A0A087X4T9_POEFO Loading...

LHFPL tetraspan subfamily member 5b

AlphaFold DB , UniProt , Accession A0A087X4T9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 220 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
1S52.3Low65.1Low141 Ų141112.2 Ų112.299%0.98663%0.63SS**  0-46.90-137.70000112.5I3 M4S1-I3 PolarHBondContact O-N 3.47Å; S1-M4 PolarHBondContact O-N 3.28Å
2S57.3Low66.1Low87 Ų87107.7 Ų107.761%0.60862%0.617SS**Hα-helixtrans-65.3-27.9-170.3-48.40000117.3L6S2-L6 WeakPolarHBondContact O-CD1 3.38Å; S2-L6 PolarHBondContact O-N 3.35Å
3I56.8Low67.1Low139 Ų139103.8 Ų103.871%0.71361%0.606SS**Hα-helixtrans-71-34.4-177.2-66.4170.6000112.1S1 L6 L7S1-I3 PolarHBondContact O-N 3.47Å; I3-L6 PolarHBondContact O-N 3.49Å; I3-L7 HydrophobicContact CG2-CD1 4.49Å; I3-L7 PolarHBondContact O-N 3.4Å
4M55.3Low68Low153 Ų153107.5 Ų107.575%0.75461%0.611SS**Hα-helixtrans-73.6-27.1-178.9-161.583.789.300112.3S1 P8S1-M4 PolarHBondContact O-N 3.28Å; M4-P8 WeakPolarHBondContact O-CD 3.43Å; M4-P8 WeakPolarHBondContact O-CG 3.41Å
5D57.8Low68.8Low111 Ų111107.5 Ų107.559%0.59461%0.607SS**Hα-helixtrans-81.2-22.7174.9-68.6-42.2000112.8P8D5-P8 WeakPolarHBondContact O-CD 3.4Å; D5-P8 WeakPolarHBondContact O-CG 3.29Å
6L61.3Low69.4Low108 Ų108111.1 Ų111.157%0.56561%0.61SS**Hα-helixtrans-75.1-36.7178.3-104.1119.5000113.2S2 I3 A9 Q10S2-L6 WeakPolarHBondContact O-CD1 3.38Å; S2-L6 PolarHBondContact O-N 3.35Å; I3-L6 PolarHBondContact O-N 3.49Å; L6-A9 PolarHBondContact O-N 2.99Å; L6-Q10 WeakPolarHBondContact O-CB 2.89Å; L6-Q10 PolarHBondContact O-N 3.41Å
7L63.3Low70.1Confident97 Ų97110.3 Ų110.351%0.50860%0.601SS.*Hα-helixtrans-56.7-52.2175.6-93.3133.7000113.8I3 A9 Q10 E11I3-L7 HydrophobicContact CG2-CD1 4.49Å; I3-L7 PolarHBondContact O-N 3.4Å; L7-A9 VanDerWaalsContact C-N 3.33Å; L7-A9 PolarHBondContact O-N 3.44Å; L7-Q10 PolarHBondContact O-N 3.08Å; L7-E11 PolarHBondContact O-N 3.01Å; L7-E11 VanDerWaalsContact O-N 3.08Å
8P76.3Confident70.8Confident70 Ų70108.9 Ų108.946%0.45560%0.596SS.*Hα-helixtrans-67.9-31.917923.5-31.4000112.6M4 D5 A12M4-P8 WeakPolarHBondContact O-CD 3.43Å; M4-P8 WeakPolarHBondContact O-CG 3.41Å; D5-P8 WeakPolarHBondContact O-CD 3.4Å; D5-P8 WeakPolarHBondContact O-CG 3.29Å; P8-A12 VanDerWaalsContact O-CB 3.29Å; P8-A12 WeakPolarHBondContact O-CB 3.2Å; P8-A12 PolarHBondContact O-N 3.31Å
9A75.8Confident71.4Confident60 Ų60106.6 Ų106.650%0.49658%0.583SS.*Hα-helixtrans-66.5-40.5174.700000112.1L6 L7 A13L6-A9 PolarHBondContact O-N 2.99Å; L7-A9 VanDerWaalsContact C-N 3.33Å; L7-A9 PolarHBondContact O-N 3.44Å; A9-A13 WeakPolarHBondContact O-CB 3.47Å; A9-A13 PolarHBondContact O-N 3.49Å
10Q79Confident71.9Confident144 Ų144103.8 Ų103.867%0.67356%0.564SS**Hα-helixtrans-71.2-37.3179.6-164.6175.1-26.600112.2L6 L7 A13 K14L6-Q10 WeakPolarHBondContact O-CB 2.89Å; L6-Q10 PolarHBondContact O-N 3.41Å; L7-Q10 PolarHBondContact O-N 3.08Å; Q10-A13 PolarHBondContact O-N 3Å; Q10-K14 WeakPolarHBondContact O-CB 3.35Å; Q10-K14 PolarHBondContact O-N 2.91Å
11E80.6Confident72.4Confident124 Ų124100.4 Ų100.458%0.57955%0.547SS*.Hα-helixtrans-66.3-44.1172.7-72.8-176.917300112.1L7 A13 K14 I15L7-E11 PolarHBondContact O-N 3.01Å; L7-E11 VanDerWaalsContact O-N 3.08Å; E11-A13 VanDerWaalsContact C-N 3.34Å; E11-A13 PolarHBondContact O-N 3.42Å; E11-K14 PolarHBondContact O-N 2.99Å; E11-I15 WeakPolarHBondContact O-CG1 3.34Å; E11-I15 PolarHBondContact O-N 3.25Å
12A77.1Confident73.9Confident58 Ų58101.4 Ų101.448%0.47953%0.529SS..Hα-helixtrans-60.7-42.5174.700000111.8P8 I15 Y16P8-A12 VanDerWaalsContact O-CB 3.29Å; P8-A12 WeakPolarHBondContact O-CB 3.2Å; P8-A12 PolarHBondContact O-N 3.31Å; A12-I15 PolarHBondContact O-N 3.46Å; A12-Y16 WeakPolarHBondContact O-CB 3.34Å; A12-Y16 PolarHBondContact O-N 2.94Å
13A79Confident75.4Confident57 Ų57101.4 Ų101.447%0.47152%0.522SS..Hα-helixtrans-62.8-41.4175.800000112.2A9 Q10 E11 Y16 H17A9-A13 WeakPolarHBondContact O-CB 3.47Å; A9-A13 PolarHBondContact O-N 3.49Å; Q10-A13 PolarHBondContact O-N 3Å; E11-A13 VanDerWaalsContact C-N 3.34Å; E11-A13 PolarHBondContact O-N 3.42Å; A13-Y16 PolarHBondContact O-N 3.5Å; A13-H17 VanDerWaalsContact O-CB 3.31Å; A13-H17 WeakPolarHBondContact O-CB 3.31Å; A13-H17 PolarHBondContact O-N 3.35Å
14K80.6Confident76.7Confident156 Ų15695.1 Ų95.168%0.67849%0.49SS*.Hα-helixtrans-63.7-45.3176.7-171.9177.4-179.3179.90111.8Q10 E11 H17 T18Q10-K14 WeakPolarHBondContact O-CB 3.35Å; Q10-K14 PolarHBondContact O-N 2.91Å; E11-K14 PolarHBondContact O-N 2.99Å; K14-H17 PolarHBondContact O-N 2.87Å; K14-T18 PolarHBondContact O-N 3.3Å; K14-T18 PolarHBondContact O-OG1 3.1Å; K14-T18 VanDerWaalsContact O-OG1 3.07Å
15I79.3Confident78.1Confident107 Ų10796.5 Ų96.555%0.54949%0.487SS..Hα-helixtrans-62.9-44.8176.8-66.7166.3000110.6E11 A12 H17 T18 N19E11-I15 WeakPolarHBondContact O-CG1 3.34Å; E11-I15 PolarHBondContact O-N 3.25Å; A12-I15 PolarHBondContact O-N 3.46Å; I15-H17 PolarHBondContact O-N 3.41Å; I15-T18 PolarHBondContact O-N 3.01Å; I15-N19 WeakPolarHBondContact O-CB 3.45Å; I15-N19 PolarHBondContact O-N 3.43Å; I15-N19 PolarHBondContact O-ND2 3.43Å
16Y79.1Confident79.7Confident165 Ų16594.1 Ų94.165%0.64748%0.483SS*.Hα-helixtrans-59.3-47.1176.1-177.8-94.2000111.3A12 A13 N19 Y20A12-Y16 WeakPolarHBondContact O-CB 3.34Å; A12-Y16 PolarHBondContact O-N 2.94Å; A13-Y16 PolarHBondContact O-N 3.5Å; Y16-N19 PolarHBondContact O-N 3.35Å; Y16-Y20 HydrophobicContact CE1-CD2 4.36Å; Y16-Y20 VanDerWaalsContact O-CB 3.23Å; Y16-Y20 WeakPolarHBondContact O-CB 3.23Å; Y16-Y20 PolarHBondContact O-N 3.48Å
17H80Confident81Confident98 Ų9891.4 Ų91.445%0.45447%0.468SS..Hα-helixtrans-60.9-46.4178.5-173.2-93.6000112.2A13 K14 I15 N19 Y20 V21 L208A13-H17 VanDerWaalsContact O-CB 3.31Å; A13-H17 WeakPolarHBondContact O-CB 3.31Å; A13-H17 PolarHBondContact O-N 3.35Å; K14-H17 PolarHBondContact O-N 2.87Å; I15-H17 PolarHBondContact O-N 3.41Å; H17-N19 PolarHBondContact O-N 2.84Å; H17-Y20 PolarHBondContact O-N 3.35Å; H17-V21 WeakPolarHBondContact O-CG2 3.34Å; H17-V21 PolarHBondContact O-N 3.48Å; H17-L208 VanDerWaalsContact NE2-CD2 3.32Å; H17-L208 WeakPolarHBondContact NE2-CD2 3.36Å
18T82.8Confident82.3Confident86 Ų8686.9 Ų86.953%0.52845%0.445SS..Hα-helixtrans-62-44.4177.4-56.30000112.1K14 I15 Y20 V21 R22K14-T18 PolarHBondContact O-N 3.3Å; K14-T18 PolarHBondContact O-OG1 3.1Å; K14-T18 VanDerWaalsContact O-OG1 3.07Å; I15-T18 PolarHBondContact O-N 3.01Å; T18-Y20 VanDerWaalsContact C-N 3.34Å; T18-V21 PolarHBondContact O-N 2.96Å; T18-R22 PolarHBondContact O-N 3.16Å; T18-R22 VanDerWaalsContact O-N 3.08Å
19N83.2Confident82.9Confident64 Ų6488 Ų8834%0.34245%0.451SS..Hα-helixtrans-63.5-41.9176.3-78.4-34.3000111.7I15 Y16 H17 R22 N23I15-N19 WeakPolarHBondContact O-CB 3.45Å; I15-N19 PolarHBondContact O-N 3.43Å; I15-N19 PolarHBondContact O-ND2 3.43Å; Y16-N19 PolarHBondContact O-N 3.35Å; H17-N19 PolarHBondContact O-N 2.84Å; N19-R22 PolarHBondContact O-N 3.29Å; N19-R22 PolarHBondContact OD1-NH2 3.39Å; N19-R22 VanDerWaalsContact OD1-NH2 3.1Å; N19-N23 WeakPolarHBondContact O-CB 3.33Å; N19-N23 PolarHBondContact O-N 2.96Å; N19-N23 PolarHBondContact O-OD1 3.18Å
20Y81.7Confident83.7Confident50 Ų5090.4 Ų90.420%0.19645%0.453CS..Hα-helixtrans-61.7-47178.1-177.1-81.8000111.8Y16 H17 T18 R22 N23 S24 R204 L208Y16-Y20 HydrophobicContact CE1-CD2 4.36Å; Y16-Y20 VanDerWaalsContact O-CB 3.23Å; Y16-Y20 WeakPolarHBondContact O-CB 3.23Å; Y16-Y20 PolarHBondContact O-N 3.48Å; H17-Y20 PolarHBondContact O-N 3.35Å; T18-Y20 VanDerWaalsContact C-N 3.34Å; Y20-R22 PolarHBondContact O-N 2.93Å; Y20-N23 PolarHBondContact O-N 2.93Å; Y20-S24 WeakPolarHBondContact O-CB 3.36Å; Y20-S24 PolarHBondContact O-N 3.07Å; Y20-R204 HydrophobicContact CE1-CB 4.36Å; Y20-R204 VanDerWaalsContact OH-CA 3.27Å; Y20-R204 WeakPolarHBondContact OH-CA 3.09Å; Y20-R204 WeakPolarHBondContact OH-CB 3.5Å; Y20-R204 WeakPolarHBondContact OH-CG 3.4Å; Y20-R204 PolarHBondContact OH-O 3.08Å; Y20-L208 HydrophobicContact CD1-CD1 3.86Å; Y20-L208 HydrophobicContact CD1-CD2 3.69Å; Y20-L208 HydrophobicContact CD1-CG 3.88Å; Y20-L208 HydrophobicContact CE1-CD1 3.55Å; Y20-L208 HydrophobicContact CE1-CD2 3.85Å; Y20-L208 HydrophobicContact CE1-CG 3.52Å
21V81.9Confident84.3Confident34 Ų3483.6 Ų83.621%0.20642%0.421CS..Hα-helixtrans-62-45.2177.7172.60000111.3H17 T18 N23 S24 R25 L208H17-V21 WeakPolarHBondContact O-CG2 3.34Å; H17-V21 PolarHBondContact O-N 3.48Å; T18-V21 PolarHBondContact O-N 2.96Å; V21-N23 PolarHBondContact O-N 3.23Å; V21-S24 PolarHBondContact O-N 3.09Å; V21-R25 WeakPolarHBondContact O-CG 3.35Å; V21-R25 PolarHBondContact O-N 2.58Å; V21-L208 HydrophobicContact CG2-CD1 4.15Å; V21-L208 HydrophobicContact CG2-CD2 3.5Å; V21-L208 VanDerWaalsContact CG2-CD2 3.5Å; V21-L208 HydrophobicContact CG2-CG 4.48Å
22R84.5Confident84.9Confident161 Ų16178.1 Ų78.161%0.60840%0.397SS*.Hα-helixtrans-61.4-44.9178.2-174.7178.764.7-167.4-4.9111.4T18 N19 Y20 R25 A26T18-R22 PolarHBondContact O-N 3.16Å; T18-R22 VanDerWaalsContact O-N 3.08Å; N19-R22 PolarHBondContact O-N 3.29Å; N19-R22 PolarHBondContact OD1-NH2 3.39Å; N19-R22 VanDerWaalsContact OD1-NH2 3.1Å; Y20-R22 PolarHBondContact O-N 2.93Å; R22-R25 PolarHBondContact O-N 2.85Å; R22-A26 PolarHBondContact O-N 3.27Å
23N87.4Confident85.6Confident87 Ų8779 Ų7947%0.46540%0.396SS..Hα-helixtrans-66.4-40.6178.8-68.2-2.9000111.5N19 Y20 V21 A26 I27N19-N23 WeakPolarHBondContact O-CB 3.33Å; N19-N23 PolarHBondContact O-N 2.96Å; N19-N23 PolarHBondContact O-OD1 3.18Å; Y20-N23 PolarHBondContact O-N 2.93Å; V21-N23 PolarHBondContact O-N 3.23Å; N23-A26 PolarHBondContact O-N 3.43Å; N23-I27 WeakPolarHBondContact O-CD1 3.13Å; N23-I27 VanDerWaalsContact O-CG1 3.25Å; N23-I27 WeakPolarHBondContact O-CG1 3.15Å; N23-I27 PolarHBondContact O-N 3.25Å
24S84.8Confident86.4Confident7 Ų781 Ų815%0.04939%0.394CS..Hα-helixtrans-60.2-46175.9-170.80000111.7Y20 V21 A26 I27 G28Y20-S24 WeakPolarHBondContact O-CB 3.36Å; Y20-S24 PolarHBondContact O-N 3.07Å; V21-S24 PolarHBondContact O-N 3.09Å; S24-A26 PolarHBondContact O-N 3.5Å; S24-I27 PolarHBondContact O-N 3.14Å; S24-G28 PolarHBondContact O-N 3.39Å
25R85.6Confident87.1Confident183 Ų18373.6 Ų73.669%0.69136%0.362SS*.Hα-helixtrans-62.4-41.7176.3-71178179.9-171.40.3112.4V21 R22 I27 G28 V29V21-R25 WeakPolarHBondContact O-CG 3.35Å; V21-R25 PolarHBondContact O-N 2.58Å; R22-R25 PolarHBondContact O-N 2.85Å; R25-I27 PolarHBondContact O-N 3.29Å; R25-G28 PolarHBondContact O-N 2.67Å; R25-V29 WeakPolarHBondContact O-CG2 3.15Å; R25-V29 PolarHBondContact O-N 3.08Å
26A89.4Confident87.8Confident60 Ų6072.7 Ų72.750%0.49636%0.357SS..Hα-helixtrans-61.8-42.5176.600000112.1R22 N23 S24 V29 M30R22-A26 PolarHBondContact O-N 3.27Å; N23-A26 PolarHBondContact O-N 3.43Å; S24-A26 PolarHBondContact O-N 3.5Å; A26-V29 PolarHBondContact O-N 3.02Å; A26-M30 PolarHBondContact O-N 3.29Å
27I89.8Confident88.6Confident52 Ų5267.9 Ų67.927%0.26735%0.347SS..Hα-helixtrans-65.9-39.4175.7-62.4162.1000110.6N23 S24 R25 M30 W31 L201N23-I27 WeakPolarHBondContact O-CD1 3.13Å; N23-I27 VanDerWaalsContact O-CG1 3.25Å; N23-I27 WeakPolarHBondContact O-CG1 3.15Å; N23-I27 PolarHBondContact O-N 3.25Å; S24-I27 PolarHBondContact O-N 3.14Å; R25-I27 PolarHBondContact O-N 3.29Å; I27-M30 PolarHBondContact O-N 3.32Å; I27-W31 WeakPolarHBondContact O-CB 3.29Å; I27-W31 PolarHBondContact O-N 3.36Å; I27-L201 HydrophobicContact CB-CD2 3.94Å; I27-L201 HydrophobicContact CG2-CD1 4.17Å; I27-L201 HydrophobicContact CG2-CD2 3.71Å; I27-L201 HydrophobicContact CG2-CG 4.1Å
28G89.6Confident89.3Confident2 Ų263.4 Ų63.42%0.02133%0.326CS..Hα-helixtrans-60.8-42.6174.700000113.3S24 R25 W31 A32S24-G28 PolarHBondContact O-N 3.39Å; R25-G28 PolarHBondContact O-N 2.67Å; G28-W31 PolarHBondContact O-N 3.43Å; G28-A32 PolarHBondContact O-N 3.26Å
