A0A087YS21_POEFO Loading...

Progestin and adipoQ receptor family member VII, b

AlphaFold DB , UniProt , Accession A0A087YS21, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 352 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
1M52.5Low53.1Low200 Ų200109.6 Ų109.699%0.98559%0.587SS**  0-49.80-126.5-170.8-55.100112.1T3 V4 V5M1-T3 VanDerWaalsContact C-N 3.35Å; M1-T3 PolarHBondContact O-N 3.28Å; M1-V4 PolarHBondContact O-N 3.34Å; M1-V5 PolarHBondContact O-N 3.04Å
2A52.4Low53.2Low81 Ų81110.2 Ų110.267%0.66959%0.589SS**Hα-helixtrans-61.8-32.9-179.500000115.2M6A2-M6 PolarHBondContact O-N 2.99Å
3T54.1Low53.4Low114 Ų114113 Ų11370%0.69959%0.593SS**Hα-helixtrans-70.1-35.5179.239.70000113.7M1 E7M1-T3 VanDerWaalsContact C-N 3.35Å; M1-T3 PolarHBondContact O-N 3.28Å; T3-E7 PolarHBondContact O-N 3.3Å
4V55.6Low53.6Low84 Ų84112.2 Ų112.251%0.50959%0.588SS.*Hα-helixtrans-70.6-36.4177.7178.70000111.2M1 E7 Q8M1-V4 PolarHBondContact O-N 3.34Å; V4-E7 PolarHBondContact O-N 3.18Å; V4-Q8 PolarHBondContact O-N 2.62Å
5V55.7Low53.8Low72 Ų72110.5 Ų110.544%0.43658%0.58SS.*Hα-helixtrans-68.4-39.9178175.70000111.2M1 E7 Q8 I9M1-V5 PolarHBondContact O-N 3.04Å; V5-E7 VanDerWaalsContact C-N 3.34Å; V5-E7 PolarHBondContact O-N 3.4Å; V5-Q8 PolarHBondContact O-N 2.87Å; V5-I9 HydrophobicContact CG1-CD1 3.72Å; V5-I9 HydrophobicContact CG1-CG1 4.41Å; V5-I9 WeakPolarHBondContact O-CB 3.39Å; V5-I9 VanDerWaalsContact O-CG1 3.22Å; V5-I9 WeakPolarHBondContact O-CG1 3.49Å; V5-I9 PolarHBondContact O-N 3.14Å
6M52.7Low54.1Low148 Ų148106.6 Ų106.673%0.72957%0.569SS**Hα-helixtrans-66.3-34.9175.3-75.3-135.7126.300113A2 G10A2-M6 PolarHBondContact O-N 2.99Å; M6-G10 PolarHBondContact O-N 2.97Å
7E52.8Low54.5Low108 Ų108107.7 Ų107.751%0.50557%0.57SS.*Hα-helixtrans-69.6-38.7176.2-154.5-172157.400112T3 V4 V5 G10 R11T3-E7 PolarHBondContact O-N 3.3Å; V4-E7 PolarHBondContact O-N 3.18Å; V5-E7 VanDerWaalsContact C-N 3.34Å; V5-E7 PolarHBondContact O-N 3.4Å; E7-G10 PolarHBondContact O-N 3.02Å; E7-R11 WeakPolarHBondContact O-CG 3.46Å; E7-R11 PolarHBondContact O-N 2.81Å; E7-R11 IonicContact OE1-CZ 2.74Å; E7-R11 IonicContact OE1-NE 3.72Å; E7-R11 IonicContact OE1-NH2 3.76Å; E7-R11 PolarHBondContact OE1-NH2 3.39Å
8Q48.2Very low54.7Low119 Ų119107.8 Ų107.856%0.55657%0.567SS**Hα-helixtrans-66.6-41.2173.9-77.4-177.2-25.700112.6V4 V5 R11 L12V4-Q8 PolarHBondContact O-N 2.62Å; V5-Q8 PolarHBondContact O-N 2.87Å; Q8-R11 PolarHBondContact O-N 2.89Å; Q8-L12 WeakPolarHBondContact O-CB 3.26Å; Q8-L12 WeakPolarHBondContact O-CG 3.34Å; Q8-L12 PolarHBondContact O-N 3.42Å
9I54.9Low55Low83 Ų83107.6 Ų107.643%0.42657%0.565SS.*Hα-helixtrans-65.6-40.3175.6-67.4167.6000110.6V5 L12 F13V5-I9 HydrophobicContact CG1-CD1 3.72Å; V5-I9 HydrophobicContact CG1-CG1 4.41Å; V5-I9 WeakPolarHBondContact O-CB 3.39Å; V5-I9 VanDerWaalsContact O-CG1 3.22Å; V5-I9 WeakPolarHBondContact O-CG1 3.49Å; V5-I9 PolarHBondContact O-N 3.14Å; I9-L12 PolarHBondContact O-N 2.86Å; I9-F13 HydrophobicContact CG2-CD2 4.17Å; I9-F13 PolarHBondContact O-N 3.49Å
10G53.7Low55.3Low31 Ų31112.6 Ų112.632%0.3258%0.576SS.*Hα-helixtrans-61.6-43.8174.700000112.9M6 E7 F13 I14M6-G10 PolarHBondContact O-N 2.97Å; E7-G10 PolarHBondContact O-N 3.02Å; G10-F13 PolarHBondContact O-N 3.27Å; G10-I14 VanDerWaalsContact O-CG1 3.27Å; G10-I14 WeakPolarHBondContact O-CG1 3.49Å; G10-I14 PolarHBondContact O-N 3.15Å
11R52Low55.5Low166 Ų166111.6 Ų111.663%0.62657%0.569SS**Hα-helixtrans-64.9-39.6174.7-71.1179.6-166.3-158.76112.5E7 Q8 I14 N15E7-R11 WeakPolarHBondContact O-CG 3.46Å; E7-R11 PolarHBondContact O-N 2.81Å; E7-R11 IonicContact OE1-CZ 2.74Å; E7-R11 IonicContact OE1-NE 3.72Å; E7-R11 IonicContact OE1-NH2 3.76Å; E7-R11 PolarHBondContact OE1-NH2 3.39Å; Q8-R11 PolarHBondContact O-N 2.89Å; R11-I14 PolarHBondContact O-N 2.91Å; R11-N15 WeakPolarHBondContact O-CB 3.18Å; R11-N15 PolarHBondContact O-N 3.19Å
12L53.7Low56Low116 Ų116105.8 Ų105.861%0.60754%0.541SS*.Hα-helixtrans-64.8-38.3175-77.3165.2000112.2Q8 I9 N15 A16Q8-L12 WeakPolarHBondContact O-CB 3.26Å; Q8-L12 WeakPolarHBondContact O-CG 3.34Å; Q8-L12 PolarHBondContact O-N 3.42Å; I9-L12 PolarHBondContact O-N 2.86Å; L12-N15 PolarHBondContact O-N 2.68Å; L12-A16 WeakPolarHBondContact O-CB 3.3Å; L12-A16 PolarHBondContact O-N 3.08Å
13F55.4Low56.2Low147 Ų147105.3 Ų105.365%0.64553%0.531SS*.Hα-helixtrans-67.9-42.1175.7-107.8-92.3000112.7I9 G10 N15 A16 Q17I9-F13 HydrophobicContact CG2-CD2 4.17Å; I9-F13 PolarHBondContact O-N 3.49Å; G10-F13 PolarHBondContact O-N 3.27Å; F13-N15 VanDerWaalsContact C-N 3.29Å; F13-N15 PolarHBondContact O-N 3.34Å; F13-A16 PolarHBondContact O-N 3.09Å; F13-Q17 WeakPolarHBondContact O-CB 3.33Å; F13-Q17 PolarHBondContact O-N 3.04Å
14I56.6Low56.5Low102 Ų102106.1 Ų106.152%0.52353%0.527SS..Hα-helixtrans-60.9-41.4174.2-67.2164.6000110.2G10 R11 Q17 Q18G10-I14 VanDerWaalsContact O-CG1 3.27Å; G10-I14 WeakPolarHBondContact O-CG1 3.49Å; G10-I14 PolarHBondContact O-N 3.15Å; R11-I14 PolarHBondContact O-N 2.91Å; I14-Q17 PolarHBondContact O-N 3.34Å; I14-Q18 WeakPolarHBondContact O-CG 3.49Å; I14-Q18 PolarHBondContact O-N 3.41Å
15N56.8Low56.7Low86 Ų86107 Ų10746%0.4653%0.529SS..Hα-helixtrans-68.1-39.5178.3-151.29.9000111.9R11 L12 F13 Q17 Q18 L19R11-N15 WeakPolarHBondContact O-CB 3.18Å; R11-N15 PolarHBondContact O-N 3.19Å; L12-N15 PolarHBondContact O-N 2.68Å; F13-N15 VanDerWaalsContact C-N 3.29Å; F13-N15 PolarHBondContact O-N 3.34Å; N15-Q17 PolarHBondContact O-N 2.77Å; N15-Q18 PolarHBondContact O-N 3.27Å; N15-L19 WeakPolarHBondContact O-CB 3.27Å; N15-L19 WeakPolarHBondContact O-CD1 3.1Å; N15-L19 PolarHBondContact O-N 2.91Å
16A58.4Low56.6Low49 Ų49107.7 Ų107.741%0.40553%0.529SS..Hα-helixtrans-67.5-33.817600000112.9L12 F13 R20L12-A16 WeakPolarHBondContact O-CB 3.3Å; L12-A16 PolarHBondContact O-N 3.08Å; F13-A16 PolarHBondContact O-N 3.09Å; A16-R20 WeakPolarHBondContact O-CB 3.41Å; A16-R20 WeakPolarHBondContact O-CG 3.49Å; A16-R20 PolarHBondContact O-N 2.88Å
17Q60.4Low56.8Low125 Ų125107.9 Ų107.958%0.58453%0.528SS*.Hα-helixtrans-72.9-38176.5-151.6171.5-4.300111.4F13 I14 N15 R20 Q21F13-Q17 WeakPolarHBondContact O-CB 3.33Å; F13-Q17 PolarHBondContact O-N 3.04Å; I14-Q17 PolarHBondContact O-N 3.34Å; N15-Q17 PolarHBondContact O-N 2.77Å; Q17-R20 PolarHBondContact O-N 2.76Å; Q17-Q21 WeakPolarHBondContact O-CG 3.2Å; Q17-Q21 PolarHBondContact O-N 2.98Å; Q17-Q21 VanDerWaalsContact O-N 3.16Å
18Q58.7Low57Low110 Ų110107.1 Ų107.151%0.51454%0.535SS..Hα-helixtrans-64.4-44.6169.6-75.8177.5-28.700111.9I14 N15 R20 Q21 I22I14-Q18 WeakPolarHBondContact O-CG 3.49Å; I14-Q18 PolarHBondContact O-N 3.41Å; N15-Q18 PolarHBondContact O-N 3.27Å; Q18-R20 VanDerWaalsContact C-N 3.29Å; Q18-R20 PolarHBondContact O-N 3.14Å; Q18-Q21 WeakPolarHBondContact O-CA 3.38Å; Q18-Q21 WeakPolarHBondContact O-CB 3.22Å; Q18-Q21 PolarHBondContact O-N 3.24Å; Q18-I22 WeakPolarHBondContact O-CG1 3.27Å; Q18-I22 PolarHBondContact O-N 3.23Å; Q18-I22 VanDerWaalsContact O-N 3.08Å
19L60Low57.3Low103 Ų103104.2 Ų104.254%0.53953%0.532SS..Hα-helixtrans-61-33.9174.5-90.4147.6000113N15 Q21 I22 P23N15-L19 WeakPolarHBondContact O-CB 3.27Å; N15-L19 WeakPolarHBondContact O-CD1 3.1Å; N15-L19 PolarHBondContact O-N 2.91Å; L19-Q21 VanDerWaalsContact C-N 3.32Å; L19-I22 HydrophobicContact CD2-CD1 3.94Å; L19-I22 HydrophobicContact CG-CD1 4.19Å; L19-I22 PolarHBondContact O-N 3.44Å; L19-P23 WeakPolarHBondContact O-CD 3.38Å
20R62.1Low57.4Low207 Ų207106.1 Ų106.178%0.78154%0.537SS*.Hα-helixtrans-71.7-23.6172.1-83.8-177.5178.5-176.70.5113.8A16 Q17 Q18 P23A16-R20 WeakPolarHBondContact O-CB 3.41Å; A16-R20 WeakPolarHBondContact O-CG 3.49Å; A16-R20 PolarHBondContact O-N 2.88Å; Q17-R20 PolarHBondContact O-N 2.76Å; Q18-R20 VanDerWaalsContact C-N 3.29Å; Q18-R20 PolarHBondContact O-N 3.14Å; R20-P23 WeakPolarHBondContact O-CD 3.23Å
21Q59.6Low58Low93 Ų93107.4 Ų107.444%0.43554%0.54SS..Hα-helixtrans-85.6-17175.1-72.3174-3.600112.5Q17 Q18 L19 Q24 L25Q17-Q21 WeakPolarHBondContact O-CG 3.2Å; Q17-Q21 PolarHBondContact O-N 2.98Å; Q17-Q21 VanDerWaalsContact O-N 3.16Å; Q18-Q21 WeakPolarHBondContact O-CA 3.38Å; Q18-Q21 WeakPolarHBondContact O-CB 3.22Å; Q18-Q21 PolarHBondContact O-N 3.24Å; L19-Q21 VanDerWaalsContact C-N 3.32Å; Q21-Q24 PolarHBondContact O-N 3.18Å; Q21-Q24 VanDerWaalsContact O-N 3.15Å; Q21-L25 HydrophobicContact CB-CD1 4.23Å; Q21-L25 WeakPolarHBondContact O-CB 3.16Å; Q21-L25 WeakPolarHBondContact O-CG 3.35Å; Q21-L25 PolarHBondContact O-N 2.99Å
22I61.5Low59.1Low78 Ų78106.1 Ų106.140%0.455%0.55SS.*Hα-helixtrans-54.8-47.1176.6-69.7174.7000112Q18 L19 Q24 L25 L26Q18-I22 WeakPolarHBondContact O-CG1 3.27Å; Q18-I22 PolarHBondContact O-N 3.23Å; Q18-I22 VanDerWaalsContact O-N 3.08Å; L19-I22 HydrophobicContact CD2-CD1 3.94Å; L19-I22 HydrophobicContact CG-CD1 4.19Å; L19-I22 PolarHBondContact O-N 3.44Å; I22-Q24 VanDerWaalsContact C-N 3.35Å; I22-Q24 PolarHBondContact O-N 2.78Å; I22-L25 PolarHBondContact O-N 3.26Å; I22-L26 HydrophobicContact CG2-CD1 3.56Å; I22-L26 HydrophobicContact CG2-CG 4.09Å; I22-L26 WeakPolarHBondContact O-CB 3.04Å; I22-L26 WeakPolarHBondContact O-CG 3.32Å; I22-L26 PolarHBondContact O-N 3.06Å
23P58.2Low60.6Low71 Ų71103 Ų10346%0.46153%0.534SS..Hα-helixtrans-58.8-41.7175.5-2533.8000113.6L19 R20 L26 E27L19-P23 WeakPolarHBondContact O-CD 3.38Å; R20-P23 WeakPolarHBondContact O-CD 3.23Å; P23-L26 PolarHBondContact O-N 2.97Å; P23-E27 WeakPolarHBondContact O-CB 3.46Å; P23-E27 WeakPolarHBondContact O-CG 3.23Å; P23-E27 PolarHBondContact O-N 2.9Å
24Q60.1Low62.3Low130 Ų13098.1 Ų98.161%0.60752%0.517SS*.Hα-helixtrans-71.1-36.7178.6-69.4178.5-23.300112.1Q21 I22 E27 S28Q21-Q24 PolarHBondContact O-N 3.18Å; Q21-Q24 VanDerWaalsContact O-N 3.15Å; I22-Q24 VanDerWaalsContact C-N 3.35Å; I22-Q24 PolarHBondContact O-N 2.78Å; Q24-E27 PolarHBondContact O-N 2.99Å; Q24-S28 WeakPolarHBondContact O-CB 2.97Å; Q24-S28 PolarHBondContact O-N 3.33Å; Q24-S28 PolarHBondContact O-OG 3Å
25L59.1Low64Low104 Ų10498.1 Ų98.155%0.54553%0.525SS..Hα-helixtrans-65.4-40.9172.2-80160.7000110.7Q21 I22 S28 A29Q21-L25 HydrophobicContact CB-CD1 4.23Å; Q21-L25 WeakPolarHBondContact O-CB 3.16Å; Q21-L25 WeakPolarHBondContact O-CG 3.35Å; Q21-L25 PolarHBondContact O-N 2.99Å; I22-L25 PolarHBondContact O-N 3.26Å; L25-S28 WeakPolarHBondContact CA-OG 3.27Å; L25-S28 PolarHBondContact O-N 3.11Å; L25-S28 PolarHBondContact O-OG 3.44Å; L25-A29 WeakPolarHBondContact O-CB 3.47Å; L25-A29 PolarHBondContact O-N 3.22Å
26L52.8Low65.9Low85 Ų8596 Ų9645%0.44552%0.516SS..Hα-helixtrans-66.1-44.3174.1-68.2167000111.1I22 P23 S28 A29 F30I22-L26 HydrophobicContact CG2-CD1 3.56Å; I22-L26 HydrophobicContact CG2-CG 4.09Å; I22-L26 WeakPolarHBondContact O-CB 3.04Å; I22-L26 WeakPolarHBondContact O-CG 3.32Å; I22-L26 PolarHBondContact O-N 3.06Å; P23-L26 PolarHBondContact O-N 2.97Å; L26-S28 VanDerWaalsContact C-N 3.31Å; L26-S28 PolarHBondContact O-N 3.11Å; L26-A29 PolarHBondContact O-N 2.96Å; L26-A29 VanDerWaalsContact O-N 3.16Å; L26-F30 HydrophobicContact CB-CD2 4.18Å; L26-F30 HydrophobicContact CB-CE2 4.23Å; L26-F30 HydrophobicContact CD2-CD2 4.45Å; L26-F30 HydrophobicContact CD2-CE2 3.72Å; L26-F30 WeakPolarHBondContact O-CB 3.25Å; L26-F30 WeakPolarHBondContact O-CD2 3.42Å; L26-F30 PolarHBondContact O-N 3.12Å
27E57.3Low67.8Low152 Ų15295 Ų9571%0.7150%0.504SS*.Hα-helixtrans-61.8-36.3173.9-80.9-179166.100112.6P23 Q24P23-E27 WeakPolarHBondContact O-CB 3.46Å; P23-E27 WeakPolarHBondContact O-CG 3.23Å; P23-E27 PolarHBondContact O-N 2.9Å; Q24-E27 PolarHBondContact O-N 2.99Å
28S56.8Low69.5Low92 Ų9295.2 Ų95.264%0.64350%0.503SS*.Hα-helixtrans-76.4-26.5174.574.70000113.4Q24 L25 L26Q24-S28 WeakPolarHBondContact O-CB 2.97Å; Q24-S28 PolarHBondContact O-N 3.33Å; Q24-S28 PolarHBondContact O-OG 3Å; L25-S28 WeakPolarHBondContact CA-OG 3.27Å; L25-S28 PolarHBondContact O-N 3.11Å; L25-S28 PolarHBondContact O-OG 3.44Å; L26-S28 VanDerWaalsContact C-N 3.31Å; L26-S28 PolarHBondContact O-N 3.11Å
29A56.1Low71.3Confident59 Ų5992.1 Ų92.149%0.48849%0.49SS..Hα-helixtrans-87.5-29.8-178.400000112.9L25 L26 P31L25-A29 WeakPolarHBondContact O-CB 3.47Å; L25-A29 PolarHBondContact O-N 3.22Å; L26-A29 PolarHBondContact O-N 2.96Å; L26-A29 VanDerWaalsContact O-N 3.16Å; A29-P31 VanDerWaalsContact O-CD 3.26Å; A29-P31 WeakPolarHBondContact O-CD 3.48Å
30F57.2Low73Confident123 Ų12390.9 Ų90.954%0.53949%0.489SS..SBendtrans-92.1103.5173.6-70.2-66.4000109.4L26 T32L26-F30 HydrophobicContact CB-CD2 4.18Å; L26-F30 HydrophobicContact CB-CE2 4.23Å; L26-F30 HydrophobicContact CD2-CD2 4.45Å; L26-F30 HydrophobicContact CD2-CE2 3.72Å; L26-F30 WeakPolarHBondContact O-CB 3.25Å; L26-F30 WeakPolarHBondContact O-CD2 3.42Å; L26-F30 PolarHBondContact O-N 3.12Å; F30-T32 PolarHBondContact O-N 3.41Å
31P64.7Low74.7Confident58 Ų5885.8 Ų85.838%0.37748%0.478SS..  trans-58.9132.5176.325.8-32.9000108.9A29 L33 L67A29-P31 VanDerWaalsContact O-CD 3.26Å; A29-P31 WeakPolarHBondContact O-CD 3.48Å; P31-L33 PolarHBondContact O-N 2.91Å; P31-L67 HydrophobicContact CG-CD1 3.37Å
32T75.1Confident76.4Confident138 Ų13881.6 Ų81.685%0.84746%0.458SS*.  trans-58.5108.2173.544.90000108.9F30F30-T32 PolarHBondContact O-N 3.41Å
33L86.4Confident77.9Confident50 Ų5080.2 Ų80.226%0.26245%0.454SS..PPolyproline II helixtrans-69.9133.1178.9-68.7171000109.6P31 Y64 L67 Q71P31-L33 PolarHBondContact O-N 2.91Å; L33-Y64 HydrophobicContact CD2-CD2 3.57Å; L33-Y64 HydrophobicContact CD2-CE2 4.01Å; L33-L67 HydrophobicContact CD1-CB 4.07Å; L33-L67 HydrophobicContact CD2-CB 3.8Å; L33-L67 HydrophobicContact CD2-CD1 4.35Å; L33-L67 HydrophobicContact CG-CB 4.42Å; L33-Q71 HydrophobicContact CD1-CB 3.93Å; L33-Q71 HydrophobicContact CD1-CG 4.45Å
34P90.5Very high79.6Confident45 Ų4586.8 Ų86.829%0.29247%0.47SS..PPolyproline II helixtrans-51.4143.7170.4-26.229.2000112.4Q57 Y64 Q71P34-Q57 VanDerWaalsContact CB-NE2 3.3Å; P34-Y64 HydrophobicContact CB-CE2 4.43Å; P34-Y64 HydrophobicContact CG-CE2 4.11Å; P34-Q71 PolarHBondContact O-NE2 3.39Å
35C92.8Very high81.1Confident103 Ų10381.4 Ų81.470%0.69645%0.446SS*.PPolyproline II helixtrans-61149.1175.1-71.30000111.4Q57C35-Q57 PolarHBondContact O-NE2 2.88Å
36T96.4Very high82.8Confident42 Ų4277.3 Ų77.326%0.25842%0.424SS..PPolyproline II helixtrans-64.1151.7170.555.10000111.2Y55 R72 H73T36-Y55 CarbonylContact C-O 3.59Å; T36-Y55 WeakPolarHBondContact CA-O 3.48Å; T36-Y55 VanDerWaalsContact CB-O 3.23Å; T36-Y55 WeakPolarHBondContact CB-O 3.48Å; T36-R72 WeakPolarHBondContact CG2-O 3.49Å; T36-H73 HydrophobicContact CG2-CB 3.79Å
37V97.3Very high84.8Confident27 Ų2777.7 Ų77.716%0.16442%0.419CS..BIsolated β-bridgetrans-110.2171.5-174.7-58.90000112.2D41 V42 G54 Y55 Q57V37-D41 HydrophobicContact CB-CB 3.87Å; V37-D41 HydrophobicContact CG2-CB 4.01Å; V37-V42 HydrophobicContact CG2-CG1 3.68Å; V37-G54 PolarHBondContact O-N 3.12Å; V37-Y55 PolarHBondContact N-O 3.38Å; V37-Y55 PolarHBondContact O-N 3.32Å; V37-Q57 HydrophobicContact CG1-CG 3.73Å
38K97.3Very high86.4Confident130 Ų13073.5 Ų73.557%0.56540%0.4SS*.  trans-85.8164.9177.5-62.5-177.3-179.9175.60110.8S40 D41 T53K38-S40 PolarHBondContact O-N 2.87Å; K38-S40 VanDerWaalsContact O-N 3.14Å; K38-D41 PolarHBondContact N-OD2 2.89Å; K38-D41 WeakPolarHBondContact O-CB 3.31Å; K38-D41 PolarHBondContact O-N 3.3Å; K38-T53 HydrophobicContact CG-CG2 4.31Å
39I96.3Very high88Confident45 Ų4578.2 Ų78.223%0.23140%0.404CS..G310 helixtrans-55.2-29.8175.1-171.4169.6000113.4D41 R47 I51 L52 Y55I39-D41 PolarHBondContact O-N 3.01Å; I39-R47 HydrophobicContact CD1-CB 4.05Å; I39-R47 HydrophobicContact CD1-CG 4.18Å; I39-R47 HydrophobicContact CG1-CB 4.12Å; I39-R47 HydrophobicContact CG1-CG 3.72Å; I39-R47 PolarHBondContact O-NE 3.5Å; I39-R47 VanDerWaalsContact O-NE 3.15Å; I39-R47 PolarHBondContact O-NH2 3.37Å; I39-I51 WeakPolarHBondContact CD1-O 3.46Å; I39-L52 HydrophobicContact CG2-CD2 4.4Å; I39-L52 PolarHBondContact N-O 3.49Å; I39-Y55 HydrophobicContact CB-CD2 4.36Å; I39-Y55 HydrophobicContact CB-CE2 3.79Å; I39-Y55 HydrophobicContact CG1-CE2 4.18Å
40S96.3Very high89.8Confident76 Ų7678.5 Ų78.553%0.53140%0.395SS..G310 helixtrans-62.9-29.1176.548.60000112.9K38K38-S40 PolarHBondContact O-N 2.87Å; K38-S40 VanDerWaalsContact O-N 3.14Å
41D96Very high91.6Very high100 Ų10072.9 Ų72.954%0.53537%0.37SS..G310 helixtrans-95.5-2.9-166.6-46.2-31.5000112V37 K38 I39V37-D41 HydrophobicContact CB-CB 3.87Å; V37-D41 HydrophobicContact CG2-CB 4.01Å; K38-D41 PolarHBondContact N-OD2 2.89Å; K38-D41 WeakPolarHBondContact O-CB 3.31Å; K38-D41 PolarHBondContact O-N 3.3Å; I39-D41 PolarHBondContact O-N 3.01Å
42V95.9Very high93.1Very high5 Ų573.9 Ų73.93%0.0337%0.372CS..SBendtrans-114.1146177.1-63.70000112.4V37 F46 R47 Y55V37-V42 HydrophobicContact CG2-CG1 3.68Å; V42-F46 HydrophobicContact CB-CB 4.48Å; V42-F46 HydrophobicContact CB-CD2 4.47Å; V42-F46 HydrophobicContact CG2-CB 4.49Å; V42-R47 HydrophobicContact CG2-CG 4.07Å; V42-R47 PolarHBondContact O-NE 3.3Å; V42-R47 PolarHBondContact O-NH2 2.8Å; V42-Y55 HydrophobicContact CG1-CG 4.28Å; V42-Y55 HydrophobicContact CG2-CD1 4.06Å; V42-Y55 HydrophobicContact CG2-CD2 4.32Å; V42-Y55 HydrophobicContact CG2-CE1 4.49Å; V42-Y55 HydrophobicContact CG2-CG 3.98Å
43P94.3Very high94.2Very high49 Ų4969.6 Ų69.632%0.31835%0.346SS..  trans-53.7151.4172.2-30.136.4000113.3V45 F46P43-V45 HydrophobicContact CB-CG1 4.3Å; P43-V45 PolarHBondContact O-N 3.15Å; P43-V45 VanDerWaalsContact O-N 3.11Å; P43-F46 HydrophobicContact CB-CD2 3.74Å; P43-F46 HydrophobicContact CB-CE2 3.79Å; P43-F46 HydrophobicContact CG-CD2 3.95Å; P43-F46 HydrophobicContact CG-CE2 3.71Å; P43-F46 PolarHBondContact O-N 3.22Å; P43-F46 VanDerWaalsContact O-N 3.11Å
44R92.5Very high94.7Very high210 Ų21067.2 Ų67.279%0.79233%0.333SS*.G310 helixtrans-57.3-30.7-174.7-70.5-176.3179.8-177.50.5113.7F46 R47R44-F46 PolarHBondContact O-N 3.11Å; R44-R47 PolarHBondContact O-N 3.18Å
45V92.5Very high95Very high17 Ų1765.4 Ų65.410%0.10332%0.321CS..G310 helixtrans-63.1-29.2-179.367.20000113.2P43 E136 Y139 Y140P43-V45 HydrophobicContact CB-CG1 4.3Å; P43-V45 PolarHBondContact O-N 3.15Å; P43-V45 VanDerWaalsContact O-N 3.11Å; V45-E136 HydrophobicContact CG1-CB 4.34Å; V45-E136 HydrophobicContact CG1-CG 3.77Å; V45-Y139 HydrophobicContact CG2-CD1 3.6Å; V45-Y139 HydrophobicContact CG2-CE1 3.63Å; V45-Y139 HydrophobicContact CG2-CG 4.22Å; V45-Y139 WeakPolarHBondContact O-CE2 3.15Å; V45-Y139 VanDerWaalsContact O-CZ 3.31Å; V45-Y139 PolarHBondContact O-OH 3.27Å; V45-Y140 HydrophobicContact CG2-CE2 3.97Å
46F94.5Very high95.3Very high17 Ų1760.8 Ų60.88%0.07529%0.289CS..G310 helixtrans-89.7-7.3-179.8-52.1-68.9000113.4V42 P43 R44 E48 Y55 T58 S132 E136 Y139V42-F46 HydrophobicContact CB-CB 4.48Å; V42-F46 HydrophobicContact CB-CD2 4.47Å; V42-F46 HydrophobicContact CG2-CB 4.49Å; P43-F46 HydrophobicContact CB-CD2 3.74Å; P43-F46 HydrophobicContact CB-CE2 3.79Å; P43-F46 HydrophobicContact CG-CD2 3.95Å; P43-F46 HydrophobicContact CG-CE2 3.71Å; P43-F46 PolarHBondContact O-N 3.22Å; P43-F46 VanDerWaalsContact O-N 3.11Å; R44-F46 PolarHBondContact O-N 3.11Å; F46-E48 PolarHBondContact O-N 3.36Å; F46-Y55 VanDerWaalsContact O-CE1 3.25Å; F46-Y55 WeakPolarHBondContact O-CE1 3.48Å; F46-T58 HydrophobicContact CD2-CG2 4.03Å; F46-T58 HydrophobicContact CE2-CG2 3.57Å; F46-T58 HydrophobicContact CZ-CG2 4.05Å; F46-S132 WeakPolarHBondContact CE1-O 3.27Å; F46-E136 HydrophobicContact CZ-CG 4.33Å; F46-Y139 AromaticContact CD1-CD2 3.75Å; F46-Y139 HydrophobicContact CD1-CD2 3.75Å; F46-Y139 HydrophobicContact CD1-CE2 4.48Å; F46-Y139 HydrophobicContact CD1-CG 4.27Å; F46-Y139 HydrophobicContact CE1-CD2 4.17Å; F46-Y139 HydrophobicContact CE1-CG 4.29Å
47R94.2Very high95.2Very high93 Ų9361.7 Ų61.735%0.35129%0.29SS..PPolyproline II helixtrans-77.9124.7-172.7-60.6-177.2-173.5-171.9-3.3110I39 V42 R44I39-R47 HydrophobicContact CD1-CB 4.05Å; I39-R47 HydrophobicContact CD1-CG 4.18Å; I39-R47 HydrophobicContact CG1-CB 4.12Å; I39-R47 HydrophobicContact CG1-CG 3.72Å; I39-R47 PolarHBondContact O-NE 3.5Å; I39-R47 VanDerWaalsContact O-NE 3.15Å; I39-R47 PolarHBondContact O-NH2 3.37Å; V42-R47 HydrophobicContact CG2-CG 4.07Å; V42-R47 PolarHBondContact O-NE 3.3Å; V42-R47 PolarHBondContact O-NH2 2.8Å; R44-R47 PolarHBondContact O-N 3.18Å
48E91.9Very high95.2Very high65 Ų6562 Ų6230%0.30429%0.292SS..PPolyproline II helixtrans-96.7148.7174.6-65.6-56.8151.400109.9F46 H50 I51 Y55F46-E48 PolarHBondContact O-N 3.36Å; E48-H50 PolarHBondContact O-N 2.82Å; E48-I51 HydrophobicContact CB-CB 4.16Å; E48-I51 HydrophobicContact CB-CG1 3.91Å; E48-Y55 PolarHBondContact N-OH 3Å
49R90Very high95.1Very high190 Ų19061.4 Ų61.472%0.71730%0.295SS*.THydrogen-bonded Turntrans-69.4136.3-177-63.5-176.9-175168.86.7109.7I51R49-I51 PolarHBondContact O-N 3.46Å; R49-I51 VanDerWaalsContact O-N 3.08Å
50H93.3Very high95Very high66 Ų6662.3 Ų62.331%0.30630%0.298SS..THydrogen-bonded Turntrans65.91.6176.6-44.4-71.7000116E48 E267 P271 G272E48-H50 PolarHBondContact O-N 2.82Å; H50-E267 HydrophobicContact CB-CB 4.2Å; H50-E267 HydrophobicContact CB-CG 4.19Å; H50-E267 VanDerWaalsContact CB-O 3.27Å; H50-E267 WeakPolarHBondContact CB-O 3.24Å; H50-P271 HydrophobicContact CB-CB 4.29Å; H50-G272 PolarHBondContact O-N 2.83Å
51I96.2Very high95Very high5 Ų562.1 Ų62.13%0.02630%0.297CS..  trans-96.8123.6174.2-53.3-55.4000109.1I39 E48 R49 Y55 N74 E267 D275 Q279I39-I51 WeakPolarHBondContact CD1-O 3.46Å; E48-I51 HydrophobicContact CB-CB 4.16Å; E48-I51 HydrophobicContact CB-CG1 3.91Å; R49-I51 PolarHBondContact O-N 3.46Å; R49-I51 VanDerWaalsContact O-N 3.08Å; I51-Y55 WeakPolarHBondContact CB-OH 3.46Å; I51-Y55 HydrophobicContact CG2-CE2 4.09Å; I51-Y55 PolarHBondContact O-OH 3.27Å; I51-N74 HydrophobicContact CG2-CB 4.02Å; I51-E267 HydrophobicContact CD1-CB 4.49Å; I51-D275 VanDerWaalsContact CA-OD1 3.3Å; I51-D275 WeakPolarHBondContact CA-OD1 3.39Å; I51-D275 HydrophobicContact CG2-CB 4.48Å; I51-Q279 HydrophobicContact CD1-CG 3.95Å
52L96.4Very high95Very high78 Ų7862.8 Ų62.841%0.40829%0.292SS..  trans-109.9-25.7-170.9-57.7-175.7000113.7I39 D275I39-L52 HydrophobicContact CG2-CD2 4.4Å; I39-L52 PolarHBondContact N-O 3.49Å; L52-D275 PolarHBondContact N-OD1 3.38Å; L52-D275 PolarHBondContact N-OD2 3.36Å
53T97.2Very high94.9Very high48 Ų4870.1 Ų70.129%0.29432%0.319SS..SBendtrans-140.5176.1-174.971.30000111.9K38 D275K38-T53 HydrophobicContact CG-CG2 4.31Å; T53-D275 WeakPolarHBondContact CA-OD2 3.24Å; T53-D275 WeakPolarHBondContact CB-OD2 3.44Å; T53-D275 PolarHBondContact N-OD2 2.79Å; T53-D275 PolarHBondContact OG1-OD2 2.96Å
54G96.8Very high95Very high0 Ų068.3 Ų68.30%031%0.306CS..  trans86.58.1176.300000114.1V37 H73 N74V37-G54 PolarHBondContact O-N 3.12Å; G54-H73 CarbonylContact O-C 3.26Å; G54-H73 WeakPolarHBondContact O-CA 3.48Å; G54-H73 VanDerWaalsContact O-CB 3.27Å; G54-H73 WeakPolarHBondContact O-CB 3.48Å; G54-N74 PolarHBondContact O-N 3.09Å; G54-N74 PolarHBondContact O-OD1 3.32Å; G54-N74 VanDerWaalsContact O-OD1 3.04Å
55Y98.1Very high95.2Very high8 Ų858.3 Ų58.33%0.03127%0.268CS..BIsolated β-bridgetrans-71142.1177.1-69.3-81.3000111.3T36 V37 I39 V42 F46 E48 I51T36-Y55 CarbonylContact C-O 3.59Å; T36-Y55 WeakPolarHBondContact CA-O 3.48Å; T36-Y55 VanDerWaalsContact CB-O 3.23Å; T36-Y55 WeakPolarHBondContact CB-O 3.48Å; V37-Y55 PolarHBondContact N-O 3.38Å; V37-Y55 PolarHBondContact O-N 3.32Å; I39-Y55 HydrophobicContact CB-CD2 4.36Å; I39-Y55 HydrophobicContact CB-CE2 3.79Å; I39-Y55 HydrophobicContact CG1-CE2 4.18Å; V42-Y55 HydrophobicContact CG1-CG 4.28Å; V42-Y55 HydrophobicContact CG2-CD1 4.06Å; V42-Y55 HydrophobicContact CG2-CD2 4.32Å; V42-Y55 HydrophobicContact CG2-CE1 4.49Å; V42-Y55 HydrophobicContact CG2-CG 3.98Å; F46-Y55 VanDerWaalsContact O-CE1 3.25Å; F46-Y55 WeakPolarHBondContact O-CE1 3.48Å; E48-Y55 PolarHBondContact N-OH 3Å; I51-Y55 WeakPolarHBondContact CB-OH 3.46Å; I51-Y55 HydrophobicContact CG2-CE2 4.09Å; I51-Y55 PolarHBondContact O-OH 3.27Å
56R97.2Very high95.3Very high6 Ų662.4 Ų62.42%0.02329%0.285CS..PPolyproline II helixtrans-80.9151172.7-70.9167.4-67.8169.77.3110.4Y64 T68 H73 H129 L130 A133R56-Y64 HydrophobicContact CB-CE1 4.36Å; R56-T68 WeakPolarHBondContact CD-OG1 3.36Å; R56-T68 HydrophobicContact CG-CG2 4.28Å; R56-T68 PolarHBondContact NH1-OG1 2.77Å; R56-T68 VanDerWaalsContact NH1-OG1 3.11Å; R56-H73 HydrophobicContact CG-CB 3.96Å; R56-H129 PolarHBondContact NH2-O 3.34Å; R56-L130 PolarHBondContact NH1-O 2.68Å; R56-A133 HydrophobicContact CB-CB 4.11Å
57Q95.9Very high95.4Very high60 Ų6063.4 Ų63.428%0.2829%0.29SS..PPolyproline II helixtrans-68.3141.5177-64.3-176.11400110.1P34 C35 V37 Q60 Y64 Y65P34-Q57 VanDerWaalsContact CB-NE2 3.3Å; C35-Q57 PolarHBondContact O-NE2 2.88Å; V37-Q57 HydrophobicContact CG1-CG 3.73Å; Q57-Q60 HydrophobicContact CB-CG 4.09Å; Q57-Y64 PolarHBondContact N-OH 3.03Å; Q57-Y65 PolarHBondContact O-OH 2.94Å
58T95.9Very high95.5Very high33 Ų3359 Ų5920%0.20227%0.274CS..SBendtrans-81.2167.4177.465.10000111.3F46 Q60F46-T58 HydrophobicContact CD2-CG2 4.03Å; F46-T58 HydrophobicContact CE2-CG2 3.57Å; F46-T58 HydrophobicContact CZ-CG2 4.05Å; T58-Q60 PolarHBondContact O-N 3.25Å
59D95.1Very high95.7Very high119 Ų11957.2 Ų57.264%0.63627%0.266SS*.SBendtrans62.110.5169.7-54.4-63.2000116.2Y65 K134D59-Y65 PolarHBondContact N-OH 2.84Å; D59-K134 WeakPolarHBondContact CA-O 3.41Å; D59-K134 PolarHBondContact N-O 3.41Å
60Q95.6Very high95.9Very high64 Ų6455.4 Ų55.430%0.29926%0.264SS..  trans-68.9168.8171.1-59.1-58.7-38.500113.4Q57 T58 Y64 Y65 K134Q57-Q60 HydrophobicContact CB-CG 4.09Å; T58-Q60 PolarHBondContact O-N 3.25Å; Q60-Y64 HydrophobicContact CB-CD1 3.28Å; Q60-Y64 HydrophobicContact CB-CD2 4.47Å; Q60-Y64 HydrophobicContact CB-CE1 3.91Å; Q60-Y64 HydrophobicContact CB-CG 3.6Å; Q60-Y64 HydrophobicContact CG-CD1 3.62Å; Q60-Y64 HydrophobicContact CG-CD2 4.42Å; Q60-Y64 HydrophobicContact CG-CE1 3.73Å; Q60-Y64 HydrophobicContact CG-CG 3.96Å; Q60-Y65 HydrophobicContact CB-CE2 3.92Å; Q60-Y65 PolarHBondContact N-OH 3.18Å; Q60-Y65 WeakPolarHBondContact O-CE2 3.3Å; Q60-K134 PolarHBondContact O-NZ 3.11Å
61S95.3Very high96Very high71 Ų7153.7 Ų53.750%0.49726%0.256SS..  trans-63.8157.3174.371.30000112.2R63 Y64 Y65S61-R63 PolarHBondContact O-N 3.43Å; S61-Y64 WeakPolarHBondContact O-CB 3.49Å; S61-Y64 PolarHBondContact O-N 3.37Å; S61-Y64 VanDerWaalsContact O-N 3.13Å; S61-Y64 PolarHBondContact OG-N 2.89Å; S61-Y65 VanDerWaalsContact O-CD2 3.22Å; S61-Y65 WeakPolarHBondContact O-CD2 3.44Å
62W95.6Very high96Very high114 Ų11461.9 Ų61.943%0.43229%0.287SS..Hα-helixtrans-59.2-37.5174.1-72108.8000112.6Y64 Y65 F66 L131 K134 F142W62-Y64 PolarHBondContact O-N 3.48Å; W62-Y65 PolarHBondContact O-N 3.41Å; W62-Y65 VanDerWaalsContact O-N 3.13Å; W62-F66 HydrophobicContact CB-CE2 4.4Å; W62-F66 WeakPolarHBondContact O-CD2 3.28Å; W62-F66 PolarHBondContact O-N 3.48Å; W62-F66 VanDerWaalsContact O-N 3.13Å; W62-L131 HydrophobicContact CE3-CD2 4.23Å; W62-L131 HydrophobicContact CZ3-CB 4.19Å; W62-L131 HydrophobicContact CZ3-CD1 4.19Å; W62-L131 HydrophobicContact CZ3-CD2 4.21Å; W62-L131 HydrophobicContact CZ3-CG 4.43Å; W62-K134 HydrophobicContact CD2-CD 3.64Å; W62-K134 HydrophobicContact CE3-CD 3.75Å; W62-K134 HydrophobicContact CG-CD 4.4Å; W62-K134 HydrophobicContact CH2-CD 3.69Å; W62-K134 HydrophobicContact CZ2-CD 3.56Å; W62-K134 HydrophobicContact CZ3-CD 3.77Å; W62-F142 AromaticContact CH2-CE2 3.75Å; W62-F142 HydrophobicContact CH2-CE2 3.75Å; W62-F142 AromaticContact CH2-CZ 3.88Å; W62-F142 HydrophobicContact CH2-CZ 3.88Å; W62-F142 AromaticContact CZ3-CE2 3.84Å; W62-F142 HydrophobicContact CZ3-CE2 3.84Å; W62-F142 AromaticContact CZ3-CZ 3.88Å; W62-F142 HydrophobicContact CZ3-CZ 3.88Å
63R95Very high96Very high160 Ų16058.2 Ų58.260%0.60427%0.267SS*.Hα-helixtrans-55.4-40.5175.4-178.2176.5176.4174.3-1.7111.6S61 F66 L67S61-R63 PolarHBondContact O-N 3.43Å; R63-F66 PolarHBondContact O-N 3.25Å; R63-L67 HydrophobicContact CG-CD1 3.87Å; R63-L67 HydrophobicContact CG-CG 4.31Å; R63-L67 WeakPolarHBondContact O-CB 3.32Å; R63-L67 VanDerWaalsContact O-CG 3.25Å; R63-L67 WeakPolarHBondContact O-CG 3.36Å; R63-L67 PolarHBondContact O-N 3.17Å
64Y95.4Very high96Very high10 Ų1056.1 Ų56.14%0.03925%0.254CS..Hα-helixtrans-56.7-52.2175.4166.4-97.1000111.4L33 P34 R56 Q57 Q60 S61 W62 F66 L67 T68L33-Y64 HydrophobicContact CD2-CD2 3.57Å; L33-Y64 HydrophobicContact CD2-CE2 4.01Å; P34-Y64 HydrophobicContact CB-CE2 4.43Å; P34-Y64 HydrophobicContact CG-CE2 4.11Å; R56-Y64 HydrophobicContact CB-CE1 4.36Å; Q57-Y64 PolarHBondContact N-OH 3.03Å; Q60-Y64 HydrophobicContact CB-CD1 3.28Å; Q60-Y64 HydrophobicContact CB-CD2 4.47Å; Q60-Y64 HydrophobicContact CB-CE1 3.91Å; Q60-Y64 HydrophobicContact CB-CG 3.6Å; Q60-Y64 HydrophobicContact CG-CD1 3.62Å; Q60-Y64 HydrophobicContact CG-CD2 4.42Å; Q60-Y64 HydrophobicContact CG-CE1 3.73Å; Q60-Y64 HydrophobicContact CG-CG 3.96Å; S61-Y64 WeakPolarHBondContact O-CB 3.49Å; S61-Y64 PolarHBondContact O-N 3.37Å; S61-Y64 VanDerWaalsContact O-N 3.13Å; S61-Y64 PolarHBondContact OG-N 2.89Å; W62-Y64 PolarHBondContact O-N 3.48Å; Y64-F66 PolarHBondContact O-N 3.2Å; Y64-L67 CarbonylContact O-C 3.59Å; Y64-L67 PolarHBondContact O-N 3.22Å; Y64-L67 VanDerWaalsContact O-N 3.13Å; Y64-T68 HydrophobicContact CD1-CG2 4.13Å; Y64-T68 HydrophobicContact CD2-CG2 4.26Å; Y64-T68 HydrophobicContact CE1-CG2 3.83Å; Y64-T68 HydrophobicContact CE2-CG2 3.91Å; Y64-T68 HydrophobicContact CG-CG2 4.36Å; Y64-T68 WeakPolarHBondContact O-CG2 3.03Å; Y64-T68 PolarHBondContact O-N 2.98Å
