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Isoform C of 14-3-3 protein epsilon AlphaSync

Canonical isoform description: Positively regulates Ras-mediated pathways. Acts downstream or parallel to Raf, but upstream of nuclear factors in Ras signaling. Three mutants have been isolated, that suppress the rough eye phenotype caused by mutated Ras1 (sev-Ras1 v12). Inhibits yki activity by restricting its nuclear localization. Together with pav, has a role in the inhibition of microtubule sliding during neurite outgrowth1.

AlphaFold DB , UniProt , Accession P92177-4 (canonical: P92177), Species DROME (Drosophila melanogaster, Fruit fly), Gene 14-3-3epsilon, Length 256 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
1M71.4Confident94.8Very high164 Ų16476.5 Ų76.581%0.80836%0.362SS*.  0127.50-69.1-173.1-68.800108.4E5 N6M1-E5 WeakPolarHBondContact CA-OE2 3.05Å; M1-E5 HydrophobicContact CB-CB 4.21Å; M1-N6 WeakPolarHBondContact CB-OD1 3.41Å; M1-N6 WeakPolarHBondContact CE-OD1 3.48Å
2T92.5Very high95.1Very high76 Ų7675.1 Ų75.147%0.46635%0.353SS..  trans-66.3166.3172.365.40000110.6R4 E5 N6T2-R4 PolarHBondContact O-N 3.2Å; T2-E5 PolarHBondContact N-OE2 2.84Å; T2-E5 PolarHBondContact O-N 3.22Å; T2-E5 VanDerWaalsContact OG1-CG 3.28Å; T2-E5 WeakPolarHBondContact OG1-CG 3.35Å; T2-E5 PolarHBondContact OG1-N 3.49Å; T2-N6 VanDerWaalsContact O-CG 3.27Å; T2-N6 PolarHBondContact O-N 2.63Å; T2-N6 PolarHBondContact O-ND2 2.78Å
3E94.7Very high95.3Very high133 Ų13375.4 Ų75.462%0.62136%0.358SS*.Hα-helixtrans-59.3-37.5174.7-173.2176.3-172.600112N6 N7 M33E3-N6 PolarHBondContact O-N 2.98Å; E3-N7 PolarHBondContact O-N 3.08Å; E3-N7 VanDerWaalsContact O-N 3.08Å; E3-N7 PolarHBondContact O-ND2 3.21Å; E3-M33 HydrophobicContact CB-CE 3.93Å; E3-M33 HydrophobicContact CG-CE 3.66Å
4R97.7Very high95.5Very high41 Ų4170.6 Ų70.616%0.15534%0.337CS..Hα-helixtrans-61.4-53.2175.8-167172.1175.1131-18.4111.2T2 N6 N7 V8 V30 M33 V35 E36 E41T2-R4 PolarHBondContact O-N 3.2Å; R4-N6 VanDerWaalsContact C-N 3.28Å; R4-N6 PolarHBondContact O-N 2.98Å; R4-N7 PolarHBondContact O-N 3.27Å; R4-N7 VanDerWaalsContact O-N 3.11Å; R4-V8 WeakPolarHBondContact O-CG2 3.36Å; R4-V8 PolarHBondContact O-N 2.93Å; R4-V30 HydrophobicContact CG-CG1 4Å; R4-V30 HydrophobicContact CG-CG2 4.49Å; R4-M33 HydrophobicContact CB-CE 4.27Å; R4-M33 HydrophobicContact CB-SD 3.65Å; R4-M33 HydrophobicContact CG-SD 3.94Å; R4-V35 PolarHBondContact NH1-O 2.91Å; R4-E36 PolarHBondContact NH2-O 2.92Å; R4-E41 IonicContact CZ-OE1 3.94Å; R4-E41 IonicContact CZ-OE2 3.5Å; R4-E41 IonicContact NE-OE1 3.9Å; R4-E41 PolarHBondContact NE-OE1 2.98Å; R4-E41 IonicContact NE-OE2 2.71Å; R4-E41 VanDerWaalsContact NH2-CD 3.31Å; R4-E41 IonicContact NH2-OE1 3.52Å; R4-E41 PolarHBondContact NH2-OE1 3.21Å; R4-E41 IonicContact NH2-OE2 3.77Å; R4-E41 PolarHBondContact NH2-OE2 3.45Å
5E97.4Very high95.6Very high102 Ų10270.8 Ų70.848%0.47734%0.338SS..Hα-helixtrans-57.6-40.3177.7-71.6165.4179.700112.1M1 T2 Y9M1-E5 WeakPolarHBondContact CA-OE2 3.05Å; M1-E5 HydrophobicContact CB-CB 4.21Å; T2-E5 PolarHBondContact N-OE2 2.84Å; T2-E5 PolarHBondContact O-N 3.22Å; T2-E5 VanDerWaalsContact OG1-CG 3.28Å; T2-E5 WeakPolarHBondContact OG1-CG 3.35Å; T2-E5 PolarHBondContact OG1-N 3.49Å; E5-Y9 VanDerWaalsContact O-CB 3.31Å; E5-Y9 WeakPolarHBondContact O-CB 3.09Å; E5-Y9 PolarHBondContact O-N 3.27Å
6N97.6Very high95.7Very high59 Ų5976.6 Ų76.632%0.31636%0.364SS..Hα-helixtrans-63.2-42176.8-73.6-29.6000112.3M1 T2 E3 R4 K10M1-N6 WeakPolarHBondContact CB-OD1 3.41Å; M1-N6 WeakPolarHBondContact CE-OD1 3.48Å; T2-N6 VanDerWaalsContact O-CG 3.27Å; T2-N6 PolarHBondContact O-N 2.63Å; T2-N6 PolarHBondContact O-ND2 2.78Å; E3-N6 PolarHBondContact O-N 2.98Å; R4-N6 VanDerWaalsContact C-N 3.28Å; R4-N6 PolarHBondContact O-N 2.98Å; N6-K10 WeakPolarHBondContact O-CB 3.43Å; N6-K10 VanDerWaalsContact O-CG 3.27Å; N6-K10 WeakPolarHBondContact O-CG 3.48Å; N6-K10 PolarHBondContact O-N 3.14Å
7N98.3Very high95.8Very high7 Ų775.6 Ų75.64%0.03737%0.372CS..Hα-helixtrans-71.9-41179-74.8-58.8000111.6E3 R4 Y9 K10 A11 A26 K29 V30E3-N7 PolarHBondContact O-N 3.08Å; E3-N7 VanDerWaalsContact O-N 3.08Å; E3-N7 PolarHBondContact O-ND2 3.21Å; R4-N7 PolarHBondContact O-N 3.27Å; R4-N7 VanDerWaalsContact O-N 3.11Å; N7-Y9 VanDerWaalsContact C-N 3.35Å; N7-Y9 PolarHBondContact O-N 3.45Å; N7-K10 PolarHBondContact O-N 3.33Å; N7-A11 PolarHBondContact O-N 3.42Å; N7-A26 HydrophobicContact CB-CB 4.46Å; N7-K29 WeakPolarHBondContact OD1-CD 3.01Å; N7-V30 HydrophobicContact CB-CG2 3.56Å
8V98.4Very high95.9Very high13 Ų1379.8 Ų79.88%0.07939%0.391CS..Hα-helixtrans-60.7-44.6174.2174.90000111.1R4 K10 A11 K12 V30 E41 L44R4-V8 WeakPolarHBondContact O-CG2 3.36Å; R4-V8 PolarHBondContact O-N 2.93Å; V8-K10 PolarHBondContact O-N 2.64Å; V8-A11 PolarHBondContact O-N 3.17Å; V8-K12 HydrophobicContact CG1-CD 4.49Å; V8-K12 WeakPolarHBondContact O-CG 3.24Å; V8-K12 PolarHBondContact O-N 2.7Å; V8-V30 HydrophobicContact CG2-CG1 4.39Å; V8-V30 HydrophobicContact CG2-CG2 3.9Å; V8-E41 HydrophobicContact CG1-CG 4.48Å; V8-E41 HydrophobicContact CG2-CG 3.74Å; V8-E41 WeakPolarHBondContact CG2-OE1 3.29Å; V8-L44 HydrophobicContact CG1-CD1 3.99Å
9Y98.2Very high96Very high128 Ų12882.7 Ų82.750%0.50240%0.397SS..Hα-helixtrans-63.6-39.8176.6-175.7-111.9000112.4E5 N7 K12 L13E5-Y9 VanDerWaalsContact O-CB 3.31Å; E5-Y9 WeakPolarHBondContact O-CB 3.09Å; E5-Y9 PolarHBondContact O-N 3.27Å; N7-Y9 VanDerWaalsContact C-N 3.35Å; N7-Y9 PolarHBondContact O-N 3.45Å; Y9-K12 PolarHBondContact O-N 2.93Å; Y9-L13 HydrophobicContact CD1-CD1 3.98Å; Y9-L13 HydrophobicContact CD1-CG 4.44Å; Y9-L13 HydrophobicContact CE1-CD1 3.51Å; Y9-L13 HydrophobicContact CE1-CG 4.07Å; Y9-L13 WeakPolarHBondContact O-CG 3.44Å; Y9-L13 PolarHBondContact O-N 3.5Å
10K98.1Very high96.1Very high119 Ų11981.3 Ų81.352%0.51739%0.388SS..Hα-helixtrans-61.9-42.1173.1-77.2174.7-177.7-178.60112.3N6 N7 V8 K12 L13 A14 A26N6-K10 WeakPolarHBondContact O-CB 3.43Å; N6-K10 VanDerWaalsContact O-CG 3.27Å; N6-K10 WeakPolarHBondContact O-CG 3.48Å; N6-K10 PolarHBondContact O-N 3.14Å; N7-K10 PolarHBondContact O-N 3.33Å; V8-K10 PolarHBondContact O-N 2.64Å; K10-K12 VanDerWaalsContact C-N 3.34Å; K10-K12 PolarHBondContact O-N 3.41Å; K10-L13 PolarHBondContact O-N 3.01Å; K10-A14 VanDerWaalsContact O-CB 3.31Å; K10-A14 WeakPolarHBondContact O-CB 3.44Å; K10-A14 PolarHBondContact O-N 2.61Å; K10-A26 HydrophobicContact CB-CB 4.31Å
11A98.4Very high96.2Very high0 Ų081.4 Ų81.40%039%0.39CS..Hα-helixtrans-61-43.5176.300000111.2N7 V8 L13 A14 E15 M23 A26 M27N7-A11 PolarHBondContact O-N 3.42Å; V8-A11 PolarHBondContact O-N 3.17Å; A11-L13 PolarHBondContact O-N 3.13Å; A11-A14 PolarHBondContact O-N 3.13Å; A11-E15 WeakPolarHBondContact O-CB 3.33Å; A11-E15 PolarHBondContact O-N 3.31Å; A11-M23 WeakPolarHBondContact O-CG 3.41Å; A11-A26 HydrophobicContact CB-CB 4.16Å; A11-M27 HydrophobicContact CB-CG 3.78Å; A11-M27 HydrophobicContact CB-SD 3.57Å; A11-M27 VanDerWaalsContact CB-SD 3.57Å
12K98.3Very high97.4Very high59 Ų5976.7 Ų76.726%0.25737%0.366SS..Hα-helixtrans-62.2-41.1175.2-68.5177.1-179.7-175.50113.2V8 Y9 K10 A14 Q16 E40 L44V8-K12 HydrophobicContact CG1-CD 4.49Å; V8-K12 WeakPolarHBondContact O-CG 3.24Å; V8-K12 PolarHBondContact O-N 2.7Å; Y9-K12 PolarHBondContact O-N 2.93Å; K10-K12 VanDerWaalsContact C-N 3.34Å; K10-K12 PolarHBondContact O-N 3.41Å; K12-A14 VanDerWaalsContact C-N 3.35Å; K12-Q16 WeakPolarHBondContact O-CG 3.4Å; K12-Q16 PolarHBondContact O-N 2.82Å; K12-E40 VanDerWaalsContact CE-CD 3.41Å; K12-E40 WeakPolarHBondContact CE-OE1 3.46Å; K12-E40 IonicContact NZ-OE1 3.88Å; K12-E40 PolarHBondContact NZ-OE1 2.81Å; K12-E40 IonicContact NZ-OE2 2.79Å; K12-E40 PolarHBondContact NZ-OE2 2.73Å; K12-L44 HydrophobicContact CG-CD1 3.95Å; K12-L44 HydrophobicContact CG-CD2 4.18Å
13L98.2Very high97.7Very high79 Ų7973 Ų7341%0.41434%0.344SS..Hα-helixtrans-66.1-39.3174.9-71.5178.2000111.9Y9 K10 A11 A17Y9-L13 HydrophobicContact CD1-CD1 3.98Å; Y9-L13 HydrophobicContact CD1-CG 4.44Å; Y9-L13 HydrophobicContact CE1-CD1 3.51Å; Y9-L13 HydrophobicContact CE1-CG 4.07Å; Y9-L13 WeakPolarHBondContact O-CG 3.44Å; Y9-L13 PolarHBondContact O-N 3.5Å; K10-L13 PolarHBondContact O-N 3.01Å; A11-L13 PolarHBondContact O-N 3.13Å; L13-A17 PolarHBondContact O-N 3.08Å
14A98.2Very high97.9Very high9 Ų967.4 Ų67.47%0.07432%0.319CS..Hα-helixtrans-68.6-38177.900000111.6K10 A11 K12 A17 E18 R19 E22 M23K10-A14 VanDerWaalsContact O-CB 3.31Å; K10-A14 WeakPolarHBondContact O-CB 3.44Å; K10-A14 PolarHBondContact O-N 2.61Å; A11-A14 PolarHBondContact O-N 3.13Å; K12-A14 VanDerWaalsContact C-N 3.35Å; A14-A17 CarbonylContact O-C 3.59Å; A14-A17 PolarHBondContact O-N 3.02Å; A14-A17 VanDerWaalsContact O-N 3.11Å; A14-E18 PolarHBondContact O-N 2.88Å; A14-R19 HydrophobicContact CB-CB 4.06Å; A14-R19 PolarHBondContact O-N 3.38Å; A14-E22 HydrophobicContact CB-CB 4.09Å; A14-M23 HydrophobicContact CB-CG 3.52Å
15E97.3Very high97.9Very high73 Ų7371.1 Ų71.134%0.34134%0.338SS..Hα-helixtrans-57-51172.9-173.7180-151.900111.8A11 A17 E18 M23 L44A11-E15 WeakPolarHBondContact O-CB 3.33Å; A11-E15 PolarHBondContact O-N 3.31Å; E15-A17 PolarHBondContact O-N 3.12Å; E15-A17 VanDerWaalsContact O-N 3.13Å; E15-E18 PolarHBondContact O-N 3.38Å; E15-M23 WeakPolarHBondContact CA-SD 3.41Å; E15-M23 HydrophobicContact CB-CE 3.62Å; E15-M23 HydrophobicContact CB-SD 3.57Å; E15-M23 VanDerWaalsContact CB-SD 3.57Å; E15-M23 HydrophobicContact CG-CE 3.94Å; E15-M23 HydrophobicContact CG-SD 4.12Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.21Å
16Q96.8Very high98Very high163 Ų16366.6 Ų66.676%0.76232%0.318SS*.Hα-helixtrans-63-20.1177.8-68.8176.92700113.5K12K12-Q16 WeakPolarHBondContact O-CG 3.4Å; K12-Q16 PolarHBondContact O-N 2.82Å
17A97.5Very high98Very high61 Ų6163.8 Ų63.850%0.50430%0.303SS..THydrogen-bonded Turntrans-101.96.6177.100000112.9L13 A14 E15 R19L13-A17 PolarHBondContact O-N 3.08Å; A14-A17 CarbonylContact O-C 3.59Å; A14-A17 PolarHBondContact O-N 3.02Å; A14-A17 VanDerWaalsContact O-N 3.11Å; E15-A17 PolarHBondContact O-N 3.12Å; E15-A17 VanDerWaalsContact O-N 3.13Å; A17-R19 HydrophobicContact CB-CB 4.49Å; A17-R19 HydrophobicContact CB-CG 4Å; A17-R19 WeakPolarHBondContact O-CG 3.41Å; A17-R19 PolarHBondContact O-N 3.29Å
18E96.7Very high98Very high150 Ų15066.6 Ų66.670%0.70132%0.315SS*.THydrogen-bonded Turntrans54.132-176.4-57.8-179.4162.700113.3A14 E15 Y20A14-E18 PolarHBondContact O-N 2.88Å; E15-E18 PolarHBondContact O-N 3.38Å; E18-Y20 HydrophobicContact CB-CE2 3.99Å; E18-Y20 WeakPolarHBondContact O-CD2 3.42Å; E18-Y20 PolarHBondContact O-N 3.19Å
19R98Very high98Very high136 Ų13670.6 Ų70.651%0.51333%0.331SS..  trans-96.965.5-178.4-73.3-160.475.2170.914.5111.1A14 A17 D21 E22 M23A14-R19 HydrophobicContact CB-CB 4.06Å; A14-R19 PolarHBondContact O-N 3.38Å; A17-R19 HydrophobicContact CB-CB 4.49Å; A17-R19 HydrophobicContact CB-CG 4Å; A17-R19 WeakPolarHBondContact O-CG 3.41Å; A17-R19 PolarHBondContact O-N 3.29Å; R19-D21 VanDerWaalsContact C-N 3.33Å; R19-D21 PolarHBondContact O-N 2.95Å; R19-E22 HydrophobicContact CB-CB 4.42Å; R19-E22 WeakPolarHBondContact CB-OE2 3.4Å; R19-E22 VanDerWaalsContact CZ-CD 3.44Å; R19-E22 IonicContact CZ-OE1 2.63Å; R19-E22 IonicContact CZ-OE2 3.66Å; R19-E22 VanDerWaalsContact NE-CD 3.27Å; R19-E22 IonicContact NE-OE1 3.82Å; R19-E22 PolarHBondContact NE-OE1 2.93Å; R19-E22 IonicContact NE-OE2 3.79Å; R19-E22 PolarHBondContact NE-OE2 3.45Å; R19-E22 VanDerWaalsContact NH2-CD 3.31Å; R19-E22 IonicContact NH2-OE1 2.69Å; R19-E22 PolarHBondContact NH2-OE1 3.32Å; R19-E22 IonicContact NH2-OE2 3.81Å; R19-E22 PolarHBondContact O-N 3.33Å; R19-M23 PolarHBondContact O-N 2.73Å; R19-M23 VanDerWaalsContact O-N 3.08Å
20Y97.9Very high98Very high54 Ų5464.5 Ų64.521%0.21231%0.307CS..Hα-helixtrans-66.9-29.3-170.3-56.1-70.9000114.2E18 M23 V24 V47 N51E18-Y20 HydrophobicContact CB-CE2 3.99Å; E18-Y20 WeakPolarHBondContact O-CD2 3.42Å; E18-Y20 PolarHBondContact O-N 3.19Å; Y20-M23 HydrophobicContact CD1-SD 3.51Å; Y20-M23 VanDerWaalsContact CD1-SD 3.51Å; Y20-M23 HydrophobicContact CE1-SD 4.02Å; Y20-M23 WeakPolarHBondContact O-CB 3.42Å; Y20-M23 PolarHBondContact O-N 2.85Å; Y20-V24 WeakPolarHBondContact O-CG2 3.42Å; Y20-V24 PolarHBondContact O-N 3.32Å; Y20-V47 HydrophobicContact CE1-CG1 4.24Å; Y20-N51 HydrophobicContact CD1-CB 3.5Å; Y20-N51 VanDerWaalsContact CD1-CB 3.5Å; Y20-N51 HydrophobicContact CD2-CB 3.42Å; Y20-N51 VanDerWaalsContact CD2-CB 3.42Å; Y20-N51 HydrophobicContact CE1-CB 3.74Å; Y20-N51 VanDerWaalsContact CE1-CG 3.42Å; Y20-N51 VanDerWaalsContact CE1-ND2 3.34Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.35Å; Y20-N51 HydrophobicContact CE2-CB 3.65Å; Y20-N51 HydrophobicContact CG-CB 3.33Å
21D97.8Very high98Very high83 Ų8358.9 Ų58.944%0.44428%0.283SS..Hα-helixtrans-62.1-44.3173.5-67.1-59.4000110.9R19 M23 V24 E25R19-D21 VanDerWaalsContact C-N 3.33Å; R19-D21 PolarHBondContact O-N 2.95Å; D21-M23 VanDerWaalsContact C-N 3.34Å; D21-M23 PolarHBondContact O-N 2.69Å; D21-V24 WeakPolarHBondContact O-CB 3.32Å; D21-V24 PolarHBondContact O-N 2.73Å; D21-E25 PolarHBondContact O-N 3.21Å
22E98.1Very high98Very high65 Ų6561.7 Ų61.730%0.30430%0.303SS..Hα-helixtrans-67-33.1173.6-73.477.6-172.900113.1A14 R19 E25 A26A14-E22 HydrophobicContact CB-CB 4.09Å; R19-E22 HydrophobicContact CB-CB 4.42Å; R19-E22 WeakPolarHBondContact CB-OE2 3.4Å; R19-E22 VanDerWaalsContact CZ-CD 3.44Å; R19-E22 IonicContact CZ-OE1 2.63Å; R19-E22 IonicContact CZ-OE2 3.66Å; R19-E22 VanDerWaalsContact NE-CD 3.27Å; R19-E22 IonicContact NE-OE1 3.82Å; R19-E22 PolarHBondContact NE-OE1 2.93Å; R19-E22 IonicContact NE-OE2 3.79Å; R19-E22 PolarHBondContact NE-OE2 3.45Å; R19-E22 VanDerWaalsContact NH2-CD 3.31Å; R19-E22 IonicContact NH2-OE1 2.69Å; R19-E22 PolarHBondContact NH2-OE1 3.32Å; R19-E22 IonicContact NH2-OE2 3.81Å; R19-E22 PolarHBondContact O-N 3.33Å; E22-E25 PolarHBondContact O-N 2.98Å; E22-A26 WeakPolarHBondContact O-CB 3.45Å; E22-A26 PolarHBondContact O-N 2.83Å
23M98.1Very high97.9Very high0 Ų061.6 Ų61.60%030%0.304CS..Hα-helixtrans-61.6-45.3171.7-66.8-179.16900111A11 A14 E15 R19 Y20 D21 E25 A26 M27 L44 V47 A48A11-M23 WeakPolarHBondContact O-CG 3.41Å; A14-M23 HydrophobicContact CB-CG 3.52Å; E15-M23 WeakPolarHBondContact CA-SD 3.41Å; E15-M23 HydrophobicContact CB-CE 3.62Å; E15-M23 HydrophobicContact CB-SD 3.57Å; E15-M23 VanDerWaalsContact CB-SD 3.57Å; E15-M23 HydrophobicContact CG-CE 3.94Å; E15-M23 HydrophobicContact CG-SD 4.12Å; R19-M23 PolarHBondContact O-N 2.73Å; R19-M23 VanDerWaalsContact O-N 3.08Å; Y20-M23 HydrophobicContact CD1-SD 3.51Å; Y20-M23 VanDerWaalsContact CD1-SD 3.51Å; Y20-M23 HydrophobicContact CE1-SD 4.02Å; Y20-M23 WeakPolarHBondContact O-CB 3.42Å; Y20-M23 PolarHBondContact O-N 2.85Å; D21-M23 VanDerWaalsContact C-N 3.34Å; D21-M23 PolarHBondContact O-N 2.69Å; M23-E25 PolarHBondContact O-N 3.13Å; M23-A26 PolarHBondContact O-N 3.48Å; M23-M27 WeakPolarHBondContact O-CB 3.2Å; M23-M27 WeakPolarHBondContact O-CG 3.4Å; M23-M27 PolarHBondContact O-N 3.01Å; M23-L44 HydrophobicContact CE-CD2 4.02Å; M23-V47 HydrophobicContact CE-CB 4.48Å; M23-V47 HydrophobicContact CE-CG1 4.15Å; M23-A48 HydrophobicContact CB-CB 3.47Å; M23-A48 VanDerWaalsContact CB-CB 3.47Å; M23-A48 HydrophobicContact CE-CB 4.19Å; M23-A48 HydrophobicContact SD-CB 4.47Å
24V98.5Very high97.9Very high15 Ų1562 Ų629%0.09131%0.307CS..Hα-helixtrans-57.9-49.8176.4166.90000109.9Y20 D21 A26 M27 K28 A48 Y49 V52Y20-V24 WeakPolarHBondContact O-CG2 3.42Å; Y20-V24 PolarHBondContact O-N 3.32Å; D21-V24 WeakPolarHBondContact O-CB 3.32Å; D21-V24 PolarHBondContact O-N 2.73Å; V24-A26 VanDerWaalsContact C-N 3.33Å; V24-A26 PolarHBondContact O-N 3.31Å; V24-M27 PolarHBondContact O-N 3.5Å; V24-K28 HydrophobicContact CG1-CD 3.64Å; V24-K28 HydrophobicContact CG1-CG 4.19Å; V24-K28 WeakPolarHBondContact O-CB 3.37Å; V24-K28 WeakPolarHBondContact O-CG 3.34Å; V24-K28 PolarHBondContact O-N 3.23Å; V24-A48 HydrophobicContact CG2-CB 3.76Å; V24-Y49 HydrophobicContact CB-CE2 4.48Å; V24-Y49 HydrophobicContact CG1-CD1 4.45Å; V24-Y49 HydrophobicContact CG1-CE1 3.78Å; V24-Y49 HydrophobicContact CG1-CE2 3.84Å; V24-Y49 VanDerWaalsContact CG1-CZ 3.46Å; V24-Y49 HydrophobicContact CG2-CD1 4.05Å; V24-Y49 HydrophobicContact CG2-CD2 4.01Å; V24-Y49 HydrophobicContact CG2-CE1 4.2Å; V24-Y49 HydrophobicContact CG2-CE2 4.17Å; V24-Y49 HydrophobicContact CG2-CG 3.96Å; V24-V52 HydrophobicContact CG2-CG2 4.11Å
25E98.4Very high97.8Very high119 Ų11965.9 Ų65.956%0.55633%0.329SS*.Hα-helixtrans-58.3-42.5178.7-70.6-173.517100113.5D21 E22 M23 K29D21-E25 PolarHBondContact O-N 3.21Å; E22-E25 PolarHBondContact O-N 2.98Å; M23-E25 PolarHBondContact O-N 3.13Å; E25-K29 WeakPolarHBondContact O-CG 3.41Å
26A98.4Very high97.8Very high6 Ų665.2 Ų65.25%0.0533%0.326CS..Hα-helixtrans-68.7-47179.100000111.4N7 K10 A11 E22 M23 V24 K28 K29 V30N7-A26 HydrophobicContact CB-CB 4.46Å; K10-A26 HydrophobicContact CB-CB 4.31Å; A11-A26 HydrophobicContact CB-CB 4.16Å; E22-A26 WeakPolarHBondContact O-CB 3.45Å; E22-A26 PolarHBondContact O-N 2.83Å; M23-A26 PolarHBondContact O-N 3.48Å; V24-A26 VanDerWaalsContact C-N 3.33Å; V24-A26 PolarHBondContact O-N 3.31Å; A26-K28 PolarHBondContact O-N 3.46Å; A26-K29 WeakPolarHBondContact O-CB 3.44Å; A26-K29 PolarHBondContact O-N 3.46Å; A26-V30 PolarHBondContact O-N 3.11Å
27M98.5Very high97.9Very high0 Ų057.9 Ų57.90%029%0.292CS..Hα-helixtrans-72.2-28.1-176.9-67.7-51.2-53.300113A11 M23 V24 K29 V30 A31 E41 L44 L45A11-M27 HydrophobicContact CB-CG 3.78Å; A11-M27 HydrophobicContact CB-SD 3.57Å; A11-M27 VanDerWaalsContact CB-SD 3.57Å; M23-M27 WeakPolarHBondContact O-CB 3.2Å; M23-M27 WeakPolarHBondContact O-CG 3.4Å; M23-M27 PolarHBondContact O-N 3.01Å; V24-M27 PolarHBondContact O-N 3.5Å; M27-K29 VanDerWaalsContact C-N 3.31Å; M27-K29 PolarHBondContact O-N 3.33Å; M27-V30 HydrophobicContact CE-CB 4.1Å; M27-V30 HydrophobicContact CE-CG1 4.18Å; M27-V30 HydrophobicContact CE-CG2 4.31Å; M27-V30 WeakPolarHBondContact O-CB 3.45Å; M27-V30 PolarHBondContact O-N 3.02Å; M27-V30 HydrophobicContact SD-CG2 4.3Å; M27-A31 WeakPolarHBondContact O-CB 3.46Å; M27-A31 PolarHBondContact O-N 3.21Å; M27-E41 HydrophobicContact CE-CB 3.99Å; M27-E41 WeakPolarHBondContact CE-O 3.46Å; M27-L44 HydrophobicContact CE-CB 4.22Å; M27-L44 HydrophobicContact CG-CB 4.23Å; M27-L44 HydrophobicContact SD-CB 3.95Å; M27-L44 HydrophobicContact SD-CD1 4.38Å; M27-L45 HydrophobicContact CB-CB 4.17Å; M27-L45 HydrophobicContact CB-CD1 3.59Å; M27-L45 HydrophobicContact CE-CB 4.31Å
28K98.2Very high97.9Very high67 Ų6758.5 Ų58.529%0.29129%0.29SS..Hα-helixtrans-60.4-40.3168.7-75.2171.576.5169.30112.5V24 A26 V30 A31 S32 Y49 D99 V103V24-K28 HydrophobicContact CG1-CD 3.64Å; V24-K28 HydrophobicContact CG1-CG 4.19Å; V24-K28 WeakPolarHBondContact O-CB 3.37Å; V24-K28 WeakPolarHBondContact O-CG 3.34Å; V24-K28 PolarHBondContact O-N 3.23Å; A26-K28 PolarHBondContact O-N 3.46Å; K28-V30 VanDerWaalsContact C-N 3.31Å; K28-V30 PolarHBondContact O-N 3.31Å; K28-A31 PolarHBondContact O-N 3.36Å; K28-S32 WeakPolarHBondContact O-CB 3.5Å; K28-S32 PolarHBondContact O-N 3.28Å; K28-S32 PolarHBondContact O-OG 2.92Å; K28-Y49 VanDerWaalsContact CD-OH 3.31Å; K28-Y49 WeakPolarHBondContact CD-OH 3.23Å; K28-Y49 HydrophobicContact CG-CE2 4.43Å; K28-Y49 WeakPolarHBondContact CG-OH 3.38Å; K28-D99 WeakPolarHBondContact CD-OD2 3.4Å; K28-D99 VanDerWaalsContact CE-OD1 3.27Å; K28-D99 WeakPolarHBondContact CE-OD1 3.39Å; K28-D99 WeakPolarHBondContact CE-OD2 3.43Å; K28-D99 IonicContact NZ-OD1 3.4Å; K28-D99 PolarHBondContact NZ-OD1 3.23Å; K28-D99 IonicContact NZ-OD2 3.85Å; K28-D99 PolarHBondContact NZ-OD2 3.48Å; K28-V103 HydrophobicContact CG-CG2 4.08Å
29K98.2Very high97.8Very high96 Ų9655.4 Ų55.442%0.41728%0.281SS..Hα-helixtrans-65-37.8176.5-67.8168.5-175.2167.10111.5N7 E25 A26 M27 S32 M33N7-K29 WeakPolarHBondContact OD1-CD 3.01Å; E25-K29 WeakPolarHBondContact O-CG 3.41Å; A26-K29 WeakPolarHBondContact O-CB 3.44Å; A26-K29 PolarHBondContact O-N 3.46Å; M27-K29 VanDerWaalsContact C-N 3.31Å; M27-K29 PolarHBondContact O-N 3.33Å; K29-S32 WeakPolarHBondContact CA-OG 3.37Å; K29-S32 PolarHBondContact O-OG 2.94Å; K29-M33 WeakPolarHBondContact O-CG 3.45Å
30V98.5Very high97.7Very high0 Ų053.9 Ų53.90%028%0.279CS..Hα-helixtrans-65.3-47174.2178.80000110.5R4 N7 V8 A26 M27 K28 S32 M33 L37R4-V30 HydrophobicContact CG-CG1 4Å; R4-V30 HydrophobicContact CG-CG2 4.49Å; N7-V30 HydrophobicContact CB-CG2 3.56Å; V8-V30 HydrophobicContact CG2-CG1 4.39Å; V8-V30 HydrophobicContact CG2-CG2 3.9Å; A26-V30 PolarHBondContact O-N 3.11Å; M27-V30 HydrophobicContact CE-CB 4.1Å; M27-V30 HydrophobicContact CE-CG1 4.18Å; M27-V30 HydrophobicContact CE-CG2 4.31Å; M27-V30 WeakPolarHBondContact O-CB 3.45Å; M27-V30 PolarHBondContact O-N 3.02Å; M27-V30 HydrophobicContact SD-CG2 4.3Å; K28-V30 VanDerWaalsContact C-N 3.31Å; K28-V30 PolarHBondContact O-N 3.31Å; V30-S32 PolarHBondContact O-N 2.89Å; V30-M33 WeakPolarHBondContact O-CB 3.28Å; V30-M33 PolarHBondContact O-N 3.03Å; V30-L37 HydrophobicContact CG1-CD2 3.56Å
31A98.2Very high97.7Very high2 Ų252 Ų522%0.01727%0.273CS..Hα-helixtrans-60.6-42.5178.100000112M27 K28 M33 D34 V103 H107 L108M27-A31 WeakPolarHBondContact O-CB 3.46Å; M27-A31 PolarHBondContact O-N 3.21Å; K28-A31 PolarHBondContact O-N 3.36Å; A31-M33 PolarHBondContact O-N 2.98Å; A31-D34 PolarHBondContact O-N 3.25Å; A31-V103 HydrophobicContact CB-CG1 3.63Å; A31-H107 WeakPolarHBondContact O-CB 3.31Å; A31-L108 HydrophobicContact CB-CD2 3.74Å; A31-L108 HydrophobicContact CB-CG 4.25Å