29V90Very high89.9Confident94 Ų9460.2 Ų60.257%0.5731%0.308SS*.Hα-helixtrans-64.3-44.1174.6173.70000111.1R25 A26 W31 A32 V33R25-V29 WeakPolarHBondContact O-CG2 3.15Å; R25-V29 PolarHBondContact O-N 3.08Å; A26-V29 PolarHBondContact O-N 3.02Å; V29-W31 VanDerWaalsContact C-N 3.34Å; V29-W31 PolarHBondContact O-N 3.02Å; V29-A32 PolarHBondContact O-N 3.49Å; V29-V33 WeakPolarHBondContact O-CG2 3.32Å; V29-V33 PolarHBondContact O-N 3.5Å
30M91.5Very high90.5Very high110 Ų11061.9 Ų61.954%0.54232%0.316SS..Hα-helixtrans-60.1-44.8176.4-179.1-178.7-70.300111.7A26 I27 A32 V33 F34A26-M30 PolarHBondContact O-N 3.29Å; I27-M30 PolarHBondContact O-N 3.32Å; M30-A32 VanDerWaalsContact C-N 3.33Å; M30-A32 PolarHBondContact O-N 3.48Å; M30-V33 PolarHBondContact O-N 2.9Å; M30-F34 HydrophobicContact CG-CD2 3.8Å; M30-F34 HydrophobicContact CG-CE2 3.33Å; M30-F34 HydrophobicContact CG-CZ 3.96Å; M30-F34 WeakPolarHBondContact O-CD2 3.11Å; M30-F34 WeakPolarHBondContact O-CG 3.43Å; M30-F34 PolarHBondContact O-N 3.4Å; M30-F34 HydrophobicContact SD-CE2 3.79Å; M30-F34 HydrophobicContact SD-CZ 4.37Å
31W93.2Very high91.2Very high1 Ų162.7 Ų62.70%0.00432%0.323CS..Hα-helixtrans-60-42175.5178.187.7000112.1I27 G28 V29 F34 T35 M114 F117 Y129 C132 L194 L201I27-W31 WeakPolarHBondContact O-CB 3.29Å; I27-W31 PolarHBondContact O-N 3.36Å; G28-W31 PolarHBondContact O-N 3.43Å; V29-W31 VanDerWaalsContact C-N 3.34Å; V29-W31 PolarHBondContact O-N 3.02Å; W31-F34 PolarHBondContact O-N 3.41Å; W31-T35 WeakPolarHBondContact O-CB 3.45Å; W31-T35 PolarHBondContact O-N 3.29Å; W31-T35 PolarHBondContact O-OG1 3.43Å; W31-M114 HydrophobicContact CZ3-CE 4.46Å; W31-F117 HydrophobicContact CE3-CD2 4.32Å; W31-F117 AromaticContact CZ3-CD2 3.79Å; W31-F117 HydrophobicContact CZ3-CD2 3.79Å; W31-F117 HydrophobicContact CZ3-CE2 4.41Å; W31-Y129 HydrophobicContact CE3-CE1 4.3Å; W31-C132 HydrophobicContact CH2-CB 3.74Å; W31-C132 HydrophobicContact CZ2-CB 3.92Å; W31-L194 PolarHBondContact NE1-O 2.96Å; W31-L201 HydrophobicContact CB-CD1 4Å; W31-L201 HydrophobicContact CG-CD1 4.21Å
32A91.8Very high91.9Very high9 Ų961.1 Ų61.17%0.07431%0.313CS..Hα-helixtrans-62.7-47.1177.400000111.4G28 V29 M30 F34 T35 I36 F117G28-A32 PolarHBondContact O-N 3.26Å; V29-A32 PolarHBondContact O-N 3.49Å; M30-A32 VanDerWaalsContact C-N 3.33Å; M30-A32 PolarHBondContact O-N 3.48Å; A32-F34 PolarHBondContact O-N 2.93Å; A32-T35 PolarHBondContact O-N 2.92Å; A32-I36 VanDerWaalsContact O-CG1 3.31Å; A32-I36 WeakPolarHBondContact O-CG1 3.27Å; A32-I36 PolarHBondContact O-N 3.04Å; A32-F117 HydrophobicContact CB-CD2 4.22Å; A32-F117 HydrophobicContact CB-CE1 4.08Å; A32-F117 HydrophobicContact CB-CE2 3.71Å; A32-F117 HydrophobicContact CB-CZ 3.63Å
33V93.3Very high92.5Very high76 Ų7658.2 Ų58.246%0.46131%0.308SS..Hα-helixtrans-59.3-47177.4173.30000111.2V29 M30 T35 I36 C37V29-V33 WeakPolarHBondContact O-CG2 3.32Å; V29-V33 PolarHBondContact O-N 3.5Å; M30-V33 PolarHBondContact O-N 2.9Å; V33-T35 VanDerWaalsContact C-N 3.34Å; V33-T35 PolarHBondContact O-N 3.35Å; V33-I36 PolarHBondContact O-N 2.99Å; V33-C37 PolarHBondContact O-N 3.24Å; V33-C37 PolarHBondContact O-SG 2.91Å
34F94.6Very high93Very high100 Ų10056.5 Ų56.544%0.43930%0.3SS..Hα-helixtrans-64.5-38.9177.6-67.8-37.3000112.5M30 W31 A32 I36 C37 F38 L194M30-F34 HydrophobicContact CG-CD2 3.8Å; M30-F34 HydrophobicContact CG-CE2 3.33Å; M30-F34 HydrophobicContact CG-CZ 3.96Å; M30-F34 WeakPolarHBondContact O-CD2 3.11Å; M30-F34 WeakPolarHBondContact O-CG 3.43Å; M30-F34 PolarHBondContact O-N 3.4Å; M30-F34 HydrophobicContact SD-CE2 3.79Å; M30-F34 HydrophobicContact SD-CZ 4.37Å; W31-F34 PolarHBondContact O-N 3.41Å; A32-F34 PolarHBondContact O-N 2.93Å; F34-I36 VanDerWaalsContact C-N 3.32Å; F34-I36 PolarHBondContact O-N 3.28Å; F34-C37 PolarHBondContact O-N 3.5Å; F34-F38 VanDerWaalsContact O-CB 3.25Å; F34-F38 WeakPolarHBondContact O-CB 3.44Å; F34-F38 PolarHBondContact O-N 2.96Å; F34-L194 HydrophobicContact CB-CD2 3.68Å
35T94.5Very high93.6Very high0 Ų056.1 Ų56.10%030%0.298CS..Hα-helixtrans-66.1-34.4176.7-53.10000111.8W31 A32 V33 F38 S39 M114W31-T35 WeakPolarHBondContact O-CB 3.45Å; W31-T35 PolarHBondContact O-N 3.29Å; W31-T35 PolarHBondContact O-OG1 3.43Å; A32-T35 PolarHBondContact O-N 2.92Å; V33-T35 VanDerWaalsContact C-N 3.34Å; V33-T35 PolarHBondContact O-N 3.35Å; T35-F38 PolarHBondContact O-N 3.11Å; T35-S39 WeakPolarHBondContact O-CB 3.25Å; T35-S39 PolarHBondContact O-N 3.04Å; T35-M114 VanDerWaalsContact C-SD 3.56Å; T35-M114 VanDerWaalsContact CB-CE 3.5Å; T35-M114 HydrophobicContact CG2-CE 3.4Å; T35-M114 VanDerWaalsContact CG2-CE 3.4Å; T35-M114 HydrophobicContact CG2-CG 4.01Å; T35-M114 HydrophobicContact CG2-SD 3.78Å
36I94.3Very high94.1Very high87 Ų8748.6 Ų48.645%0.44627%0.27SS..Hα-helixtrans-62.7-52.6173-67.9167.2000109.7A32 V33 F34 F38 S39 I40 M114A32-I36 VanDerWaalsContact O-CG1 3.31Å; A32-I36 WeakPolarHBondContact O-CG1 3.27Å; A32-I36 PolarHBondContact O-N 3.04Å; V33-I36 PolarHBondContact O-N 2.99Å; F34-I36 VanDerWaalsContact C-N 3.32Å; F34-I36 PolarHBondContact O-N 3.28Å; I36-F38 PolarHBondContact O-N 3.5Å; I36-S39 PolarHBondContact O-N 3.3Å; I36-S39 VanDerWaalsContact O-N 3.16Å; I36-S39 PolarHBondContact O-OG 2.72Å; I36-I40 HydrophobicContact CG2-CD1 4.39Å; I36-I40 PolarHBondContact O-N 3.48Å; I36-M114 VanDerWaalsContact CA-SD 3.53Å; I36-M114 HydrophobicContact CB-SD 4.01Å; I36-M114 HydrophobicContact CG1-CE 4.37Å; I36-M114 HydrophobicContact CG1-SD 3.27Å; I36-M114 WeakPolarHBondContact CG1-SD 3.43Å; I36-M114 PolarHBondContact N-SD 3.21Å
37C95.6Very high94.4Very high65 Ų6549.5 Ų49.544%0.43927%0.266SS..Hα-helixtrans-57.2-42.5177.5-67.10000111.4V33 F34 S39 I40 I41V33-C37 PolarHBondContact O-N 3.24Å; V33-C37 PolarHBondContact O-SG 2.91Å; F34-C37 PolarHBondContact O-N 3.5Å; C37-S39 PolarHBondContact O-N 3.39Å; C37-I40 PolarHBondContact O-N 2.86Å; C37-I41 WeakPolarHBondContact O-CG1 3.39Å; C37-I41 PolarHBondContact O-N 2.86Å
38F95.8Very high94.7Very high3 Ų350.3 Ų50.31%0.01327%0.268CS..Hα-helixtrans-62-41.8177.6-174-121.3000112.6F34 T35 I36 I40 I41 T42 V110 S187 D190 A191 L194F34-F38 VanDerWaalsContact O-CB 3.25Å; F34-F38 WeakPolarHBondContact O-CB 3.44Å; F34-F38 PolarHBondContact O-N 2.96Å; T35-F38 PolarHBondContact O-N 3.11Å; I36-F38 PolarHBondContact O-N 3.5Å; F38-I40 VanDerWaalsContact C-N 3.29Å; F38-I40 PolarHBondContact O-N 3.33Å; F38-I41 PolarHBondContact O-N 2.93Å; F38-T42 HydrophobicContact CD1-CG2 4.36Å; F38-T42 HydrophobicContact CD2-CG2 4.22Å; F38-T42 HydrophobicContact CE1-CG2 3.91Å; F38-T42 HydrophobicContact CE2-CG2 3.79Å; F38-T42 HydrophobicContact CG-CG2 4.48Å; F38-T42 HydrophobicContact CZ-CG2 3.57Å; F38-T42 WeakPolarHBondContact O-CG2 3.02Å; F38-T42 PolarHBondContact O-N 3.49Å; F38-T42 PolarHBondContact O-OG1 2.81Å; F38-V110 HydrophobicContact CD1-CB 4.42Å; F38-V110 HydrophobicContact CD1-CG1 3.46Å; F38-V110 VanDerWaalsContact CD1-CG1 3.46Å; F38-V110 HydrophobicContact CD1-CG2 4.01Å; F38-V110 HydrophobicContact CE1-CB 4.36Å; F38-V110 HydrophobicContact CE1-CG1 3.86Å; F38-V110 HydrophobicContact CE1-CG2 3.5Å; F38-V110 VanDerWaalsContact CE1-CG2 3.5Å; F38-V110 HydrophobicContact CG-CG1 4.39Å; F38-V110 HydrophobicContact CZ-CG2 4.43Å; F38-S187 WeakPolarHBondContact CE2-O 3.47Å; F38-S187 VanDerWaalsContact CZ-O 3.3Å; F38-S187 WeakPolarHBondContact CZ-O 3.15Å; F38-D190 HydrophobicContact CD2-CB 4.15Å; F38-D190 WeakPolarHBondContact CD2-OD2 3.42Å; F38-D190 HydrophobicContact CE2-CB 3.92Å; F38-A191 HydrophobicContact CE1-CB 3.92Å; F38-A191 HydrophobicContact CZ-CB 3.71Å; F38-L194 HydrophobicContact CB-CD1 3.88Å; F38-L194 HydrophobicContact CD1-CD1 3.93Å; F38-L194 HydrophobicContact CG-CD1 3.92Å
39S95.9Very high95Very high20 Ų2051 Ų5114%0.1427%0.272CS..Hα-helixtrans-59.6-39.5175.976.40000112.4T35 I36 C37 T42 M43T35-S39 WeakPolarHBondContact O-CB 3.25Å; T35-S39 PolarHBondContact O-N 3.04Å; I36-S39 PolarHBondContact O-N 3.3Å; I36-S39 VanDerWaalsContact O-N 3.16Å; I36-S39 PolarHBondContact O-OG 2.72Å; C37-S39 PolarHBondContact O-N 3.39Å; S39-T42 PolarHBondContact O-OG1 3.47Å; S39-T42 VanDerWaalsContact O-OG1 3.04Å; S39-M43 WeakPolarHBondContact O-CB 3.37Å; S39-M43 PolarHBondContact O-N 3.36Å
40I96Very high95.3Very high99 Ų9949.7 Ų49.751%0.50826%0.258SS..Hα-helixtrans-66.6-45.3176-61.9167.6000110I36 C37 F38 T42 M43 V44I36-I40 HydrophobicContact CG2-CD1 4.39Å; I36-I40 PolarHBondContact O-N 3.48Å; C37-I40 PolarHBondContact O-N 2.86Å; F38-I40 VanDerWaalsContact C-N 3.29Å; F38-I40 PolarHBondContact O-N 3.33Å; I40-T42 PolarHBondContact O-N 3.19Å; I40-M43 PolarHBondContact O-N 2.88Å; I40-V44 HydrophobicContact CG2-CG2 4.37Å; I40-V44 WeakPolarHBondContact O-CB 3.38Å; I40-V44 VanDerWaalsContact O-CG2 3.26Å; I40-V44 WeakPolarHBondContact O-CG2 3.44Å; I40-V44 PolarHBondContact O-N 3.46Å
41I96.1Very high95.6Very high67 Ų6744.5 Ų44.534%0.34423%0.232SC..Hα-helixtrans-60.5-47.9179.2-68.2167.4000110.9C37 F38 M43 V44 V45C37-I41 WeakPolarHBondContact O-CG1 3.39Å; C37-I41 PolarHBondContact O-N 2.86Å; F38-I41 PolarHBondContact O-N 2.93Å; I41-M43 VanDerWaalsContact C-N 3.35Å; I41-M43 PolarHBondContact O-N 3.47Å; I41-V44 PolarHBondContact O-N 2.97Å; I41-V45 HydrophobicContact CG2-CG2 4.37Å; I41-V45 WeakPolarHBondContact O-CB 3.4Å; I41-V45 WeakPolarHBondContact O-CG2 3.33Å; I41-V45 PolarHBondContact O-N 3.4Å
42T96.9Very high95.7Very high0 Ų044.4 Ų44.40%023%0.232CC..Hα-helixtrans-65.4-36.5-179.957.40000112.6F38 S39 I40 V45 F46 V110F38-T42 HydrophobicContact CD1-CG2 4.36Å; F38-T42 HydrophobicContact CD2-CG2 4.22Å; F38-T42 HydrophobicContact CE1-CG2 3.91Å; F38-T42 HydrophobicContact CE2-CG2 3.79Å; F38-T42 HydrophobicContact CG-CG2 4.48Å; F38-T42 HydrophobicContact CZ-CG2 3.57Å; F38-T42 WeakPolarHBondContact O-CG2 3.02Å; F38-T42 PolarHBondContact O-N 3.49Å; F38-T42 PolarHBondContact O-OG1 2.81Å; S39-T42 PolarHBondContact O-OG1 3.47Å; S39-T42 VanDerWaalsContact O-OG1 3.04Å; I40-T42 PolarHBondContact O-N 3.19Å; T42-V45 PolarHBondContact O-N 2.97Å; T42-F46 WeakPolarHBondContact O-CB 3.41Å; T42-F46 PolarHBondContact O-N 2.97Å; T42-V110 HydrophobicContact CG2-CG2 4.31Å
43M96.8Very high95.8Very high101 Ų10144 Ų4450%0.49823%0.228SC..Hα-helixtrans-62.4-45.3171.1179.9-177163.400111.9S39 I40 I41 F46 I47 M107S39-M43 WeakPolarHBondContact O-CB 3.37Å; S39-M43 PolarHBondContact O-N 3.36Å; I40-M43 PolarHBondContact O-N 2.88Å; I41-M43 VanDerWaalsContact C-N 3.35Å; I41-M43 PolarHBondContact O-N 3.47Å; M43-F46 PolarHBondContact O-N 2.96Å; M43-I47 HydrophobicContact CE-CD1 3.59Å; M43-I47 HydrophobicContact CG-CD1 3.72Å; M43-I47 WeakPolarHBondContact O-CG1 3.33Å; M43-I47 PolarHBondContact O-N 3.2Å; M43-M107 HydrophobicContact CB-CG 4.44Å
44V96.9Very high95.8Very high50 Ų5042.6 Ų42.630%0.30322%0.218SC..Hα-helixtrans-61.6-45.9176.7169.60000110.7I40 I41 F46 I47 Q48 W179I40-V44 HydrophobicContact CG2-CG2 4.37Å; I40-V44 WeakPolarHBondContact O-CB 3.38Å; I40-V44 VanDerWaalsContact O-CG2 3.26Å; I40-V44 WeakPolarHBondContact O-CG2 3.44Å; I40-V44 PolarHBondContact O-N 3.46Å; I41-V44 PolarHBondContact O-N 2.97Å; V44-F46 VanDerWaalsContact C-N 3.28Å; V44-F46 PolarHBondContact O-N 3.34Å; V44-I47 PolarHBondContact O-N 2.86Å; V44-Q48 HydrophobicContact CG1-CG 3.8Å; V44-Q48 WeakPolarHBondContact O-CB 3.4Å; V44-Q48 VanDerWaalsContact O-CG 3.23Å; V44-Q48 WeakPolarHBondContact O-CG 3.39Å; V44-Q48 PolarHBondContact O-N 3.25Å; V44-W179 HydrophobicContact CG1-CH2 3.68Å; V44-W179 HydrophobicContact CG1-CZ3 3.78Å