65Y96.8Very high96.1Very high0 Ų056.7 Ų56.70%026%0.257CS..Hα-helixtrans-63.5-40.6-177.4-62-74.8000113Q57 D59 Q60 S61 W62 L67 T68 L130 A133 K134Q57-Y65 PolarHBondContact O-OH 2.94Å; D59-Y65 PolarHBondContact N-OH 2.84Å; Q60-Y65 HydrophobicContact CB-CE2 3.92Å; Q60-Y65 PolarHBondContact N-OH 3.18Å; Q60-Y65 WeakPolarHBondContact O-CE2 3.3Å; S61-Y65 VanDerWaalsContact O-CD2 3.22Å; S61-Y65 WeakPolarHBondContact O-CD2 3.44Å; W62-Y65 PolarHBondContact O-N 3.41Å; W62-Y65 VanDerWaalsContact O-N 3.13Å; Y65-L67 VanDerWaalsContact C-N 3.33Å; Y65-L67 PolarHBondContact O-N 3.12Å; Y65-T68 PolarHBondContact O-N 3.39Å; Y65-T68 VanDerWaalsContact O-N 3.17Å; Y65-T68 PolarHBondContact O-OG1 3.4Å; Y65-L130 VanDerWaalsContact O-CD1 3.29Å; Y65-L130 WeakPolarHBondContact O-CD1 3.36Å; Y65-A133 HydrophobicContact CD1-CB 4.29Å; Y65-A133 HydrophobicContact CE1-CB 3.84Å; Y65-K134 HydrophobicContact CD2-CB 3.95Å; Y65-K134 HydrophobicContact CD2-CD 4.21Å; Y65-K134 HydrophobicContact CD2-CG 4.24Å; Y65-K134 HydrophobicContact CE1-CB 4.3Å; Y65-K134 HydrophobicContact CE2-CB 3.49Å; Y65-K134 VanDerWaalsContact CE2-CB 3.49Å; Y65-K134 HydrophobicContact CE2-CD 3.97Å; Y65-K134 HydrophobicContact CE2-CG 3.59Å; Y65-K134 VanDerWaalsContact OH-CA 3.32Å; Y65-K134 WeakPolarHBondContact OH-CA 3.34Å
66F95.9Very high96Very high104 Ų10457.4 Ų57.446%0.45626%0.262SS..Hα-helixtrans-63.1-39.7174.2-74-67.1000112.3W62 R63 Y64 T68 L69 L130 L131W62-F66 HydrophobicContact CB-CE2 4.4Å; W62-F66 WeakPolarHBondContact O-CD2 3.28Å; W62-F66 PolarHBondContact O-N 3.48Å; W62-F66 VanDerWaalsContact O-N 3.13Å; R63-F66 PolarHBondContact O-N 3.25Å; Y64-F66 PolarHBondContact O-N 3.2Å; F66-T68 VanDerWaalsContact C-N 3.29Å; F66-T68 PolarHBondContact O-N 3.05Å; F66-L69 WeakPolarHBondContact O-CB 3.47Å; F66-L69 PolarHBondContact O-N 2.97Å; F66-L130 HydrophobicContact CD1-CD2 4.11Å; F66-L131 HydrophobicContact CD1-CD2 4.44Å; F66-L131 HydrophobicContact CE1-CD1 4.35Å; F66-L131 HydrophobicContact CE1-CD2 4.16Å; F66-L131 HydrophobicContact CE2-CD2 4.43Å; F66-L131 HydrophobicContact CZ-CD1 4.14Å; F66-L131 HydrophobicContact CZ-CD2 4.15Å
67L95.4Very high96.1Very high37 Ų3759.7 Ų59.719%0.19428%0.275CS..Hα-helixtrans-69.6-26.2175.6-69.9176.2000112.7P31 L33 R63 Y64 Y65 L69 F70P31-L67 HydrophobicContact CG-CD1 3.37Å; L33-L67 HydrophobicContact CD1-CB 4.07Å; L33-L67 HydrophobicContact CD2-CB 3.8Å; L33-L67 HydrophobicContact CD2-CD1 4.35Å; L33-L67 HydrophobicContact CG-CB 4.42Å; R63-L67 HydrophobicContact CG-CD1 3.87Å; R63-L67 HydrophobicContact CG-CG 4.31Å; R63-L67 WeakPolarHBondContact O-CB 3.32Å; R63-L67 VanDerWaalsContact O-CG 3.25Å; R63-L67 WeakPolarHBondContact O-CG 3.36Å; R63-L67 PolarHBondContact O-N 3.17Å; Y64-L67 CarbonylContact O-C 3.59Å; Y64-L67 PolarHBondContact O-N 3.22Å; Y64-L67 VanDerWaalsContact O-N 3.13Å; Y65-L67 VanDerWaalsContact C-N 3.33Å; Y65-L67 PolarHBondContact O-N 3.12Å; L67-L69 PolarHBondContact O-N 2.95Å; L67-L69 VanDerWaalsContact O-N 3.09Å; L67-F70 PolarHBondContact O-N 3.36Å; L67-F70 VanDerWaalsContact O-N 3.08Å
68T96.3Very high96.2Very high0 Ų057 Ų570%026%0.262CS..G310 helixtrans-63.2-13.317470.90000113.5R56 Y64 Y65 F66 F70 Q71 H73R56-T68 WeakPolarHBondContact CD-OG1 3.36Å; R56-T68 HydrophobicContact CG-CG2 4.28Å; R56-T68 PolarHBondContact NH1-OG1 2.77Å; R56-T68 VanDerWaalsContact NH1-OG1 3.11Å; Y64-T68 HydrophobicContact CD1-CG2 4.13Å; Y64-T68 HydrophobicContact CD2-CG2 4.26Å; Y64-T68 HydrophobicContact CE1-CG2 3.83Å; Y64-T68 HydrophobicContact CE2-CG2 3.91Å; Y64-T68 HydrophobicContact CG-CG2 4.36Å; Y64-T68 WeakPolarHBondContact O-CG2 3.03Å; Y64-T68 PolarHBondContact O-N 2.98Å; Y65-T68 PolarHBondContact O-N 3.39Å; Y65-T68 VanDerWaalsContact O-N 3.17Å; Y65-T68 PolarHBondContact O-OG1 3.4Å; F66-T68 VanDerWaalsContact C-N 3.29Å; F66-T68 PolarHBondContact O-N 3.05Å; T68-F70 PolarHBondContact O-N 3.39Å; T68-F70 VanDerWaalsContact O-N 3.11Å; T68-Q71 WeakPolarHBondContact O-CB 3.4Å; T68-Q71 PolarHBondContact O-N 3.43Å; T68-H73 PolarHBondContact O-CD2 3.03Å; T68-H73 VanDerWaalsContact O-CD2 3.27Å; T68-H73 PolarHBondContact O-NE2 3.49Å; T68-H73 VanDerWaalsContact O-NE2 3.09Å
69L95.9Very high96.3Very high29 Ų2955.5 Ų55.515%0.15225%0.253CS..G310 helixtrans-51.3-33.7168.7-176.565000112.3F66 L67 V79 W80 L83 L130F66-L69 WeakPolarHBondContact O-CB 3.47Å; F66-L69 PolarHBondContact O-N 2.97Å; L67-L69 PolarHBondContact O-N 2.95Å; L67-L69 VanDerWaalsContact O-N 3.09Å; L69-V79 HydrophobicContact CD1-CG1 3.52Å; L69-W80 HydrophobicContact CD1-CZ2 4.27Å; L69-W80 HydrophobicContact CG-CZ2 4.03Å; L69-W80 PolarHBondContact O-NE1 3.09Å; L69-L83 HydrophobicContact CD1-CD2 3.9Å; L69-L83 HydrophobicContact CD2-CD2 4.19Å; L69-L130 HydrophobicContact CB-CD1 4.17Å; L69-L130 HydrophobicContact CD1-CD1 4.48Å
70F94.9Very high96.5Very high152 Ų15254.6 Ų54.667%0.66724%0.241SC*.G310 helixtrans-100.910.5179.1-53.5-72.6000113.1L67 T68 W80L67-F70 PolarHBondContact O-N 3.36Å; L67-F70 VanDerWaalsContact O-N 3.08Å; T68-F70 PolarHBondContact O-N 3.39Å; T68-F70 VanDerWaalsContact O-N 3.11Å; F70-W80 HydrophobicContact CD1-CZ2 4.14Å; F70-W80 HydrophobicContact CE1-CH2 4.26Å; F70-W80 HydrophobicContact CE1-CZ2 4.03Å
71Q94.7Very high96.6Very high30 Ų3053 Ų5314%0.1424%0.236CC..SBendtrans-105.9143.9176.8-173.1179.416.500110.3L33 P34 T68 H73 T76L33-Q71 HydrophobicContact CD1-CB 3.93Å; L33-Q71 HydrophobicContact CD1-CG 4.45Å; P34-Q71 PolarHBondContact O-NE2 3.39Å; T68-Q71 WeakPolarHBondContact O-CB 3.4Å; T68-Q71 PolarHBondContact O-N 3.43Å; Q71-H73 PolarHBondContact O-CD2 3Å; Q71-H73 PolarHBondContact O-N 3.16Å; Q71-T76 PolarHBondContact O-OG1 3.15Å
72R96.2Very high96.8Very high176 Ų17649.9 Ų49.966%0.66421%0.213SC*.  trans-75.1117.9169.9179.9178.8172.3175.51.1110.5T36 F276T36-R72 WeakPolarHBondContact CG2-O 3.49Å; R72-F276 HydrophobicContact CG-CD1 3.51Å; R72-F276 HydrophobicContact CG-CE1 3.8Å; R72-F276 HydrophobicContact CG-CG 4.3Å
73H97.1Very high96.9Very high1 Ų147 Ų471%0.00521%0.206CC..  trans-148.7172.6177.359.577000110.3T36 G54 R56 T68 Q71 E75 T76T36-H73 HydrophobicContact CG2-CB 3.79Å; G54-H73 CarbonylContact O-C 3.26Å; G54-H73 WeakPolarHBondContact O-CA 3.48Å; G54-H73 VanDerWaalsContact O-CB 3.27Å; G54-H73 WeakPolarHBondContact O-CB 3.48Å; R56-H73 HydrophobicContact CG-CB 3.96Å; T68-H73 PolarHBondContact O-CD2 3.03Å; T68-H73 VanDerWaalsContact O-CD2 3.27Å; T68-H73 PolarHBondContact O-NE2 3.49Å; T68-H73 VanDerWaalsContact O-NE2 3.09Å; Q71-H73 PolarHBondContact O-CD2 3Å; Q71-H73 PolarHBondContact O-N 3.16Å; H73-E75 VanDerWaalsContact CE1-C 3.41Å; H73-E75 WeakPolarHBondContact ND1-CA 3.43Å; H73-E75 WeakPolarHBondContact ND1-CB 3.49Å; H73-E75 PolarHBondContact ND1-N 2.8Å; H73-E75 VanDerWaalsContact ND1-N 3.18Å; H73-E75 PolarHBondContact O-N 2.79Å; H73-T76 PolarHBondContact CD2-OG1 3.36Å; H73-T76 VanDerWaalsContact CD2-OG1 3.3Å; H73-T76 VanDerWaalsContact CE1-CA 3.48Å; H73-T76 WeakPolarHBondContact CE1-CA 3.45Å; H73-T76 PolarHBondContact CE1-N 3.41Å; H73-T76 VanDerWaalsContact CG-OG1 3.24Å; H73-T76 PolarHBondContact N-OG1 3.46Å; H73-T76 PolarHBondContact ND1-N 2.87Å; H73-T76 VanDerWaalsContact ND1-N 3.11Å; H73-T76 PolarHBondContact ND1-OG1 2.82Å; H73-T76 PolarHBondContact NE2-OG1 2.84Å; H73-T76 WeakPolarHBondContact O-CB 3.36Å; H73-T76 PolarHBondContact O-N 3.38Å; H73-T76 VanDerWaalsContact O-N 3.15Å; H73-T76 PolarHBondContact O-OG1 2.82Å
74N97.2Very high97.1Very high4 Ų444 Ų442%0.02120%0.202CC..THydrogen-bonded Turntrans-63.7-29-174.670.3-43.3000113.6I51 G54 D275 Q279I51-N74 HydrophobicContact CG2-CB 4.02Å; G54-N74 PolarHBondContact O-N 3.09Å; G54-N74 PolarHBondContact O-OD1 3.32Å; G54-N74 VanDerWaalsContact O-OD1 3.04Å; N74-D275 WeakPolarHBondContact CA-O 3.47Å; N74-D275 VanDerWaalsContact CB-O 3.27Å; N74-D275 WeakPolarHBondContact CB-O 3.15Å; N74-Q279 PolarHBondContact O-NE2 3.3Å
75E98Very high97.3Very high13 Ų1343.7 Ų43.76%0.06120%0.201CC..THydrogen-bonded Turntrans-89.5-1.6176.5-59.4-60.615900115.2H73 L77 N78 V79 H129H73-E75 VanDerWaalsContact CE1-C 3.41Å; H73-E75 WeakPolarHBondContact ND1-CA 3.43Å; H73-E75 WeakPolarHBondContact ND1-CB 3.49Å; H73-E75 PolarHBondContact ND1-N 2.8Å; H73-E75 VanDerWaalsContact ND1-N 3.18Å; H73-E75 PolarHBondContact O-N 2.79Å; E75-L77 PolarHBondContact O-N 3.26Å; E75-N78 WeakPolarHBondContact O-CB 3.45Å; E75-N78 PolarHBondContact O-N 3.16Å; E75-N78 VanDerWaalsContact O-N 3.1Å; E75-N78 PolarHBondContact OE2-ND2 2.86Å; E75-V79 WeakPolarHBondContact O-CG2 3.38Å; E75-V79 PolarHBondContact O-N 3.11Å; E75-H129 HydrophobicContact CB-CB 4.48Å; E75-H129 IonicContact OE2-CE1 2.81Å; E75-H129 IonicContact OE2-CG 3.12Å; E75-H129 IonicContact OE2-ND1 2.65Å; E75-H129 PolarHBondContact OE2-ND1 3.3Å
76T97.5Very high97.4Very high22 Ų2243.9 Ų43.914%0.13520%0.202CC..Hα-helixtrans-57.8-48.6-167.2-61.30000111.7Q71 H73 V79 W80Q71-T76 PolarHBondContact O-OG1 3.15Å; H73-T76 PolarHBondContact CD2-OG1 3.36Å; H73-T76 VanDerWaalsContact CD2-OG1 3.3Å; H73-T76 VanDerWaalsContact CE1-CA 3.48Å; H73-T76 WeakPolarHBondContact CE1-CA 3.45Å; H73-T76 PolarHBondContact CE1-N 3.41Å; H73-T76 VanDerWaalsContact CG-OG1 3.24Å; H73-T76 PolarHBondContact N-OG1 3.46Å; H73-T76 PolarHBondContact ND1-N 2.87Å; H73-T76 VanDerWaalsContact ND1-N 3.11Å; H73-T76 PolarHBondContact ND1-OG1 2.82Å; H73-T76 PolarHBondContact NE2-OG1 2.84Å; H73-T76 WeakPolarHBondContact O-CB 3.36Å; H73-T76 PolarHBondContact O-N 3.38Å; H73-T76 VanDerWaalsContact O-N 3.15Å; H73-T76 PolarHBondContact O-OG1 2.82Å; T76-V79 PolarHBondContact O-N 3.08Å; T76-W80 VanDerWaalsContact O-CD1 3.27Å; T76-W80 PolarHBondContact O-N 3.26Å
77L97.9Very high97.5Very high55 Ų5543.4 Ų43.429%0.28820%0.204SC..Hα-helixtrans-70.6-32.8-179.6-63.9174.1000112.1E75 V79 W80 T81 F276 F277 Q282E75-L77 PolarHBondContact O-N 3.26Å; L77-V79 VanDerWaalsContact C-N 3.27Å; L77-V79 PolarHBondContact O-N 3.25Å; L77-W80 PolarHBondContact O-N 2.82Å; L77-T81 WeakPolarHBondContact O-CB 3.45Å; L77-T81 VanDerWaalsContact O-CG2 3.22Å; L77-T81 WeakPolarHBondContact O-CG2 3.44Å; L77-T81 PolarHBondContact O-N 3.09Å; L77-T81 PolarHBondContact O-OG1 2.9Å; L77-F276 WeakPolarHBondContact CD1-O 3.4Å; L77-F277 HydrophobicContact CD1-CB 4.15Å; L77-F277 HydrophobicContact CD1-CD2 3.46Å; L77-F277 VanDerWaalsContact CD1-CD2 3.46Å; L77-F277 HydrophobicContact CD1-CE2 4.2Å; L77-F277 HydrophobicContact CD1-CG 4.16Å; L77-Q282 HydrophobicContact CB-CG 3.95Å
78N98.3Very high97.6Very high2 Ų244.5 Ų44.51%0.01121%0.209CC..Hα-helixtrans-61-39.1175.2-62.3-27.9000111.2E75 T81 H129 Q282 H285E75-N78 WeakPolarHBondContact O-CB 3.45Å; E75-N78 PolarHBondContact O-N 3.16Å; E75-N78 VanDerWaalsContact O-N 3.1Å; E75-N78 PolarHBondContact OE2-ND2 2.86Å; N78-T81 PolarHBondContact O-OG1 3.45Å; N78-H129 HydrophobicContact CB-CB 4.06Å; N78-Q282 WeakPolarHBondContact OD1-CG 3.1Å; N78-H285 PolarHBondContact O-CE1 2.92Å; N78-H285 PolarHBondContact O-ND1 3Å; N78-H285 VanDerWaalsContact O-ND1 3.08Å
79V98.6Very high97.8Very high2 Ų244.6 Ų44.61%0.01221%0.21CC..Hα-helixtrans-68.8-52.4174.6-179.60000111.2L69 E75 T76 L77 T81 L83 H129 L130L69-V79 HydrophobicContact CD1-CG1 3.52Å; E75-V79 WeakPolarHBondContact O-CG2 3.38Å; E75-V79 PolarHBondContact O-N 3.11Å; T76-V79 PolarHBondContact O-N 3.08Å; L77-V79 VanDerWaalsContact C-N 3.27Å; L77-V79 PolarHBondContact O-N 3.25Å; V79-T81 PolarHBondContact O-N 3.27Å; V79-L83 WeakPolarHBondContact O-CB 3.35Å; V79-L83 PolarHBondContact O-N 3.41Å; V79-H129 HydrophobicContact CG2-CB 3.59Å; V79-L130 HydrophobicContact CG1-CB 4.17Å; V79-L130 HydrophobicContact CG1-CD1 4.38Å; V79-L130 HydrophobicContact CG2-CB 3.96Å; V79-L130 HydrophobicContact CG2-CD1 4.42Å
80W98.6Very high97.9Very high100 Ų10047.2 Ų47.238%0.37922%0.223SC..Hα-helixtrans-67.6-37-171.9-85.799.8000113.8L69 F70 T76 L77 L84L69-W80 HydrophobicContact CD1-CZ2 4.27Å; L69-W80 HydrophobicContact CG-CZ2 4.03Å; L69-W80 PolarHBondContact O-NE1 3.09Å; F70-W80 HydrophobicContact CD1-CZ2 4.14Å; F70-W80 HydrophobicContact CE1-CH2 4.26Å; F70-W80 HydrophobicContact CE1-CZ2 4.03Å; T76-W80 VanDerWaalsContact O-CD1 3.27Å; T76-W80 PolarHBondContact O-N 3.26Å; L77-W80 PolarHBondContact O-N 2.82Å; W80-L84 VanDerWaalsContact O-CB 3.25Å; W80-L84 WeakPolarHBondContact O-CB 3.07Å; W80-L84 PolarHBondContact O-N 3.3Å
81T98.6Very high98Very high32 Ų3244.3 Ų44.320%0.19622%0.218CC..Hα-helixtrans-60.9-47.517950.40000111.3L77 N78 V79 A85 H285 V286L77-T81 WeakPolarHBondContact O-CB 3.45Å; L77-T81 VanDerWaalsContact O-CG2 3.22Å; L77-T81 WeakPolarHBondContact O-CG2 3.44Å; L77-T81 PolarHBondContact O-N 3.09Å; L77-T81 PolarHBondContact O-OG1 2.9Å; N78-T81 PolarHBondContact O-OG1 3.45Å; V79-T81 PolarHBondContact O-N 3.27Å; T81-A85 WeakPolarHBondContact O-CB 3.32Å; T81-A85 PolarHBondContact O-N 3.1Å; T81-A85 VanDerWaalsContact O-N 3.17Å; T81-H285 WeakPolarHBondContact OG1-CB 3.36Å; T81-H285 PolarHBondContact OG1-ND1 3.17Å; T81-V286 HydrophobicContact CG2-CG2 3.7Å
82H98.7Very high98.2Very high4 Ų445.1 Ų45.12%0.01922%0.221CC..Hα-helixtrans-78.3-34.3179.1-76.4-174.8000113.5A85 A86 L122 S125 A126 H285H82-A85 PolarHBondContact O-N 3.36Å; H82-A86 WeakPolarHBondContact O-CB 3.15Å; H82-A86 PolarHBondContact O-N 3.13Å; H82-L122 HydrophobicContact CB-CD2 4.09Å; H82-S125 PolarHBondContact CE1-OG 3.05Å; H82-S125 WeakPolarHBondContact ND1-CB 3.4Å; H82-S125 PolarHBondContact ND1-OG 2.93Å; H82-A126 HydrophobicContact CB-CB 4.21Å; H82-H285 AromaticContact CD2-CG 3.78Å; H82-H285 AromaticContact CD2-ND1 3.67Å; H82-H285 AromaticContact CE1-CD2 3.43Å; H82-H285 PolarHBondContact CE1-CD2 2.87Å; H82-H285 VanDerWaalsContact CE1-CD2 3.43Å; H82-H285 AromaticContact CE1-CE1 3.4Å; H82-H285 PolarHBondContact CE1-CE1 3.38Å; H82-H285 AromaticContact CE1-CG 3.47Å; H82-H285 VanDerWaalsContact CE1-CG 3.47Å; H82-H285 AromaticContact CE1-ND1 3.45Å; H82-H285 PolarHBondContact CE1-ND1 3.49Å; H82-H285 AromaticContact CE1-NE2 3.4Å; H82-H285 PolarHBondContact CE1-NE2 3.35Å; H82-H285 AromaticContact CG-CE1 4Å; H82-H285 AromaticContact CG-ND1 3.67Å; H82-H285 AromaticContact ND1-CE1 3.41Å; H82-H285 PolarHBondContact ND1-CE1 3.48Å; H82-H285 AromaticContact ND1-ND1 3.52Å; H82-H285 AromaticContact ND1-NE2 3.84Å; H82-H285 WeakPolarHBondContact NE2-CB 3.36Å; H82-H285 AromaticContact NE2-CD2 3.61Å; H82-H285 AromaticContact NE2-CE1 3.97Å; H82-H285 AromaticContact NE2-CG 3.29Å; H82-H285 VanDerWaalsContact NE2-CG 3.29Å; H82-H285 AromaticContact NE2-ND1 3.55Å
83L98.7Very high98.2Very high53 Ų5338.2 Ų38.228%0.27720%0.199SC..Hα-helixtrans-62-47.7174.4178.261.8000111.3L69 V79 A85 A86 L87 A126L69-L83 HydrophobicContact CD1-CD2 3.9Å; L69-L83 HydrophobicContact CD2-CD2 4.19Å; V79-L83 WeakPolarHBondContact O-CB 3.35Å; V79-L83 PolarHBondContact O-N 3.41Å; L83-A85 VanDerWaalsContact C-N 3.33Å; L83-A85 PolarHBondContact O-N 2.86Å; L83-A86 PolarHBondContact O-N 3.35Å; L83-L87 WeakPolarHBondContact O-CG 3.43Å; L83-L87 PolarHBondContact O-N 3.39Å; L83-L87 VanDerWaalsContact O-N 3.17Å; L83-A126 HydrophobicContact CB-CB 4.26Å
84L98.6Very high98.2Very high99 Ų9944 Ų4452%0.51823%0.227SC..Hα-helixtrans-62.8-43.2177.5179.560.5000111W80 A86 L87 I88W80-L84 VanDerWaalsContact O-CB 3.25Å; W80-L84 WeakPolarHBondContact O-CB 3.07Å; W80-L84 PolarHBondContact O-N 3.3Å; L84-A86 VanDerWaalsContact C-N 3.34Å; L84-A86 PolarHBondContact O-N 2.97Å; L84-L87 WeakPolarHBondContact O-CB 3.42Å; L84-L87 PolarHBondContact O-N 3.49Å; L84-I88 HydrophobicContact CG-CD1 4.13Å; L84-I88 WeakPolarHBondContact O-CG1 3.19Å; L84-I88 PolarHBondContact O-N 3.04Å
85A98.8Very high98.2Very high3 Ų347.3 Ų47.33%0.02524%0.242CC..Hα-helixtrans-60.5-42.117600000112.3T81 H82 L83 L87 I88 I89 L122 V289T81-A85 WeakPolarHBondContact O-CB 3.32Å; T81-A85 PolarHBondContact O-N 3.1Å; T81-A85 VanDerWaalsContact O-N 3.17Å; H82-A85 PolarHBondContact O-N 3.36Å; L83-A85 VanDerWaalsContact C-N 3.33Å; L83-A85 PolarHBondContact O-N 2.86Å; A85-L87 VanDerWaalsContact C-N 3.28Å; A85-L87 PolarHBondContact O-N 3.02Å; A85-I88 WeakPolarHBondContact O-CB 3.41Å; A85-I88 PolarHBondContact O-N 2.7Å; A85-I88 VanDerWaalsContact O-N 3.08Å; A85-I89 WeakPolarHBondContact O-CG1 3.45Å; A85-I89 PolarHBondContact O-N 3.11Å; A85-L122 HydrophobicContact CB-CD1 3.78Å; A85-L122 HydrophobicContact CB-CD2 3.81Å; A85-L122 HydrophobicContact CB-CG 4.37Å; A85-V289 HydrophobicContact CB-CB 4.18Å; A85-V289 HydrophobicContact CB-CG1 3.55Å; A85-V289 HydrophobicContact CB-CG2 3.46Å; A85-V289 VanDerWaalsContact CB-CG2 3.46Å
86A98.8Very high98.1Very high3 Ų346.8 Ų46.83%0.02524%0.239CC..Hα-helixtrans-59-40.6176.300000111.6H82 L83 L84 I89 L90 F119 L122H82-A86 WeakPolarHBondContact O-CB 3.15Å; H82-A86 PolarHBondContact O-N 3.13Å; L83-A86 PolarHBondContact O-N 3.35Å; L84-A86 VanDerWaalsContact C-N 3.34Å; L84-A86 PolarHBondContact O-N 2.97Å; A86-I89 PolarHBondContact O-N 2.67Å; A86-L90 PolarHBondContact O-N 3.13Å; A86-F119 HydrophobicContact CB-CD2 4.11Å; A86-F119 HydrophobicContact CB-CE2 4.2Å; A86-L122 HydrophobicContact CB-CB 3.83Å
87L98.7Very high98.1Very high94 Ų9448.6 Ų48.649%0.49225%0.253SS..Hα-helixtrans-65.3-40.5174.1-63175.1000112L83 L84 A85 I89 L90 V91L83-L87 WeakPolarHBondContact O-CG 3.43Å; L83-L87 PolarHBondContact O-N 3.39Å; L83-L87 VanDerWaalsContact O-N 3.17Å; L84-L87 WeakPolarHBondContact O-CB 3.42Å; L84-L87 PolarHBondContact O-N 3.49Å; A85-L87 VanDerWaalsContact C-N 3.28Å; A85-L87 PolarHBondContact O-N 3.02Å; L87-I89 VanDerWaalsContact C-N 3.32Å; L87-I89 PolarHBondContact O-N 3.33Å; L87-L90 HydrophobicContact CD2-CD1 4.42Å; L87-L90 WeakPolarHBondContact O-CB 3.12Å; L87-L90 PolarHBondContact O-N 2.91Å; L87-V91 WeakPolarHBondContact O-CG2 3.45Å; L87-V91 PolarHBondContact O-N 3.29Å
88I98.7Very high98Very high60 Ų6053 Ų5331%0.30827%0.273SS..Hα-helixtrans-61.1-42174.4-67.2166.3000110.6L84 A85 L90 V91 K92 L293L84-I88 HydrophobicContact CG-CD1 4.13Å; L84-I88 WeakPolarHBondContact O-CG1 3.19Å; L84-I88 PolarHBondContact O-N 3.04Å; A85-I88 WeakPolarHBondContact O-CB 3.41Å; A85-I88 PolarHBondContact O-N 2.7Å; A85-I88 VanDerWaalsContact O-N 3.08Å; I88-L90 VanDerWaalsContact C-N 3.33Å; I88-L90 PolarHBondContact O-N 2.89Å; I88-V91 PolarHBondContact O-N 3.02Å; I88-K92 HydrophobicContact CG2-CG 4.39Å; I88-K92 WeakPolarHBondContact O-CB 3.46Å; I88-K92 WeakPolarHBondContact O-CG 3.03Å; I88-K92 PolarHBondContact O-N 3.07Å; I88-L293 HydrophobicContact CG2-CD2 3.73Å
89I98.6Very high97.8Very high3 Ų358.6 Ų58.62%0.01531%0.306CS..Hα-helixtrans-62.9-38.7176.1-64.2-52.4000111.6A85 A86 L87 K92 C93 L115 A118 F119 L122 T292 L293 I296A85-I89 WeakPolarHBondContact O-CG1 3.45Å; A85-I89 PolarHBondContact O-N 3.11Å; A86-I89 PolarHBondContact O-N 2.67Å; L87-I89 VanDerWaalsContact C-N 3.32Å; L87-I89 PolarHBondContact O-N 3.33Å; I89-K92 PolarHBondContact O-N 3.4Å; I89-C93 VanDerWaalsContact O-CB 3.29Å; I89-C93 WeakPolarHBondContact O-CB 3.39Å; I89-C93 PolarHBondContact O-N 3.41Å; I89-L115 HydrophobicContact CG2-CD2 4.44Å; I89-L115 WeakPolarHBondContact CG2-O 3.38Å; I89-A118 HydrophobicContact CD1-CB 4.34Å; I89-A118 HydrophobicContact CG1-CB 4.23Å; I89-A118 HydrophobicContact CG2-CB 4.14Å; I89-F119 HydrophobicContact CG2-CB 3.95Å; I89-L122 HydrophobicContact CG1-CD1 3.66Å; I89-T292 HydrophobicContact CD1-CG2 4.37Å; I89-L293 HydrophobicContact CD1-CD2 3.94Å; I89-I296 HydrophobicContact CD1-CD1 3.42Å; I89-I296 VanDerWaalsContact CD1-CD1 3.42Å
90L98.3Very high97.6Very high83 Ų8359 Ų5944%0.43531%0.309SS..Hα-helixtrans-62.6-45.2174.1-71.4176.2000111.9A86 L87 I88 K92 C93 Q94 F119A86-L90 PolarHBondContact O-N 3.13Å; L87-L90 HydrophobicContact CD2-CD1 4.42Å; L87-L90 WeakPolarHBondContact O-CB 3.12Å; L87-L90 PolarHBondContact O-N 2.91Å; I88-L90 VanDerWaalsContact C-N 3.33Å; I88-L90 PolarHBondContact O-N 2.89Å; L90-K92 VanDerWaalsContact C-N 3.34Å; L90-K92 PolarHBondContact O-N 2.93Å; L90-C93 PolarHBondContact O-N 3.45Å; L90-Q94 PolarHBondContact O-N 3.35Å; L90-F119 HydrophobicContact CD1-CD2 4.24Å; L90-F119 HydrophobicContact CD1-CE2 3.64Å; L90-F119 HydrophobicContact CD1-CZ 4.34Å; L90-F119 HydrophobicContact CD2-CD2 3.76Å; L90-F119 HydrophobicContact CD2-CE2 3.78Å; L90-F119 HydrophobicContact CD2-CG 4.28Å; L90-F119 HydrophobicContact CD2-CZ 4.3Å; L90-F119 HydrophobicContact CG-CD2 3.71Å; L90-F119 HydrophobicContact CG-CE2 3.64Å
91V98.4Very high97.4Very high92 Ų9257.7 Ų57.756%0.55831%0.31SS*.Hα-helixtrans-61.7-43.7175.9174.10000110.7L87 I88 Q94 E95L87-V91 WeakPolarHBondContact O-CG2 3.45Å; L87-V91 PolarHBondContact O-N 3.29Å; I88-V91 PolarHBondContact O-N 3.02Å; V91-Q94 WeakPolarHBondContact O-CB 3.22Å; V91-Q94 PolarHBondContact O-N 3.33Å; V91-E95 WeakPolarHBondContact O-CB 3.42Å; V91-E95 PolarHBondContact O-N 3.38Å
92K97.4Very high97.2Very high46 Ų4657.2 Ų57.220%0.231%0.305CS..Hα-helixtrans-63.1-41.5175.8-79.8-77.2166.8-1590112.4I88 I89 L90 Q94 E95 I96 E297I88-K92 HydrophobicContact CG2-CG 4.39Å; I88-K92 WeakPolarHBondContact O-CB 3.46Å; I88-K92 WeakPolarHBondContact O-CG 3.03Å; I88-K92 PolarHBondContact O-N 3.07Å; I89-K92 PolarHBondContact O-N 3.4Å; L90-K92 VanDerWaalsContact C-N 3.34Å; L90-K92 PolarHBondContact O-N 2.93Å; K92-Q94 VanDerWaalsContact C-N 3.32Å; K92-Q94 PolarHBondContact O-N 3.46Å; K92-E95 WeakPolarHBondContact CE-OE2 3.43Å; K92-E95 IonicContact NZ-OE1 2.84Å; K92-E95 PolarHBondContact NZ-OE1 2.67Å; K92-E95 IonicContact NZ-OE2 3.55Å; K92-E95 PolarHBondContact NZ-OE2 3.4Å; K92-E95 PolarHBondContact O-N 3.38Å; K92-I96 WeakPolarHBondContact O-CB 3.29Å; K92-I96 WeakPolarHBondContact O-CD1 3.35Å; K92-I96 WeakPolarHBondContact O-CG1 3.22Å; K92-I96 PolarHBondContact O-N 2.77Å; K92-E297 IonicContact NZ-OE2 3.5Å
93C97.6Very high96.8Very high31 Ų3164.6 Ų64.621%0.20934%0.344CS..Hα-helixtrans-61-44.1175.9-174.70000110.9I89 L90 I96 S97 L115I89-C93 VanDerWaalsContact O-CB 3.29Å; I89-C93 WeakPolarHBondContact O-CB 3.39Å; I89-C93 PolarHBondContact O-N 3.41Å; L90-C93 PolarHBondContact O-N 3.45Å; C93-I96 PolarHBondContact O-N 3.34Å; C93-S97 WeakPolarHBondContact O-CB 3.47Å; C93-S97 PolarHBondContact O-N 3.08Å; C93-S97 PolarHBondContact O-OG 3.45Å; C93-L115 HydrophobicContact CB-CD1 4.4Å
94Q97.1Very high96.4Very high124 Ų12472.3 Ų72.358%0.57937%0.369SS*.Hα-helixtrans-60.7-51.1174-176.6-178.3-16.700111.5L90 V91 K92 I96 S97 E98L90-Q94 PolarHBondContact O-N 3.35Å; V91-Q94 WeakPolarHBondContact O-CB 3.22Å; V91-Q94 PolarHBondContact O-N 3.33Å; K92-Q94 VanDerWaalsContact C-N 3.32Å; K92-Q94 PolarHBondContact O-N 3.46Å; Q94-I96 VanDerWaalsContact C-N 3.31Å; Q94-I96 PolarHBondContact O-N 3.05Å; Q94-S97 PolarHBondContact O-N 3.43Å; Q94-S97 VanDerWaalsContact O-N 3.12Å; Q94-S97 PolarHBondContact O-OG 3.26Å; Q94-E98 PolarHBondContact O-N 3.03Å
95E96.6Very high96.1Very high73 Ų7368.7 Ų68.734%0.34135%0.35SS..Hα-helixtrans-54.2-46.3177.5-175.4-166.1149.600111.5V91 K92 S97 E98 R300V91-E95 WeakPolarHBondContact O-CB 3.42Å; V91-E95 PolarHBondContact O-N 3.38Å; K92-E95 WeakPolarHBondContact CE-OE2 3.43Å; K92-E95 IonicContact NZ-OE1 2.84Å; K92-E95 PolarHBondContact NZ-OE1 2.67Å; K92-E95 IonicContact NZ-OE2 3.55Å; K92-E95 PolarHBondContact NZ-OE2 3.4Å; K92-E95 PolarHBondContact O-N 3.38Å; E95-S97 PolarHBondContact O-N 3.32Å; E95-E98 WeakPolarHBondContact O-CB 3.36Å; E95-E98 PolarHBondContact O-N 2.89Å; E95-R300 IonicContact OE1-CZ 2.68Å; E95-R300 IonicContact OE1-NH1 3.81Å; E95-R300 PolarHBondContact OE1-NH1 2.84Å; E95-R300 IonicContact OE1-NH2 3.62Å
96I96.3Very high95.7Very high1 Ų170.9 Ų70.91%0.00536%0.364CS..Hα-helixtrans-67.4-38.5-179.9-64.4166.9000110.9K92 C93 Q94 E98 T99 V100 F102 L111 L115 I296 R300K92-I96 WeakPolarHBondContact O-CB 3.29Å; K92-I96 WeakPolarHBondContact O-CD1 3.35Å; K92-I96 WeakPolarHBondContact O-CG1 3.22Å; K92-I96 PolarHBondContact O-N 2.77Å; C93-I96 PolarHBondContact O-N 3.34Å; Q94-I96 VanDerWaalsContact C-N 3.31Å; Q94-I96 PolarHBondContact O-N 3.05Å; I96-E98 PolarHBondContact O-N 3.3Å; I96-E98 VanDerWaalsContact O-N 3.15Å; I96-T99 PolarHBondContact O-N 2.87Å; I96-T99 PolarHBondContact O-OG1 3.24Å; I96-T99 VanDerWaalsContact O-OG1 3.09Å; I96-V100 HydrophobicContact CG2-CB 4.01Å; I96-V100 HydrophobicContact CG2-CG2 3.77Å; I96-V100 PolarHBondContact O-N 2.76Å; I96-F102 HydrophobicContact CB-CZ 4.25Å; I96-F102 HydrophobicContact CG2-CE1 4.33Å; I96-F102 HydrophobicContact CG2-CE2 4.2Å; I96-F102 HydrophobicContact CG2-CZ 3.52Å; I96-L111 HydrophobicContact CG2-CD2 4.03Å; I96-L115 HydrophobicContact CD1-CD1 3.98Å; I96-L115 HydrophobicContact CD1-CD2 4.19Å; I96-I296 HydrophobicContact CD1-CG2 4.32Å; I96-R300 HydrophobicContact CD1-CG 4.44Å; I96-R300 HydrophobicContact CG1-CG 4.37Å
97S96.7Very high95.4Very high61 Ų6172 Ų7243%0.42737%0.369SS..Hα-helixtrans-64.2-17.1179.974.90000114.3C93 Q94 E95 T99C93-S97 WeakPolarHBondContact O-CB 3.47Å; C93-S97 PolarHBondContact O-N 3.08Å; C93-S97 PolarHBondContact O-OG 3.45Å; Q94-S97 PolarHBondContact O-N 3.43Å; Q94-S97 VanDerWaalsContact O-N 3.12Å; Q94-S97 PolarHBondContact O-OG 3.26Å; E95-S97 PolarHBondContact O-N 3.32Å; S97-T99 PolarHBondContact O-N 3.21Å
98E95.6Very high95.2Very high148 Ų14867.5 Ų67.569%0.69235%0.345SS*.THydrogen-bonded Turntrans-70.4-23.7173.1-64.3178.717800112.4Q94 E95 I96Q94-E98 PolarHBondContact O-N 3.03Å; E95-E98 WeakPolarHBondContact O-CB 3.36Å; E95-E98 PolarHBondContact O-N 2.89Å; I96-E98 PolarHBondContact O-N 3.3Å; I96-E98 VanDerWaalsContact O-N 3.15Å
99T93.8Very high95Very high118 Ų11866.8 Ų66.872%0.72434%0.341SS*.THydrogen-bonded Turntrans-116.7-19.1-176.259.80000113.7I96 S97I96-T99 PolarHBondContact O-N 2.87Å; I96-T99 PolarHBondContact O-OG1 3.24Å; I96-T99 VanDerWaalsContact O-OG1 3.09Å; S97-T99 PolarHBondContact O-N 3.21Å
100V94.9Very high94.8Very high10 Ų1066.7 Ų66.76%0.06134%0.34CS..  trans-122.6123.6-174.5-177.10000110.5I96 F102 A108 F303I96-V100 HydrophobicContact CG2-CB 4.01Å; I96-V100 HydrophobicContact CG2-CG2 3.77Å; I96-V100 PolarHBondContact O-N 2.76Å; V100-F102 HydrophobicContact CB-CE1 4.41Å; V100-F102 HydrophobicContact CG1-CD1 3.98Å; V100-F102 HydrophobicContact CG1-CE1 3.85Å; V100-F102 HydrophobicContact CG1-CZ 4.43Å; V100-F102 PolarHBondContact O-N 3.02Å; V100-A108 HydrophobicContact CG1-CB 3.45Å; V100-A108 VanDerWaalsContact CG1-CB 3.45Å; V100-F303 HydrophobicContact CB-CE1 4.4Å; V100-F303 HydrophobicContact CG1-CE1 3.74Å; V100-F303 HydrophobicContact CG1-CZ 3.95Å; V100-F303 HydrophobicContact CG2-CD1 4.31Å; V100-F303 HydrophobicContact CG2-CE1 3.72Å
101D94.7Very high94.8Very high74 Ų7462.8 Ų62.840%0.39632%0.32SS..  trans-85.588.6176.2-171.3-21.8000111.1L103 R104 D105D101-L103 PolarHBondContact O-N 3.03Å; D101-L103 VanDerWaalsContact O-N 3.14Å; D101-L103 PolarHBondContact OD1-N 3.4Å; D101-R104 PolarHBondContact OD1-N 3.29Å; D101-R104 WeakPolarHBondContact OD2-CB 3.47Å; D101-R104 VanDerWaalsContact OD2-CD 3.3Å; D101-R104 WeakPolarHBondContact OD2-CD 2.99Å; D101-R104 WeakPolarHBondContact OD2-CG 3.48Å; D101-D105 WeakPolarHBondContact O-CB 3.4Å; D101-D105 PolarHBondContact O-N 3.46Å
102F94.3Very high94.7Very high22 Ų2262 Ų6210%0.09631%0.309CS..THydrogen-bonded Turntrans-63.8-13.8177.4-64.5-54.8000114.9I96 V100 A108 Q109 L111 F112 L115I96-F102 HydrophobicContact CB-CZ 4.25Å; I96-F102 HydrophobicContact CG2-CE1 4.33Å; I96-F102 HydrophobicContact CG2-CE2 4.2Å; I96-F102 HydrophobicContact CG2-CZ 3.52Å; V100-F102 HydrophobicContact CB-CE1 4.41Å; V100-F102 HydrophobicContact CG1-CD1 3.98Å; V100-F102 HydrophobicContact CG1-CE1 3.85Å; V100-F102 HydrophobicContact CG1-CZ 4.43Å; V100-F102 PolarHBondContact O-N 3.02Å; F102-A108 HydrophobicContact CD1-CB 3.86Å; F102-A108 HydrophobicContact CE1-CB 4.39Å; F102-Q109 PolarHBondContact O-NE2 3.34Å; F102-L111 HydrophobicContact CE1-CB 4.22Å; F102-L111 HydrophobicContact CE1-CD2 4.21Å; F102-L111 HydrophobicContact CE1-CG 4.16Å; F102-F112 HydrophobicContact CB-CB 4.35Å; F102-F112 HydrophobicContact CB-CD2 4.33Å; F102-F112 HydrophobicContact CB-CG 4.46Å; F102-F112 HydrophobicContact CD1-CB 3.62Å; F102-F112 HydrophobicContact CD1-CD2 4.44Å; F102-F112 HydrophobicContact CD1-CG 4.44Å; F102-F112 HydrophobicContact CD2-CD2 4.09Å; F102-F112 HydrophobicContact CE1-CB 4Å; F102-F112 HydrophobicContact CE2-CD2 4.47Å; F102-F112 HydrophobicContact CG-CB 4.02Å; F102-F112 HydrophobicContact CG-CD2 4.06Å; F102-F112 HydrophobicContact CG-CG 4.36Å; F102-L115 HydrophobicContact CE2-CD1 4.42Å; F102-L115 HydrophobicContact CZ-CD1 3.76Å
103L89.9Confident94.7Very high159 Ų15960.1 Ų60.183%0.83230%0.301SS*.THydrogen-bonded Turntrans-93.3-39-177.1-65.2178.2000111.7D101D101-L103 PolarHBondContact O-N 3.03Å; D101-L103 VanDerWaalsContact O-N 3.14Å; D101-L103 PolarHBondContact OD1-N 3.4Å
104R91.1Very high94.7Very high214 Ų21458.7 Ų58.781%0.80829%0.291SS*.THydrogen-bonded Turntrans-103.9-18.5-173.2-57.5-176.7176.9168.1-1.5113.9D101 P106D101-R104 PolarHBondContact OD1-N 3.29Å; D101-R104 WeakPolarHBondContact OD2-CB 3.47Å; D101-R104 VanDerWaalsContact OD2-CD 3.3Å; D101-R104 WeakPolarHBondContact OD2-CD 2.99Å; D101-R104 WeakPolarHBondContact OD2-CG 3.48Å; R104-P106 VanDerWaalsContact O-CD 3.32Å; R104-P106 WeakPolarHBondContact O-CD 3.32Å
105D91.8Very high94.8Very high23 Ų2352.9 Ų52.912%0.12326%0.264CS..  trans-97105.9178.6-172-2.7000110.7D101 H107 A108 R307D101-D105 WeakPolarHBondContact O-CB 3.4Å; D101-D105 PolarHBondContact O-N 3.46Å; D105-H107 PolarHBondContact O-N 3.03Å; D105-H107 WeakPolarHBondContact OD1-CB 3.48Å; D105-H107 PolarHBondContact OD1-N 3.42Å; D105-A108 HydrophobicContact CB-CB 3.92Å; D105-A108 WeakPolarHBondContact O-CB 3.39Å; D105-A108 PolarHBondContact O-N 2.94Å; D105-A108 VanDerWaalsContact O-N 3.07Å; D105-R307 VanDerWaalsContact CG-NH2 3.26Å; D105-R307 IonicContact OD1-NH2 3.69Å; D105-R307 PolarHBondContact OD1-NH2 3.22Å; D105-R307 IonicContact OD2-CZ 3.97Å; D105-R307 IonicContact OD2-NH1 3.73Å; D105-R307 PolarHBondContact OD2-NH1 3.5Å; D105-R307 IonicContact OD2-NH2 2.82Å; D105-R307 PolarHBondContact OD2-NH2 3.02Å
106P90.7Very high94.9Very high49 Ų4952.6 Ų52.632%0.31827%0.265SS..G310 helixtrans-60-32.2176.9-22.635.2000112.3R104 A108 Q109 A318R104-P106 VanDerWaalsContact O-CD 3.32Å; R104-P106 WeakPolarHBondContact O-CD 3.32Å; P106-A108 PolarHBondContact O-N 3.42Å; P106-Q109 WeakPolarHBondContact O-CB 3.38Å; P106-Q109 WeakPolarHBondContact O-CG 3.35Å; P106-Q109 PolarHBondContact O-N 2.69Å; P106-Q109 VanDerWaalsContact O-N 3.15Å; P106-A318 HydrophobicContact CB-CB 3.93Å; P106-A318 WeakPolarHBondContact O-CB 3.34Å
