-CB 3.31Å; R302-S306 PolarHBondContact O-N 2.89Å
303Q84.1Confident78.7Confident123 Ų123111 Ų11158%0.57558%0.582SS**Hα-helixtrans-64.7-40.4174.8-72.5-177.133.800111.8H299 E300 F301 S306 K307H299-Q303 WeakPolarHBondContact O-CG 3.45Å; H299-Q303 PolarHBondContact O-N 3.5Å; E300-Q303 PolarHBondContact O-N 3.25Å; F301-Q303 PolarHBondContact O-N 3.4Å; Q303-S306 WeakPolarHBondContact O-CB 3.47Å; Q303-S306 PolarHBondContact O-N 3.09Å; Q303-K307 PolarHBondContact O-N 3.12Å
304G81.5Confident77.9Confident30 Ų30115.3 Ų115.331%0.30960%0.597SS.*Hα-helixtrans-60.9-48.3174.400000112.4E300 F301 S306 K307 L308E300-G304 PolarHBondContact O-N 3.37Å; F301-G304 PolarHBondContact O-N 3.38Å; G304-S306 VanDerWaalsContact C-N 3.32Å; G304-S306 PolarHBondContact O-N 3.24Å; G304-K307 WeakPolarHBondContact O-CB 3.48Å; G304-K307 PolarHBondContact O-N 3.01Å; G304-K307 VanDerWaalsContact O-N 3.12Å; G304-L308 WeakPolarHBondContact O-CD1 3.39Å; G304-L308 PolarHBondContact O-N 3.43Å; G304-L308 VanDerWaalsContact O-N 3.09Å
305L78.7Confident77Confident97 Ų97116.2 Ų116.251%0.50861%0.606SS.*Hα-helixtrans-60-40.6173.1-77.1176.9000112.2F301 K307 L308 G309F301-L305 HydrophobicContact CD1-CD1 3.77Å; F301-L305 HydrophobicContact CD1-CG 4.3Å; F301-L305 HydrophobicContact CE1-CD1 3.31Å; F301-L305 HydrophobicContact CE1-CG 3.94Å; F301-L305 HydrophobicContact CZ-CD1 3.88Å; F301-L305 HydrophobicContact CZ-CD2 4.34Å; F301-L305 HydrophobicContact CZ-CG 4.09Å; F301-L305 PolarHBondContact O-N 2.98Å; L305-K307 VanDerWaalsContact C-N 3.26Å; L305-K307 PolarHBondContact O-N 3.37Å; L305-L308 PolarHBondContact O-N 3.3Å; L305-G309 PolarHBondContact O-N 2.85Å
306S79.1Confident76.1Confident80 Ų80117.6 Ų117.656%0.55961%0.614SS**Hα-helixtrans-63.8-30.3176-168.40000112.6R302 Q303 G304 V310R302-S306 WeakPolarHBondContact O-CB 3.31Å; R302-S306 PolarHBondContact O-N 2.89Å; Q303-S306 WeakPolarHBondContact O-CB 3.47Å; Q303-S306 PolarHBondContact O-N 3.09Å; G304-S306 VanDerWaalsContact C-N 3.32Å; G304-S306 PolarHBondContact O-N 3.24Å; S306-V310 WeakPolarHBondContact O-CG2 3.39Å
307K72.4Confident75.1Confident153 Ų153118.4 Ų118.467%0.66562%0.617SS**Hα-helixtrans-72.9-40.3173.2-76.5175.5179.2173.60112Q303 G304 L305 G309 V310Q303-K307 PolarHBondContact O-N 3.12Å; G304-K307 WeakPolarHBondContact O-CB 3.48Å; G304-K307 PolarHBondContact O-N 3.01Å; G304-K307 VanDerWaalsContact O-N 3.12Å; L305-K307 VanDerWaalsContact C-N 3.26Å; L305-K307 PolarHBondContact O-N 3.37Å; K307-G309 VanDerWaalsContact C-N 3.27Å; K307-G309 PolarHBondContact O-N 3.25Å; K307-V310 PolarHBondContact O-N 2.68Å
308L64.7Low73.9Confident134 Ų134119.5 Ų119.570%0.70263%0.627SS**Hα-helixtrans-66.3-26.9173.6-90.599.4000113.3G304 L305 V310G304-L308 WeakPolarHBondContact O-CD1 3.39Å; G304-L308 PolarHBondContact O-N 3.43Å; G304-L308 VanDerWaalsContact O-N 3.09Å; L305-L308 PolarHBondContact O-N 3.3Å; L308-V310 VanDerWaalsContact C-N 3.29Å; L308-V310 PolarHBondContact O-N 2.83Å
309G59.5Low72.6Confident56 Ų56120.8 Ų120.858%0.57763%0.633SS**THydrogen-bonded Turntrans-77.9-6.6175.200000115.2L305 K307L305-G309 PolarHBondContact O-N 2.85Å; K307-G309 VanDerWaalsContact C-N 3.27Å; K307-G309 PolarHBondContact O-N 3.25Å
310V56.4Low71.4Confident115 Ų115122.4 Ų122.470%0.69765%0.646SS**THydrogen-bonded Turntrans-96.2-14.6176.6174.20000111.6S306 K307 L308S306-V310 WeakPolarHBondContact O-CG2 3.39Å; K307-V310 PolarHBondContact O-N 2.68Å; L308-V310 VanDerWaalsContact C-N 3.29Å; L308-V310 PolarHBondContact O-N 2.83Å
311D50.2Low70Confident142 Ų142120.5 Ų120.576%0.75964%0.644SS**  trans-97.526.1179.7-75-23.2000113.8
312N38.6Very low68.4Low219 Ų219119.3 Ų119.3100%1.17165%0.649SS**  trans-1440172.8-141.734.1000112.8

Retrieved 312 of 312 residues in 136.7 ms (Link to these results)

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