32S97.5Very high97.7Very high59 Ų5948.5 Ų48.541%0.41325%0.253SS..THydrogen-bonded Turntrans-69.1-0.2-18064.10000115.1K28 K29 V30K28-S32 WeakPolarHBondContact O-CB 3.5Å; K28-S32 PolarHBondContact O-N 3.28Å; K28-S32 PolarHBondContact O-OG 2.92Å; K29-S32 WeakPolarHBondContact CA-OG 3.37Å; K29-S32 PolarHBondContact O-OG 2.94Å; V30-S32 PolarHBondContact O-N 2.89Å
33M97.8Very high97.6Very high57 Ų5747 Ų4728%0.28125%0.247SC..THydrogen-bonded Turntrans-81.3-2.2172.3-66.2174.7-178.400112.7E3 R4 K29 V30 A31 V35E3-M33 HydrophobicContact CB-CE 3.93Å; E3-M33 HydrophobicContact CG-CE 3.66Å; R4-M33 HydrophobicContact CB-CE 4.27Å; R4-M33 HydrophobicContact CB-SD 3.65Å; R4-M33 HydrophobicContact CG-SD 3.94Å; K29-M33 WeakPolarHBondContact O-CG 3.45Å; V30-M33 WeakPolarHBondContact O-CB 3.28Å; V30-M33 PolarHBondContact O-N 3.03Å; A31-M33 PolarHBondContact O-N 2.98Å; M33-V35 PolarHBondContact O-N 3.42Å; M33-V35 VanDerWaalsContact O-N 3.12Å
34D97.2Very high97.6Very high88 Ų8847.4 Ų47.447%0.47125%0.249SC..  trans53.733.9176.9-61.2-41.7000113.5A31 H107 C111A31-D34 PolarHBondContact O-N 3.25Å; D34-H107 IonicContact OD1-CE1 3.32Å; D34-H107 IonicContact OD1-CG 3.41Å; D34-H107 IonicContact OD1-ND1 2.73Å; D34-H107 PolarHBondContact OD1-ND1 3.27Å; D34-H107 IonicContact OD2-ND1 3.51Å; D34-C111 PolarHBondContact O-SG 2.68Å
35V96.4Very high97.6Very high89 Ų8946.7 Ų46.754%0.53925%0.245SC..SBendtrans-122.1128.7175.1171.40000107.8R4 M33 L37R4-V35 PolarHBondContact NH1-O 2.91Å; M33-V35 PolarHBondContact O-N 3.42Å; M33-V35 VanDerWaalsContact O-N 3.12Å; V35-L37 PolarHBondContact O-N 3.4Å
36E97.3Very high97.5Very high60 Ų6042.4 Ų42.428%0.2823%0.228SC..  trans-44.8132-178.4-172.5163.2-153.300111.6R4 T113 S117R4-E36 PolarHBondContact NH2-O 2.92Å; E36-T113 VanDerWaalsContact CD-OG1 3.29Å; E36-T113 PolarHBondContact OE1-N 3.49Å; E36-T113 PolarHBondContact OE1-OG1 3.5Å; E36-T113 WeakPolarHBondContact OE2-CB 3.41Å; E36-T113 WeakPolarHBondContact OE2-CG2 3.25Å; E36-T113 PolarHBondContact OE2-OG1 3.15Å; E36-S117 PolarHBondContact OE1-OG 3.3Å
37L98.1Very high97.4Very high8 Ų844.2 Ų44.24%0.04224%0.239CC..  trans-74.1138.1177.1-58.3-178.2000110V30 V35 E41 R42 L45 L108V30-L37 HydrophobicContact CG1-CD2 3.56Å; V35-L37 PolarHBondContact O-N 3.4Å; L37-E41 HydrophobicContact CB-CB 3.99Å; L37-E41 HydrophobicContact CD2-CB 4.12Å; L37-E41 HydrophobicContact CG-CB 4.45Å; L37-R42 HydrophobicContact CB-CB 4.23Å; L37-L45 HydrophobicContact CD1-CD2 4.13Å; L37-L108 HydrophobicContact CD1-CD2 3.56Å; L37-L108 HydrophobicContact CD2-CD2 4.5Å; L37-L108 HydrophobicContact CG-CD2 3.82Å
38T97.4Very high97.4Very high75 Ų7544.2 Ų44.246%0.4624%0.239SC..  trans-63.5162.9162.5610000110.2E40 E41 R42T38-E40 VanDerWaalsContact C-N 3.26Å; T38-E40 PolarHBondContact O-N 2.93Å; T38-E41 WeakPolarHBondContact CB-OE2 3.41Å; T38-E41 WeakPolarHBondContact CG2-OE2 3.28Å; T38-E41 PolarHBondContact N-OE2 3.43Å; T38-E41 PolarHBondContact O-N 3.1Å; T38-E41 WeakPolarHBondContact OG1-CB 3.31Å; T38-E41 WeakPolarHBondContact OG1-CG 3.27Å; T38-E41 PolarHBondContact OG1-N 3.24Å; T38-E41 PolarHBondContact OG1-OE2 3.28Å; T38-R42 WeakPolarHBondContact O-CB 3.45Å; T38-R42 PolarHBondContact O-N 3.4Å
39V95.1Very high97.4Very high85 Ų8541.1 Ų41.152%0.51523%0.225SC..Hα-helixtrans-54.2-44.3175.7172.20000111.4R42 N43V39-R42 PolarHBondContact O-N 3.07Å; V39-N43 WeakPolarHBondContact O-CB 3.49Å; V39-N43 VanDerWaalsContact O-CG 3.22Å; V39-N43 PolarHBondContact O-N 3.07Å; V39-N43 PolarHBondContact O-OD1 3.38Å
40E96.2Very high97.3Very high104 Ų10438.1 Ų38.149%0.48621%0.212SC..Hα-helixtrans-62.2-46.3178.2-174.8178.6-141.400112K12 T38 N43 L44K12-E40 VanDerWaalsContact CE-CD 3.41Å; K12-E40 WeakPolarHBondContact CE-OE1 3.46Å; K12-E40 IonicContact NZ-OE1 3.88Å; K12-E40 PolarHBondContact NZ-OE1 2.81Å; K12-E40 IonicContact NZ-OE2 2.79Å; K12-E40 PolarHBondContact NZ-OE2 2.73Å; T38-E40 VanDerWaalsContact C-N 3.26Å; T38-E40 PolarHBondContact O-N 2.93Å; E40-N43 PolarHBondContact O-N 2.8Å; E40-L44 HydrophobicContact CG-CD1 4.35Å; E40-L44 WeakPolarHBondContact O-CG 3.37Å; E40-L44 PolarHBondContact O-N 3.11Å
41E98Very high97.2Very high15 Ų1540.8 Ų40.87%0.0723%0.226CC..Hα-helixtrans-66.4-40.9179.5-70.7164.3143.300112.2R4 V8 M27 L37 T38 N43 L44 L45R4-E41 IonicContact CZ-OE1 3.94Å; R4-E41 IonicContact CZ-OE2 3.5Å; R4-E41 IonicContact NE-OE1 3.9Å; R4-E41 PolarHBondContact NE-OE1 2.98Å; R4-E41 IonicContact NE-OE2 2.71Å; R4-E41 VanDerWaalsContact NH2-CD 3.31Å; R4-E41 IonicContact NH2-OE1 3.52Å; R4-E41 PolarHBondContact NH2-OE1 3.21Å; R4-E41 IonicContact NH2-OE2 3.77Å; R4-E41 PolarHBondContact NH2-OE2 3.45Å; V8-E41 HydrophobicContact CG1-CG 4.48Å; V8-E41 HydrophobicContact CG2-CG 3.74Å; V8-E41 WeakPolarHBondContact CG2-OE1 3.29Å; M27-E41 HydrophobicContact CE-CB 3.99Å; M27-E41 WeakPolarHBondContact CE-O 3.46Å; L37-E41 HydrophobicContact CB-CB 3.99Å; L37-E41 HydrophobicContact CD2-CB 4.12Å; L37-E41 HydrophobicContact CG-CB 4.45Å; T38-E41 WeakPolarHBondContact CB-OE2 3.41Å; T38-E41 WeakPolarHBondContact CG2-OE2 3.28Å; T38-E41 PolarHBondContact N-OE2 3.43Å; T38-E41 PolarHBondContact O-N 3.1Å; T38-E41 WeakPolarHBondContact OG1-CB 3.31Å; T38-E41 WeakPolarHBondContact OG1-CG 3.27Å; T38-E41 PolarHBondContact OG1-N 3.24Å; T38-E41 PolarHBondContact OG1-OE2 3.28Å; E41-N43 VanDerWaalsContact C-N 3.31Å; E41-N43 PolarHBondContact O-N 2.95Å; E41-L44 PolarHBondContact O-N 3.18Å; E41-L45 PolarHBondContact O-N 3.23Å
42R97.6Very high97.1Very high9 Ų941.1 Ų41.13%0.03423%0.228CC..Hα-helixtrans-60.3-44.3174.7-179.7-163.572.3-162.31.7110.9L37 T38 V39 L45 S46 E116 F120 Y121L37-R42 HydrophobicContact CB-CB 4.23Å; T38-R42 WeakPolarHBondContact O-CB 3.45Å; T38-R42 PolarHBondContact O-N 3.4Å; V39-R42 PolarHBondContact O-N 3.07Å; R42-L45 PolarHBondContact O-N 3.06Å; R42-S46 PolarHBondContact O-N 2.88Å; R42-E116 IonicContact CZ-OE1 3.04Å; R42-E116 IonicContact NH1-OE1 2.61Å; R42-E116 PolarHBondContact NH1-OE1 2.91Å; R42-E116 IonicContact NH2-OE1 2.75Å; R42-E116 PolarHBondContact NH2-OE1 3.45Å; R42-F120 HydrophobicContact CG-CD1 3.62Å; R42-F120 HydrophobicContact CG-CD2 4.48Å; R42-F120 HydrophobicContact CG-CE1 3.42Å; R42-F120 VanDerWaalsContact CG-CE1 3.42Å; R42-F120 HydrophobicContact CG-CE2 4.32Å; R42-F120 HydrophobicContact CG-CG 4.16Å; R42-F120 HydrophobicContact CG-CZ 3.8Å; R42-Y121 HydrophobicContact CG-CE1 3.97Å
43N95.6Very high97.1Very high33 Ų3338.3 Ų38.318%0.17621%0.209CC..Hα-helixtrans-67.5-41.3179.8-73.515.7000111.2V39 E40 E41 L45 S46 V47 S256V39-N43 WeakPolarHBondContact O-CB 3.49Å; V39-N43 VanDerWaalsContact O-CG 3.22Å; V39-N43 PolarHBondContact O-N 3.07Å; V39-N43 PolarHBondContact O-OD1 3.38Å; E40-N43 PolarHBondContact O-N 2.8Å; E41-N43 VanDerWaalsContact C-N 3.31Å; E41-N43 PolarHBondContact O-N 2.95Å; N43-L45 PolarHBondContact O-N 3.31Å; N43-S46 WeakPolarHBondContact O-CB 3.21Å; N43-S46 PolarHBondContact O-N 3.47Å; N43-V47 WeakPolarHBondContact O-CG2 3.47Å; N43-V47 PolarHBondContact O-N 3.42Å; N43-S256 PolarHBondContact ND2-OXT 2.99Å; N43-S256 PolarHBondContact OD1-OXT 2.93Å
44L98Very high97Very high8 Ų836.9 Ų36.94%0.04221%0.208CC..Hα-helixtrans-58.8-44.2173-75.7169.5000112.6V8 K12 E15 M23 M27 E40 E41 S46 A48V8-L44 HydrophobicContact CG1-CD1 3.99Å; K12-L44 HydrophobicContact CG-CD1 3.95Å; K12-L44 HydrophobicContact CG-CD2 4.18Å; E15-L44 WeakPolarHBondContact OE2-CD2 3.21Å; M23-L44 HydrophobicContact CE-CD2 4.02Å; M27-L44 HydrophobicContact CE-CB 4.22Å; M27-L44 HydrophobicContact CG-CB 4.23Å; M27-L44 HydrophobicContact SD-CB 3.95Å; M27-L44 HydrophobicContact SD-CD1 4.38Å; E40-L44 HydrophobicContact CG-CD1 4.35Å; E40-L44 WeakPolarHBondContact O-CG 3.37Å; E40-L44 PolarHBondContact O-N 3.11Å; E41-L44 PolarHBondContact O-N 3.18Å; L44-S46 VanDerWaalsContact C-N 3.33Å; L44-S46 PolarHBondContact O-N 2.79Å; L44-A48 WeakPolarHBondContact O-CB 3.38Å; L44-A48 PolarHBondContact O-N 2.99Å
45L98.3Very high96.9Very high0 Ų035.1 Ų35.10%021%0.206CC..Hα-helixtrans-61-44175.5179.778.8000111.1M27 L37 E41 R42 N43 A48 Y49 I100 L108M27-L45 HydrophobicContact CB-CB 4.17Å; M27-L45 HydrophobicContact CB-CD1 3.59Å; M27-L45 HydrophobicContact CE-CB 4.31Å; L37-L45 HydrophobicContact CD1-CD2 4.13Å; E41-L45 PolarHBondContact O-N 3.23Å; R42-L45 PolarHBondContact O-N 3.06Å; N43-L45 PolarHBondContact O-N 3.31Å; L45-A48 PolarHBondContact O-N 3.44Å; L45-Y49 HydrophobicContact CD1-CD2 3.86Å; L45-Y49 HydrophobicContact CD1-CE2 3.7Å; L45-Y49 HydrophobicContact CG-CD2 4.2Å; L45-Y49 HydrophobicContact CG-CE2 4.47Å; L45-Y49 PolarHBondContact O-N 3.03Å; L45-Y49 VanDerWaalsContact O-N 3.15Å; L45-I100 HydrophobicContact CD2-CD1 4.5Å; L45-L108 HydrophobicContact CD2-CD1 3.3Å
46S97Very high97Very high30 Ų3034.1 Ų34.121%0.2119%0.192CC..Hα-helixtrans-63.5-50.6179.4-1750000112R42 N43 L44 A48 Y49 K50R42-S46 PolarHBondContact O-N 2.88Å; N43-S46 WeakPolarHBondContact O-CB 3.21Å; N43-S46 PolarHBondContact O-N 3.47Å; L44-S46 VanDerWaalsContact C-N 3.33Å; L44-S46 PolarHBondContact O-N 2.79Å; S46-A48 VanDerWaalsContact C-N 3.28Å; S46-A48 PolarHBondContact O-N 3.41Å; S46-Y49 PolarHBondContact O-N 2.71Å; S46-K50 WeakPolarHBondContact O-CB 3.3Å; S46-K50 PolarHBondContact O-N 3.02Å
47V96.7Very high97Very high44 Ų4431.3 Ų31.327%0.26718%0.179SC..Hα-helixtrans-56.4-43.2176.5169.80000111.1Y20 M23 N43 N51Y20-V47 HydrophobicContact CE1-CG1 4.24Å; M23-V47 HydrophobicContact CE-CB 4.48Å; M23-V47 HydrophobicContact CE-CG1 4.15Å; N43-V47 WeakPolarHBondContact O-CG2 3.47Å; N43-V47 PolarHBondContact O-N 3.42Å; V47-N51 PolarHBondContact O-N 3.34Å; V47-N51 VanDerWaalsContact O-N 3.11Å; V47-N51 PolarHBondContact O-ND2 3.22Å
48A97.9Very high96.9Very high0 Ų033.1 Ų33.10%020%0.195CC..Hα-helixtrans-58.1-57.7178.700000111.9M23 V24 L44 L45 S46 K50 N51 V52M23-A48 HydrophobicContact CB-CB 3.47Å; M23-A48 VanDerWaalsContact CB-CB 3.47Å; M23-A48 HydrophobicContact CE-CB 4.19Å; M23-A48 HydrophobicContact SD-CB 4.47Å; V24-A48 HydrophobicContact CG2-CB 3.76Å; L44-A48 WeakPolarHBondContact O-CB 3.38Å; L44-A48 PolarHBondContact O-N 2.99Å; L45-A48 PolarHBondContact O-N 3.44Å; S46-A48 VanDerWaalsContact C-N 3.28Å; S46-A48 PolarHBondContact O-N 3.41Å; A48-K50 PolarHBondContact O-N 3.23Å; A48-N51 PolarHBondContact O-N 3.29Å; A48-V52 WeakPolarHBondContact O-CG2 3.49Å; A48-V52 PolarHBondContact O-N 3.35Å
49Y98.3Very high96.8Very high2 Ų231.9 Ų31.91%0.00819%0.19CC..Hα-helixtrans-70.4-33.1-176.7-87.5-77.1000113V24 K28 L45 S46 V52 I53 I96 D99 I100 Y128V24-Y49 HydrophobicContact CB-CE2 4.48Å; V24-Y49 HydrophobicContact CG1-CD1 4.45Å; V24-Y49 HydrophobicContact CG1-CE1 3.78Å; V24-Y49 HydrophobicContact CG1-CE2 3.84Å; V24-Y49 VanDerWaalsContact CG1-CZ 3.46Å; V24-Y49 HydrophobicContact CG2-CD1 4.05Å; V24-Y49 HydrophobicContact CG2-CD2 4.01Å; V24-Y49 HydrophobicContact CG2-CE1 4.2Å; V24-Y49 HydrophobicContact CG2-CE2 4.17Å; V24-Y49 HydrophobicContact CG2-CG 3.96Å; K28-Y49 VanDerWaalsContact CD-OH 3.31Å; K28-Y49 WeakPolarHBondContact CD-OH 3.23Å; K28-Y49 HydrophobicContact CG-CE2 4.43Å; K28-Y49 WeakPolarHBondContact CG-OH 3.38Å; L45-Y49 HydrophobicContact CD1-CD2 3.86Å; L45-Y49 HydrophobicContact CD1-CE2 3.7Å; L45-Y49 HydrophobicContact CG-CD2 4.2Å; L45-Y49 HydrophobicContact CG-CE2 4.47Å; L45-Y49 PolarHBondContact O-N 3.03Å; L45-Y49 VanDerWaalsContact O-N 3.15Å; S46-Y49 PolarHBondContact O-N 2.71Å; Y49-V52 PolarHBondContact O-N 2.9Å; Y49-I53 WeakPolarHBondContact O-CB 3.49Å; Y49-I53 VanDerWaalsContact O-CG2 3.25Å; Y49-I53 WeakPolarHBondContact O-CG2 3.37Å; Y49-I53 PolarHBondContact O-N 3.33Å; Y49-I96 HydrophobicContact CD1-CG2 4.18Å; Y49-D99 HydrophobicContact CE1-CB 4.45Å; Y49-D99 PolarHBondContact OH-OD2 2.6Å; Y49-I100 HydrophobicContact CD1-CB 3.79Å; Y49-I100 HydrophobicContact CD1-CG1 4.4Å; Y49-I100 HydrophobicContact CD1-CG2 4.41Å; Y49-I100 HydrophobicContact CD2-CB 4.45Å; Y49-I100 HydrophobicContact CD2-CD1 3.74Å; Y49-I100 HydrophobicContact CD2-CG1 4.33Å; Y49-I100 HydrophobicContact CE1-CB 3.65Å; Y49-I100 HydrophobicContact CE1-CG2 4.49Å; Y49-I100 HydrophobicContact CE2-CB 4.31Å; Y49-I100 HydrophobicContact CE2-CD1 3.7Å; Y49-I100 HydrophobicContact CE2-CG1 4.45Å; Y49-I100 HydrophobicContact CG-CB 4.18Å; Y49-I100 HydrophobicContact CG-CD1 4.18Å; Y49-I100 HydrophobicContact CG-CG1 4.28Å; Y49-Y128 VanDerWaalsContact C-OH 3.25Å; Y49-Y128 VanDerWaalsContact CB-OH 3.29Å; Y49-Y128 WeakPolarHBondContact CB-OH 3.33Å; Y49-Y128 PolarHBondContact O-OH 3.1Å
50K96.3Very high97Very high32 Ų3229.4 Ų29.414%0.13917%0.171CC..Hα-helixtrans-59.9-47.5175.6175.5-178.5172.7169.70111.7S46 A48 I53 G54 V250 E251 Q253S46-K50 WeakPolarHBondContact O-CB 3.3Å; S46-K50 PolarHBondContact O-N 3.02Å; A48-K50 PolarHBondContact O-N 3.23Å; K50-I53 WeakPolarHBondContact O-CG2 3.34Å; K50-G54 WeakPolarHBondContact O-CA 3.43Å; K50-G54 PolarHBondContact O-N 2.6Å; K50-V250 PolarHBondContact NZ-O 3.32Å; K50-E251 WeakPolarHBondContact CE-O 3.42Å; K50-E251 HydrophobicContact CG-CB 4.34Å; K50-E251 HydrophobicContact CG-CG 4.46Å; K50-E251 PolarHBondContact NZ-O 2.87Å; K50-Q253 PolarHBondContact NZ-O 3.47Å
51N95.9Very high96.9Very high57 Ų5727.5 Ų27.531%0.30516%0.159SC..Hα-helixtrans-68.5-41.7179.8-81.2-79.7000112.2Y20 V47 A48 A55Y20-N51 HydrophobicContact CD1-CB 3.5Å; Y20-N51 VanDerWaalsContact CD1-CB 3.5Å; Y20-N51 HydrophobicContact CD2-CB 3.42Å; Y20-N51 VanDerWaalsContact CD2-CB 3.42Å; Y20-N51 HydrophobicContact CE1-CB 3.74Å; Y20-N51 VanDerWaalsContact CE1-CG 3.42Å; Y20-N51 VanDerWaalsContact CE1-ND2 3.34Å; Y20-N51 WeakPolarHBondContact CE1-ND2 3.35Å; Y20-N51 HydrophobicContact CE2-CB 3.65Å; Y20-N51 HydrophobicContact CG-CB 3.33Å; V47-N51 PolarHBondContact O-N 3.34Å; V47-N51 VanDerWaalsContact O-N 3.11Å; V47-N51 PolarHBondContact O-ND2 3.22Å; A48-N51 PolarHBondContact O-N 3.29Å; N51-A55 PolarHBondContact O-N 3.42Å
52V97.2Very high96.9Very high9 Ų931.8 Ų31.86%0.05518%0.182CC..Hα-helixtrans-63.1-48.8177.9175.10000111.2V24 A48 Y49 R56 I96V24-V52 HydrophobicContact CG2-CG2 4.11Å; A48-V52 WeakPolarHBondContact O-CG2 3.49Å; A48-V52 PolarHBondContact O-N 3.35Å; Y49-V52 PolarHBondContact O-N 2.9Å; V52-R56 WeakPolarHBondContact O-CD 3.34Å; V52-I96 HydrophobicContact CG1-CD1 3.68Å; V52-I96 HydrophobicContact CG1-CG1 3.93Å; V52-I96 HydrophobicContact CG1-CG2 4.26Å
53I97.4Very high96.8Very high0 Ų032 Ų320%018%0.183CC..Hα-helixtrans-70.3-39.6-179.6-16176.9000111.7Y49 K50 A55 R56 R57 L93 I96 Y128 Y131Y49-I53 WeakPolarHBondContact O-CB 3.49Å; Y49-I53 VanDerWaalsContact O-CG2 3.25Å; Y49-I53 WeakPolarHBondContact O-CG2 3.37Å; Y49-I53 PolarHBondContact O-N 3.33Å; K50-I53 WeakPolarHBondContact O-CG2 3.34Å; I53-A55 PolarHBondContact O-N 3.17Å; I53-R56 PolarHBondContact O-N 3.37Å; I53-R56 VanDerWaalsContact O-N 3.14Å; I53-R57 HydrophobicContact CG1-CG 4.27Å; I53-R57 WeakPolarHBondContact O-CG 3.34Å; I53-R57 PolarHBondContact O-N 2.86Å; I53-L93 HydrophobicContact CD1-CD2 3.59Å; I53-L93 HydrophobicContact CG1-CD2 4.13Å; I53-I96 HydrophobicContact CB-CG2 4.12Å; I53-I96 HydrophobicContact CD1-CB 3.76Å; I53-I96 HydrophobicContact CD1-CD1 4.26Å; I53-I96 HydrophobicContact CD1-CG2 3.54Å; I53-I96 HydrophobicContact CG1-CG2 4.4Å; I53-Y128 HydrophobicContact CB-CE1 3.91Å; I53-Y128 HydrophobicContact CD1-CD1 4.45Å; I53-Y128 HydrophobicContact CD1-CE1 4.1Å; I53-Y128 HydrophobicContact CG1-CD1 4.47Å; I53-Y128 HydrophobicContact CG1-CE1 3.87Å; I53-Y128 HydrophobicContact CG2-CE1 3.95Å; I53-Y128 WeakPolarHBondContact CG2-OH 3.32Å; I53-Y131 HydrophobicContact CG1-CD2 4.07Å
54G95.6Very high96.8Very high27 Ų2731.9 Ų31.928%0.27818%0.184SC..Hα-helixtrans-59-45.5-179.200000112.2K50 R56 R57 A58K50-G54 WeakPolarHBondContact O-CA 3.43Å; K50-G54 PolarHBondContact O-N 2.6Å; G54-R56 VanDerWaalsContact C-N 3.33Å; G54-R56 PolarHBondContact O-N 2.99Å; G54-R57 PolarHBondContact O-N 3.41Å; G54-A58 WeakPolarHBondContact O-CB 3.49Å; G54-A58 PolarHBondContact O-N 2.89Å
55A95.3Very high96.7Very high50 Ų5033.6 Ų33.641%0.41320%0.197SC..Hα-helixtrans-60.2-40.317600000112.8N51 I53 S59N51-A55 PolarHBondContact O-N 3.42Å; I53-A55 PolarHBondContact O-N 3.17Å; A55-S59 WeakPolarHBondContact O-CB 3.13Å; A55-S59 PolarHBondContact O-N 3.43Å; A55-S59 VanDerWaalsContact O-N 3.09Å; A55-S59 PolarHBondContact O-OG 3.49Å
56R97.6Very high96.5Very high68 Ų6837.4 Ų37.426%0.25722%0.216SC..Hα-helixtrans-73-38.5178.3-88.465.2-179.3-166.4-2.3111.7V52 I53 G54 S59 W60 E92 L93 I96V52-R56 WeakPolarHBondContact O-CD 3.34Å; I53-R56 PolarHBondContact O-N 3.37Å; I53-R56 VanDerWaalsContact O-N 3.14Å; G54-R56 VanDerWaalsContact C-N 3.33Å; G54-R56 PolarHBondContact O-N 2.99Å; R56-S59 PolarHBondContact O-N 3.02Å; R56-W60 WeakPolarHBondContact O-CB 3.43Å; R56-W60 PolarHBondContact O-N 3.01Å; R56-E92 HydrophobicContact CG-CB 4.12Å; R56-E92 IonicContact CZ-OE2 2.71Å; R56-E92 IonicContact NE-OE2 3.16Å; R56-E92 PolarHBondContact NE-OE2 2.88Å; R56-E92 IonicContact NH2-OE2 3.76Å; R56-L93 HydrophobicContact CB-CD2 3.51Å; R56-L93 HydrophobicContact CB-CG 3.91Å; R56-I96 HydrophobicContact CB-CD1 4.27Å; R56-I96 HydrophobicContact CG-CD1 3.91Å
57R97Very high96.3Very high2 Ų236.6 Ų36.61%0.00821%0.209CC..Hα-helixtrans-63.2-44.7175.1-75.2178.170-14310.8111.2I53 G54 S59 W60 R61 L93 Y131 E134 D249 E251I53-R57 HydrophobicContact CG1-CG 4.27Å; I53-R57 WeakPolarHBondContact O-CG 3.34Å; I53-R57 PolarHBondContact O-N 2.86Å; G54-R57 PolarHBondContact O-N 3.41Å; R57-S59 PolarHBondContact O-N 2.85Å; R57-W60 PolarHBondContact O-N 3.01Å; R57-R61 WeakPolarHBondContact O-CG 3.32Å; R57-R61 PolarHBondContact O-N 2.83Å; R57-L93 HydrophobicContact CG-CD2 3.72Å; R57-Y131 VanDerWaalsContact CZ-CD1 3.43Å; R57-Y131 VanDerWaalsContact NE-CD1 3.28Å; R57-E134 IonicContact CZ-OE1 3.52Å; R57-E134 IonicContact CZ-OE2 3.66Å; R57-E134 IonicContact NE-OE1 3.49Å; R57-E134 PolarHBondContact NE-OE1 2.89Å; R57-E134 IonicContact NE-OE2 2.65Å; R57-E134 PolarHBondContact NE-OE2 3.38Å; R57-E134 IonicContact NH2-OE1 2.67Å; R57-E134 PolarHBondContact NH2-OE1 3.04Å; R57-E134 IonicContact NH2-OE2 3.65Å; R57-D249 IonicContact CZ-OD2 3.67Å; R57-D249 IonicContact NH1-OD2 2.64Å; R57-D249 IonicContact NH2-OD2 3.5Å; R57-D249 PolarHBondContact NH2-OD2 3.24Å; R57-E251 IonicContact NH1-OE2 3.41Å; R57-E251 PolarHBondContact NH1-OE2 3.37Å
58A95.5Very high96.1Very high45 Ų4540.1 Ų40.137%0.37222%0.222SC..Hα-helixtrans-59.4-46.4174.900000111.6G54 W60 R61 I62G54-A58 WeakPolarHBondContact O-CB 3.49Å; G54-A58 PolarHBondContact O-N 2.89Å; A58-W60 PolarHBondContact O-N 3.35Å; A58-R61 PolarHBondContact O-N 3.11Å; A58-I62 WeakPolarHBondContact O-CG1 3.37Å; A58-I62 PolarHBondContact O-N 3.36Å; A58-I62 VanDerWaalsContact O-N 3.09Å
59S97.1Very high95.8Very high50 Ų5046.3 Ų46.335%0.3525%0.25SC..Hα-helixtrans-58.4-47.8175.5-58.90000111.6A55 R56 R57 R61 I62 I63A55-S59 WeakPolarHBondContact O-CB 3.13Å; A55-S59 PolarHBondContact O-N 3.43Å; A55-S59 VanDerWaalsContact O-N 3.09Å; A55-S59 PolarHBondContact O-OG 3.49Å; R56-S59 PolarHBondContact O-N 3.02Å; R57-S59 PolarHBondContact O-N 2.85Å; S59-R61 PolarHBondContact O-N 2.9Å; S59-I62 PolarHBondContact O-N 2.92Å; S59-I63 WeakPolarHBondContact O-CD1 3.4Å; S59-I63 WeakPolarHBondContact O-CG1 3.46Å; S59-I63 PolarHBondContact O-N 3.4Å
60W97.8Very high95.4Very high33 Ų3347.2 Ų47.213%0.12525%0.254CS..Hα-helixtrans-60.5-45.7178.9177.478.4000112.5R56 R57 A58 I62 I63 T64 V89 E90 L93 E134 F135R56-W60 WeakPolarHBondContact O-CB 3.43Å; R56-W60 PolarHBondContact O-N 3.01Å; R57-W60 PolarHBondContact O-N 3.01Å; A58-W60 PolarHBondContact O-N 3.35Å; W60-I62 PolarHBondContact O-N 3.08Å; W60-I63 PolarHBondContact O-N 2.86Å; W60-T64 WeakPolarHBondContact O-CB 3.43Å; W60-T64 PolarHBondContact O-N 3.43Å; W60-T64 PolarHBondContact O-OG1 3.4Å; W60-V89 HydrophobicContact CB-CG1 3.81Å; W60-E90 PolarHBondContact NE1-OE1 3.02Å; W60-L93 HydrophobicContact CB-CD1 3.79Å; W60-L93 HydrophobicContact CG-CD1 3.95Å; W60-E134 HydrophobicContact CH2-CB 4.23Å; W60-E134 WeakPolarHBondContact CH2-O 3.46Å; W60-E134 HydrophobicContact CZ3-CB 4.21Å; W60-F135 HydrophobicContact CD2-CB 4.4Å; W60-F135 HydrophobicContact CH2-CB 4.18Å; W60-F135 HydrophobicContact CZ2-CB 3.44Å; W60-F135 VanDerWaalsContact CZ2-CB 3.44Å
61R95.7Very high95Very high64 Ų6450.2 Ų50.224%0.24227%0.268CS..Hα-helixtrans-59.2-44.7177.1-73.1176.1179.8137.3-5.9112.2R57 A58 S59 S65R57-R61 WeakPolarHBondContact O-CG 3.32Å; R57-R61 PolarHBondContact O-N 2.83Å; A58-R61 PolarHBondContact O-N 3.11Å; S59-R61 PolarHBondContact O-N 2.9Å; R61-S65 PolarHBondContact O-N 3.24Å
62I96.3Very high94.5Very high104 Ų10454.3 Ų54.353%0.53329%0.29SS..Hα-helixtrans-62.9-48.1178.2-68.6167.5000110.4A58 S59 W60 T64 S65 I66A58-I62 WeakPolarHBondContact O-CG1 3.37Å; A58-I62 PolarHBondContact O-N 3.36Å; A58-I62 VanDerWaalsContact O-N 3.09Å; S59-I62 PolarHBondContact O-N 2.92Å; W60-I62 PolarHBondContact O-N 3.08Å; I62-T64 PolarHBondContact O-N 3.42Å; I62-S65 WeakPolarHBondContact O-CB 3.43Å; I62-S65 PolarHBondContact O-N 3.2Å; I62-I66 HydrophobicContact CG2-CD1 3.83Å; I62-I66 WeakPolarHBondContact O-CG1 3.4Å; I62-I66 PolarHBondContact O-N 3.18Å
63I97Very high94Very high14 Ų1460.7 Ų60.77%0.07232%0.317CS..Hα-helixtrans-62.8-44.3-179.1-64.9160.2000110.6S59 W60 S65 I66 E67 I82 Y85 R86 V89S59-I63 WeakPolarHBondContact O-CD1 3.4Å; S59-I63 WeakPolarHBondContact O-CG1 3.46Å; S59-I63 PolarHBondContact O-N 3.4Å; W60-I63 PolarHBondContact O-N 2.86Å; I63-S65 VanDerWaalsContact C-N 3.31Å; I63-S65 PolarHBondContact O-N 3.26Å; I63-I66 WeakPolarHBondContact O-CB 3.34Å; I63-I66 PolarHBondContact O-N 3.45Å; I63-I66 VanDerWaalsContact O-N 3.1Å; I63-E67 PolarHBondContact O-N 3.48Å; I63-I82 HydrophobicContact CG2-CG2 4.04Å; I63-Y85 HydrophobicContact CD1-CD1 3.5Å; I63-Y85 HydrophobicContact CD1-CE1 3.41Å; I63-Y85 VanDerWaalsContact CD1-CE1 3.41Å; I63-Y85 HydrophobicContact CG1-CD1 3.98Å; I63-Y85 HydrophobicContact CG1-CE1 4.05Å; I63-R86 HydrophobicContact CG2-CB 3.73Å; I63-R86 HydrophobicContact CG2-CG 4.37Å; I63-V89 HydrophobicContact CD1-CB 4.37Å; I63-V89 HydrophobicContact CD1-CG2 3.58Å