107H91.8Very high95Very high26 Ų2652.6 Ų52.612%0.1226%0.264CS..G310 helixtrans-71.5-14.1179.1-72.6-73.6000113.1D105 Y164 F303 G315D105-H107 PolarHBondContact O-N 3.03Å; D105-H107 WeakPolarHBondContact OD1-CB 3.48Å; D105-H107 PolarHBondContact OD1-N 3.42Å; H107-Y164 PolarHBondContact O-OH 3.25Å; H107-F303 HydrophobicContact CB-CE2 4.34Å; H107-F303 WeakPolarHBondContact O-CE2 3.42Å; H107-G315 PolarHBondContact CE1-O 3.43Å
108A94.6Very high95.1Very high0 Ų049.7 Ų49.70%024%0.244CC..G310 helixtrans-87.7-12.1173.700000113.2V100 F102 D105 P106 L111 F112 F303V100-A108 HydrophobicContact CG1-CB 3.45Å; V100-A108 VanDerWaalsContact CG1-CB 3.45Å; F102-A108 HydrophobicContact CD1-CB 3.86Å; F102-A108 HydrophobicContact CE1-CB 4.39Å; D105-A108 HydrophobicContact CB-CB 3.92Å; D105-A108 WeakPolarHBondContact O-CB 3.39Å; D105-A108 PolarHBondContact O-N 2.94Å; D105-A108 VanDerWaalsContact O-N 3.07Å; P106-A108 PolarHBondContact O-N 3.42Å; A108-L111 WeakPolarHBondContact O-CB 3.47Å; A108-L111 PolarHBondContact O-N 3.12Å; A108-F112 PolarHBondContact O-N 3.3Å; A108-F303 HydrophobicContact CB-CE2 4.29Å; A108-F303 HydrophobicContact CB-CZ 3.98Å
109Q94.3Very high95.3Very high46 Ų4645.8 Ų45.822%0.21523%0.225CC..Hα-helixtrans-59.9-43.8-177.7-62.2-66.6-22.400113.4F102 P106 L111 F112 I113 V322F102-Q109 PolarHBondContact O-NE2 3.34Å; P106-Q109 WeakPolarHBondContact O-CB 3.38Å; P106-Q109 WeakPolarHBondContact O-CG 3.35Å; P106-Q109 PolarHBondContact O-N 2.69Å; P106-Q109 VanDerWaalsContact O-N 3.15Å; Q109-L111 VanDerWaalsContact C-N 3.29Å; Q109-L111 PolarHBondContact O-N 2.87Å; Q109-F112 PolarHBondContact O-N 2.89Å; Q109-I113 WeakPolarHBondContact O-CB 3.26Å; Q109-I113 WeakPolarHBondContact O-CG1 3.29Å; Q109-I113 PolarHBondContact O-N 3.28Å; Q109-V322 HydrophobicContact CB-CG2 4.03Å; Q109-V322 HydrophobicContact CG-CG2 4.43Å
110P95.9Very high95.5Very high1 Ų141.7 Ų41.71%0.00620%0.2CC..Hα-helixtrans-59.5-37.8175.1-24.334.6000113.2I113 V114 L159 Y163 Y164P110-I113 PolarHBondContact O-N 3.36Å; P110-V114 PolarHBondContact O-N 3.4Å; P110-L159 HydrophobicContact CB-CD2 4.26Å; P110-L159 HydrophobicContact CB-CG 4.09Å; P110-Y163 HydrophobicContact CB-CD1 4.41Å; P110-Y163 HydrophobicContact CB-CD2 4.26Å; P110-Y163 HydrophobicContact CB-CG 4.02Å; P110-Y163 HydrophobicContact CG-CD1 3.62Å; P110-Y163 HydrophobicContact CG-CD2 3.93Å; P110-Y163 HydrophobicContact CG-CE1 3.79Å; P110-Y163 HydrophobicContact CG-CE2 4.11Å; P110-Y163 HydrophobicContact CG-CG 3.66Å; P110-Y164 HydrophobicContact CB-CE2 3.86Å; P110-Y164 WeakPolarHBondContact CB-OH 3.35Å; P110-Y164 WeakPolarHBondContact CD-OH 3.49Å
111L96.9Very high95.7Very high0 Ų041.6 Ų41.60%020%0.199CC..Hα-helixtrans-66.2-41.5175.9-174.361.3000111.5I96 F102 A108 Q109 V114 L115 Y164 L299 F303I96-L111 HydrophobicContact CG2-CD2 4.03Å; F102-L111 HydrophobicContact CE1-CB 4.22Å; F102-L111 HydrophobicContact CE1-CD2 4.21Å; F102-L111 HydrophobicContact CE1-CG 4.16Å; A108-L111 WeakPolarHBondContact O-CB 3.47Å; A108-L111 PolarHBondContact O-N 3.12Å; Q109-L111 VanDerWaalsContact C-N 3.29Å; Q109-L111 PolarHBondContact O-N 2.87Å; L111-V114 HydrophobicContact CD1-CG1 4.22Å; L111-V114 VanDerWaalsContact O-CG1 3.23Å; L111-V114 WeakPolarHBondContact O-CG1 3.49Å; L111-L115 HydrophobicContact CG-CD1 4.46Å; L111-L115 WeakPolarHBondContact O-CG 3.47Å; L111-L115 PolarHBondContact O-N 3.19Å; L111-L115 VanDerWaalsContact O-N 3.17Å; L111-Y164 HydrophobicContact CB-CE2 3.83Å; L111-Y164 PolarHBondContact N-OH 2.84Å; L111-Y164 VanDerWaalsContact N-OH 3.13Å; L111-L299 HydrophobicContact CD1-CB 4.44Å; L111-F303 HydrophobicContact CD2-CB 4.48Å; L111-F303 HydrophobicContact CD2-CD1 4.05Å; L111-F303 HydrophobicContact CD2-CG 4.23Å
112F97.1Very high95.9Very high76 Ų7638.1 Ų38.133%0.33318%0.18SC..Hα-helixtrans-62.6-43.9172.8-179.8-107.8000112F102 A108 Q109 V114 L115 L116F102-F112 HydrophobicContact CB-CB 4.35Å; F102-F112 HydrophobicContact CB-CD2 4.33Å; F102-F112 HydrophobicContact CB-CG 4.46Å; F102-F112 HydrophobicContact CD1-CB 3.62Å; F102-F112 HydrophobicContact CD1-CD2 4.44Å; F102-F112 HydrophobicContact CD1-CG 4.44Å; F102-F112 HydrophobicContact CD2-CD2 4.09Å; F102-F112 HydrophobicContact CE1-CB 4Å; F102-F112 HydrophobicContact CE2-CD2 4.47Å; F102-F112 HydrophobicContact CG-CB 4.02Å; F102-F112 HydrophobicContact CG-CD2 4.06Å; F102-F112 HydrophobicContact CG-CG 4.36Å; A108-F112 PolarHBondContact O-N 3.3Å; Q109-F112 PolarHBondContact O-N 2.89Å; F112-V114 PolarHBondContact O-N 3.07Å; F112-L115 PolarHBondContact O-N 3.34Å; F112-L116 HydrophobicContact CE1-CD2 4.23Å; F112-L116 WeakPolarHBondContact O-CB 3.49Å; F112-L116 PolarHBondContact O-N 3.19Å
113I97.4Very high96.1Very high7 Ų738.4 Ų38.44%0.03618%0.184CC..Hα-helixtrans-59-46.9178.9-75.9167.9000110.9Q109 P110 L115 L116 A117 L159 V322 F325Q109-I113 WeakPolarHBondContact O-CB 3.26Å; Q109-I113 WeakPolarHBondContact O-CG1 3.29Å; Q109-I113 PolarHBondContact O-N 3.28Å; P110-I113 PolarHBondContact O-N 3.36Å; I113-L115 VanDerWaalsContact C-N 3.34Å; I113-L115 PolarHBondContact O-N 3.17Å; I113-L116 PolarHBondContact O-N 3.49Å; I113-A117 WeakPolarHBondContact O-CB 3.38Å; I113-A117 PolarHBondContact O-N 3.4Å; I113-L159 HydrophobicContact CB-CD2 4.29Å; I113-L159 HydrophobicContact CD1-CD2 3.73Å; I113-L159 HydrophobicContact CG2-CD2 3.96Å; I113-V322 HydrophobicContact CD1-CG2 3.87Å; I113-F325 HydrophobicContact CD1-CB 4.2Å; I113-F325 HydrophobicContact CD1-CG 4.31Å; I113-F325 HydrophobicContact CG1-CD1 4.47Å; I113-F325 HydrophobicContact CG1-CG 4.4Å; I113-F325 HydrophobicContact CG2-CD1 4.43Å; I113-F325 HydrophobicContact CG2-CD2 3.32Å; I113-F325 HydrophobicContact CG2-CE2 3.47Å; I113-F325 VanDerWaalsContact CG2-CE2 3.47Å; I113-F325 HydrophobicContact CG2-CG 3.86Å; I113-F325 HydrophobicContact CG2-CZ 4.1Å
114V98.3Very high96.5Very high0 Ų033.6 Ų33.60%016%0.157CC..Hα-helixtrans-67-35.5179.869.90000111.9P110 L111 F112 A117 A118 Y153 A160 L299P110-V114 PolarHBondContact O-N 3.4Å; L111-V114 HydrophobicContact CD1-CG1 4.22Å; L111-V114 VanDerWaalsContact O-CG1 3.23Å; L111-V114 WeakPolarHBondContact O-CG1 3.49Å; F112-V114 PolarHBondContact O-N 3.07Å; V114-A117 PolarHBondContact O-N 2.97Å; V114-A118 WeakPolarHBondContact O-CB 3.44Å; V114-A118 PolarHBondContact O-N 3.02Å; V114-Y153 HydrophobicContact CG2-CE2 4.17Å; V114-A160 HydrophobicContact CB-CB 3.96Å; V114-A160 HydrophobicContact CG1-CB 4Å; V114-A160 HydrophobicContact CG2-CB 4.23Å; V114-L299 HydrophobicContact CG1-CD1 4.32Å; V114-L299 HydrophobicContact CG2-CD1 4.5Å
115L98.6Very high96.9Very high2 Ų223.5 Ų23.51%0.0112%0.119CC..Hα-helixtrans-64.7-45.8173.2-72.3166.6000112.1I89 C93 I96 F102 L111 F112 I113 A118 F119 I296I89-L115 HydrophobicContact CG2-CD2 4.44Å; I89-L115 WeakPolarHBondContact CG2-O 3.38Å; C93-L115 HydrophobicContact CB-CD1 4.4Å; I96-L115 HydrophobicContact CD1-CD1 3.98Å; I96-L115 HydrophobicContact CD1-CD2 4.19Å; F102-L115 HydrophobicContact CE2-CD1 4.42Å; F102-L115 HydrophobicContact CZ-CD1 3.76Å; L111-L115 HydrophobicContact CG-CD1 4.46Å; L111-L115 WeakPolarHBondContact O-CG 3.47Å; L111-L115 PolarHBondContact O-N 3.19Å; L111-L115 VanDerWaalsContact O-N 3.17Å; F112-L115 PolarHBondContact O-N 3.34Å; I113-L115 VanDerWaalsContact C-N 3.34Å; I113-L115 PolarHBondContact O-N 3.17Å; L115-A118 PolarHBondContact O-N 3.4Å; L115-F119 WeakPolarHBondContact O-CB 3.23Å; L115-F119 PolarHBondContact O-N 3.21Å; L115-I296 HydrophobicContact CD2-CD1 4.1Å; L115-I296 HydrophobicContact CD2-CG1 4.49Å; L115-I296 HydrophobicContact CD2-CG2 3.92Å
116L98.4Very high97.2Very high68 Ų6822.8 Ų22.836%0.35612%0.116SC..Hα-helixtrans-62.9-44176.8176.562.2000111.2F112 I113 F119 T120F112-L116 HydrophobicContact CE1-CD2 4.23Å; F112-L116 WeakPolarHBondContact O-CB 3.49Å; F112-L116 PolarHBondContact O-N 3.19Å; I113-L116 PolarHBondContact O-N 3.49Å; L116-F119 PolarHBondContact O-N 2.95Å; L116-T120 VanDerWaalsContact O-CB 3.31Å; L116-T120 WeakPolarHBondContact O-CB 3.41Å; L116-T120 PolarHBondContact O-N 3.35Å; L116-T120 PolarHBondContact O-OG1 3.43Å
117A98.6Very high97.6Very high0 Ų023.3 Ų23.30%012%0.116CC..Hα-helixtrans-66.2-39.4177.900000111.2I113 V114 T120 Y121 V152 Y153 F325I113-A117 WeakPolarHBondContact O-CB 3.38Å; I113-A117 PolarHBondContact O-N 3.4Å; V114-A117 PolarHBondContact O-N 2.97Å; A117-T120 PolarHBondContact O-N 3.43Å; A117-Y121 WeakPolarHBondContact O-CD1 3.13Å; A117-Y121 PolarHBondContact O-N 3.17Å; A117-V152 HydrophobicContact CB-CG1 4.07Å; A117-Y153 HydrophobicContact CB-CD2 4.23Å; A117-F325 HydrophobicContact CB-CE2 4.3Å
118A98.8Very high97.9Very high0 Ų022.1 Ų22.10%011%0.111CC..Hα-helixtrans-59-51.7174.100000111.3I89 V114 L115 T120 Y121 L122 Y153 T292 I296I89-A118 HydrophobicContact CD1-CB 4.34Å; I89-A118 HydrophobicContact CG1-CB 4.23Å; I89-A118 HydrophobicContact CG2-CB 4.14Å; V114-A118 WeakPolarHBondContact O-CB 3.44Å; V114-A118 PolarHBondContact O-N 3.02Å; L115-A118 PolarHBondContact O-N 3.4Å; A118-T120 VanDerWaalsContact C-N 3.3Å; A118-T120 PolarHBondContact O-N 3.36Å; A118-Y121 VanDerWaalsContact CA-CD1 3.48Å; A118-Y121 HydrophobicContact CB-CE1 4.2Å; A118-Y121 WeakPolarHBondContact O-CD1 3.27Å; A118-Y121 WeakPolarHBondContact O-CE1 3.46Å; A118-L122 WeakPolarHBondContact O-CB 3.45Å; A118-L122 WeakPolarHBondContact O-CD1 3.32Å; A118-L122 VanDerWaalsContact O-CG 3.25Å; A118-L122 WeakPolarHBondContact O-CG 3.5Å; A118-L122 PolarHBondContact O-N 3.03Å; A118-Y153 HydrophobicContact CB-CD2 4.1Å; A118-Y153 HydrophobicContact CB-CE2 3.83Å; A118-T292 HydrophobicContact CB-CG2 4.04Å; A118-I296 HydrophobicContact CB-CD1 4.13Å
119F98.8Very high98.1Very high67 Ų6722.2 Ų22.229%0.29411%0.111SC..Hα-helixtrans-58.6-42.7175.8173.8-103.4000112.1A86 I89 L90 L115 L116 S123A86-F119 HydrophobicContact CB-CD2 4.11Å; A86-F119 HydrophobicContact CB-CE2 4.2Å; I89-F119 HydrophobicContact CG2-CB 3.95Å; L90-F119 HydrophobicContact CD1-CD2 4.24Å; L90-F119 HydrophobicContact CD1-CE2 3.64Å; L90-F119 HydrophobicContact CD1-CZ 4.34Å; L90-F119 HydrophobicContact CD2-CD2 3.76Å; L90-F119 HydrophobicContact CD2-CE2 3.78Å; L90-F119 HydrophobicContact CD2-CG 4.28Å; L90-F119 HydrophobicContact CD2-CZ 4.3Å; L90-F119 HydrophobicContact CG-CD2 3.71Å; L90-F119 HydrophobicContact CG-CE2 3.64Å; L115-F119 WeakPolarHBondContact O-CB 3.23Å; L115-F119 PolarHBondContact O-N 3.21Å; L116-F119 PolarHBondContact O-N 2.95Å; F119-S123 WeakPolarHBondContact CE2-OG 3.25Å; F119-S123 WeakPolarHBondContact CZ-OG 3.38Å; F119-S123 VanDerWaalsContact O-CB 3.26Å; F119-S123 WeakPolarHBondContact O-CB 3.34Å; F119-S123 PolarHBondContact O-N 2.96Å; F119-S123 PolarHBondContact O-OG 3.19Å
120T98.6Very high98.3Very high31 Ų3120.6 Ų20.619%0.1910%0.104CC..Hα-helixtrans-65.3-48.9-177.1-60.80000111.9L116 A117 A118 L122 S123 F124L116-T120 VanDerWaalsContact O-CB 3.31Å; L116-T120 WeakPolarHBondContact O-CB 3.41Å; L116-T120 PolarHBondContact O-N 3.35Å; L116-T120 PolarHBondContact O-OG1 3.43Å; A117-T120 PolarHBondContact O-N 3.43Å; A118-T120 VanDerWaalsContact C-N 3.3Å; A118-T120 PolarHBondContact O-N 3.36Å; T120-L122 PolarHBondContact O-N 3.47Å; T120-S123 PolarHBondContact O-N 3.31Å; T120-F124 HydrophobicContact CG2-CD2 3.81Å; T120-F124 HydrophobicContact CG2-CE1 4.35Å; T120-F124 HydrophobicContact CG2-CE2 3.56Å; T120-F124 HydrophobicContact CG2-CG 4.34Å; T120-F124 HydrophobicContact CG2-CZ 3.86Å; T120-F124 WeakPolarHBondContact O-CB 3.22Å; T120-F124 WeakPolarHBondContact O-CG 3.35Å; T120-F124 PolarHBondContact O-N 2.87Å
121Y98.6Very high98.4Very high9 Ų920.8 Ų20.84%0.03511%0.105CC..Hα-helixtrans-65.4-41.1-179.391.4-98.6000111.9A117 A118 S123 F124 S125 G149 Y153 T292A117-Y121 WeakPolarHBondContact O-CD1 3.13Å; A117-Y121 PolarHBondContact O-N 3.17Å; A118-Y121 VanDerWaalsContact CA-CD1 3.48Å; A118-Y121 HydrophobicContact CB-CE1 4.2Å; A118-Y121 WeakPolarHBondContact O-CD1 3.27Å; A118-Y121 WeakPolarHBondContact O-CE1 3.46Å; Y121-S123 PolarHBondContact O-N 2.88Å; Y121-F124 PolarHBondContact O-N 3.48Å; Y121-S125 WeakPolarHBondContact O-CB 3.45Å; Y121-S125 PolarHBondContact O-N 3.12Å; Y121-G149 WeakPolarHBondContact CB-O 3.46Å; Y121-Y153 AromaticContact CD1-CD1 3.88Å; Y121-Y153 HydrophobicContact CD1-CD1 3.88Å; Y121-Y153 AromaticContact CD1-CD2 3.57Å; Y121-Y153 HydrophobicContact CD1-CD2 3.57Å; Y121-Y153 HydrophobicContact CD1-CE2 4.23Å; Y121-Y153 AromaticContact CD1-CG 3.36Å; Y121-Y153 HydrophobicContact CD1-CG 3.36Å; Y121-Y153 AromaticContact CE1-CD1 3.88Å; Y121-Y153 HydrophobicContact CE1-CD1 3.88Å; Y121-Y153 AromaticContact CE1-CD2 3.71Å; Y121-Y153 HydrophobicContact CE1-CD2 3.71Å; Y121-Y153 HydrophobicContact CE1-CE1 4.06Å; Y121-Y153 AromaticContact CE1-CE2 3.88Å; Y121-Y153 HydrophobicContact CE1-CE2 3.88Å; Y121-Y153 AromaticContact CE1-CG 3.71Å; Y121-Y153 HydrophobicContact CE1-CG 3.71Å; Y121-Y153 HydrophobicContact CG-CG 4.18Å; Y121-T292 HydrophobicContact CE1-CG2 4.23Å; Y121-T292 PolarHBondContact OH-OG1 3.35Å
122L98.9Very high98.4Very high1 Ų121 Ų211%0.00511%0.107CC..Hα-helixtrans-62.7-44.3178.2-69.7168.2000111.1H82 A85 A86 I89 A118 T120 A126 V289H82-L122 HydrophobicContact CB-CD2 4.09Å; A85-L122 HydrophobicContact CB-CD1 3.78Å; A85-L122 HydrophobicContact CB-CD2 3.81Å; A85-L122 HydrophobicContact CB-CG 4.37Å; A86-L122 HydrophobicContact CB-CB 3.83Å; I89-L122 HydrophobicContact CG1-CD1 3.66Å; A118-L122 WeakPolarHBondContact O-CB 3.45Å; A118-L122 WeakPolarHBondContact O-CD1 3.32Å; A118-L122 VanDerWaalsContact O-CG 3.25Å; A118-L122 WeakPolarHBondContact O-CG 3.5Å; A118-L122 PolarHBondContact O-N 3.03Å; T120-L122 PolarHBondContact O-N 3.47Å; L122-A126 WeakPolarHBondContact O-CB 3.22Å; L122-A126 PolarHBondContact O-N 3.22Å; L122-V289 HydrophobicContact CD2-CG2 3.85Å
123S98.8Very high98.4Very high27 Ų2718 Ų1819%0.18910%0.095CC..Hα-helixtrans-65.3-46.2178.2-61.80000112F119 T120 Y121 A126 L127F119-S123 WeakPolarHBondContact CE2-OG 3.25Å; F119-S123 WeakPolarHBondContact CZ-OG 3.38Å; F119-S123 VanDerWaalsContact O-CB 3.26Å; F119-S123 WeakPolarHBondContact O-CB 3.34Å; F119-S123 PolarHBondContact O-N 2.96Å; F119-S123 PolarHBondContact O-OG 3.19Å; T120-S123 PolarHBondContact O-N 3.31Å; Y121-S123 PolarHBondContact O-N 2.88Å; S123-A126 PolarHBondContact O-N 3.25Å; S123-L127 WeakPolarHBondContact O-CB 3.43Å; S123-L127 VanDerWaalsContact O-CG 3.28Å; S123-L127 WeakPolarHBondContact O-CG 3.49Å; S123-L127 PolarHBondContact O-N 2.92Å
124F98.8Very high98.4Very high59 Ų5919.4 Ų19.426%0.25910%0.101SC..Hα-helixtrans-65.4-39.3179.1-73.8-3.1000112.1T120 Y121 L127 A128 L145T120-F124 HydrophobicContact CG2-CD2 3.81Å; T120-F124 HydrophobicContact CG2-CE1 4.35Å; T120-F124 HydrophobicContact CG2-CE2 3.56Å; T120-F124 HydrophobicContact CG2-CG 4.34Å; T120-F124 HydrophobicContact CG2-CZ 3.86Å; T120-F124 WeakPolarHBondContact O-CB 3.22Å; T120-F124 WeakPolarHBondContact O-CG 3.35Å; T120-F124 PolarHBondContact O-N 2.87Å; Y121-F124 PolarHBondContact O-N 3.48Å; F124-L127 PolarHBondContact O-N 3.45Å; F124-A128 WeakPolarHBondContact O-CB 3.39Å; F124-A128 PolarHBondContact O-N 3.03Å; F124-L145 HydrophobicContact CD2-CB 4.31Å; F124-L145 WeakPolarHBondContact CD2-O 3.35Å; F124-L145 HydrophobicContact CG-CB 4.33Å
125S98.7Very high98.4Very high2 Ų220.9 Ų20.91%0.01411%0.111CC..Hα-helixtrans-64.1-47.5174.3-171.90000112.1H82 Y121 L127 A128 H129 D146H82-S125 PolarHBondContact CE1-OG 3.05Å; H82-S125 WeakPolarHBondContact ND1-CB 3.4Å; H82-S125 PolarHBondContact ND1-OG 2.93Å; Y121-S125 WeakPolarHBondContact O-CB 3.45Å; Y121-S125 PolarHBondContact O-N 3.12Å; S125-L127 VanDerWaalsContact C-N 3.31Å; S125-L127 PolarHBondContact O-N 2.96Å; S125-A128 WeakPolarHBondContact O-CB 3.41Å; S125-A128 PolarHBondContact O-N 3.31Å; S125-A128 VanDerWaalsContact O-N 3.1Å; S125-H129 PolarHBondContact O-CD2 2.91Å; S125-H129 VanDerWaalsContact O-CD2 3.26Å; S125-H129 PolarHBondContact O-N 3.48Å; S125-D146 WeakPolarHBondContact CA-OD1 3.33Å; S125-D146 WeakPolarHBondContact CB-OD1 3.38Å; S125-D146 PolarHBondContact OG-OD1 2.83Å
126A98.8Very high98.2Very high7 Ų724 Ų246%0.05813%0.126CC..Hα-helixtrans-59.4-42.1176.200000111.8H82 L83 L122 S123 H129 L130H82-A126 HydrophobicContact CB-CB 4.21Å; L83-A126 HydrophobicContact CB-CB 4.26Å; L122-A126 WeakPolarHBondContact O-CB 3.22Å; L122-A126 PolarHBondContact O-N 3.22Å; S123-A126 PolarHBondContact O-N 3.25Å; A126-H129 PolarHBondContact O-N 2.92Å; A126-L130 WeakPolarHBondContact O-CB 3.47Å; A126-L130 PolarHBondContact O-N 3.42Å
127L98.6Very high98.1Very high61 Ų6122.6 Ų22.632%0.31912%0.119SC..Hα-helixtrans-64.4-38.4174.7-73170.7000112.3S123 F124 S125 L130 L131 F142S123-L127 WeakPolarHBondContact O-CB 3.43Å; S123-L127 VanDerWaalsContact O-CG 3.28Å; S123-L127 WeakPolarHBondContact O-CG 3.49Å; S123-L127 PolarHBondContact O-N 2.92Å; F124-L127 PolarHBondContact O-N 3.45Å; S125-L127 VanDerWaalsContact C-N 3.31Å; S125-L127 PolarHBondContact O-N 2.96Å; L127-L130 PolarHBondContact O-N 3.33Å; L127-L131 HydrophobicContact CD2-CD1 3.86Å; L127-L131 VanDerWaalsContact O-CB 3.28Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 PolarHBondContact O-N 3.02Å; L127-F142 HydrophobicContact CB-CD1 4.32Å
128A98.5Very high98.1Very high0 Ų023.2 Ų23.20%012%0.123CC..Hα-helixtrans-62.1-49.6175.500000112.3F124 S125 L130 S132 F142 Y143 D146F124-A128 WeakPolarHBondContact O-CB 3.39Å; F124-A128 PolarHBondContact O-N 3.03Å; S125-A128 WeakPolarHBondContact O-CB 3.41Å; S125-A128 PolarHBondContact O-N 3.31Å; S125-A128 VanDerWaalsContact O-N 3.1Å; A128-L130 VanDerWaalsContact C-N 3.28Å; A128-L130 PolarHBondContact O-N 2.96Å; A128-S132 WeakPolarHBondContact O-CB 3.4Å; A128-S132 PolarHBondContact O-N 3.47Å; A128-S132 PolarHBondContact O-OG 3.39Å; A128-F142 HydrophobicContact CB-CB 3.95Å; A128-F142 WeakPolarHBondContact CB-O 3.36Å; A128-Y143 HydrophobicContact CB-CD1 4.21Å; A128-Y143 HydrophobicContact CB-CE1 4.44Å; A128-D146 HydrophobicContact CB-CB 3.91Å
129H98.4Very high98Very high3 Ų323.5 Ų23.51%0.01412%0.124CC..Hα-helixtrans-67.2-29.9176.7-72.6-74.4000112.1R56 E75 N78 V79 S125 A126 H281 H285R56-H129 PolarHBondContact NH2-O 3.34Å; E75-H129 HydrophobicContact CB-CB 4.48Å; E75-H129 IonicContact OE2-CE1 2.81Å; E75-H129 IonicContact OE2-CG 3.12Å; E75-H129 IonicContact OE2-ND1 2.65Å; E75-H129 PolarHBondContact OE2-ND1 3.3Å; N78-H129 HydrophobicContact CB-CB 4.06Å; V79-H129 HydrophobicContact CG2-CB 3.59Å; S125-H129 PolarHBondContact O-CD2 2.91Å; S125-H129 VanDerWaalsContact O-CD2 3.26Å; S125-H129 PolarHBondContact O-N 3.48Å; A126-H129 PolarHBondContact O-N 2.92Å; H129-H281 AromaticContact CE1-CD2 3.68Å; H129-H281 AromaticContact CE1-NE2 3.3Å; H129-H281 PolarHBondContact CE1-NE2 3.22Å; H129-H281 VanDerWaalsContact CE1-NE2 3.3Å; H129-H281 AromaticContact NE2-CD2 3.91Å; H129-H281 AromaticContact NE2-NE2 3.19Å; H129-H281 PolarHBondContact NE2-NE2 2.95Å; H129-H281 VanDerWaalsContact NE2-NE2 3.19Å; H129-H285 AromaticContact CD2-CE1 3.56Å; H129-H285 AromaticContact NE2-CE1 3.45Å; H129-H285 PolarHBondContact NE2-CE1 3.19Å; H129-H285 AromaticContact NE2-NE2 3.6Å
130L98.4Very high98Very high12 Ų1221.4 Ų21.46%0.06311%0.114CC..Hα-helixtrans-79.4-38.4179.2-173.561.6000113.2R56 Y65 F66 L69 V79 A126 L127 A128R56-L130 PolarHBondContact NH1-O 2.68Å; Y65-L130 VanDerWaalsContact O-CD1 3.29Å; Y65-L130 WeakPolarHBondContact O-CD1 3.36Å; F66-L130 HydrophobicContact CD1-CD2 4.11Å; L69-L130 HydrophobicContact CB-CD1 4.17Å; L69-L130 HydrophobicContact CD1-CD1 4.48Å; V79-L130 HydrophobicContact CG1-CB 4.17Å; V79-L130 HydrophobicContact CG1-CD1 4.38Å; V79-L130 HydrophobicContact CG2-CB 3.96Å; V79-L130 HydrophobicContact CG2-CD1 4.42Å; A126-L130 WeakPolarHBondContact O-CB 3.47Å; A126-L130 PolarHBondContact O-N 3.42Å; L127-L130 PolarHBondContact O-N 3.33Å; A128-L130 VanDerWaalsContact C-N 3.28Å; A128-L130 PolarHBondContact O-N 2.96Å
131L98.3Very high98Very high5 Ų521.2 Ų21.23%0.02611%0.113CC..Hα-helixtrans-113-8.6-165.4-58.3180000114.4W62 F66 L127 A133 K134 F142W62-L131 HydrophobicContact CE3-CD2 4.23Å; W62-L131 HydrophobicContact CZ3-CB 4.19Å; W62-L131 HydrophobicContact CZ3-CD1 4.19Å; W62-L131 HydrophobicContact CZ3-CD2 4.21Å; W62-L131 HydrophobicContact CZ3-CG 4.43Å; F66-L131 HydrophobicContact CD1-CD2 4.44Å; F66-L131 HydrophobicContact CE1-CD1 4.35Å; F66-L131 HydrophobicContact CE1-CD2 4.16Å; F66-L131 HydrophobicContact CE2-CD2 4.43Å; F66-L131 HydrophobicContact CZ-CD1 4.14Å; F66-L131 HydrophobicContact CZ-CD2 4.15Å; L127-L131 HydrophobicContact CD2-CD1 3.86Å; L127-L131 VanDerWaalsContact O-CB 3.28Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 PolarHBondContact O-N 3.02Å; L131-A133 VanDerWaalsContact C-N 3.28Å; L131-A133 PolarHBondContact O-N 3.01Å; L131-K134 PolarHBondContact O-N 3.3Å; L131-F142 HydrophobicContact CB-CD1 4.36Å; L131-F142 HydrophobicContact CB-CD2 3.6Å; L131-F142 HydrophobicContact CB-CE1 4.13Å; L131-F142 HydrophobicContact CB-CE2 3.33Å; L131-F142 HydrophobicContact CB-CG 4.14Å; L131-F142 HydrophobicContact CB-CZ 3.63Å; L131-F142 HydrophobicContact CD1-CD1 4.36Å; L131-F142 HydrophobicContact CD1-CE1 3.56Å; L131-F142 HydrophobicContact CD1-CE2 4.04Å; L131-F142 HydrophobicContact CD1-CZ 3.37Å; L131-F142 HydrophobicContact CG-CE1 4.46Å; L131-F142 HydrophobicContact CG-CE2 4.32Å; L131-F142 HydrophobicContact CG-CZ 4.14Å
132S97.2Very high98Very high5 Ų522 Ų224%0.03512%0.117CC..G310 helixtrans-61.9-31.1-178.754.60000114F46 A128 K134 Y139F46-S132 WeakPolarHBondContact CE1-O 3.27Å; A128-S132 WeakPolarHBondContact O-CB 3.4Å; A128-S132 PolarHBondContact O-N 3.47Å; A128-S132 PolarHBondContact O-OG 3.39Å; S132-K134 PolarHBondContact O-N 2.86Å; S132-Y139 WeakPolarHBondContact O-CA 3.49Å; S132-Y139 WeakPolarHBondContact O-CB 3.26Å; S132-Y139 PolarHBondContact O-N 3.4Å
133A97.1Very high97.9Very high11 Ų1122.7 Ų22.79%0.09112%0.119CC..G310 helixtrans-66.8-7.8-177.600000114.3R56 Y65 L131R56-A133 HydrophobicContact CB-CB 4.11Å; Y65-A133 HydrophobicContact CD1-CB 4.29Å; Y65-A133 HydrophobicContact CE1-CB 3.84Å; L131-A133 VanDerWaalsContact C-N 3.28Å; L131-A133 PolarHBondContact O-N 3.01Å
134K97.3Very high97.9Very high37 Ų3721.5 Ų21.516%0.16111%0.111CC..G310 helixtrans-64.2-50.6-173.1177.6167.3174.751.60115.4D59 Q60 W62 Y65 L131 S132D59-K134 WeakPolarHBondContact CA-O 3.41Å; D59-K134 PolarHBondContact N-O 3.41Å; Q60-K134 PolarHBondContact O-NZ 3.11Å; W62-K134 HydrophobicContact CD2-CD 3.64Å; W62-K134 HydrophobicContact CE3-CD 3.75Å; W62-K134 HydrophobicContact CG-CD 4.4Å; W62-K134 HydrophobicContact CH2-CD 3.69Å; W62-K134 HydrophobicContact CZ2-CD 3.56Å; W62-K134 HydrophobicContact CZ3-CD 3.77Å; Y65-K134 HydrophobicContact CD2-CB 3.95Å; Y65-K134 HydrophobicContact CD2-CD 4.21Å; Y65-K134 HydrophobicContact CD2-CG 4.24Å; Y65-K134 HydrophobicContact CE1-CB 4.3Å; Y65-K134 HydrophobicContact CE2-CB 3.49Å; Y65-K134 VanDerWaalsContact CE2-CB 3.49Å; Y65-K134 HydrophobicContact CE2-CD 3.97Å; Y65-K134 HydrophobicContact CE2-CG 3.59Å; Y65-K134 VanDerWaalsContact OH-CA 3.32Å; Y65-K134 WeakPolarHBondContact OH-CA 3.34Å; L131-K134 PolarHBondContact O-N 3.3Å; S132-K134 PolarHBondContact O-N 2.86Å
135S97Very high97.9Very high31 Ų3121.6 Ų21.622%0.21711%0.114CC..  trans-162.3162.9-175.868.80000107.9L137 S138 Y139S135-L137 PolarHBondContact O-N 3.44Å; S135-S138 WeakPolarHBondContact O-CB 3.45Å; S135-S138 PolarHBondContact O-N 3.02Å; S135-S138 VanDerWaalsContact O-N 3.07Å; S135-S138 WeakPolarHBondContact OG-CB 3.46Å; S135-S138 PolarHBondContact OG-N 3.01Å; S135-S138 VanDerWaalsContact OG-N 3.1Å; S135-S138 PolarHBondContact OG-OG 3.49Å; S135-Y139 PolarHBondContact O-N 3.08Å
136E96Very high97.9Very high68 Ų6822.2 Ų22.232%0.31812%0.117SC..Hα-helixtrans-58.6-39.8178.3-54.6-15717200111.6V45 F46 S138 Y139 Y140 L347V45-E136 HydrophobicContact CG1-CB 4.34Å; V45-E136 HydrophobicContact CG1-CG 3.77Å; F46-E136 HydrophobicContact CZ-CG 4.33Å; E136-S138 PolarHBondContact O-N 3.3Å; E136-Y139 WeakPolarHBondContact O-CB 3.25Å; E136-Y139 PolarHBondContact O-N 3.39Å; E136-Y140 WeakPolarHBondContact O-CD2 3.21Å; E136-Y140 PolarHBondContact O-N 2.95Å; E136-L347 HydrophobicContact CB-CD1 4.03Å; E136-L347 HydrophobicContact CB-CD2 4.27Å; E136-L347 VanDerWaalsContact OE2-CD2 3.27Å; E136-L347 WeakPolarHBondContact OE2-CD2 3.48Å
137L96.7Very high97.9Very high39 Ų3923.7 Ų23.720%0.20412%0.121CC..Hα-helixtrans-65.3-39.6176.5-177.461.3000112S135 T141 R340 V343 R344 L347S135-L137 PolarHBondContact O-N 3.44Å; L137-T141 VanDerWaalsContact O-CB 3.29Å; L137-T141 WeakPolarHBondContact O-CB 3.44Å; L137-T141 PolarHBondContact O-N 2.9Å; L137-T141 PolarHBondContact O-OG1 3.47Å; L137-R340 HydrophobicContact CD1-CG 4.31Å; L137-V343 HydrophobicContact CD1-CG1 4.18Å; L137-R344 HydrophobicContact CD1-CB 4.04Å; L137-R344 HydrophobicContact CD2-CG 4.31Å; L137-L347 HydrophobicContact CB-CD1 4.06Å
138S97.4Very high97.9Very high13 Ų1321.1 Ų21.19%0.09111%0.108CC..Hα-helixtrans-63-43.1175.2-61.70000111.2S135 E136 Y140 T141 F142S135-S138 WeakPolarHBondContact O-CB 3.45Å; S135-S138 PolarHBondContact O-N 3.02Å; S135-S138 VanDerWaalsContact O-N 3.07Å; S135-S138 WeakPolarHBondContact OG-CB 3.46Å; S135-S138 PolarHBondContact OG-N 3.01Å; S135-S138 VanDerWaalsContact OG-N 3.1Å; S135-S138 PolarHBondContact OG-OG 3.49Å; E136-S138 PolarHBondContact O-N 3.3Å; S138-Y140 PolarHBondContact O-N 3.31Å; S138-T141 PolarHBondContact O-N 3.13Å; S138-F142 VanDerWaalsContact O-CD2 3.22Å; S138-F142 WeakPolarHBondContact O-CD2 3.44Å; S138-F142 PolarHBondContact O-N 2.86Å
139Y97.5Very high97.9Very high5 Ų521.1 Ų21.12%0.0211%0.108CC..Hα-helixtrans-52.3-56.9175.1176.5-89.9000111.2V45 F46 S132 S135 E136 T141 Y143 K197V45-Y139 HydrophobicContact CG2-CD1 3.6Å; V45-Y139 HydrophobicContact CG2-CE1 3.63Å; V45-Y139 HydrophobicContact CG2-CG 4.22Å; V45-Y139 WeakPolarHBondContact O-CE2 3.15Å; V45-Y139 VanDerWaalsContact O-CZ 3.31Å; V45-Y139 PolarHBondContact O-OH 3.27Å; F46-Y139 AromaticContact CD1-CD2 3.75Å; F46-Y139 HydrophobicContact CD1-CD2 3.75Å; F46-Y139 HydrophobicContact CD1-CE2 4.48Å; F46-Y139 HydrophobicContact CD1-CG 4.27Å; F46-Y139 HydrophobicContact CE1-CD2 4.17Å; F46-Y139 HydrophobicContact CE1-CG 4.29Å; S132-Y139 WeakPolarHBondContact O-CA 3.49Å; S132-Y139 WeakPolarHBondContact O-CB 3.26Å; S132-Y139 PolarHBondContact O-N 3.4Å; S135-Y139 PolarHBondContact O-N 3.08Å; E136-Y139 WeakPolarHBondContact O-CB 3.25Å; E136-Y139 PolarHBondContact O-N 3.39Å; Y139-T141 PolarHBondContact O-N 3.17Å; Y139-Y143 HydrophobicContact CD1-CD2 4.23Å; Y139-Y143 AromaticContact CD2-CD2 3.83Å; Y139-Y143 HydrophobicContact CD2-CD2 3.83Å; Y139-Y143 AromaticContact CD2-CE2 3.58Å; Y139-Y143 HydrophobicContact CD2-CE2 3.58Å; Y139-Y143 HydrophobicContact CE1-CD2 4.11Å; Y139-Y143 HydrophobicContact CE1-CE2 4.46Å; Y139-Y143 AromaticContact CE2-CD2 3.72Å; Y139-Y143 HydrophobicContact CE2-CD2 3.72Å; Y139-Y143 AromaticContact CE2-CE2 3.28Å; Y139-Y143 HydrophobicContact CE2-CE2 3.28Å; Y139-Y143 HydrophobicContact CG-CD2 4.07Å; Y139-Y143 HydrophobicContact CG-CE2 4.3Å; Y139-Y143 AromaticContact CZ-CD2 3.85Å; Y139-Y143 AromaticContact CZ-CE2 3.75Å; Y139-Y143 WeakPolarHBondContact O-CB 3.37Å; Y139-Y143 VanDerWaalsContact O-CD2 3.23Å; Y139-Y143 WeakPolarHBondContact O-CD2 3.21Å; Y139-Y143 PolarHBondContact O-N 3.47Å; Y139-Y143 VanDerWaalsContact O-N 3.16Å; Y139-K197 WeakPolarHBondContact OH-CE 3.48Å; Y139-K197 PolarHBondContact OH-NZ 3.41Å
140Y97.8Very high97.9Very high24 Ų2424 Ų249%0.09413%0.126CC..Hα-helixtrans-63.7-42.7178.8-70.7-73.2000112.3V45 E136 S138 F142 Y143 F144 K197 V343V45-Y140 HydrophobicContact CG2-CE2 3.97Å; E136-Y140 WeakPolarHBondContact O-CD2 3.21Å; E136-Y140 PolarHBondContact O-N 2.95Å; S138-Y140 PolarHBondContact O-N 3.31Å; Y140-F142 PolarHBondContact O-N 3.13Å; Y140-Y143 PolarHBondContact O-N 3.33Å; Y140-F144 HydrophobicContact CD1-CE1 4.27Å; Y140-F144 AromaticContact CD1-CZ 3.94Å; Y140-F144 HydrophobicContact CD1-CZ 3.94Å; Y140-F144 HydrophobicContact CG-CZ 4.42Å; Y140-F144 WeakPolarHBondContact O-CB 3.25Å; Y140-F144 WeakPolarHBondContact O-CD1 2.99Å; Y140-F144 WeakPolarHBondContact O-CD2 3.49Å; Y140-F144 WeakPolarHBondContact O-CG 3.21Å; Y140-F144 PolarHBondContact O-N 3.26Å; Y140-K197 HydrophobicContact CD1-CG 4.12Å; Y140-K197 HydrophobicContact CE1-CG 4Å; Y140-V343 HydrophobicContact CD1-CG2 4.22Å; Y140-V343 HydrophobicContact CD2-CG1 3.45Å; Y140-V343 VanDerWaalsContact CD2-CG1 3.45Å; Y140-V343 HydrophobicContact CD2-CG2 4.31Å; Y140-V343 HydrophobicContact CE2-CG1 4.1Å; Y140-V343 HydrophobicContact CG-CG1 3.84Å; Y140-V343 HydrophobicContact CG-CG2 3.97Å
141T98.4Very high97.9Very high26 Ų2623.5 Ų23.516%0.1612%0.123CC..Hα-helixtrans-57.6-52.7-177.8-60.10000111.7L137 S138 Y139 F144 L145 R340L137-T141 VanDerWaalsContact O-CB 3.29Å; L137-T141 WeakPolarHBondContact O-CB 3.44Å; L137-T141 PolarHBondContact O-N 2.9Å; L137-T141 PolarHBondContact O-OG1 3.47Å; S138-T141 PolarHBondContact O-N 3.13Å; Y139-T141 PolarHBondContact O-N 3.17Å; T141-F144 PolarHBondContact O-N 2.95Å; T141-L145 PolarHBondContact O-N 3.27Å; T141-L145 VanDerWaalsContact O-N 3.08Å; T141-R340 PolarHBondContact OG1-NE 3.35Å
142F98.5Very high97.8Very high27 Ų2723.5 Ų23.512%0.11812%0.123CC..Hα-helixtrans-75.5-33.2-175.5-67-76000112.8W62 L127 A128 L131 S138 Y140 F144 L145 D146W62-F142 AromaticContact CH2-CE2 3.75Å; W62-F142 HydrophobicContact CH2-CE2 3.75Å; W62-F142 AromaticContact CH2-CZ 3.88Å; W62-F142 HydrophobicContact CH2-CZ 3.88Å; W62-F142 AromaticContact CZ3-CE2 3.84Å; W62-F142 HydrophobicContact CZ3-CE2 3.84Å; W62-F142 AromaticContact CZ3-CZ 3.88Å; W62-F142 HydrophobicContact CZ3-CZ 3.88Å; L127-F142 HydrophobicContact CB-CD1 4.32Å; A128-F142 HydrophobicContact CB-CB 3.95Å; A128-F142 WeakPolarHBondContact CB-O 3.36Å; L131-F142 HydrophobicContact CB-CD1 4.36Å; L131-F142 HydrophobicContact CB-CD2 3.6Å; L131-F142 HydrophobicContact CB-CE1 4.13Å; L131-F142 HydrophobicContact CB-CE2 3.33Å; L131-F142 HydrophobicContact CB-CG 4.14Å; L131-F142 HydrophobicContact CB-CZ 3.63Å; L131-F142 HydrophobicContact CD1-CD1 4.36Å; L131-F142 HydrophobicContact CD1-CE1 3.56Å; L131-F142 HydrophobicContact CD1-CE2 4.04Å; L131-F142 HydrophobicContact CD1-CZ 3.37Å; L131-F142 HydrophobicContact CG-CE1 4.46Å; L131-F142 HydrophobicContact CG-CE2 4.32Å; L131-F142 HydrophobicContact CG-CZ 4.14Å; S138-F142 VanDerWaalsContact O-CD2 3.22Å; S138-F142 WeakPolarHBondContact O-CD2 3.44Å; S138-F142 PolarHBondContact O-N 2.86Å; Y140-F142 PolarHBondContact O-N 3.13Å; F142-F144 VanDerWaalsContact C-N 3.29Å; F142-F144 PolarHBondContact O-N 3.33Å; F142-L145 HydrophobicContact CD1-CD1 4.02Å; F142-L145 HydrophobicContact CE1-CD1 4.47Å; F142-L145 WeakPolarHBondContact O-CB 3.33Å; F142-L145 PolarHBondContact O-N 2.86Å; F142-D146 PolarHBondContact O-N 3.47Å