45V97.5Very high95.6Very high0 Ų039 Ų390%021%0.205CC..Hα-helixtrans-58.1-40.6177164.30000111.7I41 T42 W51 L183 A184I41-V45 HydrophobicContact CG2-CG2 4.37Å; I41-V45 WeakPolarHBondContact O-CB 3.4Å; I41-V45 WeakPolarHBondContact O-CG2 3.33Å; I41-V45 PolarHBondContact O-N 3.4Å; T42-V45 PolarHBondContact O-N 2.97Å; V45-W51 HydrophobicContact CG1-CZ2 3.63Å; V45-W51 PolarHBondContact O-NE1 2.96Å; V45-L183 HydrophobicContact CG2-CB 3.59Å; V45-L183 HydrophobicContact CG2-CD1 4.49Å; V45-A184 HydrophobicContact CG1-CB 3.67Å
46F97.3Very high95.3Very high24 Ų2445.8 Ų45.811%0.10525%0.246CC..Hα-helixtrans-69.1-45178.8-179.1-106.8000112.6T42 M43 V44 L66 F67 M100 V103 M107T42-F46 WeakPolarHBondContact O-CB 3.41Å; T42-F46 PolarHBondContact O-N 2.97Å; M43-F46 PolarHBondContact O-N 2.96Å; V44-F46 VanDerWaalsContact C-N 3.28Å; V44-F46 PolarHBondContact O-N 3.34Å; F46-L66 HydrophobicContact CD2-CD1 3.89Å; F46-L66 HydrophobicContact CE2-CD1 4.46Å; F46-F67 HydrophobicContact CD1-CE1 4.28Å; F46-F67 AromaticContact CE1-CE1 3.96Å; F46-F67 HydrophobicContact CE1-CE1 3.96Å; F46-F67 HydrophobicContact CE2-CE1 4.46Å; F46-F67 HydrophobicContact CZ-CD1 4.35Å; F46-F67 HydrophobicContact CZ-CE1 4.06Å; F46-F67 VanDerWaalsContact O-CE1 3.23Å; F46-F67 WeakPolarHBondContact O-CE1 3.49Å; F46-M100 HydrophobicContact CE2-CG 3.94Å; F46-M100 HydrophobicContact CZ-CG 4.26Å; F46-V103 HydrophobicContact CD2-CB 4.47Å; F46-V103 HydrophobicContact CD2-CG1 4.12Å; F46-M107 HydrophobicContact CD1-CE 3.86Å; F46-M107 HydrophobicContact CE1-CE 4.27Å; F46-M107 HydrophobicContact CG-CE 4.27Å
47I95.5Very high95Very high79 Ų7946.9 Ų46.941%0.40525%0.253SS..Hα-helixtrans-80.7-36.8-172.7-65.4172.2000112.3M43 V44M43-I47 HydrophobicContact CE-CD1 3.59Å; M43-I47 HydrophobicContact CG-CD1 3.72Å; M43-I47 WeakPolarHBondContact O-CG1 3.33Å; M43-I47 PolarHBondContact O-N 3.2Å; V44-I47 PolarHBondContact O-N 2.86Å
48Q96.4Very high94.6Very high69 Ų6944.8 Ų44.832%0.32224%0.238SC..  trans-77.1128.9-168.5-71.4-71.7-20.300112V44 Y50 W179V44-Q48 HydrophobicContact CG1-CG 3.8Å; V44-Q48 WeakPolarHBondContact O-CB 3.4Å; V44-Q48 VanDerWaalsContact O-CG 3.23Å; V44-Q48 WeakPolarHBondContact O-CG 3.39Å; V44-Q48 PolarHBondContact O-N 3.25Å; Q48-Y50 HydrophobicContact CB-CD2 4.3Å; Q48-Y50 PolarHBondContact O-N 3.28Å; Q48-W179 HydrophobicContact CB-CH2 3.84Å; Q48-W179 HydrophobicContact CB-CZ2 4.08Å; Q48-W179 HydrophobicContact CG-CH2 3.78Å; Q48-W179 HydrophobicContact CG-CZ2 4.2Å
49P94.8Very high94Very high16 Ų1649.5 Ų49.510%0.10427%0.269CS..  trans-8425.8-173.637.8-39.3000113.3Y63 F64 G65 H68P49-Y63 HydrophobicContact CB-CD2 3.73Å; P49-Y63 HydrophobicContact CB-CE2 3.87Å; P49-Y63 HydrophobicContact CG-CD2 3.65Å; P49-Y63 HydrophobicContact CG-CE2 3.41Å; P49-Y63 VanDerWaalsContact CG-CE2 3.41Å; P49-Y63 WeakPolarHBondContact O-CD2 3.5Å; P49-F64 CarbonylContact C-O 3.5Å; P49-F64 CarbonylContact O-C 3.15Å; P49-F64 PolarHBondContact O-N 3.26Å; P49-G65 PolarHBondContact O-N 3.19Å; P49-H68 HydrophobicContact CB-CB 4.35Å; P49-H68 WeakPolarHBondContact CB-O 3.37Å
50Y95.9Very high93.6Very high68 Ų6849.9 Ų49.927%0.26727%0.269SS..  trans-107.753.2-174.2-61-66.7000111.3Q48 Y63 R178 W179 A180Q48-Y50 HydrophobicContact CB-CD2 4.3Å; Q48-Y50 PolarHBondContact O-N 3.28Å; Y50-Y63 HydrophobicContact CD1-CD1 4.33Å; Y50-Y63 HydrophobicContact CD1-CD2 4.33Å; Y50-Y63 AromaticContact CD1-CG 3.96Å; Y50-Y63 HydrophobicContact CD1-CG 3.96Å; Y50-Y63 AromaticContact CE1-CD1 3.74Å; Y50-Y63 HydrophobicContact CE1-CD1 3.74Å; Y50-Y63 HydrophobicContact CE1-CD2 4.14Å; Y50-Y63 HydrophobicContact CE1-CE1 4.03Å; Y50-Y63 HydrophobicContact CE1-CE2 4.42Å; Y50-Y63 AromaticContact CE1-CG 3.78Å; Y50-Y63 HydrophobicContact CE1-CG 3.78Å; Y50-R178 CarbonylContact O-C 3.57Å; Y50-R178 WeakPolarHBondContact O-CB 3.35Å; Y50-W179 AromaticContact CD2-CZ2 3.71Å; Y50-W179 HydrophobicContact CD2-CZ2 3.71Å; Y50-W179 AromaticContact CD2-NE1 3.84Å; Y50-W179 HydrophobicContact CG-CZ2 4.33Å; Y50-W179 AromaticContact CG-NE1 3.71Å; Y50-A180 WeakPolarHBondContact O-CB 3.23Å; Y50-A180 PolarHBondContact O-N 2.02Å; Y50-A180 VanDerWaalsContact O-N 3.09Å
51W97.4Very high93.3Very high0 Ų047.6 Ų47.60%027%0.265CS..SBendtrans-87.6-48.4174.7-78.152.8000111V45 F64 L66 V103 Y150 R178 A180 Y181 A184V45-W51 HydrophobicContact CG1-CZ2 3.63Å; V45-W51 PolarHBondContact O-NE1 2.96Å; W51-F64 WeakPolarHBondContact CB-O 3.4Å; W51-F64 PolarHBondContact N-O 3.33Å; W51-L66 HydrophobicContact CD2-CD2 4.28Å; W51-L66 HydrophobicContact CD2-CG 4.12Å; W51-L66 HydrophobicContact CE3-CD2 4.1Å; W51-L66 HydrophobicContact CE3-CG 4.45Å; W51-L66 HydrophobicContact CH2-CD1 4.21Å; W51-L66 HydrophobicContact CH2-CD2 3.76Å; W51-L66 HydrophobicContact CH2-CG 4.18Å; W51-L66 HydrophobicContact CZ2-CD1 3.57Å; W51-L66 HydrophobicContact CZ2-CD2 3.87Å; W51-L66 HydrophobicContact CZ2-CG 3.74Å; W51-L66 HydrophobicContact CZ3-CD2 3.84Å; W51-L66 HydrophobicContact CZ3-CG 4.48Å; W51-V103 HydrophobicContact CH2-CG1 4.49Å; W51-V103 HydrophobicContact CH2-CG2 3.87Å; W51-V103 HydrophobicContact CZ2-CG1 4.3Å; W51-V103 HydrophobicContact CZ2-CG2 4.43Å; W51-Y150 HydrophobicContact CB-CE1 3.87Å; W51-Y150 HydrophobicContact CB-CE2 4.46Å; W51-Y150 WeakPolarHBondContact CB-OH 3.42Å; W51-Y150 HydrophobicContact CD2-CE1 4.48Å; W51-Y150 HydrophobicContact CD2-CE2 4.3Å; W51-Y150 AromaticContact CE3-CD1 3.66Å; W51-Y150 HydrophobicContact CE3-CD1 3.66Å; W51-Y150 AromaticContact CE3-CD2 3.67Å; W51-Y150 HydrophobicContact CE3-CD2 3.67Å; W51-Y150 AromaticContact CE3-CE1 3.78Å; W51-Y150 HydrophobicContact CE3-CE1 3.78Å; W51-Y150 AromaticContact CE3-CE2 3.8Å; W51-Y150 HydrophobicContact CE3-CE2 3.8Å; W51-Y150 AromaticContact CE3-CG 3.59Å; W51-Y150 HydrophobicContact CE3-CG 3.59Å; W51-Y150 AromaticContact CE3-CZ 3.85Å; W51-Y150 HydrophobicContact CZ3-CD1 4.24Å; W51-Y150 HydrophobicContact CZ3-CD2 4.01Å; W51-Y150 AromaticContact CZ3-CG 3.84Å; W51-Y150 HydrophobicContact CZ3-CG 3.84Å; W51-R178 PolarHBondContact O-N 2.56Å; W51-A180 HydrophobicContact CG-CB 4.45Å; W51-Y181 HydrophobicContact CD2-CD2 4.17Å; W51-Y181 AromaticContact CE3-CD2 3.3Å; W51-Y181 HydrophobicContact CE3-CD2 3.3Å; W51-Y181 AromaticContact CE3-CE2 3.95Å; W51-Y181 HydrophobicContact CE3-CE2 3.95Å; W51-Y181 HydrophobicContact CE3-CG 4.25Å; W51-Y181 HydrophobicContact CH2-CD2 4.29Å; W51-Y181 AromaticContact CZ3-CD2 3.39Å; W51-Y181 HydrophobicContact CZ3-CD2 3.39Å; W51-Y181 AromaticContact CZ3-CE2 3.74Å; W51-Y181 HydrophobicContact CZ3-CE2 3.74Å; W51-A184 HydrophobicContact CH2-CB 3.9Å; W51-A184 HydrophobicContact CZ2-CB 4.08Å
52I96.3Very high93.1Very high0 Ų044.5 Ų44.50%025%0.249CC..EExtended strand (participates in β ladder)trans-131.7160.4168.959.7170.7000109.3Y63 F64 Y150 W154 V159 L172 T176I52-Y63 CarbonylContact O-C 3.45Å; I52-Y63 WeakPolarHBondContact O-CA 3.3Å; I52-F64 HydrophobicContact CD1-CB 4.02Å; I52-F64 HydrophobicContact CD1-CD2 3.93Å; I52-F64 HydrophobicContact CD1-CG 4.17Å; I52-F64 HydrophobicContact CG1-CB 3.63Å; I52-F64 HydrophobicContact CG1-CD2 3.96Å; I52-F64 HydrophobicContact CG1-CG 4.17Å; I52-F64 PolarHBondContact N-O 3.28Å; I52-F64 VanDerWaalsContact N-O 3.13Å; I52-F64 PolarHBondContact O-N 2.91Å; I52-Y150 HydrophobicContact CG2-CE1 4.09Å; I52-W154 HydrophobicContact CG2-CZ2 4.33Å; I52-V159 HydrophobicContact CD1-CG1 4.07Å; I52-L172 HydrophobicContact CB-CD1 4.46Å; I52-L172 HydrophobicContact CB-CD2 4.27Å; I52-L172 HydrophobicContact CD1-CD1 4.11Å; I52-L172 HydrophobicContact CG2-CD1 3.95Å; I52-L172 HydrophobicContact CG2-CD2 3.87Å; I52-T176 WeakPolarHBondContact CA-O 3.34Å
53G94.6Very high93Very high0 Ų046.3 Ų46.30%026%0.257CS..EExtended strand (participates in β ladder)trans-173.1-165.2171.800000114.4G62 C175 T176G53-G62 CarbonylContact C-O 3.59Å; G53-G62 VanDerWaalsContact CA-O 3.25Å; G53-G62 WeakPolarHBondContact CA-O 3.49Å; G53-C175 WeakPolarHBondContact O-CA 2.99Å; G53-C175 VanDerWaalsContact O-CB 3.24Å; G53-C175 WeakPolarHBondContact O-CB 3.3Å; G53-T176 PolarHBondContact N-O 3.15Å; G53-T176 PolarHBondContact O-N 2.77Å
54D92.6Very high93Very high47 Ų4741.6 Ų41.625%0.25123%0.233SC..  trans-62.9156.3-176.461.9-77.5000112.1T58 G62 M162 T176 R178D54-T58 WeakPolarHBondContact CA-OG1 3.47Å; D54-T58 VanDerWaalsContact CB-OG1 3.26Å; D54-T58 WeakPolarHBondContact CB-OG1 3.4Å; D54-G62 PolarHBondContact N-O 3.22Å; D54-G62 PolarHBondContact OD1-N 3.32Å; D54-M162 HydrophobicContact CB-CE 3.37Å; D54-T176 PolarHBondContact O-OG1 3.29Å; D54-R178 VanDerWaalsContact CG-NH2 3.25Å; D54-R178 PolarHBondContact O-NH2 3.23Å; D54-R178 IonicContact OD1-CZ 2.58Å; D54-R178 IonicContact OD1-NH2 3.49Å; D54-R178 PolarHBondContact OD1-NH2 2.91Å; D54-R178 IonicContact OD2-NH2 3.8Å
55S91.4Very high93Very high23 Ų2339.4 Ų39.416%0.16122%0.221CC..  trans-134.1177.8173.586.30000109.6N57 T58 N174S55-N57 PolarHBondContact O-N 3.39Å; S55-N57 PolarHBondContact OG-N 2.96Å; S55-N57 VanDerWaalsContact OG-N 3.07Å; S55-T58 PolarHBondContact N-OG1 2.88Å; S55-T58 PolarHBondContact O-N 2.9Å; S55-T58 VanDerWaalsContact O-N 3.15Å; S55-T58 PolarHBondContact O-OG1 2.63Å; S55-N174 WeakPolarHBondContact CB-O 3.26Å; S55-N174 PolarHBondContact OG-O 3.08Å
56V88Confident92.8Very high143 Ų14339.5 Ų39.587%0.86722%0.221SC*.THydrogen-bonded Turntrans-58.9-19.1173.8-60.80000113.8
57N87.4Confident92.7Very high111 Ų11139.6 Ų39.659%0.59422%0.221SC*.THydrogen-bonded Turntrans-97.7-2.7-177.2-61.2-43.3000113.4S55 N174S55-N57 PolarHBondContact O-N 3.39Å; S55-N57 PolarHBondContact OG-N 2.96Å; S55-N57 VanDerWaalsContact OG-N 3.07Å; N57-N174 HydrophobicContact CB-CB 4.15Å; N57-N174 PolarHBondContact O-ND2 3.05Å
58T87.3Confident92.6Very high20 Ų2038.5 Ų38.512%0.12322%0.215CC..  trans-91.1139.6179.648.60000111.4D54 S55 Q60 N174D54-T58 WeakPolarHBondContact CA-OG1 3.47Å; D54-T58 VanDerWaalsContact CB-OG1 3.26Å; D54-T58 WeakPolarHBondContact CB-OG1 3.4Å; S55-T58 PolarHBondContact N-OG1 2.88Å; S55-T58 PolarHBondContact O-N 2.9Å; S55-T58 VanDerWaalsContact O-N 3.15Å; S55-T58 PolarHBondContact O-OG1 2.63Å; T58-Q60 VanDerWaalsContact C-N 3.25Å; T58-Q60 PolarHBondContact O-N 3.21Å; T58-N174 HydrophobicContact CG2-CB 3.91Å; T58-N174 WeakPolarHBondContact CG2-O 3.2Å
59P83.3Confident92.5Very high103 Ų10336 Ų3667%0.66920%0.202SC*.SBendtrans-73.8-14.8-176.930.3-35.9000113.8
60Q86.3Confident92.5Very high27 Ų2735.2 Ų35.213%0.12620%0.197CC..SBendtrans-144.5145.7-178.565.8-159-35.800110T58 I71 G72 R161 M162T58-Q60 VanDerWaalsContact C-N 3.25Å; T58-Q60 PolarHBondContact O-N 3.21Å; Q60-I71 HydrophobicContact CG-CG2 4.35Å; Q60-G72 WeakPolarHBondContact CB-O 3.06Å; Q60-G72 PolarHBondContact OE1-O 3.49Å; Q60-R161 PolarHBondContact NE2-O 3.02Å; Q60-M162 HydrophobicContact CG-CG 4.16Å
61A89.8Confident92.3Very high52 Ų5233.1 Ų33.143%0.4319%0.191SC..  trans-74.4152.7177.200000111.2G72A61-G72 WeakPolarHBondContact O-CA 3.45Å; A61-G72 PolarHBondContact O-N 3.04Å
62G93.5Very high92Very high1 Ų133.4 Ų33.41%0.0119%0.193CC..EExtended strand (participates in β ladder)trans169171.7178.800000113.7G53 D54 C70 M162 R178G53-G62 CarbonylContact C-O 3.59Å; G53-G62 VanDerWaalsContact CA-O 3.25Å; G53-G62 WeakPolarHBondContact CA-O 3.49Å; D54-G62 PolarHBondContact N-O 3.22Å; D54-G62 PolarHBondContact OD1-N 3.32Å; G62-C70 CarbonylContact C-O 3.55Å; G62-C70 WeakPolarHBondContact CA-O 3.38Å; G62-M162 VanDerWaalsContact C-CE 3.43Å; G62-M162 VanDerWaalsContact CA-CE 3.42Å; G62-M162 VanDerWaalsContact O-CE 3.31Å; G62-M162 WeakPolarHBondContact O-CE 3.47Å; G62-R178 PolarHBondContact O-NH2 3.5Å