64T95.7Very high93.1Very high30 Ų3063.7 Ų63.718%0.18435%0.349CS..Hα-helixtrans-60.5-39.5176.1-62.90000111.7W60 I62 E67 Q68 R86W60-T64 WeakPolarHBondContact O-CB 3.43Å; W60-T64 PolarHBondContact O-N 3.43Å; W60-T64 PolarHBondContact O-OG1 3.4Å; I62-T64 PolarHBondContact O-N 3.42Å; T64-E67 WeakPolarHBondContact O-CB 3.38Å; T64-E67 PolarHBondContact O-N 3.06Å; T64-Q68 WeakPolarHBondContact O-CG 3.22Å; T64-Q68 PolarHBondContact O-N 3.02Å; T64-Q68 VanDerWaalsContact O-N 3.11Å; T64-R86 WeakPolarHBondContact OG1-CD 3.33Å
65S94.4Very high92.5Very high45 Ų4564 Ų6432%0.31535%0.348SS..Hα-helixtrans-65.3-37.7173.8-173.20000112.6R61 I62 I63 K69R61-S65 PolarHBondContact O-N 3.24Å; I62-S65 WeakPolarHBondContact O-CB 3.43Å; I62-S65 PolarHBondContact O-N 3.2Å; I63-S65 VanDerWaalsContact C-N 3.31Å; I63-S65 PolarHBondContact O-N 3.26Å; S65-K69 WeakPolarHBondContact O-CG 3.2Å; S65-K69 PolarHBondContact O-N 3.44Å
66I94.3Very high92.3Very high80 Ų8069.5 Ų69.541%0.4137%0.365SS..Hα-helixtrans-67.3-42.4175.8-67.4166.9000110.6I62 I63 K69 E70 I82I62-I66 HydrophobicContact CG2-CD1 3.83Å; I62-I66 WeakPolarHBondContact O-CG1 3.4Å; I62-I66 PolarHBondContact O-N 3.18Å; I63-I66 WeakPolarHBondContact O-CB 3.34Å; I63-I66 PolarHBondContact O-N 3.45Å; I63-I66 VanDerWaalsContact O-N 3.1Å; I66-K69 PolarHBondContact O-N 2.89Å; I66-E70 PolarHBondContact O-N 2.98Å; I66-I82 HydrophobicContact CG2-CD1 3.9Å; I66-I82 HydrophobicContact CG2-CG1 4.36Å
67E93.9Very high92Very high13 Ų1374.4 Ų74.46%0.06139%0.391CS..Hα-helixtrans-55-53.4175.7-172173.3160.100110.9I63 T64 K69 E70 E71 L79 I82 K83 R86I63-E67 PolarHBondContact O-N 3.48Å; T64-E67 WeakPolarHBondContact O-CB 3.38Å; T64-E67 PolarHBondContact O-N 3.06Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 PolarHBondContact O-N 2.93Å; E67-E70 PolarHBondContact O-N 3.29Å; E67-E71 WeakPolarHBondContact O-CG 3.5Å; E67-E71 PolarHBondContact O-N 3.48Å; E67-L79 HydrophobicContact CG-CD1 3.91Å; E67-I82 HydrophobicContact CB-CG2 3.62Å; E67-I82 HydrophobicContact CG-CG2 4.12Å; E67-K83 HydrophobicContact CG-CG 4.36Å; E67-K83 WeakPolarHBondContact OE1-CE 3.46Å; E67-K83 VanDerWaalsContact OE1-CG 3.31Å; E67-K83 WeakPolarHBondContact OE1-CG 3.49Å; E67-R86 IonicContact OE1-CZ 2.73Å; E67-R86 IonicContact OE1-NE 3.85Å; E67-R86 IonicContact OE1-NH2 3.85Å; E67-R86 PolarHBondContact OE1-NH2 3.4Å; E67-R86 VanDerWaalsContact OE2-CD 3.26Å; E67-R86 WeakPolarHBondContact OE2-CD 3.37Å; E67-R86 IonicContact OE2-CZ 3.66Å; E67-R86 IonicContact OE2-NE 3.66Å; E67-R86 PolarHBondContact OE2-NE 3.08Å; E67-R86 IonicContact OE2-NH2 3.66Å
68Q91.5Very high91.8Very high117 Ų11780.3 Ų80.355%0.54742%0.417SS..Hα-helixtrans-57.3-38.1178.4-70.6173.3-4.700112.8T64 N72T64-Q68 WeakPolarHBondContact O-CG 3.22Å; T64-Q68 PolarHBondContact O-N 3.02Å; T64-Q68 VanDerWaalsContact O-N 3.11Å; Q68-N72 PolarHBondContact O-ND2 2.99Å
69K91.6Very high91.8Very high131 Ų13179.6 Ų79.657%0.5741%0.407SS*.Hα-helixtrans-71.7-32.2177.5-72172.2-172.6171.40112.8S65 I66 E67S65-K69 WeakPolarHBondContact O-CG 3.2Å; S65-K69 PolarHBondContact O-N 3.44Å; I66-K69 PolarHBondContact O-N 2.89Å; E67-K69 VanDerWaalsContact C-N 3.27Å; E67-K69 PolarHBondContact O-N 2.93Å
70E90.3Very high91.7Very high21 Ų2182.9 Ų82.910%0.09842%0.417CS..Hα-helixtrans-84-31.1-178.7-158.266.3-168.500112.4I66 E67 N72 K73 K78 I82I66-E70 PolarHBondContact O-N 2.98Å; E67-E70 PolarHBondContact O-N 3.29Å; E70-N72 PolarHBondContact O-N 2.9Å; E70-K73 PolarHBondContact O-N 3.05Å; E70-K73 WeakPolarHBondContact OE2-CD 3.45Å; E70-K73 WeakPolarHBondContact OE2-CE 3.24Å; E70-K73 IonicContact OE2-NZ 2.58Å; E70-K73 PolarHBondContact OE2-NZ 3.38Å; E70-K78 HydrophobicContact CG-CB 4.23Å; E70-K78 WeakPolarHBondContact OE1-CD 3.15Å; E70-I82 HydrophobicContact CB-CD1 3.72Å; E70-I82 HydrophobicContact CG-CD1 3.86Å
71E88Confident91.6Very high94 Ų9488 Ų8844%0.43944%0.443SS..Hα-helixtrans-54-36.9171.6-75.8-166.7152.800111.7E67 K73 L79 K83E67-E71 WeakPolarHBondContact O-CG 3.5Å; E67-E71 PolarHBondContact O-N 3.48Å; E71-K73 PolarHBondContact O-N 3.29Å; E71-L79 HydrophobicContact CB-CD1 4.5Å; E71-L79 HydrophobicContact CG-CD1 3.37Å; E71-L79 HydrophobicContact CG-CD2 3.79Å; E71-L79 HydrophobicContact CG-CG 4.22Å; E71-K83 WeakPolarHBondContact OE1-CE 3.06Å; E71-K83 IonicContact OE1-NZ 3.53Å; E71-K83 PolarHBondContact OE1-NZ 3.33Å
72N85.5Confident91.7Very high144 Ų14486.3 Ų86.377%0.7744%0.439SS*.THydrogen-bonded Turntrans-71.7-8.4178.2-68.3-41.3000114.8Q68 E70Q68-N72 PolarHBondContact O-ND2 2.99Å; E70-N72 PolarHBondContact O-N 2.9Å
73K86.7Confident91.7Very high142 Ų14284.6 Ų84.662%0.61743%0.428SS*.THydrogen-bonded Turntrans-104.5-10.2-176.4-60.6-177.9-160.5153.60114.4E70 E71 A75E70-K73 PolarHBondContact O-N 3.05Å; E70-K73 WeakPolarHBondContact OE2-CD 3.45Å; E70-K73 WeakPolarHBondContact OE2-CE 3.24Å; E70-K73 IonicContact OE2-NZ 2.58Å; E70-K73 PolarHBondContact OE2-NZ 3.38Å; E71-K73 PolarHBondContact O-N 3.29Å; K73-A75 VanDerWaalsContact C-N 3.32Å; K73-A75 PolarHBondContact O-N 2.97Å
74G78.6Confident91.7Very high64 Ų6487.4 Ų87.466%0.6645%0.446SS*.THydrogen-bonded Turntrans70.81917900000115.5E76G74-E76 PolarHBondContact O-N 3.42Å
75A83.8Confident91.8Very high33 Ų3392.2 Ų92.227%0.27346%0.461SS..  trans-88.984.2177.600000111.5K73 E77 K78 L79K73-A75 VanDerWaalsContact C-N 3.32Å; K73-A75 PolarHBondContact O-N 2.97Å; A75-E77 PolarHBondContact O-N 2.9Å; A75-K78 HydrophobicContact CB-CB 4.3Å; A75-K78 HydrophobicContact CB-CD 4.3Å; A75-K78 PolarHBondContact O-N 3.43Å; A75-L79 WeakPolarHBondContact O-CB 3.36Å; A75-L79 PolarHBondContact O-N 3.41Å
76E89.8Confident92Very high165 Ų16593 Ų9377%0.77146%0.458SS*.Hα-helixtrans-56.5-45.6-171.8-66.4-178.4177.300114.2G74 K78 L79 E80G74-E76 PolarHBondContact O-N 3.42Å; E76-K78 PolarHBondContact O-N 3.14Å; E76-L79 PolarHBondContact O-N 3.31Å; E76-E80 PolarHBondContact O-N 3.39Å
77E91.9Very high92.2Very high171 Ų17190.8 Ų90.880%0.79945%0.454SS*.Hα-helixtrans-62.5-42.6-178.7-66.8-177.3169.800112.5A75 E80 M81A75-E77 PolarHBondContact O-N 2.9Å; E77-E80 PolarHBondContact O-N 2.88Å; E77-M81 WeakPolarHBondContact O-CG 3.14Å; E77-M81 PolarHBondContact O-N 2.93Å; E77-M81 VanDerWaalsContact O-N 3.17Å
78K93.1Very high92.4Very high126 Ų12695.1 Ų95.155%0.54847%0.474SS..Hα-helixtrans-67.8-40.6177.5-70.8-177.1179.8177.40111.2E70 A75 E76 E80 M81 I82E70-K78 HydrophobicContact CG-CB 4.23Å; E70-K78 WeakPolarHBondContact OE1-CD 3.15Å; A75-K78 HydrophobicContact CB-CB 4.3Å; A75-K78 HydrophobicContact CB-CD 4.3Å; A75-K78 PolarHBondContact O-N 3.43Å; E76-K78 PolarHBondContact O-N 3.14Å; K78-E80 VanDerWaalsContact C-N 3.31Å; K78-E80 PolarHBondContact O-N 2.93Å; K78-M81 PolarHBondContact O-N 3.06Å; K78-I82 WeakPolarHBondContact O-CD1 3.33Å; K78-I82 VanDerWaalsContact O-CG1 3.28Å; K78-I82 WeakPolarHBondContact O-CG1 3.35Å; K78-I82 PolarHBondContact O-N 3.4Å
79L94.5Very high92.7Very high31 Ų3189.8 Ų89.816%0.16245%0.45CS..Hα-helixtrans-60.5-42.8177.9-179.760.2000111.3E67 E71 A75 E76 I82 K83E67-L79 HydrophobicContact CG-CD1 3.91Å; E71-L79 HydrophobicContact CB-CD1 4.5Å; E71-L79 HydrophobicContact CG-CD1 3.37Å; E71-L79 HydrophobicContact CG-CD2 3.79Å; E71-L79 HydrophobicContact CG-CG 4.22Å; A75-L79 WeakPolarHBondContact O-CB 3.36Å; A75-L79 PolarHBondContact O-N 3.41Å; E76-L79 PolarHBondContact O-N 3.31Å; L79-I82 PolarHBondContact O-N 2.85Å; L79-K83 HydrophobicContact CD1-CD 4.4Å; L79-K83 HydrophobicContact CG-CD 4.23Å; L79-K83 WeakPolarHBondContact O-CG 3.1Å; L79-K83 PolarHBondContact O-N 3.41Å
80E95.4Very high93Very high118 Ų11884.9 Ų84.955%0.55143%0.429SS*.Hα-helixtrans-64.7-39.9177.3-171.657.5-153.900112.3E76 E77 K78 I82 K83 T84E76-E80 PolarHBondContact O-N 3.39Å; E77-E80 PolarHBondContact O-N 2.88Å; K78-E80 VanDerWaalsContact C-N 3.31Å; K78-E80 PolarHBondContact O-N 2.93Å; E80-I82 VanDerWaalsContact C-N 3.34Å; E80-I82 PolarHBondContact O-N 3.36Å; E80-K83 PolarHBondContact O-N 3.28Å; E80-T84 WeakPolarHBondContact O-CB 3.49Å; E80-T84 PolarHBondContact O-N 3.19Å; E80-T84 PolarHBondContact O-OG1 3.06Å
81M96.2Very high93.4Very high140 Ų14089.9 Ų89.969%0.6945%0.45SS*.Hα-helixtrans-60.9-42.6173-70.7179.366.700112E77 K78 T84 Y85E77-M81 WeakPolarHBondContact O-CG 3.14Å; E77-M81 PolarHBondContact O-N 2.93Å; E77-M81 VanDerWaalsContact O-N 3.17Å; K78-M81 PolarHBondContact O-N 3.06Å; M81-T84 PolarHBondContact O-N 3.31Å; M81-Y85 WeakPolarHBondContact O-CB 3.4Å; M81-Y85 PolarHBondContact O-N 3.4Å
82I96.6Very high93.9Very high29 Ų2989.3 Ų89.315%0.14945%0.448CS..Hα-helixtrans-64.8-46178.2-66.4159000110.4I63 I66 E67 E70 K78 L79 E80 T84 Y85 R86I63-I82 HydrophobicContact CG2-CG2 4.04Å; I66-I82 HydrophobicContact CG2-CD1 3.9Å; I66-I82 HydrophobicContact CG2-CG1 4.36Å; E67-I82 HydrophobicContact CB-CG2 3.62Å; E67-I82 HydrophobicContact CG-CG2 4.12Å; E70-I82 HydrophobicContact CB-CD1 3.72Å; E70-I82 HydrophobicContact CG-CD1 3.86Å; K78-I82 WeakPolarHBondContact O-CD1 3.33Å; K78-I82 VanDerWaalsContact O-CG1 3.28Å; K78-I82 WeakPolarHBondContact O-CG1 3.35Å; K78-I82 PolarHBondContact O-N 3.4Å; L79-I82 PolarHBondContact O-N 2.85Å; E80-I82 VanDerWaalsContact C-N 3.34Å; E80-I82 PolarHBondContact O-N 3.36Å; I82-T84 VanDerWaalsContact C-N 3.34Å; I82-T84 PolarHBondContact O-N 3.07Å; I82-Y85 PolarHBondContact O-N 2.9Å; I82-R86 PolarHBondContact O-N 2.76Å
83K96.7Very high94.5Very high68 Ų6882.4 Ų82.430%0.29641%0.411SS..Hα-helixtrans-59.7-43.6177-77.8176.7176.5174.30112.1E67 E71 L79 E80 Y85 R86 G87E67-K83 HydrophobicContact CG-CG 4.36Å; E67-K83 WeakPolarHBondContact OE1-CE 3.46Å; E67-K83 VanDerWaalsContact OE1-CG 3.31Å; E67-K83 WeakPolarHBondContact OE1-CG 3.49Å; E71-K83 WeakPolarHBondContact OE1-CE 3.06Å; E71-K83 IonicContact OE1-NZ 3.53Å; E71-K83 PolarHBondContact OE1-NZ 3.33Å; L79-K83 HydrophobicContact CD1-CD 4.4Å; L79-K83 HydrophobicContact CG-CD 4.23Å; L79-K83 WeakPolarHBondContact O-CG 3.1Å; L79-K83 PolarHBondContact O-N 3.41Å; E80-K83 PolarHBondContact O-N 3.28Å; K83-Y85 PolarHBondContact O-N 3.11Å; K83-R86 PolarHBondContact O-N 3.01Å; K83-G87 PolarHBondContact O-N 3.06Å
84T97.8Very high95.1Very high73 Ų7379.9 Ų79.945%0.44840%0.397SS..Hα-helixtrans-60.7-45.9175.9-62.60000111.2E80 M81 I82 G87 Q88E80-T84 WeakPolarHBondContact O-CB 3.49Å; E80-T84 PolarHBondContact O-N 3.19Å; E80-T84 PolarHBondContact O-OG1 3.06Å; M81-T84 PolarHBondContact O-N 3.31Å; I82-T84 VanDerWaalsContact C-N 3.34Å; I82-T84 PolarHBondContact O-N 3.07Å; T84-G87 PolarHBondContact O-N 3.33Å; T84-Q88 PolarHBondContact O-N 3.37Å
85Y97.9Very high96Very high131 Ų13180.5 Ų80.551%0.51439%0.386SS..Hα-helixtrans-68.9-39.5180-170.1-124.3000112.4I63 M81 I82 K83 G87 Q88 V89I63-Y85 HydrophobicContact CD1-CD1 3.5Å; I63-Y85 HydrophobicContact CD1-CE1 3.41Å; I63-Y85 VanDerWaalsContact CD1-CE1 3.41Å; I63-Y85 HydrophobicContact CG1-CD1 3.98Å; I63-Y85 HydrophobicContact CG1-CE1 4.05Å; M81-Y85 WeakPolarHBondContact O-CB 3.4Å; M81-Y85 PolarHBondContact O-N 3.4Å; I82-Y85 PolarHBondContact O-N 2.9Å; K83-Y85 PolarHBondContact O-N 3.11Å; Y85-G87 VanDerWaalsContact C-N 3.31Å; Y85-G87 PolarHBondContact O-N 3.04Å; Y85-Q88 WeakPolarHBondContact O-CB 3.02Å; Y85-Q88 PolarHBondContact O-N 3.42Å; Y85-Q88 VanDerWaalsContact O-N 3.15Å; Y85-V89 PolarHBondContact O-N 2.87Å; Y85-V89 VanDerWaalsContact O-N 3.16Å
86R97.7Very high96.7Very high63 Ų6380 Ų8024%0.23838%0.378CS..Hα-helixtrans-55.8-47.1171.2-176.2177.151.9105.6-13.8111I63 T64 E67 I82 K83 Q88 V89 E90I63-R86 HydrophobicContact CG2-CB 3.73Å; I63-R86 HydrophobicContact CG2-CG 4.37Å; T64-R86 WeakPolarHBondContact OG1-CD 3.33Å; E67-R86 IonicContact OE1-CZ 2.73Å; E67-R86 IonicContact OE1-NE 3.85Å; E67-R86 IonicContact OE1-NH2 3.85Å; E67-R86 PolarHBondContact OE1-NH2 3.4Å; E67-R86 VanDerWaalsContact OE2-CD 3.26Å; E67-R86 WeakPolarHBondContact OE2-CD 3.37Å; E67-R86 IonicContact OE2-CZ 3.66Å; E67-R86 IonicContact OE2-NE 3.66Å; E67-R86 PolarHBondContact OE2-NE 3.08Å; E67-R86 IonicContact OE2-NH2 3.66Å; I82-R86 PolarHBondContact O-N 2.76Å; K83-R86 PolarHBondContact O-N 3.01Å; R86-Q88 VanDerWaalsContact C-N 3.26Å; R86-Q88 PolarHBondContact O-N 2.94Å; R86-V89 PolarHBondContact O-N 2.85Å; R86-V89 VanDerWaalsContact O-N 3.12Å; R86-E90 WeakPolarHBondContact CD-OE1 3.05Å; R86-E90 HydrophobicContact CG-CG 4.27Å; R86-E90 WeakPolarHBondContact CG-OE1 2.8Å; R86-E90 IonicContact CZ-OE1 3.52Å; R86-E90 IonicContact NE-OE1 3.99Å; R86-E90 IonicContact NH1-OE1 3.43Å; R86-E90 PolarHBondContact NH1-OE1 3.29Å; R86-E90 IonicContact NH1-OE2 3.29Å; R86-E90 WeakPolarHBondContact O-CG 3.48Å; R86-E90 PolarHBondContact O-N 3.25Å
87G97.9Very high97.1Very high33 Ų3372.2 Ų72.234%0.3434%0.342SS..Hα-helixtrans-60.4-32.5178.300000113.8K83 T84 Y85 K91K83-G87 PolarHBondContact O-N 3.06Å; T84-G87 PolarHBondContact O-N 3.33Å; Y85-G87 VanDerWaalsContact C-N 3.31Å; Y85-G87 PolarHBondContact O-N 3.04Å; G87-K91 PolarHBondContact O-N 3.25Å
88Q98.3Very high97.4Very high103 Ų10366.4 Ų66.448%0.48132%0.32SS..Hα-helixtrans-66.6-45.9173.1-68.1175.11.300111.5T84 Y85 R86 E90 K91 E92T84-Q88 PolarHBondContact O-N 3.37Å; Y85-Q88 WeakPolarHBondContact O-CB 3.02Å; Y85-Q88 PolarHBondContact O-N 3.42Å; Y85-Q88 VanDerWaalsContact O-N 3.15Å; R86-Q88 VanDerWaalsContact C-N 3.26Å; R86-Q88 PolarHBondContact O-N 2.94Å; Q88-E90 PolarHBondContact O-N 3.19Å; Q88-K91 WeakPolarHBondContact O-CB 3.32Å; Q88-K91 PolarHBondContact O-N 3.36Å; Q88-E92 PolarHBondContact O-N 3.33Å
89V98.3Very high97.7Very high5 Ų562.5 Ų62.53%0.0331%0.305CS..Hα-helixtrans-65.4-39.1177.3-179.50000111.6W60 I63 Y85 R86 K91 E92 L93W60-V89 HydrophobicContact CB-CG1 3.81Å; I63-V89 HydrophobicContact CD1-CB 4.37Å; I63-V89 HydrophobicContact CD1-CG2 3.58Å; Y85-V89 PolarHBondContact O-N 2.87Å; Y85-V89 VanDerWaalsContact O-N 3.16Å; R86-V89 PolarHBondContact O-N 2.85Å; R86-V89 VanDerWaalsContact O-N 3.12Å; V89-K91 VanDerWaalsContact C-N 3.29Å; V89-K91 PolarHBondContact O-N 3.5Å; V89-E92 PolarHBondContact O-N 3.18Å; V89-L93 HydrophobicContact CG1-CD1 4.43Å; V89-L93 WeakPolarHBondContact O-CG 3.37Å; V89-L93 PolarHBondContact O-N 2.87Å
90E98.4Very high97.9Very high28 Ų2861 Ų6113%0.13130%0.297CS..Hα-helixtrans-62.5-35.9173.8-72.8175.9179.700112.3W60 R86 Q88 R94 F135W60-E90 PolarHBondContact NE1-OE1 3.02Å; R86-E90 WeakPolarHBondContact CD-OE1 3.05Å; R86-E90 HydrophobicContact CG-CG 4.27Å; R86-E90 WeakPolarHBondContact CG-OE1 2.8Å; R86-E90 IonicContact CZ-OE1 3.52Å; R86-E90 IonicContact NE-OE1 3.99Å; R86-E90 IonicContact NH1-OE1 3.43Å; R86-E90 PolarHBondContact NH1-OE1 3.29Å; R86-E90 IonicContact NH1-OE2 3.29Å; R86-E90 WeakPolarHBondContact O-CG 3.48Å; R86-E90 PolarHBondContact O-N 3.25Å; Q88-E90 PolarHBondContact O-N 3.19Å; E90-R94 WeakPolarHBondContact O-CB 3.46Å; E90-R94 PolarHBondContact O-N 2.88Å; E90-F135 HydrophobicContact CB-CD2 3.85Å; E90-F135 HydrophobicContact CB-CE2 4.15Å; E90-F135 HydrophobicContact CG-CB 4.05Å; E90-F135 HydrophobicContact CG-CD2 3.8Å; E90-F135 HydrophobicContact CG-CG 4.11Å; E90-F135 WeakPolarHBondContact O-CE2 3.31Å
91K98.4Very high98.1Very high126 Ų12656 Ų5655%0.54827%0.274SS..Hα-helixtrans-64.7-47172.6-174.9-172.1173.3-63.10111G87 Q88 V89 L93 R94 D95G87-K91 PolarHBondContact O-N 3.25Å; Q88-K91 WeakPolarHBondContact O-CB 3.32Å; Q88-K91 PolarHBondContact O-N 3.36Å; V89-K91 VanDerWaalsContact C-N 3.29Å; V89-K91 PolarHBondContact O-N 3.5Å; K91-L93 PolarHBondContact O-N 3.49Å; K91-R94 PolarHBondContact O-N 3.45Å; K91-D95 IonicContact NZ-OD2 3.03Å; K91-D95 PolarHBondContact NZ-OD2 3.32Å; K91-D95 VanDerWaalsContact O-CG 3.25Å; K91-D95 PolarHBondContact O-N 3.48Å
92E98.4Very high98.2Very high82 Ų8252.6 Ų52.638%0.38326%0.259SS..Hα-helixtrans-58.5-46.5176.2-68.8178.8-157.900111.8R56 Q88 V89 R94 D95 I96R56-E92 HydrophobicContact CG-CB 4.12Å; R56-E92 IonicContact CZ-OE2 2.71Å; R56-E92 IonicContact NE-OE2 3.16Å; R56-E92 PolarHBondContact NE-OE2 2.88Å; R56-E92 IonicContact NH2-OE2 3.76Å; Q88-E92 PolarHBondContact O-N 3.33Å; V89-E92 PolarHBondContact O-N 3.18Å; E92-R94 VanDerWaalsContact C-N 3.32Å; E92-R94 PolarHBondContact O-N 2.87Å; E92-D95 PolarHBondContact O-N 3.49Å; E92-I96 WeakPolarHBondContact O-CD1 3.48Å; E92-I96 VanDerWaalsContact O-CG1 3.26Å; E92-I96 WeakPolarHBondContact O-CG1 3.44Å; E92-I96 PolarHBondContact O-N 3.11Å
93L98.4Very high98.3Very high0 Ų051.6 Ų51.60%025%0.254CS..Hα-helixtrans-56.5-46.1175.2-78.9171.4000111.8I53 R56 R57 W60 V89 K91 D95 I96 C97 F135I53-L93 HydrophobicContact CD1-CD2 3.59Å; I53-L93 HydrophobicContact CG1-CD2 4.13Å; R56-L93 HydrophobicContact CB-CD2 3.51Å; R56-L93 HydrophobicContact CB-CG 3.91Å; R57-L93 HydrophobicContact CG-CD2 3.72Å; W60-L93 HydrophobicContact CB-CD1 3.79Å; W60-L93 HydrophobicContact CG-CD1 3.95Å; V89-L93 HydrophobicContact CG1-CD1 4.43Å; V89-L93 WeakPolarHBondContact O-CG 3.37Å; V89-L93 PolarHBondContact O-N 2.87Å; K91-L93 PolarHBondContact O-N 3.49Å; L93-D95 VanDerWaalsContact C-N 3.35Å; L93-I96 PolarHBondContact O-N 3.15Å; L93-C97 WeakPolarHBondContact O-CB 3.4Å; L93-C97 PolarHBondContact O-N 3.45Å; L93-C97 PolarHBondContact O-SG 3.21Å; L93-F135 HydrophobicContact CB-CD1 4.45Å; L93-F135 HydrophobicContact CB-CE1 3.68Å; L93-F135 HydrophobicContact CB-CZ 3.73Å; L93-F135 HydrophobicContact CD1-CD1 4Å; L93-F135 HydrophobicContact CD1-CE1 4.03Å; L93-F135 HydrophobicContact CG-CE1 4.43Å
94R98.5Very high98.4Very high88 Ų8848.4 Ų48.433%0.33224%0.24SC..Hα-helixtrans-63.5-41178.7-169.4-177.8-55.7-103-0.5112E90 K91 E92 S98 L132 F135 D140E90-R94 WeakPolarHBondContact O-CB 3.46Å; E90-R94 PolarHBondContact O-N 2.88Å; K91-R94 PolarHBondContact O-N 3.45Å; E92-R94 VanDerWaalsContact C-N 3.32Å; E92-R94 PolarHBondContact O-N 2.87Å; R94-S98 VanDerWaalsContact O-CB 3.26Å; R94-S98 WeakPolarHBondContact O-CB 3.47Å; R94-S98 PolarHBondContact O-N 3.03Å; R94-S98 PolarHBondContact O-OG 2.92Å; R94-L132 HydrophobicContact CB-CD2 4.38Å; R94-L132 HydrophobicContact CG-CD2 4.11Å; R94-F135 HydrophobicContact CB-CE2 4.31Å; R94-F135 HydrophobicContact CB-CZ 4.19Å; R94-D140 IonicContact NH1-OD2 2.85Å; R94-D140 PolarHBondContact NH1-OD2 3.35Å
95D98.6Very high98.4Very high78 Ų7849.2 Ų49.242%0.41724%0.239SC..Hα-helixtrans-64.8-45.3178.3-69.2-19.4000110.3K91 E92 L93 S98 D99K91-D95 IonicContact NZ-OD2 3.03Å; K91-D95 PolarHBondContact NZ-OD2 3.32Å; K91-D95 VanDerWaalsContact O-CG 3.25Å; K91-D95 PolarHBondContact O-N 3.48Å; E92-D95 PolarHBondContact O-N 3.49Å; L93-D95 VanDerWaalsContact C-N 3.35Å; D95-S98 PolarHBondContact O-N 3.24Å; D95-D99 WeakPolarHBondContact O-CB 3.42Å; D95-D99 PolarHBondContact O-N 3.26Å
96I98.4Very high98.4Very high23 Ų2349.2 Ų49.212%0.11824%0.242CC..Hα-helixtrans-62.2-48176.9-62.4155.9000110.9Y49 V52 I53 R56 E92 L93 D99 I100 Y128Y49-I96 HydrophobicContact CD1-CG2 4.18Å; V52-I96 HydrophobicContact CG1-CD1 3.68Å; V52-I96 HydrophobicContact CG1-CG1 3.93Å; V52-I96 HydrophobicContact CG1-CG2 4.26Å; I53-I96 HydrophobicContact CB-CG2 4.12Å; I53-I96 HydrophobicContact CD1-CB 3.76Å; I53-I96 HydrophobicContact CD1-CD1 4.26Å; I53-I96 HydrophobicContact CD1-CG2 3.54Å; I53-I96 HydrophobicContact CG1-CG2 4.4Å; R56-I96 HydrophobicContact CB-CD1 4.27Å; R56-I96 HydrophobicContact CG-CD1 3.91Å; E92-I96 WeakPolarHBondContact O-CD1 3.48Å; E92-I96 VanDerWaalsContact O-CG1 3.26Å; E92-I96 WeakPolarHBondContact O-CG1 3.44Å; E92-I96 PolarHBondContact O-N 3.11Å; L93-I96 PolarHBondContact O-N 3.15Å; I96-D99 WeakPolarHBondContact O-CB 3.38Å; I96-D99 PolarHBondContact O-N 3.24Å; I96-I100 WeakPolarHBondContact O-CG2 3.41Å; I96-I100 PolarHBondContact O-N 3.46Å; I96-I100 VanDerWaalsContact O-N 3.17Å; I96-Y128 HydrophobicContact CG2-CE1 4.49Å
97C98.5Very high98.4Very high0 Ų048.3 Ų48.30%024%0.24CC..Hα-helixtrans-61.5-46.2178.8-66.60000111.4L93 D99 I100 L101 Y128 L132L93-C97 WeakPolarHBondContact O-CB 3.4Å; L93-C97 PolarHBondContact O-N 3.45Å; L93-C97 PolarHBondContact O-SG 3.21Å; C97-D99 PolarHBondContact O-N 3.12Å; C97-I100 WeakPolarHBondContact O-CG2 3.42Å; C97-L101 VanDerWaalsContact O-CB 3.26Å; C97-L101 WeakPolarHBondContact O-CB 3.1Å; C97-L101 WeakPolarHBondContact O-CD1 3.26Å; C97-L101 WeakPolarHBondContact O-CG 3.4Å; C97-L101 PolarHBondContact O-N 3.34Å; C97-Y128 HydrophobicContact CB-CD1 4.26Å; C97-L132 HydrophobicContact CB-CD1 4.04Å; C97-L132 HydrophobicContact CB-CD2 3.61Å; C97-L132 HydrophobicContact CB-CG 3.66Å
98S98.4Very high98.5Very high49 Ų4947 Ų4734%0.34323%0.225SC..Hα-helixtrans-61.1-37178.5-58.90000111.3R94 D95 N102R94-S98 VanDerWaalsContact O-CB 3.26Å; R94-S98 WeakPolarHBondContact O-CB 3.47Å; R94-S98 PolarHBondContact O-N 3.03Å; R94-S98 PolarHBondContact O-OG 2.92Å; D95-S98 PolarHBondContact O-N 3.24Å; S98-N102 WeakPolarHBondContact O-CB 3.14Å; S98-N102 PolarHBondContact O-N 3.31Å; S98-N102 PolarHBondContact O-ND2 3.35Å
99D98.5Very high98.5Very high44 Ų4443.6 Ų43.624%0.23521%0.21CC..Hα-helixtrans-64.9-54.2-180-168.844000112.5K28 Y49 D95 I96 C97 L101 N102 V103K28-D99 WeakPolarHBondContact CD-OD2 3.4Å; K28-D99 VanDerWaalsContact CE-OD1 3.27Å; K28-D99 WeakPolarHBondContact CE-OD1 3.39Å; K28-D99 WeakPolarHBondContact CE-OD2 3.43Å; K28-D99 IonicContact NZ-OD1 3.4Å; K28-D99 PolarHBondContact NZ-OD1 3.23Å; K28-D99 IonicContact NZ-OD2 3.85Å; K28-D99 PolarHBondContact NZ-OD2 3.48Å; Y49-D99 HydrophobicContact CE1-CB 4.45Å; Y49-D99 PolarHBondContact OH-OD2 2.6Å; D95-D99 WeakPolarHBondContact O-CB 3.42Å; D95-D99 PolarHBondContact O-N 3.26Å; I96-D99 WeakPolarHBondContact O-CB 3.38Å; I96-D99 PolarHBondContact O-N 3.24Å; C97-D99 PolarHBondContact O-N 3.12Å; D99-L101 PolarHBondContact O-N 2.87Å; D99-N102 WeakPolarHBondContact O-CB 3.36Å; D99-N102 PolarHBondContact O-N 3.02Å; D99-V103 WeakPolarHBondContact O-CG2 3.29Å; D99-V103 PolarHBondContact O-N 3.21Å; D99-V103 VanDerWaalsContact O-N 3.08Å