143Y98.1Very high97.9Very high14 Ų1424.4 Ų24.46%0.05513%0.126CC..Hα-helixtrans-67.3-30171.8-82.3-65.4000112.8A128 Y139 Y140 D146 Y147A128-Y143 HydrophobicContact CB-CD1 4.21Å; A128-Y143 HydrophobicContact CB-CE1 4.44Å; Y139-Y143 HydrophobicContact CD1-CD2 4.23Å; Y139-Y143 AromaticContact CD2-CD2 3.83Å; Y139-Y143 HydrophobicContact CD2-CD2 3.83Å; Y139-Y143 AromaticContact CD2-CE2 3.58Å; Y139-Y143 HydrophobicContact CD2-CE2 3.58Å; Y139-Y143 HydrophobicContact CE1-CD2 4.11Å; Y139-Y143 HydrophobicContact CE1-CE2 4.46Å; Y139-Y143 AromaticContact CE2-CD2 3.72Å; Y139-Y143 HydrophobicContact CE2-CD2 3.72Å; Y139-Y143 AromaticContact CE2-CE2 3.28Å; Y139-Y143 HydrophobicContact CE2-CE2 3.28Å; Y139-Y143 HydrophobicContact CG-CD2 4.07Å; Y139-Y143 HydrophobicContact CG-CE2 4.3Å; Y139-Y143 AromaticContact CZ-CD2 3.85Å; Y139-Y143 AromaticContact CZ-CE2 3.75Å; Y139-Y143 WeakPolarHBondContact O-CB 3.37Å; Y139-Y143 VanDerWaalsContact O-CD2 3.23Å; Y139-Y143 WeakPolarHBondContact O-CD2 3.21Å; Y139-Y143 PolarHBondContact O-N 3.47Å; Y139-Y143 VanDerWaalsContact O-N 3.16Å; Y140-Y143 PolarHBondContact O-N 3.33Å; Y143-D146 WeakPolarHBondContact O-CB 3.38Å; Y143-D146 PolarHBondContact O-N 2.84Å; Y143-Y147 VanDerWaalsContact O-CD2 3.22Å; Y143-Y147 WeakPolarHBondContact O-CD2 3.5Å; Y143-Y147 PolarHBondContact O-N 2.86Å
144F98.6Very high98Very high2 Ų225 Ų251%0.00913%0.127CC..Hα-helixtrans-69.2-36.6170.5-64-18000111.9Y140 T141 F142 D146 Y147 V148 C194 K197 A336 V339 R340 V343Y140-F144 HydrophobicContact CD1-CE1 4.27Å; Y140-F144 AromaticContact CD1-CZ 3.94Å; Y140-F144 HydrophobicContact CD1-CZ 3.94Å; Y140-F144 HydrophobicContact CG-CZ 4.42Å; Y140-F144 WeakPolarHBondContact O-CB 3.25Å; Y140-F144 WeakPolarHBondContact O-CD1 2.99Å; Y140-F144 WeakPolarHBondContact O-CD2 3.49Å; Y140-F144 WeakPolarHBondContact O-CG 3.21Å; Y140-F144 PolarHBondContact O-N 3.26Å; T141-F144 PolarHBondContact O-N 2.95Å; F142-F144 VanDerWaalsContact C-N 3.29Å; F142-F144 PolarHBondContact O-N 3.33Å; F144-D146 VanDerWaalsContact C-N 3.35Å; F144-Y147 HydrophobicContact CD1-CD2 4.08Å; F144-Y147 HydrophobicContact CD1-CE2 4.33Å; F144-Y147 PolarHBondContact O-N 3.24Å; F144-V148 WeakPolarHBondContact O-CG2 3.22Å; F144-V148 PolarHBondContact O-N 2.92Å; F144-C194 HydrophobicContact CD1-CB 4.03Å; F144-C194 HydrophobicContact CE1-CB 4.18Å; F144-C194 WeakPolarHBondContact CE1-O 3.25Å; F144-C194 HydrophobicContact CG-CB 4.49Å; F144-K197 HydrophobicContact CE1-CB 4.17Å; F144-K197 HydrophobicContact CE1-CG 4.41Å; F144-A336 HydrophobicContact CB-CB 3.98Å; F144-V339 HydrophobicContact CE1-CG1 4.44Å; F144-V339 HydrophobicContact CE2-CB 4.1Å; F144-V339 HydrophobicContact CE2-CG1 3.69Å; F144-V339 HydrophobicContact CZ-CB 4.41Å; F144-V339 HydrophobicContact CZ-CG1 3.59Å; F144-R340 HydrophobicContact CD2-CB 4.11Å; F144-R340 HydrophobicContact CE2-CB 4.35Å; F144-V343 HydrophobicContact CE2-CG2 3.97Å; F144-V343 HydrophobicContact CZ-CG2 4.04Å
145L98.4Very high98Very high61 Ų6123.3 Ų23.332%0.31912%0.12SC..Hα-helixtrans-62.2-43.4171.2-69.3175.9000111.4F124 T141 F142 Y147 V148 G149F124-L145 HydrophobicContact CD2-CB 4.31Å; F124-L145 WeakPolarHBondContact CD2-O 3.35Å; F124-L145 HydrophobicContact CG-CB 4.33Å; T141-L145 PolarHBondContact O-N 3.27Å; T141-L145 VanDerWaalsContact O-N 3.08Å; F142-L145 HydrophobicContact CD1-CD1 4.02Å; F142-L145 HydrophobicContact CE1-CD1 4.47Å; F142-L145 WeakPolarHBondContact O-CB 3.33Å; F142-L145 PolarHBondContact O-N 2.86Å; L145-Y147 VanDerWaalsContact C-N 3.32Å; L145-Y147 PolarHBondContact O-N 3.48Å; L145-V148 WeakPolarHBondContact O-CB 3.3Å; L145-V148 PolarHBondContact O-N 3.44Å; L145-V148 VanDerWaalsContact O-N 3.17Å; L145-G149 PolarHBondContact O-N 3.44Å
146D98.6Very high98.1Very high16 Ų1621.9 Ų21.99%0.08611%0.109CC..Hα-helixtrans-55.8-46.4173.5-176.234.7000111.5S125 A128 F142 Y143 F144 V148 G149 V150S125-D146 WeakPolarHBondContact CA-OD1 3.33Å; S125-D146 WeakPolarHBondContact CB-OD1 3.38Å; S125-D146 PolarHBondContact OG-OD1 2.83Å; A128-D146 HydrophobicContact CB-CB 3.91Å; F142-D146 PolarHBondContact O-N 3.47Å; Y143-D146 WeakPolarHBondContact O-CB 3.38Å; Y143-D146 PolarHBondContact O-N 2.84Å; F144-D146 VanDerWaalsContact C-N 3.35Å; D146-V148 PolarHBondContact O-N 3.25Å; D146-G149 WeakPolarHBondContact O-CA 3.1Å; D146-G149 PolarHBondContact O-N 3.39Å; D146-G149 VanDerWaalsContact O-N 3.08Å; D146-V150 WeakPolarHBondContact O-CG2 3.21Å; D146-V150 PolarHBondContact O-N 2.8Å
147Y98.3Very high98.2Very high38 Ų3819.2 Ų19.215%0.14910%0.098CC..Hα-helixtrans-63.7-36176-59.5-26000114.1Y143 F144 L145 S151 C193 K197Y143-Y147 VanDerWaalsContact O-CD2 3.22Å; Y143-Y147 WeakPolarHBondContact O-CD2 3.5Å; Y143-Y147 PolarHBondContact O-N 2.86Å; F144-Y147 HydrophobicContact CD1-CD2 4.08Å; F144-Y147 HydrophobicContact CD1-CE2 4.33Å; F144-Y147 PolarHBondContact O-N 3.24Å; L145-Y147 VanDerWaalsContact C-N 3.32Å; L145-Y147 PolarHBondContact O-N 3.48Å; Y147-S151 WeakPolarHBondContact O-CB 3.42Å; Y147-S151 PolarHBondContact O-N 3.48Å; Y147-S151 PolarHBondContact O-OG 3.36Å; Y147-C193 HydrophobicContact CD1-CB 3.98Å; Y147-C193 HydrophobicContact CD2-CB 3.55Å; Y147-C193 HydrophobicContact CE1-CB 4.37Å; Y147-C193 HydrophobicContact CE2-CB 3.97Å; Y147-C193 WeakPolarHBondContact CE2-O 3.15Å; Y147-C193 HydrophobicContact CG-CB 3.56Å; Y147-K197 HydrophobicContact CE2-CB 4.07Å; Y147-K197 HydrophobicContact CE2-CD 3.66Å; Y147-K197 HydrophobicContact CE2-CG 4.5Å; Y147-K197 VanDerWaalsContact OH-CD 3.22Å; Y147-K197 WeakPolarHBondContact OH-CD 3.21Å; Y147-K197 PolarHBondContact OH-NZ 3.18Å
148V98.8Very high98.3Very high7 Ų717.3 Ų17.34%0.0429%0.089CC..Hα-helixtrans-61.9-47.9170.4171.30000109.8F144 L145 D146 V150 S151 V152 C332 A336F144-V148 WeakPolarHBondContact O-CG2 3.22Å; F144-V148 PolarHBondContact O-N 2.92Å; L145-V148 WeakPolarHBondContact O-CB 3.3Å; L145-V148 PolarHBondContact O-N 3.44Å; L145-V148 VanDerWaalsContact O-N 3.17Å; D146-V148 PolarHBondContact O-N 3.25Å; V148-V150 PolarHBondContact O-N 3.39Å; V148-S151 PolarHBondContact O-N 2.97Å; V148-V152 HydrophobicContact CG1-CG2 4.17Å; V148-V152 WeakPolarHBondContact O-CB 3.47Å; V148-V152 VanDerWaalsContact O-CG2 3.24Å; V148-V152 WeakPolarHBondContact O-CG2 3.43Å; V148-V152 PolarHBondContact O-N 2.94Å; V148-C332 HydrophobicContact CG1-CB 4.08Å; V148-C332 HydrophobicContact CG2-CB 4.21Å; V148-A336 HydrophobicContact CG2-CB 3.57Å
149G98.6Very high98.3Very high0 Ų016.7 Ų16.70%08%0.084CC..Hα-helixtrans-56.5-51.7178.600000112.4Y121 L145 D146 S151 V152 Y153Y121-G149 WeakPolarHBondContact CB-O 3.46Å; L145-G149 PolarHBondContact O-N 3.44Å; D146-G149 WeakPolarHBondContact O-CA 3.1Å; D146-G149 PolarHBondContact O-N 3.39Å; D146-G149 VanDerWaalsContact O-N 3.08Å; G149-S151 VanDerWaalsContact C-N 3.31Å; G149-S151 PolarHBondContact O-N 2.95Å; G149-V152 PolarHBondContact O-N 3.02Å; G149-Y153 WeakPolarHBondContact O-CB 3.44Å; G149-Y153 PolarHBondContact O-N 3.38Å
150V97.9Very high98.3Very high63 Ų6316.5 Ų16.538%0.3828%0.083SC..Hα-helixtrans-58.5-42.8177.8171.90000111.4D146 V148 Y153 Q154D146-V150 WeakPolarHBondContact O-CG2 3.21Å; D146-V150 PolarHBondContact O-N 2.8Å; V148-V150 PolarHBondContact O-N 3.39Å; V150-Y153 PolarHBondContact O-N 3.4Å; V150-Q154 WeakPolarHBondContact O-CB 3.22Å; V150-Q154 PolarHBondContact O-N 2.89Å
151S98.4Very high98.3Very high1 Ų115.4 Ų15.41%0.0078%0.079CC..Hα-helixtrans-70-38.1-178.8-55.10000112.5Y147 V148 G149 Q154 Y155 A186 C190Y147-S151 WeakPolarHBondContact O-CB 3.42Å; Y147-S151 PolarHBondContact O-N 3.48Å; Y147-S151 PolarHBondContact O-OG 3.36Å; V148-S151 PolarHBondContact O-N 2.97Å; G149-S151 VanDerWaalsContact C-N 3.31Å; G149-S151 PolarHBondContact O-N 2.95Å; S151-Q154 WeakPolarHBondContact O-CB 3.44Å; S151-Q154 PolarHBondContact O-N 2.88Å; S151-Y155 PolarHBondContact O-N 2.82Å; S151-Y155 VanDerWaalsContact O-N 3.17Å; S151-A186 WeakPolarHBondContact CB-O 3.28Å; S151-A186 WeakPolarHBondContact O-CB 3.4Å; S151-C190 VanDerWaalsContact OG-CA 3.29Å; S151-C190 WeakPolarHBondContact OG-CA 3.42Å; S151-C190 VanDerWaalsContact OG-CB 3.26Å; S151-C190 WeakPolarHBondContact OG-CB 3.46Å; S151-C190 PolarHBondContact OG-N 3.42Å
152V97.9Very high98.3Very high5 Ų514.3 Ų14.33%0.037%0.072CC..Hα-helixtrans-66.7-40.6174.7171.50000110.6A117 V148 G149 Y155 G156 F325 T329A117-V152 HydrophobicContact CB-CG1 4.07Å; V148-V152 HydrophobicContact CG1-CG2 4.17Å; V148-V152 WeakPolarHBondContact O-CB 3.47Å; V148-V152 VanDerWaalsContact O-CG2 3.24Å; V148-V152 WeakPolarHBondContact O-CG2 3.43Å; V148-V152 PolarHBondContact O-N 2.94Å; G149-V152 PolarHBondContact O-N 3.02Å; V152-Y155 PolarHBondContact O-N 3.39Å; V152-G156 PolarHBondContact O-N 3.27Å; V152-F325 HydrophobicContact CG1-CE2 3.52Å; V152-F325 HydrophobicContact CG1-CZ 3.56Å; V152-T329 HydrophobicContact CG2-CG2 4.02Å
153Y98.6Very high98.2Very high24 Ų2413 Ų139%0.0947%0.067CC..Hα-helixtrans-64.7-41.7173.5-179-108.4000112.8V114 A117 A118 Y121 G149 V150 Y155 G156 S157 T292 Q295V114-Y153 HydrophobicContact CG2-CE2 4.17Å; A117-Y153 HydrophobicContact CB-CD2 4.23Å; A118-Y153 HydrophobicContact CB-CD2 4.1Å; A118-Y153 HydrophobicContact CB-CE2 3.83Å; Y121-Y153 AromaticContact CD1-CD1 3.88Å; Y121-Y153 HydrophobicContact CD1-CD1 3.88Å; Y121-Y153 AromaticContact CD1-CD2 3.57Å; Y121-Y153 HydrophobicContact CD1-CD2 3.57Å; Y121-Y153 HydrophobicContact CD1-CE2 4.23Å; Y121-Y153 AromaticContact CD1-CG 3.36Å; Y121-Y153 HydrophobicContact CD1-CG 3.36Å; Y121-Y153 AromaticContact CE1-CD1 3.88Å; Y121-Y153 HydrophobicContact CE1-CD1 3.88Å; Y121-Y153 AromaticContact CE1-CD2 3.71Å; Y121-Y153 HydrophobicContact CE1-CD2 3.71Å; Y121-Y153 HydrophobicContact CE1-CE1 4.06Å; Y121-Y153 AromaticContact CE1-CE2 3.88Å; Y121-Y153 HydrophobicContact CE1-CE2 3.88Å; Y121-Y153 AromaticContact CE1-CG 3.71Å; Y121-Y153 HydrophobicContact CE1-CG 3.71Å; Y121-Y153 HydrophobicContact CG-CG 4.18Å; G149-Y153 WeakPolarHBondContact O-CB 3.44Å; G149-Y153 PolarHBondContact O-N 3.38Å; V150-Y153 PolarHBondContact O-N 3.4Å; Y153-Y155 PolarHBondContact O-N 2.93Å; Y153-G156 PolarHBondContact O-N 3.1Å; Y153-S157 VanDerWaalsContact O-CB 3.24Å; Y153-S157 WeakPolarHBondContact O-CB 3.22Å; Y153-S157 PolarHBondContact O-N 3.4Å; Y153-T292 HydrophobicContact CE2-CG2 4.17Å; Y153-T292 WeakPolarHBondContact OH-CG2 3.19Å; Y153-T292 PolarHBondContact OH-OG1 3.45Å; Y153-Q295 PolarHBondContact OH-OE1 3.49Å
154Q98.3Very high98.1Very high25 Ų2512.5 Ų12.512%0.1176%0.064CC..Hα-helixtrans-54-51.8174.7-176.8-178.2-71.300111.1V150 S151 S157 A158 A186 T189 A219 D223V150-Q154 WeakPolarHBondContact O-CB 3.22Å; V150-Q154 PolarHBondContact O-N 2.89Å; S151-Q154 WeakPolarHBondContact O-CB 3.44Å; S151-Q154 PolarHBondContact O-N 2.88Å; Q154-S157 WeakPolarHBondContact O-CB 3.45Å; Q154-S157 PolarHBondContact O-N 3.48Å; Q154-A158 PolarHBondContact O-N 3.19Å; Q154-A186 VanDerWaalsContact NE2-CA 3.26Å; Q154-T189 PolarHBondContact NE2-OG1 3.47Å; Q154-A219 HydrophobicContact CG-CB 4.06Å; Q154-D223 WeakPolarHBondContact CG-OD2 3.4Å
155Y98.5Very high98Very high1 Ų112.4 Ų12.40%0.0046%0.064CC..Hα-helixtrans-64.9-42.3176.3176.4-98.4000113S151 V152 Y153 S157 A158 L159 A182 A183 L324 F325 T328S151-Y155 PolarHBondContact O-N 2.82Å; S151-Y155 VanDerWaalsContact O-N 3.17Å; V152-Y155 PolarHBondContact O-N 3.39Å; Y153-Y155 PolarHBondContact O-N 2.93Å; Y155-S157 VanDerWaalsContact C-N 3.28Å; Y155-S157 PolarHBondContact O-N 3.16Å; Y155-A158 WeakPolarHBondContact O-CB 3.06Å; Y155-A158 PolarHBondContact O-N 3.45Å; Y155-L159 HydrophobicContact CE1-CD2 4.49Å; Y155-L159 WeakPolarHBondContact O-CB 3.46Å; Y155-L159 PolarHBondContact O-N 3.46Å; Y155-A182 HydrophobicContact CD2-CB 4.13Å; Y155-A182 HydrophobicContact CE2-CB 4.48Å; Y155-A183 HydrophobicContact CD2-CB 3.91Å; Y155-A183 HydrophobicContact CE2-CB 3.74Å; Y155-L324 HydrophobicContact CE2-CD2 4.15Å; Y155-L324 HydrophobicContact CE2-CG 4.22Å; Y155-L324 WeakPolarHBondContact OH-CB 3.15Å; Y155-L324 WeakPolarHBondContact OH-CD2 3.49Å; Y155-L324 WeakPolarHBondContact OH-CG 3.48Å; Y155-F325 HydrophobicContact CD1-CB 4.32Å; Y155-F325 AromaticContact CD1-CD2 3.74Å; Y155-F325 HydrophobicContact CD1-CD2 3.74Å; Y155-F325 VanDerWaalsContact CE1-CA 3.44Å; Y155-F325 HydrophobicContact CE1-CB 3.73Å; Y155-F325 AromaticContact CE1-CD2 3.96Å; Y155-F325 HydrophobicContact CE1-CD2 3.96Å; Y155-F325 HydrophobicContact CE1-CG 4.36Å; Y155-T328 HydrophobicContact CG-CG2 4.45Å
156G98.3Very high97.9Very high0 Ų09.5 Ų9.50%05%0.049CC..Hα-helixtrans-60.1-38.8176.600000112.8V152 Y153 A160V152-G156 PolarHBondContact O-N 3.27Å; Y153-G156 PolarHBondContact O-N 3.1Å; G156-A160 WeakPolarHBondContact O-CB 3.33Å; G156-A160 PolarHBondContact O-N 3.15Å
157S98.3Very high97.8Very high12 Ų1210 Ų108%0.0845%0.051CC..Hα-helixtrans-64.2-48.2173169.60000111.5Y153 Q154 Y155 L159 A160 H161 Q295Y153-S157 VanDerWaalsContact O-CB 3.24Å; Y153-S157 WeakPolarHBondContact O-CB 3.22Å; Y153-S157 PolarHBondContact O-N 3.4Å; Q154-S157 WeakPolarHBondContact O-CB 3.45Å; Q154-S157 PolarHBondContact O-N 3.48Å; Y155-S157 VanDerWaalsContact C-N 3.28Å; Y155-S157 PolarHBondContact O-N 3.16Å; S157-L159 VanDerWaalsContact C-N 3.32Å; S157-L159 PolarHBondContact O-N 2.97Å; S157-A160 PolarHBondContact O-N 3.31Å; S157-H161 PolarHBondContact O-N 3.48Å; S157-H161 PolarHBondContact O-ND1 2.89Å; S157-H161 PolarHBondContact OG-CE1 3.35Å; S157-H161 VanDerWaalsContact OG-CE1 3.24Å; S157-Q295 VanDerWaalsContact CB-NE2 3.3Å; S157-Q295 PolarHBondContact OG-NE2 3.12Å
158A98.4Very high97.7Very high0 Ų014.3 Ų14.30%07%0.07CC..Hα-helixtrans-57-46.7176.100000111.7Q154 Y155 A160 H161 Y162 F178 A182 D223Q154-A158 PolarHBondContact O-N 3.19Å; Y155-A158 WeakPolarHBondContact O-CB 3.06Å; Y155-A158 PolarHBondContact O-N 3.45Å; A158-A160 PolarHBondContact O-N 3.25Å; A158-H161 PolarHBondContact O-N 3.1Å; A158-Y162 VanDerWaalsContact O-CB 3.3Å; A158-Y162 WeakPolarHBondContact O-CB 3.33Å; A158-Y162 PolarHBondContact O-N 2.89Å; A158-F178 HydrophobicContact CB-CE1 4.25Å; A158-F178 WeakPolarHBondContact O-CE1 3.39Å; A158-A182 HydrophobicContact CB-CB 3.69Å; A158-D223 HydrophobicContact CB-CB 3.96Å; A158-D223 VanDerWaalsContact CB-CG 3.41Å; A158-D223 WeakPolarHBondContact CB-OD1 3.48Å
159L97.9Very high97.5Very high0 Ų019 Ų190%09%0.092CC..Hα-helixtrans-58.7-48.2176.8173.863.1000110.9P110 I113 Y155 S157 Y162 Y163 L179 A321P110-L159 HydrophobicContact CB-CD2 4.26Å; P110-L159 HydrophobicContact CB-CG 4.09Å; I113-L159 HydrophobicContact CB-CD2 4.29Å; I113-L159 HydrophobicContact CD1-CD2 3.73Å; I113-L159 HydrophobicContact CG2-CD2 3.96Å; Y155-L159 HydrophobicContact CE1-CD2 4.49Å; Y155-L159 WeakPolarHBondContact O-CB 3.46Å; Y155-L159 PolarHBondContact O-N 3.46Å; S157-L159 VanDerWaalsContact C-N 3.32Å; S157-L159 PolarHBondContact O-N 2.97Å; L159-Y162 PolarHBondContact O-N 2.92Å; L159-Y163 HydrophobicContact CD1-CD2 3.52Å; L159-Y163 HydrophobicContact CD1-CE2 3.45Å; L159-Y163 VanDerWaalsContact CD1-CE2 3.45Å; L159-Y163 HydrophobicContact CG-CD2 4.33Å; L159-Y163 WeakPolarHBondContact O-CD2 3.48Å; L159-Y163 PolarHBondContact O-N 3.28Å; L159-L179 HydrophobicContact CB-CD2 4.37Å; L159-L179 HydrophobicContact CD1-CD1 4.23Å; L159-L179 HydrophobicContact CD1-CD2 3.74Å; L159-A321 HydrophobicContact CD1-CB 3.52Å; L159-A321 HydrophobicContact CD2-CB 4.14Å; L159-A321 HydrophobicContact CG-CB 4.49Å
160A97.6Very high97.5Very high0 Ų022.6 Ų22.60%011%0.105CC..Hα-helixtrans-68.2-38.7-178.600000112.8V114 G156 S157 A158 Y162 Y163 Y164 L299V114-A160 HydrophobicContact CB-CB 3.96Å; V114-A160 HydrophobicContact CG1-CB 4Å; V114-A160 HydrophobicContact CG2-CB 4.23Å; G156-A160 WeakPolarHBondContact O-CB 3.33Å; G156-A160 PolarHBondContact O-N 3.15Å; S157-A160 PolarHBondContact O-N 3.31Å; A158-A160 PolarHBondContact O-N 3.25Å; A160-Y162 VanDerWaalsContact C-N 3.35Å; A160-Y163 PolarHBondContact O-N 3.48Å; A160-Y164 HydrophobicContact CB-CD2 4.32Å; A160-Y164 PolarHBondContact O-N 3.47Å; A160-L299 HydrophobicContact CB-CD1 3.56Å; A160-L299 HydrophobicContact CB-CD2 4.03Å; A160-L299 HydrophobicContact CB-CG 4.41Å; A160-L299 WeakPolarHBondContact O-CD2 3.41Å
161H98.3Very high97.4Very high1 Ų120 Ų201%0.0059%0.089CC..Hα-helixtrans-64.6-40.3172.7-64.9149.5000112.1S157 A158 Y163 A165 I166 D223 P226 V227 Q250 Q295S157-H161 PolarHBondContact O-N 3.48Å; S157-H161 PolarHBondContact O-ND1 2.89Å; S157-H161 PolarHBondContact OG-CE1 3.35Å; S157-H161 VanDerWaalsContact OG-CE1 3.24Å; A158-H161 PolarHBondContact O-N 3.1Å; H161-Y163 VanDerWaalsContact C-N 3.25Å; H161-Y163 PolarHBondContact O-N 2.91Å; H161-A165 HydrophobicContact CB-CB 4.35Å; H161-A165 CarbonylContact O-C 3.57Å; H161-A165 WeakPolarHBondContact O-CA 3.43Å; H161-A165 WeakPolarHBondContact O-CB 3.42Å; H161-A165 PolarHBondContact O-N 2.9Å; H161-I166 PolarHBondContact O-N 3.02Å; H161-I166 VanDerWaalsContact O-N 3.14Å; H161-D223 PolarHBondContact ND1-O 3.25Å; H161-P226 HydrophobicContact CB-CB 4.32Å; H161-P226 HydrophobicContact CB-CG 4.16Å; H161-V227 HydrophobicContact CB-CG2 4.14Å; H161-V227 WeakPolarHBondContact CD2-CG2 3.4Å; H161-Q250 PolarHBondContact CE1-NE2 3.49Å; H161-Q250 PolarHBondContact NE2-NE2 2.82Å; H161-Q295 PolarHBondContact NE2-NE2 3.46Å
162Y97.4Very high97.4Very high4 Ų423.3 Ų23.32%0.01611%0.112CC..Hα-helixtrans-61.9-35.8175.4-176.2-97.1000111.9A158 L159 A160 I166 H171 V174 Q175 F178 L179 H314 L317A158-Y162 VanDerWaalsContact O-CB 3.3Å; A158-Y162 WeakPolarHBondContact O-CB 3.33Å; A158-Y162 PolarHBondContact O-N 2.89Å; L159-Y162 PolarHBondContact O-N 2.92Å; A160-Y162 VanDerWaalsContact C-N 3.35Å; Y162-I166 HydrophobicContact CD2-CD1 3.57Å; Y162-I166 HydrophobicContact CE2-CD1 3.68Å; Y162-I166 HydrophobicContact CG-CD1 4.44Å; Y162-I166 WeakPolarHBondContact O-CB 3.32Å; Y162-I166 WeakPolarHBondContact O-CG2 3.49Å; Y162-H171 AromaticContact CZ-CD2 3.75Å; Y162-H171 AromaticContact CZ-NE2 3.79Å; Y162-H171 PolarHBondContact OH-CD2 3.32Å; Y162-H171 PolarHBondContact OH-NE2 3.37Å; Y162-V174 HydrophobicContact CD2-CG2 4.48Å; Y162-V174 HydrophobicContact CE2-CG2 4.08Å; Y162-Q175 WeakPolarHBondContact OH-CA 3.25Å; Y162-Q175 VanDerWaalsContact OH-CB 3.3Å; Y162-Q175 WeakPolarHBondContact OH-CB 3.36Å; Y162-F178 HydrophobicContact CD2-CB 3.82Å; Y162-F178 AromaticContact CD2-CD1 3.38Å; Y162-F178 HydrophobicContact CD2-CD1 3.38Å; Y162-F178 HydrophobicContact CD2-CD2 4.15Å; Y162-F178 AromaticContact CD2-CE1 3.96Å; Y162-F178 HydrophobicContact CD2-CE1 3.96Å; Y162-F178 AromaticContact CD2-CG 3.5Å; Y162-F178 HydrophobicContact CD2-CG 3.5Å; Y162-F178 HydrophobicContact CE2-CB 3.79Å; Y162-F178 HydrophobicContact CE2-CD1 4.22Å; Y162-F178 HydrophobicContact CE2-CG 4Å; Y162-F178 AromaticContact CG-CD1 3.79Å; Y162-F178 HydrophobicContact CG-CD1 3.79Å; Y162-F178 HydrophobicContact CG-CE1 4.16Å; Y162-F178 HydrophobicContact CG-CG 4.36Å; Y162-L179 HydrophobicContact CD1-CD1 4.07Å; Y162-L179 HydrophobicContact CD1-CD2 4.01Å; Y162-L179 HydrophobicContact CD1-CG 4.06Å; Y162-L179 HydrophobicContact CE1-CD1 4.14Å; Y162-L179 HydrophobicContact CE1-CG 4.33Å; Y162-L179 HydrophobicContact CG-CD2 4.04Å; Y162-L179 HydrophobicContact CG-CG 4.33Å; Y162-H314 AromaticContact CD1-CE1 3.79Å; Y162-H314 AromaticContact CE1-CE1 3.49Å; Y162-H314 VanDerWaalsContact CE1-CE1 3.49Å; Y162-H314 WeakPolarHBondContact CE1-CE1 3.48Å; Y162-H314 AromaticContact CE1-ND1 3.56Å; Y162-H314 PolarHBondContact O-CE1 2.68Å; Y162-H314 PolarHBondContact O-NE2 3.27Å; Y162-L317 HydrophobicContact CE1-CD2 3.87Å
163Y95.9Very high97.3Very high0 Ų027 Ų270%014%0.138CC..Hα-helixtrans-83.8-38.9-179.3-95.9-99.4000114.7P110 L159 A160 H161 Y310 H314 L317 A318 A321P110-Y163 HydrophobicContact CB-CD1 4.41Å; P110-Y163 HydrophobicContact CB-CD2 4.26Å; P110-Y163 HydrophobicContact CB-CG 4.02Å; P110-Y163 HydrophobicContact CG-CD1 3.62Å; P110-Y163 HydrophobicContact CG-CD2 3.93Å; P110-Y163 HydrophobicContact CG-CE1 3.79Å; P110-Y163 HydrophobicContact CG-CE2 4.11Å; P110-Y163 HydrophobicContact CG-CG 3.66Å; L159-Y163 HydrophobicContact CD1-CD2 3.52Å; L159-Y163 HydrophobicContact CD1-CE2 3.45Å; L159-Y163 VanDerWaalsContact CD1-CE2 3.45Å; L159-Y163 HydrophobicContact CG-CD2 4.33Å; L159-Y163 WeakPolarHBondContact O-CD2 3.48Å; L159-Y163 PolarHBondContact O-N 3.28Å; A160-Y163 PolarHBondContact O-N 3.48Å; H161-Y163 VanDerWaalsContact C-N 3.25Å; H161-Y163 PolarHBondContact O-N 2.91Å; Y163-Y310 WeakPolarHBondContact O-CB 3.49Å; Y163-Y310 WeakPolarHBondContact O-CD1 3.48Å; Y163-H314 WeakPolarHBondContact CA-NE2 3.33Å; Y163-H314 HydrophobicContact CD1-CB 4.24Å; Y163-H314 AromaticContact CD1-CD2 3.69Å; Y163-H314 AromaticContact CD1-CG 3.93Å; Y163-H314 HydrophobicContact CE1-CB 3.72Å; Y163-H314 AromaticContact CE1-CG 3.85Å; Y163-H314 PolarHBondContact O-NE2 3.41Å; Y163-L317 HydrophobicContact CE2-CD2 4.32Å; Y163-L317 VanDerWaalsContact OH-CB 3.23Å; Y163-L317 WeakPolarHBondContact OH-CB 3.45Å; Y163-L317 WeakPolarHBondContact OH-CG 3.13Å; Y163-L317 PolarHBondContact OH-O 3Å; Y163-L317 VanDerWaalsContact OH-O 3.07Å; Y163-A318 WeakPolarHBondContact OH-CA 3.49Å; Y163-A318 PolarHBondContact OH-N 3.37Å; Y163-A321 HydrophobicContact CE2-CB 4.22Å
164Y96.4Very high97.2Very high2 Ų226 Ų261%0.00814%0.135CC..Hα-helixtrans-124.2-2.4-166.3-47.4-52.8000114.3H107 P110 L111 A160 L299 D302 F303 Y310H107-Y164 PolarHBondContact O-OH 3.25Å; P110-Y164 HydrophobicContact CB-CE2 3.86Å; P110-Y164 WeakPolarHBondContact CB-OH 3.35Å; P110-Y164 WeakPolarHBondContact CD-OH 3.49Å; L111-Y164 HydrophobicContact CB-CE2 3.83Å; L111-Y164 PolarHBondContact N-OH 2.84Å; L111-Y164 VanDerWaalsContact N-OH 3.13Å; A160-Y164 HydrophobicContact CB-CD2 4.32Å; A160-Y164 PolarHBondContact O-N 3.47Å; Y164-L299 HydrophobicContact CD2-CB 4.4Å; Y164-L299 HydrophobicContact CD2-CD2 4.15Å; Y164-D302 WeakPolarHBondContact O-CB 3.41Å; Y164-F303 HydrophobicContact CD1-CB 4.1Å; Y164-F303 HydrophobicContact CD1-CD2 4.18Å; Y164-F303 HydrophobicContact CE1-CB 4.16Å; Y164-F303 AromaticContact CE1-CD2 3.5Å; Y164-F303 HydrophobicContact CE1-CD2 3.5Å; Y164-F303 VanDerWaalsContact CE1-CD2 3.5Å; Y164-F303 HydrophobicContact CE1-CE2 4.38Å; Y164-F303 HydrophobicContact CE1-CG 4.28Å; Y164-F303 HydrophobicContact CG-CB 4.35Å; Y164-F303 AromaticContact CZ-CD2 3.81Å; Y164-Y310 VanDerWaalsContact C-CZ 3.44Å; Y164-Y310 HydrophobicContact CD1-CD2 4.01Å; Y164-Y310 HydrophobicContact CD1-CE2 4.43Å; Y164-Y310 PolarHBondContact O-OH 2.91Å
165A96.9Very high97.1Very high0 Ų030 Ų300%015%0.153CC..THydrogen-bonded Turntrans-118.6-12.6174.600000113H161 P226 V227H161-A165 HydrophobicContact CB-CB 4.35Å; H161-A165 CarbonylContact O-C 3.57Å; H161-A165 WeakPolarHBondContact O-CA 3.43Å; H161-A165 WeakPolarHBondContact O-CB 3.42Å; H161-A165 PolarHBondContact O-N 2.9Å; A165-P226 HydrophobicContact CB-CB 4.49Å; A165-V227 HydrophobicContact CB-CG2 3.83Å
166I97.1Very high96.8Very high0 Ų033.3 Ų33.30%019%0.187CC..  trans-71.4138-173.1-154.9158.9000112.6H161 Y162 W170 H171 V174 P226 L313H161-I166 PolarHBondContact O-N 3.02Å; H161-I166 VanDerWaalsContact O-N 3.14Å; Y162-I166 HydrophobicContact CD2-CD1 3.57Å; Y162-I166 HydrophobicContact CE2-CD1 3.68Å; Y162-I166 HydrophobicContact CG-CD1 4.44Å; Y162-I166 WeakPolarHBondContact O-CB 3.32Å; Y162-I166 WeakPolarHBondContact O-CG2 3.49Å; I166-W170 HydrophobicContact CG1-CB 4.14Å; I166-W170 HydrophobicContact CG1-CG 4.45Å; I166-H171 HydrophobicContact CD1-CB 3.91Å; I166-H171 HydrophobicContact CG1-CB 4.01Å; I166-H171 HydrophobicContact CG2-CB 4.29Å; I166-V174 HydrophobicContact CD1-CG2 3.89Å; I166-P226 HydrophobicContact CB-CB 4.04Å; I166-P226 HydrophobicContact CD1-CG 4.47Å; I166-P226 HydrophobicContact CG1-CB 4.09Å; I166-L313 HydrophobicContact CG2-CD1 4.02Å
167E95.9Very high96.7Very high27 Ų2738 Ų3813%0.12621%0.208CC..  trans-92.2157.7169.1-61.4-55145.500111E169 W170 H171 R230 R306E167-E169 VanDerWaalsContact C-N 3.31Å; E167-E169 PolarHBondContact O-N 3.41Å; E167-W170 PolarHBondContact O-N 3.43Å; E167-H171 WeakPolarHBondContact O-CB 3.44Å; E167-H171 PolarHBondContact O-N 2.96Å; E167-R230 HydrophobicContact CG-CB 4.14Å; E167-R230 WeakPolarHBondContact OE1-CG 3.49Å; E167-R306 IonicContact OE1-CZ 2.77Å; E167-R306 VanDerWaalsContact OE1-CZ 3.24Å; E167-R306 IonicContact OE1-NH1 2.69Å; E167-R306 PolarHBondContact OE1-NH1 2.94Å; E167-R306 IonicContact OE1-NH2 3.2Å; E167-R306 PolarHBondContact OE1-NH2 2.94Å; E167-R306 IonicContact OE2-CZ 2.76Å; E167-R306 IonicContact OE2-NH2 3.49Å; E167-R306 PolarHBondContact OE2-NH2 3.37Å
168K95.9Very high96.7Very high128 Ų12837.4 Ų37.456%0.55720%0.204SC*.Hα-helixtrans-58.4-41.1-173.8-178.3-176176-172.10112.9S172 L313K168-S172 PolarHBondContact O-N 2.93Å; K168-S172 PolarHBondContact O-OG 2.87Å; K168-L313 HydrophobicContact CG-CD2 4.34Å
169E95.6Very high96.6Very high106 Ų10638 Ų3850%0.49521%0.207SC..Hα-helixtrans-65.9-43.5-179.1-63.366.7-143.100110.4E167 S173E167-E169 VanDerWaalsContact C-N 3.31Å; E167-E169 PolarHBondContact O-N 3.41Å; E169-S173 PolarHBondContact O-N 3.4Å; E169-S173 PolarHBondContact O-OG 3Å; E169-S173 VanDerWaalsContact O-OG 3.08Å
170W97.3Very high96.6Very high75 Ų7544.1 Ų44.128%0.28424%0.235SC..Hα-helixtrans-69.1-45177.1-163.2-114.8000111.5I166 E167 S172 S173 V174 S225 H229I166-W170 HydrophobicContact CG1-CB 4.14Å; I166-W170 HydrophobicContact CG1-CG 4.45Å; E167-W170 PolarHBondContact O-N 3.43Å; W170-S172 VanDerWaalsContact C-N 3.3Å; W170-S172 PolarHBondContact O-N 3.27Å; W170-S173 WeakPolarHBondContact O-CA 3.18Å; W170-S173 WeakPolarHBondContact O-CB 3.37Å; W170-S173 PolarHBondContact O-N 3.39Å; W170-V174 HydrophobicContact CD2-CG1 4.25Å; W170-V174 HydrophobicContact CZ2-CG1 3.93Å; W170-V174 WeakPolarHBondContact O-CG2 3.37Å; W170-V174 PolarHBondContact O-N 3.37Å; W170-V174 VanDerWaalsContact O-N 3.1Å; W170-S225 PolarHBondContact NE1-OG 3.45Å; W170-S225 VanDerWaalsContact NE1-OG 3.07Å; W170-H229 HydrophobicContact CB-CB 4.29Å; W170-H229 HydrophobicContact CD2-CB 4.36Å; W170-H229 AromaticContact CE3-CD2 3.62Å; W170-H229 HydrophobicContact CG-CB 4.2Å
171H97.3Very high96.6Very high9 Ų946.4 Ų46.44%0.04225%0.249CC..Hα-helixtrans-52.8-48.5176.3-178-89.1000111.5Y162 I166 E167 S173 V174 Q175 L313 H314Y162-H171 AromaticContact CZ-CD2 3.75Å; Y162-H171 AromaticContact CZ-NE2 3.79Å; Y162-H171 PolarHBondContact OH-CD2 3.32Å; Y162-H171 PolarHBondContact OH-NE2 3.37Å; I166-H171 HydrophobicContact CD1-CB 3.91Å; I166-H171 HydrophobicContact CG1-CB 4.01Å; I166-H171 HydrophobicContact CG2-CB 4.29Å; E167-H171 WeakPolarHBondContact O-CB 3.44Å; E167-H171 PolarHBondContact O-N 2.96Å; H171-S173 PolarHBondContact O-N 3.45Å; H171-S173 VanDerWaalsContact O-N 3.13Å; H171-V174 PolarHBondContact O-N 3.47Å; H171-Q175 PolarHBondContact CE1-OE1 2.95Å; H171-Q175 VanDerWaalsContact CE1-OE1 3.32Å; H171-Q175 WeakPolarHBondContact O-CB 3.47Å; H171-Q175 WeakPolarHBondContact O-CG 3.45Å; H171-Q175 PolarHBondContact O-N 2.91Å; H171-L313 HydrophobicContact CB-CD1 4.4Å; H171-L313 HydrophobicContact CB-CD2 4.34Å; H171-L313 PolarHBondContact CE1-O 2.85Å; H171-L313 PolarHBondContact NE2-O 2.97Å; H171-H314 AromaticContact CD2-CE1 3.53Å; H171-H314 AromaticContact CD2-ND1 3.97Å; H171-H314 AromaticContact NE2-CE1 3.61Å; H171-H314 AromaticContact NE2-ND1 3.54Å
172S96.6Very high96.6Very high71 Ų7146.4 Ų46.450%0.49725%0.249SC..Hα-helixtrans-57.7-31179.4-57.70000112.8K168 W170K168-S172 PolarHBondContact O-N 2.93Å; K168-S172 PolarHBondContact O-OG 2.87Å; W170-S172 VanDerWaalsContact C-N 3.3Å; W170-S172 PolarHBondContact O-N 3.27Å
173S97Very high96.6Very high81 Ų8146.5 Ų46.557%0.56625%0.251SS*.Hα-helixtrans-82.8-32.4-178.3-55.80000113.5E169 W170 H171E169-S173 PolarHBondContact O-N 3.4Å; E169-S173 PolarHBondContact O-OG 3Å; E169-S173 VanDerWaalsContact O-OG 3.08Å; W170-S173 WeakPolarHBondContact O-CA 3.18Å; W170-S173 WeakPolarHBondContact O-CB 3.37Å; W170-S173 PolarHBondContact O-N 3.39Å; H171-S173 PolarHBondContact O-N 3.45Å; H171-S173 VanDerWaalsContact O-N 3.13Å
174V97.2Very high96.7Very high5 Ų552 Ų523%0.0328%0.275CS..Hα-helixtrans-115.2-11.5-168.5-520000115.1Y162 I166 W170 H171 G176 F177 F178Y162-V174 HydrophobicContact CD2-CG2 4.48Å; Y162-V174 HydrophobicContact CE2-CG2 4.08Å; I166-V174 HydrophobicContact CD1-CG2 3.89Å; W170-V174 HydrophobicContact CD2-CG1 4.25Å; W170-V174 HydrophobicContact CZ2-CG1 3.93Å; W170-V174 WeakPolarHBondContact O-CG2 3.37Å; W170-V174 PolarHBondContact O-N 3.37Å; W170-V174 VanDerWaalsContact O-N 3.1Å; H171-V174 PolarHBondContact O-N 3.47Å; V174-G176 PolarHBondContact O-N 3.37Å; V174-F177 HydrophobicContact CB-CE1 4.25Å; V174-F177 HydrophobicContact CB-CZ 4.02Å; V174-F177 HydrophobicContact CG1-CE1 4.45Å; V174-F177 HydrophobicContact CG1-CZ 3.97Å; V174-F177 PolarHBondContact O-N 3.15Å; V174-F178 HydrophobicContact CB-CB 4.13Å; V174-F178 HydrophobicContact CB-CD2 4.06Å; V174-F178 HydrophobicContact CG2-CB 4Å; V174-F178 HydrophobicContact CG2-CD2 3.71Å; V174-F178 HydrophobicContact CG2-CG 4.17Å; V174-F178 WeakPolarHBondContact O-CB 3.27Å; V174-F178 PolarHBondContact O-N 3.45Å
175Q94.6Very high96.8Very high109 Ų10952.7 Ų52.751%0.50928%0.279SS..THydrogen-bonded Turntrans-52.4-32.8-172.959.3-176.3-29.700115.3Y162 H171 F177Y162-Q175 WeakPolarHBondContact OH-CA 3.25Å; Y162-Q175 VanDerWaalsContact OH-CB 3.3Å; Y162-Q175 WeakPolarHBondContact OH-CB 3.36Å; H171-Q175 PolarHBondContact CE1-OE1 2.95Å; H171-Q175 VanDerWaalsContact CE1-OE1 3.32Å; H171-Q175 WeakPolarHBondContact O-CB 3.47Å; H171-Q175 WeakPolarHBondContact O-CG 3.45Å; H171-Q175 PolarHBondContact O-N 2.91Å; Q175-F177 VanDerWaalsContact C-N 3.34Å; Q175-F177 PolarHBondContact O-N 3.33Å