63Y95Very high91.4Very high39 Ų3936.8 Ų36.815%0.15321%0.211CC..EExtended strand (participates in β ladder)trans-157149.4178.949.3-97.3000110.3P49 Y50 I52 Y69 C70P49-Y63 HydrophobicContact CB-CD2 3.73Å; P49-Y63 HydrophobicContact CB-CE2 3.87Å; P49-Y63 HydrophobicContact CG-CD2 3.65Å; P49-Y63 HydrophobicContact CG-CE2 3.41Å; P49-Y63 VanDerWaalsContact CG-CE2 3.41Å; P49-Y63 WeakPolarHBondContact O-CD2 3.5Å; Y50-Y63 HydrophobicContact CD1-CD1 4.33Å; Y50-Y63 HydrophobicContact CD1-CD2 4.33Å; Y50-Y63 AromaticContact CD1-CG 3.96Å; Y50-Y63 HydrophobicContact CD1-CG 3.96Å; Y50-Y63 AromaticContact CE1-CD1 3.74Å; Y50-Y63 HydrophobicContact CE1-CD1 3.74Å; Y50-Y63 HydrophobicContact CE1-CD2 4.14Å; Y50-Y63 HydrophobicContact CE1-CE1 4.03Å; Y50-Y63 HydrophobicContact CE1-CE2 4.42Å; Y50-Y63 AromaticContact CE1-CG 3.78Å; Y50-Y63 HydrophobicContact CE1-CG 3.78Å; I52-Y63 CarbonylContact O-C 3.45Å; I52-Y63 WeakPolarHBondContact O-CA 3.3Å; Y63-Y69 CarbonylContact O-C 3.39Å; Y63-Y69 VanDerWaalsContact O-CA 3.27Å; Y63-Y69 WeakPolarHBondContact O-CA 3.41Å; Y63-Y69 WeakPolarHBondContact O-CB 3.34Å; Y63-C70 HydrophobicContact CD2-CB 4.33Å; Y63-C70 HydrophobicContact CE1-CB 4.09Å; Y63-C70 HydrophobicContact CE2-CB 3.76Å; Y63-C70 WeakPolarHBondContact CE2-SG 3.44Å; Y63-C70 PolarHBondContact N-O 3.48Å; Y63-C70 PolarHBondContact O-N 3.13Å; Y63-C70 PolarHBondContact OH-SG 3.49Å
64F95.8Very high90.6Very high1 Ų140.3 Ų40.30%0.00424%0.241CC..EExtended strand (participates in β ladder)trans-124.1134.5175.8-57.9-103000109.7P49 W51 I52 Y69 I71 Y150 E158 V159 M162P49-F64 CarbonylContact C-O 3.5Å; P49-F64 CarbonylContact O-C 3.15Å; P49-F64 PolarHBondContact O-N 3.26Å; W51-F64 WeakPolarHBondContact CB-O 3.4Å; W51-F64 PolarHBondContact N-O 3.33Å; I52-F64 HydrophobicContact CD1-CB 4.02Å; I52-F64 HydrophobicContact CD1-CD2 3.93Å; I52-F64 HydrophobicContact CD1-CG 4.17Å; I52-F64 HydrophobicContact CG1-CB 3.63Å; I52-F64 HydrophobicContact CG1-CD2 3.96Å; I52-F64 HydrophobicContact CG1-CG 4.17Å; I52-F64 PolarHBondContact N-O 3.28Å; I52-F64 VanDerWaalsContact N-O 3.13Å; I52-F64 PolarHBondContact O-N 2.91Å; F64-Y69 HydrophobicContact CD1-CD2 4.03Å; F64-Y69 AromaticContact CD1-CG 3.75Å; F64-Y69 HydrophobicContact CD1-CG 3.75Å; F64-Y69 AromaticContact CE1-CD2 3.7Å; F64-Y69 HydrophobicContact CE1-CD2 3.7Å; F64-Y69 HydrophobicContact CE1-CE2 4.47Å; F64-Y69 AromaticContact CE1-CG 3.92Å; F64-Y69 HydrophobicContact CE1-CG 3.92Å; F64-I71 HydrophobicContact CE1-CD1 4.19Å; F64-I71 HydrophobicContact CE1-CG1 4.48Å; F64-I71 HydrophobicContact CZ-CD1 3.82Å; F64-I71 HydrophobicContact CZ-CG1 4.01Å; F64-Y150 PolarHBondContact O-OH 2.91Å; F64-E158 HydrophobicContact CE1-CB 4.07Å; F64-E158 HydrophobicContact CZ-CB 4.42Å; F64-V159 HydrophobicContact CD1-CG2 4.16Å; F64-V159 HydrophobicContact CE1-CG2 3.92Å; F64-V159 HydrophobicContact CE2-CG2 4.38Å; F64-V159 HydrophobicContact CZ-CB 4.47Å; F64-V159 HydrophobicContact CZ-CG2 4.05Å; F64-M162 HydrophobicContact CD2-SD 4.23Å; F64-M162 HydrophobicContact CE2-CB 4.23Å; F64-M162 HydrophobicContact CE2-CG 4.5Å; F64-M162 HydrophobicContact CE2-SD 3.44Å; F64-M162 WeakPolarHBondContact CE2-SD 3.45Å; F64-M162 HydrophobicContact CZ-CB 4.43Å; F64-M162 HydrophobicContact CZ-SD 4.23Å
65G96.1Very high90Very high4 Ų445.6 Ų45.64%0.04127%0.268CS..  trans-100.5-155.4164.800000112.2P49 H68 Y150P49-G65 PolarHBondContact O-N 3.19Å; G65-H68 WeakPolarHBondContact CA-O 3.3Å; G65-H68 PolarHBondContact N-O 3.39Å; G65-Y150 WeakPolarHBondContact O-CE2 3.38Å; G65-Y150 PolarHBondContact O-OH 3.45Å
66L94.8Very high89.5Confident2 Ų248 Ų481%0.0128%0.282CS..SBendtrans-74.6-42.4173.8-70.4163.4000112.7F46 W51 A99 M100 V103 Y150F46-L66 HydrophobicContact CD2-CD1 3.89Å; F46-L66 HydrophobicContact CE2-CD1 4.46Å; W51-L66 HydrophobicContact CD2-CD2 4.28Å; W51-L66 HydrophobicContact CD2-CG 4.12Å; W51-L66 HydrophobicContact CE3-CD2 4.1Å; W51-L66 HydrophobicContact CE3-CG 4.45Å; W51-L66 HydrophobicContact CH2-CD1 4.21Å; W51-L66 HydrophobicContact CH2-CD2 3.76Å; W51-L66 HydrophobicContact CH2-CG 4.18Å; W51-L66 HydrophobicContact CZ2-CD1 3.57Å; W51-L66 HydrophobicContact CZ2-CD2 3.87Å; W51-L66 HydrophobicContact CZ2-CG 3.74Å; W51-L66 HydrophobicContact CZ3-CD2 3.84Å; W51-L66 HydrophobicContact CZ3-CG 4.48Å; L66-A99 HydrophobicContact CD2-CB 4.07Å; L66-M100 HydrophobicContact CB-CB 4.14Å; L66-M100 HydrophobicContact CB-CG 4.4Å; L66-V103 HydrophobicContact CD1-CB 3.89Å; L66-V103 HydrophobicContact CD1-CG1 3.73Å; L66-V103 HydrophobicContact CD1-CG2 4.29Å; L66-V103 HydrophobicContact CD2-CG2 4.17Å; L66-Y150 HydrophobicContact CD2-CD2 3.86Å; L66-Y150 HydrophobicContact CD2-CE2 4.15Å
67F94.3Very high89Confident26 Ų2646.3 Ų46.311%0.11428%0.276CS..SBendtrans-131.4-16.9-175.559.3-98.4000114.2F46 G83 V85 I91 M100F46-F67 HydrophobicContact CD1-CE1 4.28Å; F46-F67 AromaticContact CE1-CE1 3.96Å; F46-F67 HydrophobicContact CE1-CE1 3.96Å; F46-F67 HydrophobicContact CE2-CE1 4.46Å; F46-F67 HydrophobicContact CZ-CD1 4.35Å; F46-F67 HydrophobicContact CZ-CE1 4.06Å; F46-F67 VanDerWaalsContact O-CE1 3.23Å; F46-F67 WeakPolarHBondContact O-CE1 3.49Å; F67-G83 CarbonylContact O-C 3.58Å; F67-G83 WeakPolarHBondContact O-CA 3.38Å; F67-V85 HydrophobicContact CD1-CG2 3.75Å; F67-V85 HydrophobicContact CD2-CG2 3.51Å; F67-V85 HydrophobicContact CE1-CG2 3.7Å; F67-V85 HydrophobicContact CE2-CG2 3.49Å; F67-V85 VanDerWaalsContact CE2-CG2 3.49Å; F67-V85 HydrophobicContact CG-CG2 3.66Å; F67-V85 HydrophobicContact CZ-CG2 3.58Å; F67-I91 HydrophobicContact CB-CD1 3.87Å; F67-I91 HydrophobicContact CB-CG1 4.43Å; F67-M100 HydrophobicContact CB-CE 3.69Å; F67-M100 HydrophobicContact CB-CG 4.18Å; F67-M100 HydrophobicContact CD1-CG 4.02Å
68H94.1Very high89Confident56 Ų5647.4 Ų47.426%0.25928%0.278SS..  trans-119.9137.4-179.4-173-86.8000109.7P49 G65 C70 G83P49-H68 HydrophobicContact CB-CB 4.35Å; P49-H68 WeakPolarHBondContact CB-O 3.37Å; G65-H68 WeakPolarHBondContact CA-O 3.3Å; G65-H68 PolarHBondContact N-O 3.39Å; H68-C70 PolarHBondContact CE1-SG 3.31Å; H68-G83 PolarHBondContact CD2-O 2.89Å
69Y94.6Very high89Confident17 Ų1750.7 Ų50.77%0.06729%0.294CS..EExtended strand (participates in β ladder)trans-145.9152.2178.566.4-83.5000110.7Y63 F64 I71 C81 K82 P92 E158Y63-Y69 CarbonylContact O-C 3.39Å; Y63-Y69 VanDerWaalsContact O-CA 3.27Å; Y63-Y69 WeakPolarHBondContact O-CA 3.41Å; Y63-Y69 WeakPolarHBondContact O-CB 3.34Å; F64-Y69 HydrophobicContact CD1-CD2 4.03Å; F64-Y69 AromaticContact CD1-CG 3.75Å; F64-Y69 HydrophobicContact CD1-CG 3.75Å; F64-Y69 AromaticContact CE1-CD2 3.7Å; F64-Y69 HydrophobicContact CE1-CD2 3.7Å; F64-Y69 HydrophobicContact CE1-CE2 4.47Å; F64-Y69 AromaticContact CE1-CG 3.92Å; F64-Y69 HydrophobicContact CE1-CG 3.92Å; Y69-I71 HydrophobicContact CD2-CD1 4.01Å; Y69-I71 HydrophobicContact CD2-CG1 4.06Å; Y69-I71 HydrophobicContact CE2-CD1 4Å; Y69-I71 HydrophobicContact CE2-CG1 4.44Å; Y69-C81 WeakPolarHBondContact O-CA 3.31Å; Y69-K82 WeakPolarHBondContact CD1-O 3.41Å; Y69-K82 HydrophobicContact CE1-CB 3.86Å; Y69-K82 HydrophobicContact CE2-CB 4.05Å; Y69-K82 PolarHBondContact N-O 3.23Å; Y69-K82 PolarHBondContact O-N 3.1Å; Y69-P92 HydrophobicContact CE1-CG 4.33Å; Y69-E158 HydrophobicContact CE2-CG 4.38Å
70C94.1Very high89.4Confident0 Ų049.6 Ų49.60%029%0.285CS..EExtended strand (participates in β ladder)trans-132.4133.1175.7-55.10000109.6G62 Y63 H68 L79 T80 C81G62-C70 CarbonylContact C-O 3.55Å; G62-C70 WeakPolarHBondContact CA-O 3.38Å; Y63-C70 HydrophobicContact CD2-CB 4.33Å; Y63-C70 HydrophobicContact CE1-CB 4.09Å; Y63-C70 HydrophobicContact CE2-CB 3.76Å; Y63-C70 WeakPolarHBondContact CE2-SG 3.44Å; Y63-C70 PolarHBondContact N-O 3.48Å; Y63-C70 PolarHBondContact O-N 3.13Å; Y63-C70 PolarHBondContact OH-SG 3.49Å; H68-C70 PolarHBondContact CE1-SG 3.31Å; C70-L79 HydrophobicContact CB-CD2 4.13Å; C70-T80 WeakPolarHBondContact CA-O 3.37Å; C70-C81 HydrophobicContact CB-CB 4.13Å; C70-C81 WeakPolarHBondContact CB-SG 3.42Å; C70-C81 VanDerWaalsContact SG-CA 3.57Å; C70-C81 WeakPolarHBondContact SG-CB 3.48Å; C70-C81 CovalentContact SG-SG 2.04Å; C70-C81 PolarHBondContact SG-SG 2.89Å
71I92.5Very high89.7Confident24 Ų2451.3 Ų51.312%0.12330%0.3CS..EExtended strand (participates in β ladder)trans-123.1127.4178.2-57.1172.8000107.7Q60 F64 Y69 T80 E158Q60-I71 HydrophobicContact CG-CG2 4.35Å; F64-I71 HydrophobicContact CE1-CD1 4.19Å; F64-I71 HydrophobicContact CE1-CG1 4.48Å; F64-I71 HydrophobicContact CZ-CD1 3.82Å; F64-I71 HydrophobicContact CZ-CG1 4.01Å; Y69-I71 HydrophobicContact CD2-CD1 4.01Å; Y69-I71 HydrophobicContact CD2-CG1 4.06Å; Y69-I71 HydrophobicContact CE2-CD1 4Å; Y69-I71 HydrophobicContact CE2-CG1 4.44Å; I71-T80 PolarHBondContact N-O 3.47Å; I71-T80 VanDerWaalsContact N-O 3.07Å; I71-T80 PolarHBondContact O-N 3.04Å; I71-E158 HydrophobicContact CD1-CB 4.2Å
72G89.8Confident89.8Confident5 Ų554.4 Ų54.45%0.05230%0.303CS..EExtended strand (participates in β ladder)trans-75.7141.3176.900000111.5Q60 A61 E78Q60-G72 WeakPolarHBondContact CB-O 3.06Å; Q60-G72 PolarHBondContact OE1-O 3.49Å; A61-G72 WeakPolarHBondContact O-CA 3.45Å; A61-G72 PolarHBondContact O-N 3.04Å; G72-E78 CarbonylContact C-O 3.57Å; G72-E78 WeakPolarHBondContact CA-O 2.94Å
73N85.1Confident89.6Confident71 Ų7155.2 Ų55.238%0.3831%0.312SS..  trans-78.4127.4170.3-173.1-10.1000110L75 T76 S77 E78N73-L75 PolarHBondContact O-N 3.1Å; N73-L75 VanDerWaalsContact O-N 3.14Å; N73-L75 PolarHBondContact OD1-N 3.49Å; N73-T76 WeakPolarHBondContact CB-OG1 3.41Å; N73-T76 PolarHBondContact ND2-OG1 2.91Å; N73-S77 WeakPolarHBondContact O-CA 3.25Å; N73-S77 PolarHBondContact O-N 3.37Å; N73-E78 PolarHBondContact N-O 3.17Å
74A76.7Confident89.3Confident75 Ų7555.7 Ų55.762%0.6232%0.321SS*.THydrogen-bonded Turntrans-60.1-23.2179.800000114.2
75L80.8Confident88.8Confident158 Ų15857.8 Ų57.883%0.82733%0.334SS*.THydrogen-bonded Turntrans-94.2-43.8-177.5-74.5142.9000113.4N73N73-L75 PolarHBondContact O-N 3.1Å; N73-L75 VanDerWaalsContact O-N 3.14Å; N73-L75 PolarHBondContact OD1-N 3.49Å
76T80.1Confident88.3Confident74 Ų7466.6 Ų66.645%0.45437%0.371SS..THydrogen-bonded Turntrans-103.4-7.4-172.461.10000113.5N73 E78N73-T76 WeakPolarHBondContact CB-OG1 3.41Å; N73-T76 PolarHBondContact ND2-OG1 2.91Å; T76-E78 PolarHBondContact O-N 3.06Å
77S76.9Confident88.1Confident106 Ų10670.3 Ų70.374%0.74139%0.391SS*.  trans5711-172-56.20000114.7N73N73-S77 WeakPolarHBondContact O-CA 3.25Å; N73-S77 PolarHBondContact O-N 3.37Å
78E87.8Confident87.7Confident135 Ų13572.7 Ų72.763%0.63140%0.402SS*.  trans-78.6134.9176.8-68.6-179.1154.100110.8G72 N73 T76G72-E78 CarbonylContact C-O 3.57Å; G72-E78 WeakPolarHBondContact CA-O 2.94Å; N73-E78 PolarHBondContact N-O 3.17Å; T76-E78 PolarHBondContact O-N 3.06Å
79L88.6Confident87.3Confident89 Ų8976.4 Ų76.447%0.46642%0.423SS..EExtended strand (participates in β ladder)trans-86116.8176.9-76.6155.5000110.1C70C70-L79 HydrophobicContact CB-CD2 4.13Å
80T91Very high87.1Confident79 Ų7976.9 Ų76.949%0.48543%0.429SS..EExtended strand (participates in β ladder)trans-92.8110170.9-54.30000109.1C70 I71 K82C70-T80 WeakPolarHBondContact CA-O 3.37Å; I71-T80 PolarHBondContact N-O 3.47Å; I71-T80 VanDerWaalsContact N-O 3.07Å; I71-T80 PolarHBondContact O-N 3.04Å; T80-K82 HydrophobicContact CG2-CG 4.49Å
81C92.6Very high86.9Confident63 Ų6377 Ų7743%0.42643%0.43SS..EExtended strand (participates in β ladder)trans-94.8133.2178.9-65.10000111.5Y69 C70Y69-C81 WeakPolarHBondContact O-CA 3.31Å; C70-C81 HydrophobicContact CB-CB 4.13Å; C70-C81 WeakPolarHBondContact CB-SG 3.42Å; C70-C81 VanDerWaalsContact SG-CA 3.57Å; C70-C81 WeakPolarHBondContact SG-CB 3.48Å; C70-C81 CovalentContact SG-SG 2.04Å; C70-C81 PolarHBondContact SG-SG 2.89Å