100I98.5Very high98.4Very high0 Ų047.5 Ų47.50%024%0.236CC..Hα-helixtrans-65.9-38.3178.3-177.856.6000112.3L45 Y49 I96 C97 N102 V103 L104 M124 Y128L45-I100 HydrophobicContact CD2-CD1 4.5Å; Y49-I100 HydrophobicContact CD1-CB 3.79Å; Y49-I100 HydrophobicContact CD1-CG1 4.4Å; Y49-I100 HydrophobicContact CD1-CG2 4.41Å; Y49-I100 HydrophobicContact CD2-CB 4.45Å; Y49-I100 HydrophobicContact CD2-CD1 3.74Å; Y49-I100 HydrophobicContact CD2-CG1 4.33Å; Y49-I100 HydrophobicContact CE1-CB 3.65Å; Y49-I100 HydrophobicContact CE1-CG2 4.49Å; Y49-I100 HydrophobicContact CE2-CB 4.31Å; Y49-I100 HydrophobicContact CE2-CD1 3.7Å; Y49-I100 HydrophobicContact CE2-CG1 4.45Å; Y49-I100 HydrophobicContact CG-CB 4.18Å; Y49-I100 HydrophobicContact CG-CD1 4.18Å; Y49-I100 HydrophobicContact CG-CG1 4.28Å; I96-I100 WeakPolarHBondContact O-CG2 3.41Å; I96-I100 PolarHBondContact O-N 3.46Å; I96-I100 VanDerWaalsContact O-N 3.17Å; C97-I100 WeakPolarHBondContact O-CG2 3.42Å; I100-N102 VanDerWaalsContact C-N 3.28Å; I100-N102 PolarHBondContact O-N 3.08Å; I100-V103 HydrophobicContact CD1-CB 4.46Å; I100-V103 PolarHBondContact O-N 2.89Å; I100-V103 VanDerWaalsContact O-N 3.12Å; I100-L104 HydrophobicContact CD1-CD1 4.31Å; I100-L104 HydrophobicContact CD1-CG 4.01Å; I100-L104 HydrophobicContact CG1-CD1 3.89Å; I100-L104 HydrophobicContact CG1-CG 4.13Å; I100-L104 WeakPolarHBondContact O-CB 3.48Å; I100-L104 VanDerWaalsContact O-CG 3.29Å; I100-L104 WeakPolarHBondContact O-CG 3.5Å; I100-L104 PolarHBondContact O-N 3.47Å; I100-M124 HydrophobicContact CD1-CE 4.11Å; I100-M124 HydrophobicContact CD1-SD 4.13Å; I100-M124 HydrophobicContact CG1-CE 4.14Å; I100-M124 HydrophobicContact CG1-SD 4.27Å; I100-Y128 HydrophobicContact CG1-CD2 4.18Å; I100-Y128 HydrophobicContact CG1-CE2 4.1Å; I100-Y128 HydrophobicContact CG2-CD1 3.31Å; I100-Y128 HydrophobicContact CG2-CD2 3.67Å; I100-Y128 HydrophobicContact CG2-CE1 3.58Å; I100-Y128 HydrophobicContact CG2-CE2 3.95Å; I100-Y128 HydrophobicContact CG2-CG 3.36Å
101L98.7Very high98.4Very high13 Ų1347.6 Ų47.67%0.06824%0.239CC..Hα-helixtrans-60.1-41.5176.4-71.8170.6000110.9C97 D99 L104 E105 K125 L132C97-L101 VanDerWaalsContact O-CB 3.26Å; C97-L101 WeakPolarHBondContact O-CB 3.1Å; C97-L101 WeakPolarHBondContact O-CD1 3.26Å; C97-L101 WeakPolarHBondContact O-CG 3.4Å; C97-L101 PolarHBondContact O-N 3.34Å; D99-L101 PolarHBondContact O-N 2.87Å; L101-L104 PolarHBondContact O-N 3.44Å; L101-E105 WeakPolarHBondContact O-CB 3.29Å; L101-E105 VanDerWaalsContact O-CG 3.31Å; L101-E105 WeakPolarHBondContact O-CG 3.22Å; L101-E105 PolarHBondContact O-N 3.34Å; L101-K125 HydrophobicContact CD2-CB 4.45Å; L101-K125 HydrophobicContact CD2-CG 3.83Å; L101-L132 HydrophobicContact CD1-CD1 3.8Å
102N98.6Very high98.3Very high68 Ų6842 Ų4236%0.36422%0.216SC..Hα-helixtrans-62.2-42.6173.7-85-63.6000112.6S98 D99 I100 K106S98-N102 WeakPolarHBondContact O-CB 3.14Å; S98-N102 PolarHBondContact O-N 3.31Å; S98-N102 PolarHBondContact O-ND2 3.35Å; D99-N102 WeakPolarHBondContact O-CB 3.36Å; D99-N102 PolarHBondContact O-N 3.02Å; I100-N102 VanDerWaalsContact C-N 3.28Å; I100-N102 PolarHBondContact O-N 3.08Å; N102-K106 VanDerWaalsContact O-CB 3.26Å; N102-K106 WeakPolarHBondContact O-CB 3.41Å; N102-K106 VanDerWaalsContact O-CG 3.31Å; N102-K106 WeakPolarHBondContact O-CG 3.45Å; N102-K106 PolarHBondContact O-N 3.05Å; N102-K106 PolarHBondContact OD1-NZ 3.49Å
103V98.6Very high98.2Very high9 Ų943 Ų436%0.05523%0.228CC..Hα-helixtrans-64.5-43.8178.1174.50000111K28 A31 D99 I100 H107 L108K28-V103 HydrophobicContact CG-CG2 4.08Å; A31-V103 HydrophobicContact CB-CG1 3.63Å; D99-V103 WeakPolarHBondContact O-CG2 3.29Å; D99-V103 PolarHBondContact O-N 3.21Å; D99-V103 VanDerWaalsContact O-N 3.08Å; I100-V103 HydrophobicContact CD1-CB 4.46Å; I100-V103 PolarHBondContact O-N 2.89Å; I100-V103 VanDerWaalsContact O-N 3.12Å; V103-H107 WeakPolarHBondContact O-CB 3.44Å; V103-H107 PolarHBondContact O-N 3.49Å; V103-H107 VanDerWaalsContact O-N 3.07Å; V103-L108 HydrophobicContact CG1-CD1 3.78Å; V103-L108 HydrophobicContact CG1-CG 4.09Å; V103-L108 PolarHBondContact O-N 2.94Å
104L98.7Very high98.1Very high0 Ų045.2 Ų45.20%024%0.244CC..Iπ-helixtrans-60.9-50.2177.6-72.3168.1000111.3I100 L101 L108 I109 Y121 M124 K125I100-L104 HydrophobicContact CD1-CD1 4.31Å; I100-L104 HydrophobicContact CD1-CG 4.01Å; I100-L104 HydrophobicContact CG1-CD1 3.89Å; I100-L104 HydrophobicContact CG1-CG 4.13Å; I100-L104 WeakPolarHBondContact O-CB 3.48Å; I100-L104 VanDerWaalsContact O-CG 3.29Å; I100-L104 WeakPolarHBondContact O-CG 3.5Å; I100-L104 PolarHBondContact O-N 3.47Å; L101-L104 PolarHBondContact O-N 3.44Å; L104-L108 HydrophobicContact CD2-CB 4.39Å; L104-L108 HydrophobicContact CD2-CD1 3.95Å; L104-L108 PolarHBondContact O-N 3.18Å; L104-I109 HydrophobicContact CB-CD1 4.22Å; L104-I109 WeakPolarHBondContact O-CB 3.32Å; L104-I109 WeakPolarHBondContact O-CG1 3.26Å; L104-I109 PolarHBondContact O-N 2.58Å; L104-Y121 HydrophobicContact CD2-CD1 3.73Å; L104-Y121 HydrophobicContact CD2-CG 4.09Å; L104-M124 HydrophobicContact CD1-CB 4.2Å; L104-M124 HydrophobicContact CD1-CG 4.13Å; L104-M124 HydrophobicContact CD1-SD 4.47Å; L104-M124 HydrophobicContact CD2-CB 4.45Å; L104-M124 HydrophobicContact CD2-SD 4.16Å; L104-K125 HydrophobicContact CD1-CB 4.14Å
105E98.3Very high98.1Very high90 Ų9041.6 Ų41.642%0.42123%0.233SC..Iπ-helixtrans-71.4-38.9-175.1-71.1-176.8161.200113.4L101 P110 K125L101-E105 WeakPolarHBondContact O-CB 3.29Å; L101-E105 VanDerWaalsContact O-CG 3.31Å; L101-E105 WeakPolarHBondContact O-CG 3.22Å; L101-E105 PolarHBondContact O-N 3.34Å; E105-P110 WeakPolarHBondContact O-CD 3.36Å; E105-P110 WeakPolarHBondContact O-CG 3.17Å; E105-K125 VanDerWaalsContact OE1-CE 3.24Å; E105-K125 WeakPolarHBondContact OE1-CE 3.24Å; E105-K125 IonicContact OE1-NZ 3.57Å; E105-K125 PolarHBondContact OE1-NZ 3.4Å
106K98.1Very high98Very high132 Ų13240.6 Ų40.657%0.57423%0.226SC*.Iπ-helixtrans-84.5-33.7-174.4-66.8178.5-176.6172.40113.5N102N102-K106 VanDerWaalsContact O-CB 3.26Å; N102-K106 WeakPolarHBondContact O-CB 3.41Å; N102-K106 VanDerWaalsContact O-CG 3.31Å; N102-K106 WeakPolarHBondContact O-CG 3.45Å; N102-K106 PolarHBondContact O-N 3.05Å; N102-K106 PolarHBondContact OD1-NZ 3.49Å
107H98.4Very high97.9Very high44 Ų4439.8 Ų39.820%0.20422%0.223CC..Iπ-helixtrans-123.4-49.9-166.6-56.7-61.8000112.8A31 D34 V103 C111A31-H107 WeakPolarHBondContact O-CB 3.31Å; D34-H107 IonicContact OD1-CE1 3.32Å; D34-H107 IonicContact OD1-CG 3.41Å; D34-H107 IonicContact OD1-ND1 2.73Å; D34-H107 PolarHBondContact OD1-ND1 3.27Å; D34-H107 IonicContact OD2-ND1 3.51Å; V103-H107 WeakPolarHBondContact O-CB 3.44Å; V103-H107 PolarHBondContact O-N 3.49Å; V103-H107 VanDerWaalsContact O-N 3.07Å; H107-C111 VanDerWaalsContact O-CB 3.32Å; H107-C111 WeakPolarHBondContact O-CB 3.32Å; H107-C111 PolarHBondContact O-N 3.01Å; H107-C111 PolarHBondContact O-SG 3.32Å
108L98.5Very high97.9Very high6 Ų643.1 Ų43.13%0.03124%0.237CC..Iπ-helixtrans-84-48.3-166.6-58.5175.6000114.1A31 L37 L45 V103 L104 C111 A112 Y121A31-L108 HydrophobicContact CB-CD2 3.74Å; A31-L108 HydrophobicContact CB-CG 4.25Å; L37-L108 HydrophobicContact CD1-CD2 3.56Å; L37-L108 HydrophobicContact CD2-CD2 4.5Å; L37-L108 HydrophobicContact CG-CD2 3.82Å; L45-L108 HydrophobicContact CD2-CD1 3.3Å; V103-L108 HydrophobicContact CG1-CD1 3.78Å; V103-L108 HydrophobicContact CG1-CG 4.09Å; V103-L108 PolarHBondContact O-N 2.94Å; L104-L108 HydrophobicContact CD2-CB 4.39Å; L104-L108 HydrophobicContact CD2-CD1 3.95Å; L104-L108 PolarHBondContact O-N 3.18Å; L108-C111 PolarHBondContact O-N 3.18Å; L108-A112 PolarHBondContact O-N 2.95Å; L108-Y121 HydrophobicContact CB-CD1 4.07Å; L108-Y121 HydrophobicContact CB-CD2 4.06Å; L108-Y121 HydrophobicContact CB-CE1 4.01Å; L108-Y121 HydrophobicContact CB-CE2 4Å; L108-Y121 HydrophobicContact CB-CG 4.12Å; L108-Y121 HydrophobicContact CD1-CD1 4.22Å; L108-Y121 HydrophobicContact CD1-CE1 3.95Å; L108-Y121 HydrophobicContact CG-CE1 4.41Å
109I98.4Very high97.9Very high30 Ų3040.8 Ų40.815%0.15422%0.221CC..Hα-helixtrans-61.9-44.5178.1-67171.1000111L104 C111 A112 Y122 K125L104-I109 HydrophobicContact CB-CD1 4.22Å; L104-I109 WeakPolarHBondContact O-CB 3.32Å; L104-I109 WeakPolarHBondContact O-CG1 3.26Å; L104-I109 PolarHBondContact O-N 2.58Å; I109-C111 VanDerWaalsContact C-N 3.28Å; I109-C111 PolarHBondContact O-N 3.28Å; I109-A112 PolarHBondContact O-N 3.06Å; I109-Y122 HydrophobicContact CD1-CD1 4.36Å; I109-Y122 HydrophobicContact CD1-CE1 4.24Å; I109-Y122 HydrophobicContact CG2-CE1 4.47Å; I109-Y122 HydrophobicContact CG2-CE2 4.11Å; I109-K125 HydrophobicContact CD1-CD 4.13Å
110P98.1Very high97.9Very high88 Ų8839.7 Ų39.757%0.57121%0.214SC*.Hα-helixtrans-62.5-31.5176.9-25.636.6000114.4E105E105-P110 WeakPolarHBondContact O-CD 3.36Å; E105-P110 WeakPolarHBondContact O-CG 3.17Å
111C97Very high97.9Very high30 Ų3039.8 Ų39.820%0.20321%0.214CC..Hα-helixtrans-91-7.6-178.2-66.10000114D34 H107 L108 I109 T113D34-C111 PolarHBondContact O-SG 2.68Å; H107-C111 VanDerWaalsContact O-CB 3.32Å; H107-C111 WeakPolarHBondContact O-CB 3.32Å; H107-C111 PolarHBondContact O-N 3.01Å; H107-C111 PolarHBondContact O-SG 3.32Å; L108-C111 PolarHBondContact O-N 3.18Å; I109-C111 VanDerWaalsContact C-N 3.28Å; I109-C111 PolarHBondContact O-N 3.28Å; C111-T113 PolarHBondContact O-N 3.39Å
112A97.2Very high97.9Very high9 Ų942.4 Ų42.47%0.07422%0.224CC..  trans-72.9116.9-178.500000111.4L108 I109 K118 Y121L108-A112 PolarHBondContact O-N 2.95Å; I109-A112 PolarHBondContact O-N 3.06Å; A112-K118 HydrophobicContact CB-CG 3.77Å; A112-K118 WeakPolarHBondContact O-CE 3.34Å; A112-Y121 HydrophobicContact CB-CD2 3.78Å; A112-Y121 HydrophobicContact CB-CE2 3.88Å
113T96.4Very high97.9Very high101 Ų10140.3 Ų40.362%0.6221%0.212SC*.  trans-98.7-40.5-179.168.80000112E36 C111 K118E36-T113 VanDerWaalsContact CD-OG1 3.29Å; E36-T113 PolarHBondContact OE1-N 3.49Å; E36-T113 PolarHBondContact OE1-OG1 3.5Å; E36-T113 WeakPolarHBondContact OE2-CB 3.41Å; E36-T113 WeakPolarHBondContact OE2-CG2 3.25Å; E36-T113 PolarHBondContact OE2-OG1 3.15Å; C111-T113 PolarHBondContact O-N 3.39Å; T113-K118 PolarHBondContact O-NZ 2.81Å
114S96.4Very high97.9Very high48 Ų4840.4 Ų40.434%0.33621%0.211SC..SBendtrans-78.4152-179.175.60000112.9E116 S117 K118S114-E116 VanDerWaalsContact C-N 3.26Å; S114-E116 PolarHBondContact O-N 3.35Å; S114-S117 PolarHBondContact O-N 2.95Å; S114-S117 VanDerWaalsContact OG-CB 3.3Å; S114-S117 WeakPolarHBondContact OG-CB 3.45Å; S114-S117 PolarHBondContact OG-N 3.48Å; S114-S117 PolarHBondContact OG-OG 3.2Å; S114-K118 WeakPolarHBondContact O-CG 3.25Å; S114-K118 PolarHBondContact O-N 2.98Å; S114-K118 VanDerWaalsContact O-N 3.11Å
115G96.9Very high97.9Very high11 Ų1142 Ų4211%0.11322%0.218CC..Hα-helixtrans-57.5-42.4171.700000111.7K118 V119 D162G115-K118 PolarHBondContact O-N 3.47Å; G115-V119 WeakPolarHBondContact O-CG2 3.43Å; G115-V119 PolarHBondContact O-N 2.72Å; G115-D162 WeakPolarHBondContact CA-OD2 3.38Å
116E96.8Very high97.9Very high57 Ų5737.7 Ų37.727%0.26620%0.198SC..Hα-helixtrans-57.5-51.7177.1-167.1-170.9129.500112.6R42 S114 K118 V119 F120 L163 H167 I169R42-E116 IonicContact CZ-OE1 3.04Å; R42-E116 IonicContact NH1-OE1 2.61Å; R42-E116 PolarHBondContact NH1-OE1 2.91Å; R42-E116 IonicContact NH2-OE1 2.75Å; R42-E116 PolarHBondContact NH2-OE1 3.45Å; S114-E116 VanDerWaalsContact C-N 3.26Å; S114-E116 PolarHBondContact O-N 3.35Å; E116-K118 VanDerWaalsContact C-N 3.33Å; E116-K118 PolarHBondContact O-N 3.02Å; E116-V119 PolarHBondContact O-N 2.93Å; E116-F120 WeakPolarHBondContact O-CB 3.49Å; E116-F120 PolarHBondContact O-N 3.03Å; E116-L163 HydrophobicContact CB-CD2 4.12Å; E116-L163 HydrophobicContact CG-CD2 4.45Å; E116-H167 IonicContact OE2-NE2 2.84Å; E116-I169 HydrophobicContact CG-CD1 3.45Å; E116-I169 VanDerWaalsContact CG-CD1 3.45Å
117S97.7Very high98Very high7 Ų731.5 Ų31.55%0.04917%0.172CC..Hα-helixtrans-59.9-43.1178-69.20000111.5E36 S114 F120 Y121E36-S117 PolarHBondContact OE1-OG 3.3Å; S114-S117 PolarHBondContact O-N 2.95Å; S114-S117 VanDerWaalsContact OG-CB 3.3Å; S114-S117 WeakPolarHBondContact OG-CB 3.45Å; S114-S117 PolarHBondContact OG-N 3.48Å; S114-S117 PolarHBondContact OG-OG 3.2Å; S117-F120 PolarHBondContact O-N 3.34Å; S117-Y121 WeakPolarHBondContact O-CD2 3.41Å; S117-Y121 PolarHBondContact O-N 2.91Å
118K98.4Very high98Very high70 Ų7029.5 Ų29.530%0.30416%0.162SC..Hα-helixtrans-63.2-49.2178.7-70.5170.4-173.7166.50111.6A112 T113 S114 G115 E116 F120 Y121 Y122 I158A112-K118 HydrophobicContact CB-CG 3.77Å; A112-K118 WeakPolarHBondContact O-CE 3.34Å; T113-K118 PolarHBondContact O-NZ 2.81Å; S114-K118 WeakPolarHBondContact O-CG 3.25Å; S114-K118 PolarHBondContact O-N 2.98Å; S114-K118 VanDerWaalsContact O-N 3.11Å; G115-K118 PolarHBondContact O-N 3.47Å; E116-K118 VanDerWaalsContact C-N 3.33Å; E116-K118 PolarHBondContact O-N 3.02Å; K118-F120 VanDerWaalsContact C-N 3.28Å; K118-F120 PolarHBondContact O-N 2.67Å; K118-Y121 PolarHBondContact O-N 3.41Å; K118-Y122 HydrophobicContact CB-CD2 4.48Å; K118-Y122 WeakPolarHBondContact O-CB 3.37Å; K118-Y122 VanDerWaalsContact O-CD2 3.25Å; K118-Y122 WeakPolarHBondContact O-CD2 3.48Å; K118-Y122 PolarHBondContact O-N 3.27Å; K118-I158 HydrophobicContact CB-CD1 3.93Å; K118-I158 HydrophobicContact CB-CG2 4.4Å; K118-I158 HydrophobicContact CD-CD1 4.4Å
119V98.6Very high98Very high0 Ų030 Ų300%017%0.165CC..Hα-helixtrans-59.7-43.7178.8178.40000109.9G115 E116 K123 A155 I158 A159 L163 I169 L173G115-V119 WeakPolarHBondContact O-CG2 3.43Å; G115-V119 PolarHBondContact O-N 2.72Å; E116-V119 PolarHBondContact O-N 2.93Å; V119-K123 WeakPolarHBondContact O-CB 3.5Å; V119-K123 PolarHBondContact O-N 3.31Å; V119-A155 HydrophobicContact CG1-CB 4.44Å; V119-I158 HydrophobicContact CG2-CB 3.82Å; V119-I158 HydrophobicContact CG2-CG2 3.6Å; V119-A159 HydrophobicContact CG1-CB 3.88Å; V119-A159 HydrophobicContact CG2-CB 3.84Å; V119-L163 HydrophobicContact CB-CD1 4.02Å; V119-L163 HydrophobicContact CG1-CD1 4.03Å; V119-L163 HydrophobicContact CG2-CD1 3.91Å; V119-I169 HydrophobicContact CB-CG2 4.08Å; V119-I169 HydrophobicContact CG1-CG2 3.58Å; V119-L173 HydrophobicContact CG1-CD2 4.05Å
120F98.2Very high98Very high20 Ų2028.6 Ų28.69%0.08816%0.157CC..Hα-helixtrans-57.3-51.8177.3-169.5-83.3000112.2R42 E116 S117 K118 K123 M124 I169R42-F120 HydrophobicContact CG-CD1 3.62Å; R42-F120 HydrophobicContact CG-CD2 4.48Å; R42-F120 HydrophobicContact CG-CE1 3.42Å; R42-F120 VanDerWaalsContact CG-CE1 3.42Å; R42-F120 HydrophobicContact CG-CE2 4.32Å; R42-F120 HydrophobicContact CG-CG 4.16Å; R42-F120 HydrophobicContact CG-CZ 3.8Å; E116-F120 WeakPolarHBondContact O-CB 3.49Å; E116-F120 PolarHBondContact O-N 3.03Å; S117-F120 PolarHBondContact O-N 3.34Å; K118-F120 VanDerWaalsContact C-N 3.28Å; K118-F120 PolarHBondContact O-N 2.67Å; F120-K123 PolarHBondContact O-N 3.45Å; F120-M124 HydrophobicContact CE1-SD 4.39Å; F120-M124 WeakPolarHBondContact O-CB 3.29Å; F120-M124 PolarHBondContact O-N 3.14Å; F120-I169 HydrophobicContact CB-CD1 4.39Å; F120-I169 HydrophobicContact CD2-CD1 3.79Å; F120-I169 HydrophobicContact CD2-CG1 4.16Å
121Y98.6Very high98Very high2 Ų224.4 Ų24.41%0.00813%0.13CC..Hα-helixtrans-71.2-37.2-177.4-61.1-43000113.3R42 L104 L108 A112 S117 K118 M124 K125R42-Y121 HydrophobicContact CG-CE1 3.97Å; L104-Y121 HydrophobicContact CD2-CD1 3.73Å; L104-Y121 HydrophobicContact CD2-CG 4.09Å; L108-Y121 HydrophobicContact CB-CD1 4.07Å; L108-Y121 HydrophobicContact CB-CD2 4.06Å; L108-Y121 HydrophobicContact CB-CE1 4.01Å; L108-Y121 HydrophobicContact CB-CE2 4Å; L108-Y121 HydrophobicContact CB-CG 4.12Å; L108-Y121 HydrophobicContact CD1-CD1 4.22Å; L108-Y121 HydrophobicContact CD1-CE1 3.95Å; L108-Y121 HydrophobicContact CG-CE1 4.41Å; A112-Y121 HydrophobicContact CB-CD2 3.78Å; A112-Y121 HydrophobicContact CB-CE2 3.88Å; S117-Y121 WeakPolarHBondContact O-CD2 3.41Å; S117-Y121 PolarHBondContact O-N 2.91Å; K118-Y121 PolarHBondContact O-N 3.41Å; Y121-M124 PolarHBondContact O-N 2.9Å; Y121-K125 WeakPolarHBondContact O-CB 3.42Å; Y121-K125 PolarHBondContact O-N 2.92Å
122Y98.8Very high98.1Very high68 Ų6824 Ų2427%0.26713%0.126SC..Hα-helixtrans-69.8-37.5174.7-82-68.8000112.2I109 K118 K125 G126 A154 I158I109-Y122 HydrophobicContact CD1-CD1 4.36Å; I109-Y122 HydrophobicContact CD1-CE1 4.24Å; I109-Y122 HydrophobicContact CG2-CE1 4.47Å; I109-Y122 HydrophobicContact CG2-CE2 4.11Å; K118-Y122 HydrophobicContact CB-CD2 4.48Å; K118-Y122 WeakPolarHBondContact O-CB 3.37Å; K118-Y122 VanDerWaalsContact O-CD2 3.25Å; K118-Y122 WeakPolarHBondContact O-CD2 3.48Å; K118-Y122 PolarHBondContact O-N 3.27Å; Y122-K125 PolarHBondContact O-N 3.14Å; Y122-G126 PolarHBondContact O-N 2.9Å; Y122-A154 HydrophobicContact CD1-CB 3.99Å; Y122-A154 HydrophobicContact CE1-CB 4.16Å; Y122-A154 HydrophobicContact CG-CB 4.25Å; Y122-I158 HydrophobicContact CD2-CD1 4.06Å; Y122-I158 HydrophobicContact CE2-CD1 4.15Å
123K98.5Very high98.1Very high25 Ų2523.7 Ų23.711%0.10912%0.123CC..Hα-helixtrans-57.9-51.4170.5178.8-170174.6-68.30110.1V119 F120 K125 G126 D127 G172 L173 N176V119-K123 WeakPolarHBondContact O-CB 3.5Å; V119-K123 PolarHBondContact O-N 3.31Å; F120-K123 PolarHBondContact O-N 3.45Å; K123-K125 VanDerWaalsContact C-N 3.32Å; K123-K125 PolarHBondContact O-N 2.73Å; K123-G126 WeakPolarHBondContact O-CA 3.33Å; K123-G126 PolarHBondContact O-N 2.89Å; K123-D127 IonicContact NZ-OD2 3.56Å; K123-D127 PolarHBondContact NZ-OD2 3.45Å; K123-D127 VanDerWaalsContact O-CG 3.27Å; K123-D127 PolarHBondContact O-N 3.45Å; K123-G172 WeakPolarHBondContact CE-O 3.4Å; K123-L173 HydrophobicContact CB-CD1 4.1Å; K123-L173 HydrophobicContact CD-CB 4.1Å; K123-L173 HydrophobicContact CG-CB 4.3Å; K123-L173 HydrophobicContact CG-CD1 4.05Å; K123-N176 PolarHBondContact NZ-ND2 3.29Å
124M98.4Very high98.1Very high10 Ų1020.6 Ų20.65%0.04910%0.102CC..Hα-helixtrans-58.5-43.3178.2-163.6176-156.600111.4I100 L104 F120 Y121 G126 D127 Y128I100-M124 HydrophobicContact CD1-CE 4.11Å; I100-M124 HydrophobicContact CD1-SD 4.13Å; I100-M124 HydrophobicContact CG1-CE 4.14Å; I100-M124 HydrophobicContact CG1-SD 4.27Å; L104-M124 HydrophobicContact CD1-CB 4.2Å; L104-M124 HydrophobicContact CD1-CG 4.13Å; L104-M124 HydrophobicContact CD1-SD 4.47Å; L104-M124 HydrophobicContact CD2-CB 4.45Å; L104-M124 HydrophobicContact CD2-SD 4.16Å; F120-M124 HydrophobicContact CE1-SD 4.39Å; F120-M124 WeakPolarHBondContact O-CB 3.29Å; F120-M124 PolarHBondContact O-N 3.14Å; Y121-M124 PolarHBondContact O-N 2.9Å; M124-G126 VanDerWaalsContact C-N 3.31Å; M124-G126 PolarHBondContact O-N 3.49Å; M124-D127 WeakPolarHBondContact O-CB 3.25Å; M124-D127 PolarHBondContact O-N 3.06Å; M124-Y128 HydrophobicContact CE-CE2 3.8Å; M124-Y128 HydrophobicContact CG-CD2 3.86Å; M124-Y128 HydrophobicContact CG-CE2 3.73Å; M124-Y128 VanDerWaalsContact O-CD2 3.29Å; M124-Y128 WeakPolarHBondContact O-CD2 3.31Å; M124-Y128 PolarHBondContact O-N 3.38Å
125K98.7Very high98.1Very high33 Ų3318.9 Ų18.914%0.1439%0.088CC..Hα-helixtrans-57.5-44.2173.3-177.5174.2-174.5171.60111.9L101 L104 E105 I109 Y121 Y122 K123 H129 A151L101-K125 HydrophobicContact CD2-CB 4.45Å; L101-K125 HydrophobicContact CD2-CG 3.83Å; L104-K125 HydrophobicContact CD1-CB 4.14Å; E105-K125 VanDerWaalsContact OE1-CE 3.24Å; E105-K125 WeakPolarHBondContact OE1-CE 3.24Å; E105-K125 IonicContact OE1-NZ 3.57Å; E105-K125 PolarHBondContact OE1-NZ 3.4Å; I109-K125 HydrophobicContact CD1-CD 4.13Å; Y121-K125 WeakPolarHBondContact O-CB 3.42Å; Y121-K125 PolarHBondContact O-N 2.92Å; Y122-K125 PolarHBondContact O-N 3.14Å; K123-K125 VanDerWaalsContact C-N 3.32Å; K123-K125 PolarHBondContact O-N 2.73Å; K125-H129 PolarHBondContact O-CD2 2.83Å; K125-H129 VanDerWaalsContact O-CD2 3.23Å; K125-H129 PolarHBondContact O-N 2.93Å; K125-H129 VanDerWaalsContact O-N 3.14Å; K125-A151 HydrophobicContact CB-CB 4.04Å; K125-A151 HydrophobicContact CD-CB 4.16Å; K125-A151 HydrophobicContact CG-CB 3.86Å
126G98.7Very high98.1Very high0 Ų018.7 Ų18.70%09%0.086CC..Hα-helixtrans-59.6-45175.300000112.6Y122 K123 M124 H129 R130 S148 Y152Y122-G126 PolarHBondContact O-N 2.9Å; K123-G126 WeakPolarHBondContact O-CA 3.33Å; K123-G126 PolarHBondContact O-N 2.89Å; M124-G126 VanDerWaalsContact C-N 3.31Å; M124-G126 PolarHBondContact O-N 3.49Å; G126-H129 PolarHBondContact O-N 3.46Å; G126-R130 WeakPolarHBondContact O-CB 3.29Å; G126-R130 PolarHBondContact O-N 2.92Å; G126-S148 PolarHBondContact O-OG 3.04Å; G126-Y152 VanDerWaalsContact C-CZ 3.44Å
127D98.5Very high98.1Very high3 Ų321.3 Ų21.32%0.01611%0.106CC..Hα-helixtrans-59.8-50.8178.4-69-27.6000111.8K123 M124 H129 R130 Y131 Y152 N176K123-D127 IonicContact NZ-OD2 3.56Å; K123-D127 PolarHBondContact NZ-OD2 3.45Å; K123-D127 VanDerWaalsContact O-CG 3.27Å; K123-D127 PolarHBondContact O-N 3.45Å; M124-D127 WeakPolarHBondContact O-CB 3.25Å; M124-D127 PolarHBondContact O-N 3.06Å; D127-H129 PolarHBondContact O-N 3.12Å; D127-R130 WeakPolarHBondContact O-CA 3.48Å; D127-R130 VanDerWaalsContact O-CB 3.28Å; D127-R130 WeakPolarHBondContact O-CB 3.45Å; D127-R130 PolarHBondContact O-N 2.92Å; D127-R130 VanDerWaalsContact O-N 3.07Å; D127-Y131 HydrophobicContact CB-CE2 4.03Å; D127-Y131 WeakPolarHBondContact CB-OH 3.44Å; D127-Y131 VanDerWaalsContact O-CD2 3.27Å; D127-Y131 WeakPolarHBondContact O-CD2 3.48Å; D127-Y131 WeakPolarHBondContact O-CE2 3.49Å; D127-Y131 VanDerWaalsContact O-CG 3.3Å; D127-Y131 PolarHBondContact O-N 3.29Å; D127-Y152 WeakPolarHBondContact CA-OH 3.14Å; D127-Y152 PolarHBondContact N-OH 3.37Å; D127-Y152 WeakPolarHBondContact OD1-CE1 3.28Å; D127-Y152 PolarHBondContact OD1-OH 3.12Å; D127-N176 VanDerWaalsContact OD1-CB 3.25Å; D127-N176 WeakPolarHBondContact OD1-CB 3.4Å; D127-N176 PolarHBondContact OD1-ND2 2.64Å; D127-N176 PolarHBondContact OD2-ND2 3.2Å