176G93.2Very high96.9Very high69 Ų6952.7 Ų52.771%0.71128%0.279SS*.THydrogen-bonded Turntrans-72.6-21.7-177.700000114.7V174V174-G176 PolarHBondContact O-N 3.37Å
177F95.9Very high97Very high98 Ų9856.8 Ų56.843%0.4329%0.294SS..THydrogen-bonded Turntrans-136.4-16.2-170.669.4-95000115.3V174 Q175 L179 H180 T181 L222V174-F177 HydrophobicContact CB-CE1 4.25Å; V174-F177 HydrophobicContact CB-CZ 4.02Å; V174-F177 HydrophobicContact CG1-CE1 4.45Å; V174-F177 HydrophobicContact CG1-CZ 3.97Å; V174-F177 PolarHBondContact O-N 3.15Å; Q175-F177 VanDerWaalsContact C-N 3.34Å; Q175-F177 PolarHBondContact O-N 3.33Å; F177-L179 PolarHBondContact O-N 3.2Å; F177-H180 PolarHBondContact O-N 3.02Å; F177-T181 VanDerWaalsContact O-CB 3.31Å; F177-T181 WeakPolarHBondContact O-CB 3.42Å; F177-T181 PolarHBondContact O-N 3.4Å; F177-T181 PolarHBondContact O-OG1 2.84Å; F177-L222 HydrophobicContact CE2-CD1 4.36Å
178F97.5Very high97.1Very high0 Ų057.8 Ų57.80%030%0.301CS..Hα-helixtrans-53.4-58.5-169.4-171.7-81.6000112.8A158 Y162 V174 H180 T181 A182 L222 P226A158-F178 HydrophobicContact CB-CE1 4.25Å; A158-F178 WeakPolarHBondContact O-CE1 3.39Å; Y162-F178 HydrophobicContact CD2-CB 3.82Å; Y162-F178 AromaticContact CD2-CD1 3.38Å; Y162-F178 HydrophobicContact CD2-CD1 3.38Å; Y162-F178 HydrophobicContact CD2-CD2 4.15Å; Y162-F178 AromaticContact CD2-CE1 3.96Å; Y162-F178 HydrophobicContact CD2-CE1 3.96Å; Y162-F178 AromaticContact CD2-CG 3.5Å; Y162-F178 HydrophobicContact CD2-CG 3.5Å; Y162-F178 HydrophobicContact CE2-CB 3.79Å; Y162-F178 HydrophobicContact CE2-CD1 4.22Å; Y162-F178 HydrophobicContact CE2-CG 4Å; Y162-F178 AromaticContact CG-CD1 3.79Å; Y162-F178 HydrophobicContact CG-CD1 3.79Å; Y162-F178 HydrophobicContact CG-CE1 4.16Å; Y162-F178 HydrophobicContact CG-CG 4.36Å; V174-F178 HydrophobicContact CB-CB 4.13Å; V174-F178 HydrophobicContact CB-CD2 4.06Å; V174-F178 HydrophobicContact CG2-CB 4Å; V174-F178 HydrophobicContact CG2-CD2 3.71Å; V174-F178 HydrophobicContact CG2-CG 4.17Å; V174-F178 WeakPolarHBondContact O-CB 3.27Å; V174-F178 PolarHBondContact O-N 3.45Å; F178-H180 PolarHBondContact O-N 2.92Å; F178-T181 PolarHBondContact O-N 3.26Å; F178-A182 WeakPolarHBondContact O-CB 3.34Å; F178-A182 PolarHBondContact O-N 3.04Å; F178-L222 HydrophobicContact CD2-CD1 3.74Å; F178-L222 HydrophobicContact CD2-CG 4.21Å; F178-L222 HydrophobicContact CE2-CD1 3.83Å; F178-L222 HydrophobicContact CE2-CG 3.98Å; F178-L222 VanDerWaalsContact CE2-O 3.28Å; F178-L222 WeakPolarHBondContact CE2-O 3.34Å; F178-L222 HydrophobicContact CZ-CG 4.33Å; F178-L222 WeakPolarHBondContact CZ-O 3.43Å; F178-P226 HydrophobicContact CE2-CG 3.78Å; F178-P226 HydrophobicContact CZ-CG 3.72Å
179L97Very high97.1Very high13 Ų1351.9 Ų51.97%0.06828%0.275CS..Hα-helixtrans-66.6-39.4-175-65177.5000112.7L159 Y162 F177 T181 A182 A183 L317 L324L159-L179 HydrophobicContact CB-CD2 4.37Å; L159-L179 HydrophobicContact CD1-CD1 4.23Å; L159-L179 HydrophobicContact CD1-CD2 3.74Å; Y162-L179 HydrophobicContact CD1-CD1 4.07Å; Y162-L179 HydrophobicContact CD1-CD2 4.01Å; Y162-L179 HydrophobicContact CD1-CG 4.06Å; Y162-L179 HydrophobicContact CE1-CD1 4.14Å; Y162-L179 HydrophobicContact CE1-CG 4.33Å; Y162-L179 HydrophobicContact CG-CD2 4.04Å; Y162-L179 HydrophobicContact CG-CG 4.33Å; F177-L179 PolarHBondContact O-N 3.2Å; L179-T181 VanDerWaalsContact C-N 3.34Å; L179-A182 PolarHBondContact O-N 3.04Å; L179-A183 WeakPolarHBondContact O-CB 3.5Å; L179-A183 PolarHBondContact O-N 3.46Å; L179-L317 HydrophobicContact CD1-CD2 4.14Å; L179-L324 HydrophobicContact CB-CD2 4.05Å
180H97Very high97.2Very high128 Ų12846.8 Ų46.859%0.59325%0.251SS*.Hα-helixtrans-65.1-40177-62.797.2000111.8F177 F178 A183 F184F177-H180 PolarHBondContact O-N 3.02Å; F178-H180 PolarHBondContact O-N 2.92Å; H180-A183 PolarHBondContact O-N 3.39Å; H180-F184 WeakPolarHBondContact O-CB 3.4Å; H180-F184 PolarHBondContact O-N 3.24Å
181T98.2Very high97.2Very high49 Ų4946.5 Ų46.530%0.30125%0.252SS..Hα-helixtrans-70.1-41.5177.7-52.30000110.6F177 F178 L179 A183 F184 L185 L222F177-T181 VanDerWaalsContact O-CB 3.31Å; F177-T181 WeakPolarHBondContact O-CB 3.42Å; F177-T181 PolarHBondContact O-N 3.4Å; F177-T181 PolarHBondContact O-OG1 2.84Å; F178-T181 PolarHBondContact O-N 3.26Å; L179-T181 VanDerWaalsContact C-N 3.34Å; T181-A183 PolarHBondContact O-N 3.07Å; T181-F184 PolarHBondContact O-N 2.92Å; T181-L185 HydrophobicContact CG2-CD1 3.92Å; T181-L185 HydrophobicContact CG2-CG 4.33Å; T181-L185 WeakPolarHBondContact O-CB 3.46Å; T181-L185 VanDerWaalsContact O-CG 3.28Å; T181-L185 WeakPolarHBondContact O-CG 3.45Å; T181-L185 PolarHBondContact O-N 2.83Å; T181-L222 HydrophobicContact CG2-CD2 3.71Å
182A98.3Very high97.1Very high0 Ų046.1 Ų46.10%025%0.251CS..Hα-helixtrans-60.4-44.5174.500000111.7Y155 A158 F178 L179 L185 A186 L222Y155-A182 HydrophobicContact CD2-CB 4.13Å; Y155-A182 HydrophobicContact CE2-CB 4.48Å; A158-A182 HydrophobicContact CB-CB 3.69Å; F178-A182 WeakPolarHBondContact O-CB 3.34Å; F178-A182 PolarHBondContact O-N 3.04Å; L179-A182 PolarHBondContact O-N 3.04Å; A182-L185 PolarHBondContact O-N 3.35Å; A182-A186 VanDerWaalsContact O-CB 3.3Å; A182-A186 WeakPolarHBondContact O-CB 3.4Å; A182-A186 PolarHBondContact O-N 3.08Å; A182-L222 HydrophobicContact CB-CD2 4.08Å
183A98.4Very high97Very high7 Ų743.6 Ų43.66%0.05823%0.233CC..Hα-helixtrans-60.8-46.317600000112.1Y155 L179 H180 T181 A186 W187 L324 T328Y155-A183 HydrophobicContact CD2-CB 3.91Å; Y155-A183 HydrophobicContact CE2-CB 3.74Å; L179-A183 WeakPolarHBondContact O-CB 3.5Å; L179-A183 PolarHBondContact O-N 3.46Å; H180-A183 PolarHBondContact O-N 3.39Å; T181-A183 PolarHBondContact O-N 3.07Å; A183-A186 PolarHBondContact O-N 3.45Å; A183-W187 PolarHBondContact O-N 3.4Å; A183-L324 HydrophobicContact CB-CD1 3.78Å; A183-L324 HydrophobicContact CB-CD2 3.99Å; A183-L324 HydrophobicContact CB-CG 3.85Å; A183-T328 WeakPolarHBondContact CB-OG1 3.42Å
184F98.3Very high97Very high114 Ų11439.8 Ų39.850%0.521%0.206SC..Hα-helixtrans-61.8-46176.7175-102.5000112.1H180 T181 W187 L188H180-F184 WeakPolarHBondContact O-CB 3.4Å; H180-F184 PolarHBondContact O-N 3.24Å; T181-F184 PolarHBondContact O-N 2.92Å; F184-W187 HydrophobicContact CD2-CE3 4.01Å; F184-W187 HydrophobicContact CD2-CZ3 4.19Å; F184-W187 AromaticContact CE2-CE3 3.96Å; F184-W187 HydrophobicContact CE2-CE3 3.96Å; F184-W187 AromaticContact CE2-CZ3 3.69Å; F184-W187 HydrophobicContact CE2-CZ3 3.69Å; F184-W187 HydrophobicContact CZ-CZ3 4.47Å; F184-W187 PolarHBondContact O-N 3.17Å; F184-L188 HydrophobicContact CE1-CD2 4.1Å; F184-L188 HydrophobicContact CZ-CD2 4.41Å; F184-L188 VanDerWaalsContact O-CB 3.31Å; F184-L188 WeakPolarHBondContact O-CB 3.41Å; F184-L188 PolarHBondContact O-N 3.29Å
185L98.3Very high96.8Very high18 Ų1844 Ų449%0.09422%0.222CC..Hα-helixtrans-67.4-34.3179.2-71173000112.4T181 A182 L188 T189 L218 A219 L222T181-L185 HydrophobicContact CG2-CD1 3.92Å; T181-L185 HydrophobicContact CG2-CG 4.33Å; T181-L185 WeakPolarHBondContact O-CB 3.46Å; T181-L185 VanDerWaalsContact O-CG 3.28Å; T181-L185 WeakPolarHBondContact O-CG 3.45Å; T181-L185 PolarHBondContact O-N 2.83Å; A182-L185 PolarHBondContact O-N 3.35Å; L185-L188 PolarHBondContact O-N 2.99Å; L185-T189 VanDerWaalsContact O-CB 3.31Å; L185-T189 WeakPolarHBondContact O-CB 3.44Å; L185-T189 PolarHBondContact O-N 2.95Å; L185-T189 PolarHBondContact O-OG1 2.87Å; L185-L218 HydrophobicContact CD1-CB 4.44Å; L185-L218 HydrophobicContact CD2-CB 4.19Å; L185-A219 HydrophobicContact CB-CB 3.92Å; L185-A219 HydrophobicContact CD1-CB 4.44Å; L185-L222 HydrophobicContact CD1-CD2 4.07Å
186A98.4Very high96.7Very high0 Ų038.8 Ų38.80%020%0.198CC..Hα-helixtrans-62.6-49.6171.300000111.8S151 Q154 A182 A183 L188 T189 C190 T328S151-A186 WeakPolarHBondContact CB-O 3.28Å; S151-A186 WeakPolarHBondContact O-CB 3.4Å; Q154-A186 VanDerWaalsContact NE2-CA 3.26Å; A182-A186 VanDerWaalsContact O-CB 3.3Å; A182-A186 WeakPolarHBondContact O-CB 3.4Å; A182-A186 PolarHBondContact O-N 3.08Å; A183-A186 PolarHBondContact O-N 3.45Å; A186-L188 VanDerWaalsContact C-N 3.34Å; A186-L188 PolarHBondContact O-N 3.21Å; A186-T189 WeakPolarHBondContact O-CB 3.35Å; A186-T189 PolarHBondContact O-N 3.49Å; A186-C190 PolarHBondContact O-N 3.33Å; A186-T328 HydrophobicContact CB-CG2 4Å
187W98.4Very high96.6Very high85 Ų8535.9 Ų35.932%0.32217%0.165SC..Hα-helixtrans-60.4-43.617416869.3000112.2A183 F184 T189 C190 F191 C331 T335A183-W187 PolarHBondContact O-N 3.4Å; F184-W187 HydrophobicContact CD2-CE3 4.01Å; F184-W187 HydrophobicContact CD2-CZ3 4.19Å; F184-W187 AromaticContact CE2-CE3 3.96Å; F184-W187 HydrophobicContact CE2-CE3 3.96Å; F184-W187 AromaticContact CE2-CZ3 3.69Å; F184-W187 HydrophobicContact CE2-CZ3 3.69Å; F184-W187 HydrophobicContact CZ-CZ3 4.47Å; F184-W187 PolarHBondContact O-N 3.17Å; W187-T189 VanDerWaalsContact C-N 3.29Å; W187-T189 PolarHBondContact O-N 3.24Å; W187-C190 WeakPolarHBondContact O-CB 3.44Å; W187-C190 PolarHBondContact O-N 2.78Å; W187-F191 WeakPolarHBondContact O-CB 3.38Å; W187-F191 PolarHBondContact O-N 3.35Å; W187-C331 HydrophobicContact CG-CB 4.31Å; W187-T335 PolarHBondContact NE1-OG1 2.97Å
188L97.7Very high96.4Very high49 Ų4933.4 Ų33.426%0.25715%0.154SC..Hα-helixtrans-63.6-36.5179.4-173.562.6000111.9F184 L185 A186 F191 G192 P215F184-L188 HydrophobicContact CE1-CD2 4.1Å; F184-L188 HydrophobicContact CZ-CD2 4.41Å; F184-L188 VanDerWaalsContact O-CB 3.31Å; F184-L188 WeakPolarHBondContact O-CB 3.41Å; F184-L188 PolarHBondContact O-N 3.29Å; L185-L188 PolarHBondContact O-N 2.99Å; A186-L188 VanDerWaalsContact C-N 3.34Å; A186-L188 PolarHBondContact O-N 3.21Å; L188-F191 HydrophobicContact CD1-CD1 4.5Å; L188-F191 PolarHBondContact O-N 3.36Å; L188-G192 PolarHBondContact O-N 3.25Å; L188-P215 HydrophobicContact CB-CB 4.35Å; L188-P215 HydrophobicContact CD2-CB 4.08Å; L188-P215 HydrophobicContact CD2-CG 4.05Å; L188-P215 HydrophobicContact CG-CB 3.91Å; L188-P215 HydrophobicContact CG-CG 3.9Å
189T97.3Very high96Very high3 Ų333.6 Ų33.62%0.01816%0.155CC..Hα-helixtrans-63-48.5172.6-62.50000110.9Q154 L185 A186 W187 F191 G192 C193 S216Q154-T189 PolarHBondContact NE2-OG1 3.47Å; L185-T189 VanDerWaalsContact O-CB 3.31Å; L185-T189 WeakPolarHBondContact O-CB 3.44Å; L185-T189 PolarHBondContact O-N 2.95Å; L185-T189 PolarHBondContact O-OG1 2.87Å; A186-T189 WeakPolarHBondContact O-CB 3.35Å; A186-T189 PolarHBondContact O-N 3.49Å; W187-T189 VanDerWaalsContact C-N 3.29Å; W187-T189 PolarHBondContact O-N 3.24Å; T189-F191 PolarHBondContact O-N 3.41Å; T189-G192 PolarHBondContact O-N 3.04Å; T189-C193 WeakPolarHBondContact O-CB 3.3Å; T189-C193 PolarHBondContact O-N 3.14Å; T189-C193 PolarHBondContact O-SG 3.3Å; T189-C193 VanDerWaalsContact O-SG 3.37Å; T189-S216 VanDerWaalsContact CG2-OG 3.25Å; T189-S216 WeakPolarHBondContact CG2-OG 3.43Å; T189-S216 PolarHBondContact OG1-N 3.31Å
190C98.1Very high95.3Very high0 Ų037.9 Ų37.90%017%0.17CC..Hα-helixtrans-58-48175.5-174.70000111.6S151 A186 W187 C194 C332S151-C190 VanDerWaalsContact OG-CA 3.29Å; S151-C190 WeakPolarHBondContact OG-CA 3.42Å; S151-C190 VanDerWaalsContact OG-CB 3.26Å; S151-C190 WeakPolarHBondContact OG-CB 3.46Å; S151-C190 PolarHBondContact OG-N 3.42Å; A186-C190 PolarHBondContact O-N 3.33Å; W187-C190 WeakPolarHBondContact O-CB 3.44Å; W187-C190 PolarHBondContact O-N 2.78Å; C190-C194 VanDerWaalsContact O-CB 3.31Å; C190-C194 WeakPolarHBondContact O-CB 3.38Å; C190-C194 PolarHBondContact O-N 3.49Å; C190-C194 PolarHBondContact O-SG 2.97Å; C190-C194 VanDerWaalsContact O-SG 3.35Å; C190-C332 HydrophobicContact CB-CB 4.06Å
191F96.8Very high94.4Very high69 Ų6938.9 Ų38.930%0.30318%0.175SC..Hα-helixtrans-60.2-49.6178.6173.9-94.8000111.3W187 L188 T189 C193 C194 Y195 T335W187-F191 WeakPolarHBondContact O-CB 3.38Å; W187-F191 PolarHBondContact O-N 3.35Å; L188-F191 HydrophobicContact CD1-CD1 4.5Å; L188-F191 PolarHBondContact O-N 3.36Å; T189-F191 PolarHBondContact O-N 3.41Å; F191-C193 PolarHBondContact O-N 2.95Å; F191-C194 PolarHBondContact O-N 3.37Å; F191-Y195 HydrophobicContact CZ-CD2 4.49Å; F191-Y195 HydrophobicContact CZ-CG 4.35Å; F191-Y195 WeakPolarHBondContact O-CB 3.34Å; F191-Y195 PolarHBondContact O-N 2.88Å; F191-T335 HydrophobicContact CB-CG2 4.07Å; F191-T335 HydrophobicContact CD2-CG2 3.94Å; F191-T335 HydrophobicContact CG-CG2 4.5Å
192G95.3Very high93.6Very high1 Ų142.8 Ų42.81%0.0119%0.194CC..Hα-helixtrans-59.8-44.4179.400000112.9L188 T189 G196 L211L188-G192 PolarHBondContact O-N 3.25Å; T189-G192 PolarHBondContact O-N 3.04Å; G192-G196 WeakPolarHBondContact O-CA 3.08Å; G192-G196 PolarHBondContact O-N 2.95Å; G192-L211 VanDerWaalsContact CA-O 3.32Å; G192-L211 WeakPolarHBondContact CA-O 3.31Å
193C94.9Very high92.8Very high18 Ų1844.8 Ų44.812%0.12221%0.205CC..Hα-helixtrans-65.9-50.2177.2-72.30000112.4Y147 T189 F191 K197 Q212Y147-C193 HydrophobicContact CD1-CB 3.98Å; Y147-C193 HydrophobicContact CD2-CB 3.55Å; Y147-C193 HydrophobicContact CE1-CB 4.37Å; Y147-C193 HydrophobicContact CE2-CB 3.97Å; Y147-C193 WeakPolarHBondContact CE2-O 3.15Å; Y147-C193 HydrophobicContact CG-CB 3.56Å; T189-C193 WeakPolarHBondContact O-CB 3.3Å; T189-C193 PolarHBondContact O-N 3.14Å; T189-C193 PolarHBondContact O-SG 3.3Å; T189-C193 VanDerWaalsContact O-SG 3.37Å; F191-C193 PolarHBondContact O-N 2.95Å; C193-K197 WeakPolarHBondContact O-CB 3.48Å; C193-K197 PolarHBondContact O-N 3.44Å; C193-Q212 PolarHBondContact O-NE2 3.24Å
194C95.8Very high92.2Very high0 Ų048.7 Ų48.70%023%0.229CC..Hα-helixtrans-62-52.9178.6-73.80000111.8F144 C190 F191 K197 Y198 V339F144-C194 HydrophobicContact CD1-CB 4.03Å; F144-C194 HydrophobicContact CE1-CB 4.18Å; F144-C194 WeakPolarHBondContact CE1-O 3.25Å; F144-C194 HydrophobicContact CG-CB 4.49Å; C190-C194 VanDerWaalsContact O-CB 3.31Å; C190-C194 WeakPolarHBondContact O-CB 3.38Å; C190-C194 PolarHBondContact O-N 3.49Å; C190-C194 PolarHBondContact O-SG 2.97Å; C190-C194 VanDerWaalsContact O-SG 3.35Å; F191-C194 PolarHBondContact O-N 3.37Å; C194-K197 PolarHBondContact O-N 2.97Å; C194-Y198 PolarHBondContact O-N 2.79Å; C194-V339 HydrophobicContact CB-CB 4.4Å; C194-V339 HydrophobicContact CB-CG1 4.48Å; C194-V339 HydrophobicContact CB-CG2 4.24Å
195Y93.9Very high91.3Very high94 Ų9452 Ų5237%0.36924%0.244SC..Hα-helixtrans-67.7-42.7-178.2-169-92.9000111.7F191 K197 Y198 A199 L203 L211F191-Y195 HydrophobicContact CZ-CD2 4.49Å; F191-Y195 HydrophobicContact CZ-CG 4.35Å; F191-Y195 WeakPolarHBondContact O-CB 3.34Å; F191-Y195 PolarHBondContact O-N 2.88Å; Y195-K197 VanDerWaalsContact C-N 3.29Å; Y195-K197 PolarHBondContact O-N 3.29Å; Y195-Y198 HydrophobicContact CD2-CD1 4.35Å; Y195-Y198 HydrophobicContact CE2-CD1 4.27Å; Y195-Y198 PolarHBondContact O-N 3.38Å; Y195-A199 HydrophobicContact CD1-CB 4.3Å; Y195-A199 HydrophobicContact CE1-CB 3.95Å; Y195-A199 WeakPolarHBondContact O-CB 3.36Å; Y195-A199 PolarHBondContact O-N 3.22Å; Y195-L203 HydrophobicContact CE1-CD1 4.41Å; Y195-L211 HydrophobicContact CD1-CD1 4.45Å
196G91.9Very high90.6Very high0 Ų058.7 Ų58.70%027%0.272CS..Hα-helixtrans-60-39176.900000112.3G192 R200 H208G192-G196 WeakPolarHBondContact O-CA 3.08Å; G192-G196 PolarHBondContact O-N 2.95Å; G196-R200 WeakPolarHBondContact O-CA 3.28Å; G196-R200 PolarHBondContact O-N 2.9Å; G196-R200 VanDerWaalsContact O-N 3.12Å; G196-H208 PolarHBondContact O-CE1 3.48Å; G196-H208 PolarHBondContact O-ND1 3.49Å
197K91.4Very high89.8Confident7 Ų760 Ų603%0.0328%0.283CS..Hα-helixtrans-70.8-39.1176.1-174.7155.7-168.8159.20112.3Y139 Y140 F144 Y147 C193 C194 Y195Y139-K197 WeakPolarHBondContact OH-CE 3.48Å; Y139-K197 PolarHBondContact OH-NZ 3.41Å; Y140-K197 HydrophobicContact CD1-CG 4.12Å; Y140-K197 HydrophobicContact CE1-CG 4Å; F144-K197 HydrophobicContact CE1-CB 4.17Å; F144-K197 HydrophobicContact CE1-CG 4.41Å; Y147-K197 HydrophobicContact CE2-CB 4.07Å; Y147-K197 HydrophobicContact CE2-CD 3.66Å; Y147-K197 HydrophobicContact CE2-CG 4.5Å; Y147-K197 VanDerWaalsContact OH-CD 3.22Å; Y147-K197 WeakPolarHBondContact OH-CD 3.21Å; Y147-K197 PolarHBondContact OH-NZ 3.18Å; C193-K197 WeakPolarHBondContact O-CB 3.48Å; C193-K197 PolarHBondContact O-N 3.44Å; C194-K197 PolarHBondContact O-N 2.97Å; Y195-K197 VanDerWaalsContact C-N 3.29Å; Y195-K197 PolarHBondContact O-N 3.29Å
198Y91.6Very high88.7Confident47 Ų4757.4 Ų57.418%0.18427%0.274CS..Hα-helixtrans-61.6-52.1172.9165-107.5000112.2C194 Y195 R200 V339 R342 V343C194-Y198 PolarHBondContact O-N 2.79Å; Y195-Y198 HydrophobicContact CD2-CD1 4.35Å; Y195-Y198 HydrophobicContact CE2-CD1 4.27Å; Y195-Y198 PolarHBondContact O-N 3.38Å; Y198-R200 VanDerWaalsContact C-N 3.28Å; Y198-R200 PolarHBondContact O-N 2.98Å; Y198-V339 HydrophobicContact CG-CG1 4.01Å; Y198-R342 HydrophobicContact CE2-CB 4.1Å; Y198-V343 HydrophobicContact CD2-CG2 3.54Å; Y198-V343 HydrophobicContact CE2-CG2 4.26Å; Y198-V343 HydrophobicContact CG-CG2 4.41Å
199A88.8Confident87.8Confident3 Ų361.9 Ų61.93%0.02529%0.291CS..THydrogen-bonded Turntrans-89.720.1-17500000113.3Y195 H201 D202 L203Y195-A199 HydrophobicContact CD1-CB 4.3Å; Y195-A199 HydrophobicContact CE1-CB 3.95Å; Y195-A199 WeakPolarHBondContact O-CB 3.36Å; Y195-A199 PolarHBondContact O-N 3.22Å; A199-H201 PolarHBondContact O-N 3.48Å; A199-H201 VanDerWaalsContact O-N 3.12Å; A199-D202 PolarHBondContact O-N 3.48Å; A199-L203 HydrophobicContact CB-CD1 3.51Å; A199-L203 HydrophobicContact CB-CG 3.95Å; A199-L203 WeakPolarHBondContact O-CB 3.39Å; A199-L203 PolarHBondContact O-N 3.39Å
200R81.7Confident87.2Confident104 Ų10466 Ų6639%0.39231%0.313SS..THydrogen-bonded Turntrans-54.8-34-175.8176.7-176-75.6-173-3.5113.2G196 Y198G196-R200 WeakPolarHBondContact O-CA 3.28Å; G196-R200 PolarHBondContact O-N 2.9Å; G196-R200 VanDerWaalsContact O-N 3.12Å; Y198-R200 VanDerWaalsContact C-N 3.28Å; Y198-R200 PolarHBondContact O-N 2.98Å
201H79.6Confident86.5Confident148 Ų14868.5 Ų68.569%0.68533%0.326SS*.THydrogen-bonded Turntrans-84.9-24-178.6-69.3-68.3000113.3A199A199-H201 PolarHBondContact O-N 3.48Å; A199-H201 VanDerWaalsContact O-N 3.12Å
202D81.4Confident85.9Confident132 Ų13266.9 Ų66.971%0.70632%0.319SS*.THydrogen-bonded Turntrans-96.6-24.7-174.9-51.9-45.8000112A199A199-D202 PolarHBondContact O-N 3.48Å
203L80.9Confident85.5Confident42 Ų4270 Ų7022%0.2234%0.338CS..SBendtrans-87.2136.2-178.9-76.8162.2000112.4Y195 A199 A207 L211Y195-L203 HydrophobicContact CE1-CD1 4.41Å; A199-L203 HydrophobicContact CB-CD1 3.51Å; A199-L203 HydrophobicContact CB-CG 3.95Å; A199-L203 WeakPolarHBondContact O-CB 3.39Å; A199-L203 PolarHBondContact O-N 3.39Å; L203-A207 HydrophobicContact CD2-CB 3.98Å; L203-L211 HydrophobicContact CD1-CD1 3.84Å; L203-L211 HydrophobicContact CD2-CD1 4.32Å
204P84.8Confident85.3Confident89 Ų8972.1 Ų72.158%0.57835%0.351SS*.  trans-55.2144164.6-23.232.6000111.3F206 A207 H208P204-F206 PolarHBondContact O-N 2.91Å; P204-A207 PolarHBondContact O-N 3.12Å; P204-H208 PolarHBondContact O-N 3.43Å
205K80.4Confident85.2Confident184 Ų18472.7 Ų72.780%0.835%0.354SS*.Hα-helixtrans-52-35.8-178.5-67.9-178.2-178.1174.40113.4K209K205-K209 WeakPolarHBondContact O-CG 3.49Å; K205-K209 PolarHBondContact O-N 2.97Å; K205-K209 VanDerWaalsContact O-N 3.17Å
206F82.7Confident85.2Confident157 Ų15770 Ų7069%0.68935%0.349SS*.Hα-helixtrans-66.7-48.3176.9176.3-100.6000112.1P204 H208 K209 L210P204-F206 PolarHBondContact O-N 2.91Å; F206-H208 VanDerWaalsContact C-N 3.3Å; F206-H208 PolarHBondContact O-N 2.87Å; F206-K209 PolarHBondContact O-N 3.5Å; F206-L210 WeakPolarHBondContact O-CB 3.42Å; F206-L210 PolarHBondContact O-N 2.03Å
207A82.1Confident85.4Confident27 Ų2772.2 Ų72.222%0.22337%0.368CS..Hα-helixtrans-62.6-38.2178.600000111.8L203 P204 L210 L211L203-A207 HydrophobicContact CD2-CB 3.98Å; P204-A207 PolarHBondContact O-N 3.12Å; A207-L210 PolarHBondContact O-N 3.41Å; A207-L211 WeakPolarHBondContact O-CB 3.41Å; A207-L211 WeakPolarHBondContact O-CG 3.26Å; A207-L211 PolarHBondContact O-N 3.3Å
208H75.9Confident85.6Confident31 Ų3176.4 Ų76.414%0.14439%0.39CS..Hα-helixtrans-60.5-46.2173.9-173.696.8000112.1G196 P204 F206 L211 Q212G196-H208 PolarHBondContact O-CE1 3.48Å; G196-H208 PolarHBondContact O-ND1 3.49Å; P204-H208 PolarHBondContact O-N 3.43Å; F206-H208 VanDerWaalsContact C-N 3.3Å; F206-H208 PolarHBondContact O-N 2.87Å; H208-L211 PolarHBondContact O-N 3.08Å; H208-Q212 PolarHBondContact CE1-NE2 2.9Å; H208-Q212 PolarHBondContact NE2-OE1 2.84Å; H208-Q212 WeakPolarHBondContact O-CG 3.35Å; H208-Q212 PolarHBondContact O-N 3.17Å
209K78.1Confident85.9Confident143 Ų14374.2 Ų74.262%0.62238%0.381SS*.Hα-helixtrans-64.1-41.4175.3-75.4-175176.3-169.60111.9K205 F206 L211 Q212 V213K205-K209 WeakPolarHBondContact O-CG 3.49Å; K205-K209 PolarHBondContact O-N 2.97Å; K205-K209 VanDerWaalsContact O-N 3.17Å; F206-K209 PolarHBondContact O-N 3.5Å; K209-L211 VanDerWaalsContact C-N 3.35Å; K209-L211 PolarHBondContact O-N 2.93Å; K209-Q212 PolarHBondContact O-N 3.27Å; K209-V213 VanDerWaalsContact O-CB 3.25Å; K209-V213 WeakPolarHBondContact O-CB 3.48Å; K209-V213 WeakPolarHBondContact O-CG2 3.32Å; K209-V213 PolarHBondContact O-N 2.88Å
210L84.6Confident86.3Confident90 Ų9076 Ų7647%0.47139%0.388SS..Hα-helixtrans-60.1-46178.6-169.975000111.1F206 A207 V214 P215F206-L210 WeakPolarHBondContact O-CB 3.42Å; F206-L210 PolarHBondContact O-N 2.03Å; A207-L210 PolarHBondContact O-N 3.41Å; L210-V214 HydrophobicContact CD1-CB 4.43Å; L210-V214 HydrophobicContact CD1-CG2 3.72Å; L210-V214 WeakPolarHBondContact O-CB 3.14Å; L210-V214 PolarHBondContact O-N 3.49Å; L210-P215 WeakPolarHBondContact O-CD 3.03Å
211L84.5Confident87.1Confident53 Ų5375 Ų7528%0.27740%0.396SS..Hα-helixtrans-67.4-36.6-179.3-75.9166.9000113.6G192 Y195 L203 A207 H208 K209 P215G192-L211 VanDerWaalsContact CA-O 3.32Å; G192-L211 WeakPolarHBondContact CA-O 3.31Å; Y195-L211 HydrophobicContact CD1-CD1 4.45Å; L203-L211 HydrophobicContact CD1-CD1 3.84Å; L203-L211 HydrophobicContact CD2-CD1 4.32Å; A207-L211 WeakPolarHBondContact O-CB 3.41Å; A207-L211 WeakPolarHBondContact O-CG 3.26Å; A207-L211 PolarHBondContact O-N 3.3Å; H208-L211 PolarHBondContact O-N 3.08Å; K209-L211 VanDerWaalsContact C-N 3.35Å; K209-L211 PolarHBondContact O-N 2.93Å; L211-P215 WeakPolarHBondContact O-CD 3.13Å; L211-P215 WeakPolarHBondContact O-CG 3.47Å
212Q83.6Confident88Confident34 Ų3469.1 Ų69.116%0.15937%0.369CS..Hα-helixtrans-91.4-41.9-175.2-65.6-169-16.700113.5C193 H208 K209 S216C193-Q212 PolarHBondContact O-NE2 3.24Å; H208-Q212 PolarHBondContact CE1-NE2 2.9Å; H208-Q212 PolarHBondContact NE2-OE1 2.84Å; H208-Q212 WeakPolarHBondContact O-CG 3.35Å; H208-Q212 PolarHBondContact O-N 3.17Å; K209-Q212 PolarHBondContact O-N 3.27Å; Q212-S216 PolarHBondContact O-OG 2.88Å
213V87.3Confident88.8Confident66 Ų6663.1 Ų63.140%0.434%0.337SS..Hα-helixtrans-90-40.8-168.1-177.20000111.6K209 S216 A217K209-V213 VanDerWaalsContact O-CB 3.25Å; K209-V213 WeakPolarHBondContact O-CB 3.48Å; K209-V213 WeakPolarHBondContact O-CG2 3.32Å; K209-V213 PolarHBondContact O-N 2.88Å; V213-S216 PolarHBondContact O-N 3.38Å; V213-A217 WeakPolarHBondContact O-CB 3.29Å; V213-A217 PolarHBondContact O-N 3.4Å
214V91.3Very high89.6Confident64 Ų6461.7 Ų61.739%0.38833%0.33SS..Hα-helixtrans-66.5-46.8-173.8174.40000112.8L210 S216 A217 L218L210-V214 HydrophobicContact CD1-CB 4.43Å; L210-V214 HydrophobicContact CD1-CG2 3.72Å; L210-V214 WeakPolarHBondContact O-CB 3.14Å; L210-V214 PolarHBondContact O-N 3.49Å; V214-S216 VanDerWaalsContact C-N 3.32Å; V214-S216 PolarHBondContact O-N 2.91Å; V214-A217 PolarHBondContact O-N 3.44Å; V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.15Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 WeakPolarHBondContact O-CG 3.37Å; V214-L218 PolarHBondContact O-N 2.95Å
215P93.9Very high90.2Very high11 Ų1158.3 Ų58.37%0.07131%0.308CS..Hα-helixtrans-57.4-44.9175.7-27.237000112.7L188 L210 L211 A217 L218 A219L188-P215 HydrophobicContact CB-CB 4.35Å; L188-P215 HydrophobicContact CD2-CB 4.08Å; L188-P215 HydrophobicContact CD2-CG 4.05Å; L188-P215 HydrophobicContact CG-CB 3.91Å; L188-P215 HydrophobicContact CG-CG 3.9Å; L210-P215 WeakPolarHBondContact O-CD 3.03Å; L211-P215 WeakPolarHBondContact O-CD 3.13Å; L211-P215 WeakPolarHBondContact O-CG 3.47Å; P215-A217 PolarHBondContact O-N 3.17Å; P215-L218 PolarHBondContact O-N 3.28Å; P215-A219 WeakPolarHBondContact O-CB 3.39Å; P215-A219 PolarHBondContact O-N 2.95Å
216S93.6Very high91.1Very high37 Ų3749.6 Ų49.626%0.25927%0.27SS..Hα-helixtrans-63-40.6178.4-490000112.2T189 Q212 V213 V214 Y220T189-S216 VanDerWaalsContact CG2-OG 3.25Å; T189-S216 WeakPolarHBondContact CG2-OG 3.43Å; T189-S216 PolarHBondContact OG1-N 3.31Å; Q212-S216 PolarHBondContact O-OG 2.88Å; V213-S216 PolarHBondContact O-N 3.38Å; V214-S216 VanDerWaalsContact C-N 3.32Å; V214-S216 PolarHBondContact O-N 2.91Å; S216-Y220 WeakPolarHBondContact O-CB 3.46Å; S216-Y220 PolarHBondContact O-N 3.08Å
217A95.1Very high91.8Very high48 Ų4842.1 Ų42.140%0.39724%0.237SC..Hα-helixtrans-68.9-43.3178.200000112.1V213 V214 P215 A219 Y220 C221V213-A217 WeakPolarHBondContact O-CB 3.29Å; V213-A217 PolarHBondContact O-N 3.4Å; V214-A217 PolarHBondContact O-N 3.44Å; P215-A217 PolarHBondContact O-N 3.17Å; A217-A219 VanDerWaalsContact C-N 3.33Å; A217-Y220 PolarHBondContact O-N 3.41Å; A217-C221 PolarHBondContact O-N 3.49Å; A217-C221 PolarHBondContact O-SG 2.82Å
218L96.9Very high92.5Very high95 Ų9544.3 Ų44.350%0.49725%0.248SC..Hα-helixtrans-63.7-40.6175.3-70.4175.5000111.4L185 V214 P215 C221 L222L185-L218 HydrophobicContact CD1-CB 4.44Å; L185-L218 HydrophobicContact CD2-CB 4.19Å; V214-L218 HydrophobicContact CG1-CD1 3.83Å; V214-L218 HydrophobicContact CG1-CG 4.15Å; V214-L218 WeakPolarHBondContact O-CB 3.42Å; V214-L218 WeakPolarHBondContact O-CG 3.37Å; V214-L218 PolarHBondContact O-N 2.95Å; P215-L218 PolarHBondContact O-N 3.28Å; L218-C221 PolarHBondContact O-N 2.93Å; L218-L222 PolarHBondContact O-N 3.42Å; L218-L222 VanDerWaalsContact O-N 3.12Å
219A97.1Very high93.6Very high0 Ų044.8 Ų44.80%025%0.25CC..Hα-helixtrans-59.6-51.8173.900000111.1Q154 L185 P215 A217 C221 L222 D223Q154-A219 HydrophobicContact CG-CB 4.06Å; L185-A219 HydrophobicContact CB-CB 3.92Å; L185-A219 HydrophobicContact CD1-CB 4.44Å; P215-A219 WeakPolarHBondContact O-CB 3.39Å; P215-A219 PolarHBondContact O-N 2.95Å; A217-A219 VanDerWaalsContact C-N 3.33Å; A219-C221 VanDerWaalsContact C-N 3.3Å; A219-C221 PolarHBondContact O-N 3.4Å; A219-L222 WeakPolarHBondContact O-CB 3.42Å; A219-L222 PolarHBondContact O-N 3.22Å; A219-D223 WeakPolarHBondContact O-CB 3.17Å; A219-D223 PolarHBondContact O-N 3.37Å
220Y97.3Very high94.4Very high41 Ų4138.1 Ų38.116%0.16122%0.221CC..Hα-helixtrans-56.5-44.2178.4179.4-108.5000112.4S216 A217 L222 D223 I224 F254 L255S216-Y220 WeakPolarHBondContact O-CB 3.46Å; S216-Y220 PolarHBondContact O-N 3.08Å; A217-Y220 PolarHBondContact O-N 3.41Å; Y220-L222 VanDerWaalsContact C-N 3.3Å; Y220-L222 PolarHBondContact O-N 2.99Å; Y220-D223 PolarHBondContact O-N 2.93Å; Y220-I224 HydrophobicContact CD1-CG2 4.43Å; Y220-I224 HydrophobicContact CD2-CB 4.38Å; Y220-I224 HydrophobicContact CE1-CG2 4.11Å; Y220-I224 HydrophobicContact CE2-CB 3.97Å; Y220-I224 HydrophobicContact CE2-CD1 4.22Å; Y220-I224 HydrophobicContact CE2-CG1 4.08Å; Y220-I224 HydrophobicContact CE2-CG2 4.44Å; Y220-I224 WeakPolarHBondContact O-CB 3.46Å; Y220-I224 WeakPolarHBondContact O-CG2 3.26Å; Y220-I224 PolarHBondContact O-N 2.95Å; Y220-F254 HydrophobicContact CD1-CD1 4.12Å; Y220-F254 AromaticContact CD1-CE1 3.65Å; Y220-F254 HydrophobicContact CD1-CE1 3.65Å; Y220-F254 HydrophobicContact CD1-CZ 4.44Å; Y220-F254 AromaticContact CD2-CD1 3.63Å; Y220-F254 HydrophobicContact CD2-CD1 3.63Å; Y220-F254 HydrophobicContact CD2-CD2 4.26Å; Y220-F254 AromaticContact CD2-CE1 3.21Å; Y220-F254 HydrophobicContact CD2-CE1 3.21Å; Y220-F254 AromaticContact CD2-CE2 3.9Å; Y220-F254 HydrophobicContact CD2-CE2 3.9Å; Y220-F254 HydrophobicContact CD2-CG 4.13Å; Y220-F254 AromaticContact CD2-CZ 3.35Å; Y220-F254 HydrophobicContact CD2-CZ 3.35Å; Y220-F254 AromaticContact CE1-CD1 3.69Å; Y220-F254 HydrophobicContact CE1-CD1 3.69Å; Y220-F254 AromaticContact CE1-CE1 3.72Å; Y220-F254 HydrophobicContact CE1-CE1 3.72Å; Y220-F254 HydrophobicContact CE2-CB 4.21Å; Y220-F254 AromaticContact CE2-CD1 3.14Å; Y220-F254 HydrophobicContact CE2-CD1 3.14Å; Y220-F254 AromaticContact CE2-CD2 3.94Å; Y220-F254 HydrophobicContact CE2-CD2 3.94Å; Y220-F254 AromaticContact CE2-CE1 3.3Å; Y220-F254 HydrophobicContact CE2-CE1 3.3Å; Y220-F254 HydrophobicContact CE2-CE2 4.07Å; Y220-F254 AromaticContact CE2-CG 3.48Å; Y220-F254 HydrophobicContact CE2-CG 3.48Å; Y220-F254 VanDerWaalsContact CE2-CG 3.48Å; Y220-F254 AromaticContact CE2-CZ 3.76Å; Y220-F254 HydrophobicContact CE2-CZ 3.76Å; Y220-F254 HydrophobicContact CG-CD1 4.08Å; Y220-F254 AromaticContact CG-CE1 3.38Å; Y220-F254 HydrophobicContact CG-CE1 3.38Å; Y220-F254 AromaticContact CG-CZ 3.73Å; Y220-F254 HydrophobicContact CG-CZ 3.73Å; Y220-F254 AromaticContact CZ-CD1 3.16Å; Y220-F254 AromaticContact CZ-CE1 3.55Å; Y220-F254 AromaticContact CZ-CG 3.81Å; Y220-F254 WeakPolarHBondContact OH-CD1 3.47Å; Y220-L255 HydrophobicContact CE1-CD2 4.15Å
221C98Very high95Very high83 Ų8335.7 Ų35.756%0.56121%0.208SC*.Hα-helixtrans-58-40.4176.6-71.70000112.8A217 L218 A219A217-C221 PolarHBondContact O-N 3.49Å; A217-C221 PolarHBondContact O-SG 2.82Å; L218-C221 PolarHBondContact O-N 2.93Å; A219-C221 VanDerWaalsContact C-N 3.3Å; A219-C221 PolarHBondContact O-N 3.4Å