82K92Very high86.8Confident117 Ų11777.1 Ų77.151%0.50943%0.432SS..EExtended strand (participates in β ladder)trans-139.3159.7179.1-67-175-178.4-177.20109.7Y69 T80Y69-K82 WeakPolarHBondContact CD1-O 3.41Å; Y69-K82 HydrophobicContact CE1-CB 3.86Å; Y69-K82 HydrophobicContact CE2-CB 4.05Å; Y69-K82 PolarHBondContact N-O 3.23Å; Y69-K82 PolarHBondContact O-N 3.1Å; T80-K82 HydrophobicContact CG2-CG 4.49Å
83G88.6Confident86.9Confident18 Ų1877.3 Ų77.319%0.18643%0.433CS..  trans108.2136.9179.100000112.9F67 H68 S90F67-G83 CarbonylContact O-C 3.58Å; F67-G83 WeakPolarHBondContact O-CA 3.38Å; H68-G83 PolarHBondContact CD2-O 2.89Å; G83-S90 VanDerWaalsContact CA-OG 3.3Å; G83-S90 WeakPolarHBondContact CA-OG 3.3Å
84S89.1Confident87.3Confident49 Ų4978.3 Ų78.334%0.34344%0.443SS..BIsolated β-bridgetrans-147.8150173.1177.90000109.5F86 D87 S90S84-F86 PolarHBondContact O-N 3Å; S84-F86 PolarHBondContact OG-N 3.44Å; S84-D87 PolarHBondContact O-N 3.46Å; S84-S90 PolarHBondContact N-OG 3.47Å
85V85.9Confident88.2Confident45 Ų4575.5 Ų75.527%0.27342%0.42SS..THydrogen-bonded Turntrans-61.7-27.3174.4-176.30000111.4F67 M100F67-V85 HydrophobicContact CD1-CG2 3.75Å; F67-V85 HydrophobicContact CD2-CG2 3.51Å; F67-V85 HydrophobicContact CE1-CG2 3.7Å; F67-V85 HydrophobicContact CE2-CG2 3.49Å; F67-V85 VanDerWaalsContact CE2-CG2 3.49Å; F67-V85 HydrophobicContact CG-CG2 3.66Å; F67-V85 HydrophobicContact CZ-CG2 3.58Å; V85-M100 HydrophobicContact CG1-SD 4.38Å
86F85.4Confident88.9Confident190 Ų19068 Ų6883%0.83338%0.381SS*.THydrogen-bonded Turntrans-94.4-11.6-178.3-61.6-69.6000114.2S84S84-F86 PolarHBondContact O-N 3Å; S84-F86 PolarHBondContact OG-N 3.44Å
87D90Very high89.6Confident80 Ų8067.8 Ų67.843%0.42837%0.371SS..BIsolated β-bridgetrans-116.780.1177.8-176.910.7000110.2S84 N89 S90S84-D87 PolarHBondContact O-N 3.46Å; D87-N89 PolarHBondContact O-N 3Å; D87-N89 VanDerWaalsContact O-N 3.13Å; D87-N89 PolarHBondContact OD1-N 3.45Å; D87-S90 WeakPolarHBondContact O-CB 3.3Å; D87-S90 PolarHBondContact O-N 3.23Å; D87-S90 PolarHBondContact O-OG 3.01Å
88F85.6Confident90.5Very high76 Ų7665.5 Ų65.533%0.33335%0.353SS..G310 helixtrans-58.6-27.6-178-64.8-79.7000113.2S90 I91 R97 M100 F101F88-S90 PolarHBondContact O-N 3.33Å; F88-I91 HydrophobicContact CD1-CD1 4.49Å; F88-I91 PolarHBondContact O-N 3.39Å; F88-R97 PolarHBondContact O-NE 2.94Å; F88-R97 PolarHBondContact O-NH2 2.93Å; F88-R97 VanDerWaalsContact O-NH2 3.11Å; F88-M100 HydrophobicContact CD1-CE 3.99Å; F88-M100 HydrophobicContact CE1-CE 3.73Å; F88-M100 HydrophobicContact CE1-SD 4.17Å; F88-F101 HydrophobicContact CD1-CE2 4.18Å; F88-F101 HydrophobicContact CD1-CZ 4.08Å; F88-F101 HydrophobicContact CE1-CE1 4.01Å; F88-F101 AromaticContact CE1-CE2 3.71Å; F88-F101 HydrophobicContact CE1-CE2 3.71Å; F88-F101 AromaticContact CE1-CZ 3.25Å; F88-F101 HydrophobicContact CE1-CZ 3.25Å; F88-F101 HydrophobicContact CZ-CE1 4.09Å; F88-F101 HydrophobicContact CZ-CE2 4.44Å; F88-F101 AromaticContact CZ-CZ 3.56Å; F88-F101 HydrophobicContact CZ-CZ 3.56Å
89N86.6Confident90.9Very high133 Ų13359 Ų5971%0.71132%0.323SS*.G310 helixtrans-70.6-23.5-179.4-69.9-38.3000112.6D87 I91 R97D87-N89 PolarHBondContact O-N 3Å; D87-N89 VanDerWaalsContact O-N 3.13Å; D87-N89 PolarHBondContact OD1-N 3.45Å; N89-I91 PolarHBondContact O-N 3.24Å; N89-R97 PolarHBondContact O-NH2 3.25Å
90S89Confident91.3Very high28 Ų2855.1 Ų55.120%0.19630%0.302CS..G310 helixtrans-72.1-14.917670.40000114.2G83 S84 D87 F88G83-S90 VanDerWaalsContact CA-OG 3.3Å; G83-S90 WeakPolarHBondContact CA-OG 3.3Å; S84-S90 PolarHBondContact N-OG 3.47Å; D87-S90 WeakPolarHBondContact O-CB 3.3Å; D87-S90 PolarHBondContact O-N 3.23Å; D87-S90 PolarHBondContact O-OG 3.01Å; F88-S90 PolarHBondContact O-N 3.33Å
91I91.5Very high91.5Very high1 Ų156.6 Ų56.61%0.00530%0.302CS..SBendtrans-84.4127.4-177.6-57.8173.8000109.3F67 F88 N89 S93 F96 R97 M100F67-I91 HydrophobicContact CB-CD1 3.87Å; F67-I91 HydrophobicContact CB-CG1 4.43Å; F88-I91 HydrophobicContact CD1-CD1 4.49Å; F88-I91 PolarHBondContact O-N 3.39Å; N89-I91 PolarHBondContact O-N 3.24Å; I91-S93 PolarHBondContact O-N 3.33Å; I91-F96 HydrophobicContact CG2-CB 3.7Å; I91-R97 HydrophobicContact CB-CG 3.81Å; I91-R97 HydrophobicContact CD1-CG 4.1Å; I91-R97 HydrophobicContact CG2-CG 3.7Å; I91-R97 PolarHBondContact O-NE 3.35Å; I91-R97 PolarHBondContact O-NH2 3.48Å; I91-M100 HydrophobicContact CD1-CE 3.24Å
92P89.3Confident91.8Very high28 Ų2856.3 Ų56.318%0.18229%0.294CS..SBendtrans-71.3-27.9-162.526.1-35.1000114.5Y69 F96 A156 E158Y69-P92 HydrophobicContact CE1-CG 4.33Å; P92-F96 HydrophobicContact CG-CD2 3.73Å; P92-F96 HydrophobicContact CG-CE2 3.94Å; P92-A156 HydrophobicContact CB-CB 4.18Å; P92-E158 HydrophobicContact CB-CB 4.08Å; P92-E158 HydrophobicContact CB-CG 3.91Å; P92-E158 WeakPolarHBondContact CB-OE2 3.24Å
93S92.6Very high92Very high8 Ų850.8 Ų50.86%0.05627%0.27CS..  trans-126.5140.4-180-178.40000112I91 A95 F96 R97 G153I91-S93 PolarHBondContact O-N 3.33Å; S93-A95 PolarHBondContact O-N 3.32Å; S93-A95 PolarHBondContact OG-N 3.14Å; S93-A95 VanDerWaalsContact OG-N 3.16Å; S93-F96 PolarHBondContact O-N 2.89Å; S93-F96 VanDerWaalsContact O-N 3.15Å; S93-R97 PolarHBondContact O-N 2.77Å; S93-G153 WeakPolarHBondContact OG-CA 3.48Å
94P93.4Very high92.4Very high92 Ų9250.3 Ų50.360%0.59727%0.265SS*.Hα-helixtrans-53.8-35.5166.3-24.434.1000112.8F96 R97 T98P94-F96 PolarHBondContact O-N 2.83Å; P94-R97 WeakPolarHBondContact O-CB 3.42Å; P94-R97 PolarHBondContact O-N 2.92Å; P94-T98 PolarHBondContact O-N 3.15Å; P94-T98 PolarHBondContact O-OG1 3.31Å
95A95.2Very high92.8Very high16 Ų1651.1 Ų51.113%0.13227%0.268CS..Hα-helixtrans-63.1-40.817800000111.9S93 R97 T98 A99 I149 D152S93-A95 PolarHBondContact O-N 3.32Å; S93-A95 PolarHBondContact OG-N 3.14Å; S93-A95 VanDerWaalsContact OG-N 3.16Å; A95-R97 VanDerWaalsContact C-N 3.34Å; A95-R97 PolarHBondContact O-N 2.85Å; A95-T98 PolarHBondContact O-N 3.22Å; A95-A99 WeakPolarHBondContact O-CB 3.15Å; A95-A99 PolarHBondContact O-N 3.23Å; A95-I149 HydrophobicContact CB-CG2 4.18Å; A95-I149 WeakPolarHBondContact O-CG2 3.46Å; A95-D152 HydrophobicContact CB-CB 3.82Å
96F95.4Very high93.4Very high2 Ų249 Ų491%0.00926%0.255CS..Hα-helixtrans-65.3-36.8174.5-69.3-17.4000112.4I91 P92 S93 P94 A99 M100 Y150 V159I91-F96 HydrophobicContact CG2-CB 3.7Å; P92-F96 HydrophobicContact CG-CD2 3.73Å; P92-F96 HydrophobicContact CG-CE2 3.94Å; S93-F96 PolarHBondContact O-N 2.89Å; S93-F96 VanDerWaalsContact O-N 3.15Å; P94-F96 PolarHBondContact O-N 2.83Å; F96-A99 PolarHBondContact O-N 3.43Å; F96-M100 VanDerWaalsContact O-CB 3.29Å; F96-M100 WeakPolarHBondContact O-CB 3.44Å; F96-M100 PolarHBondContact O-N 3.49Å; F96-Y150 AromaticContact CD1-CD2 3.55Å; F96-Y150 HydrophobicContact CD1-CD2 3.55Å; F96-Y150 AromaticContact CD1-CE2 3.5Å; F96-Y150 HydrophobicContact CD1-CE2 3.5Å; F96-Y150 HydrophobicContact CD1-CG 4.27Å; F96-Y150 HydrophobicContact CE1-CD1 4.31Å; F96-Y150 AromaticContact CE1-CD2 3.73Å; F96-Y150 HydrophobicContact CE1-CD2 3.73Å; F96-Y150 HydrophobicContact CE1-CE1 4.1Å; F96-Y150 AromaticContact CE1-CE2 3.48Å; F96-Y150 HydrophobicContact CE1-CE2 3.48Å; F96-Y150 VanDerWaalsContact CE1-CE2 3.48Å; F96-Y150 HydrophobicContact CE1-CG 4.13Å; F96-Y150 AromaticContact CE1-CZ 3.69Å; F96-Y150 VanDerWaalsContact CE1-O 3.24Å; F96-Y150 WeakPolarHBondContact CE1-O 3.42Å; F96-Y150 HydrophobicContact CG-CE2 4.24Å; F96-Y150 HydrophobicContact CZ-CE2 4.23Å; F96-V159 HydrophobicContact CE2-CG2 3.99Å; F96-V159 HydrophobicContact CZ-CG2 4.08Å
97R95.2Very high94Very high68 Ų6841.2 Ų41.226%0.25722%0.221SC..Hα-helixtrans-61.5-48.3174-59.1173.7-166.1-170.3-3.1110.4F88 N89 I91 S93 P94 A95 M100 F101F88-R97 PolarHBondContact O-NE 2.94Å; F88-R97 PolarHBondContact O-NH2 2.93Å; F88-R97 VanDerWaalsContact O-NH2 3.11Å; N89-R97 PolarHBondContact O-NH2 3.25Å; I91-R97 HydrophobicContact CB-CG 3.81Å; I91-R97 HydrophobicContact CD1-CG 4.1Å; I91-R97 HydrophobicContact CG2-CG 3.7Å; I91-R97 PolarHBondContact O-NE 3.35Å; I91-R97 PolarHBondContact O-NH2 3.48Å; S93-R97 PolarHBondContact O-N 2.77Å; P94-R97 WeakPolarHBondContact O-CB 3.42Å; P94-R97 PolarHBondContact O-N 2.92Å; A95-R97 VanDerWaalsContact C-N 3.34Å; A95-R97 PolarHBondContact O-N 2.85Å; R97-M100 WeakPolarHBondContact O-CB 3.44Å; R97-M100 PolarHBondContact O-N 3.32Å; R97-F101 WeakPolarHBondContact O-CD2 3.42Å; R97-F101 PolarHBondContact O-N 3.47Å; R97-F101 VanDerWaalsContact O-N 3.08Å
98T95.4Very high94.3Very high58 Ų5842.8 Ų42.836%0.35623%0.229SC..Hα-helixtrans-64-44178.3-57.30000111.9P94 A95 M100 F101 F102 I149P94-T98 PolarHBondContact O-N 3.15Å; P94-T98 PolarHBondContact O-OG1 3.31Å; A95-T98 PolarHBondContact O-N 3.22Å; T98-M100 VanDerWaalsContact C-N 3.32Å; T98-M100 PolarHBondContact O-N 3.08Å; T98-F101 PolarHBondContact O-N 2.98Å; T98-F102 HydrophobicContact CG2-CD2 3.73Å; T98-F102 HydrophobicContact CG2-CE2 3.48Å; T98-F102 VanDerWaalsContact CG2-CE2 3.48Å; T98-F102 VanDerWaalsContact O-CD2 3.22Å; T98-F102 WeakPolarHBondContact O-CD2 3.33Å; T98-F102 PolarHBondContact O-N 3.48Å; T98-F102 VanDerWaalsContact O-N 3.08Å; T98-I149 HydrophobicContact CG2-CD1 3.98Å; T98-I149 HydrophobicContact CG2-CG2 4.29Å
99A97Very high94.9Very high0 Ų041.2 Ų41.20%022%0.224CC..Hα-helixtrans-60.4-41.3174.600000111.7L66 A95 F96 F101 F102 V103 I149 Y150L66-A99 HydrophobicContact CD2-CB 4.07Å; A95-A99 WeakPolarHBondContact O-CB 3.15Å; A95-A99 PolarHBondContact O-N 3.23Å; F96-A99 PolarHBondContact O-N 3.43Å; A99-F101 VanDerWaalsContact C-N 3.35Å; A99-F101 PolarHBondContact O-N 2.92Å; A99-F102 PolarHBondContact O-N 3.37Å; A99-V103 WeakPolarHBondContact O-CB 3.39Å; A99-V103 VanDerWaalsContact O-CG2 3.27Å; A99-V103 WeakPolarHBondContact O-CG2 3.24Å; A99-V103 PolarHBondContact O-N 3Å; A99-I149 HydrophobicContact CB-CB 4.44Å; A99-I149 HydrophobicContact CB-CG2 4.24Å; A99-Y150 HydrophobicContact CB-CD2 4.27Å
100M95.8Very high95.3Very high7 Ų734.9 Ų34.93%0.03419%0.19CC..Hα-helixtrans-58.7-44.2175-179.7-115.7-80.100111.8F46 L66 F67 V85 F88 I91 F96 R97 T98 G104F46-M100 HydrophobicContact CE2-CG 3.94Å; F46-M100 HydrophobicContact CZ-CG 4.26Å; L66-M100 HydrophobicContact CB-CB 4.14Å; L66-M100 HydrophobicContact CB-CG 4.4Å; F67-M100 HydrophobicContact CB-CE 3.69Å; F67-M100 HydrophobicContact CB-CG 4.18Å; F67-M100 HydrophobicContact CD1-CG 4.02Å; V85-M100 HydrophobicContact CG1-SD 4.38Å; F88-M100 HydrophobicContact CD1-CE 3.99Å; F88-M100 HydrophobicContact CE1-CE 3.73Å; F88-M100 HydrophobicContact CE1-SD 4.17Å; I91-M100 HydrophobicContact CD1-CE 3.24Å; F96-M100 VanDerWaalsContact O-CB 3.29Å; F96-M100 WeakPolarHBondContact O-CB 3.44Å; F96-M100 PolarHBondContact O-N 3.49Å; R97-M100 WeakPolarHBondContact O-CB 3.44Å; R97-M100 PolarHBondContact O-N 3.32Å; T98-M100 VanDerWaalsContact C-N 3.32Å; T98-M100 PolarHBondContact O-N 3.08Å; M100-G104 WeakPolarHBondContact O-CA 3.42Å; M100-G104 PolarHBondContact O-N 3.19Å
101F96.1Very high95.6Very high109 Ų10936.4 Ų36.448%0.47820%0.198SC..Hα-helixtrans-61-50.1175.4-77.4-68.7000111.9F88 R97 T98 A99 G104 T105F88-F101 HydrophobicContact CD1-CE2 4.18Å; F88-F101 HydrophobicContact CD1-CZ 4.08Å; F88-F101 HydrophobicContact CE1-CE1 4.01Å; F88-F101 AromaticContact CE1-CE2 3.71Å; F88-F101 HydrophobicContact CE1-CE2 3.71Å; F88-F101 AromaticContact CE1-CZ 3.25Å; F88-F101 HydrophobicContact CE1-CZ 3.25Å; F88-F101 HydrophobicContact CZ-CE1 4.09Å; F88-F101 HydrophobicContact CZ-CE2 4.44Å; F88-F101 AromaticContact CZ-CZ 3.56Å; F88-F101 HydrophobicContact CZ-CZ 3.56Å; R97-F101 WeakPolarHBondContact O-CD2 3.42Å; R97-F101 PolarHBondContact O-N 3.47Å; R97-F101 VanDerWaalsContact O-N 3.08Å; T98-F101 PolarHBondContact O-N 2.98Å; A99-F101 VanDerWaalsContact C-N 3.35Å; A99-F101 PolarHBondContact O-N 2.92Å; F101-G104 PolarHBondContact O-N 2.94Å; F101-T105 WeakPolarHBondContact O-CB 3.49Å; F101-T105 PolarHBondContact O-N 3.42Å; F101-T105 PolarHBondContact O-OG1 2.88Å