128Y98.6Very high98Very high1 Ų124.1 Ų24.10%0.00414%0.135CC..Hα-helixtrans-70.2-31.5-179.1-78.7-84.4000113.7Y49 I53 I96 C97 I100 M124 Y131 L132Y49-Y128 VanDerWaalsContact C-OH 3.25Å; Y49-Y128 VanDerWaalsContact CB-OH 3.29Å; Y49-Y128 WeakPolarHBondContact CB-OH 3.33Å; Y49-Y128 PolarHBondContact O-OH 3.1Å; I53-Y128 HydrophobicContact CB-CE1 3.91Å; I53-Y128 HydrophobicContact CD1-CD1 4.45Å; I53-Y128 HydrophobicContact CD1-CE1 4.1Å; I53-Y128 HydrophobicContact CG1-CD1 4.47Å; I53-Y128 HydrophobicContact CG1-CE1 3.87Å; I53-Y128 HydrophobicContact CG2-CE1 3.95Å; I53-Y128 WeakPolarHBondContact CG2-OH 3.32Å; I96-Y128 HydrophobicContact CG2-CE1 4.49Å; C97-Y128 HydrophobicContact CB-CD1 4.26Å; I100-Y128 HydrophobicContact CG1-CD2 4.18Å; I100-Y128 HydrophobicContact CG1-CE2 4.1Å; I100-Y128 HydrophobicContact CG2-CD1 3.31Å; I100-Y128 HydrophobicContact CG2-CD2 3.67Å; I100-Y128 HydrophobicContact CG2-CE1 3.58Å; I100-Y128 HydrophobicContact CG2-CE2 3.95Å; I100-Y128 HydrophobicContact CG2-CG 3.36Å; M124-Y128 HydrophobicContact CE-CE2 3.8Å; M124-Y128 HydrophobicContact CG-CD2 3.86Å; M124-Y128 HydrophobicContact CG-CE2 3.73Å; M124-Y128 VanDerWaalsContact O-CD2 3.29Å; M124-Y128 WeakPolarHBondContact O-CD2 3.31Å; M124-Y128 PolarHBondContact O-N 3.38Å; Y128-Y131 AromaticContact CD1-CD2 3.91Å; Y128-Y131 HydrophobicContact CD1-CD2 3.91Å; Y128-Y131 HydrophobicContact CD1-CE2 4.43Å; Y128-Y131 HydrophobicContact CE1-CD2 4.21Å; Y128-Y131 HydrophobicContact CE1-CE2 4.49Å; Y128-Y131 HydrophobicContact CG-CD2 4.23Å; Y128-Y131 PolarHBondContact O-N 3.43Å; Y128-L132 WeakPolarHBondContact O-CG 3.29Å; Y128-L132 PolarHBondContact O-N 3.32Å; Y128-L132 VanDerWaalsContact O-N 3.12Å
129H98.8Very high97.9Very high18 Ų1824.6 Ų24.68%0.08315%0.147CC..Hα-helixtrans-69.3-34.2168.5-80.5-63.7000112.6K125 G126 D127 Y131 L132 A133 N147K125-H129 PolarHBondContact O-CD2 2.83Å; K125-H129 VanDerWaalsContact O-CD2 3.23Å; K125-H129 PolarHBondContact O-N 2.93Å; K125-H129 VanDerWaalsContact O-N 3.14Å; G126-H129 PolarHBondContact O-N 3.46Å; D127-H129 PolarHBondContact O-N 3.12Å; H129-Y131 VanDerWaalsContact C-N 3.35Å; H129-L132 PolarHBondContact O-N 3.35Å; H129-A133 PolarHBondContact O-N 2.86Å; H129-N147 HydrophobicContact CB-CB 4.39Å
130R98.4Very high97.9Very high0 Ų028.2 Ų28.20%017%0.167CC..Hα-helixtrans-61-44.8172.3174.2176.471.399.2-8.1110.4G126 D127 L132 A133 E134 Y152 F180 E183 I184 D249G126-R130 WeakPolarHBondContact O-CB 3.29Å; G126-R130 PolarHBondContact O-N 2.92Å; D127-R130 WeakPolarHBondContact O-CA 3.48Å; D127-R130 VanDerWaalsContact O-CB 3.28Å; D127-R130 WeakPolarHBondContact O-CB 3.45Å; D127-R130 PolarHBondContact O-N 2.92Å; D127-R130 VanDerWaalsContact O-N 3.07Å; R130-L132 PolarHBondContact O-N 3.32Å; R130-A133 WeakPolarHBondContact O-CA 3.35Å; R130-A133 WeakPolarHBondContact O-CB 3.43Å; R130-A133 PolarHBondContact O-N 2.53Å; R130-E134 IonicContact NH1-OE1 2.75Å; R130-E134 PolarHBondContact O-N 3.19Å; R130-E134 VanDerWaalsContact O-N 3.14Å; R130-Y152 PolarHBondContact NE-OH 3.5Å; R130-F180 HydrophobicContact CB-CD2 4.25Å; R130-F180 HydrophobicContact CG-CD2 4.18Å; R130-E183 IonicContact NH1-OE2 2.68Å; R130-I184 HydrophobicContact CG-CD1 4.35Å; R130-I184 HydrophobicContact CG-CG1 3.85Å; R130-D249 IonicContact CZ-OD2 2.74Å; R130-D249 IonicContact NH1-OD2 3.49Å; R130-D249 PolarHBondContact NH1-OD2 2.85Å; R130-D249 IonicContact NH2-OD2 3.2Å; R130-D249 PolarHBondContact NH2-OD2 3.42Å
131Y98.1Very high97.9Very high0 Ų032.8 Ų32.80%018%0.184CC..Hα-helixtrans-60.8-42.3176-55-31.6000112.8I53 R57 D127 Y128 H129 A133 E134 F135 E251I53-Y131 HydrophobicContact CG1-CD2 4.07Å; R57-Y131 VanDerWaalsContact CZ-CD1 3.43Å; R57-Y131 VanDerWaalsContact NE-CD1 3.28Å; D127-Y131 HydrophobicContact CB-CE2 4.03Å; D127-Y131 WeakPolarHBondContact CB-OH 3.44Å; D127-Y131 VanDerWaalsContact O-CD2 3.27Å; D127-Y131 WeakPolarHBondContact O-CD2 3.48Å; D127-Y131 WeakPolarHBondContact O-CE2 3.49Å; D127-Y131 VanDerWaalsContact O-CG 3.3Å; D127-Y131 PolarHBondContact O-N 3.29Å; Y128-Y131 AromaticContact CD1-CD2 3.91Å; Y128-Y131 HydrophobicContact CD1-CD2 3.91Å; Y128-Y131 HydrophobicContact CD1-CE2 4.43Å; Y128-Y131 HydrophobicContact CE1-CD2 4.21Å; Y128-Y131 HydrophobicContact CE1-CE2 4.49Å; Y128-Y131 HydrophobicContact CG-CD2 4.23Å; Y128-Y131 PolarHBondContact O-N 3.43Å; H129-Y131 VanDerWaalsContact C-N 3.35Å; Y131-A133 VanDerWaalsContact C-N 3.25Å; Y131-A133 PolarHBondContact O-N 2.99Å; Y131-E134 WeakPolarHBondContact CD1-OE1 3.43Å; Y131-E134 WeakPolarHBondContact O-CB 3.49Å; Y131-E134 PolarHBondContact O-N 3.38Å; Y131-F135 WeakPolarHBondContact O-CD1 3.37Å; Y131-F135 WeakPolarHBondContact O-CE1 3.39Å; Y131-E251 VanDerWaalsContact CE2-OE1 3.24Å; Y131-E251 WeakPolarHBondContact CE2-OE1 3.36Å; Y131-E251 VanDerWaalsContact CE2-OE2 3.31Å; Y131-E251 WeakPolarHBondContact CE2-OE2 3.47Å; Y131-E251 PolarHBondContact OH-OE1 2.79Å; Y131-E251 PolarHBondContact OH-OE2 2.84Å
132L98.5Very high97.9Very high22 Ų2238.8 Ų38.812%0.11521%0.21CC..Hα-helixtrans-57.4-40.8171.9-71.4173.7000111.8R94 C97 L101 Y128 H129 R130 E134 F135 A136 A144R94-L132 HydrophobicContact CB-CD2 4.38Å; R94-L132 HydrophobicContact CG-CD2 4.11Å; C97-L132 HydrophobicContact CB-CD1 4.04Å; C97-L132 HydrophobicContact CB-CD2 3.61Å; C97-L132 HydrophobicContact CB-CG 3.66Å; L101-L132 HydrophobicContact CD1-CD1 3.8Å; Y128-L132 WeakPolarHBondContact O-CG 3.29Å; Y128-L132 PolarHBondContact O-N 3.32Å; Y128-L132 VanDerWaalsContact O-N 3.12Å; H129-L132 PolarHBondContact O-N 3.35Å; R130-L132 PolarHBondContact O-N 3.32Å; L132-E134 VanDerWaalsContact C-N 3.29Å; L132-E134 PolarHBondContact O-N 3.43Å; L132-F135 HydrophobicContact CD2-CE1 4.35Å; L132-F135 HydrophobicContact CD2-CZ 3.78Å; L132-A136 WeakPolarHBondContact O-CB 3.47Å; L132-A136 PolarHBondContact O-N 3.03Å; L132-A144 HydrophobicContact CB-CB 3.85Å
133A98.3Very high97.8Very high1 Ų139.4 Ų39.41%0.00822%0.218CC..Hα-helixtrans-70.9-18.7-179.700000114.3H129 R130 Y131 A144 A145 I184H129-A133 PolarHBondContact O-N 2.86Å; R130-A133 WeakPolarHBondContact O-CA 3.35Å; R130-A133 WeakPolarHBondContact O-CB 3.43Å; R130-A133 PolarHBondContact O-N 2.53Å; Y131-A133 VanDerWaalsContact C-N 3.25Å; Y131-A133 PolarHBondContact O-N 2.99Å; A133-A144 HydrophobicContact CB-CB 3.87Å; A133-A145 HydrophobicContact CB-CB 4.45Å; A133-I184 HydrophobicContact CB-CD1 4.16Å; A133-I184 HydrophobicContact CB-CG1 4.43Å; A133-I184 HydrophobicContact CB-CG2 3.79Å
134E96.5Very high97.8Very high37 Ų3738.6 Ų38.617%0.17322%0.216CC..Hα-helixtrans-64.3-40.4177.5-69.4176.6-17200111.9R57 W60 R130 Y131 L132 I184R57-E134 IonicContact CZ-OE1 3.52Å; R57-E134 IonicContact CZ-OE2 3.66Å; R57-E134 IonicContact NE-OE1 3.49Å; R57-E134 PolarHBondContact NE-OE1 2.89Å; R57-E134 IonicContact NE-OE2 2.65Å; R57-E134 PolarHBondContact NE-OE2 3.38Å; R57-E134 IonicContact NH2-OE1 2.67Å; R57-E134 PolarHBondContact NH2-OE1 3.04Å; R57-E134 IonicContact NH2-OE2 3.65Å; W60-E134 HydrophobicContact CH2-CB 4.23Å; W60-E134 WeakPolarHBondContact CH2-O 3.46Å; W60-E134 HydrophobicContact CZ3-CB 4.21Å; R130-E134 IonicContact NH1-OE1 2.75Å; R130-E134 PolarHBondContact O-N 3.19Å; R130-E134 VanDerWaalsContact O-N 3.14Å; Y131-E134 WeakPolarHBondContact CD1-OE1 3.43Å; Y131-E134 WeakPolarHBondContact O-CB 3.49Å; Y131-E134 PolarHBondContact O-N 3.38Å; L132-E134 VanDerWaalsContact C-N 3.29Å; L132-E134 PolarHBondContact O-N 3.43Å; E134-I184 HydrophobicContact CG-CD1 4.1Å
135F95.8Very high97.9Very high11 Ų1138.8 Ų38.85%0.04822%0.218CC..Hα-helixtrans-116.2-14.4-173.965.2-92.2000114.2W60 E90 L93 R94 Y131 L132W60-F135 HydrophobicContact CD2-CB 4.4Å; W60-F135 HydrophobicContact CH2-CB 4.18Å; W60-F135 HydrophobicContact CZ2-CB 3.44Å; W60-F135 VanDerWaalsContact CZ2-CB 3.44Å; E90-F135 HydrophobicContact CB-CD2 3.85Å; E90-F135 HydrophobicContact CB-CE2 4.15Å; E90-F135 HydrophobicContact CG-CB 4.05Å; E90-F135 HydrophobicContact CG-CD2 3.8Å; E90-F135 HydrophobicContact CG-CG 4.11Å; E90-F135 WeakPolarHBondContact O-CE2 3.31Å; L93-F135 HydrophobicContact CB-CD1 4.45Å; L93-F135 HydrophobicContact CB-CE1 3.68Å; L93-F135 HydrophobicContact CB-CZ 3.73Å; L93-F135 HydrophobicContact CD1-CD1 4Å; L93-F135 HydrophobicContact CD1-CE1 4.03Å; L93-F135 HydrophobicContact CG-CE1 4.43Å; R94-F135 HydrophobicContact CB-CE2 4.31Å; R94-F135 HydrophobicContact CB-CZ 4.19Å; Y131-F135 WeakPolarHBondContact O-CD1 3.37Å; Y131-F135 WeakPolarHBondContact O-CE1 3.39Å; L132-F135 HydrophobicContact CD2-CE1 4.35Å; L132-F135 HydrophobicContact CD2-CZ 3.78Å
136A97.5Very high97.9Very high8 Ų841.5 Ų41.57%0.06623%0.232CC..  trans-66158.3174.600000112L132 D140 R141L132-A136 WeakPolarHBondContact O-CB 3.47Å; L132-A136 PolarHBondContact O-N 3.03Å; A136-D140 HydrophobicContact CB-CB 3.97Å; A136-R141 HydrophobicContact CB-CB 4.04Å; A136-R141 WeakPolarHBondContact O-CB 3.41Å; A136-R141 WeakPolarHBondContact O-CD 3.33Å
137T95.7Very high97.9Very high112 Ų11244.4 Ų44.469%0.68725%0.247SC*.  trans-130.6163.3177.960.80000110.9S139 D140 R141T137-S139 PolarHBondContact O-N 2.86Å; T137-D140 PolarHBondContact O-N 2.87Å; T137-R141 PolarHBondContact O-N 3.46Å
138G96.2Very high97.9Very high65 Ų6544.3 Ų44.367%0.6725%0.247SC*.Hα-helixtrans57.4-131.6174.700000114.1K142G138-K142 PolarHBondContact O-N 3.38Å
139S97.7Very high97.9Very high80 Ų8046.1 Ų46.156%0.55926%0.256SS*.Hα-helixtrans-62.7-42.3178.548.10000112.4T137 R141 K142 D143T137-S139 PolarHBondContact O-N 2.86Å; S139-R141 VanDerWaalsContact C-N 3.25Å; S139-R141 PolarHBondContact O-N 3.5Å; S139-K142 WeakPolarHBondContact O-CA 3.44Å; S139-K142 WeakPolarHBondContact O-CB 3.27Å; S139-K142 PolarHBondContact O-N 3.12Å; S139-D143 PolarHBondContact O-N 3.21Å
140D97.2Very high97.9Very high77 Ų7750.5 Ų50.541%0.41228%0.279SS..Hα-helixtrans-58.8-40.1-178.4-70.314.9000111.4R94 A136 T137 A144R94-D140 IonicContact NH1-OD2 2.85Å; R94-D140 PolarHBondContact NH1-OD2 3.35Å; A136-D140 HydrophobicContact CB-CB 3.97Å; T137-D140 PolarHBondContact O-N 2.87Å; D140-A144 VanDerWaalsContact O-CB 3.27Å; D140-A144 WeakPolarHBondContact O-CB 3.3Å; D140-A144 PolarHBondContact O-N 3.07Å
141R98.1Very high97.9Very high116 Ų11650.6 Ų50.644%0.43828%0.28SS..Hα-helixtrans-64-43.2176.3-172.2177.3173.6-134.4-5.7111.6A136 T137 S139 A145 I184A136-R141 HydrophobicContact CB-CB 4.04Å; A136-R141 WeakPolarHBondContact O-CB 3.41Å; A136-R141 WeakPolarHBondContact O-CD 3.33Å; T137-R141 PolarHBondContact O-N 3.46Å; S139-R141 VanDerWaalsContact C-N 3.25Å; S139-R141 PolarHBondContact O-N 3.5Å; R141-A145 WeakPolarHBondContact O-CB 3.49Å; R141-A145 PolarHBondContact O-N 3.19Å; R141-I184 PolarHBondContact NH2-O 3.47Å
142K98.2Very high97.9Very high128 Ų12850.6 Ų50.656%0.55728%0.28SS*.Hα-helixtrans-64.1-47.4179.6-177.1-179169.2-174.60110.5G138 S139 A144 A145 E146G138-K142 PolarHBondContact O-N 3.38Å; S139-K142 WeakPolarHBondContact O-CA 3.44Å; S139-K142 WeakPolarHBondContact O-CB 3.27Å; S139-K142 PolarHBondContact O-N 3.12Å; K142-A144 PolarHBondContact O-N 2.84Å; K142-A145 PolarHBondContact O-N 3.38Å; K142-E146 WeakPolarHBondContact CE-OE1 3.46Å; K142-E146 IonicContact NZ-OE1 3.27Å; K142-E146 WeakPolarHBondContact O-CB 3.41Å; K142-E146 WeakPolarHBondContact O-CG 3.35Å; K142-E146 PolarHBondContact O-N 2.91Å
143D98.4Very high97.9Very high81 Ų8154.5 Ų54.543%0.43330%0.296SS..Hα-helixtrans-63.5-42.2179.8-65.1-11.2000111S139 E146 N147S139-D143 PolarHBondContact O-N 3.21Å; D143-E146 PolarHBondContact O-N 3.09Å; D143-N147 WeakPolarHBondContact O-CB 3.49Å; D143-N147 PolarHBondContact O-N 3.14Å; D143-N147 PolarHBondContact O-ND2 3.41Å
144A98.6Very high97.9Very high8 Ų855.9 Ų55.97%0.06631%0.307CS..Hα-helixtrans-62.1-45.9174.800000111.9L132 A133 D140 K142 E146 N147 S148L132-A144 HydrophobicContact CB-CB 3.85Å; A133-A144 HydrophobicContact CB-CB 3.87Å; D140-A144 VanDerWaalsContact O-CB 3.27Å; D140-A144 WeakPolarHBondContact O-CB 3.3Å; D140-A144 PolarHBondContact O-N 3.07Å; K142-A144 PolarHBondContact O-N 2.84Å; A144-E146 PolarHBondContact O-N 2.84Å; A144-N147 PolarHBondContact O-N 3.42Å; A144-S148 WeakPolarHBondContact O-CB 3.39Å; A144-S148 PolarHBondContact O-N 3.3Å
145A98.6Very high98Very high13 Ų1354.1 Ų54.111%0.10730%0.299CS..Hα-helixtrans-63.9-40.6177.700000112.5A133 R141 K142 S148 L149 F180 I184 L185A133-A145 HydrophobicContact CB-CB 4.45Å; R141-A145 WeakPolarHBondContact O-CB 3.49Å; R141-A145 PolarHBondContact O-N 3.19Å; K142-A145 PolarHBondContact O-N 3.38Å; A145-S148 PolarHBondContact O-N 2.84Å; A145-L149 WeakPolarHBondContact O-CB 3.25Å; A145-L149 PolarHBondContact O-N 2.75Å; A145-F180 HydrophobicContact CB-CE2 4.44Å; A145-F180 WeakPolarHBondContact O-CZ 3.34Å; A145-I184 HydrophobicContact CB-CG2 3.77Å; A145-L185 HydrophobicContact CB-CD2 4.46Å
146E98.7Very high98.2Very high91 Ų9154.3 Ų54.343%0.42530%0.302SS..Hα-helixtrans-64.7-46.2176.8-75.2179.6-176.200111.7K142 D143 A144 S148 L149 I150K142-E146 WeakPolarHBondContact CE-OE1 3.46Å; K142-E146 IonicContact NZ-OE1 3.27Å; K142-E146 WeakPolarHBondContact O-CB 3.41Å; K142-E146 WeakPolarHBondContact O-CG 3.35Å; K142-E146 PolarHBondContact O-N 2.91Å; D143-E146 PolarHBondContact O-N 3.09Å; A144-E146 PolarHBondContact O-N 2.84Å; E146-S148 PolarHBondContact O-N 2.93Å; E146-L149 PolarHBondContact O-N 2.61Å; E146-I150 VanDerWaalsContact O-CG1 3.28Å; E146-I150 WeakPolarHBondContact O-CG1 3.29Å; E146-I150 PolarHBondContact O-N 3.38Å
147N98.7Very high98.2Very high61 Ų6158.9 Ų58.933%0.32633%0.325SS..Hα-helixtrans-65-38.7177.1-78.3-70.6000112.5H129 D143 A144 I150 A151H129-N147 HydrophobicContact CB-CB 4.39Å; D143-N147 WeakPolarHBondContact O-CB 3.49Å; D143-N147 PolarHBondContact O-N 3.14Å; D143-N147 PolarHBondContact O-ND2 3.41Å; A144-N147 PolarHBondContact O-N 3.42Å; N147-I150 PolarHBondContact O-N 2.85Å; N147-A151 WeakPolarHBondContact O-CB 3.31Å; N147-A151 PolarHBondContact O-N 3.29Å
148S98.8Very high98.3Very high0 Ų055.2 Ų55.20%030%0.301CS..Hα-helixtrans-60-48.6173.9-175.30000111.1G126 A144 A145 E146 I150 A151 Y152 F180G126-S148 PolarHBondContact O-OG 3.04Å; A144-S148 WeakPolarHBondContact O-CB 3.39Å; A144-S148 PolarHBondContact O-N 3.3Å; A145-S148 PolarHBondContact O-N 2.84Å; E146-S148 PolarHBondContact O-N 2.93Å; S148-I150 PolarHBondContact O-N 2.66Å; S148-A151 PolarHBondContact O-N 2.71Å; S148-Y152 VanDerWaalsContact O-CD2 3.24Å; S148-Y152 WeakPolarHBondContact O-CD2 3.41Å; S148-Y152 PolarHBondContact O-N 3.01Å; S148-Y152 WeakPolarHBondContact OG-CD2 3.48Å; S148-Y152 WeakPolarHBondContact OG-CE2 3.34Å; S148-F180 WeakPolarHBondContact OG-CD2 3.2Å; S148-F180 WeakPolarHBondContact OG-CE2 3.21Å
149L98.7Very high98.5Very high39 Ų3952.2 Ų52.220%0.20427%0.27CS..Hα-helixtrans-60.8-42.2177.6179.261.9000112.5A145 E146 K153 F177 F180 Y181A145-L149 WeakPolarHBondContact O-CB 3.25Å; A145-L149 PolarHBondContact O-N 2.75Å; E146-L149 PolarHBondContact O-N 2.61Å; L149-K153 HydrophobicContact CD1-CD 4.2Å; L149-K153 HydrophobicContact CD1-CG 4.29Å; L149-K153 HydrophobicContact CG-CD 4.27Å; L149-K153 WeakPolarHBondContact O-CB 3.41Å; L149-K153 VanDerWaalsContact O-CG 3.31Å; L149-K153 WeakPolarHBondContact O-CG 3.5Å; L149-K153 PolarHBondContact O-N 3.17Å; L149-F177 HydrophobicContact CD1-CE2 3.77Å; L149-F177 HydrophobicContact CD1-CZ 3.79Å; L149-F180 HydrophobicContact CB-CE1 3.95Å; L149-F180 HydrophobicContact CB-CZ 3.97Å; L149-F180 HydrophobicContact CD1-CE1 4.04Å; L149-Y181 HydrophobicContact CD1-CE1 4.33Å
150I98.7Very high98.4Very high110 Ų11054.2 Ų54.256%0.56427%0.272SS*.Hα-helixtrans-61.7-47.4177.2-70.9164.8000110.3E146 N147 S148 K153 A154E146-I150 VanDerWaalsContact O-CG1 3.28Å; E146-I150 WeakPolarHBondContact O-CG1 3.29Å; E146-I150 PolarHBondContact O-N 3.38Å; N147-I150 PolarHBondContact O-N 2.85Å; S148-I150 PolarHBondContact O-N 2.66Å; I150-K153 PolarHBondContact O-N 2.98Å; I150-A154 WeakPolarHBondContact O-CB 3.24Å; I150-A154 PolarHBondContact O-N 2.88Å
151A98.8Very high98.4Very high2 Ų257 Ų572%0.01729%0.287CS..Hα-helixtrans-64.9-44.9-178.700000112.1K125 N147 S148 K153 A154 A155K125-A151 HydrophobicContact CB-CB 4.04Å; K125-A151 HydrophobicContact CD-CB 4.16Å; K125-A151 HydrophobicContact CG-CB 3.86Å; N147-A151 WeakPolarHBondContact O-CB 3.31Å; N147-A151 PolarHBondContact O-N 3.29Å; S148-A151 PolarHBondContact O-N 2.71Å; A151-K153 PolarHBondContact O-N 3.19Å; A151-A154 PolarHBondContact O-N 3.36Å; A151-A155 WeakPolarHBondContact O-CB 3.41Å; A151-A155 PolarHBondContact O-N 3.42Å
152Y98.8Very high98.4Very high0 Ų055.9 Ų55.90%029%0.29CS..Hα-helixtrans-65-37.1177.1-74.2-48.8000113.4G126 D127 R130 S148 A155 S156 L173 N176 F177 F180G126-Y152 VanDerWaalsContact C-CZ 3.44Å; D127-Y152 WeakPolarHBondContact CA-OH 3.14Å; D127-Y152 PolarHBondContact N-OH 3.37Å; D127-Y152 WeakPolarHBondContact OD1-CE1 3.28Å; D127-Y152 PolarHBondContact OD1-OH 3.12Å; R130-Y152 PolarHBondContact NE-OH 3.5Å; S148-Y152 VanDerWaalsContact O-CD2 3.24Å; S148-Y152 WeakPolarHBondContact O-CD2 3.41Å; S148-Y152 PolarHBondContact O-N 3.01Å; S148-Y152 WeakPolarHBondContact OG-CD2 3.48Å; S148-Y152 WeakPolarHBondContact OG-CE2 3.34Å; Y152-A155 PolarHBondContact O-N 3.37Å; Y152-S156 WeakPolarHBondContact O-CB 3.49Å; Y152-S156 PolarHBondContact O-N 3.28Å; Y152-S156 PolarHBondContact O-OG 3.04Å; Y152-L173 HydrophobicContact CD1-CD1 3.64Å; Y152-L173 HydrophobicContact CE1-CD1 4.35Å; Y152-N176 HydrophobicContact CE1-CB 4.3Å; Y152-F177 VanDerWaalsContact CB-CD2 3.48Å; Y152-F177 HydrophobicContact CD1-CB 4.06Å; Y152-F177 HydrophobicContact CD1-CG 4.32Å; Y152-F177 HydrophobicContact CD2-CB 4.35Å; Y152-F177 AromaticContact CD2-CD2 3.47Å; Y152-F177 HydrophobicContact CD2-CD2 3.47Å; Y152-F177 VanDerWaalsContact CD2-CD2 3.47Å; Y152-F177 AromaticContact CD2-CE2 3.95Å; Y152-F177 HydrophobicContact CD2-CE2 3.95Å; Y152-F177 HydrophobicContact CD2-CG 4.09Å; Y152-F177 HydrophobicContact CE1-CB 4.48Å; Y152-F177 HydrophobicContact CE2-CD2 4.28Å; Y152-F177 HydrophobicContact CG-CB 3.99Å; Y152-F177 HydrophobicContact CG-CD1 4.39Å; Y152-F177 AromaticContact CG-CD2 3.6Å; Y152-F177 HydrophobicContact CG-CD2 3.6Å; Y152-F177 HydrophobicContact CG-CE2 4.1Å; Y152-F177 AromaticContact CG-CG 3.78Å; Y152-F177 HydrophobicContact CG-CG 3.78Å; Y152-F180 HydrophobicContact CD2-CB 4.21Å; Y152-F180 HydrophobicContact CD2-CD1 4.2Å; Y152-F180 HydrophobicContact CD2-CG 4.08Å; Y152-F180 HydrophobicContact CE2-CB 3.65Å; Y152-F180 HydrophobicContact CE2-CD1 4.4Å; Y152-F180 HydrophobicContact CE2-CD2 4.18Å; Y152-F180 AromaticContact CE2-CG 3.82Å; Y152-F180 HydrophobicContact CE2-CG 3.82Å
153K98.7Very high98.3Very high105 Ų10550.5 Ų50.546%0.45727%0.267SS..Hα-helixtrans-64.2-47.1173.7-78177.9172.1177.40111.7L149 I150 A151 A155 S156 D157 F177L149-K153 HydrophobicContact CD1-CD 4.2Å; L149-K153 HydrophobicContact CD1-CG 4.29Å; L149-K153 HydrophobicContact CG-CD 4.27Å; L149-K153 WeakPolarHBondContact O-CB 3.41Å; L149-K153 VanDerWaalsContact O-CG 3.31Å; L149-K153 WeakPolarHBondContact O-CG 3.5Å; L149-K153 PolarHBondContact O-N 3.17Å; I150-K153 PolarHBondContact O-N 2.98Å; A151-K153 PolarHBondContact O-N 3.19Å; K153-A155 VanDerWaalsContact C-N 3.3Å; K153-A155 PolarHBondContact O-N 3.39Å; K153-S156 PolarHBondContact O-N 3.22Å; K153-D157 VanDerWaalsContact O-CG 3.31Å; K153-D157 PolarHBondContact O-N 3.4Å; K153-F177 HydrophobicContact CG-CE1 4.49Å; K153-F177 HydrophobicContact CG-CZ 4.13Å
154A98.5Very high98.2Very high29 Ų2949.7 Ų49.724%0.2427%0.266CS..Hα-helixtrans-58.6-42.717600000111.8Y122 I150 A151 S156 I158Y122-A154 HydrophobicContact CD1-CB 3.99Å; Y122-A154 HydrophobicContact CE1-CB 4.16Å; Y122-A154 HydrophobicContact CG-CB 4.25Å; I150-A154 WeakPolarHBondContact O-CB 3.24Å; I150-A154 PolarHBondContact O-N 2.88Å; A151-A154 PolarHBondContact O-N 3.36Å; A154-S156 VanDerWaalsContact C-N 3.34Å; A154-S156 PolarHBondContact O-N 3.04Å; A154-I158 VanDerWaalsContact O-CG1 3.32Å; A154-I158 WeakPolarHBondContact O-CG1 3.47Å; A154-I158 PolarHBondContact O-N 3.17Å
155A98.7Very high98.1Very high0 Ų050.2 Ų50.20%027%0.269CS..Hα-helixtrans-61.7-42.2173.900000111.9V119 A151 Y152 K153 I158 A159 L173V119-A155 HydrophobicContact CG1-CB 4.44Å; A151-A155 WeakPolarHBondContact O-CB 3.41Å; A151-A155 PolarHBondContact O-N 3.42Å; Y152-A155 PolarHBondContact O-N 3.37Å; K153-A155 VanDerWaalsContact C-N 3.3Å; K153-A155 PolarHBondContact O-N 3.39Å; A155-I158 PolarHBondContact O-N 3.18Å; A155-A159 VanDerWaalsContact O-CB 3.22Å; A155-A159 WeakPolarHBondContact O-CB 3.42Å; A155-A159 PolarHBondContact O-N 3.42Å; A155-L173 VanDerWaalsContact C-CD2 3.48Å; A155-L173 HydrophobicContact CB-CD1 3.69Å; A155-L173 HydrophobicContact CB-CD2 3.62Å; A155-L173 HydrophobicContact CB-CG 4.31Å
156S98.5Very high97.9Very high16 Ų1649.9 Ų49.911%0.11227%0.265CS..Hα-helixtrans-66.9-43.7-177.4-59.70000111.6Y152 K153 A154 I158 A159 M160Y152-S156 WeakPolarHBondContact O-CB 3.49Å; Y152-S156 PolarHBondContact O-N 3.28Å; Y152-S156 PolarHBondContact O-OG 3.04Å; K153-S156 PolarHBondContact O-N 3.22Å; A154-S156 VanDerWaalsContact C-N 3.34Å; A154-S156 PolarHBondContact O-N 3.04Å; S156-I158 VanDerWaalsContact C-N 3.31Å; S156-I158 PolarHBondContact O-N 3.06Å; S156-A159 PolarHBondContact O-N 2.57Å; S156-M160 VanDerWaalsContact O-CG 3.29Å; S156-M160 WeakPolarHBondContact O-CG 3.36Å; S156-M160 PolarHBondContact O-N 3.05Å