222L98.3Very high95.6Very high24 Ų2440 Ų4013%0.12622%0.221CC..Hα-helixtrans-70.4-53175.5179.968.1000110.8F177 F178 T181 A182 L185 L218 A219 Y220 I224 S225F177-L222 HydrophobicContact CE2-CD1 4.36Å; F178-L222 HydrophobicContact CD2-CD1 3.74Å; F178-L222 HydrophobicContact CD2-CG 4.21Å; F178-L222 HydrophobicContact CE2-CD1 3.83Å; F178-L222 HydrophobicContact CE2-CG 3.98Å; F178-L222 VanDerWaalsContact CE2-O 3.28Å; F178-L222 WeakPolarHBondContact CE2-O 3.34Å; F178-L222 HydrophobicContact CZ-CG 4.33Å; F178-L222 WeakPolarHBondContact CZ-O 3.43Å; T181-L222 HydrophobicContact CG2-CD2 3.71Å; A182-L222 HydrophobicContact CB-CD2 4.08Å; L185-L222 HydrophobicContact CD1-CD2 4.07Å; L218-L222 PolarHBondContact O-N 3.42Å; L218-L222 VanDerWaalsContact O-N 3.12Å; A219-L222 WeakPolarHBondContact O-CB 3.42Å; A219-L222 PolarHBondContact O-N 3.22Å; Y220-L222 VanDerWaalsContact C-N 3.3Å; Y220-L222 PolarHBondContact O-N 2.99Å; L222-I224 VanDerWaalsContact C-N 3.3Å; L222-I224 PolarHBondContact O-N 3.23Å; L222-S225 VanDerWaalsContact O-CB 3.32Å; L222-S225 WeakPolarHBondContact O-CB 3.29Å; L222-S225 PolarHBondContact O-N 3.46Å; L222-S225 PolarHBondContact O-OG 3.48Å
223D97.8Very high96.1Very high7 Ų739.1 Ų39.14%0.03722%0.219CC..Hα-helixtrans-63.1-34.8-171.1-61.9-8000112.3Q154 A158 H161 A219 Y220 P226Q154-D223 WeakPolarHBondContact CG-OD2 3.4Å; A158-D223 HydrophobicContact CB-CB 3.96Å; A158-D223 VanDerWaalsContact CB-CG 3.41Å; A158-D223 WeakPolarHBondContact CB-OD1 3.48Å; H161-D223 PolarHBondContact ND1-O 3.25Å; A219-D223 WeakPolarHBondContact O-CB 3.17Å; A219-D223 PolarHBondContact O-N 3.37Å; Y220-D223 PolarHBondContact O-N 2.93Å; D223-P226 WeakPolarHBondContact O-CD 3.35Å
224I98.1Very high96.4Very high12 Ų1236.8 Ų36.86%0.06221%0.205CC..THydrogen-bonded Turntrans-86.2-11.6179.1-153.262.4000113Y220 L222 P226 V227 V228 V251Y220-I224 HydrophobicContact CD1-CG2 4.43Å; Y220-I224 HydrophobicContact CD2-CB 4.38Å; Y220-I224 HydrophobicContact CE1-CG2 4.11Å; Y220-I224 HydrophobicContact CE2-CB 3.97Å; Y220-I224 HydrophobicContact CE2-CD1 4.22Å; Y220-I224 HydrophobicContact CE2-CG1 4.08Å; Y220-I224 HydrophobicContact CE2-CG2 4.44Å; Y220-I224 WeakPolarHBondContact O-CB 3.46Å; Y220-I224 WeakPolarHBondContact O-CG2 3.26Å; Y220-I224 PolarHBondContact O-N 2.95Å; L222-I224 VanDerWaalsContact C-N 3.3Å; L222-I224 PolarHBondContact O-N 3.23Å; I224-P226 VanDerWaalsContact C-CD 3.43Å; I224-V227 HydrophobicContact CD1-CB 3.93Å; I224-V227 HydrophobicContact CD1-CG1 4.15Å; I224-V227 HydrophobicContact CD1-CG2 4.14Å; I224-V227 HydrophobicContact CG1-CB 4.31Å; I224-V227 WeakPolarHBondContact O-CB 3.36Å; I224-V227 PolarHBondContact O-N 2.98Å; I224-V227 VanDerWaalsContact O-N 3.07Å; I224-V228 HydrophobicContact CG1-CG2 4.16Å; I224-V228 HydrophobicContact CG2-CG2 4.06Å; I224-V228 PolarHBondContact O-N 3.49Å; I224-V251 HydrophobicContact CD1-CG2 3.86Å; I224-V251 HydrophobicContact CG1-CG2 3.83Å
225S98.3Very high96.5Very high18 Ų1843 Ų4313%0.12622%0.223CC..Hα-helixtrans-58.4-37.8-175.568.50000114.8W170 L222 V227 V228 H229W170-S225 PolarHBondContact NE1-OG 3.45Å; W170-S225 VanDerWaalsContact NE1-OG 3.07Å; L222-S225 VanDerWaalsContact O-CB 3.32Å; L222-S225 WeakPolarHBondContact O-CB 3.29Å; L222-S225 PolarHBondContact O-N 3.46Å; L222-S225 PolarHBondContact O-OG 3.48Å; S225-V227 VanDerWaalsContact C-N 3.33Å; S225-V227 PolarHBondContact O-N 2.92Å; S225-V228 PolarHBondContact O-N 3.07Å; S225-H229 WeakPolarHBondContact O-CB 3.37Å; S225-H229 PolarHBondContact O-N 3.46Å
226P98.2Very high96.5Very high0 Ų051.6 Ų51.60%025%0.254CS..Hα-helixtrans-62.9-41.1174.4-20.635000112H161 A165 I166 F178 D223 I224 H229 R230H161-P226 HydrophobicContact CB-CB 4.32Å; H161-P226 HydrophobicContact CB-CG 4.16Å; A165-P226 HydrophobicContact CB-CB 4.49Å; I166-P226 HydrophobicContact CB-CB 4.04Å; I166-P226 HydrophobicContact CD1-CG 4.47Å; I166-P226 HydrophobicContact CG1-CB 4.09Å; F178-P226 HydrophobicContact CE2-CG 3.78Å; F178-P226 HydrophobicContact CZ-CG 3.72Å; D223-P226 WeakPolarHBondContact O-CD 3.35Å; I224-P226 VanDerWaalsContact C-CD 3.43Å; P226-H229 PolarHBondContact O-N 3.31Å; P226-R230 WeakPolarHBondContact O-CB 3.32Å; P226-R230 PolarHBondContact O-N 2.87Å
227V98.2Very high96.4Very high0 Ų056.9 Ų56.90%028%0.275CS..Hα-helixtrans-65.7-47.3179.51770000111.1H161 A165 I224 S225 H229 R230 I231 H247 V251H161-V227 HydrophobicContact CB-CG2 4.14Å; H161-V227 WeakPolarHBondContact CD2-CG2 3.4Å; A165-V227 HydrophobicContact CB-CG2 3.83Å; I224-V227 HydrophobicContact CD1-CB 3.93Å; I224-V227 HydrophobicContact CD1-CG1 4.15Å; I224-V227 HydrophobicContact CD1-CG2 4.14Å; I224-V227 HydrophobicContact CG1-CB 4.31Å; I224-V227 WeakPolarHBondContact O-CB 3.36Å; I224-V227 PolarHBondContact O-N 2.98Å; I224-V227 VanDerWaalsContact O-N 3.07Å; S225-V227 VanDerWaalsContact C-N 3.33Å; S225-V227 PolarHBondContact O-N 2.92Å; V227-H229 VanDerWaalsContact C-N 3.33Å; V227-H229 PolarHBondContact O-N 2.93Å; V227-R230 PolarHBondContact O-N 3.43Å; V227-I231 HydrophobicContact CG1-CD1 3.93Å; V227-I231 VanDerWaalsContact O-CG1 3.31Å; V227-I231 WeakPolarHBondContact O-CG1 3.28Å; V227-I231 PolarHBondContact O-N 2.72Å; V227-H247 HydrophobicContact CG1-CB 3.62Å; V227-V251 HydrophobicContact CG1-CG2 4.33Å
228V97.8Very high96.1Very high73 Ų7357.4 Ų57.444%0.44229%0.286SS..Hα-helixtrans-61.6-43.5177.6171.40000110.9I224 S225 I231 Y232I224-V228 HydrophobicContact CG1-CG2 4.16Å; I224-V228 HydrophobicContact CG2-CG2 4.06Å; I224-V228 PolarHBondContact O-N 3.49Å; S225-V228 PolarHBondContact O-N 3.07Å; V228-I231 PolarHBondContact O-N 3.2Å; V228-Y232 WeakPolarHBondContact O-CB 3.5Å; V228-Y232 PolarHBondContact O-N 3.25Å
229H97.6Very high95.7Very high41 Ų4155.3 Ų55.319%0.1928%0.278CS..Hα-helixtrans-61.3-44.9176.3-173.5-74.3000111.2W170 S225 P226 V227 I231 Y232 S233W170-H229 HydrophobicContact CB-CB 4.29Å; W170-H229 HydrophobicContact CD2-CB 4.36Å; W170-H229 AromaticContact CE3-CD2 3.62Å; W170-H229 HydrophobicContact CG-CB 4.2Å; S225-H229 WeakPolarHBondContact O-CB 3.37Å; S225-H229 PolarHBondContact O-N 3.46Å; P226-H229 PolarHBondContact O-N 3.31Å; V227-H229 VanDerWaalsContact C-N 3.33Å; V227-H229 PolarHBondContact O-N 2.93Å; H229-I231 PolarHBondContact O-N 3.06Å; H229-Y232 PolarHBondContact O-N 2.97Å; H229-S233 PolarHBondContact CE1-OG 3.07Å; H229-S233 PolarHBondContact ND1-OG 3.21Å; H229-S233 WeakPolarHBondContact O-CB 3.39Å; H229-S233 PolarHBondContact O-N 3.08Å; H229-S233 PolarHBondContact O-OG 2.91Å
230R96Very high95.1Very high4 Ų461.1 Ų61.12%0.01532%0.319CS..Hα-helixtrans-59.9-45.4176.2175.5174.5178.7165.1-3.2113E167 P226 V227 Y232 S233 C234 D241 D302E167-R230 HydrophobicContact CG-CB 4.14Å; E167-R230 WeakPolarHBondContact OE1-CG 3.49Å; P226-R230 WeakPolarHBondContact O-CB 3.32Å; P226-R230 PolarHBondContact O-N 2.87Å; V227-R230 PolarHBondContact O-N 3.43Å; R230-Y232 VanDerWaalsContact C-N 3.28Å; R230-Y232 PolarHBondContact O-N 3.33Å; R230-S233 PolarHBondContact O-N 2.87Å; R230-C234 WeakPolarHBondContact O-CB 3.47Å; R230-C234 PolarHBondContact O-N 3.34Å; R230-D241 IonicContact CZ-OD2 3.24Å; R230-D241 IonicContact NH2-OD2 2.73Å; R230-D241 PolarHBondContact NH2-OD2 2.85Å; R230-D302 IonicContact CZ-OD1 3.46Å; R230-D302 IonicContact CZ-OD2 3.48Å; R230-D302 IonicContact NH1-OD1 2.72Å; R230-D302 PolarHBondContact NH1-OD1 3.36Å; R230-D302 IonicContact NH1-OD2 3.29Å; R230-D302 PolarHBondContact NH1-OD2 3.47Å; R230-D302 IonicContact NH2-OD1 3.96Å; R230-D302 PolarHBondContact NH2-OD1 3.26Å; R230-D302 IonicContact NH2-OD2 3.06Å
231I96.9Very high94.7Very high39 Ų3961 Ų6120%0.232%0.321CS..Hα-helixtrans-58-45.5176.2-67.3163.5000109.8V227 V228 H229 Y235 V244 H247 V248 V251V227-I231 HydrophobicContact CG1-CD1 3.93Å; V227-I231 VanDerWaalsContact O-CG1 3.31Å; V227-I231 WeakPolarHBondContact O-CG1 3.28Å; V227-I231 PolarHBondContact O-N 2.72Å; V228-I231 PolarHBondContact O-N 3.2Å; H229-I231 PolarHBondContact O-N 3.06Å; I231-Y235 WeakPolarHBondContact O-CB 3.43Å; I231-Y235 PolarHBondContact O-N 3.12Å; I231-Y235 VanDerWaalsContact O-N 3.08Å; I231-V244 HydrophobicContact CB-CG1 4.36Å; I231-V244 HydrophobicContact CG1-CG1 4.01Å; I231-V244 HydrophobicContact CG2-CG1 4.46Å; I231-H247 HydrophobicContact CD1-CB 4.09Å; I231-H247 HydrophobicContact CG1-CB 4.11Å; I231-V248 HydrophobicContact CD1-CG2 3.91Å; I231-V248 HydrophobicContact CG1-CG2 4.05Å; I231-V248 HydrophobicContact CG2-CG2 3.92Å; I231-V251 HydrophobicContact CD1-CG2 4.38Å
232Y96.2Very high94.4Very high142 Ų14261.2 Ų61.256%0.55732%0.322SS*.Hα-helixtrans-64.6-48.1179.1-179.5-94.8000112.5V228 H229 R230 C234 Y235 W236V228-Y232 WeakPolarHBondContact O-CB 3.5Å; V228-Y232 PolarHBondContact O-N 3.25Å; H229-Y232 PolarHBondContact O-N 2.97Å; R230-Y232 VanDerWaalsContact C-N 3.28Å; R230-Y232 PolarHBondContact O-N 3.33Å; Y232-C234 PolarHBondContact O-N 2.79Å; Y232-Y235 PolarHBondContact O-N 3.04Å; Y232-W236 WeakPolarHBondContact O-CB 3.44Å; Y232-W236 PolarHBondContact O-N 3.49Å
233S94.4Very high94.2Very high17 Ų1760.9 Ų60.912%0.11932%0.319CS..Hα-helixtrans-58.1-48177.1-70.80000111.6H229 R230 Y235 W236 E237H229-S233 PolarHBondContact CE1-OG 3.07Å; H229-S233 PolarHBondContact ND1-OG 3.21Å; H229-S233 WeakPolarHBondContact O-CB 3.39Å; H229-S233 PolarHBondContact O-N 3.08Å; H229-S233 PolarHBondContact O-OG 2.91Å; R230-S233 PolarHBondContact O-N 2.87Å; S233-Y235 PolarHBondContact O-N 2.88Å; S233-W236 PolarHBondContact O-N 3.44Å; S233-E237 WeakPolarHBondContact O-CB 3.32Å; S233-E237 WeakPolarHBondContact O-CG 3.31Å; S233-E237 PolarHBondContact O-N 2.86Å
234C93.9Very high94Very high16 Ų1661.1 Ų61.111%0.10832%0.321CS..Hα-helixtrans-59.9-45.3178.1174.70000112.2R230 Y232 W236 E237 G238 C239 V244R230-C234 WeakPolarHBondContact O-CB 3.47Å; R230-C234 PolarHBondContact O-N 3.34Å; Y232-C234 PolarHBondContact O-N 2.79Å; C234-W236 PolarHBondContact O-N 2.66Å; C234-E237 PolarHBondContact O-N 3.35Å; C234-G238 PolarHBondContact O-N 3.19Å; C234-G238 VanDerWaalsContact O-N 3.12Å; C234-C239 HydrophobicContact CB-CB 3.9Å; C234-C239 WeakPolarHBondContact CB-SG 3.35Å; C234-C239 WeakPolarHBondContact O-CB 3.31Å; C234-C239 PolarHBondContact O-N 3.33Å; C234-C239 WeakPolarHBondContact SG-CB 3.17Å; C234-C239 CovalentContact SG-SG 2.03Å; C234-C239 PolarHBondContact SG-SG 3.42Å; C234-V244 HydrophobicContact CB-CG1 4.27Å; C234-V244 HydrophobicContact CB-CG2 3.92Å
235Y93.3Very high93.9Very high195 Ų19568 Ų6877%0.76535%0.346SS*.Hα-helixtrans-62.4-43.6178.5179.3-96.5000111.9I231 Y232 S233 G238I231-Y235 WeakPolarHBondContact O-CB 3.43Å; I231-Y235 PolarHBondContact O-N 3.12Å; I231-Y235 VanDerWaalsContact O-N 3.08Å; Y232-Y235 PolarHBondContact O-N 3.04Å; S233-Y235 PolarHBondContact O-N 2.88Å; Y235-G238 PolarHBondContact O-N 2.74Å
236W93.1Very high93.9Very high191 Ų19171.2 Ų71.272%0.72336%0.357SS*.Hα-helixtrans-67.1-39-179.3-173.6-99.8000112.9Y232 S233 C234 G238Y232-W236 WeakPolarHBondContact O-CB 3.44Å; Y232-W236 PolarHBondContact O-N 3.49Å; S233-W236 PolarHBondContact O-N 3.44Å; C234-W236 PolarHBondContact O-N 2.66Å; W236-G238 VanDerWaalsContact C-N 3.29Å; W236-G238 PolarHBondContact O-N 3Å
237E92.5Very high93.8Very high148 Ų14871.2 Ų71.269%0.69236%0.357SS*.Hα-helixtrans-81.8-5.8-179.8-67.8174.6-169.900113.4S233 C234 C239S233-E237 WeakPolarHBondContact O-CB 3.32Å; S233-E237 WeakPolarHBondContact O-CG 3.31Å; S233-E237 PolarHBondContact O-N 2.86Å; C234-E237 PolarHBondContact O-N 3.35Å; E237-C239 VanDerWaalsContact C-N 3.33Å
238G89.4Confident93.8Very high60 Ų6072.7 Ų72.762%0.61937%0.365SS*.THydrogen-bonded Turntrans68.133.3-175.500000112.7C234 Y235 W236C234-G238 PolarHBondContact O-N 3.19Å; C234-G238 VanDerWaalsContact O-N 3.12Å; Y235-G238 PolarHBondContact O-N 2.74Å; W236-G238 VanDerWaalsContact C-N 3.29Å; W236-G238 PolarHBondContact O-N 3Å
239C87.1Confident93.7Very high50 Ų5074.5 Ų74.534%0.33837%0.365SS..  trans-68.7144.7-176.9117.60000111.6C234 E237 D241C234-C239 HydrophobicContact CB-CB 3.9Å; C234-C239 WeakPolarHBondContact CB-SG 3.35Å; C234-C239 WeakPolarHBondContact O-CB 3.31Å; C234-C239 PolarHBondContact O-N 3.33Å; C234-C239 WeakPolarHBondContact SG-CB 3.17Å; C234-C239 CovalentContact SG-SG 2.03Å; C234-C239 PolarHBondContact SG-SG 3.42Å; E237-C239 VanDerWaalsContact C-N 3.33Å; C239-D241 VanDerWaalsContact SG-CB 3.56Å
240S85.7Confident93.7Very high123 Ų12372.8 Ų72.886%0.8636%0.357SS*.  trans-10831179.5-61.50000112.3P242S240-P242 VanDerWaalsContact O-CD 3.27Å; S240-P242 WeakPolarHBondContact O-CD 3.28Å
241D88.8Confident93.8Very high38 Ų3873.9 Ų73.920%0.20336%0.364CS..  trans-75110.9178178.61.1000110.2R230 C239 I243 V244R230-D241 IonicContact CZ-OD2 3.24Å; R230-D241 IonicContact NH2-OD2 2.73Å; R230-D241 PolarHBondContact NH2-OD2 2.85Å; C239-D241 VanDerWaalsContact SG-CB 3.56Å; D241-I243 PolarHBondContact O-N 3.4Å; D241-I243 VanDerWaalsContact OD1-CB 3.26Å; D241-I243 WeakPolarHBondContact OD1-CB 3.39Å; D241-I243 WeakPolarHBondContact OD1-CG1 3.44Å; D241-I243 PolarHBondContact OD1-N 3.48Å; D241-V244 HydrophobicContact CB-CG2 4.01Å; D241-V244 PolarHBondContact O-N 3.28Å
242P89.9Confident93.9Very high88 Ų8875.7 Ų75.757%0.57137%0.373SS*.THydrogen-bonded Turntrans-65.9-21.5-179.329.2-34.9000112.8S240 V244 W245S240-P242 VanDerWaalsContact O-CD 3.27Å; S240-P242 WeakPolarHBondContact O-CD 3.28Å; P242-V244 VanDerWaalsContact C-N 3.27Å; P242-V244 PolarHBondContact O-N 3.43Å; P242-W245 WeakPolarHBondContact O-CB 3.39Å; P242-W245 PolarHBondContact O-N 3.35Å
243I94.6Very high94Very high16 Ų1671.4 Ų71.48%0.08236%0.358CS..THydrogen-bonded Turntrans-71.4-24.7-177.7-56.3-54.4000111.9D241 W245 Y246 H247 A298 T301D241-I243 PolarHBondContact O-N 3.4Å; D241-I243 VanDerWaalsContact OD1-CB 3.26Å; D241-I243 WeakPolarHBondContact OD1-CB 3.39Å; D241-I243 WeakPolarHBondContact OD1-CG1 3.44Å; D241-I243 PolarHBondContact OD1-N 3.48Å; I243-W245 PolarHBondContact O-N 3.04Å; I243-W245 VanDerWaalsContact O-N 3.14Å; I243-Y246 WeakPolarHBondContact O-CB 3.31Å; I243-Y246 PolarHBondContact O-N 2.99Å; I243-H247 PolarHBondContact O-N 2.89Å; I243-A298 HydrophobicContact CG2-CB 3.95Å; I243-T301 HydrophobicContact CD1-CG2 3.63Å; I243-T301 HydrophobicContact CG1-CG2 3.67Å
244V95Very high94.1Very high13 Ų1373.6 Ų73.68%0.07937%0.365CS..Hα-helixtrans-58.4-29.1173.6175.40000111.7I231 C234 D241 P242 Y246 H247 V248I231-V244 HydrophobicContact CB-CG1 4.36Å; I231-V244 HydrophobicContact CG1-CG1 4.01Å; I231-V244 HydrophobicContact CG2-CG1 4.46Å; C234-V244 HydrophobicContact CB-CG1 4.27Å; C234-V244 HydrophobicContact CB-CG2 3.92Å; D241-V244 HydrophobicContact CB-CG2 4.01Å; D241-V244 PolarHBondContact O-N 3.28Å; P242-V244 VanDerWaalsContact C-N 3.27Å; P242-V244 PolarHBondContact O-N 3.43Å; V244-Y246 PolarHBondContact O-N 3.33Å; V244-H247 WeakPolarHBondContact O-CB 3.5Å; V244-H247 PolarHBondContact O-N 3.42Å; V244-V248 WeakPolarHBondContact O-CG2 3.45Å; V244-V248 PolarHBondContact O-N 3.4Å
245W95.4Very high94.3Very high155 Ų15577.5 Ų77.559%0.58739%0.385SS*.Hα-helixtrans-67.7-33.7174.8-71.6109.2000113.3P242 I243 H247 V248 Y249P242-W245 WeakPolarHBondContact O-CB 3.39Å; P242-W245 PolarHBondContact O-N 3.35Å; I243-W245 PolarHBondContact O-N 3.04Å; I243-W245 VanDerWaalsContact O-N 3.14Å; W245-H247 VanDerWaalsContact C-N 3.33Å; W245-V248 HydrophobicContact CE3-CB 4.23Å; W245-V248 HydrophobicContact CE3-CG1 4.23Å; W245-V248 HydrophobicContact CE3-CG2 4.39Å; W245-V248 HydrophobicContact CZ3-CG1 4.33Å; W245-V248 PolarHBondContact O-N 3.16Å; W245-Y249 HydrophobicContact CB-CD2 4.46Å; W245-Y249 HydrophobicContact CB-CE2 4.1Å; W245-Y249 WeakPolarHBondContact O-CD2 3.48Å; W245-Y249 PolarHBondContact O-N 3.42Å
246Y97.1Very high94.5Very high87 Ų8771.6 Ų71.634%0.34137%0.366SS..Hα-helixtrans-64.1-41.4173.8-77.4-105.9000111I243 V244 Y249 Q250 M294 E297I243-Y246 WeakPolarHBondContact O-CB 3.31Å; I243-Y246 PolarHBondContact O-N 2.99Å; V244-Y246 PolarHBondContact O-N 3.33Å; Y246-Y249 PolarHBondContact O-N 3.17Å; Y246-Q250 WeakPolarHBondContact O-CB 3.44Å; Y246-Q250 PolarHBondContact O-N 2.75Å; Y246-M294 HydrophobicContact CD1-CB 4.39Å; Y246-M294 HydrophobicContact CD1-SD 3.49Å; Y246-M294 WeakPolarHBondContact CD1-SD 2.97Å; Y246-M294 HydrophobicContact CE1-SD 3.67Å; Y246-M294 HydrophobicContact CG-SD 4.47Å; Y246-E297 HydrophobicContact CD1-CB 4.01Å; Y246-E297 HydrophobicContact CD1-CG 3.97Å; Y246-E297 HydrophobicContact CE1-CB 4.02Å; Y246-E297 HydrophobicContact CE1-CG 3.58Å
247H97.1Very high94.7Very high0 Ų062.6 Ų62.60%033%0.332CS..Hα-helixtrans-60.5-43.1172.3-75.9-55.3000112.1V227 I231 I243 V244 W245 Q250 V251 D302V227-H247 HydrophobicContact CG1-CB 3.62Å; I231-H247 HydrophobicContact CD1-CB 4.09Å; I231-H247 HydrophobicContact CG1-CB 4.11Å; I243-H247 PolarHBondContact O-N 2.89Å; V244-H247 WeakPolarHBondContact O-CB 3.5Å; V244-H247 PolarHBondContact O-N 3.42Å; W245-H247 VanDerWaalsContact C-N 3.33Å; H247-Q250 PolarHBondContact O-N 3.06Å; H247-V251 WeakPolarHBondContact O-CG2 3.49Å; H247-V251 PolarHBondContact O-N 3.5Å; H247-V251 VanDerWaalsContact O-N 3.15Å; H247-D302 IonicContact CD2-OD2 2.82Å; H247-D302 IonicContact CE1-OD2 3.9Å; H247-D302 IonicContact NE2-OD2 2.83Å; H247-D302 PolarHBondContact NE2-OD2 2.86Å
248V97.1Very high94.8Very high30 Ų3057.1 Ų57.118%0.18231%0.312CS..Hα-helixtrans-61.6-48.3174.4169.90000111.2I231 V244 W245 Q250 V251 I252I231-V248 HydrophobicContact CD1-CG2 3.91Å; I231-V248 HydrophobicContact CG1-CG2 4.05Å; I231-V248 HydrophobicContact CG2-CG2 3.92Å; V244-V248 WeakPolarHBondContact O-CG2 3.45Å; V244-V248 PolarHBondContact O-N 3.4Å; W245-V248 HydrophobicContact CE3-CB 4.23Å; W245-V248 HydrophobicContact CE3-CG1 4.23Å; W245-V248 HydrophobicContact CE3-CG2 4.39Å; W245-V248 HydrophobicContact CZ3-CG1 4.33Å; W245-V248 PolarHBondContact O-N 3.16Å; V248-Q250 VanDerWaalsContact C-N 3.35Å; V248-Q250 PolarHBondContact O-N 2.69Å; V248-V251 PolarHBondContact O-N 3.39Å; V248-I252 HydrophobicContact CG1-CD1 3.79Å; V248-I252 HydrophobicContact CG1-CG1 4.49Å; V248-I252 WeakPolarHBondContact O-CG1 3.49Å; V248-I252 PolarHBondContact O-N 2.8Å
249Y97.4Very high95.1Very high112 Ų11259.6 Ų59.644%0.43930%0.303SS..Hα-helixtrans-63.5-40.9179.6-69.5-48.4000112W245 Y246 V251 I252 F253W245-Y249 HydrophobicContact CB-CD2 4.46Å; W245-Y249 HydrophobicContact CB-CE2 4.1Å; W245-Y249 WeakPolarHBondContact O-CD2 3.48Å; W245-Y249 PolarHBondContact O-N 3.42Å; Y246-Y249 PolarHBondContact O-N 3.17Å; Y249-V251 VanDerWaalsContact C-N 3.35Å; Y249-V251 PolarHBondContact O-N 2.83Å; Y249-I252 PolarHBondContact O-N 2.84Å; Y249-F253 WeakPolarHBondContact O-CB 3.27Å; Y249-F253 WeakPolarHBondContact O-CD2 3.29Å; Y249-F253 WeakPolarHBondContact O-CG 3.48Å; Y249-F253 PolarHBondContact O-N 3.16Å
250Q97.1Very high95.5Very high5 Ų559.2 Ų59.22%0.02330%0.296CS..Hα-helixtrans-53.8-50.4173.2174.4-169.8-33.600111.3H161 Y246 H247 V248 I252 F253 F254 C291 M294 Q295H161-Q250 PolarHBondContact CE1-NE2 3.49Å; H161-Q250 PolarHBondContact NE2-NE2 2.82Å; Y246-Q250 WeakPolarHBondContact O-CB 3.44Å; Y246-Q250 PolarHBondContact O-N 2.75Å; H247-Q250 PolarHBondContact O-N 3.06Å; V248-Q250 VanDerWaalsContact C-N 3.35Å; V248-Q250 PolarHBondContact O-N 2.69Å; Q250-I252 PolarHBondContact O-N 3.3Å; Q250-F253 PolarHBondContact O-N 3.36Å; Q250-F254 WeakPolarHBondContact O-CB 3.26Å; Q250-F254 PolarHBondContact O-N 3.5Å; Q250-C291 PolarHBondContact O-SG 2.76Å; Q250-C291 VanDerWaalsContact O-SG 3.4Å; Q250-M294 HydrophobicContact CB-CB 4.43Å; Q250-Q295 HydrophobicContact CG-CB 4.11Å; Q250-Q295 VanDerWaalsContact OE1-CA 3.24Å; Q250-Q295 VanDerWaalsContact OE1-CB 3.23Å
251V97.9Very high95.7Very high26 Ų2659.1 Ų59.116%0.15828%0.28CS..Hα-helixtrans-60.4-46178.4173.80000111.1I224 V227 I231 H247 V248 Y249 F254 L255I224-V251 HydrophobicContact CD1-CG2 3.86Å; I224-V251 HydrophobicContact CG1-CG2 3.83Å; V227-V251 HydrophobicContact CG1-CG2 4.33Å; I231-V251 HydrophobicContact CD1-CG2 4.38Å; H247-V251 WeakPolarHBondContact O-CG2 3.49Å; H247-V251 PolarHBondContact O-N 3.5Å; H247-V251 VanDerWaalsContact O-N 3.15Å; V248-V251 PolarHBondContact O-N 3.39Å; Y249-V251 VanDerWaalsContact C-N 3.35Å; Y249-V251 PolarHBondContact O-N 2.83Å; V251-F254 PolarHBondContact O-N 2.84Å; V251-L255 HydrophobicContact CG1-CD1 3.99Å; V251-L255 HydrophobicContact CG1-CG 4.47Å; V251-L255 VanDerWaalsContact O-CG 3.29Å; V251-L255 WeakPolarHBondContact O-CG 3.49Å; V251-L255 PolarHBondContact O-N 3.26Å
252I98.3Very high95.7Very high77 Ų7761 Ų6140%0.39530%0.296SS..Hα-helixtrans-61.2-50.6179.5-69.3170.3000110.8V248 Y249 Q250 F254 L255 I256V248-I252 HydrophobicContact CG1-CD1 3.79Å; V248-I252 HydrophobicContact CG1-CG1 4.49Å; V248-I252 WeakPolarHBondContact O-CG1 3.49Å; V248-I252 PolarHBondContact O-N 2.8Å; Y249-I252 PolarHBondContact O-N 2.84Å; Q250-I252 PolarHBondContact O-N 3.3Å; I252-F254 VanDerWaalsContact C-N 3.33Å; I252-F254 PolarHBondContact O-N 2.89Å; I252-L255 PolarHBondContact O-N 3.02Å; I252-I256 HydrophobicContact CG2-CD1 3.7Å; I252-I256 HydrophobicContact CG2-CG1 4.45Å; I252-I256 VanDerWaalsContact O-CG1 3.3Å; I252-I256 WeakPolarHBondContact O-CG1 3.37Å; I252-I256 PolarHBondContact O-N 3.46Å
253F98.4Very high95.7Very high52 Ų5258.7 Ų58.723%0.22828%0.281CS..Hα-helixtrans-63-39.7-179-74.7-56.5000111.8Y249 Q250 S257 L287 V290 C291Y249-F253 WeakPolarHBondContact O-CB 3.27Å; Y249-F253 WeakPolarHBondContact O-CD2 3.29Å; Y249-F253 WeakPolarHBondContact O-CG 3.48Å; Y249-F253 PolarHBondContact O-N 3.16Å; Q250-F253 PolarHBondContact O-N 3.36Å; F253-S257 VanDerWaalsContact O-CB 3.26Å; F253-S257 WeakPolarHBondContact O-CB 3.49Å; F253-S257 PolarHBondContact O-N 3.08Å; F253-L287 HydrophobicContact CD1-CD2 3.77Å; F253-L287 HydrophobicContact CE1-CD2 4.22Å; F253-V290 HydrophobicContact CD1-CG1 4.4Å; F253-V290 HydrophobicContact CD2-CG1 3.75Å; F253-V290 HydrophobicContact CE1-CG1 4.25Å; F253-V290 HydrophobicContact CE2-CG1 3.58Å; F253-V290 HydrophobicContact CG-CG1 4.19Å; F253-V290 HydrophobicContact CZ-CG1 3.85Å; F253-C291 HydrophobicContact CB-CB 3.95Å
254F97.9Very high95.3Very high63 Ų6360 Ų6028%0.27629%0.291SS..Hα-helixtrans-61-49.6175-175.7-87.9000111.6Y220 Q250 V251 I252 I256 S257 A258Y220-F254 HydrophobicContact CD1-CD1 4.12Å; Y220-F254 AromaticContact CD1-CE1 3.65Å; Y220-F254 HydrophobicContact CD1-CE1 3.65Å; Y220-F254 HydrophobicContact CD1-CZ 4.44Å; Y220-F254 AromaticContact CD2-CD1 3.63Å; Y220-F254 HydrophobicContact CD2-CD1 3.63Å; Y220-F254 HydrophobicContact CD2-CD2 4.26Å; Y220-F254 AromaticContact CD2-CE1 3.21Å; Y220-F254 HydrophobicContact CD2-CE1 3.21Å; Y220-F254 AromaticContact CD2-CE2 3.9Å; Y220-F254 HydrophobicContact CD2-CE2 3.9Å; Y220-F254 HydrophobicContact CD2-CG 4.13Å; Y220-F254 AromaticContact CD2-CZ 3.35Å; Y220-F254 HydrophobicContact CD2-CZ 3.35Å; Y220-F254 AromaticContact CE1-CD1 3.69Å; Y220-F254 HydrophobicContact CE1-CD1 3.69Å; Y220-F254 AromaticContact CE1-CE1 3.72Å; Y220-F254 HydrophobicContact CE1-CE1 3.72Å; Y220-F254 HydrophobicContact CE2-CB 4.21Å; Y220-F254 AromaticContact CE2-CD1 3.14Å; Y220-F254 HydrophobicContact CE2-CD1 3.14Å; Y220-F254 AromaticContact CE2-CD2 3.94Å; Y220-F254 HydrophobicContact CE2-CD2 3.94Å; Y220-F254 AromaticContact CE2-CE1 3.3Å; Y220-F254 HydrophobicContact CE2-CE1 3.3Å; Y220-F254 HydrophobicContact CE2-CE2 4.07Å; Y220-F254 AromaticContact CE2-CG 3.48Å; Y220-F254 HydrophobicContact CE2-CG 3.48Å; Y220-F254 VanDerWaalsContact CE2-CG 3.48Å; Y220-F254 AromaticContact CE2-CZ 3.76Å; Y220-F254 HydrophobicContact CE2-CZ 3.76Å; Y220-F254 HydrophobicContact CG-CD1 4.08Å; Y220-F254 AromaticContact CG-CE1 3.38Å; Y220-F254 HydrophobicContact CG-CE1 3.38Å; Y220-F254 AromaticContact CG-CZ 3.73Å; Y220-F254 HydrophobicContact CG-CZ 3.73Å; Y220-F254 AromaticContact CZ-CD1 3.16Å; Y220-F254 AromaticContact CZ-CE1 3.55Å; Y220-F254 AromaticContact CZ-CG 3.81Å; Y220-F254 WeakPolarHBondContact OH-CD1 3.47Å; Q250-F254 WeakPolarHBondContact O-CB 3.26Å; Q250-F254 PolarHBondContact O-N 3.5Å; V251-F254 PolarHBondContact O-N 2.84Å; I252-F254 VanDerWaalsContact C-N 3.33Å; I252-F254 PolarHBondContact O-N 2.89Å; F254-I256 VanDerWaalsContact C-N 3.35Å; F254-I256 PolarHBondContact O-N 3.22Å; F254-S257 WeakPolarHBondContact O-CB 3.23Å; F254-S257 PolarHBondContact O-N 3.18Å; F254-S257 VanDerWaalsContact O-N 3.12Å; F254-S257 PolarHBondContact O-OG 3.4Å; F254-A258 HydrophobicContact CE1-CB 4.47Å; F254-A258 WeakPolarHBondContact O-CB 3.33Å; F254-A258 PolarHBondContact O-N 3.3Å
255L97.3Very high95.2Very high99 Ų9962.1 Ų62.152%0.51830%0.3SS..Hα-helixtrans-62.1-41-178.5-69.4175.2000112.3Y220 V251 I252 A258 Y259Y220-L255 HydrophobicContact CE1-CD2 4.15Å; V251-L255 HydrophobicContact CG1-CD1 3.99Å; V251-L255 HydrophobicContact CG1-CG 4.47Å; V251-L255 VanDerWaalsContact O-CG 3.29Å; V251-L255 WeakPolarHBondContact O-CG 3.49Å; V251-L255 PolarHBondContact O-N 3.26Å; I252-L255 PolarHBondContact O-N 3.02Å; L255-A258 PolarHBondContact O-N 2.97Å; L255-Y259 PolarHBondContact O-N 2.65Å
256I97.9Very high95.1Very high71 Ų7156.6 Ų56.636%0.36428%0.284SS..Hα-helixtrans-67.2-40.5174.9-59169.4000110.2I252 F254 A258 Y259 F260 L287I252-I256 HydrophobicContact CG2-CD1 3.7Å; I252-I256 HydrophobicContact CG2-CG1 4.45Å; I252-I256 VanDerWaalsContact O-CG1 3.3Å; I252-I256 WeakPolarHBondContact O-CG1 3.37Å; I252-I256 PolarHBondContact O-N 3.46Å; F254-I256 VanDerWaalsContact C-N 3.35Å; F254-I256 PolarHBondContact O-N 3.22Å; I256-A258 VanDerWaalsContact C-N 3.32Å; I256-A258 PolarHBondContact O-N 3.06Å; I256-Y259 WeakPolarHBondContact O-CB 3.14Å; I256-Y259 PolarHBondContact O-N 3.47Å; I256-F260 HydrophobicContact CG2-CD2 3.99Å; I256-F260 HydrophobicContact CG2-CE2 3.77Å; I256-F260 VanDerWaalsContact O-CD2 3.32Å; I256-F260 WeakPolarHBondContact O-CD2 3.31Å; I256-F260 PolarHBondContact O-N 2.74Å; I256-L287 HydrophobicContact CB-CD1 4.13Å; I256-L287 HydrophobicContact CG2-CD1 3.52Å
257S97Very high94.8Very high1 Ų153.3 Ų53.31%0.00727%0.271CS..Hα-helixtrans-61.2-41.5176.183.50000111.8F253 F254 Y259 F260 F261 F284F253-S257 VanDerWaalsContact O-CB 3.26Å; F253-S257 WeakPolarHBondContact O-CB 3.49Å; F253-S257 PolarHBondContact O-N 3.08Å; F254-S257 WeakPolarHBondContact O-CB 3.23Å; F254-S257 PolarHBondContact O-N 3.18Å; F254-S257 VanDerWaalsContact O-N 3.12Å; F254-S257 PolarHBondContact O-OG 3.4Å; S257-Y259 VanDerWaalsContact C-N 3.27Å; S257-Y259 PolarHBondContact O-N 3.27Å; S257-F260 PolarHBondContact O-N 2.84Å; S257-F260 VanDerWaalsContact O-N 3.11Å; S257-F261 PolarHBondContact O-N 2.72Å; S257-F284 WeakPolarHBondContact O-CD2 3.18Å
258A94.4Very high94.6Very high33 Ų3354.9 Ų54.927%0.27328%0.282SS..Hα-helixtrans-63-35.417900000111.8F254 L255 I256 F261 C262F254-A258 HydrophobicContact CE1-CB 4.47Å; F254-A258 WeakPolarHBondContact O-CB 3.33Å; F254-A258 PolarHBondContact O-N 3.3Å; L255-A258 PolarHBondContact O-N 2.97Å; I256-A258 VanDerWaalsContact C-N 3.32Å; I256-A258 PolarHBondContact O-N 3.06Å; A258-F261 PolarHBondContact O-N 2.88Å; A258-C262 WeakPolarHBondContact O-CB 3.5Å; A258-C262 PolarHBondContact O-N 3.43Å; A258-C262 PolarHBondContact O-SG 2.93Å
259Y95Very high94.4Very high112 Ų11259.3 Ų59.344%0.43930%0.304SS..Hα-helixtrans-59.6-52.4171.1170.1-93000111.5L255 I256 S257 F261 C262 C263 H265L255-Y259 PolarHBondContact O-N 2.65Å; I256-Y259 WeakPolarHBondContact O-CB 3.14Å; I256-Y259 PolarHBondContact O-N 3.47Å; S257-Y259 VanDerWaalsContact C-N 3.27Å; S257-Y259 PolarHBondContact O-N 3.27Å; Y259-F261 VanDerWaalsContact C-N 3.28Å; Y259-F261 PolarHBondContact O-N 3.4Å; Y259-C262 PolarHBondContact O-N 3.3Å; Y259-C263 HydrophobicContact CD2-CB 4.46Å; Y259-C263 HydrophobicContact CE2-CB 4.17Å; Y259-C263 VanDerWaalsContact O-CB 3.31Å; Y259-C263 WeakPolarHBondContact O-CB 3.4Å; Y259-C263 PolarHBondContact O-N 2.91Å; Y259-H265 AromaticContact CZ-ND1 3.69Å; Y259-H265 PolarHBondContact OH-ND1 2.81Å
260F95.4Very high94.2Very high42 Ų4258.4 Ų58.418%0.18431%0.307CS..Hα-helixtrans-68-26.5-179.2-77.3-72000113.5I256 S257 H265 I283 F284 L287I256-F260 HydrophobicContact CG2-CD2 3.99Å; I256-F260 HydrophobicContact CG2-CE2 3.77Å; I256-F260 VanDerWaalsContact O-CD2 3.32Å; I256-F260 WeakPolarHBondContact O-CD2 3.31Å; I256-F260 PolarHBondContact O-N 2.74Å; S257-F260 PolarHBondContact O-N 2.84Å; S257-F260 VanDerWaalsContact O-N 3.11Å; F260-H265 VanDerWaalsContact CD1-O 3.32Å; F260-H265 WeakPolarHBondContact CD1-O 3.45Å; F260-H265 WeakPolarHBondContact CE1-O 3.4Å; F260-I283 HydrophobicContact CD1-CB 4.13Å; F260-I283 HydrophobicContact CD1-CD1 4.12Å; F260-I283 HydrophobicContact CD1-CG2 4.09Å; F260-I283 HydrophobicContact CD2-CB 4.36Å; F260-I283 HydrophobicContact CD2-CG2 3.57Å; F260-I283 HydrophobicContact CE1-CB 4.39Å; F260-I283 HydrophobicContact CE1-CD1 3.72Å; F260-I283 HydrophobicContact CE1-CG2 4.11Å; F260-I283 HydrophobicContact CE2-CG2 3.6Å; F260-I283 HydrophobicContact CG-CB 4.12Å; F260-I283 HydrophobicContact CG-CG2 3.83Å; F260-I283 HydrophobicContact CZ-CD1 4.17Å; F260-I283 HydrophobicContact CZ-CG2 3.88Å; F260-F284 HydrophobicContact CB-CB 4.01Å; F260-L287 HydrophobicContact CD2-CD1 3.74Å; F260-L287 HydrophobicContact CE2-CD1 4.13Å
261F91.3Very high93.9Very high122 Ų12261.6 Ų61.654%0.53533%0.328SS..Hα-helixtrans-69.3-41.8170.9178.9-100000112.3S257 A258 Y259 F284S257-F261 PolarHBondContact O-N 2.72Å; A258-F261 PolarHBondContact O-N 2.88Å; Y259-F261 VanDerWaalsContact C-N 3.28Å; Y259-F261 PolarHBondContact O-N 3.4Å; F261-F284 HydrophobicContact CB-CD2 3.79Å; F261-F284 HydrophobicContact CB-CE2 4.05Å; F261-F284 HydrophobicContact CB-CG 4.05Å; F261-F284 HydrophobicContact CD2-CD1 4.08Å; F261-F284 HydrophobicContact CD2-CD2 4.5Å; F261-F284 AromaticContact CD2-CE1 3.83Å; F261-F284 HydrophobicContact CD2-CE1 3.83Å; F261-F284 HydrophobicContact CD2-CE2 4.25Å; F261-F284 HydrophobicContact CD2-CG 4.44Å; F261-F284 AromaticContact CD2-CZ 3.92Å; F261-F284 HydrophobicContact CD2-CZ 3.92Å; F261-F284 HydrophobicContact CE2-CE1 4.49Å; F261-F284 HydrophobicContact CG-CE2 4.42Å
262C88.6Confident93.6Very high78 Ų7861.5 Ų61.553%0.52733%0.332SS..Hα-helixtrans-83.3-29.2-175.9-67.60000113.4A258 Y259A258-C262 WeakPolarHBondContact O-CB 3.5Å; A258-C262 PolarHBondContact O-N 3.43Å; A258-C262 PolarHBondContact O-SG 2.93Å; Y259-C262 PolarHBondContact O-N 3.3Å