102F97.8Very high95.7Very high58 Ų5837.5 Ų37.525%0.25421%0.21SC..Hα-helixtrans-62.2-47.3-179-78.7-63.3000112.9T98 A99 S106 L142 M145 I149T98-F102 HydrophobicContact CG2-CD2 3.73Å; T98-F102 HydrophobicContact CG2-CE2 3.48Å; T98-F102 VanDerWaalsContact CG2-CE2 3.48Å; T98-F102 VanDerWaalsContact O-CD2 3.22Å; T98-F102 WeakPolarHBondContact O-CD2 3.33Å; T98-F102 PolarHBondContact O-N 3.48Å; T98-F102 VanDerWaalsContact O-N 3.08Å; A99-F102 PolarHBondContact O-N 3.37Å; F102-S106 VanDerWaalsContact O-CB 3.29Å; F102-S106 WeakPolarHBondContact O-CB 3.49Å; F102-S106 PolarHBondContact O-N 2.82Å; F102-L142 HydrophobicContact CD1-CD2 3.57Å; F102-L142 HydrophobicContact CE1-CD2 3.96Å; F102-M145 HydrophobicContact CD1-CB 4.39Å; F102-M145 HydrophobicContact CD1-CE 3.63Å; F102-M145 HydrophobicContact CE1-CE 3.39Å; F102-M145 HydrophobicContact CE1-SD 4.16Å; F102-M145 HydrophobicContact CG-CB 4.35Å; F102-M145 HydrophobicContact CZ-CE 4.2Å; F102-M145 HydrophobicContact CZ-SD 4.41Å; F102-I149 HydrophobicContact CD2-CD1 3.61Å; F102-I149 HydrophobicContact CE2-CD1 3.56Å
103V98.1Very high95.9Very high0 Ų036.1 Ų36.10%020%0.201CC..Hα-helixtrans-67.6-37.9178-179.80000111.2F46 W51 L66 A99 S106 M107 M143F46-V103 HydrophobicContact CD2-CB 4.47Å; F46-V103 HydrophobicContact CD2-CG1 4.12Å; W51-V103 HydrophobicContact CH2-CG1 4.49Å; W51-V103 HydrophobicContact CH2-CG2 3.87Å; W51-V103 HydrophobicContact CZ2-CG1 4.3Å; W51-V103 HydrophobicContact CZ2-CG2 4.43Å; L66-V103 HydrophobicContact CD1-CB 3.89Å; L66-V103 HydrophobicContact CD1-CG1 3.73Å; L66-V103 HydrophobicContact CD1-CG2 4.29Å; L66-V103 HydrophobicContact CD2-CG2 4.17Å; A99-V103 WeakPolarHBondContact O-CB 3.39Å; A99-V103 VanDerWaalsContact O-CG2 3.27Å; A99-V103 WeakPolarHBondContact O-CG2 3.24Å; A99-V103 PolarHBondContact O-N 3Å; V103-S106 WeakPolarHBondContact O-CB 3.37Å; V103-S106 PolarHBondContact O-N 3.46Å; V103-M107 WeakPolarHBondContact O-CB 3.46Å; V103-M107 PolarHBondContact O-N 3.46Å; V103-M143 HydrophobicContact CB-SD 4.47Å; V103-M143 HydrophobicContact CG1-CE 3.82Å; V103-M143 HydrophobicContact CG1-SD 3.88Å; V103-M143 HydrophobicContact CG2-SD 4.05Å
104G97.3Very high95.6Very high8 Ų837.1 Ų37.18%0.08221%0.205CC..Hα-helixtrans-64.3-47.3176.400000112.4M100 F101 S106 M107 L108M100-G104 WeakPolarHBondContact O-CA 3.42Å; M100-G104 PolarHBondContact O-N 3.19Å; F101-G104 PolarHBondContact O-N 2.94Å; G104-S106 VanDerWaalsContact C-N 3.33Å; G104-S106 PolarHBondContact O-N 2.94Å; G104-M107 PolarHBondContact O-N 3.01Å; G104-L108 WeakPolarHBondContact O-CG 3.39Å; G104-L108 PolarHBondContact O-N 3.31Å
105T97.4Very high95.3Very high66 Ų6637 Ų3741%0.40520%0.203SC..Hα-helixtrans-64.2-39.5175.1-54.70000111.5F101 M107 L108 L109 L142F101-T105 WeakPolarHBondContact O-CB 3.49Å; F101-T105 PolarHBondContact O-N 3.42Å; F101-T105 PolarHBondContact O-OG1 2.88Å; T105-M107 PolarHBondContact O-N 3.33Å; T105-L108 PolarHBondContact O-N 2.89Å; T105-L109 WeakPolarHBondContact O-CG 3.34Å; T105-L109 PolarHBondContact O-N 2.9Å; T105-L142 HydrophobicContact CG2-CD1 3.79Å
106S98.1Very high94.8Very high1 Ų137 Ų371%0.00720%0.203CC..Hα-helixtrans-56.2-48.6173.1173.60000111.8F102 V103 G104 L109 V110 S139F102-S106 VanDerWaalsContact O-CB 3.29Å; F102-S106 WeakPolarHBondContact O-CB 3.49Å; F102-S106 PolarHBondContact O-N 2.82Å; V103-S106 WeakPolarHBondContact O-CB 3.37Å; V103-S106 PolarHBondContact O-N 3.46Å; G104-S106 VanDerWaalsContact C-N 3.33Å; G104-S106 PolarHBondContact O-N 2.94Å; S106-L109 PolarHBondContact O-N 3.36Å; S106-V110 WeakPolarHBondContact O-CG2 3.5Å; S106-V110 PolarHBondContact O-N 2.95Å; S106-S139 WeakPolarHBondContact CB-O 3.48Å; S106-S139 PolarHBondContact O-OG 3.49Å; S106-S139 PolarHBondContact OG-O 3.2Å; S106-S139 PolarHBondContact OG-OG 3.25Å
107M97.1Very high93.8Very high26 Ų2640.1 Ų40.113%0.12822%0.216CC..Hα-helixtrans-61.8-44.3176.9178-83.2-70.500111.8M43 F46 V103 G104 T105 L109 V110 V111M43-M107 HydrophobicContact CB-CG 4.44Å; F46-M107 HydrophobicContact CD1-CE 3.86Å; F46-M107 HydrophobicContact CE1-CE 4.27Å; F46-M107 HydrophobicContact CG-CE 4.27Å; V103-M107 WeakPolarHBondContact O-CB 3.46Å; V103-M107 PolarHBondContact O-N 3.46Å; G104-M107 PolarHBondContact O-N 3.01Å; T105-M107 PolarHBondContact O-N 3.33Å; M107-L109 VanDerWaalsContact C-N 3.31Å; M107-L109 PolarHBondContact O-N 3.01Å; M107-V110 PolarHBondContact O-N 3.45Å; M107-V110 VanDerWaalsContact O-N 3.11Å; M107-V111 WeakPolarHBondContact O-CG2 3.44Å; M107-V111 PolarHBondContact O-N 3.1Å; M107-V111 HydrophobicContact SD-CG2 3.82Å
108L97.1Very high92.8Very high113 Ų11340.6 Ų40.659%0.59223%0.23SC*.Hα-helixtrans-62.6-35.7177.7-70.4175.3000112.7G104 T105 V111 G112G104-L108 WeakPolarHBondContact O-CG 3.39Å; G104-L108 PolarHBondContact O-N 3.31Å; T105-L108 PolarHBondContact O-N 2.89Å; L108-V111 PolarHBondContact O-N 3.46Å; L108-G112 PolarHBondContact O-N 3.26Å
109L97Very high91.7Very high43 Ų4342.1 Ų42.123%0.22524%0.235CC..Hα-helixtrans-64.7-39.5173.2-73.7177000112T105 S106 M107 G112 T113 M135 A138 L142T105-L109 WeakPolarHBondContact O-CG 3.34Å; T105-L109 PolarHBondContact O-N 2.9Å; S106-L109 PolarHBondContact O-N 3.36Å; M107-L109 VanDerWaalsContact C-N 3.31Å; M107-L109 PolarHBondContact O-N 3.01Å; L109-G112 CarbonylContact O-C 3.57Å; L109-G112 WeakPolarHBondContact O-CA 3.37Å; L109-G112 PolarHBondContact O-N 2.91Å; L109-T113 PolarHBondContact O-N 3.07Å; L109-T113 PolarHBondContact O-OG1 3.4Å; L109-M135 HydrophobicContact CD2-CE 4.27Å; L109-M135 WeakPolarHBondContact O-CE 3.43Å; L109-A138 HydrophobicContact CD1-CB 3.84Å; L109-L142 HydrophobicContact CD1-CD1 3.57Å
110V96.2Very high90.4Very high0 Ų044 Ų440%024%0.244CC..Hα-helixtrans-66.5-44.2177179.60000111.1F38 T42 S106 M107 G112 T113 M114 S139F38-V110 HydrophobicContact CD1-CB 4.42Å; F38-V110 HydrophobicContact CD1-CG1 3.46Å; F38-V110 VanDerWaalsContact CD1-CG1 3.46Å; F38-V110 HydrophobicContact CD1-CG2 4.01Å; F38-V110 HydrophobicContact CE1-CB 4.36Å; F38-V110 HydrophobicContact CE1-CG1 3.86Å; F38-V110 HydrophobicContact CE1-CG2 3.5Å; F38-V110 VanDerWaalsContact CE1-CG2 3.5Å; F38-V110 HydrophobicContact CG-CG1 4.39Å; F38-V110 HydrophobicContact CZ-CG2 4.43Å; T42-V110 HydrophobicContact CG2-CG2 4.31Å; S106-V110 WeakPolarHBondContact O-CG2 3.5Å; S106-V110 PolarHBondContact O-N 2.95Å; M107-V110 PolarHBondContact O-N 3.45Å; M107-V110 VanDerWaalsContact O-N 3.11Å; V110-G112 VanDerWaalsContact C-N 3.27Å; V110-G112 PolarHBondContact O-N 3.26Å; V110-T113 WeakPolarHBondContact CA-OG1 3.48Å; V110-T113 PolarHBondContact O-N 3.46Å; V110-T113 PolarHBondContact O-OG1 3.5Å; V110-M114 PolarHBondContact O-N 3.21Å; V110-S139 WeakPolarHBondContact CG2-OG 3.25Å
111V95.2Very high89Confident60 Ų6052.3 Ų52.336%0.36428%0.28SS..Hα-helixtrans-60.6-41.4172.5174.60000110.4M107 L108 T113 M114 V115M107-V111 WeakPolarHBondContact O-CG2 3.44Å; M107-V111 PolarHBondContact O-N 3.1Å; M107-V111 HydrophobicContact SD-CG2 3.82Å; L108-V111 PolarHBondContact O-N 3.46Å; V111-T113 VanDerWaalsContact C-N 3.34Å; V111-T113 PolarHBondContact O-N 3.43Å; V111-M114 WeakPolarHBondContact O-CB 3.27Å; V111-M114 PolarHBondContact O-N 2.89Å; V111-V115 PolarHBondContact O-N 3.36Å; V111-V115 VanDerWaalsContact O-N 3.08Å
112G93.8Very high87.6Confident24 Ų2455.6 Ų55.625%0.24730%0.295CS..Hα-helixtrans-58.7-40.6174.400000113L108 L109 V110 M114 V115 A116L108-G112 PolarHBondContact O-N 3.26Å; L109-G112 CarbonylContact O-C 3.57Å; L109-G112 WeakPolarHBondContact O-CA 3.37Å; L109-G112 PolarHBondContact O-N 2.91Å; V110-G112 VanDerWaalsContact C-N 3.27Å; V110-G112 PolarHBondContact O-N 3.26Å; G112-M114 PolarHBondContact O-N 3.18Å; G112-V115 PolarHBondContact O-N 3.49Å; G112-A116 WeakPolarHBondContact O-CB 3.02Å; G112-A116 PolarHBondContact O-N 3.42Å
113T92.3Very high86.5Confident0 Ų056.2 Ų56.20%031%0.305CS..Hα-helixtrans-63.8-30.317438.90000113.4L109 V110 V111 F117 C132 M135 Q136L109-T113 PolarHBondContact O-N 3.07Å; L109-T113 PolarHBondContact O-OG1 3.4Å; V110-T113 WeakPolarHBondContact CA-OG1 3.48Å; V110-T113 PolarHBondContact O-N 3.46Å; V110-T113 PolarHBondContact O-OG1 3.5Å; V111-T113 VanDerWaalsContact C-N 3.34Å; V111-T113 PolarHBondContact O-N 3.43Å; T113-F117 PolarHBondContact O-N 2.6Å; T113-C132 HydrophobicContact CG2-CB 3.89Å; T113-C132 WeakPolarHBondContact CG2-O 3.29Å; T113-M135 HydrophobicContact CG2-CB 3.43Å; T113-M135 VanDerWaalsContact CG2-CB 3.43Å; T113-M135 HydrophobicContact CG2-CE 4.03Å; T113-M135 HydrophobicContact CG2-CG 4.3Å; T113-M135 HydrophobicContact CG2-SD 4Å; T113-Q136 HydrophobicContact CG2-CG 3.98Å
114M87.9Confident85.6Confident29 Ų2959.7 Ų59.714%0.14332%0.324CS..Hα-helixtrans-70.8-39.8172.9-71-76.272.700112.9W31 T35 I36 V110 V111 G112 F117W31-M114 HydrophobicContact CZ3-CE 4.46Å; T35-M114 VanDerWaalsContact C-SD 3.56Å; T35-M114 VanDerWaalsContact CB-CE 3.5Å; T35-M114 HydrophobicContact CG2-CE 3.4Å; T35-M114 VanDerWaalsContact CG2-CE 3.4Å; T35-M114 HydrophobicContact CG2-CG 4.01Å; T35-M114 HydrophobicContact CG2-SD 3.78Å; I36-M114 VanDerWaalsContact CA-SD 3.53Å; I36-M114 HydrophobicContact CB-SD 4.01Å; I36-M114 HydrophobicContact CG1-CE 4.37Å; I36-M114 HydrophobicContact CG1-SD 3.27Å; I36-M114 WeakPolarHBondContact CG1-SD 3.43Å; I36-M114 PolarHBondContact N-SD 3.21Å; V110-M114 PolarHBondContact O-N 3.21Å; V111-M114 WeakPolarHBondContact O-CB 3.27Å; V111-M114 PolarHBondContact O-N 2.89Å; G112-M114 PolarHBondContact O-N 3.18Å; M114-F117 HydrophobicContact CE-CB 4.16Å; M114-F117 WeakPolarHBondContact O-CB 3.41Å; M114-F117 PolarHBondContact O-N 2.88Å
115V86.6Confident84.8Confident90 Ų9060.4 Ų60.455%0.54533%0.329SS..Hα-helixtrans-66.8-40174.8178.80000111.2V111 G112 F117 S118V111-V115 PolarHBondContact O-N 3.36Å; V111-V115 VanDerWaalsContact O-N 3.08Å; G112-V115 PolarHBondContact O-N 3.49Å; V115-F117 PolarHBondContact O-N 3.32Å; V115-S118 WeakPolarHBondContact O-CB 3.16Å; V115-S118 PolarHBondContact O-N 3.04Å
116A84.6Confident84.2Confident16 Ų1657.2 Ų57.213%0.13231%0.309CS..Hα-helixtrans-60.8-29.617600000112.4G112 S118 L119 V128G112-A116 WeakPolarHBondContact O-CB 3.02Å; G112-A116 PolarHBondContact O-N 3.42Å; A116-S118 VanDerWaalsContact C-N 3.31Å; A116-S118 PolarHBondContact O-N 3.21Å; A116-L119 WeakPolarHBondContact O-CB 3.39Å; A116-L119 PolarHBondContact O-N 3.16Å; A116-L119 VanDerWaalsContact O-N 3.08Å; A116-V128 WeakPolarHBondContact O-CG1 3.18Å
117F73.8Confident83.6Confident67 Ų6761.2 Ų61.229%0.29433%0.33SS..Hα-helixtrans-63.8-34.8172.1-171.2-93.1000112.3W31 A32 T113 M114 V115 L119 F120W31-F117 HydrophobicContact CE3-CD2 4.32Å; W31-F117 AromaticContact CZ3-CD2 3.79Å; W31-F117 HydrophobicContact CZ3-CD2 3.79Å; W31-F117 HydrophobicContact CZ3-CE2 4.41Å; A32-F117 HydrophobicContact CB-CD2 4.22Å; A32-F117 HydrophobicContact CB-CE1 4.08Å; A32-F117 HydrophobicContact CB-CE2 3.71Å; A32-F117 HydrophobicContact CB-CZ 3.63Å; T113-F117 PolarHBondContact O-N 2.6Å; M114-F117 HydrophobicContact CE-CB 4.16Å; M114-F117 WeakPolarHBondContact O-CB 3.41Å; M114-F117 PolarHBondContact O-N 2.88Å; V115-F117 PolarHBondContact O-N 3.32Å; F117-L119 PolarHBondContact O-N 3.41Å; F117-L119 VanDerWaalsContact O-N 3.15Å; F117-F120 HydrophobicContact CB-CD2 4.24Å; F117-F120 HydrophobicContact CB-CE2 4.3Å; F117-F120 AromaticContact CD2-CD2 3.43Å; F117-F120 HydrophobicContact CD2-CD2 3.43Å; F117-F120 VanDerWaalsContact CD2-CD2 3.43Å; F117-F120 AromaticContact CD2-CE2 3.25Å; F117-F120 HydrophobicContact CD2-CE2 3.25Å; F117-F120 HydrophobicContact CD2-CZ 4.38Å; F117-F120 AromaticContact CE2-CD2 3.79Å; F117-F120 HydrophobicContact CE2-CD2 3.79Å; F117-F120 AromaticContact CE2-CE2 3.73Å; F117-F120 HydrophobicContact CE2-CE2 3.73Å; F117-F120 AromaticContact CG-CD2 3.83Å; F117-F120 HydrophobicContact CG-CD2 3.83Å; F117-F120 AromaticContact CG-CE2 3.99Å; F117-F120 HydrophobicContact CG-CE2 3.99Å; F117-F120 HydrophobicContact CZ-CD2 4.48Å; F117-F120 WeakPolarHBondContact O-CB 3.45Å; F117-F120 WeakPolarHBondContact O-CD2 3.35Å; F117-F120 PolarHBondContact O-N 3.25Å