157D98.3Very high97.8Very high103 Ų10347.2 Ų47.255%0.55125%0.253SS*.Hα-helixtrans-61.9-39.6179.1-67.6-19.6000111.4K153 N161K153-D157 VanDerWaalsContact O-CG 3.31Å; K153-D157 PolarHBondContact O-N 3.4Å; D157-N161 PolarHBondContact O-ND2 3.33Å
158I98.5Very high97.6Very high36 Ų3645 Ų4519%0.18524%0.242CC..Hα-helixtrans-71.7-46.1175.6-59.5167.5000110.1K118 V119 Y122 A154 A155 S156 M160 N161 D162K118-I158 HydrophobicContact CB-CD1 3.93Å; K118-I158 HydrophobicContact CB-CG2 4.4Å; K118-I158 HydrophobicContact CD-CD1 4.4Å; V119-I158 HydrophobicContact CG2-CB 3.82Å; V119-I158 HydrophobicContact CG2-CG2 3.6Å; Y122-I158 HydrophobicContact CD2-CD1 4.06Å; Y122-I158 HydrophobicContact CE2-CD1 4.15Å; A154-I158 VanDerWaalsContact O-CG1 3.32Å; A154-I158 WeakPolarHBondContact O-CG1 3.47Å; A154-I158 PolarHBondContact O-N 3.17Å; A155-I158 PolarHBondContact O-N 3.18Å; S156-I158 VanDerWaalsContact C-N 3.31Å; S156-I158 PolarHBondContact O-N 3.06Å; I158-M160 VanDerWaalsContact C-N 3.28Å; I158-M160 PolarHBondContact O-N 3.45Å; I158-N161 PolarHBondContact O-N 3.39Å; I158-N161 VanDerWaalsContact O-N 3.08Å; I158-D162 HydrophobicContact CG2-CB 4.35Å; I158-D162 WeakPolarHBondContact O-CB 3.28Å; I158-D162 PolarHBondContact O-N 3Å
159A98.4Very high97.5Very high2 Ų245.7 Ų45.72%0.01725%0.245CC..Hα-helixtrans-61.1-35.8-177.700000112.9V119 A155 S156 N161 L163 R170 L173V119-A159 HydrophobicContact CG1-CB 3.88Å; V119-A159 HydrophobicContact CG2-CB 3.84Å; A155-A159 VanDerWaalsContact O-CB 3.22Å; A155-A159 WeakPolarHBondContact O-CB 3.42Å; A155-A159 PolarHBondContact O-N 3.42Å; S156-A159 PolarHBondContact O-N 2.57Å; A159-N161 VanDerWaalsContact C-N 3.26Å; A159-N161 PolarHBondContact O-N 3.05Å; A159-L163 HydrophobicContact CB-CD1 4.34Å; A159-L163 PolarHBondContact O-N 3.46Å; A159-L163 VanDerWaalsContact O-N 3.11Å; A159-R170 HydrophobicContact CB-CB 4.37Å; A159-R170 HydrophobicContact CB-CG 4.1Å; A159-L173 HydrophobicContact CB-CD2 4.02Å
160M97Very high97.4Very high122 Ų12246.1 Ų46.160%0.60124%0.244SC*.Hα-helixtrans-64.4-30.2177.1-75.5179.4-172.300113.1S156 I158S156-M160 VanDerWaalsContact O-CG 3.29Å; S156-M160 WeakPolarHBondContact O-CG 3.36Å; S156-M160 PolarHBondContact O-N 3.05Å; I158-M160 VanDerWaalsContact C-N 3.28Å; I158-M160 PolarHBondContact O-N 3.45Å
161N96.6Very high97.4Very high136 Ų13641 Ų4173%0.72722%0.218SC*.Hα-helixtrans-93.6-36.7-178.1-68.3-57.2000112.8D157 I158 A159D157-N161 PolarHBondContact O-ND2 3.33Å; I158-N161 PolarHBondContact O-N 3.39Å; I158-N161 VanDerWaalsContact O-N 3.08Å; A159-N161 VanDerWaalsContact C-N 3.26Å; A159-N161 PolarHBondContact O-N 3.05Å
162D97.7Very high97.3Very high92 Ų9241 Ų4149%0.49222%0.218SC..Hα-helixtrans-106.4-18-165.5-67.99.2000113.4G115 I158G115-D162 WeakPolarHBondContact CA-OD2 3.38Å; I158-D162 HydrophobicContact CG2-CB 4.35Å; I158-D162 WeakPolarHBondContact O-CB 3.28Å; I158-D162 PolarHBondContact O-N 3Å
163L96.5Very high97.3Very high15 Ų1541.1 Ų41.18%0.07922%0.219CC..SBendtrans-124.4135.2-174.9-56.7-179.3000111.8E116 V119 A159 H167 I169 R170E116-L163 HydrophobicContact CB-CD2 4.12Å; E116-L163 HydrophobicContact CG-CD2 4.45Å; V119-L163 HydrophobicContact CB-CD1 4.02Å; V119-L163 HydrophobicContact CG1-CD1 4.03Å; V119-L163 HydrophobicContact CG2-CD1 3.91Å; A159-L163 HydrophobicContact CB-CD1 4.34Å; A159-L163 PolarHBondContact O-N 3.46Å; A159-L163 VanDerWaalsContact O-N 3.11Å; L163-H167 HydrophobicContact CB-CB 4.03Å; L163-I169 HydrophobicContact CD1-CB 4.37Å; L163-I169 HydrophobicContact CD1-CG2 4.2Å; L163-R170 HydrophobicContact CB-CB 4.22Å; L163-R170 HydrophobicContact CD1-CB 4.26Å; L163-R170 PolarHBondContact O-NH1 3.42Å
164P95.8Very high97.3Very high63 Ų6336.6 Ų36.641%0.40920%0.201SC..  trans-63.7152.9174.826.7-32.7000111T166 H167 R170P164-T166 PolarHBondContact O-N 3.23Å; P164-H167 HydrophobicContact CG-CB 4.02Å; P164-H167 WeakPolarHBondContact O-CB 3.45Å; P164-H167 PolarHBondContact O-N 3.31Å; P164-R170 WeakPolarHBondContact O-CD 3.27Å
165P96.6Very high97.3Very high20 Ų2035.2 Ų35.213%0.1319%0.19CC..THydrogen-bonded Turntrans-52.4-30.2178.6-27.535.1000114.8H167 D201 E205P165-H167 VanDerWaalsContact C-N 3.34Å; P165-D201 HydrophobicContact CB-CB 3.91Å; P165-D201 HydrophobicContact CG-CB 4.42Å; P165-E205 WeakPolarHBondContact CD-OE2 3.42Å
166T95.6Very high97.2Very high5 Ų535.2 Ų35.23%0.03119%0.19CC..THydrogen-bonded Turntrans-84.4-2.7179.853.30000114.1P164 A202 E205 L209 S217P164-T166 PolarHBondContact O-N 3.23Å; T166-A202 HydrophobicContact CG2-CB 4.38Å; T166-A202 WeakPolarHBondContact CG2-O 3.27Å; T166-E205 HydrophobicContact CG2-CB 3.8Å; T166-L209 HydrophobicContact CG2-CD1 3.94Å; T166-L209 HydrophobicContact CG2-CG 4.1Å; T166-S217 WeakPolarHBondContact O-CB 3.5Å; T166-S217 PolarHBondContact O-OG 2.95Å
167H94.9Very high97.2Very high36 Ų3634.8 Ų34.817%0.16719%0.186CC..  trans-66.7129.6-178.1-165.4-70.8000111.4E116 L163 P164 P165 I169 R170 L171E116-H167 IonicContact OE2-NE2 2.84Å; L163-H167 HydrophobicContact CB-CB 4.03Å; P164-H167 HydrophobicContact CG-CB 4.02Å; P164-H167 WeakPolarHBondContact O-CB 3.45Å; P164-H167 PolarHBondContact O-N 3.31Å; P165-H167 VanDerWaalsContact C-N 3.34Å; H167-I169 VanDerWaalsContact C-N 3.35Å; H167-I169 PolarHBondContact ND1-N 2.54Å; H167-I169 VanDerWaalsContact ND1-N 3.18Å; H167-I169 PolarHBondContact O-N 2.8Å; H167-R170 HydrophobicContact CB-CB 4.16Å; H167-R170 PolarHBondContact O-N 2.94Å; H167-L171 PolarHBondContact O-N 3.32Å
168P95.4Very high97.2Very high15 Ų1529.9 Ų29.910%0.09716%0.159CC..Hα-helixtrans-52.6-46.2-178.1-27.932.7000113.8R170 L171 G172 D216 S217 I220P168-R170 PolarHBondContact O-N 2.78Å; P168-L171 PolarHBondContact O-N 3.26Å; P168-G172 PolarHBondContact O-N 3.33Å; P168-D216 HydrophobicContact CB-CB 4.11Å; P168-D216 HydrophobicContact CG-CB 4.01Å; P168-S217 WeakPolarHBondContact CD-OG 3.41Å; P168-S217 WeakPolarHBondContact CG-OG 3.46Å; P168-I220 HydrophobicContact CB-CD1 4.04Å; P168-I220 VanDerWaalsContact O-CD1 3.23Å; P168-I220 WeakPolarHBondContact O-CD1 3.34Å
169I96.1Very high97.2Very high14 Ų1428.2 Ų28.27%0.07215%0.151CC..Hα-helixtrans-60.9-39.3177.2-66.9171.4000112.8E116 V119 F120 L163 H167 L173E116-I169 HydrophobicContact CG-CD1 3.45Å; E116-I169 VanDerWaalsContact CG-CD1 3.45Å; V119-I169 HydrophobicContact CB-CG2 4.08Å; V119-I169 HydrophobicContact CG1-CG2 3.58Å; F120-I169 HydrophobicContact CB-CD1 4.39Å; F120-I169 HydrophobicContact CD2-CD1 3.79Å; F120-I169 HydrophobicContact CD2-CG1 4.16Å; L163-I169 HydrophobicContact CD1-CB 4.37Å; L163-I169 HydrophobicContact CD1-CG2 4.2Å; H167-I169 VanDerWaalsContact C-N 3.35Å; H167-I169 PolarHBondContact ND1-N 2.54Å; H167-I169 VanDerWaalsContact ND1-N 3.18Å; H167-I169 PolarHBondContact O-N 2.8Å; I169-L173 WeakPolarHBondContact O-CB 3.24Å; I169-L173 PolarHBondContact O-N 3.49Å
170R97.6Very high97.2Very high47 Ų4728.1 Ų28.118%0.17715%0.15CC..Hα-helixtrans-69.2-42.6178.1177.3172.4170.4174.7-5.9111A159 L163 P164 H167 P168 L173 A174A159-R170 HydrophobicContact CB-CB 4.37Å; A159-R170 HydrophobicContact CB-CG 4.1Å; L163-R170 HydrophobicContact CB-CB 4.22Å; L163-R170 HydrophobicContact CD1-CB 4.26Å; L163-R170 PolarHBondContact O-NH1 3.42Å; P164-R170 WeakPolarHBondContact O-CD 3.27Å; H167-R170 HydrophobicContact CB-CB 4.16Å; H167-R170 PolarHBondContact O-N 2.94Å; P168-R170 PolarHBondContact O-N 2.78Å; R170-L173 WeakPolarHBondContact O-CB 3.37Å; R170-L173 PolarHBondContact O-N 3.42Å; R170-A174 PolarHBondContact O-N 3.07Å
171L97.9Very high97.3Very high2 Ų223.6 Ų23.61%0.0113%0.127CC..Hα-helixtrans-63.8-44.5175-72.8167000111.5H167 P168 L173 A174 L175 A202 I220 M221 L224H167-L171 PolarHBondContact O-N 3.32Å; P168-L171 PolarHBondContact O-N 3.26Å; L171-L173 VanDerWaalsContact C-N 3.3Å; L171-L173 PolarHBondContact O-N 3Å; L171-A174 WeakPolarHBondContact O-CB 3.45Å; L171-A174 PolarHBondContact O-N 2.87Å; L171-A174 VanDerWaalsContact O-N 3.14Å; L171-L175 PolarHBondContact O-N 3.43Å; L171-A202 HydrophobicContact CD1-CB 4.41Å; L171-A202 HydrophobicContact CD2-CB 3.68Å; L171-I220 HydrophobicContact CB-CB 4.12Å; L171-I220 HydrophobicContact CB-CD1 4.25Å; L171-I220 HydrophobicContact CB-CG2 3.63Å; L171-M221 HydrophobicContact CD1-CG 4Å; L171-M221 HydrophobicContact CD1-SD 4.42Å; L171-M221 HydrophobicContact CD2-CG 4.16Å; L171-L224 HydrophobicContact CD2-CD1 4.01Å
172G97.6Very high97.3Very high2 Ų217.8 Ų17.82%0.02110%0.095CC..Hα-helixtrans-64.2-35.1177.900000112.5K123 P168 N176K123-G172 WeakPolarHBondContact CE-O 3.4Å; P168-G172 PolarHBondContact O-N 3.33Å; G172-N176 PolarHBondContact O-N 2.74Å
173L98.5Very high97.2Very high4 Ų416.5 Ų16.52%0.0219%0.085CC..Hα-helixtrans-61.7-48.8170.4169.363.9000111.2V119 K123 Y152 A155 A159 I169 R170 L171 L175 N176 F177V119-L173 HydrophobicContact CG1-CD2 4.05Å; K123-L173 HydrophobicContact CB-CD1 4.1Å; K123-L173 HydrophobicContact CD-CB 4.1Å; K123-L173 HydrophobicContact CG-CB 4.3Å; K123-L173 HydrophobicContact CG-CD1 4.05Å; Y152-L173 HydrophobicContact CD1-CD1 3.64Å; Y152-L173 HydrophobicContact CE1-CD1 4.35Å; A155-L173 VanDerWaalsContact C-CD2 3.48Å; A155-L173 HydrophobicContact CB-CD1 3.69Å; A155-L173 HydrophobicContact CB-CD2 3.62Å; A155-L173 HydrophobicContact CB-CG 4.31Å; A159-L173 HydrophobicContact CB-CD2 4.02Å; I169-L173 WeakPolarHBondContact O-CB 3.24Å; I169-L173 PolarHBondContact O-N 3.49Å; R170-L173 WeakPolarHBondContact O-CB 3.37Å; R170-L173 PolarHBondContact O-N 3.42Å; L171-L173 VanDerWaalsContact C-N 3.3Å; L171-L173 PolarHBondContact O-N 3Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.46Å; L173-N176 PolarHBondContact O-N 2.93Å; L173-F177 WeakPolarHBondContact O-CB 3.1Å; L173-F177 PolarHBondContact O-N 3.46Å
174A98.5Very high97.2Very high10 Ų1016.4 Ų16.48%0.0839%0.085CC..Hα-helixtrans-60.9-41.517900000111.9R170 L171 S178 A198R170-A174 PolarHBondContact O-N 3.07Å; L171-A174 WeakPolarHBondContact O-CB 3.45Å; L171-A174 PolarHBondContact O-N 2.87Å; L171-A174 VanDerWaalsContact O-N 3.14Å; A174-S178 VanDerWaalsContact O-CB 3.26Å; A174-S178 WeakPolarHBondContact O-CB 3.42Å; A174-S178 PolarHBondContact O-N 2.96Å; A174-S178 PolarHBondContact O-OG 3Å; A174-S178 VanDerWaalsContact O-OG 3.14Å; A174-A198 HydrophobicContact CB-CB 3.38Å
175L98.1Very high97.3Very high0 Ų016.1 Ų16.10%08%0.08CC..Hα-helixtrans-57.9-60.5175.4-179.860.2000110.8L171 L173 F177 S178 V179 I220 L223 L224 N227 V250L171-L175 PolarHBondContact O-N 3.43Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.46Å; L175-F177 VanDerWaalsContact C-N 3.32Å; L175-F177 PolarHBondContact O-N 3.14Å; L175-S178 PolarHBondContact O-N 3.47Å; L175-S178 VanDerWaalsContact O-N 3.14Å; L175-S178 PolarHBondContact O-OG 3.31Å; L175-V179 WeakPolarHBondContact O-CG2 3.34Å; L175-V179 PolarHBondContact O-N 2.97Å; L175-I220 HydrophobicContact CB-CG2 4.27Å; L175-I220 HydrophobicContact CD2-CG2 4.23Å; L175-L223 HydrophobicContact CD1-CB 4.15Å; L175-L223 HydrophobicContact CD2-CB 3.52Å; L175-L223 HydrophobicContact CD2-CD1 3.42Å; L175-L223 VanDerWaalsContact CD2-CD1 3.42Å; L175-L223 HydrophobicContact CD2-CG 4.1Å; L175-L224 HydrophobicContact CB-CD2 3.93Å; L175-L224 HydrophobicContact CB-CG 4.23Å; L175-L224 HydrophobicContact CD1-CD2 3.91Å; L175-L224 HydrophobicContact CD1-CG 4.17Å; L175-N227 WeakPolarHBondContact CD1-ND2 3.44Å; L175-V250 HydrophobicContact CB-CG2 4.22Å; L175-V250 HydrophobicContact CD2-CG2 3.65Å; L175-V250 HydrophobicContact CG-CG2 4.26Å
176N98Very high97.3Very high0 Ų020.9 Ų20.90%010%0.104CC..Hα-helixtrans-64.3-36.2-176-74.814000112.9K123 D127 Y152 G172 L173 V179 F180 V250K123-N176 PolarHBondContact NZ-ND2 3.29Å; D127-N176 VanDerWaalsContact OD1-CB 3.25Å; D127-N176 WeakPolarHBondContact OD1-CB 3.4Å; D127-N176 PolarHBondContact OD1-ND2 2.64Å; D127-N176 PolarHBondContact OD2-ND2 3.2Å; Y152-N176 HydrophobicContact CE1-CB 4.3Å; G172-N176 PolarHBondContact O-N 2.74Å; L173-N176 PolarHBondContact O-N 2.93Å; N176-V179 PolarHBondContact O-N 3.22Å; N176-F180 PolarHBondContact O-N 3.23Å; N176-V250 WeakPolarHBondContact OD1-CG2 3.41Å; N176-V250 PolarHBondContact OD1-N 3.14Å; N176-V250 VanDerWaalsContact OD1-N 3.1Å
177F98.6Very high97.3Very high7 Ų721.8 Ų21.83%0.03111%0.11CC..Hα-helixtrans-70.7-32.9177.8-169.9-166.4000112L149 Y152 K153 L173 L175 F180 Y181 L194L149-F177 HydrophobicContact CD1-CE2 3.77Å; L149-F177 HydrophobicContact CD1-CZ 3.79Å; Y152-F177 VanDerWaalsContact CB-CD2 3.48Å; Y152-F177 HydrophobicContact CD1-CB 4.06Å; Y152-F177 HydrophobicContact CD1-CG 4.32Å; Y152-F177 HydrophobicContact CD2-CB 4.35Å; Y152-F177 AromaticContact CD2-CD2 3.47Å; Y152-F177 HydrophobicContact CD2-CD2 3.47Å; Y152-F177 VanDerWaalsContact CD2-CD2 3.47Å; Y152-F177 AromaticContact CD2-CE2 3.95Å; Y152-F177 HydrophobicContact CD2-CE2 3.95Å; Y152-F177 HydrophobicContact CD2-CG 4.09Å; Y152-F177 HydrophobicContact CE1-CB 4.48Å; Y152-F177 HydrophobicContact CE2-CD2 4.28Å; Y152-F177 HydrophobicContact CG-CB 3.99Å; Y152-F177 HydrophobicContact CG-CD1 4.39Å; Y152-F177 AromaticContact CG-CD2 3.6Å; Y152-F177 HydrophobicContact CG-CD2 3.6Å; Y152-F177 HydrophobicContact CG-CE2 4.1Å; Y152-F177 AromaticContact CG-CG 3.78Å; Y152-F177 HydrophobicContact CG-CG 3.78Å; K153-F177 HydrophobicContact CG-CE1 4.49Å; K153-F177 HydrophobicContact CG-CZ 4.13Å; L173-F177 WeakPolarHBondContact O-CB 3.1Å; L173-F177 PolarHBondContact O-N 3.46Å; L175-F177 VanDerWaalsContact C-N 3.32Å; L175-F177 PolarHBondContact O-N 3.14Å; F177-F180 HydrophobicContact CD2-CB 4.33Å; F177-F180 AromaticContact CD2-CD1 3.78Å; F177-F180 HydrophobicContact CD2-CD1 3.78Å; F177-F180 HydrophobicContact CD2-CG 4.44Å; F177-F180 AromaticContact CE2-CD1 3.75Å; F177-F180 HydrophobicContact CE2-CD1 3.75Å; F177-F180 HydrophobicContact CE2-CE1 4.18Å; F177-F180 WeakPolarHBondContact O-CB 3.31Å; F177-F180 PolarHBondContact O-N 3.12Å; F177-Y181 HydrophobicContact CD1-CE2 4.24Å; F177-Y181 AromaticContact CD2-CD2 3.95Å; F177-Y181 HydrophobicContact CD2-CD2 3.95Å; F177-Y181 AromaticContact CD2-CE2 3.67Å; F177-Y181 HydrophobicContact CD2-CE2 3.67Å; F177-Y181 AromaticContact CE1-CE2 3.94Å; F177-Y181 HydrophobicContact CE1-CE2 3.94Å; F177-Y181 AromaticContact CE2-CD2 3.97Å; F177-Y181 HydrophobicContact CE2-CD2 3.97Å; F177-Y181 HydrophobicContact CE2-CE1 4.33Å; F177-Y181 AromaticContact CE2-CE2 3.31Å; F177-Y181 HydrophobicContact CE2-CE2 3.31Å; F177-Y181 AromaticContact CE2-CZ 3.51Å; F177-Y181 HydrophobicContact CG-CD2 4.45Å; F177-Y181 HydrophobicContact CG-CE2 4.13Å; F177-Y181 HydrophobicContact CZ-CD2 4.5Å; F177-Y181 AromaticContact CZ-CE2 3.46Å; F177-Y181 HydrophobicContact CZ-CE2 3.46Å; F177-Y181 VanDerWaalsContact CZ-CE2 3.46Å; F177-Y181 AromaticContact CZ-CZ 3.55Å; F177-Y181 WeakPolarHBondContact CZ-OH 3.35Å; F177-Y181 VanDerWaalsContact O-CD2 3.25Å; F177-Y181 WeakPolarHBondContact O-CD2 3.41Å; F177-Y181 PolarHBondContact O-N 3.48Å; F177-L194 HydrophobicContact CB-CD2 3.77Å; F177-L194 HydrophobicContact CD1-CD2 3.58Å; F177-L194 HydrophobicContact CE1-CD2 4.36Å; F177-L194 HydrophobicContact CG-CD2 3.68Å
178S98.3Very high97.3Very high0 Ų021.7 Ų21.70%011%0.113CC..Hα-helixtrans-66.7-41171.869.70000111.8A174 L175 F180 Y181 Y182 A191 W231A174-S178 VanDerWaalsContact O-CB 3.26Å; A174-S178 WeakPolarHBondContact O-CB 3.42Å; A174-S178 PolarHBondContact O-N 2.96Å; A174-S178 PolarHBondContact O-OG 3Å; A174-S178 VanDerWaalsContact O-OG 3.14Å; L175-S178 PolarHBondContact O-N 3.47Å; L175-S178 VanDerWaalsContact O-N 3.14Å; L175-S178 PolarHBondContact O-OG 3.31Å; S178-F180 VanDerWaalsContact C-N 3.34Å; S178-F180 PolarHBondContact O-N 2.98Å; S178-Y181 PolarHBondContact O-N 2.97Å; S178-Y182 PolarHBondContact O-N 3.33Å; S178-A191 WeakPolarHBondContact O-CB 3.46Å; S178-W231 VanDerWaalsContact OG-CH2 3.32Å; S178-W231 WeakPolarHBondContact OG-CH2 3.42Å
179V97.5Very high97.3Very high1 Ų124.6 Ų24.61%0.00613%0.128CC..Hα-helixtrans-59.5-44172.51760000110.8L175 N176 Y181 Y182 E183 W231 I247 D249L175-V179 WeakPolarHBondContact O-CG2 3.34Å; L175-V179 PolarHBondContact O-N 2.97Å; N176-V179 PolarHBondContact O-N 3.22Å; V179-Y181 PolarHBondContact O-N 3.43Å; V179-Y182 PolarHBondContact O-N 3.09Å; V179-E183 HydrophobicContact CG1-CG 4.01Å; V179-E183 VanDerWaalsContact CG1-OE2 3.28Å; V179-E183 WeakPolarHBondContact CG1-OE2 3.26Å; V179-E183 WeakPolarHBondContact O-CB 3.47Å; V179-E183 PolarHBondContact O-N 3.38Å; V179-W231 HydrophobicContact CG2-CH2 4.16Å; V179-W231 HydrophobicContact CG2-CZ2 4.06Å; V179-I247 HydrophobicContact CB-CG2 4.41Å; V179-I247 HydrophobicContact CG1-CG2 3.96Å; V179-I247 HydrophobicContact CG2-CG2 3.7Å; V179-D249 HydrophobicContact CG2-CB 4.35Å
180F98.4Very high97.3Very high0 Ų029.9 Ų29.90%015%0.147CC..Hα-helixtrans-56.2-47173.5170.1-101.4000112.9R130 A145 S148 L149 Y152 N176 F177 S178 Y182 I184 L185R130-F180 HydrophobicContact CB-CD2 4.25Å; R130-F180 HydrophobicContact CG-CD2 4.18Å; A145-F180 HydrophobicContact CB-CE2 4.44Å; A145-F180 WeakPolarHBondContact O-CZ 3.34Å; S148-F180 WeakPolarHBondContact OG-CD2 3.2Å; S148-F180 WeakPolarHBondContact OG-CE2 3.21Å; L149-F180 HydrophobicContact CB-CE1 3.95Å; L149-F180 HydrophobicContact CB-CZ 3.97Å; L149-F180 HydrophobicContact CD1-CE1 4.04Å; Y152-F180 HydrophobicContact CD2-CB 4.21Å; Y152-F180 HydrophobicContact CD2-CD1 4.2Å; Y152-F180 HydrophobicContact CD2-CG 4.08Å; Y152-F180 HydrophobicContact CE2-CB 3.65Å; Y152-F180 HydrophobicContact CE2-CD1 4.4Å; Y152-F180 HydrophobicContact CE2-CD2 4.18Å; Y152-F180 AromaticContact CE2-CG 3.82Å; Y152-F180 HydrophobicContact CE2-CG 3.82Å; N176-F180 PolarHBondContact O-N 3.23Å; F177-F180 HydrophobicContact CD2-CB 4.33Å; F177-F180 AromaticContact CD2-CD1 3.78Å; F177-F180 HydrophobicContact CD2-CD1 3.78Å; F177-F180 HydrophobicContact CD2-CG 4.44Å; F177-F180 AromaticContact CE2-CD1 3.75Å; F177-F180 HydrophobicContact CE2-CD1 3.75Å; F177-F180 HydrophobicContact CE2-CE1 4.18Å; F177-F180 WeakPolarHBondContact O-CB 3.31Å; F177-F180 PolarHBondContact O-N 3.12Å; S178-F180 VanDerWaalsContact C-N 3.34Å; S178-F180 PolarHBondContact O-N 2.98Å; F180-Y182 VanDerWaalsContact C-N 3.27Å; F180-Y182 PolarHBondContact O-N 3.01Å; F180-I184 HydrophobicContact CD2-CB 3.69Å; F180-I184 HydrophobicContact CD2-CG1 3.73Å; F180-I184 HydrophobicContact CD2-CG2 4.15Å; F180-I184 HydrophobicContact CE2-CB 3.71Å; F180-I184 HydrophobicContact CE2-CG1 4.12Å; F180-I184 HydrophobicContact CE2-CG2 3.65Å; F180-I184 HydrophobicContact CZ-CG2 4.43Å; F180-I184 WeakPolarHBondContact O-CB 3.43Å; F180-I184 PolarHBondContact O-N 2.93Å; F180-L185 HydrophobicContact CD1-CD1 4.19Å; F180-L185 HydrophobicContact CD1-CG 4.32Å; F180-L185 HydrophobicContact CE1-CD1 3.34Å; F180-L185 HydrophobicContact CE1-CD2 4.35Å; F180-L185 HydrophobicContact CE1-CG 3.58Å; F180-L185 HydrophobicContact CE2-CG 4.42Å; F180-L185 HydrophobicContact CZ-CD1 3.79Å; F180-L185 HydrophobicContact CZ-CD2 3.95Å; F180-L185 HydrophobicContact CZ-CG 3.63Å; F180-L185 PolarHBondContact O-N 3.29Å
181Y98.3Very high97.3Very high27 Ų2727.6 Ų27.611%0.10614%0.138CC..Hα-helixtrans-60.2-40.4177.6-84.1-58.9000111.9L149 F177 S178 V179 L185 N186 S187 R190 L194L149-Y181 HydrophobicContact CD1-CE1 4.33Å; F177-Y181 HydrophobicContact CD1-CE2 4.24Å; F177-Y181 AromaticContact CD2-CD2 3.95Å; F177-Y181 HydrophobicContact CD2-CD2 3.95Å; F177-Y181 AromaticContact CD2-CE2 3.67Å; F177-Y181 HydrophobicContact CD2-CE2 3.67Å; F177-Y181 AromaticContact CE1-CE2 3.94Å; F177-Y181 HydrophobicContact CE1-CE2 3.94Å; F177-Y181 AromaticContact CE2-CD2 3.97Å; F177-Y181 HydrophobicContact CE2-CD2 3.97Å; F177-Y181 HydrophobicContact CE2-CE1 4.33Å; F177-Y181 AromaticContact CE2-CE2 3.31Å; F177-Y181 HydrophobicContact CE2-CE2 3.31Å; F177-Y181 AromaticContact CE2-CZ 3.51Å; F177-Y181 HydrophobicContact CG-CD2 4.45Å; F177-Y181 HydrophobicContact CG-CE2 4.13Å; F177-Y181 HydrophobicContact CZ-CD2 4.5Å; F177-Y181 AromaticContact CZ-CE2 3.46Å; F177-Y181 HydrophobicContact CZ-CE2 3.46Å; F177-Y181 VanDerWaalsContact CZ-CE2 3.46Å; F177-Y181 AromaticContact CZ-CZ 3.55Å; F177-Y181 WeakPolarHBondContact CZ-OH 3.35Å; F177-Y181 VanDerWaalsContact O-CD2 3.25Å; F177-Y181 WeakPolarHBondContact O-CD2 3.41Å; F177-Y181 PolarHBondContact O-N 3.48Å; S178-Y181 PolarHBondContact O-N 2.97Å; V179-Y181 PolarHBondContact O-N 3.43Å; Y181-L185 HydrophobicContact CD1-CB 4.46Å; Y181-L185 HydrophobicContact CD1-CD1 3.71Å; Y181-L185 HydrophobicContact CE1-CD1 3.77Å; Y181-L185 CarbonylContact O-C 3.5Å; Y181-N186 PolarHBondContact O-N 2.87Å; Y181-S187 PolarHBondContact O-N 3.48Å; Y181-R190 HydrophobicContact CD1-CB 3.87Å; Y181-R190 HydrophobicContact CD2-CB 4.39Å; Y181-R190 HydrophobicContact CE1-CB 4.32Å; Y181-R190 HydrophobicContact CG-CB 3.93Å; Y181-L194 HydrophobicContact CD2-CD2 4.01Å; Y181-L194 HydrophobicContact CE2-CD2 3.99Å