263C89.6Confident93.3Very high39 Ų3965.9 Ų65.926%0.26435%0.348SS..SBendtrans-118.5120.8-172.4-61.50000110.1Y259 H265Y259-C263 HydrophobicContact CD2-CB 4.46Å; Y259-C263 HydrophobicContact CE2-CB 4.17Å; Y259-C263 VanDerWaalsContact O-CB 3.31Å; Y259-C263 WeakPolarHBondContact O-CB 3.4Å; Y259-C263 PolarHBondContact O-N 2.91Å; C263-H265 WeakPolarHBondContact CB-ND1 3.45Å; C263-H265 PolarHBondContact O-N 3.46Å
264P86.3Confident93.1Very high44 Ų4463.9 Ų63.929%0.28634%0.341SS..  trans-77.758.9-177.733.7-36.4000111.3E267 S268P264-E267 VanDerWaalsContact CA-OE1 3.23Å; P264-E267 WeakPolarHBondContact CA-OE1 3.21Å; P264-E267 HydrophobicContact CB-CG 4.21Å; P264-E267 WeakPolarHBondContact CB-OE1 3.46Å; P264-S268 WeakPolarHBondContact O-CB 3.41Å; P264-S268 PolarHBondContact O-N 3.5Å; P264-S268 PolarHBondContact O-OG 2.94Å
265H91.9Very high93Very high57 Ų5761.1 Ų61.126%0.26433%0.329SS..THydrogen-bonded Turntrans-105.8140.7175.8-64114.1000109.9Y259 F260 C263 S268 G280Y259-H265 AromaticContact CZ-ND1 3.69Å; Y259-H265 PolarHBondContact OH-ND1 2.81Å; F260-H265 VanDerWaalsContact CD1-O 3.32Å; F260-H265 WeakPolarHBondContact CD1-O 3.45Å; F260-H265 WeakPolarHBondContact CE1-O 3.4Å; C263-H265 WeakPolarHBondContact CB-ND1 3.45Å; C263-H265 PolarHBondContact O-N 3.46Å; H265-S268 PolarHBondContact CD2-OG 2.83Å; H265-S268 VanDerWaalsContact CD2-OG 3.27Å; H265-G280 WeakPolarHBondContact O-CA 3.37Å; H265-G280 PolarHBondContact O-N 3.36Å
266P93.4Very high92.9Very high39 Ų3958.5 Ų58.525%0.25331%0.313SS..THydrogen-bonded Turncis-88.8-1.44.835-36.5000115.3S268 L269 L270 G278P266-S268 VanDerWaalsContact C-N 3.27Å; P266-S268 PolarHBondContact O-N 3.34Å; P266-L269 WeakPolarHBondContact O-CA 3.3Å; P266-L269 WeakPolarHBondContact O-CB 3.48Å; P266-L269 PolarHBondContact O-N 2.82Å; P266-L270 PolarHBondContact O-N 2.91Å; P266-G278 WeakPolarHBondContact CD-O 3.3Å; P266-G278 WeakPolarHBondContact CG-O 3.45Å
267E92.4Very high92.8Very high17 Ų1762.7 Ų62.78%0.07933%0.329CS..THydrogen-bonded Turntrans-61.8-29.3-171.364.3-85.4-160.500114.2H50 I51 P264 L269 L270 C274 G280H50-E267 HydrophobicContact CB-CB 4.2Å; H50-E267 HydrophobicContact CB-CG 4.19Å; H50-E267 VanDerWaalsContact CB-O 3.27Å; H50-E267 WeakPolarHBondContact CB-O 3.24Å; I51-E267 HydrophobicContact CD1-CB 4.49Å; P264-E267 VanDerWaalsContact CA-OE1 3.23Å; P264-E267 WeakPolarHBondContact CA-OE1 3.21Å; P264-E267 HydrophobicContact CB-CG 4.21Å; P264-E267 WeakPolarHBondContact CB-OE1 3.46Å; E267-L269 VanDerWaalsContact C-N 3.27Å; E267-L269 PolarHBondContact O-N 2.72Å; E267-L270 CarbonylContact O-C 3.43Å; E267-L270 VanDerWaalsContact O-C 3.26Å; E267-L270 PolarHBondContact O-N 3.28Å; E267-C274 HydrophobicContact CB-CB 3.81Å; E267-G280 PolarHBondContact OE2-N 2.91Å
268S92.1Very high92.6Very high33 Ų3363.4 Ų63.423%0.23134%0.337CS..THydrogen-bonded Turntrans-65.3-29172.255.30000113.7P264 H265 P266P264-S268 WeakPolarHBondContact O-CB 3.41Å; P264-S268 PolarHBondContact O-N 3.5Å; P264-S268 PolarHBondContact O-OG 2.94Å; H265-S268 PolarHBondContact CD2-OG 2.83Å; H265-S268 VanDerWaalsContact CD2-OG 3.27Å; P266-S268 VanDerWaalsContact C-N 3.27Å; P266-S268 PolarHBondContact O-N 3.34Å
269L92.9Very high92.6Very high124 Ų12462.3 Ų62.365%0.64933%0.326SS*.THydrogen-bonded Turntrans-83.9-25.9176.6-57.6174.7000111.7P266 E267P266-L269 WeakPolarHBondContact O-CA 3.3Å; P266-L269 WeakPolarHBondContact O-CB 3.48Å; P266-L269 PolarHBondContact O-N 2.82Å; E267-L269 VanDerWaalsContact C-N 3.27Å; E267-L269 PolarHBondContact O-N 2.72Å
270L92.6Very high92.7Very high93 Ų9357 Ų5749%0.48731%0.305SS..SBendtrans-13163.7-176-56.3171.6000112.2P266 E267 G272 K273P266-L270 PolarHBondContact O-N 2.91Å; E267-L270 CarbonylContact O-C 3.43Å; E267-L270 VanDerWaalsContact O-C 3.26Å; E267-L270 PolarHBondContact O-N 3.28Å; L270-G272 PolarHBondContact O-N 2.73Å; L270-K273 HydrophobicContact CB-CB 3.91Å; L270-K273 HydrophobicContact CB-CG 4.16Å; L270-K273 WeakPolarHBondContact O-CB 3.43Å; L270-K273 PolarHBondContact O-N 3.15Å
271P92.2Very high92.7Very high71 Ų7157.6 Ų57.646%0.46131%0.308SS..THydrogen-bonded Turntrans-56.9132.7-177.5-24.234.5000112.3H50 K273H50-P271 HydrophobicContact CB-CB 4.29Å; P271-K273 PolarHBondContact O-N 3.44Å
272G90.6Very high93Very high25 Ų2552.2 Ų52.226%0.25829%0.285SS..THydrogen-bonded Turntrans79.2-11.8-178.200000115.6H50 L270 D275H50-G272 PolarHBondContact O-N 2.83Å; L270-G272 PolarHBondContact O-N 2.73Å; G272-D275 VanDerWaalsContact CA-OD1 3.26Å; G272-D275 WeakPolarHBondContact CA-OD1 3.45Å
273K93.3Very high93.4Very high169 Ų16951.1 Ų51.174%0.73527%0.273SS*.THydrogen-bonded Turntrans-88.7-27.6178.5-59.1-61.5-175.2-179.50112.5L270 P271L270-K273 HydrophobicContact CB-CB 3.91Å; L270-K273 HydrophobicContact CB-CG 4.16Å; L270-K273 WeakPolarHBondContact O-CB 3.43Å; L270-K273 PolarHBondContact O-N 3.15Å; P271-K273 PolarHBondContact O-N 3.44Å
274C93.9Very high93.8Very high9 Ų951 Ų516%0.06127%0.268CS..SBendtrans-95.819.5177.7-59.20000112.9E267 F276 F277 G278 Q279E267-C274 HydrophobicContact CB-CB 3.81Å; C274-F276 PolarHBondContact O-N 2.99Å; C274-F276 VanDerWaalsContact O-N 3.09Å; C274-F277 WeakPolarHBondContact CA-O 3.4Å; C274-G278 PolarHBondContact SG-O 2.9Å; C274-G278 VanDerWaalsContact SG-O 3.4Å; C274-Q279 HydrophobicContact CB-CG 4.35Å; C274-Q279 WeakPolarHBondContact O-CG 3.35Å; C274-Q279 PolarHBondContact O-NE2 3.14Å
275D94.6Very high94.4Very high6 Ų649 Ų493%0.03226%0.255CS..SBendtrans-58.4-30-173.7-79.4-1000113.6I51 L52 T53 N74 G272 Q279I51-D275 VanDerWaalsContact CA-OD1 3.3Å; I51-D275 WeakPolarHBondContact CA-OD1 3.39Å; I51-D275 HydrophobicContact CG2-CB 4.48Å; L52-D275 PolarHBondContact N-OD1 3.38Å; L52-D275 PolarHBondContact N-OD2 3.36Å; T53-D275 WeakPolarHBondContact CA-OD2 3.24Å; T53-D275 WeakPolarHBondContact CB-OD2 3.44Å; T53-D275 PolarHBondContact N-OD2 2.79Å; T53-D275 PolarHBondContact OG1-OD2 2.96Å; N74-D275 WeakPolarHBondContact CA-O 3.47Å; N74-D275 VanDerWaalsContact CB-O 3.27Å; N74-D275 WeakPolarHBondContact CB-O 3.15Å; G272-D275 VanDerWaalsContact CA-OD1 3.26Å; G272-D275 WeakPolarHBondContact CA-OD1 3.45Å; D275-Q279 PolarHBondContact O-NE2 3.4Å
276F94.9Very high94.7Very high43 Ų4349.7 Ų49.719%0.18926%0.263CS..SBendtrans-119.5-34.3-178.6-60.6-88.1000113.7R72 L77 C274 Q282R72-F276 HydrophobicContact CG-CD1 3.51Å; R72-F276 HydrophobicContact CG-CE1 3.8Å; R72-F276 HydrophobicContact CG-CG 4.3Å; L77-F276 WeakPolarHBondContact CD1-O 3.4Å; C274-F276 PolarHBondContact O-N 2.99Å; C274-F276 VanDerWaalsContact O-N 3.09Å; F276-Q282 PolarHBondContact O-NE2 3.21Å
277F95.9Very high95Very high160 Ų16049.1 Ų49.170%0.70226%0.258SS*.SBendtrans-137.9142.8-173.4-177.7-82.9000110.2L77 C274L77-F277 HydrophobicContact CD1-CB 4.15Å; L77-F277 HydrophobicContact CD1-CD2 3.46Å; L77-F277 VanDerWaalsContact CD1-CD2 3.46Å; L77-F277 HydrophobicContact CD1-CE2 4.2Å; L77-F277 HydrophobicContact CD1-CG 4.16Å; C274-F277 WeakPolarHBondContact CA-O 3.4Å
278G92.5Very high95.2Very high16 Ų1649.1 Ų49.117%0.16526%0.259CS..  trans80.627.6175.500000113.4P266 C274P266-G278 WeakPolarHBondContact CD-O 3.3Å; P266-G278 WeakPolarHBondContact CG-O 3.45Å; C274-G278 PolarHBondContact SG-O 2.9Å; C274-G278 VanDerWaalsContact SG-O 3.4Å
279Q95.1Very high95.6Very high10 Ų1048.4 Ų48.45%0.04725%0.253CS..  trans-75143.4169.1-57.6170.66.800109.4I51 N74 C274 D275 H281 Q282 I283I51-Q279 HydrophobicContact CD1-CG 3.95Å; N74-Q279 PolarHBondContact O-NE2 3.3Å; C274-Q279 HydrophobicContact CB-CG 4.35Å; C274-Q279 WeakPolarHBondContact O-CG 3.35Å; C274-Q279 PolarHBondContact O-NE2 3.14Å; D275-Q279 PolarHBondContact O-NE2 3.4Å; Q279-H281 PolarHBondContact O-N 3.43Å; Q279-Q282 HydrophobicContact CB-CB 4.39Å; Q279-Q282 HydrophobicContact CB-CG 3.92Å; Q279-Q282 HydrophobicContact CG-CG 4.43Å; Q279-Q282 WeakPolarHBondContact O-CB 3.42Å; Q279-Q282 PolarHBondContact O-N 3.39Å; Q279-I283 PolarHBondContact O-N 3.21Å; Q279-I283 VanDerWaalsContact O-N 3.14Å
280G96.4Very high95.8Very high0 Ų044.5 Ų44.50%023%0.234CC..Hα-helixtrans-53.4-40.3172.800000112.1H265 E267 Q282 I283 F284H265-G280 WeakPolarHBondContact O-CA 3.37Å; H265-G280 PolarHBondContact O-N 3.36Å; E267-G280 PolarHBondContact OE2-N 2.91Å; G280-Q282 VanDerWaalsContact C-N 3.3Å; G280-Q282 PolarHBondContact O-N 2.93Å; G280-I283 WeakPolarHBondContact O-CB 3.31Å; G280-I283 PolarHBondContact O-N 2.89Å; G280-I283 VanDerWaalsContact O-N 3.12Å; G280-F284 WeakPolarHBondContact O-CB 3.29Å; G280-F284 PolarHBondContact O-N 3.42Å
281H96.5Very high96.1Very high54 Ų5440.3 Ų40.325%0.2521%0.213CC..Hα-helixtrans-60.7-35.6176.2-160.774.7000113.5H129 Q279 F284 H285H129-H281 AromaticContact CE1-CD2 3.68Å; H129-H281 AromaticContact CE1-NE2 3.3Å; H129-H281 PolarHBondContact CE1-NE2 3.22Å; H129-H281 VanDerWaalsContact CE1-NE2 3.3Å; H129-H281 AromaticContact NE2-CD2 3.91Å; H129-H281 AromaticContact NE2-NE2 3.19Å; H129-H281 PolarHBondContact NE2-NE2 2.95Å; H129-H281 VanDerWaalsContact NE2-NE2 3.19Å; Q279-H281 PolarHBondContact O-N 3.43Å; H281-F284 AromaticContact CE1-CD1 3.91Å; H281-F284 AromaticContact ND1-CD1 3.99Å; H281-F284 WeakPolarHBondContact O-CB 3.21Å; H281-F284 PolarHBondContact O-N 2.88Å; H281-H285 AromaticContact CD2-CD2 3.89Å; H281-H285 AromaticContact CD2-NE2 3.53Å; H281-H285 AromaticContact CE1-NE2 3.75Å; H281-H285 AromaticContact NE2-CD2 3.61Å; H281-H285 AromaticContact NE2-CE1 3.71Å; H281-H285 AromaticContact NE2-NE2 2.93Å; H281-H285 PolarHBondContact NE2-NE2 2.94Å; H281-H285 PolarHBondContact O-CD2 2.87Å; H281-H285 PolarHBondContact O-N 3.42Å
282Q97.4Very high96.4Very high10 Ų1037 Ų375%0.04719%0.191CC..Hα-helixtrans-68.8-41.5175.1-65.6167.4-3.500111.2L77 N78 F276 Q279 G280 F284 H285 V286L77-Q282 HydrophobicContact CB-CG 3.95Å; N78-Q282 WeakPolarHBondContact OD1-CG 3.1Å; F276-Q282 PolarHBondContact O-NE2 3.21Å; Q279-Q282 HydrophobicContact CB-CB 4.39Å; Q279-Q282 HydrophobicContact CB-CG 3.92Å; Q279-Q282 HydrophobicContact CG-CG 4.43Å; Q279-Q282 WeakPolarHBondContact O-CB 3.42Å; Q279-Q282 PolarHBondContact O-N 3.39Å; G280-Q282 VanDerWaalsContact C-N 3.3Å; G280-Q282 PolarHBondContact O-N 2.93Å; Q282-F284 VanDerWaalsContact C-N 3.33Å; Q282-H285 PolarHBondContact O-N 3.48Å; Q282-V286 WeakPolarHBondContact O-CG2 3.18Å; Q282-V286 PolarHBondContact O-N 3.17Å; Q282-V286 VanDerWaalsContact O-N 3.09Å
283I97.7Very high96.8Very high54 Ų5438.3 Ų38.328%0.27719%0.192SC..Hα-helixtrans-64.2-42.9176.7-60.2169.2000109.6F260 Q279 G280 H285 V286 L287F260-I283 HydrophobicContact CD1-CB 4.13Å; F260-I283 HydrophobicContact CD1-CD1 4.12Å; F260-I283 HydrophobicContact CD1-CG2 4.09Å; F260-I283 HydrophobicContact CD2-CB 4.36Å; F260-I283 HydrophobicContact CD2-CG2 3.57Å; F260-I283 HydrophobicContact CE1-CB 4.39Å; F260-I283 HydrophobicContact CE1-CD1 3.72Å; F260-I283 HydrophobicContact CE1-CG2 4.11Å; F260-I283 HydrophobicContact CE2-CG2 3.6Å; F260-I283 HydrophobicContact CG-CB 4.12Å; F260-I283 HydrophobicContact CG-CG2 3.83Å; F260-I283 HydrophobicContact CZ-CD1 4.17Å; F260-I283 HydrophobicContact CZ-CG2 3.88Å; Q279-I283 PolarHBondContact O-N 3.21Å; Q279-I283 VanDerWaalsContact O-N 3.14Å; G280-I283 WeakPolarHBondContact O-CB 3.31Å; G280-I283 PolarHBondContact O-N 2.89Å; G280-I283 VanDerWaalsContact O-N 3.12Å; I283-H285 PolarHBondContact O-N 2.91Å; I283-V286 PolarHBondContact O-N 3.32Å; I283-L287 HydrophobicContact CG2-CD1 3.73Å; I283-L287 HydrophobicContact CG2-CG 4.22Å; I283-L287 VanDerWaalsContact O-CG 3.28Å; I283-L287 WeakPolarHBondContact O-CG 3.49Å; I283-L287 PolarHBondContact O-N 3.07Å
284F97.9Very high97Very high36 Ų3632.7 Ų32.716%0.15817%0.169CC..Hα-helixtrans-54.2-51172.2160.2-111.4000111.7S257 F260 F261 G280 H281 Q282 V286 L287 V288S257-F284 WeakPolarHBondContact O-CD2 3.18Å; F260-F284 HydrophobicContact CB-CB 4.01Å; F261-F284 HydrophobicContact CB-CD2 3.79Å; F261-F284 HydrophobicContact CB-CE2 4.05Å; F261-F284 HydrophobicContact CB-CG 4.05Å; F261-F284 HydrophobicContact CD2-CD1 4.08Å; F261-F284 HydrophobicContact CD2-CD2 4.5Å; F261-F284 AromaticContact CD2-CE1 3.83Å; F261-F284 HydrophobicContact CD2-CE1 3.83Å; F261-F284 HydrophobicContact CD2-CE2 4.25Å; F261-F284 HydrophobicContact CD2-CG 4.44Å; F261-F284 AromaticContact CD2-CZ 3.92Å; F261-F284 HydrophobicContact CD2-CZ 3.92Å; F261-F284 HydrophobicContact CE2-CE1 4.49Å; F261-F284 HydrophobicContact CG-CE2 4.42Å; G280-F284 WeakPolarHBondContact O-CB 3.29Å; G280-F284 PolarHBondContact O-N 3.42Å; H281-F284 AromaticContact CE1-CD1 3.91Å; H281-F284 AromaticContact ND1-CD1 3.99Å; H281-F284 WeakPolarHBondContact O-CB 3.21Å; H281-F284 PolarHBondContact O-N 2.88Å; Q282-F284 VanDerWaalsContact C-N 3.33Å; F284-V286 VanDerWaalsContact C-N 3.34Å; F284-V286 PolarHBondContact O-N 3.24Å; F284-L287 PolarHBondContact O-N 2.76Å; F284-V288 HydrophobicContact CE2-CB 4.19Å; F284-V288 HydrophobicContact CE2-CG1 4.4Å; F284-V288 HydrophobicContact CZ-CG1 4.4Å; F284-V288 WeakPolarHBondContact O-CG1 3.44Å; F284-V288 PolarHBondContact O-N 3.4Å
285H98.4Very high97.2Very high2 Ų232.5 Ų32.51%0.00917%0.167CC..Hα-helixtrans-56.2-45.6177.1-80.7-152.8000112.5N78 T81 H82 H129 H281 Q282 I283 V288 V289N78-H285 PolarHBondContact O-CE1 2.92Å; N78-H285 PolarHBondContact O-ND1 3Å; N78-H285 VanDerWaalsContact O-ND1 3.08Å; T81-H285 WeakPolarHBondContact OG1-CB 3.36Å; T81-H285 PolarHBondContact OG1-ND1 3.17Å; H82-H285 AromaticContact CD2-CG 3.78Å; H82-H285 AromaticContact CD2-ND1 3.67Å; H82-H285 AromaticContact CE1-CD2 3.43Å; H82-H285 PolarHBondContact CE1-CD2 2.87Å; H82-H285 VanDerWaalsContact CE1-CD2 3.43Å; H82-H285 AromaticContact CE1-CE1 3.4Å; H82-H285 PolarHBondContact CE1-CE1 3.38Å; H82-H285 AromaticContact CE1-CG 3.47Å; H82-H285 VanDerWaalsContact CE1-CG 3.47Å; H82-H285 AromaticContact CE1-ND1 3.45Å; H82-H285 PolarHBondContact CE1-ND1 3.49Å; H82-H285 AromaticContact CE1-NE2 3.4Å; H82-H285 PolarHBondContact CE1-NE2 3.35Å; H82-H285 AromaticContact CG-CE1 4Å; H82-H285 AromaticContact CG-ND1 3.67Å; H82-H285 AromaticContact ND1-CE1 3.41Å; H82-H285 PolarHBondContact ND1-CE1 3.48Å; H82-H285 AromaticContact ND1-ND1 3.52Å; H82-H285 AromaticContact ND1-NE2 3.84Å; H82-H285 WeakPolarHBondContact NE2-CB 3.36Å; H82-H285 AromaticContact NE2-CD2 3.61Å; H82-H285 AromaticContact NE2-CE1 3.97Å; H82-H285 AromaticContact NE2-CG 3.29Å; H82-H285 VanDerWaalsContact NE2-CG 3.29Å; H82-H285 AromaticContact NE2-ND1 3.55Å; H129-H285 AromaticContact CD2-CE1 3.56Å; H129-H285 AromaticContact NE2-CE1 3.45Å; H129-H285 PolarHBondContact NE2-CE1 3.19Å; H129-H285 AromaticContact NE2-NE2 3.6Å; H281-H285 AromaticContact CD2-CD2 3.89Å; H281-H285 AromaticContact CD2-NE2 3.53Å; H281-H285 AromaticContact CE1-NE2 3.75Å; H281-H285 AromaticContact NE2-CD2 3.61Å; H281-H285 AromaticContact NE2-CE1 3.71Å; H281-H285 AromaticContact NE2-NE2 2.93Å; H281-H285 PolarHBondContact NE2-NE2 2.94Å; H281-H285 PolarHBondContact O-CD2 2.87Å; H281-H285 PolarHBondContact O-N 3.42Å; Q282-H285 PolarHBondContact O-N 3.48Å; I283-H285 PolarHBondContact O-N 2.91Å; H285-V288 WeakPolarHBondContact O-CG1 3.48Å; H285-V289 WeakPolarHBondContact O-CB 3.41Å; H285-V289 WeakPolarHBondContact O-CG2 3.39Å; H285-V289 PolarHBondContact O-N 3.41Å
286V98.5Very high97.4Very high73 Ų7332.3 Ų32.344%0.44217%0.167SC..Hα-helixtrans-64.6-47.2179.9174.10000111.1T81 Q282 I283 F284 V289 V290T81-V286 HydrophobicContact CG2-CG2 3.7Å; Q282-V286 WeakPolarHBondContact O-CG2 3.18Å; Q282-V286 PolarHBondContact O-N 3.17Å; Q282-V286 VanDerWaalsContact O-N 3.09Å; I283-V286 PolarHBondContact O-N 3.32Å; F284-V286 VanDerWaalsContact C-N 3.34Å; F284-V286 PolarHBondContact O-N 3.24Å; V286-V289 PolarHBondContact O-N 3.44Å; V286-V290 WeakPolarHBondContact O-CG2 3.45Å; V286-V290 PolarHBondContact O-N 2.97Å
287L98.6Very high97.5Very high26 Ų2632.2 Ų32.214%0.13617%0.166CC..Hα-helixtrans-66.1-40.2-178-67.3170.1000112.3F253 I256 F260 I283 F284 V289 V290 C291F253-L287 HydrophobicContact CD1-CD2 3.77Å; F253-L287 HydrophobicContact CE1-CD2 4.22Å; I256-L287 HydrophobicContact CB-CD1 4.13Å; I256-L287 HydrophobicContact CG2-CD1 3.52Å; F260-L287 HydrophobicContact CD2-CD1 3.74Å; F260-L287 HydrophobicContact CE2-CD1 4.13Å; I283-L287 HydrophobicContact CG2-CD1 3.73Å; I283-L287 HydrophobicContact CG2-CG 4.22Å; I283-L287 VanDerWaalsContact O-CG 3.28Å; I283-L287 WeakPolarHBondContact O-CG 3.49Å; I283-L287 PolarHBondContact O-N 3.07Å; F284-L287 PolarHBondContact O-N 2.76Å; L287-V289 VanDerWaalsContact C-N 3.34Å; L287-V290 PolarHBondContact O-N 3.01Å; L287-C291 WeakPolarHBondContact O-CB 3.46Å; L287-C291 PolarHBondContact O-N 2.87Å
288V98.4Very high97.6Very high17 Ų1724.6 Ų24.610%0.10313%0.133CC..Hα-helixtrans-68.8-34.5177.778.80000111.4F284 H285 C291 T292F284-V288 HydrophobicContact CE2-CB 4.19Å; F284-V288 HydrophobicContact CE2-CG1 4.4Å; F284-V288 HydrophobicContact CZ-CG1 4.4Å; F284-V288 WeakPolarHBondContact O-CG1 3.44Å; F284-V288 PolarHBondContact O-N 3.4Å; H285-V288 WeakPolarHBondContact O-CG1 3.48Å; V288-C291 WeakPolarHBondContact O-CB 3.22Å; V288-C291 PolarHBondContact O-N 2.76Å; V288-T292 WeakPolarHBondContact O-CB 3.33Å; V288-T292 PolarHBondContact O-N 3Å; V288-T292 PolarHBondContact O-OG1 2.89Å
289V98.7Very high97.8Very high18 Ų1823.8 Ų23.811%0.10913%0.125CC..Hα-helixtrans-62.5-47.7171.7165.40000111.2A85 L122 H285 V286 L287 C291 T292 L293A85-V289 HydrophobicContact CB-CB 4.18Å; A85-V289 HydrophobicContact CB-CG1 3.55Å; A85-V289 HydrophobicContact CB-CG2 3.46Å; A85-V289 VanDerWaalsContact CB-CG2 3.46Å; L122-V289 HydrophobicContact CD2-CG2 3.85Å; H285-V289 WeakPolarHBondContact O-CB 3.41Å; H285-V289 WeakPolarHBondContact O-CG2 3.39Å; H285-V289 PolarHBondContact O-N 3.41Å; V286-V289 PolarHBondContact O-N 3.44Å; L287-V289 VanDerWaalsContact C-N 3.34Å; V289-C291 VanDerWaalsContact C-N 3.31Å; V289-C291 PolarHBondContact O-N 2.88Å; V289-T292 PolarHBondContact O-N 3.2Å; V289-L293 HydrophobicContact CG1-CD1 4.07Å; V289-L293 HydrophobicContact CG1-CG 4.47Å; V289-L293 WeakPolarHBondContact O-CG 3.47Å; V289-L293 PolarHBondContact O-N 3.35Å
290V98.6Very high97.9Very high42 Ų4225.7 Ų25.726%0.25513%0.132SC..Hα-helixtrans-61.8-42.2177.6176.20000110.6F253 V286 L287 T292 L293 M294F253-V290 HydrophobicContact CD1-CG1 4.4Å; F253-V290 HydrophobicContact CD2-CG1 3.75Å; F253-V290 HydrophobicContact CE1-CG1 4.25Å; F253-V290 HydrophobicContact CE2-CG1 3.58Å; F253-V290 HydrophobicContact CG-CG1 4.19Å; F253-V290 HydrophobicContact CZ-CG1 3.85Å; V286-V290 WeakPolarHBondContact O-CG2 3.45Å; V286-V290 PolarHBondContact O-N 2.97Å; L287-V290 PolarHBondContact O-N 3.01Å; V290-T292 PolarHBondContact O-N 3.46Å; V290-L293 PolarHBondContact O-N 2.87Å; V290-M294 HydrophobicContact CG1-CE 4.21Å; V290-M294 HydrophobicContact CG1-CG 4.35Å; V290-M294 VanDerWaalsContact O-CG 3.3Å; V290-M294 WeakPolarHBondContact O-CG 3.4Å; V290-M294 PolarHBondContact O-N 3.38Å
291C98.6Very high97.9Very high5 Ų526.7 Ų26.73%0.03414%0.138CC..Hα-helixtrans-54.3-51.7172.8178.40000111.8Q250 F253 L287 V288 V289 L293 M294 Q295Q250-C291 PolarHBondContact O-SG 2.76Å; Q250-C291 VanDerWaalsContact O-SG 3.4Å; F253-C291 HydrophobicContact CB-CB 3.95Å; L287-C291 WeakPolarHBondContact O-CB 3.46Å; L287-C291 PolarHBondContact O-N 2.87Å; V288-C291 WeakPolarHBondContact O-CB 3.22Å; V288-C291 PolarHBondContact O-N 2.76Å; V289-C291 VanDerWaalsContact C-N 3.31Å; V289-C291 PolarHBondContact O-N 2.88Å; C291-L293 VanDerWaalsContact C-N 3.33Å; C291-L293 PolarHBondContact O-N 3.33Å; C291-M294 PolarHBondContact O-N 3.49Å; C291-Q295 WeakPolarHBondContact O-CB 3.48Å; C291-Q295 PolarHBondContact O-N 3.36Å
292T98.6Very high97.8Very high2 Ų224.1 Ų24.11%0.01213%0.126CC..Hα-helixtrans-59.5-40.8178.1-63.50000112.3I89 A118 Y121 Y153 V288 V289 V290 Q295 I296I89-T292 HydrophobicContact CD1-CG2 4.37Å; A118-T292 HydrophobicContact CB-CG2 4.04Å; Y121-T292 HydrophobicContact CE1-CG2 4.23Å; Y121-T292 PolarHBondContact OH-OG1 3.35Å; Y153-T292 HydrophobicContact CE2-CG2 4.17Å; Y153-T292 WeakPolarHBondContact OH-CG2 3.19Å; Y153-T292 PolarHBondContact OH-OG1 3.45Å; V288-T292 WeakPolarHBondContact O-CB 3.33Å; V288-T292 PolarHBondContact O-N 3Å; V288-T292 PolarHBondContact O-OG1 2.89Å; V289-T292 PolarHBondContact O-N 3.2Å; V290-T292 PolarHBondContact O-N 3.46Å; T292-Q295 PolarHBondContact O-N 2.67Å; T292-I296 HydrophobicContact CG2-CD1 3.8Å; T292-I296 VanDerWaalsContact O-CG1 3.3Å; T292-I296 WeakPolarHBondContact O-CG1 3.45Å; T292-I296 PolarHBondContact O-N 2.95Å
293L98.4Very high97.7Very high52 Ų5224 Ų2427%0.27213%0.125SC..Hα-helixtrans-67.5-42.1178-67.5174000112.1I88 I89 V289 V290 C291 Q295 I296 E297I88-L293 HydrophobicContact CG2-CD2 3.73Å; I89-L293 HydrophobicContact CD1-CD2 3.94Å; V289-L293 HydrophobicContact CG1-CD1 4.07Å; V289-L293 HydrophobicContact CG1-CG 4.47Å; V289-L293 WeakPolarHBondContact O-CG 3.47Å; V289-L293 PolarHBondContact O-N 3.35Å; V290-L293 PolarHBondContact O-N 2.87Å; C291-L293 VanDerWaalsContact C-N 3.33Å; C291-L293 PolarHBondContact O-N 3.33Å; L293-Q295 VanDerWaalsContact C-N 3.33Å; L293-I296 PolarHBondContact O-N 2.9Å; L293-E297 WeakPolarHBondContact O-CB 3.34Å; L293-E297 PolarHBondContact O-N 3.36Å
294M98.1Very high97.5Very high52 Ų5225.7 Ų25.726%0.25614%0.138SC..Hα-helixtrans-63.9-41.2175.4-66.1-62.2160.700111.4Y246 Q250 V290 C291 E297 A298Y246-M294 HydrophobicContact CD1-CB 4.39Å; Y246-M294 HydrophobicContact CD1-SD 3.49Å; Y246-M294 WeakPolarHBondContact CD1-SD 2.97Å; Y246-M294 HydrophobicContact CE1-SD 3.67Å; Y246-M294 HydrophobicContact CG-SD 4.47Å; Q250-M294 HydrophobicContact CB-CB 4.43Å; V290-M294 HydrophobicContact CG1-CE 4.21Å; V290-M294 HydrophobicContact CG1-CG 4.35Å; V290-M294 VanDerWaalsContact O-CG 3.3Å; V290-M294 WeakPolarHBondContact O-CG 3.4Å; V290-M294 PolarHBondContact O-N 3.38Å; C291-M294 PolarHBondContact O-N 3.49Å; M294-E297 PolarHBondContact O-N 2.81Å; M294-A298 WeakPolarHBondContact O-CB 3.48Å; M294-A298 PolarHBondContact O-N 3.34Å
295Q98.2Very high97.3Very high4 Ų430.2 Ų30.22%0.01916%0.16CC..Hα-helixtrans-59.9-51.5175.9179.4176.8-11.700111.5Y153 S157 H161 Q250 C291 T292 L293 E297 A298 L299Y153-Q295 PolarHBondContact OH-OE1 3.49Å; S157-Q295 VanDerWaalsContact CB-NE2 3.3Å; S157-Q295 PolarHBondContact OG-NE2 3.12Å; H161-Q295 PolarHBondContact NE2-NE2 3.46Å; Q250-Q295 HydrophobicContact CG-CB 4.11Å; Q250-Q295 VanDerWaalsContact OE1-CA 3.24Å; Q250-Q295 VanDerWaalsContact OE1-CB 3.23Å; C291-Q295 WeakPolarHBondContact O-CB 3.48Å; C291-Q295 PolarHBondContact O-N 3.36Å; T292-Q295 PolarHBondContact O-N 2.67Å; L293-Q295 VanDerWaalsContact C-N 3.33Å; Q295-E297 VanDerWaalsContact C-N 3.31Å; Q295-E297 PolarHBondContact O-N 3.04Å; Q295-A298 PolarHBondContact O-N 3.06Å; Q295-L299 HydrophobicContact CG-CD1 3.62Å; Q295-L299 HydrophobicContact CG-CG 4.26Å; Q295-L299 WeakPolarHBondContact O-CB 3.38Å; Q295-L299 WeakPolarHBondContact O-CD1 3.49Å; Q295-L299 WeakPolarHBondContact O-CG 3.43Å; Q295-L299 PolarHBondContact O-N 3.5Å
296I98.1Very high97.1Very high3 Ų332.6 Ų32.62%0.01517%0.169CC..Hα-helixtrans-61.9-40.9-179.5-71.5165.9000111.1I89 I96 L115 A118 T292 L293 R300I89-I296 HydrophobicContact CD1-CD1 3.42Å; I89-I296 VanDerWaalsContact CD1-CD1 3.42Å; I96-I296 HydrophobicContact CD1-CG2 4.32Å; L115-I296 HydrophobicContact CD2-CD1 4.1Å; L115-I296 HydrophobicContact CD2-CG1 4.49Å; L115-I296 HydrophobicContact CD2-CG2 3.92Å; A118-I296 HydrophobicContact CB-CD1 4.13Å; T292-I296 HydrophobicContact CG2-CD1 3.8Å; T292-I296 VanDerWaalsContact O-CG1 3.3Å; T292-I296 WeakPolarHBondContact O-CG1 3.45Å; T292-I296 PolarHBondContact O-N 2.95Å; L293-I296 PolarHBondContact O-N 2.9Å; I296-R300 VanDerWaalsContact O-CB 3.27Å; I296-R300 WeakPolarHBondContact O-CB 2.97Å; I296-R300 PolarHBondContact O-N 3.49Å
297E97.3Very high96.8Very high40 Ų4032.7 Ų32.719%0.18716%0.161CC..Hα-helixtrans-63.6-45177.9-171.560.2-148.700111.7K92 Y246 L293 M294 Q295 R300 T301K92-E297 IonicContact NZ-OE2 3.5Å; Y246-E297 HydrophobicContact CD1-CB 4.01Å; Y246-E297 HydrophobicContact CD1-CG 3.97Å; Y246-E297 HydrophobicContact CE1-CB 4.02Å; Y246-E297 HydrophobicContact CE1-CG 3.58Å; L293-E297 WeakPolarHBondContact O-CB 3.34Å; L293-E297 PolarHBondContact O-N 3.36Å; M294-E297 PolarHBondContact O-N 2.81Å; Q295-E297 VanDerWaalsContact C-N 3.31Å; Q295-E297 PolarHBondContact O-N 3.04Å; E297-R300 VanDerWaalsContact CD-NH2 3.26Å; E297-R300 IonicContact OE1-CZ 3.54Å; E297-R300 IonicContact OE1-NE 3.61Å; E297-R300 IonicContact OE1-NH2 3.7Å; E297-R300 PolarHBondContact OE1-NH2 3.02Å; E297-R300 IonicContact OE2-CZ 3.64Å; E297-R300 IonicContact OE2-NE 3.96Å; E297-R300 IonicContact OE2-NH2 2.75Å; E297-R300 PolarHBondContact OE2-NH2 3.21Å; E297-T301 PolarHBondContact O-N 3.17Å; E297-T301 PolarHBondContact O-OG1 2.86Å; E297-T301 VanDerWaalsContact O-OG1 3.08Å
298A97.7Very high96.7Very high0 Ų035 Ų350%018%0.177CC..Hα-helixtrans-62.2-49.7176.800000111.6I243 M294 Q295 R300 T301 D302I243-A298 HydrophobicContact CG2-CB 3.95Å; M294-A298 WeakPolarHBondContact O-CB 3.48Å; M294-A298 PolarHBondContact O-N 3.34Å; Q295-A298 PolarHBondContact O-N 3.06Å; A298-R300 VanDerWaalsContact C-N 3.35Å; A298-R300 PolarHBondContact O-N 3.47Å; A298-T301 PolarHBondContact O-N 3.17Å; A298-D302 WeakPolarHBondContact O-CB 3.4Å; A298-D302 PolarHBondContact O-N 3.25Å
299L97.4Very high96.4Very high0 Ų035.8 Ų35.80%018%0.181CC..Hα-helixtrans-61.8-39.8-179.2-68.6169.7000112.7L111 V114 A160 Y164 Q295 F303L111-L299 HydrophobicContact CD1-CB 4.44Å; V114-L299 HydrophobicContact CG1-CD1 4.32Å; V114-L299 HydrophobicContact CG2-CD1 4.5Å; A160-L299 HydrophobicContact CB-CD1 3.56Å; A160-L299 HydrophobicContact CB-CD2 4.03Å; A160-L299 HydrophobicContact CB-CG 4.41Å; A160-L299 WeakPolarHBondContact O-CD2 3.41Å; Y164-L299 HydrophobicContact CD2-CB 4.4Å; Y164-L299 HydrophobicContact CD2-CD2 4.15Å; Q295-L299 HydrophobicContact CG-CD1 3.62Å; Q295-L299 HydrophobicContact CG-CG 4.26Å; Q295-L299 WeakPolarHBondContact O-CB 3.38Å; Q295-L299 WeakPolarHBondContact O-CD1 3.49Å; Q295-L299 WeakPolarHBondContact O-CG 3.43Å; Q295-L299 PolarHBondContact O-N 3.5Å; L299-F303 WeakPolarHBondContact O-CB 3.4Å; L299-F303 PolarHBondContact O-N 3.35Å
300R96.3Very high96.2Very high49 Ų4935.1 Ų35.119%0.18518%0.177CC..Hα-helixtrans-62.3-47.2176.8175.4-177.376.1161.82111.4E95 I96 I296 E297 A298 D302 F303 T304E95-R300 IonicContact OE1-CZ 2.68Å; E95-R300 IonicContact OE1-NH1 3.81Å; E95-R300 PolarHBondContact OE1-NH1 2.84Å; E95-R300 IonicContact OE1-NH2 3.62Å; I96-R300 HydrophobicContact CD1-CG 4.44Å; I96-R300 HydrophobicContact CG1-CG 4.37Å; I296-R300 VanDerWaalsContact O-CB 3.27Å; I296-R300 WeakPolarHBondContact O-CB 2.97Å; I296-R300 PolarHBondContact O-N 3.49Å; E297-R300 VanDerWaalsContact CD-NH2 3.26Å; E297-R300 IonicContact OE1-CZ 3.54Å; E297-R300 IonicContact OE1-NE 3.61Å; E297-R300 IonicContact OE1-NH2 3.7Å; E297-R300 PolarHBondContact OE1-NH2 3.02Å; E297-R300 IonicContact OE2-CZ 3.64Å; E297-R300 IonicContact OE2-NE 3.96Å; E297-R300 IonicContact OE2-NH2 2.75Å; E297-R300 PolarHBondContact OE2-NH2 3.21Å; A298-R300 VanDerWaalsContact C-N 3.35Å; A298-R300 PolarHBondContact O-N 3.47Å; R300-D302 VanDerWaalsContact C-N 3.35Å; R300-F303 PolarHBondContact O-N 2.92Å; R300-T304 PolarHBondContact O-N 3.2Å; R300-T304 PolarHBondContact O-OG1 3.49Å
301T96.1Very high95.8Very high21 Ų2136.6 Ų36.613%0.12918%0.181CC..Hα-helixtrans-66.7-43.2-179.4-55.40000110.1I243 E297 A298 F303 T304 E305I243-T301 HydrophobicContact CD1-CG2 3.63Å; I243-T301 HydrophobicContact CG1-CG2 3.67Å; E297-T301 PolarHBondContact O-N 3.17Å; E297-T301 PolarHBondContact O-OG1 2.86Å; E297-T301 VanDerWaalsContact O-OG1 3.08Å; A298-T301 PolarHBondContact O-N 3.17Å; T301-F303 PolarHBondContact O-N 3.36Å; T301-T304 PolarHBondContact O-N 3.13Å; T301-E305 VanDerWaalsContact CG2-CD 3.45Å; T301-E305 HydrophobicContact CG2-CG 3.95Å; T301-E305 WeakPolarHBondContact O-CB 3.38Å; T301-E305 PolarHBondContact O-N 2.77Å
302D96.1Very high95.6Very high0 Ų045.4 Ų45.40%021%0.213CC..Hα-helixtrans-61.6-44.3176.3-71.5-35000113.3Y164 R230 H247 A298 R300 T304 R306 Y310Y164-D302 WeakPolarHBondContact O-CB 3.41Å; R230-D302 IonicContact CZ-OD1 3.46Å; R230-D302 IonicContact CZ-OD2 3.48Å; R230-D302 IonicContact NH1-OD1 2.72Å; R230-D302 PolarHBondContact NH1-OD1 3.36Å; R230-D302 IonicContact NH1-OD2 3.29Å; R230-D302 PolarHBondContact NH1-OD2 3.47Å; R230-D302 IonicContact NH2-OD1 3.96Å; R230-D302 PolarHBondContact NH2-OD1 3.26Å; R230-D302 IonicContact NH2-OD2 3.06Å; H247-D302 IonicContact CD2-OD2 2.82Å; H247-D302 IonicContact CE1-OD2 3.9Å; H247-D302 IonicContact NE2-OD2 2.83Å; H247-D302 PolarHBondContact NE2-OD2 2.86Å; A298-D302 WeakPolarHBondContact O-CB 3.4Å; A298-D302 PolarHBondContact O-N 3.25Å; R300-D302 VanDerWaalsContact C-N 3.35Å; D302-T304 PolarHBondContact O-N 3.46Å; D302-R306 WeakPolarHBondContact O-CA 3.5Å; D302-R306 WeakPolarHBondContact O-CB 3.42Å; D302-R306 PolarHBondContact O-N 2.82Å; D302-Y310 HydrophobicContact CB-CE2 4.36Å; D302-Y310 WeakPolarHBondContact O-CE2 3.43Å
303F95.1Very high95.4Very high8 Ų846.9 Ų46.94%0.03522%0.221CC..Hα-helixtrans-52.8-38173.3165.6-103.1000111.5V100 H107 A108 L111 Y164 L299 R300 T301 R307V100-F303 HydrophobicContact CB-CE1 4.4Å; V100-F303 HydrophobicContact CG1-CE1 3.74Å; V100-F303 HydrophobicContact CG1-CZ 3.95Å; V100-F303 HydrophobicContact CG2-CD1 4.31Å; V100-F303 HydrophobicContact CG2-CE1 3.72Å; H107-F303 HydrophobicContact CB-CE2 4.34Å; H107-F303 WeakPolarHBondContact O-CE2 3.42Å; A108-F303 HydrophobicContact CB-CE2 4.29Å; A108-F303 HydrophobicContact CB-CZ 3.98Å; L111-F303 HydrophobicContact CD2-CB 4.48Å; L111-F303 HydrophobicContact CD2-CD1 4.05Å; L111-F303 HydrophobicContact CD2-CG 4.23Å; Y164-F303 HydrophobicContact CD1-CB 4.1Å; Y164-F303 HydrophobicContact CD1-CD2 4.18Å; Y164-F303 HydrophobicContact CE1-CB 4.16Å; Y164-F303 AromaticContact CE1-CD2 3.5Å; Y164-F303 HydrophobicContact CE1-CD2 3.5Å; Y164-F303 VanDerWaalsContact CE1-CD2 3.5Å; Y164-F303 HydrophobicContact CE1-CE2 4.38Å; Y164-F303 HydrophobicContact CE1-CG 4.28Å; Y164-F303 HydrophobicContact CG-CB 4.35Å; Y164-F303 AromaticContact CZ-CD2 3.81Å; L299-F303 WeakPolarHBondContact O-CB 3.4Å; L299-F303 PolarHBondContact O-N 3.35Å; R300-F303 PolarHBondContact O-N 2.92Å; T301-F303 PolarHBondContact O-N 3.36Å; F303-R307 VanDerWaalsContact O-CB 3.29Å; F303-R307 WeakPolarHBondContact O-CB 3.37Å