118S73.4Confident83.2Confident78 Ų7860.4 Ų60.455%0.54533%0.327SS..Hα-helixtrans-66.1-17.3174.3-57.50000113V115 A116V115-S118 WeakPolarHBondContact O-CB 3.16Å; V115-S118 PolarHBondContact O-N 3.04Å; A116-S118 VanDerWaalsContact C-N 3.31Å; A116-S118 PolarHBondContact O-N 3.21Å
119L72.4Confident83Confident89 Ų8956.1 Ų56.147%0.46630%0.303SS..G310 helixtrans-86.2-0.9178.6-58.5174.9000113.8A116 F117 F121 F122 C123A116-L119 WeakPolarHBondContact O-CB 3.39Å; A116-L119 PolarHBondContact O-N 3.16Å; A116-L119 VanDerWaalsContact O-N 3.08Å; F117-L119 PolarHBondContact O-N 3.41Å; F117-L119 VanDerWaalsContact O-N 3.15Å; L119-F121 PolarHBondContact O-N 3.34Å; L119-F122 PolarHBondContact O-N 2.66Å; L119-C123 PolarHBondContact O-N 2.94Å
120F69.8Low82.7Confident39 Ų3956.8 Ų56.817%0.17130%0.304CS..G310 helixtrans-55-21.1174.6-91.8-74.5000113.8F117 A125 V128 Y129F117-F120 HydrophobicContact CB-CD2 4.24Å; F117-F120 HydrophobicContact CB-CE2 4.3Å; F117-F120 AromaticContact CD2-CD2 3.43Å; F117-F120 HydrophobicContact CD2-CD2 3.43Å; F117-F120 VanDerWaalsContact CD2-CD2 3.43Å; F117-F120 AromaticContact CD2-CE2 3.25Å; F117-F120 HydrophobicContact CD2-CE2 3.25Å; F117-F120 HydrophobicContact CD2-CZ 4.38Å; F117-F120 AromaticContact CE2-CD2 3.79Å; F117-F120 HydrophobicContact CE2-CD2 3.79Å; F117-F120 AromaticContact CE2-CE2 3.73Å; F117-F120 HydrophobicContact CE2-CE2 3.73Å; F117-F120 AromaticContact CG-CD2 3.83Å; F117-F120 HydrophobicContact CG-CD2 3.83Å; F117-F120 AromaticContact CG-CE2 3.99Å; F117-F120 HydrophobicContact CG-CE2 3.99Å; F117-F120 HydrophobicContact CZ-CD2 4.48Å; F117-F120 WeakPolarHBondContact O-CB 3.45Å; F117-F120 WeakPolarHBondContact O-CD2 3.35Å; F117-F120 PolarHBondContact O-N 3.25Å; F120-A125 HydrophobicContact CD1-CB 3.64Å; F120-A125 HydrophobicContact CE1-CB 3.63Å; F120-A125 WeakPolarHBondContact CE1-O 3.41Å; F120-V128 HydrophobicContact CD1-CB 4.23Å; F120-V128 HydrophobicContact CD1-CG1 4.32Å; F120-V128 HydrophobicContact CD2-CG1 3.95Å; F120-V128 HydrophobicContact CE1-CB 3.8Å; F120-V128 HydrophobicContact CE1-CG1 3.96Å; F120-V128 HydrophobicContact CE2-CB 4.22Å; F120-V128 HydrophobicContact CE2-CG1 3.45Å; F120-V128 VanDerWaalsContact CE2-CG1 3.45Å; F120-V128 HydrophobicContact CG-CG1 4.3Å; F120-V128 HydrophobicContact CZ-CB 3.76Å; F120-V128 HydrophobicContact CZ-CG1 3.46Å; F120-V128 VanDerWaalsContact CZ-CG1 3.46Å; F120-Y129 HydrophobicContact CE1-CD1 4.42Å; F120-Y129 AromaticContact CE1-CD2 3.75Å; F120-Y129 HydrophobicContact CE1-CD2 3.75Å; F120-Y129 HydrophobicContact CE1-CE1 4.17Å; F120-Y129 AromaticContact CE1-CE2 3.46Å; F120-Y129 HydrophobicContact CE1-CE2 3.46Å; F120-Y129 VanDerWaalsContact CE1-CE2 3.46Å; F120-Y129 HydrophobicContact CE1-CG 4.2Å; F120-Y129 AromaticContact CE1-CZ 3.68Å; F120-Y129 HydrophobicContact CE2-CE1 4.18Å; F120-Y129 AromaticContact CZ-CD1 3.65Å; F120-Y129 HydrophobicContact CZ-CD1 3.65Å; F120-Y129 AromaticContact CZ-CD2 3.81Å; F120-Y129 HydrophobicContact CZ-CD2 3.81Å; F120-Y129 AromaticContact CZ-CE1 3.46Å; F120-Y129 HydrophobicContact CZ-CE1 3.46Å; F120-Y129 VanDerWaalsContact CZ-CE1 3.46Å; F120-Y129 AromaticContact CZ-CE2 3.63Å; F120-Y129 HydrophobicContact CZ-CE2 3.63Å; F120-Y129 AromaticContact CZ-CG 3.79Å; F120-Y129 HydrophobicContact CZ-CG 3.79Å; F120-Y129 AromaticContact CZ-CZ 3.43Å; F120-Y129 VanDerWaalsContact CZ-CZ 3.43Å
121F67Low82.5Confident182 Ų18261.3 Ų61.380%0.79833%0.327SS*.G310 helixtrans-76.2-21.7178.1-65.9-76.1000114.1L119L119-F121 PolarHBondContact O-N 3.34Å
122F66Low82.5Confident179 Ų17958.4 Ų58.479%0.78531%0.31SS*.THydrogen-bonded Turntrans-115.5-16.8-173.1-61.4-75.6000113.6L119L119-F122 PolarHBondContact O-N 2.66Å
123C74.4Confident82.5Confident70 Ų7057.3 Ų57.347%0.47330%0.298SS..SBendtrans-121.8157.4-174.7-63.40000112.2L119 A125 V128L119-C123 PolarHBondContact O-N 2.94Å; C123-A125 PolarHBondContact O-N 3.01Å; C123-A125 VanDerWaalsContact O-N 3.1Å; C123-V128 HydrophobicContact CB-CG2 3.65Å
124N80.3Confident82.7Confident74 Ų7465.1 Ų65.140%0.39633%0.328SS..  trans-58.3118.1173.3-176.3-36.6000109.8G126 N127 V128 L209N124-G126 PolarHBondContact O-N 3.3Å; N124-G126 PolarHBondContact OD1-N 3.23Å; N124-N127 HydrophobicContact CB-CB 4.5Å; N124-N127 PolarHBondContact O-N 2.72Å; N124-V128 PolarHBondContact O-N 2.64Å; N124-V128 VanDerWaalsContact O-N 3.1Å; N124-L209 VanDerWaalsContact ND2-CD1 3.33Å; N124-L209 WeakPolarHBondContact ND2-CD1 3.47Å
125A80.3Confident83.1Confident22 Ų2265.9 Ų65.918%0.18233%0.331CS..Hα-helixtrans-53.9-36.7-17700000113.3F120 C123 N127 V128 Y129 Q205F120-A125 HydrophobicContact CD1-CB 3.64Å; F120-A125 HydrophobicContact CE1-CB 3.63Å; F120-A125 WeakPolarHBondContact CE1-O 3.41Å; C123-A125 PolarHBondContact O-N 3.01Å; C123-A125 VanDerWaalsContact O-N 3.1Å; A125-N127 PolarHBondContact O-N 3.25Å; A125-V128 PolarHBondContact O-N 3.36Å; A125-Y129 WeakPolarHBondContact O-CD2 3.41Å; A125-Y129 PolarHBondContact O-N 3.43Å; A125-Q205 HydrophobicContact CB-CG 3.94Å
126G83.9Confident83.6Confident0 Ų061.6 Ų61.60%031%0.305CS..Hα-helixtrans-62.6-43.6178.200000112.3N124 Y129 K130N124-G126 PolarHBondContact O-N 3.3Å; N124-G126 PolarHBondContact OD1-N 3.23Å; G126-Y129 PolarHBondContact O-N 3.2Å; G126-K130 WeakPolarHBondContact O-CG 3.45Å; G126-K130 PolarHBondContact O-N 3.19Å; G126-K130 VanDerWaalsContact O-N 3.13Å
127N86.6Confident84.2Confident84 Ų8463.1 Ų63.145%0.44931%0.311SS..Hα-helixtrans-68.1-40.3177.3-70.2-20.7000111.9N124 A125 Y129 K130 I131N124-N127 HydrophobicContact CB-CB 4.5Å; N124-N127 PolarHBondContact O-N 2.72Å; A125-N127 PolarHBondContact O-N 3.25Å; N127-Y129 PolarHBondContact O-N 3.23Å; N127-K130 PolarHBondContact O-N 3.05Å; N127-I131 VanDerWaalsContact O-CG1 3.3Å; N127-I131 WeakPolarHBondContact O-CG1 3.35Å; N127-I131 PolarHBondContact O-N 3.21Å
128V89.6Confident85.3Confident10 Ų1061.9 Ų61.96%0.06131%0.314CS..Hα-helixtrans-60.7-46.4176.8179.60000110.6A116 F120 C123 N124 A125 K130 I131 C132A116-V128 WeakPolarHBondContact O-CG1 3.18Å; F120-V128 HydrophobicContact CD1-CB 4.23Å; F120-V128 HydrophobicContact CD1-CG1 4.32Å; F120-V128 HydrophobicContact CD2-CG1 3.95Å; F120-V128 HydrophobicContact CE1-CB 3.8Å; F120-V128 HydrophobicContact CE1-CG1 3.96Å; F120-V128 HydrophobicContact CE2-CB 4.22Å; F120-V128 HydrophobicContact CE2-CG1 3.45Å; F120-V128 VanDerWaalsContact CE2-CG1 3.45Å; F120-V128 HydrophobicContact CG-CG1 4.3Å; F120-V128 HydrophobicContact CZ-CB 3.76Å; F120-V128 HydrophobicContact CZ-CG1 3.46Å; F120-V128 VanDerWaalsContact CZ-CG1 3.46Å; C123-V128 HydrophobicContact CB-CG2 3.65Å; N124-V128 PolarHBondContact O-N 2.64Å; N124-V128 VanDerWaalsContact O-N 3.1Å; A125-V128 PolarHBondContact O-N 3.36Å; V128-K130 VanDerWaalsContact C-N 3.33Å; V128-K130 PolarHBondContact O-N 3.35Å; V128-I131 PolarHBondContact O-N 3.45Å; V128-C132 WeakPolarHBondContact O-CB 3.36Å; V128-C132 PolarHBondContact O-N 2.95Å; V128-C132 PolarHBondContact O-SG 3.5Å
129Y90.9Very high86.5Confident23 Ų2358.2 Ų58.29%0.0929%0.288CS..Hα-helixtrans-60-40.5175.8-77.5-58.3000112.6W31 F120 A125 G126 N127 C132 A133 S198 L201W31-Y129 HydrophobicContact CE3-CE1 4.3Å; F120-Y129 HydrophobicContact CE1-CD1 4.42Å; F120-Y129 AromaticContact CE1-CD2 3.75Å; F120-Y129 HydrophobicContact CE1-CD2 3.75Å; F120-Y129 HydrophobicContact CE1-CE1 4.17Å; F120-Y129 AromaticContact CE1-CE2 3.46Å; F120-Y129 HydrophobicContact CE1-CE2 3.46Å; F120-Y129 VanDerWaalsContact CE1-CE2 3.46Å; F120-Y129 HydrophobicContact CE1-CG 4.2Å; F120-Y129 AromaticContact CE1-CZ 3.68Å; F120-Y129 HydrophobicContact CE2-CE1 4.18Å; F120-Y129 AromaticContact CZ-CD1 3.65Å; F120-Y129 HydrophobicContact CZ-CD1 3.65Å; F120-Y129 AromaticContact CZ-CD2 3.81Å; F120-Y129 HydrophobicContact CZ-CD2 3.81Å; F120-Y129 AromaticContact CZ-CE1 3.46Å; F120-Y129 HydrophobicContact CZ-CE1 3.46Å; F120-Y129 VanDerWaalsContact CZ-CE1 3.46Å; F120-Y129 AromaticContact CZ-CE2 3.63Å; F120-Y129 HydrophobicContact CZ-CE2 3.63Å; F120-Y129 AromaticContact CZ-CG 3.79Å; F120-Y129 HydrophobicContact CZ-CG 3.79Å; F120-Y129 AromaticContact CZ-CZ 3.43Å; F120-Y129 VanDerWaalsContact CZ-CZ 3.43Å; A125-Y129 WeakPolarHBondContact O-CD2 3.41Å; A125-Y129 PolarHBondContact O-N 3.43Å; G126-Y129 PolarHBondContact O-N 3.2Å; N127-Y129 PolarHBondContact O-N 3.23Å; Y129-C132 PolarHBondContact O-N 3.08Å; Y129-A133 WeakPolarHBondContact O-CB 3.41Å; Y129-A133 PolarHBondContact O-N 2.97Å; Y129-S198 PolarHBondContact O-OG 3.12Å; Y129-L201 HydrophobicContact CD1-CB 4.01Å; Y129-L201 HydrophobicContact CD1-CD1 4.19Å; Y129-L201 HydrophobicContact CD2-CB 4.11Å; Y129-L201 HydrophobicContact CE1-CB 4.22Å; Y129-L201 HydrophobicContact CE1-CD1 3.82Å; Y129-L201 HydrophobicContact CE2-CB 4.32Å; Y129-L201 HydrophobicContact CG-CB 3.98Å
130K91.8Very high87.7Confident56 Ų5654.3 Ų54.324%0.24327%0.268CS..Hα-helixtrans-66.5-42.4176.8-70172-174.8170.70112.3G126 N127 V128 A133 W134 D206G126-K130 WeakPolarHBondContact O-CG 3.45Å; G126-K130 PolarHBondContact O-N 3.19Å; G126-K130 VanDerWaalsContact O-N 3.13Å; N127-K130 PolarHBondContact O-N 3.05Å; V128-K130 VanDerWaalsContact C-N 3.33Å; V128-K130 PolarHBondContact O-N 3.35Å; K130-A133 WeakPolarHBondContact O-CB 3.46Å; K130-A133 PolarHBondContact O-N 3.15Å; K130-W134 PolarHBondContact O-N 2.81Å; K130-D206 WeakPolarHBondContact CE-OD2 3.04Å; K130-D206 IonicContact NZ-OD1 2.63Å; K130-D206 PolarHBondContact NZ-OD1 3.37Å; K130-D206 IonicContact NZ-OD2 3.7Å; K130-D206 PolarHBondContact NZ-OD2 3.33Å
131I92.3Very high89.1Confident95 Ų9556.9 Ų56.949%0.48729%0.287SS..Hα-helixtrans-61.5-48.2176.2-68.5164.8000109.8N127 V128 A133 W134 M135N127-I131 VanDerWaalsContact O-CG1 3.3Å; N127-I131 WeakPolarHBondContact O-CG1 3.35Å; N127-I131 PolarHBondContact O-N 3.21Å; V128-I131 PolarHBondContact O-N 3.45Å; I131-A133 VanDerWaalsContact C-N 3.26Å; I131-A133 PolarHBondContact O-N 3.22Å; I131-W134 PolarHBondContact O-N 3.43Å; I131-M135 HydrophobicContact CG2-CG 4.41Å; I131-M135 HydrophobicContact CG2-SD 3.89Å; I131-M135 WeakPolarHBondContact O-CG 3.21Å; I131-M135 PolarHBondContact O-N 2.89Å
132C94Very high90.6Very high0 Ų049.7 Ų49.70%026%0.257CS..Hα-helixtrans-58.7-39.2176.2-70.70000112.2W31 T113 V128 Y129 M135 Q136W31-C132 HydrophobicContact CH2-CB 3.74Å; W31-C132 HydrophobicContact CZ2-CB 3.92Å; T113-C132 HydrophobicContact CG2-CB 3.89Å; T113-C132 WeakPolarHBondContact CG2-O 3.29Å; V128-C132 WeakPolarHBondContact O-CB 3.36Å; V128-C132 PolarHBondContact O-N 2.95Å; V128-C132 PolarHBondContact O-SG 3.5Å; Y129-C132 PolarHBondContact O-N 3.08Å; C132-M135 PolarHBondContact O-N 3.23Å; C132-Q136 WeakPolarHBondContact O-CG 3.5Å; C132-Q136 PolarHBondContact O-N 3.41Å