182Y97.4Very high97.3Very high14 Ų1428.3 Ų28.36%0.05514%0.143CC..Hα-helixtrans-72-56.9179.9-175.7-83000111.7S178 V179 F180 N186 P188 W231 D234 K244 I247S178-Y182 PolarHBondContact O-N 3.33Å; V179-Y182 PolarHBondContact O-N 3.09Å; F180-Y182 VanDerWaalsContact C-N 3.27Å; F180-Y182 PolarHBondContact O-N 3.01Å; Y182-N186 WeakPolarHBondContact O-CA 3.2Å; Y182-N186 PolarHBondContact O-N 3.48Å; Y182-P188 HydrophobicContact CD2-CB 3.87Å; Y182-P188 HydrophobicContact CE2-CB 4.08Å; Y182-W231 AromaticContact CD1-NE1 3.72Å; Y182-W231 HydrophobicContact CD2-CB 4.02Å; Y182-W231 AromaticContact CD2-CD1 3.26Å; Y182-W231 AromaticContact CD2-CD2 3.81Å; Y182-W231 HydrophobicContact CD2-CD2 3.81Å; Y182-W231 AromaticContact CD2-CE2 3.85Å; Y182-W231 AromaticContact CD2-CG 3.42Å; Y182-W231 HydrophobicContact CD2-CG 3.42Å; Y182-W231 VanDerWaalsContact CD2-CG 3.42Å; Y182-W231 AromaticContact CD2-NE1 3.51Å; Y182-W231 AromaticContact CE1-NE1 3.98Å; Y182-W231 HydrophobicContact CE2-CB 3.9Å; Y182-W231 AromaticContact CE2-CD1 3.13Å; Y182-W231 HydrophobicContact CE2-CD2 4.39Å; Y182-W231 AromaticContact CE2-CG 3.54Å; Y182-W231 HydrophobicContact CE2-CG 3.54Å; Y182-W231 AromaticContact CE2-NE1 3.75Å; Y182-W231 AromaticContact CG-CD1 3.77Å; Y182-W231 HydrophobicContact CG-CD2 4.19Å; Y182-W231 AromaticContact CG-CE2 3.77Å; Y182-W231 HydrophobicContact CG-CG 4.16Å; Y182-W231 HydrophobicContact CG-CZ2 4.34Å; Y182-W231 AromaticContact CG-NE1 3.5Å; Y182-W231 AromaticContact CZ-CD1 3.56Å; Y182-W231 AromaticContact CZ-NE1 3.97Å; Y182-D234 PolarHBondContact OH-OD2 3.47Å; Y182-K244 HydrophobicContact CE1-CD 4.5Å; Y182-I247 HydrophobicContact CD1-CD1 3.26Å; Y182-I247 HydrophobicContact CE1-CD1 3.32Å; Y182-I247 HydrophobicContact CG-CD1 4.22Å
183E95.5Very high97.3Very high64 Ų6435.9 Ų35.930%0.29917%0.171SC..Hα-helixtrans-79.5-40.9-169.4-65.3-171.4143.200113.5R130 V179 I247R130-E183 IonicContact NH1-OE2 2.68Å; V179-E183 HydrophobicContact CG1-CG 4.01Å; V179-E183 VanDerWaalsContact CG1-OE2 3.28Å; V179-E183 WeakPolarHBondContact CG1-OE2 3.26Å; V179-E183 WeakPolarHBondContact O-CB 3.47Å; V179-E183 PolarHBondContact O-N 3.38Å; E183-I247 HydrophobicContact CG-CD1 3.71Å
184I97.4Very high97.3Very high14 Ų1437.7 Ų37.77%0.07218%0.18CC..THydrogen-bonded Turntrans-95-46.1-172.3-54.1-53.2000111.5R130 A133 E134 R141 A145 F180R130-I184 HydrophobicContact CG-CD1 4.35Å; R130-I184 HydrophobicContact CG-CG1 3.85Å; A133-I184 HydrophobicContact CB-CD1 4.16Å; A133-I184 HydrophobicContact CB-CG1 4.43Å; A133-I184 HydrophobicContact CB-CG2 3.79Å; E134-I184 HydrophobicContact CG-CD1 4.1Å; R141-I184 PolarHBondContact NH2-O 3.47Å; A145-I184 HydrophobicContact CB-CG2 3.77Å; F180-I184 HydrophobicContact CD2-CB 3.69Å; F180-I184 HydrophobicContact CD2-CG1 3.73Å; F180-I184 HydrophobicContact CD2-CG2 4.15Å; F180-I184 HydrophobicContact CE2-CB 3.71Å; F180-I184 HydrophobicContact CE2-CG1 4.12Å; F180-I184 HydrophobicContact CE2-CG2 3.65Å; F180-I184 HydrophobicContact CZ-CG2 4.43Å; F180-I184 WeakPolarHBondContact O-CB 3.43Å; F180-I184 PolarHBondContact O-N 2.93Å
185L97.3Very high97.2Very high57 Ų5737.2 Ų37.230%0.29818%0.176SC..THydrogen-bonded Turntrans-91.2-1.7-178.4-63.1-171.5000114A145 F180 Y181 S187A145-L185 HydrophobicContact CB-CD2 4.46Å; F180-L185 HydrophobicContact CD1-CD1 4.19Å; F180-L185 HydrophobicContact CD1-CG 4.32Å; F180-L185 HydrophobicContact CE1-CD1 3.34Å; F180-L185 HydrophobicContact CE1-CD2 4.35Å; F180-L185 HydrophobicContact CE1-CG 3.58Å; F180-L185 HydrophobicContact CE2-CG 4.42Å; F180-L185 HydrophobicContact CZ-CD1 3.79Å; F180-L185 HydrophobicContact CZ-CD2 3.95Å; F180-L185 HydrophobicContact CZ-CG 3.63Å; F180-L185 PolarHBondContact O-N 3.29Å; Y181-L185 HydrophobicContact CD1-CB 4.46Å; Y181-L185 HydrophobicContact CD1-CD1 3.71Å; Y181-L185 HydrophobicContact CE1-CD1 3.77Å; Y181-L185 CarbonylContact O-C 3.5Å; L185-S187 PolarHBondContact O-N 3.34Å; L185-S187 VanDerWaalsContact O-N 3.11Å; L185-S187 PolarHBondContact O-OG 3.4Å
186N95.6Very high97.2Very high120 Ų12042.9 Ų42.964%0.64220%0.201SC*.  trans46.543.8-178.9-165.758.1000112.1Y181 Y182 P188Y181-N186 PolarHBondContact O-N 2.87Å; Y182-N186 WeakPolarHBondContact O-CA 3.2Å; Y182-N186 PolarHBondContact O-N 3.48Å; N186-P188 VanDerWaalsContact C-CD 3.42Å; N186-P188 WeakPolarHBondContact O-CD 3.48Å
187S96.5Very high97.2Very high23 Ų2345 Ų4516%0.16122%0.219CC..  trans-121.467.9-174.5-62.30000109.8Y181 L185 D189 R190 A191Y181-S187 PolarHBondContact O-N 3.48Å; L185-S187 PolarHBondContact O-N 3.34Å; L185-S187 VanDerWaalsContact O-N 3.11Å; L185-S187 PolarHBondContact O-OG 3.4Å; S187-D189 PolarHBondContact O-N 3.33Å; S187-R190 PolarHBondContact O-N 3.17Å; S187-A191 PolarHBondContact O-N 3.25Å
188P95Very high97.1Very high34 Ų3445.5 Ų45.522%0.22122%0.224CC..Hα-helixtrans-61.3-30.2-175.126.1-35.7000112.7Y182 N186 R190 A191 C192 M235Y182-P188 HydrophobicContact CD2-CB 3.87Å; Y182-P188 HydrophobicContact CE2-CB 4.08Å; N186-P188 VanDerWaalsContact C-CD 3.42Å; N186-P188 WeakPolarHBondContact O-CD 3.48Å; P188-R190 VanDerWaalsContact C-N 3.32Å; P188-R190 PolarHBondContact O-N 2.92Å; P188-A191 PolarHBondContact O-N 2.88Å; P188-C192 WeakPolarHBondContact O-CB 3.38Å; P188-C192 PolarHBondContact O-N 3.42Å; P188-C192 PolarHBondContact O-SG 3.04Å; P188-M235 HydrophobicContact CB-CG 4.07Å; P188-M235 HydrophobicContact CB-SD 3.88Å; P188-M235 HydrophobicContact CG-CG 4.23Å; P188-M235 HydrophobicContact CG-SD 4.18Å
189D95.2Very high97.1Very high77 Ų7747.3 Ų47.341%0.41223%0.232SC..Hα-helixtrans-63.4-35.9175.470.7-63.5000112.7S187 R193S187-D189 PolarHBondContact O-N 3.33Å; D189-R193 WeakPolarHBondContact O-CB 3.31Å; D189-R193 WeakPolarHBondContact O-CG 3.39Å; D189-R193 PolarHBondContact O-N 3.08Å; D189-R193 PolarHBondContact O-NE 2.77Å; D189-R193 IonicContact OD2-CZ 2.76Å; D189-R193 IonicContact OD2-NH2 2.95Å; D189-R193 PolarHBondContact OD2-NH2 3.43Å
190R97.1Very high97.1Very high124 Ų12450.9 Ų50.947%0.46825%0.251SS..Hα-helixtrans-77.8-41.4175.9-67.6-174.4178.9-177.8-1.3111Y181 S187 P188 R193 L194Y181-R190 HydrophobicContact CD1-CB 3.87Å; Y181-R190 HydrophobicContact CD2-CB 4.39Å; Y181-R190 HydrophobicContact CE1-CB 4.32Å; Y181-R190 HydrophobicContact CG-CB 3.93Å; S187-R190 PolarHBondContact O-N 3.17Å; P188-R190 VanDerWaalsContact C-N 3.32Å; P188-R190 PolarHBondContact O-N 2.92Å; R190-R193 PolarHBondContact O-N 2.96Å; R190-L194 WeakPolarHBondContact O-CB 3.26Å; R190-L194 PolarHBondContact O-N 3.48Å
191A97.1Very high97Very high0 Ų054.6 Ų54.60%027%0.271CS..Hα-helixtrans-56.5-52175.300000111S178 S187 P188 R193 L194 A195 W231S178-A191 WeakPolarHBondContact O-CB 3.46Å; S187-A191 PolarHBondContact O-N 3.25Å; P188-A191 PolarHBondContact O-N 2.88Å; A191-R193 PolarHBondContact O-N 3.27Å; A191-L194 PolarHBondContact O-N 2.88Å; A191-A195 WeakPolarHBondContact O-CB 3.35Å; A191-A195 PolarHBondContact O-N 2.94Å; A191-W231 HydrophobicContact CB-CE3 3.99Å; A191-W231 HydrophobicContact CB-CH2 4.43Å; A191-W231 HydrophobicContact CB-CZ3 3.92Å
192C97.2Very high96.9Very high16 Ų1653.3 Ų53.311%0.10827%0.266CS..Hα-helixtrans-64.4-41.4179.9-65.30000112.3P188 L194 K196 L228 M235P188-C192 WeakPolarHBondContact O-CB 3.38Å; P188-C192 PolarHBondContact O-N 3.42Å; P188-C192 PolarHBondContact O-SG 3.04Å; C192-L194 PolarHBondContact O-N 3.23Å; C192-K196 WeakPolarHBondContact O-CB 3.35Å; C192-K196 PolarHBondContact O-N 2.63Å; C192-L228 HydrophobicContact CB-CD2 4.04Å; C192-L228 WeakPolarHBondContact O-CD2 3.26Å; C192-M235 HydrophobicContact CB-CE 4.44Å; C192-M235 WeakPolarHBondContact SG-CE 3.45Å
193R97.5Very high96.8Very high161 Ų16156.6 Ų56.661%0.60828%0.284SS*.Hα-helixtrans-60.9-44.4176.1-90.5-176.3-74.1148.9-11.9112.3D189 R190 A191 A197D189-R193 WeakPolarHBondContact O-CB 3.31Å; D189-R193 WeakPolarHBondContact O-CG 3.39Å; D189-R193 PolarHBondContact O-N 3.08Å; D189-R193 PolarHBondContact O-NE 2.77Å; D189-R193 IonicContact OD2-CZ 2.76Å; D189-R193 IonicContact OD2-NH2 2.95Å; D189-R193 PolarHBondContact OD2-NH2 3.43Å; R190-R193 PolarHBondContact O-N 2.96Å; A191-R193 PolarHBondContact O-N 3.27Å; R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.26Å; R193-A197 PolarHBondContact O-N 2.82Å
194L98Very high96.8Very high42 Ų4257.6 Ų57.622%0.2230%0.303CS..Hα-helixtrans-66.7-49.9-179.9179.661.7000111.5F177 Y181 R190 A191 C192 K196 A197 A198F177-L194 HydrophobicContact CB-CD2 3.77Å; F177-L194 HydrophobicContact CD1-CD2 3.58Å; F177-L194 HydrophobicContact CE1-CD2 4.36Å; F177-L194 HydrophobicContact CG-CD2 3.68Å; Y181-L194 HydrophobicContact CD2-CD2 4.01Å; Y181-L194 HydrophobicContact CE2-CD2 3.99Å; R190-L194 WeakPolarHBondContact O-CB 3.26Å; R190-L194 PolarHBondContact O-N 3.48Å; A191-L194 PolarHBondContact O-N 2.88Å; C192-L194 PolarHBondContact O-N 3.23Å; L194-K196 VanDerWaalsContact C-N 3.34Å; L194-K196 PolarHBondContact O-N 3.49Å; L194-A197 PolarHBondContact O-N 3.36Å; L194-A198 PolarHBondContact O-N 2.84Å
195A97.5Very high96.7Very high0 Ų060.8 Ų60.80%032%0.318CS..Hα-helixtrans-62.8-41.6-179.400000111.8A191 A198 F199 L224 L228 W231A191-A195 WeakPolarHBondContact O-CB 3.35Å; A191-A195 PolarHBondContact O-N 2.94Å; A195-A198 PolarHBondContact O-N 2.68Å; A195-F199 WeakPolarHBondContact O-CB 3.33Å; A195-F199 PolarHBondContact O-N 3.11Å; A195-L224 HydrophobicContact CB-CD2 3.77Å; A195-L228 HydrophobicContact CB-CD1 4.21Å; A195-L228 HydrophobicContact CB-CD2 3.82Å; A195-L228 HydrophobicContact CB-CG 3.82Å; A195-W231 HydrophobicContact CB-CZ3 4.13Å
196K97.4Very high96.3Very high119 Ų11959.7 Ų59.752%0.51731%0.312SS..Hα-helixtrans-65.2-46.1177.5-176174.8-179179.60112.1C192 L194 A198 F199 D200 L228C192-K196 WeakPolarHBondContact O-CB 3.35Å; C192-K196 PolarHBondContact O-N 2.63Å; L194-K196 VanDerWaalsContact C-N 3.34Å; L194-K196 PolarHBondContact O-N 3.49Å; K196-A198 VanDerWaalsContact C-N 3.34Å; K196-A198 PolarHBondContact O-N 3.22Å; K196-F199 PolarHBondContact O-N 3.24Å; K196-D200 WeakPolarHBondContact CE-OD2 3.28Å; K196-D200 WeakPolarHBondContact CG-OD2 3.34Å; K196-D200 WeakPolarHBondContact O-CB 3.39Å; K196-D200 VanDerWaalsContact O-CG 3.27Å; K196-D200 PolarHBondContact O-N 3.21Å; K196-L228 HydrophobicContact CB-CD1 4.19Å; K196-L228 HydrophobicContact CB-CD2 4.11Å
197A98Very high96Very high46 Ų4661.9 Ų61.938%0.3832%0.324SS..Hα-helixtrans-59.3-45.8177.800000111.5R193 L194 F199 D200 D201R193-A197 VanDerWaalsContact O-CB 3.29Å; R193-A197 WeakPolarHBondContact O-CB 3.26Å; R193-A197 PolarHBondContact O-N 2.82Å; L194-A197 PolarHBondContact O-N 3.36Å; A197-F199 VanDerWaalsContact C-N 3.35Å; A197-F199 PolarHBondContact O-N 2.93Å; A197-D200 PolarHBondContact O-N 2.98Å; A197-D201 WeakPolarHBondContact O-CB 3.4Å; A197-D201 PolarHBondContact O-N 2.98Å
198A97.9Very high95.6Very high16 Ų1665.8 Ų65.813%0.13235%0.347CS..Hα-helixtrans-63.4-39.9177.600000112.9A174 L194 A195 K196 A202 L224A174-A198 HydrophobicContact CB-CB 3.38Å; L194-A198 PolarHBondContact O-N 2.84Å; A195-A198 PolarHBondContact O-N 2.68Å; K196-A198 VanDerWaalsContact C-N 3.34Å; K196-A198 PolarHBondContact O-N 3.22Å; A198-A202 VanDerWaalsContact O-CB 3.28Å; A198-A202 WeakPolarHBondContact O-CB 3.46Å; A198-A202 PolarHBondContact O-N 3.49Å; A198-A202 VanDerWaalsContact O-N 3.07Å; A198-L224 HydrophobicContact CB-CD1 4.34Å
199F97.3Very high95.1Very high38 Ų3865.8 Ų65.817%0.16735%0.345CS..Hα-helixtrans-66.6-46.7177.2-174.5-98.5000112A195 K196 A197 A202 I203 M221 L224 R225A195-F199 WeakPolarHBondContact O-CB 3.33Å; A195-F199 PolarHBondContact O-N 3.11Å; K196-F199 PolarHBondContact O-N 3.24Å; A197-F199 VanDerWaalsContact C-N 3.35Å; A197-F199 PolarHBondContact O-N 2.93Å; F199-A202 PolarHBondContact O-N 3.24Å; F199-I203 HydrophobicContact CD1-CD1 3.58Å; F199-I203 HydrophobicContact CD1-CG1 4.36Å; F199-I203 HydrophobicContact CE1-CD1 3.08Å; F199-I203 HydrophobicContact CE1-CG1 4.16Å; F199-I203 HydrophobicContact CE2-CD1 4.28Å; F199-I203 HydrophobicContact CG-CD1 4.39Å; F199-I203 HydrophobicContact CZ-CD1 3.49Å; F199-I203 VanDerWaalsContact CZ-CD1 3.49Å; F199-I203 HydrophobicContact CZ-CG1 4.34Å; F199-I203 WeakPolarHBondContact O-CB 3.44Å; F199-I203 WeakPolarHBondContact O-CG1 3.48Å; F199-I203 PolarHBondContact O-N 3.48Å; F199-M221 HydrophobicContact CD2-CB 4.12Å; F199-M221 HydrophobicContact CD2-CE 4.49Å; F199-M221 WeakPolarHBondContact CD2-O 3.41Å; F199-M221 HydrophobicContact CE2-CB 4.08Å; F199-M221 HydrophobicContact CE2-CE 4.46Å; F199-M221 VanDerWaalsContact CE2-O 3.29Å; F199-M221 WeakPolarHBondContact CE2-O 3.36Å; F199-L224 HydrophobicContact CD2-CB 4.38Å; F199-R225 HydrophobicContact CD2-CB 4.44Å; F199-R225 HydrophobicContact CE2-CB 3.88Å; F199-R225 HydrophobicContact CZ-CB 4.18Å; F199-R225 HydrophobicContact CZ-CG 4.3Å
200D97.6Very high94.5Very high77 Ų7765.1 Ų65.141%0.41235%0.346SS..Hα-helixtrans-64.8-44179.6-69.8-16.1000111.2K196 A197 A202 I203 A204K196-D200 WeakPolarHBondContact CE-OD2 3.28Å; K196-D200 WeakPolarHBondContact CG-OD2 3.34Å; K196-D200 WeakPolarHBondContact O-CB 3.39Å; K196-D200 VanDerWaalsContact O-CG 3.27Å; K196-D200 PolarHBondContact O-N 3.21Å; A197-D200 PolarHBondContact O-N 2.98Å; D200-A202 PolarHBondContact O-N 3.32Å; D200-I203 PolarHBondContact O-N 2.91Å; D200-A204 PolarHBondContact O-N 2.97Å; D200-A204 VanDerWaalsContact O-N 3.14Å
201D96.8Very high93.9Very high78 Ų7868.2 Ų68.242%0.41737%0.366SS..Hα-helixtrans-62.4-42.2176.8-70.9-12.7000111.5P165 A197 A204P165-D201 HydrophobicContact CB-CB 3.91Å; P165-D201 HydrophobicContact CG-CB 4.42Å; A197-D201 WeakPolarHBondContact O-CB 3.4Å; A197-D201 PolarHBondContact O-N 2.98Å; D201-A204 PolarHBondContact O-N 3.43Å
202A96.1Very high93.1Very high0 Ų076.4 Ų76.40%040%0.404CS..Hα-helixtrans-71.4-37.417900000112.8T166 L171 A198 F199 D200 A204 E205 L206 M221T166-A202 HydrophobicContact CG2-CB 4.38Å; T166-A202 WeakPolarHBondContact CG2-O 3.27Å; L171-A202 HydrophobicContact CD1-CB 4.41Å; L171-A202 HydrophobicContact CD2-CB 3.68Å; A198-A202 VanDerWaalsContact O-CB 3.28Å; A198-A202 WeakPolarHBondContact O-CB 3.46Å; A198-A202 PolarHBondContact O-N 3.49Å; A198-A202 VanDerWaalsContact O-N 3.07Å; F199-A202 PolarHBondContact O-N 3.24Å; D200-A202 PolarHBondContact O-N 3.32Å; A202-A204 VanDerWaalsContact C-N 3.28Å; A202-A204 PolarHBondContact O-N 2.95Å; A202-E205 CarbonylContact O-C 3.37Å; A202-E205 PolarHBondContact O-N 3.39Å; A202-L206 WeakPolarHBondContact O-CA 3.1Å; A202-L206 WeakPolarHBondContact O-CB 3.4Å; A202-L206 PolarHBondContact O-N 3.14Å; A202-M221 HydrophobicContact CB-CE 3.83Å; A202-M221 HydrophobicContact CB-CG 4.29Å; A202-M221 HydrophobicContact CB-SD 3.86Å
203I95.4Very high92.5Very high82 Ų8277.3 Ų77.342%0.42141%0.411SS..Hα-helixtrans-58.7-42.1173.6-80.7-178.6000111.1F199 D200 E205 L206 M221F199-I203 HydrophobicContact CD1-CD1 3.58Å; F199-I203 HydrophobicContact CD1-CG1 4.36Å; F199-I203 HydrophobicContact CE1-CD1 3.08Å; F199-I203 HydrophobicContact CE1-CG1 4.16Å; F199-I203 HydrophobicContact CE2-CD1 4.28Å; F199-I203 HydrophobicContact CG-CD1 4.39Å; F199-I203 HydrophobicContact CZ-CD1 3.49Å; F199-I203 VanDerWaalsContact CZ-CD1 3.49Å; F199-I203 HydrophobicContact CZ-CG1 4.34Å; F199-I203 WeakPolarHBondContact O-CB 3.44Å; F199-I203 WeakPolarHBondContact O-CG1 3.48Å; F199-I203 PolarHBondContact O-N 3.48Å; D200-I203 PolarHBondContact O-N 2.91Å; I203-E205 PolarHBondContact O-N 3.39Å; I203-E205 VanDerWaalsContact O-N 3.17Å; I203-L206 PolarHBondContact O-N 3.01Å; I203-M221 HydrophobicContact CB-CE 4.4Å; I203-M221 HydrophobicContact CG1-CE 3.48Å; I203-M221 VanDerWaalsContact CG1-CE 3.48Å
204A95.1Very high92Very high86 Ų8675.2 Ų75.271%0.71140%0.403SS*.Hα-helixtrans-61.6-24.7-177.400000113.3D200 D201 A202D200-A204 PolarHBondContact O-N 2.97Å; D200-A204 VanDerWaalsContact O-N 3.14Å; D201-A204 PolarHBondContact O-N 3.43Å; A202-A204 VanDerWaalsContact C-N 3.28Å; A202-A204 PolarHBondContact O-N 2.95Å
205E94.3Very high91.7Very high81 Ų8180.4 Ų80.438%0.37942%0.424SS..Hα-helixtrans-116.93.9-177.8-65.9-174.1-158.100113.6P165 T166 A202 I203 D207 T208P165-E205 WeakPolarHBondContact CD-OE2 3.42Å; T166-E205 HydrophobicContact CG2-CB 3.8Å; A202-E205 CarbonylContact O-C 3.37Å; A202-E205 PolarHBondContact O-N 3.39Å; I203-E205 PolarHBondContact O-N 3.39Å; I203-E205 VanDerWaalsContact O-N 3.17Å; E205-D207 VanDerWaalsContact C-N 3.27Å; E205-D207 PolarHBondContact O-N 3.35Å; E205-T208 WeakPolarHBondContact O-CB 3.13Å; E205-T208 PolarHBondContact O-N 3.44Å; E205-T208 PolarHBondContact O-OG1 3.18Å
206L90.8Very high91.4Very high34 Ų3481.6 Ų81.618%0.17843%0.431CS..G310 helixtrans-57.5-37.7-173.4-174.759.6000113.1A202 I203 T208 L209 Y214 T218 M221A202-L206 WeakPolarHBondContact O-CA 3.1Å; A202-L206 WeakPolarHBondContact O-CB 3.4Å; A202-L206 PolarHBondContact O-N 3.14Å; I203-L206 PolarHBondContact O-N 3.01Å; L206-T208 PolarHBondContact O-N 3.37Å; L206-T208 VanDerWaalsContact O-N 3.08Å; L206-L209 HydrophobicContact CD1-CD1 3.54Å; L206-L209 WeakPolarHBondContact O-CB 3.05Å; L206-L209 PolarHBondContact O-N 3.04Å; L206-Y214 HydrophobicContact CD1-CE2 4.23Å; L206-Y214 HydrophobicContact CG-CE2 4.39Å; L206-T218 HydrophobicContact CD1-CG2 4.03Å; L206-M221 HydrophobicContact CD1-CE 4.46Å; L206-M221 HydrophobicContact CD1-SD 3.94Å; L206-M221 HydrophobicContact CD2-CE 4.23Å
207D89.3Confident91.2Very high166 Ų16676 Ų7689%0.88841%0.406SS*.G310 helixtrans-65.5-10.1179-67.8-24.6000113.6E205E205-D207 VanDerWaalsContact C-N 3.27Å; E205-D207 PolarHBondContact O-N 3.35Å
208T86.2Confident91Very high105 Ų10575.9 Ų75.964%0.64440%0.401SS*.G310 helixtrans-94.8-5.7179.672.30000113.8E205 L206E205-T208 WeakPolarHBondContact O-CB 3.13Å; E205-T208 PolarHBondContact O-N 3.44Å; E205-T208 PolarHBondContact O-OG1 3.18Å; L206-T208 PolarHBondContact O-N 3.37Å; L206-T208 VanDerWaalsContact O-N 3.08Å
209L85.2Confident90.9Very high34 Ų3477.9 Ų77.918%0.17841%0.409CS..  trans-70.2144.2-175.6-86.4167.3000113.1T166 L206 Y214T166-L209 HydrophobicContact CG2-CD1 3.94Å; T166-L209 HydrophobicContact CG2-CG 4.1Å; L206-L209 HydrophobicContact CD1-CD1 3.54Å; L206-L209 WeakPolarHBondContact O-CB 3.05Å; L206-L209 PolarHBondContact O-N 3.04Å; L209-Y214 HydrophobicContact CB-CD2 4.23Å
210S83.1Confident90.8Very high63 Ų6376.1 Ų76.144%0.44140%0.401SS..  trans-71.8155.8167.166.10000110.9E212 S213 Y214S210-E212 PolarHBondContact O-N 3Å; S210-S213 PolarHBondContact O-N 2.97Å; S210-S213 PolarHBondContact OG-N 3.21Å; S210-Y214 WeakPolarHBondContact O-CB 3.34Å; S210-Y214 PolarHBondContact O-N 2.85Å
211E83.1Confident90.8Very high188 Ų18872.9 Ų72.988%0.87938%0.384SS*.Hα-helixtrans-57.7-33.4176.8-168.3175.7-176.300112.4
212E80.9Confident90.7Very high172 Ų17272.1 Ų72.180%0.80438%0.378SS*.Hα-helixtrans-65.2-43.5179.9-173.2174.6-166.700112.6S210S210-E212 PolarHBondContact O-N 3Å
213S84.7Confident90.7Very high36 Ų3672.2 Ų72.225%0.25238%0.378SS..Hα-helixtrans-88.2-19.3179.8-58.50000113.4S210 K215 D216 S217S210-S213 PolarHBondContact O-N 2.97Å; S210-S213 PolarHBondContact OG-N 3.21Å; S213-K215 VanDerWaalsContact C-N 3.33Å; S213-K215 PolarHBondContact O-N 3.1Å; S213-D216 PolarHBondContact O-N 3.22Å; S213-S217 WeakPolarHBondContact O-CB 3.38Å; S213-S217 PolarHBondContact O-N 3.4Å; S213-S217 PolarHBondContact O-OG 2.98Å; S213-S217 VanDerWaalsContact O-OG 3.13Å
214Y88.2Confident90.8Very high116 Ų11668.3 Ų68.346%0.45536%0.358SS..Hα-helixtrans-57.2-43.6-174.2-171.1-90.9000112.7L206 L209 S210 T218L206-Y214 HydrophobicContact CD1-CE2 4.23Å; L206-Y214 HydrophobicContact CG-CE2 4.39Å; L209-Y214 HydrophobicContact CB-CD2 4.23Å; S210-Y214 WeakPolarHBondContact O-CB 3.34Å; S210-Y214 PolarHBondContact O-N 2.85Å; Y214-T218 HydrophobicContact CD1-CG2 4.06Å; Y214-T218 HydrophobicContact CD2-CG2 4.41Å; Y214-T218 HydrophobicContact CE1-CG2 3.78Å; Y214-T218 HydrophobicContact CE2-CG2 4.15Å; Y214-T218 HydrophobicContact CG-CG2 4.37Å; Y214-T218 WeakPolarHBondContact O-CB 3.46Å; Y214-T218 VanDerWaalsContact O-CG2 3.24Å; Y214-T218 WeakPolarHBondContact O-CG2 3.26Å; Y214-T218 PolarHBondContact O-N 3.23Å; Y214-T218 PolarHBondContact O-OG1 3.42Å
215K90.8Very high90.8Very high152 Ų15269.7 Ų69.766%0.66135%0.345SS*.Hα-helixtrans-62.3-51.3-178.6-174.4-170.7171.5-159.80111.9S213 T218 L219S213-K215 VanDerWaalsContact C-N 3.33Å; S213-K215 PolarHBondContact O-N 3.1Å; K215-T218 PolarHBondContact O-OG1 2.83Å; K215-T218 VanDerWaalsContact O-OG1 3.13Å; K215-L219 WeakPolarHBondContact O-CB 3.44Å; K215-L219 PolarHBondContact O-N 3.4Å; K215-L219 VanDerWaalsContact O-N 3.12Å
216D90.9Very high90.9Very high25 Ų2568.5 Ų68.513%0.13434%0.342CS..Hα-helixtrans-69.5-43.5-175.8-68.9-5.9000111.1P168 S213 T218 L219 I220 V255 S256P168-D216 HydrophobicContact CB-CB 4.11Å; P168-D216 HydrophobicContact CG-CB 4.01Å; S213-D216 PolarHBondContact O-N 3.22Å; D216-T218 PolarHBondContact O-N 3.4Å; D216-L219 PolarHBondContact O-N 3.15Å; D216-I220 VanDerWaalsContact O-CG1 3.32Å; D216-I220 WeakPolarHBondContact O-CG1 3.49Å; D216-I220 PolarHBondContact O-N 3.39Å; D216-I220 VanDerWaalsContact O-N 3.08Å; D216-V255 HydrophobicContact CB-CG1 4.16Å; D216-S256 PolarHBondContact OD2-OG 3.11Å
217S94Very high91.1Very high0 Ų067.1 Ų67.10%033%0.334CS..Hα-helixtrans-62.9-44.9178.2-62.40000112.3T166 P168 S213 L219 I220 M221T166-S217 WeakPolarHBondContact O-CB 3.5Å; T166-S217 PolarHBondContact O-OG 2.95Å; P168-S217 WeakPolarHBondContact CD-OG 3.41Å; P168-S217 WeakPolarHBondContact CG-OG 3.46Å; S213-S217 WeakPolarHBondContact O-CB 3.38Å; S213-S217 PolarHBondContact O-N 3.4Å; S213-S217 PolarHBondContact O-OG 2.98Å; S213-S217 VanDerWaalsContact O-OG 3.13Å; S217-L219 VanDerWaalsContact C-N 3.34Å; S217-L219 PolarHBondContact O-N 2.89Å; S217-I220 PolarHBondContact O-N 3Å; S217-M221 WeakPolarHBondContact O-CB 3.37Å; S217-M221 WeakPolarHBondContact O-CG 3.47Å; S217-M221 PolarHBondContact O-N 3.5Å
218T94.3Very high91.3Very high44 Ų4460.4 Ų60.427%0.2730%0.298SS..Hα-helixtrans-67.3-34.7179.653.10000112.6L206 Y214 K215 D216 M221 Q222L206-T218 HydrophobicContact CD1-CG2 4.03Å; Y214-T218 HydrophobicContact CD1-CG2 4.06Å; Y214-T218 HydrophobicContact CD2-CG2 4.41Å; Y214-T218 HydrophobicContact CE1-CG2 3.78Å; Y214-T218 HydrophobicContact CE2-CG2 4.15Å; Y214-T218 HydrophobicContact CG-CG2 4.37Å; Y214-T218 WeakPolarHBondContact O-CB 3.46Å; Y214-T218 VanDerWaalsContact O-CG2 3.24Å; Y214-T218 WeakPolarHBondContact O-CG2 3.26Å; Y214-T218 PolarHBondContact O-N 3.23Å; Y214-T218 PolarHBondContact O-OG1 3.42Å; K215-T218 PolarHBondContact O-OG1 2.83Å; K215-T218 VanDerWaalsContact O-OG1 3.13Å; D216-T218 PolarHBondContact O-N 3.4Å; T218-M221 PolarHBondContact O-N 2.72Å; T218-Q222 WeakPolarHBondContact O-CB 3.33Å; T218-Q222 PolarHBondContact O-N 2.75Å