304T93.4Very high95.1Very high89 Ų8945 Ų4555%0.54621%0.211SC..Hα-helixtrans-83.1-53.7-177.5-52.60000111.9R300 T301 D302R300-T304 PolarHBondContact O-N 3.2Å; R300-T304 PolarHBondContact O-OG1 3.49Å; T301-T304 PolarHBondContact O-N 3.13Å; D302-T304 PolarHBondContact O-N 3.46Å
305E93.9Very high94.5Very high131 Ų13144 Ų4461%0.61221%0.214SC*.Hα-helixtrans-77.8-30.8-170.5-65.3-173170.500113T301T301-E305 VanDerWaalsContact CG2-CD 3.45Å; T301-E305 HydrophobicContact CG2-CG 3.95Å; T301-E305 WeakPolarHBondContact O-CB 3.38Å; T301-E305 PolarHBondContact O-N 2.77Å
306R93.6Very high93.6Very high52 Ų5250.3 Ų50.320%0.19625%0.248CC..SBendtrans-110.312.5-175.7-55.4-17671-165.86.5112.8E167 D302 P308 L309 Y310E167-R306 IonicContact OE1-CZ 2.77Å; E167-R306 VanDerWaalsContact OE1-CZ 3.24Å; E167-R306 IonicContact OE1-NH1 2.69Å; E167-R306 PolarHBondContact OE1-NH1 2.94Å; E167-R306 IonicContact OE1-NH2 3.2Å; E167-R306 PolarHBondContact OE1-NH2 2.94Å; E167-R306 IonicContact OE2-CZ 2.76Å; E167-R306 IonicContact OE2-NH2 3.49Å; E167-R306 PolarHBondContact OE2-NH2 3.37Å; D302-R306 WeakPolarHBondContact O-CA 3.5Å; D302-R306 WeakPolarHBondContact O-CB 3.42Å; D302-R306 PolarHBondContact O-N 2.82Å; R306-P308 VanDerWaalsContact C-CD 3.42Å; R306-L309 VanDerWaalsContact O-CB 3.3Å; R306-L309 WeakPolarHBondContact O-CB 3.32Å; R306-L309 PolarHBondContact O-N 3.21Å; R306-Y310 HydrophobicContact CB-CD2 4.23Å; R306-Y310 HydrophobicContact CB-CE2 3.47Å; R306-Y310 VanDerWaalsContact CB-CE2 3.47Å; R306-Y310 WeakPolarHBondContact CD-OH 3.21Å; R306-Y310 PolarHBondContact NE-OH 3.22Å; R306-Y310 PolarHBondContact NH1-OH 2.82Å; R306-Y310 VanDerWaalsContact NH1-OH 3.15Å; R306-Y310 WeakPolarHBondContact O-CD2 3.39Å; R306-Y310 PolarHBondContact O-N 2.84Å
307R92.8Very high93Very high76 Ų7652.5 Ų52.529%0.28726%0.259SS..Hα-helixtrans-43.8-48.9179.3-168.3174.6173.4130.511.4114.8D105 F303 L309 Y310 E311D105-R307 VanDerWaalsContact CG-NH2 3.26Å; D105-R307 IonicContact OD1-NH2 3.69Å; D105-R307 PolarHBondContact OD1-NH2 3.22Å; D105-R307 IonicContact OD2-CZ 3.97Å; D105-R307 IonicContact OD2-NH1 3.73Å; D105-R307 PolarHBondContact OD2-NH1 3.5Å; D105-R307 IonicContact OD2-NH2 2.82Å; D105-R307 PolarHBondContact OD2-NH2 3.02Å; F303-R307 VanDerWaalsContact O-CB 3.29Å; F303-R307 WeakPolarHBondContact O-CB 3.37Å; R307-L309 PolarHBondContact O-N 3.18Å; R307-L309 VanDerWaalsContact O-N 3.14Å; R307-Y310 PolarHBondContact O-N 2.95Å; R307-E311 HydrophobicContact CG-CG 4.11Å; R307-E311 IonicContact CZ-OE1 2.84Å; R307-E311 IonicContact NE-OE1 2.73Å; R307-E311 PolarHBondContact NE-OE1 3.32Å; R307-E311 IonicContact NH2-OE1 3.04Å; R307-E311 PolarHBondContact NH2-OE1 3.32Å; R307-E311 WeakPolarHBondContact O-CG 3.37Å; R307-E311 PolarHBondContact O-N 3.27Å
308P94.4Very high92.3Very high73 Ų7350.7 Ų50.747%0.47425%0.251SS..Hα-helixtrans-64.8-22.7-176.6-21.434.8000113.7R306 R312R306-P308 VanDerWaalsContact C-CD 3.42Å; P308-R312 WeakPolarHBondContact O-CG 3.33Å; P308-R312 PolarHBondContact O-NE 3.06Å
309L93.9Very high91.7Very high34 Ų3456.9 Ų56.918%0.17828%0.28CS..Hα-helixtrans-71-50172.6175.561.9000110.2R306 R307 R312 L313R306-L309 VanDerWaalsContact O-CB 3.3Å; R306-L309 WeakPolarHBondContact O-CB 3.32Å; R306-L309 PolarHBondContact O-N 3.21Å; R307-L309 PolarHBondContact O-N 3.18Å; R307-L309 VanDerWaalsContact O-N 3.14Å; L309-R312 PolarHBondContact O-N 2.96Å; L309-L313 HydrophobicContact CD1-CD1 4Å; L309-L313 HydrophobicContact CD1-CG 4.23Å; L309-L313 HydrophobicContact CG-CD1 4Å; L309-L313 WeakPolarHBondContact O-CG 3.25Å; L309-L313 PolarHBondContact O-N 3.32Å
310Y92.8Very high91.2Very high4 Ų462.2 Ų62.22%0.01631%0.308CS..Hα-helixtrans-70-35.4-174.4-55.8-42.9000113Y163 Y164 D302 R306 R307 R312 L313 H314Y163-Y310 WeakPolarHBondContact O-CB 3.49Å; Y163-Y310 WeakPolarHBondContact O-CD1 3.48Å; Y164-Y310 VanDerWaalsContact C-CZ 3.44Å; Y164-Y310 HydrophobicContact CD1-CD2 4.01Å; Y164-Y310 HydrophobicContact CD1-CE2 4.43Å; Y164-Y310 PolarHBondContact O-OH 2.91Å; D302-Y310 HydrophobicContact CB-CE2 4.36Å; D302-Y310 WeakPolarHBondContact O-CE2 3.43Å; R306-Y310 HydrophobicContact CB-CD2 4.23Å; R306-Y310 HydrophobicContact CB-CE2 3.47Å; R306-Y310 VanDerWaalsContact CB-CE2 3.47Å; R306-Y310 WeakPolarHBondContact CD-OH 3.21Å; R306-Y310 PolarHBondContact NE-OH 3.22Å; R306-Y310 PolarHBondContact NH1-OH 2.82Å; R306-Y310 VanDerWaalsContact NH1-OH 3.15Å; R306-Y310 WeakPolarHBondContact O-CD2 3.39Å; R306-Y310 PolarHBondContact O-N 2.84Å; R307-Y310 PolarHBondContact O-N 2.95Å; Y310-R312 VanDerWaalsContact C-N 3.28Å; Y310-R312 PolarHBondContact O-N 3.29Å; Y310-L313 HydrophobicContact CD1-CD1 4.49Å; Y310-L313 PolarHBondContact O-N 3.4Å; Y310-H314 WeakPolarHBondContact O-CB 3.35Å; Y310-H314 PolarHBondContact O-CD2 3.1Å; Y310-H314 VanDerWaalsContact O-CD2 3.25Å; Y310-H314 PolarHBondContact O-N 3.4Å
311E92Very high90.8Very high73 Ų7360 Ų6034%0.34130%0.3SS..Hα-helixtrans-59.8-40172.3-69.7-179161.700111.5R307 G315R307-E311 HydrophobicContact CG-CG 4.11Å; R307-E311 IonicContact CZ-OE1 2.84Å; R307-E311 IonicContact NE-OE1 2.73Å; R307-E311 PolarHBondContact NE-OE1 3.32Å; R307-E311 IonicContact NH2-OE1 3.04Å; R307-E311 PolarHBondContact NH2-OE1 3.32Å; R307-E311 WeakPolarHBondContact O-CG 3.37Å; R307-E311 PolarHBondContact O-N 3.27Å; E311-G315 PolarHBondContact O-N 3.2Å; E311-G315 VanDerWaalsContact O-N 3.08Å
312R93.3Very high90.6Very high190 Ų19061 Ų6172%0.71731%0.306SS*.Hα-helixtrans-70.9-34.7176.3-71.7-172.6-60.5-121.50.6113.6P308 L309 Y310P308-R312 WeakPolarHBondContact O-CG 3.33Å; P308-R312 PolarHBondContact O-NE 3.06Å; L309-R312 PolarHBondContact O-N 2.96Å; Y310-R312 VanDerWaalsContact C-N 3.28Å; Y310-R312 PolarHBondContact O-N 3.29Å
313L94.1Very high90.5Very high33 Ų3363.6 Ų63.617%0.17333%0.328CS..Hα-helixtrans-77.5-40.2-177.7-70.3178.1000112.1I166 K168 H171 L309 Y310I166-L313 HydrophobicContact CG2-CD1 4.02Å; K168-L313 HydrophobicContact CG-CD2 4.34Å; H171-L313 HydrophobicContact CB-CD1 4.4Å; H171-L313 HydrophobicContact CB-CD2 4.34Å; H171-L313 PolarHBondContact CE1-O 2.85Å; H171-L313 PolarHBondContact NE2-O 2.97Å; L309-L313 HydrophobicContact CD1-CD1 4Å; L309-L313 HydrophobicContact CD1-CG 4.23Å; L309-L313 HydrophobicContact CG-CD1 4Å; L309-L313 WeakPolarHBondContact O-CG 3.25Å; L309-L313 PolarHBondContact O-N 3.32Å; Y310-L313 HydrophobicContact CD1-CD1 4.49Å; Y310-L313 PolarHBondContact O-N 3.4Å
314H92.5Very high90.6Very high12 Ų1264.6 Ų64.66%0.05633%0.334CS..Hα-helixtrans-105.2-23.1-168.4-57.4-55.2000114.3Y162 Y163 H171 Y310 D316 L317Y162-H314 AromaticContact CD1-CE1 3.79Å; Y162-H314 AromaticContact CE1-CE1 3.49Å; Y162-H314 VanDerWaalsContact CE1-CE1 3.49Å; Y162-H314 WeakPolarHBondContact CE1-CE1 3.48Å; Y162-H314 AromaticContact CE1-ND1 3.56Å; Y162-H314 PolarHBondContact O-CE1 2.68Å; Y162-H314 PolarHBondContact O-NE2 3.27Å; Y163-H314 WeakPolarHBondContact CA-NE2 3.33Å; Y163-H314 HydrophobicContact CD1-CB 4.24Å; Y163-H314 AromaticContact CD1-CD2 3.69Å; Y163-H314 AromaticContact CD1-CG 3.93Å; Y163-H314 HydrophobicContact CE1-CB 3.72Å; Y163-H314 AromaticContact CE1-CG 3.85Å; Y163-H314 PolarHBondContact O-NE2 3.41Å; H171-H314 AromaticContact CD2-CE1 3.53Å; H171-H314 AromaticContact CD2-ND1 3.97Å; H171-H314 AromaticContact NE2-CE1 3.61Å; H171-H314 AromaticContact NE2-ND1 3.54Å; Y310-H314 WeakPolarHBondContact O-CB 3.35Å; Y310-H314 PolarHBondContact O-CD2 3.1Å; Y310-H314 VanDerWaalsContact O-CD2 3.25Å; Y310-H314 PolarHBondContact O-N 3.4Å; H314-D316 PolarHBondContact O-N 3.29Å; H314-L317 HydrophobicContact CB-CB 4.4Å; H314-L317 WeakPolarHBondContact O-CB 3.29Å; H314-L317 PolarHBondContact O-N 2.92Å; H314-L317 VanDerWaalsContact O-N 3.09Å
315G86Confident90.7Very high32 Ų3261.3 Ų61.333%0.3331%0.312SS..THydrogen-bonded Turntrans47.3-127.1-174.800000111.5H107 E311 L317H107-G315 PolarHBondContact CE1-O 3.43Å; E311-G315 PolarHBondContact O-N 3.2Å; E311-G315 VanDerWaalsContact O-N 3.08Å; G315-L317 VanDerWaalsContact C-N 3.34Å; G315-L317 PolarHBondContact O-N 3.19Å
316D79.8Confident90.9Very high137 Ų13759.6 Ų59.673%0.73331%0.306SS*.THydrogen-bonded Turntrans-88.915.5-176.1-59.6-38.1000115H314 A318H314-D316 PolarHBondContact O-N 3.29Å; D316-A318 PolarHBondContact O-N 2.82Å
317L85.4Confident91.1Very high48 Ų4863.4 Ų63.425%0.25132%0.324SS..THydrogen-bonded Turntrans-60.6-10.1-176.7-174.868.8000114Y162 Y163 L179 H314 G315 H319 D320 A321Y162-L317 HydrophobicContact CE1-CD2 3.87Å; Y163-L317 HydrophobicContact CE2-CD2 4.32Å; Y163-L317 VanDerWaalsContact OH-CB 3.23Å; Y163-L317 WeakPolarHBondContact OH-CB 3.45Å; Y163-L317 WeakPolarHBondContact OH-CG 3.13Å; Y163-L317 PolarHBondContact OH-O 3Å; Y163-L317 VanDerWaalsContact OH-O 3.07Å; L179-L317 HydrophobicContact CD1-CD2 4.14Å; H314-L317 HydrophobicContact CB-CB 4.4Å; H314-L317 WeakPolarHBondContact O-CB 3.29Å; H314-L317 PolarHBondContact O-N 2.92Å; H314-L317 VanDerWaalsContact O-N 3.09Å; G315-L317 VanDerWaalsContact C-N 3.34Å; G315-L317 PolarHBondContact O-N 3.19Å; L317-H319 VanDerWaalsContact C-N 3.28Å; L317-H319 PolarHBondContact O-N 3.13Å; L317-D320 HydrophobicContact CD1-CB 4.2Å; L317-D320 PolarHBondContact O-N 3.42Å; L317-A321 PolarHBondContact O-N 3.29Å
318A81.8Confident91.4Very high2 Ų260 Ų602%0.01731%0.312CS..Hα-helixtrans-59.1-37.1-176.600000112.7P106 Y163 D316 A321 V322P106-A318 HydrophobicContact CB-CB 3.93Å; P106-A318 WeakPolarHBondContact O-CB 3.34Å; Y163-A318 WeakPolarHBondContact OH-CA 3.49Å; Y163-A318 PolarHBondContact OH-N 3.37Å; D316-A318 PolarHBondContact O-N 2.82Å; A318-A321 PolarHBondContact O-N 3.46Å; A318-V322 VanDerWaalsContact O-CG2 3.26Å; A318-V322 WeakPolarHBondContact O-CG2 3.46Å; A318-V322 PolarHBondContact O-N 2.9Å
319H85.2Confident91.6Very high131 Ų13158.5 Ų58.561%0.60630%0.301SS*.Hα-helixtrans-66.8-44.2179.6-68.4-62.2000112.5L317 A321 V322 A323L317-H319 VanDerWaalsContact C-N 3.28Å; L317-H319 PolarHBondContact O-N 3.13Å; H319-A321 VanDerWaalsContact C-N 3.31Å; H319-A321 PolarHBondContact O-N 2.73Å; H319-V322 PolarHBondContact O-N 3.34Å; H319-A323 PolarHBondContact O-N 3.08Å
320D87.6Confident91.8Very high111 Ų11159.9 Ų59.959%0.59431%0.313SS*.Hα-helixtrans-65.6-38.1177.7-66.9-24.6000111L317 A323 L324L317-D320 HydrophobicContact CD1-CB 4.2Å; L317-D320 PolarHBondContact O-N 3.42Å; D320-A323 PolarHBondContact O-N 3.48Å; D320-L324 WeakPolarHBondContact O-CB 3.47Å; D320-L324 PolarHBondContact O-N 2.95Å
321A87.9Confident92.1Very high2 Ų261.1 Ų61.12%0.01732%0.322CS..Hα-helixtrans-61.1-44174.100000112.5L159 Y163 L317 A318 H319 L324 F325L159-A321 HydrophobicContact CD1-CB 3.52Å; L159-A321 HydrophobicContact CD2-CB 4.14Å; L159-A321 HydrophobicContact CG-CB 4.49Å; Y163-A321 HydrophobicContact CE2-CB 4.22Å; L317-A321 PolarHBondContact O-N 3.29Å; A318-A321 PolarHBondContact O-N 3.46Å; H319-A321 VanDerWaalsContact C-N 3.31Å; H319-A321 PolarHBondContact O-N 2.73Å; A321-L324 PolarHBondContact O-N 3.48Å; A321-F325 WeakPolarHBondContact O-CB 3.48Å; A321-F325 PolarHBondContact O-N 3.02Å
322V90.8Very high92.4Very high42 Ų4257.6 Ų57.626%0.25531%0.306SS..Hα-helixtrans-63.7-45175.5172.80000110.9Q109 I113 A318 H319 L324 F325 I326Q109-V322 HydrophobicContact CB-CG2 4.03Å; Q109-V322 HydrophobicContact CG-CG2 4.43Å; I113-V322 HydrophobicContact CD1-CG2 3.87Å; A318-V322 VanDerWaalsContact O-CG2 3.26Å; A318-V322 WeakPolarHBondContact O-CG2 3.46Å; A318-V322 PolarHBondContact O-N 2.9Å; H319-V322 PolarHBondContact O-N 3.34Å; V322-L324 VanDerWaalsContact C-N 3.33Å; V322-L324 PolarHBondContact O-N 3.37Å; V322-F325 WeakPolarHBondContact O-CB 3.44Å; V322-F325 PolarHBondContact O-N 2.9Å; V322-I326 HydrophobicContact CG1-CD1 3.99Å; V322-I326 WeakPolarHBondContact O-CG1 3.42Å; V322-I326 PolarHBondContact O-N 2.92Å
323A94.7Very high92.6Very high56 Ų5650.9 Ų50.946%0.46329%0.29SS..Hα-helixtrans-60.9-43.8178.700000111.6H319 D320 I326 F327H319-A323 PolarHBondContact O-N 3.08Å; D320-A323 PolarHBondContact O-N 3.48Å; A323-I326 PolarHBondContact O-N 2.92Å; A323-F327 WeakPolarHBondContact O-CB 3.37Å; A323-F327 PolarHBondContact O-N 3Å
324L95.8Very high92.8Very high29 Ų2954.8 Ų54.815%0.15231%0.311CS..Hα-helixtrans-68.6-34.9178.4-172.958.8000112.4Y155 L179 A183 D320 A321 V322 F327 T328Y155-L324 HydrophobicContact CE2-CD2 4.15Å; Y155-L324 HydrophobicContact CE2-CG 4.22Å; Y155-L324 WeakPolarHBondContact OH-CB 3.15Å; Y155-L324 WeakPolarHBondContact OH-CD2 3.49Å; Y155-L324 WeakPolarHBondContact OH-CG 3.48Å; L179-L324 HydrophobicContact CB-CD2 4.05Å; A183-L324 HydrophobicContact CB-CD1 3.78Å; A183-L324 HydrophobicContact CB-CD2 3.99Å; A183-L324 HydrophobicContact CB-CG 3.85Å; D320-L324 WeakPolarHBondContact O-CB 3.47Å; D320-L324 PolarHBondContact O-N 2.95Å; A321-L324 PolarHBondContact O-N 3.48Å; V322-L324 VanDerWaalsContact C-N 3.33Å; V322-L324 PolarHBondContact O-N 3.37Å; L324-F327 HydrophobicContact CD1-CD1 4.28Å; L324-F327 PolarHBondContact O-N 3.06Å; L324-T328 WeakPolarHBondContact O-CB 3.3Å; L324-T328 PolarHBondContact O-N 3.43Å; L324-T328 PolarHBondContact O-OG1 3.07Å
325F97Very high93.1Very high20 Ų2055 Ų559%0.08831%0.313CS..Hα-helixtrans-58.5-50.5170.7178-99.4000111.9I113 A117 V152 Y155 A321 V322 T328 T329I113-F325 HydrophobicContact CD1-CB 4.2Å; I113-F325 HydrophobicContact CD1-CG 4.31Å; I113-F325 HydrophobicContact CG1-CD1 4.47Å; I113-F325 HydrophobicContact CG1-CG 4.4Å; I113-F325 HydrophobicContact CG2-CD1 4.43Å; I113-F325 HydrophobicContact CG2-CD2 3.32Å; I113-F325 HydrophobicContact CG2-CE2 3.47Å; I113-F325 VanDerWaalsContact CG2-CE2 3.47Å; I113-F325 HydrophobicContact CG2-CG 3.86Å; I113-F325 HydrophobicContact CG2-CZ 4.1Å; A117-F325 HydrophobicContact CB-CE2 4.3Å; V152-F325 HydrophobicContact CG1-CE2 3.52Å; V152-F325 HydrophobicContact CG1-CZ 3.56Å; Y155-F325 HydrophobicContact CD1-CB 4.32Å; Y155-F325 AromaticContact CD1-CD2 3.74Å; Y155-F325 HydrophobicContact CD1-CD2 3.74Å; Y155-F325 VanDerWaalsContact CE1-CA 3.44Å; Y155-F325 HydrophobicContact CE1-CB 3.73Å; Y155-F325 AromaticContact CE1-CD2 3.96Å; Y155-F325 HydrophobicContact CE1-CD2 3.96Å; Y155-F325 HydrophobicContact CE1-CG 4.36Å; A321-F325 WeakPolarHBondContact O-CB 3.48Å; A321-F325 PolarHBondContact O-N 3.02Å; V322-F325 WeakPolarHBondContact O-CB 3.44Å; V322-F325 PolarHBondContact O-N 2.9Å; F325-T328 PolarHBondContact O-N 3.39Å; F325-T329 WeakPolarHBondContact O-CB 3.49Å; F325-T329 PolarHBondContact O-N 3.26Å; F325-T329 PolarHBondContact O-OG1 3.14Å
326I97.7Very high93.7Very high94 Ų9453.8 Ų53.848%0.48230%0.3SS..Hα-helixtrans-62.3-47.2179.5-66.7167.7000109.9V322 A323 T328 T329 C330V322-I326 HydrophobicContact CG1-CD1 3.99Å; V322-I326 WeakPolarHBondContact O-CG1 3.42Å; V322-I326 PolarHBondContact O-N 2.92Å; A323-I326 PolarHBondContact O-N 2.92Å; I326-T328 PolarHBondContact O-N 3.09Å; I326-T329 PolarHBondContact O-N 3.15Å; I326-C330 WeakPolarHBondContact O-CB 3.34Å; I326-C330 PolarHBondContact O-N 2.96Å; I326-C330 PolarHBondContact O-SG 3.47Å; I326-C330 VanDerWaalsContact O-SG 3.33Å
327F98Very high94.6Very high133 Ų13353.3 Ų53.358%0.58329%0.292SS*.Hα-helixtrans-56.8-50.3177.7177.3-99.6000111.7A323 L324 T329 C330 C331A323-F327 WeakPolarHBondContact O-CB 3.37Å; A323-F327 PolarHBondContact O-N 3Å; L324-F327 HydrophobicContact CD1-CD1 4.28Å; L324-F327 PolarHBondContact O-N 3.06Å; F327-T329 VanDerWaalsContact C-N 3.33Å; F327-T329 PolarHBondContact O-N 3.06Å; F327-C330 WeakPolarHBondContact O-CB 3.26Å; F327-C330 PolarHBondContact O-N 2.98Å; F327-C331 VanDerWaalsContact CZ-SG 3.59Å; F327-C331 PolarHBondContact O-N 3.15Å; F327-C331 PolarHBondContact O-SG 3.21Å; F327-C331 VanDerWaalsContact O-SG 3.37Å
328T98.1Very high95.2Very high4 Ų458 Ų583%0.02531%0.307CS..Hα-helixtrans-60.5-43.1179.5-55.90000111.4Y155 A183 A186 L324 F325 I326 C331 C332Y155-T328 HydrophobicContact CG-CG2 4.45Å; A183-T328 WeakPolarHBondContact CB-OG1 3.42Å; A186-T328 HydrophobicContact CB-CG2 4Å; L324-T328 WeakPolarHBondContact O-CB 3.3Å; L324-T328 PolarHBondContact O-N 3.43Å; L324-T328 PolarHBondContact O-OG1 3.07Å; F325-T328 PolarHBondContact O-N 3.39Å; I326-T328 PolarHBondContact O-N 3.09Å; T328-C331 PolarHBondContact O-N 2.58Å; T328-C332 PolarHBondContact O-N 3.25Å; T328-C332 PolarHBondContact O-SG 3.02Å
329T98.4Very high95.9Very high41 Ų4158 Ų5825%0.25231%0.307SS..Hα-helixtrans-61.6-46176.8-59.40000111.4V152 F325 I326 F327 C332 A333V152-T329 HydrophobicContact CG2-CG2 4.02Å; F325-T329 WeakPolarHBondContact O-CB 3.49Å; F325-T329 PolarHBondContact O-N 3.26Å; F325-T329 PolarHBondContact O-OG1 3.14Å; I326-T329 PolarHBondContact O-N 3.15Å; F327-T329 VanDerWaalsContact C-N 3.33Å; F327-T329 PolarHBondContact O-N 3.06Å; T329-C332 PolarHBondContact O-N 3.46Å; T329-A333 WeakPolarHBondContact O-CB 3.38Å; T329-A333 PolarHBondContact O-N 3.07Å
330C98.6Very high96.5Very high64 Ų6455 Ų5543%0.43229%0.29SS..Hα-helixtrans-60.5-45.8175.9-73.90000111.8I326 F327 C332 A333 L334I326-C330 WeakPolarHBondContact O-CB 3.34Å; I326-C330 PolarHBondContact O-N 2.96Å; I326-C330 PolarHBondContact O-SG 3.47Å; I326-C330 VanDerWaalsContact O-SG 3.33Å; F327-C330 WeakPolarHBondContact O-CB 3.26Å; F327-C330 PolarHBondContact O-N 2.98Å; C330-C332 VanDerWaalsContact C-N 3.35Å; C330-C332 PolarHBondContact O-N 2.93Å; C330-A333 PolarHBondContact O-N 3.44Å; C330-L334 WeakPolarHBondContact O-CB 3.48Å; C330-L334 VanDerWaalsContact O-CG 3.25Å; C330-L334 WeakPolarHBondContact O-CG 3.23Å; C330-L334 PolarHBondContact O-N 3.06Å
331C98.6Very high97Very high29 Ų2952.5 Ų52.520%0.19628%0.277CS..Hα-helixtrans-60.3-42.7176.8-70.90000112.3W187 F327 T328 T335W187-C331 HydrophobicContact CG-CB 4.31Å; F327-C331 VanDerWaalsContact CZ-SG 3.59Å; F327-C331 PolarHBondContact O-N 3.15Å; F327-C331 PolarHBondContact O-SG 3.21Å; F327-C331 VanDerWaalsContact O-SG 3.37Å; T328-C331 PolarHBondContact O-N 2.58Å; C331-T335 WeakPolarHBondContact O-CB 3.38Å; C331-T335 PolarHBondContact O-N 3.07Å; C331-T335 PolarHBondContact O-OG1 3.22Å
332C98.6Very high97.4Very high0 Ų058.4 Ų58.40%030%0.299CS..Hα-helixtrans-64-47.1176.1-66.30000111.5V148 C190 T328 T329 C330 T335 A336V148-C332 HydrophobicContact CG1-CB 4.08Å; V148-C332 HydrophobicContact CG2-CB 4.21Å; C190-C332 HydrophobicContact CB-CB 4.06Å; T328-C332 PolarHBondContact O-N 3.25Å; T328-C332 PolarHBondContact O-SG 3.02Å; T329-C332 PolarHBondContact O-N 3.46Å; C330-C332 VanDerWaalsContact C-N 3.35Å; C330-C332 PolarHBondContact O-N 2.93Å; C332-T335 WeakPolarHBondContact O-CB 3.46Å; C332-T335 PolarHBondContact O-N 3.23Å; C332-A336 PolarHBondContact O-N 3.39Å
333A98.5Very high97.6Very high48 Ų4856.6 Ų56.640%0.39729%0.288SS..Hα-helixtrans-63-43.717900000112.5T329 C330 T335 A336 F337T329-A333 WeakPolarHBondContact O-CB 3.38Å; T329-A333 PolarHBondContact O-N 3.07Å; C330-A333 PolarHBondContact O-N 3.44Å; A333-T335 VanDerWaalsContact C-N 3.31Å; A333-T335 PolarHBondContact O-N 3.48Å; A333-A336 PolarHBondContact O-N 3.35Å; A333-F337 WeakPolarHBondContact O-CB 3.33Å; A333-F337 PolarHBondContact O-N 3.04Å
334L98.6Very high97.7Very high115 Ų11559.1 Ų59.160%0.60229%0.286SS*.Hα-helixtrans-62.2-39.6175.3-73.2172.1000111.6C330 F337 Y338C330-L334 WeakPolarHBondContact O-CB 3.48Å; C330-L334 VanDerWaalsContact O-CG 3.25Å; C330-L334 WeakPolarHBondContact O-CG 3.23Å; C330-L334 PolarHBondContact O-N 3.06Å; L334-F337 PolarHBondContact O-N 3.29Å; L334-Y338 VanDerWaalsContact O-CB 3.29Å; L334-Y338 WeakPolarHBondContact O-CB 3.34Å; L334-Y338 PolarHBondContact O-N 3.03Å
335T98.3Very high97.7Very high17 Ų1759.9 Ų59.910%0.10430%0.296CS..Hα-helixtrans-62.3-50175.5-61.70000111.2W187 F191 C331 C332 A333 F337 Y338 V339W187-T335 PolarHBondContact NE1-OG1 2.97Å; F191-T335 HydrophobicContact CB-CG2 4.07Å; F191-T335 HydrophobicContact CD2-CG2 3.94Å; F191-T335 HydrophobicContact CG-CG2 4.5Å; C331-T335 WeakPolarHBondContact O-CB 3.38Å; C331-T335 PolarHBondContact O-N 3.07Å; C331-T335 PolarHBondContact O-OG1 3.22Å; C332-T335 WeakPolarHBondContact O-CB 3.46Å; C332-T335 PolarHBondContact O-N 3.23Å; A333-T335 VanDerWaalsContact C-N 3.31Å; A333-T335 PolarHBondContact O-N 3.48Å; T335-F337 VanDerWaalsContact C-N 3.33Å; T335-F337 PolarHBondContact O-N 3.29Å; T335-Y338 PolarHBondContact O-N 2.93Å; T335-V339 WeakPolarHBondContact O-CG2 3.3Å; T335-V339 PolarHBondContact O-N 3.46Å
336A98.3Very high97.5Very high7 Ų760.3 Ų60.36%0.05830%0.301CS..Hα-helixtrans-59.3-43.2176.100000112.1F144 V148 C332 A333 R340F144-A336 HydrophobicContact CB-CB 3.98Å; V148-A336 HydrophobicContact CG2-CB 3.57Å; C332-A336 PolarHBondContact O-N 3.39Å; A333-A336 PolarHBondContact O-N 3.35Å; A336-R340 WeakPolarHBondContact O-CB 3.22Å; A336-R340 PolarHBondContact O-N 3.44Å
337F98.3Very high97.2Very high126 Ų12657.3 Ų57.355%0.55329%0.286SS*.Hα-helixtrans-62.7-46.6177.2179-101.4000112.3A333 L334 T335 R340 N341A333-F337 WeakPolarHBondContact O-CB 3.33Å; A333-F337 PolarHBondContact O-N 3.04Å; L334-F337 PolarHBondContact O-N 3.29Å; T335-F337 VanDerWaalsContact C-N 3.33Å; T335-F337 PolarHBondContact O-N 3.29Å; F337-R340 PolarHBondContact O-N 3.33Å; F337-N341 WeakPolarHBondContact CE1-ND2 3.15Å; F337-N341 WeakPolarHBondContact CZ-ND2 3.44Å; F337-N341 PolarHBondContact O-N 3.05Å; F337-N341 PolarHBondContact O-ND2 2.91Å
338Y98.3Very high96.9Very high146 Ų14657.1 Ų57.157%0.57328%0.283SS*.Hα-helixtrans-59.2-52177.7173.2-96.8000111.5L334 T335 R340 N341 R342L334-Y338 VanDerWaalsContact O-CB 3.29Å; L334-Y338 WeakPolarHBondContact O-CB 3.34Å; L334-Y338 PolarHBondContact O-N 3.03Å; T335-Y338 PolarHBondContact O-N 2.93Å; Y338-R340 VanDerWaalsContact C-N 3.33Å; Y338-R340 PolarHBondContact O-N 3.36Å; Y338-N341 PolarHBondContact O-N 3.32Å; Y338-N341 VanDerWaalsContact O-N 3.16Å; Y338-R342 HydrophobicContact CE1-CG 4.15Å; Y338-R342 PolarHBondContact O-N 2.92Å; Y338-R342 VanDerWaalsContact O-N 3.16Å
339V97.3Very high96.4Very high3 Ų363.4 Ų63.42%0.01831%0.311CS..Hα-helixtrans-66-36.6-179.3-177.80000111.1F144 C194 Y198 T335 N341 R342 V343F144-V339 HydrophobicContact CE1-CG1 4.44Å; F144-V339 HydrophobicContact CE2-CB 4.1Å; F144-V339 HydrophobicContact CE2-CG1 3.69Å; F144-V339 HydrophobicContact CZ-CB 4.41Å; F144-V339 HydrophobicContact CZ-CG1 3.59Å; C194-V339 HydrophobicContact CB-CB 4.4Å; C194-V339 HydrophobicContact CB-CG1 4.48Å; C194-V339 HydrophobicContact CB-CG2 4.24Å; Y198-V339 HydrophobicContact CG-CG1 4.01Å; T335-V339 WeakPolarHBondContact O-CG2 3.3Å; T335-V339 PolarHBondContact O-N 3.46Å; V339-N341 VanDerWaalsContact C-N 3.31Å; V339-N341 PolarHBondContact O-N 3.36Å; V339-R342 WeakPolarHBondContact O-CB 3.39Å; V339-R342 PolarHBondContact O-N 3.46Å; V339-V343 WeakPolarHBondContact O-CG2 3.21Å; V339-V343 PolarHBondContact O-N 2.91Å
340R97.6Very high95.7Very high68 Ų6868.5 Ų68.526%0.25733%0.33SS..Hα-helixtrans-58.4-42.1172.8-177.2-170178.1-89.10.5112.2L137 T141 F144 A336 F337 Y338 R342 V343 R344L137-R340 HydrophobicContact CD1-CG 4.31Å; T141-R340 PolarHBondContact OG1-NE 3.35Å; F144-R340 HydrophobicContact CD2-CB 4.11Å; F144-R340 HydrophobicContact CE2-CB 4.35Å; A336-R340 WeakPolarHBondContact O-CB 3.22Å; A336-R340 PolarHBondContact O-N 3.44Å; F337-R340 PolarHBondContact O-N 3.33Å; Y338-R340 VanDerWaalsContact C-N 3.33Å; Y338-R340 PolarHBondContact O-N 3.36Å; R340-R342 VanDerWaalsContact C-N 3.31Å; R340-R342 PolarHBondContact O-N 3.47Å; R340-V343 WeakPolarHBondContact O-CB 3.38Å; R340-V343 PolarHBondContact O-N 2.95Å; R340-R344 PolarHBondContact O-N 3.03Å
341N97.4Very high94.7Very high58 Ų5874 Ų7431%0.3135%0.347SS..Hα-helixtrans-67.6-34178.4-71.2-25.8000111.8F337 Y338 V339 R344 A345F337-N341 WeakPolarHBondContact CE1-ND2 3.15Å; F337-N341 WeakPolarHBondContact CZ-ND2 3.44Å; F337-N341 PolarHBondContact O-N 3.05Å; F337-N341 PolarHBondContact O-ND2 2.91Å; Y338-N341 PolarHBondContact O-N 3.32Å; Y338-N341 VanDerWaalsContact O-N 3.16Å; V339-N341 VanDerWaalsContact C-N 3.31Å; V339-N341 PolarHBondContact O-N 3.36Å; N341-R344 PolarHBondContact O-N 3.29Å; N341-A345 PolarHBondContact O-N 3.04Å
342R96.1Very high92.9Very high126 Ų12683.1 Ų83.148%0.47539%0.387SS..Hα-helixtrans-63.3-45.2171.2-64.6-74.6-66.4169.7-0.4112.1Y198 Y338 V339 R340 R344 A345 S346Y198-R342 HydrophobicContact CE2-CB 4.1Å; Y338-R342 HydrophobicContact CE1-CG 4.15Å; Y338-R342 PolarHBondContact O-N 2.92Å; Y338-R342 VanDerWaalsContact O-N 3.16Å; V339-R342 WeakPolarHBondContact O-CB 3.39Å; V339-R342 PolarHBondContact O-N 3.46Å; R340-R342 VanDerWaalsContact C-N 3.31Å; R340-R342 PolarHBondContact O-N 3.47Å; R342-R344 VanDerWaalsContact C-N 3.33Å; R342-R344 PolarHBondContact O-N 2.77Å; R342-A345 PolarHBondContact O-N 2.73Å; R342-S346 PolarHBondContact O-N 2.72Å
343V95.8Very high92.6Very high5 Ų587.3 Ų87.33%0.0341%0.406CS..Hα-helixtrans-56.2-49.1172.3170.40000110.3L137 Y140 F144 Y198 V339 R340 A345 S346 L347L137-V343 HydrophobicContact CD1-CG1 4.18Å; Y140-V343 HydrophobicContact CD1-CG2 4.22Å; Y140-V343 HydrophobicContact CD2-CG1 3.45Å; Y140-V343 VanDerWaalsContact CD2-CG1 3.45Å; Y140-V343 HydrophobicContact CD2-CG2 4.31Å; Y140-V343 HydrophobicContact CE2-CG1 4.1Å; Y140-V343 HydrophobicContact CG-CG1 3.84Å; Y140-V343 HydrophobicContact CG-CG2 3.97Å; F144-V343 HydrophobicContact CE2-CG2 3.97Å; F144-V343 HydrophobicContact CZ-CG2 4.04Å; Y198-V343 HydrophobicContact CD2-CG2 3.54Å; Y198-V343 HydrophobicContact CE2-CG2 4.26Å; Y198-V343 HydrophobicContact CG-CG2 4.41Å; V339-V343 WeakPolarHBondContact O-CG2 3.21Å; V339-V343 PolarHBondContact O-N 2.91Å; R340-V343 WeakPolarHBondContact O-CB 3.38Å; R340-V343 PolarHBondContact O-N 2.95Å; V343-A345 VanDerWaalsContact C-N 3.34Å; V343-A345 PolarHBondContact O-N 3.04Å; V343-S346 PolarHBondContact O-N 3.14Å; V343-L347 HydrophobicContact CG1-CD1 3.81Å; V343-L347 HydrophobicContact CG1-CG 4.2Å; V343-L347 WeakPolarHBondContact O-CG 3.3Å; V343-L347 PolarHBondContact O-N 3.28Å
344R96.5Very high92.3Very high109 Ų10989.4 Ų89.441%0.41141%0.406SS..Hα-helixtrans-58-46.4-178.5-175.6178.3-176.3-164.7-5.2111.5L137 R340 N341 R342 L347 Y348L137-R344 HydrophobicContact CD1-CB 4.04Å; L137-R344 HydrophobicContact CD2-CG 4.31Å; R340-R344 PolarHBondContact O-N 3.03Å; N341-R344 PolarHBondContact O-N 3.29Å; R342-R344 VanDerWaalsContact C-N 3.33Å; R342-R344 PolarHBondContact O-N 2.77Å; R344-L347 PolarHBondContact O-N 3.13Å; R344-Y348 HydrophobicContact CG-CD2 3.96Å; R344-Y348 HydrophobicContact CG-CE2 3.6Å; R344-Y348 PolarHBondContact NH2-OH 2.91Å; R344-Y348 WeakPolarHBondContact O-CD2 3.34Å; R344-Y348 PolarHBondContact O-N 2.84Å; R344-Y348 VanDerWaalsContact O-N 3.15Å
345A95.4Very high91.9Very high44 Ų4487.9 Ų87.936%0.36440%0.396SS..Hα-helixtrans-60.3-49.3176.800000111.8N341 R342 V343 L347 Y348 E349N341-A345 PolarHBondContact O-N 3.04Å; R342-A345 PolarHBondContact O-N 2.73Å; V343-A345 VanDerWaalsContact C-N 3.34Å; V343-A345 PolarHBondContact O-N 3.04Å; A345-L347 VanDerWaalsContact C-N 3.27Å; A345-L347 PolarHBondContact O-N 3.08Å; A345-Y348 WeakPolarHBondContact O-CB 3.38Å; A345-Y348 PolarHBondContact O-N 3.38Å; A345-E349 PolarHBondContact O-N 3.22Å
346S92.5Very high91.6Very high30 Ų3092.1 Ų92.121%0.2141%0.413CS..Hα-helixtrans-61-34178.3-179.90000113.3R342 V343 K350R342-S346 PolarHBondContact O-N 2.72Å; V343-S346 PolarHBondContact O-N 3.14Å; S346-K350 WeakPolarHBondContact O-CG 3.14Å; S346-K350 PolarHBondContact O-N 3.27Å
347L92.3Very high91.2Very high31 Ų3197.4 Ų97.416%0.16244%0.435CS..Hα-helixtrans-73.1-26.6175.5-69.9177.9000113.2E136 L137 V343 R344 A345 K351E136-L347 HydrophobicContact CB-CD1 4.03Å; E136-L347 HydrophobicContact CB-CD2 4.27Å; E136-L347 VanDerWaalsContact OE2-CD2 3.27Å; E136-L347 WeakPolarHBondContact OE2-CD2 3.48Å; L137-L347 HydrophobicContact CB-CD1 4.06Å; V343-L347 HydrophobicContact CG1-CD1 3.81Å; V343-L347 HydrophobicContact CG1-CG 4.2Å; V343-L347 WeakPolarHBondContact O-CG 3.3Å; V343-L347 PolarHBondContact O-N 3.28Å; R344-L347 PolarHBondContact O-N 3.13Å; A345-L347 VanDerWaalsContact C-N 3.27Å; A345-L347 PolarHBondContact O-N 3.08Å; L347-K351 WeakPolarHBondContact O-CG 3.32Å
348Y91Very high90.7Very high129 Ų12995.5 Ų95.551%0.50643%0.427SS..Hα-helixtrans-73.1-46.4171.6-81.3-69000110.9R344 A345 K350 K351 E352R344-Y348 HydrophobicContact CG-CD2 3.96Å; R344-Y348 HydrophobicContact CG-CE2 3.6Å; R344-Y348 PolarHBondContact NH2-OH 2.91Å; R344-Y348 WeakPolarHBondContact O-CD2 3.34Å; R344-Y348 PolarHBondContact O-N 2.84Å; R344-Y348 VanDerWaalsContact O-N 3.15Å; A345-Y348 WeakPolarHBondContact O-CB 3.38Å; A345-Y348 PolarHBondContact O-N 3.38Å; Y348-K350 PolarHBondContact O-N 3.09Å; Y348-K351 WeakPolarHBondContact O-CB 3.38Å; Y348-K351 PolarHBondContact O-N 3.3Å; Y348-E352 PolarHBondContact O-N 3.29Å
349E89.3Confident90.1Very high135 Ų13591.9 Ų91.963%0.63142%0.417SS*.Hα-helixtrans-58.7-30.5177.9-69.7169.2-175.700113.1A345 K351A345-E349 PolarHBondContact O-N 3.22Å; E349-K351 VanDerWaalsContact C-N 3.31Å
350K83.6Confident89.6Confident149 Ų14998.8 Ų98.865%0.64845%0.447SS*.THydrogen-bonded Turntrans-75.9-14.8175.7-76175.6-178.5175.10114.6S346 Y348S346-K350 WeakPolarHBondContact O-CG 3.14Å; S346-K350 PolarHBondContact O-N 3.27Å; Y348-K350 PolarHBondContact O-N 3.09Å
351K77.6Confident88.9Confident178 Ų178101.3 Ų101.377%0.77446%0.463SS*.THydrogen-bonded Turntrans-95.9-22-179-73.7-179.6178.5-171.30112.6L347 Y348 E349L347-K351 WeakPolarHBondContact O-CG 3.32Å; Y348-K351 WeakPolarHBondContact O-CB 3.38Å; Y348-K351 PolarHBondContact O-N 3.3Å; E349-K351 VanDerWaalsContact C-N 3.31Å
352E59.6Low88.1Confident222 Ų222105.3 Ų105.3100%1.03748%0.477SS*.  trans-77.10164.4-63.7-176.2171.300109.7Y348Y348-E352 PolarHBondContact O-N 3.29Å

Retrieved 352 of 352 residues in 284.5 ms (Link to these results)

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