219L94.5Very high91.7Very high58 Ų5859.7 Ų59.730%0.30429%0.294SS..Hα-helixtrans-62.6-45.3173.3-177.359.5000111.5K215 D216 S217 Q222 L223 V255K215-L219 WeakPolarHBondContact O-CB 3.44Å; K215-L219 PolarHBondContact O-N 3.4Å; K215-L219 VanDerWaalsContact O-N 3.12Å; D216-L219 PolarHBondContact O-N 3.15Å; S217-L219 VanDerWaalsContact C-N 3.34Å; S217-L219 PolarHBondContact O-N 2.89Å; L219-Q222 WeakPolarHBondContact O-CB 3.48Å; L219-Q222 PolarHBondContact O-N 3.41Å; L219-L223 PolarHBondContact O-N 2.91Å; L219-L223 VanDerWaalsContact O-N 3.1Å; L219-V255 HydrophobicContact CD2-CG2 3.96Å; L219-V255 HydrophobicContact CG-CG2 4.46Å
220I95.9Very high91.9Very high1 Ų159.1 Ų59.11%0.00529%0.291CS..Hα-helixtrans-68-38177-59.4162.1000111.7P168 L171 L175 D216 S217 Q222 L223 L224 V255P168-I220 HydrophobicContact CB-CD1 4.04Å; P168-I220 VanDerWaalsContact O-CD1 3.23Å; P168-I220 WeakPolarHBondContact O-CD1 3.34Å; L171-I220 HydrophobicContact CB-CB 4.12Å; L171-I220 HydrophobicContact CB-CD1 4.25Å; L171-I220 HydrophobicContact CB-CG2 3.63Å; L175-I220 HydrophobicContact CB-CG2 4.27Å; L175-I220 HydrophobicContact CD2-CG2 4.23Å; D216-I220 VanDerWaalsContact O-CG1 3.32Å; D216-I220 WeakPolarHBondContact O-CG1 3.49Å; D216-I220 PolarHBondContact O-N 3.39Å; D216-I220 VanDerWaalsContact O-N 3.08Å; S217-I220 PolarHBondContact O-N 3Å; I220-Q222 VanDerWaalsContact C-N 3.27Å; I220-Q222 PolarHBondContact O-N 3.12Å; I220-L223 WeakPolarHBondContact O-CB 3.39Å; I220-L223 PolarHBondContact O-N 3.03Å; I220-L224 HydrophobicContact CG2-CD1 4.47Å; I220-L224 WeakPolarHBondContact O-CG 3.49Å; I220-L224 PolarHBondContact O-N 3.16Å; I220-V255 HydrophobicContact CD1-CG1 3.63Å; I220-V255 HydrophobicContact CG1-CG1 3.86Å; I220-V255 HydrophobicContact CG1-CG2 4.19Å
221M96.5Very high92.4Very high9 Ų956.1 Ų56.14%0.04427%0.27CS..Hα-helixtrans-62.6-37.2174.7-71.8171.973.100111.7L171 F199 A202 I203 L206 S217 T218 L224 R225L171-M221 HydrophobicContact CD1-CG 4Å; L171-M221 HydrophobicContact CD1-SD 4.42Å; L171-M221 HydrophobicContact CD2-CG 4.16Å; F199-M221 HydrophobicContact CD2-CB 4.12Å; F199-M221 HydrophobicContact CD2-CE 4.49Å; F199-M221 WeakPolarHBondContact CD2-O 3.41Å; F199-M221 HydrophobicContact CE2-CB 4.08Å; F199-M221 HydrophobicContact CE2-CE 4.46Å; F199-M221 VanDerWaalsContact CE2-O 3.29Å; F199-M221 WeakPolarHBondContact CE2-O 3.36Å; A202-M221 HydrophobicContact CB-CE 3.83Å; A202-M221 HydrophobicContact CB-CG 4.29Å; A202-M221 HydrophobicContact CB-SD 3.86Å; I203-M221 HydrophobicContact CB-CE 4.4Å; I203-M221 HydrophobicContact CG1-CE 3.48Å; I203-M221 VanDerWaalsContact CG1-CE 3.48Å; L206-M221 HydrophobicContact CD1-CE 4.46Å; L206-M221 HydrophobicContact CD1-SD 3.94Å; L206-M221 HydrophobicContact CD2-CE 4.23Å; S217-M221 WeakPolarHBondContact O-CB 3.37Å; S217-M221 WeakPolarHBondContact O-CG 3.47Å; S217-M221 PolarHBondContact O-N 3.5Å; T218-M221 PolarHBondContact O-N 2.72Å; M221-L224 PolarHBondContact O-N 2.87Å; M221-R225 PolarHBondContact O-N 3.21Å
222Q96Very high92.7Very high63 Ų6349.8 Ų49.829%0.29424%0.244SC..Hα-helixtrans-61.3-46.9173.5178.256.431.700111.2T218 L219 I220 L224 R225 D226T218-Q222 WeakPolarHBondContact O-CB 3.33Å; T218-Q222 PolarHBondContact O-N 2.75Å; L219-Q222 WeakPolarHBondContact O-CB 3.48Å; L219-Q222 PolarHBondContact O-N 3.41Å; I220-Q222 VanDerWaalsContact C-N 3.27Å; I220-Q222 PolarHBondContact O-N 3.12Å; Q222-L224 PolarHBondContact O-N 3.02Å; Q222-R225 WeakPolarHBondContact O-CB 3.46Å; Q222-R225 PolarHBondContact O-N 3.19Å; Q222-D226 PolarHBondContact NE2-OD1 3.47Å; Q222-D226 PolarHBondContact NE2-OD2 3.39Å; Q222-D226 PolarHBondContact O-N 3.3Å
223L96.3Very high93Very high1 Ų144.1 Ų44.11%0.00522%0.224CC..Hα-helixtrans-57.7-45.3174.7-73.7177.1000113.1L175 L219 I220 R225 D226 N227 Q248 Q253L175-L223 HydrophobicContact CD1-CB 4.15Å; L175-L223 HydrophobicContact CD2-CB 3.52Å; L175-L223 HydrophobicContact CD2-CD1 3.42Å; L175-L223 VanDerWaalsContact CD2-CD1 3.42Å; L175-L223 HydrophobicContact CD2-CG 4.1Å; L219-L223 PolarHBondContact O-N 2.91Å; L219-L223 VanDerWaalsContact O-N 3.1Å; I220-L223 WeakPolarHBondContact O-CB 3.39Å; I220-L223 PolarHBondContact O-N 3.03Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.4Å; L223-D226 PolarHBondContact O-N 3.44Å; L223-N227 WeakPolarHBondContact O-CB 3.5Å; L223-N227 PolarHBondContact O-N 3.02Å; L223-Q248 HydrophobicContact CD2-CB 3.63Å; L223-Q248 HydrophobicContact CD2-CG 4.37Å; L223-Q253 HydrophobicContact CD1-CB 4.49Å; L223-Q253 HydrophobicContact CD1-CG 4.07Å; L223-Q253 VanDerWaalsContact CD2-CD 3.45Å; L223-Q253 HydrophobicContact CD2-CG 4.28Å
224L96.9Very high92.9Very high0 Ų044.8 Ų44.80%022%0.224CC..Hα-helixtrans-57.8-44.6176.4-78.3167.2000111.5L171 L175 A195 A198 F199 I220 M221 Q222 L228L171-L224 HydrophobicContact CD2-CD1 4.01Å; L175-L224 HydrophobicContact CB-CD2 3.93Å; L175-L224 HydrophobicContact CB-CG 4.23Å; L175-L224 HydrophobicContact CD1-CD2 3.91Å; L175-L224 HydrophobicContact CD1-CG 4.17Å; A195-L224 HydrophobicContact CB-CD2 3.77Å; A198-L224 HydrophobicContact CB-CD1 4.34Å; F199-L224 HydrophobicContact CD2-CB 4.38Å; I220-L224 HydrophobicContact CG2-CD1 4.47Å; I220-L224 WeakPolarHBondContact O-CG 3.49Å; I220-L224 PolarHBondContact O-N 3.16Å; M221-L224 PolarHBondContact O-N 2.87Å; Q222-L224 PolarHBondContact O-N 3.02Å; L224-L228 WeakPolarHBondContact O-CB 3.5Å; L224-L228 VanDerWaalsContact O-CG 3.26Å; L224-L228 WeakPolarHBondContact O-CG 3.45Å; L224-L228 PolarHBondContact O-N 2.67Å
225R95.9Very high92.5Very high115 Ų11542.4 Ų42.443%0.43422%0.218SC..Hα-helixtrans-64.8-41.7178.4-172.1-173.474-171.57.3112.4F199 M221 Q222 L223 L228 T229F199-R225 HydrophobicContact CD2-CB 4.44Å; F199-R225 HydrophobicContact CE2-CB 3.88Å; F199-R225 HydrophobicContact CZ-CB 4.18Å; F199-R225 HydrophobicContact CZ-CG 4.3Å; M221-R225 PolarHBondContact O-N 3.21Å; Q222-R225 WeakPolarHBondContact O-CB 3.46Å; Q222-R225 PolarHBondContact O-N 3.19Å; L223-R225 VanDerWaalsContact C-N 3.31Å; L223-R225 PolarHBondContact O-N 3.4Å; R225-L228 PolarHBondContact O-N 2.88Å; R225-T229 PolarHBondContact O-N 2.95Å; R225-T229 PolarHBondContact O-OG1 2.87Å
226D95.5Very high91.7Very high57 Ų5742.8 Ų42.831%0.30522%0.222SC..Hα-helixtrans-67.7-44-177.7-65-9.5000110.1Q222 L223 L228 T229 L230Q222-D226 PolarHBondContact NE2-OD1 3.47Å; Q222-D226 PolarHBondContact NE2-OD2 3.39Å; Q222-D226 PolarHBondContact O-N 3.3Å; L223-D226 PolarHBondContact O-N 3.44Å; D226-L228 PolarHBondContact O-N 3.49Å; D226-T229 WeakPolarHBondContact O-CB 3.07Å; D226-T229 PolarHBondContact O-N 3.33Å; D226-L230 PolarHBondContact O-N 3.26Å
227N94.1Very high90.6Very high4 Ų444.2 Ų44.22%0.02124%0.238CC..Hα-helixtrans-61.8-42.6172.4-79-8.1000113L175 L223 T229 L230 W231 Q248L175-N227 WeakPolarHBondContact CD1-ND2 3.44Å; L223-N227 WeakPolarHBondContact O-CB 3.5Å; L223-N227 PolarHBondContact O-N 3.02Å; N227-T229 VanDerWaalsContact C-N 3.25Å; N227-T229 PolarHBondContact O-N 3.26Å; N227-L230 PolarHBondContact O-N 3.02Å; N227-W231 HydrophobicContact CB-CD2 4.28Å; N227-W231 HydrophobicContact CB-CE3 4.23Å; N227-W231 HydrophobicContact CB-CH2 3.67Å; N227-W231 HydrophobicContact CB-CZ2 3.71Å; N227-W231 HydrophobicContact CB-CZ3 3.93Å; N227-W231 WeakPolarHBondContact O-CB 3.38Å; N227-W231 PolarHBondContact O-N 2.95Å; N227-Q248 PolarHBondContact ND2-O 3.28Å; N227-Q248 PolarHBondContact OD1-N 3.27Å
228L94.4Very high88.6Confident25 Ų2552.7 Ų52.713%0.13128%0.277CS..Hα-helixtrans-58.4-39.5175-81.5168.6000112.2C192 A195 K196 L224 R225 D226 T232C192-L228 HydrophobicContact CB-CD2 4.04Å; C192-L228 WeakPolarHBondContact O-CD2 3.26Å; A195-L228 HydrophobicContact CB-CD1 4.21Å; A195-L228 HydrophobicContact CB-CD2 3.82Å; A195-L228 HydrophobicContact CB-CG 3.82Å; K196-L228 HydrophobicContact CB-CD1 4.19Å; K196-L228 HydrophobicContact CB-CD2 4.11Å; L224-L228 WeakPolarHBondContact O-CB 3.5Å; L224-L228 VanDerWaalsContact O-CG 3.26Å; L224-L228 WeakPolarHBondContact O-CG 3.45Å; L224-L228 PolarHBondContact O-N 2.67Å; R225-L228 PolarHBondContact O-N 2.88Å; D226-L228 PolarHBondContact O-N 3.49Å; L228-T232 WeakPolarHBondContact O-CB 3.42Å; L228-T232 PolarHBondContact O-N 3.21Å; L228-T232 PolarHBondContact O-OG1 3.25Å
229T93.6Very high86.5Confident90 Ų9054 Ų5455%0.55230%0.3SS*.Hα-helixtrans-64.9-51178.4-56.70000110.1R225 D226 N227 W231 T232 S233R225-T229 PolarHBondContact O-N 2.95Å; R225-T229 PolarHBondContact O-OG1 2.87Å; D226-T229 WeakPolarHBondContact O-CB 3.07Å; D226-T229 PolarHBondContact O-N 3.33Å; N227-T229 VanDerWaalsContact C-N 3.25Å; N227-T229 PolarHBondContact O-N 3.26Å; T229-W231 PolarHBondContact O-N 2.95Å; T229-T232 PolarHBondContact O-N 2.9Å; T229-S233 PolarHBondContact O-N 2.65Å; T229-S233 PolarHBondContact O-OG 2.78Å
230L90.6Very high84Confident23 Ų2357.8 Ų57.812%0.1232%0.32CS..Hα-helixtrans-57.8-50.2178.9178.864.4000112.3D226 N227 T232 S233 D234 E245 I247D226-L230 PolarHBondContact O-N 3.26Å; N227-L230 PolarHBondContact O-N 3.02Å; L230-T232 VanDerWaalsContact C-N 3.31Å; L230-T232 PolarHBondContact O-N 3.05Å; L230-S233 WeakPolarHBondContact CA-OG 3.43Å; L230-S233 PolarHBondContact O-N 3.03Å; L230-S233 PolarHBondContact O-OG 2.92Å; L230-D234 VanDerWaalsContact O-CG 3.28Å; L230-D234 PolarHBondContact O-N 3.39Å; L230-E245 HydrophobicContact CD1-CB 3.89Å; L230-E245 HydrophobicContact CD1-CG 4.28Å; L230-E245 HydrophobicContact CD2-CB 4.22Å; L230-I247 HydrophobicContact CD2-CG1 3.85Å
231W92.5Very high81.4Confident0 Ų062.1 Ų62.10%037%0.365CS..Hα-helixtrans-69.8-30.9-177.4-57.7-25.7000112.6S178 V179 Y182 A191 A195 N227 T229 D234 M235 I247S178-W231 VanDerWaalsContact OG-CH2 3.32Å; S178-W231 WeakPolarHBondContact OG-CH2 3.42Å; V179-W231 HydrophobicContact CG2-CH2 4.16Å; V179-W231 HydrophobicContact CG2-CZ2 4.06Å; Y182-W231 AromaticContact CD1-NE1 3.72Å; Y182-W231 HydrophobicContact CD2-CB 4.02Å; Y182-W231 AromaticContact CD2-CD1 3.26Å; Y182-W231 AromaticContact CD2-CD2 3.81Å; Y182-W231 HydrophobicContact CD2-CD2 3.81Å; Y182-W231 AromaticContact CD2-CE2 3.85Å; Y182-W231 AromaticContact CD2-CG 3.42Å; Y182-W231 HydrophobicContact CD2-CG 3.42Å; Y182-W231 VanDerWaalsContact CD2-CG 3.42Å; Y182-W231 AromaticContact CD2-NE1 3.51Å; Y182-W231 AromaticContact CE1-NE1 3.98Å; Y182-W231 HydrophobicContact CE2-CB 3.9Å; Y182-W231 AromaticContact CE2-CD1 3.13Å; Y182-W231 HydrophobicContact CE2-CD2 4.39Å; Y182-W231 AromaticContact CE2-CG 3.54Å; Y182-W231 HydrophobicContact CE2-CG 3.54Å; Y182-W231 AromaticContact CE2-NE1 3.75Å; Y182-W231 AromaticContact CG-CD1 3.77Å; Y182-W231 HydrophobicContact CG-CD2 4.19Å; Y182-W231 AromaticContact CG-CE2 3.77Å; Y182-W231 HydrophobicContact CG-CG 4.16Å; Y182-W231 HydrophobicContact CG-CZ2 4.34Å; Y182-W231 AromaticContact CG-NE1 3.5Å; Y182-W231 AromaticContact CZ-CD1 3.56Å; Y182-W231 AromaticContact CZ-NE1 3.97Å; A191-W231 HydrophobicContact CB-CE3 3.99Å; A191-W231 HydrophobicContact CB-CH2 4.43Å; A191-W231 HydrophobicContact CB-CZ3 3.92Å; A195-W231 HydrophobicContact CB-CZ3 4.13Å; N227-W231 HydrophobicContact CB-CD2 4.28Å; N227-W231 HydrophobicContact CB-CE3 4.23Å; N227-W231 HydrophobicContact CB-CH2 3.67Å; N227-W231 HydrophobicContact CB-CZ2 3.71Å; N227-W231 HydrophobicContact CB-CZ3 3.93Å; N227-W231 WeakPolarHBondContact O-CB 3.38Å; N227-W231 PolarHBondContact O-N 2.95Å; T229-W231 PolarHBondContact O-N 2.95Å; W231-D234 PolarHBondContact O-N 3.24Å; W231-M235 WeakPolarHBondContact O-CE 3.31Å; W231-M235 WeakPolarHBondContact O-CG 3.42Å; W231-M235 PolarHBondContact O-N 2.99Å; W231-M235 VanDerWaalsContact O-N 3.12Å; W231-I247 HydrophobicContact CZ2-CG2 3.85Å
232T89.5Confident78.7Confident54 Ų5469.5 Ų69.533%0.33140%0.399SS..Hα-helixtrans-71.5-36.3175.7-57.30000111.4L228 T229 L230 Q236L228-T232 WeakPolarHBondContact O-CB 3.42Å; L228-T232 PolarHBondContact O-N 3.21Å; L228-T232 PolarHBondContact O-OG1 3.25Å; T229-T232 PolarHBondContact O-N 2.9Å; L230-T232 VanDerWaalsContact C-N 3.31Å; L230-T232 PolarHBondContact O-N 3.05Å; T232-Q236 VanDerWaalsContact O-CG 3.3Å; T232-Q236 WeakPolarHBondContact O-CG 3.28Å; T232-Q236 PolarHBondContact O-N 2.99Å
233S87.5Confident76.3Confident54 Ų5472.2 Ų72.238%0.37842%0.422SS..Hα-helixtrans-66-42.5171.545.90000111.9T229 L230 M235 Q236 A237T229-S233 PolarHBondContact O-N 2.65Å; T229-S233 PolarHBondContact O-OG 2.78Å; L230-S233 WeakPolarHBondContact CA-OG 3.43Å; L230-S233 PolarHBondContact O-N 3.03Å; L230-S233 PolarHBondContact O-OG 2.92Å; S233-M235 VanDerWaalsContact C-N 3.32Å; S233-M235 PolarHBondContact O-N 2.73Å; S233-Q236 CarbonylContact O-C 3.57Å; S233-Q236 PolarHBondContact O-N 3.33Å; S233-A237 VanDerWaalsContact O-CB 3.29Å; S233-A237 WeakPolarHBondContact O-CB 3.44Å; S233-A237 PolarHBondContact O-N 2.92Å
234D82.9Confident74.3Confident49 Ų4978.5 Ų78.526%0.26245%0.45SS..Hα-helixtrans-59.8-42.3178.4-69.1-13.8000112.2Y182 L230 W231 Q236 A237 E238Y182-D234 PolarHBondContact OH-OD2 3.47Å; L230-D234 VanDerWaalsContact O-CG 3.28Å; L230-D234 PolarHBondContact O-N 3.39Å; W231-D234 PolarHBondContact O-N 3.24Å; D234-Q236 PolarHBondContact O-N 3.45Å; D234-A237 PolarHBondContact O-N 3.47Å; D234-E238 PolarHBondContact O-N 3.21Å
235M79.3Confident72.4Confident67 Ų6785.2 Ų85.233%0.3348%0.481SS..Hα-helixtrans-66.9-24.8176.4-72.4-174.3-65.200113P188 C192 W231 S233P188-M235 HydrophobicContact CB-CG 4.07Å; P188-M235 HydrophobicContact CB-SD 3.88Å; P188-M235 HydrophobicContact CG-CG 4.23Å; P188-M235 HydrophobicContact CG-SD 4.18Å; C192-M235 HydrophobicContact CB-CE 4.44Å; C192-M235 WeakPolarHBondContact SG-CE 3.45Å; W231-M235 WeakPolarHBondContact O-CE 3.31Å; W231-M235 WeakPolarHBondContact O-CG 3.42Å; W231-M235 PolarHBondContact O-N 2.99Å; W231-M235 VanDerWaalsContact O-N 3.12Å; S233-M235 VanDerWaalsContact C-N 3.32Å; S233-M235 PolarHBondContact O-N 2.73Å
236Q75.8Confident70.8Confident159 Ų15986.1 Ų86.174%0.74349%0.49SS*.Hα-helixtrans-87.3-26.1175.8-69.9174.616.500112.4T232 S233 D234 E238T232-Q236 VanDerWaalsContact O-CG 3.3Å; T232-Q236 WeakPolarHBondContact O-CG 3.28Å; T232-Q236 PolarHBondContact O-N 2.99Å; S233-Q236 CarbonylContact O-C 3.57Å; S233-Q236 PolarHBondContact O-N 3.33Å; D234-Q236 PolarHBondContact O-N 3.45Å; Q236-E238 VanDerWaalsContact C-N 3.34Å
237A67Low69.5Low56 Ų5683.9 Ų83.946%0.46348%0.478SS..  trans-90.514.6-178.100000113.6S233 D234 G239 D240S233-A237 VanDerWaalsContact O-CB 3.29Å; S233-A237 WeakPolarHBondContact O-CB 3.44Å; S233-A237 PolarHBondContact O-N 2.92Å; D234-A237 PolarHBondContact O-N 3.47Å; A237-G239 PolarHBondContact O-N 3.18Å; A237-D240 PolarHBondContact O-N 3.49Å
238E51.3Low68.4Low177 Ų17787.4 Ų87.483%0.82750%0.495SS*.THydrogen-bonded Turntrans-55.982.6171.6-74.9-169.3170.200110.7D234 Q236D234-E238 PolarHBondContact O-N 3.21Å; Q236-E238 VanDerWaalsContact C-N 3.34Å
239G51Low67.3Low72 Ų7286.3 Ų86.374%0.74249%0.489SS*.THydrogen-bonded Turntrans177-40.4-170.400000113.2A237A237-G239 PolarHBondContact O-N 3.18Å
240D41.8Very low66Low138 Ų13882.8 Ų82.874%0.73847%0.467SS*.  trans-121.8121.4-177.8-76.5-37.6000111.3A237 E242A237-D240 PolarHBondContact O-N 3.49Å; D240-E242 PolarHBondContact O-N 3.29Å
241G41.3Very low64.7Low91 Ų9183 Ų8394%0.93847%0.468SS*.  trans-72.853.4-177.300000114
242E39.2Very low63.1Low164 Ų16486.8 Ų86.877%0.76649%0.488SS*.PPolyproline II helixtrans-67.2147.8173.6-72.8-166.6157.600111.4D240 K244D240-E242 PolarHBondContact O-N 3.29Å; E242-K244 PolarHBondContact O-N 3.17Å
243P45.1Very low61.6Low120 Ų12086.4 Ų86.478%0.77948%0.482SS*.PPolyproline II helixtrans-63.9126.1175.23.34.5000110E245P243-E245 PolarHBondContact O-N 3.01Å
244K54.4Low60Low133 Ų13391.3 Ų91.358%0.57850%0.504SS*.PPolyproline II helixtrans-53.2122.9174.1-65.4-174.7173.8-166.80110.1Y182 E242Y182-K244 HydrophobicContact CE1-CD 4.5Å; E242-K244 PolarHBondContact O-N 3.17Å
245E57.3Low58.7Low142 Ų14290 Ų9066%0.66450%0.498SS*.PPolyproline II helixtrans-60153.8171.6-69.5-169.6157.400110.5L230 P243 I247L230-E245 HydrophobicContact CD1-CB 3.89Å; L230-E245 HydrophobicContact CD1-CG 4.28Å; L230-E245 HydrophobicContact CD2-CB 4.22Å; P243-E245 PolarHBondContact O-N 3.01Å; E245-I247 PolarHBondContact O-N 3.4Å; E245-I247 VanDerWaalsContact O-N 3.12Å
246Q62.2Low57.3Low133 Ų13390.9 Ų90.962%0.62151%0.51SS*.  trans-69112.2-178.9-168.5173.9-4.500109.8
247I69.7Low56.4Low11 Ų1187.5 Ų87.56%0.05650%0.499CS..  trans-67.7133.4178.1-66.2166.2000109.1V179 Y182 E183 L230 W231 E245V179-I247 HydrophobicContact CB-CG2 4.41Å; V179-I247 HydrophobicContact CG1-CG2 3.96Å; V179-I247 HydrophobicContact CG2-CG2 3.7Å; Y182-I247 HydrophobicContact CD1-CD1 3.26Å; Y182-I247 HydrophobicContact CE1-CD1 3.32Å; Y182-I247 HydrophobicContact CG-CD1 4.22Å; E183-I247 HydrophobicContact CG-CD1 3.71Å; L230-I247 HydrophobicContact CD2-CG1 3.85Å; W231-I247 HydrophobicContact CZ2-CG2 3.85Å; E245-I247 PolarHBondContact O-N 3.4Å; E245-I247 VanDerWaalsContact O-N 3.12Å
248Q71Confident55.8Low78 Ų7889.1 Ų89.136%0.36450%0.501SS..  trans-88.4124.2-179.4-62.5-178.6-8.700109.7L223 N227L223-Q248 HydrophobicContact CD2-CB 3.63Å; L223-Q248 HydrophobicContact CD2-CG 4.37Å; N227-Q248 PolarHBondContact ND2-O 3.28Å; N227-Q248 PolarHBondContact OD1-N 3.27Å
249D70.7Confident56.1Low2 Ų284.2 Ų84.21%0.01148%0.483CS..  trans-109.4170.1168.567.326.6000110.7R57 R130 V179 E251 D252R57-D249 IonicContact CZ-OD2 3.67Å; R57-D249 IonicContact NH1-OD2 2.64Å; R57-D249 IonicContact NH2-OD2 3.5Å; R57-D249 PolarHBondContact NH2-OD2 3.24Å; R130-D249 IonicContact CZ-OD2 2.74Å; R130-D249 IonicContact NH1-OD2 3.49Å; R130-D249 PolarHBondContact NH1-OD2 2.85Å; R130-D249 IonicContact NH2-OD2 3.2Å; R130-D249 PolarHBondContact NH2-OD2 3.42Å; V179-D249 HydrophobicContact CG2-CB 4.35Å; D249-E251 PolarHBondContact O-N 3.02Å; D249-E251 VanDerWaalsContact O-N 3.07Å; D249-E251 WeakPolarHBondContact OD1-CA 2.86Å; D249-E251 WeakPolarHBondContact OD1-CB 3.42Å; D249-E251 PolarHBondContact OD1-N 3.26Å; D249-D252 PolarHBondContact O-N 3.3Å; D249-D252 PolarHBondContact OD1-N 3.37Å
250V66.2Low56.4Low16 Ų1684.9 Ų84.910%0.09747%0.467CS..G310 helixtrans-58.5-23.6-179.8-178.40000111.4K50 L175 N176 D252 Q253 V255K50-V250 PolarHBondContact NZ-O 3.32Å; L175-V250 HydrophobicContact CB-CG2 4.22Å; L175-V250 HydrophobicContact CD2-CG2 3.65Å; L175-V250 HydrophobicContact CG-CG2 4.26Å; N176-V250 WeakPolarHBondContact OD1-CG2 3.41Å; N176-V250 PolarHBondContact OD1-N 3.14Å; N176-V250 VanDerWaalsContact OD1-N 3.1Å; V250-D252 VanDerWaalsContact C-N 3.34Å; V250-Q253 PolarHBondContact O-N 3.47Å; V250-V255 HydrophobicContact CG1-CB 3.88Å; V250-V255 HydrophobicContact CG1-CG1 4.47Å; V250-V255 HydrophobicContact CG1-CG2 4.08Å
251E63.1Low57.3Low28 Ų2881.6 Ų81.613%0.13145%0.45CS..G310 helixtrans-76.7-22.8-176.4-63.3-174.6-179.400113.1K50 R57 Y131 D249 Q253K50-E251 WeakPolarHBondContact CE-O 3.42Å; K50-E251 HydrophobicContact CG-CB 4.34Å; K50-E251 HydrophobicContact CG-CG 4.46Å; K50-E251 PolarHBondContact NZ-O 2.87Å; R57-E251 IonicContact NH1-OE2 3.41Å; R57-E251 PolarHBondContact NH1-OE2 3.37Å; Y131-E251 VanDerWaalsContact CE2-OE1 3.24Å; Y131-E251 WeakPolarHBondContact CE2-OE1 3.36Å; Y131-E251 VanDerWaalsContact CE2-OE2 3.31Å; Y131-E251 WeakPolarHBondContact CE2-OE2 3.47Å; Y131-E251 PolarHBondContact OH-OE1 2.79Å; Y131-E251 PolarHBondContact OH-OE2 2.84Å; D249-E251 PolarHBondContact O-N 3.02Å; D249-E251 VanDerWaalsContact O-N 3.07Å; D249-E251 WeakPolarHBondContact OD1-CA 2.86Å; D249-E251 WeakPolarHBondContact OD1-CB 3.42Å; D249-E251 PolarHBondContact OD1-N 3.26Å; E251-Q253 PolarHBondContact O-N 2.97Å
252D57.9Low58.4Low78 Ų7881 Ų8142%0.41742%0.418SS..G310 helixtrans-78.3-0.2174.6-67.2-31.7000112.5D249 V250D249-D252 PolarHBondContact O-N 3.3Å; D249-D252 PolarHBondContact OD1-N 3.37Å; V250-D252 VanDerWaalsContact C-N 3.34Å
253Q59.6Low59.7Low46 Ų4675.1 Ų75.122%0.21539%0.393CS..SBendtrans-131.5150.2-177.5-60.9-155.3-900114.6K50 L223 V250 E251 V255K50-Q253 PolarHBondContact NZ-O 3.47Å; L223-Q253 HydrophobicContact CD1-CB 4.49Å; L223-Q253 HydrophobicContact CD1-CG 4.07Å; L223-Q253 VanDerWaalsContact CD2-CD 3.45Å; L223-Q253 HydrophobicContact CD2-CG 4.28Å; V250-Q253 PolarHBondContact O-N 3.47Å; E251-Q253 PolarHBondContact O-N 2.97Å; Q253-V255 VanDerWaalsContact C-N 3.26Å; Q253-V255 HydrophobicContact CB-CG2 4.1Å; Q253-V255 PolarHBondContact O-N 3.42Å
254D52.2Low60.9Low157 Ų15771.6 Ų71.684%0.8436%0.363SS*.  trans-73.771.9175.7-68.1-32.3000112.1
255V57.3Low61.4Low23 Ų2366.5 Ų66.514%0.13935%0.345CS..  trans-106.7125.1172-166.60000109.2D216 L219 I220 V250 Q253D216-V255 HydrophobicContact CB-CG1 4.16Å; L219-V255 HydrophobicContact CD2-CG2 3.96Å; L219-V255 HydrophobicContact CG-CG2 4.46Å; I220-V255 HydrophobicContact CD1-CG1 3.63Å; I220-V255 HydrophobicContact CG1-CG1 3.86Å; I220-V255 HydrophobicContact CG1-CG2 4.19Å; V250-V255 HydrophobicContact CG1-CB 3.88Å; V250-V255 HydrophobicContact CG1-CG1 4.47Å; V250-V255 HydrophobicContact CG1-CG2 4.08Å; Q253-V255 VanDerWaalsContact C-N 3.26Å; Q253-V255 HydrophobicContact CB-CG2 4.1Å; Q253-V255 PolarHBondContact O-N 3.42Å
256S49.7Very low61.8Low84 Ų8459.6 Ų59.659%0.58732%0.316SS*.  trans-80.60-179.526.10000115.8N43 D216N43-S256 PolarHBondContact ND2-OXT 2.99Å; N43-S256 PolarHBondContact OD1-OXT 2.93Å; D216-S256 PolarHBondContact OD2-OG 3.11Å

Retrieved 256 of 256 residues in 739.3 ms (Link to these results)

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