133A95.2Very high92.1Very high0 Ų041.2 Ų41.20%022%0.22CC..Hα-helixtrans-61.9-46.9177.100000111.8Y129 K130 I131 M135 Q136 L137 A195 F199Y129-A133 WeakPolarHBondContact O-CB 3.41Å; Y129-A133 PolarHBondContact O-N 2.97Å; K130-A133 WeakPolarHBondContact O-CB 3.46Å; K130-A133 PolarHBondContact O-N 3.15Å; I131-A133 VanDerWaalsContact C-N 3.26Å; I131-A133 PolarHBondContact O-N 3.22Å; A133-M135 PolarHBondContact O-N 3.28Å; A133-Q136 PolarHBondContact O-N 3.26Å; A133-L137 PolarHBondContact O-N 2.89Å; A133-A195 WeakPolarHBondContact CB-O 3.44Å; A133-A195 WeakPolarHBondContact O-CB 3.08Å; A133-F199 HydrophobicContact CB-CB 4.44Å; A133-F199 HydrophobicContact CB-CD1 3.79Å; A133-F199 HydrophobicContact CB-CD2 3.47Å; A133-F199 VanDerWaalsContact CB-CD2 3.47Å; A133-F199 HydrophobicContact CB-CE1 3.77Å; A133-F199 HydrophobicContact CB-CE2 3.43Å; A133-F199 VanDerWaalsContact CB-CE2 3.43Å; A133-F199 HydrophobicContact CB-CG 3.63Å; A133-F199 HydrophobicContact CB-CZ 3.58Å
134W96.1Very high93.3Very high165 Ų16538.5 Ų38.563%0.62520%0.203SC*.Hα-helixtrans-63.9-39.8176.4-77.1115.2000112.7K130 I131 L137 A138 F199K130-W134 PolarHBondContact O-N 2.81Å; I131-W134 PolarHBondContact O-N 3.43Å; W134-L137 HydrophobicContact CE3-CD1 4.2Å; W134-L137 HydrophobicContact CZ3-CD1 4.21Å; W134-L137 PolarHBondContact O-N 2.98Å; W134-A138 WeakPolarHBondContact O-CB 3.44Å; W134-A138 PolarHBondContact O-N 3.25Å; W134-F199 AromaticContact CD1-CZ 3.96Å; W134-F199 AromaticContact CD2-CZ 3.81Å; W134-F199 HydrophobicContact CD2-CZ 3.81Å; W134-F199 AromaticContact CE2-CZ 3.61Å; W134-F199 HydrophobicContact CE3-CZ 4.4Å; W134-F199 HydrophobicContact CG-CZ 4.03Å; W134-F199 HydrophobicContact CZ2-CE1 4.49Å; W134-F199 HydrophobicContact CZ2-CZ 4.05Å; W134-F199 AromaticContact NE1-CE1 3.72Å; W134-F199 AromaticContact NE1-CZ 3.7Å
135M95.9Very high94.1Very high44 Ų4438.2 Ų38.222%0.21720%0.2CC..Hα-helixtrans-63.5-40.7175.8-71.1175.467.800112L109 T113 I131 C132 A133 A138 S139L109-M135 HydrophobicContact CD2-CE 4.27Å; L109-M135 WeakPolarHBondContact O-CE 3.43Å; T113-M135 HydrophobicContact CG2-CB 3.43Å; T113-M135 VanDerWaalsContact CG2-CB 3.43Å; T113-M135 HydrophobicContact CG2-CE 4.03Å; T113-M135 HydrophobicContact CG2-CG 4.3Å; T113-M135 HydrophobicContact CG2-SD 4Å; I131-M135 HydrophobicContact CG2-CG 4.41Å; I131-M135 HydrophobicContact CG2-SD 3.89Å; I131-M135 WeakPolarHBondContact O-CG 3.21Å; I131-M135 PolarHBondContact O-N 2.89Å; C132-M135 PolarHBondContact O-N 3.23Å; A133-M135 PolarHBondContact O-N 3.28Å; M135-A138 PolarHBondContact O-N 2.91Å; M135-S139 WeakPolarHBondContact O-CB 3.22Å; M135-S139 PolarHBondContact O-N 2.83Å
136Q96.6Very high95Very high0 Ų037.1 Ų37.10%019%0.192CC..Hα-helixtrans-68.8-38.9176.1-74.6176.57.400112.3T113 C132 A133 S139 A140 L194 A195T113-Q136 HydrophobicContact CG2-CG 3.98Å; C132-Q136 WeakPolarHBondContact O-CG 3.5Å; C132-Q136 PolarHBondContact O-N 3.41Å; A133-Q136 PolarHBondContact O-N 3.26Å; Q136-S139 WeakPolarHBondContact O-CB 3.45Å; Q136-S139 PolarHBondContact O-N 2.93Å; Q136-A140 PolarHBondContact O-N 3.4Å; Q136-L194 PolarHBondContact OE1-O 3.33Å; Q136-A195 HydrophobicContact CB-CB 3.86Å
137L97.4Very high95.6Very high48 Ų4837.5 Ų37.525%0.25119%0.194SC..Hα-helixtrans-62.6-45.9171.9-74.3-173.9000112.1A133 W134 S139 A140 V141 A195 F199A133-L137 PolarHBondContact O-N 2.89Å; W134-L137 HydrophobicContact CE3-CD1 4.2Å; W134-L137 HydrophobicContact CZ3-CD1 4.21Å; W134-L137 PolarHBondContact O-N 2.98Å; L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 2.94Å; L137-A140 WeakPolarHBondContact O-CB 2.98Å; L137-A140 PolarHBondContact O-N 3.3Å; L137-V141 WeakPolarHBondContact O-CG2 3.38Å; L137-V141 PolarHBondContact O-N 3.24Å; L137-V141 VanDerWaalsContact O-N 3.08Å; L137-A195 HydrophobicContact CD2-CB 3.61Å; L137-A195 HydrophobicContact CG-CB 3.68Å; L137-F199 HydrophobicContact CD1-CE2 3.7Å; L137-F199 HydrophobicContact CD1-CZ 4.38Å; L137-F199 HydrophobicContact CG-CE2 4.35Å
138A97.9Very high96.1Very high42 Ų4239.6 Ų39.635%0.34720%0.202SC..Hα-helixtrans-60.4-41.8176.300000111L109 W134 M135 A140 V141 L142L109-A138 HydrophobicContact CD1-CB 3.84Å; W134-A138 WeakPolarHBondContact O-CB 3.44Å; W134-A138 PolarHBondContact O-N 3.25Å; M135-A138 PolarHBondContact O-N 2.91Å; A138-A140 PolarHBondContact O-N 3.47Å; A138-V141 PolarHBondContact O-N 2.8Å; A138-L142 VanDerWaalsContact O-CG 3.24Å; A138-L142 WeakPolarHBondContact O-CG 3.39Å; A138-L142 PolarHBondContact O-N 2.86Å
139S98Very high96.5Very high1 Ų141 Ų411%0.00721%0.209CC..Hα-helixtrans-58.7-43.6173.9177.90000112.6S106 V110 M135 Q136 L137 V141 L142 M143S106-S139 WeakPolarHBondContact CB-O 3.48Å; S106-S139 PolarHBondContact O-OG 3.49Å; S106-S139 PolarHBondContact OG-O 3.2Å; S106-S139 PolarHBondContact OG-OG 3.25Å; V110-S139 WeakPolarHBondContact CG2-OG 3.25Å; M135-S139 WeakPolarHBondContact O-CB 3.22Å; M135-S139 PolarHBondContact O-N 2.83Å; Q136-S139 WeakPolarHBondContact O-CB 3.45Å; Q136-S139 PolarHBondContact O-N 2.93Å; L137-S139 VanDerWaalsContact C-N 3.28Å; L137-S139 PolarHBondContact O-N 2.94Å; S139-V141 PolarHBondContact O-N 2.87Å; S139-L142 PolarHBondContact O-N 3.08Å; S139-M143 WeakPolarHBondContact O-CB 3.15Å; S139-M143 PolarHBondContact O-N 3.31Å
140A98.3Very high96.8Very high6 Ų639.9 Ų39.95%0.0521%0.205CC..Hα-helixtrans-61.1-44.2177.500000112.2Q136 L137 A138 M143 G144 I188 A191 V192Q136-A140 PolarHBondContact O-N 3.4Å; L137-A140 WeakPolarHBondContact O-CB 2.98Å; L137-A140 PolarHBondContact O-N 3.3Å; A138-A140 PolarHBondContact O-N 3.47Å; A140-M143 PolarHBondContact O-N 2.97Å; A140-G144 PolarHBondContact O-N 3.48Å; A140-I188 HydrophobicContact CB-CG2 4.44Å; A140-A191 HydrophobicContact CB-CB 3.72Å; A140-V192 HydrophobicContact CB-CG2 3.94Å
141V98.4Very high97.1Very high93 Ų9337.4 Ų37.456%0.56419%0.194SC*.Hα-helixtrans-63.8-45.9177.9174.30000111L137 A138 S139 G144 M145L137-V141 WeakPolarHBondContact O-CG2 3.38Å; L137-V141 PolarHBondContact O-N 3.24Å; L137-V141 VanDerWaalsContact O-N 3.08Å; A138-V141 PolarHBondContact O-N 2.8Å; S139-V141 PolarHBondContact O-N 2.87Å; V141-G144 PolarHBondContact O-N 2.99Å; V141-M145 HydrophobicContact CG1-CE 4.12Å; V141-M145 WeakPolarHBondContact O-CG 3.34Å; V141-M145 PolarHBondContact O-N 3.09Å
142L98.4Very high97.2Very high31 Ų3135.3 Ų35.316%0.16218%0.184CC..Hα-helixtrans-64.1-43.2178.1-65.9168000111.9F102 T105 L109 A138 S139 G144 M145 G146F102-L142 HydrophobicContact CD1-CD2 3.57Å; F102-L142 HydrophobicContact CE1-CD2 3.96Å; T105-L142 HydrophobicContact CG2-CD1 3.79Å; L109-L142 HydrophobicContact CD1-CD1 3.57Å; A138-L142 VanDerWaalsContact O-CG 3.24Å; A138-L142 WeakPolarHBondContact O-CG 3.39Å; A138-L142 PolarHBondContact O-N 2.86Å; S139-L142 PolarHBondContact O-N 3.08Å; L142-G144 VanDerWaalsContact C-N 3.33Å; L142-G144 PolarHBondContact O-N 3.05Å; L142-M145 HydrophobicContact CD2-CE 3.67Å; L142-M145 HydrophobicContact CG-CE 4.43Å; L142-M145 PolarHBondContact O-N 3.43Å; L142-G146 PolarHBondContact O-N 2.94Å
143M98.4Very high97.3Very high2 Ų235.3 Ų35.31%0.0118%0.184CC..Hα-helixtrans-61-43.5174.8-176.16371.400111.2V103 S139 A140 G146 C147 A184 I188V103-M143 HydrophobicContact CB-SD 4.47Å; V103-M143 HydrophobicContact CG1-CE 3.82Å; V103-M143 HydrophobicContact CG1-SD 3.88Å; V103-M143 HydrophobicContact CG2-SD 4.05Å; S139-M143 WeakPolarHBondContact O-CB 3.15Å; S139-M143 PolarHBondContact O-N 3.31Å; A140-M143 PolarHBondContact O-N 2.97Å; M143-G146 PolarHBondContact O-N 3.23Å; M143-C147 PolarHBondContact O-N 3.24Å; M143-C147 PolarHBondContact O-SG 3.46Å; M143-A184 HydrophobicContact SD-CB 4.02Å; M143-I188 HydrophobicContact CB-CG1 3.99Å; M143-I188 HydrophobicContact CG-CD1 4.35Å; M143-I188 HydrophobicContact CG-CG1 3.66Å
144G98.3Very high97.3Very high12 Ų1236.2 Ų36.212%0.12419%0.188CC..Hα-helixtrans-58.9-47.6175.700000112.6A140 V141 L142 G146 C147 M148A140-G144 PolarHBondContact O-N 3.48Å; V141-G144 PolarHBondContact O-N 2.99Å; L142-G144 VanDerWaalsContact C-N 3.33Å; L142-G144 PolarHBondContact O-N 3.05Å; G144-G146 PolarHBondContact O-N 3.23Å; G144-C147 PolarHBondContact O-N 3.19Å; G144-M148 WeakPolarHBondContact O-CG 3.49Å; G144-M148 PolarHBondContact O-N 2.84Å
145M98.2Very high97.2Very high68 Ų6830.6 Ų30.634%0.33517%0.17SC..Hα-helixtrans-60.9-43.8174.6-71.4-171.1-63.900111.8F102 V141 L142 C147 M148 I149F102-M145 HydrophobicContact CD1-CB 4.39Å; F102-M145 HydrophobicContact CD1-CE 3.63Å; F102-M145 HydrophobicContact CE1-CE 3.39Å; F102-M145 HydrophobicContact CE1-SD 4.16Å; F102-M145 HydrophobicContact CG-CB 4.35Å; F102-M145 HydrophobicContact CZ-CE 4.2Å; F102-M145 HydrophobicContact CZ-SD 4.41Å; V141-M145 HydrophobicContact CG1-CE 4.12Å; V141-M145 WeakPolarHBondContact O-CG 3.34Å; V141-M145 PolarHBondContact O-N 3.09Å; L142-M145 HydrophobicContact CD2-CE 3.67Å; L142-M145 HydrophobicContact CG-CE 4.43Å; L142-M145 PolarHBondContact O-N 3.43Å; M145-C147 VanDerWaalsContact C-N 3.32Å; M145-C147 PolarHBondContact O-N 2.89Å; M145-M148 PolarHBondContact O-N 2.86Å; M145-I149 HydrophobicContact CB-CD1 4.46Å; M145-I149 WeakPolarHBondContact O-CB 3.36Å; M145-I149 WeakPolarHBondContact O-CD1 3.5Å; M145-I149 WeakPolarHBondContact O-CG1 3.33Å; M145-I149 PolarHBondContact O-N 3.2Å
146G97.8Very high97.2Very high0 Ų029 Ų290%016%0.164CC..Hα-helixtrans-57.7-43.9175.200000112.8L142 M143 G144 I149 Y150L142-G146 PolarHBondContact O-N 2.94Å; M143-G146 PolarHBondContact O-N 3.23Å; G144-G146 PolarHBondContact O-N 3.23Å; G146-I149 PolarHBondContact O-N 2.9Å; G146-Y150 WeakPolarHBondContact O-CB 3.03Å; G146-Y150 PolarHBondContact O-N 2.82Å
147C97.8Very high97Very high7 Ų735 Ų355%0.04720%0.196CC..Hα-helixtrans-67.1-34.7177.8-67.30000113M143 G144 M145 P151 Y181M143-C147 PolarHBondContact O-N 3.24Å; M143-C147 PolarHBondContact O-SG 3.46Å; G144-C147 PolarHBondContact O-N 3.19Å; M145-C147 VanDerWaalsContact C-N 3.32Å; M145-C147 PolarHBondContact O-N 2.89Å; C147-P151 WeakPolarHBondContact O-CD 3.45Å; C147-Y181 HydrophobicContact CB-CE2 4.17Å; C147-Y181 PolarHBondContact O-OH 3.35Å
148M97.8Very high96.8Very high128 Ų12835.7 Ų35.763%0.63120%0.198SC*.Hα-helixtrans-73.5-38.5175.4-69.4-175.8-169.900112.3G144 M145 P151 Y170G144-M148 WeakPolarHBondContact O-CG 3.49Å; G144-M148 PolarHBondContact O-N 2.84Å; M145-M148 PolarHBondContact O-N 2.86Å; M148-P151 WeakPolarHBondContact O-CD 3.37Å; M148-Y170 PolarHBondContact O-OH 2.85Å
149I97.7Very high96.6Very high39 Ų3933.7 Ų33.720%0.218%0.181CC..Hα-helixtrans-75.4-31.4-178.6-66.7165.3000111.3A95 T98 A99 F102 M145 G146 D152A95-I149 HydrophobicContact CB-CG2 4.18Å; A95-I149 WeakPolarHBondContact O-CG2 3.46Å; T98-I149 HydrophobicContact CG2-CD1 3.98Å; T98-I149 HydrophobicContact CG2-CG2 4.29Å; A99-I149 HydrophobicContact CB-CB 4.44Å; A99-I149 HydrophobicContact CB-CG2 4.24Å; F102-I149 HydrophobicContact CD2-CD1 3.61Å; F102-I149 HydrophobicContact CE2-CD1 3.56Å; M145-I149 HydrophobicContact CB-CD1 4.46Å; M145-I149 WeakPolarHBondContact O-CB 3.36Å; M145-I149 WeakPolarHBondContact O-CD1 3.5Å; M145-I149 WeakPolarHBondContact O-CG1 3.33Å; M145-I149 PolarHBondContact O-N 3.2Å; G146-I149 PolarHBondContact O-N 2.9Å; I149-D152 WeakPolarHBondContact O-CB 3.35Å; I149-D152 PolarHBondContact O-N 3.35Å
150Y97.1Very high96.3Very high0 Ų035.9 Ų35.90%019%0.191CC..G310 helixtrans-55.4-46.1-176.3-173-96.6000113.6W51 I52 F64 G65 L66 F96 A99 G146 D152 G153 W154 Y181W51-Y150 HydrophobicContact CB-CE1 3.87Å; W51-Y150 HydrophobicContact CB-CE2 4.46Å; W51-Y150 WeakPolarHBondContact CB-OH 3.42Å; W51-Y150 HydrophobicContact CD2-CE1 4.48Å; W51-Y150 HydrophobicContact CD2-CE2 4.3Å; W51-Y150 AromaticContact CE3-CD1 3.66Å; W51-Y150 HydrophobicContact CE3-CD1 3.66Å; W51-Y150 AromaticContact CE3-CD2 3.67Å; W51-Y150 HydrophobicContact CE3-CD2 3.67Å; W51-Y150 AromaticContact CE3-CE1 3.78Å; W51-Y150 HydrophobicContact CE3-CE1 3.78Å; W51-Y150 AromaticContact CE3-CE2 3.8Å; W51-Y150 HydrophobicContact CE3-CE2 3.8Å; W51-Y150 AromaticContact CE3-CG 3.59Å; W51-Y150 HydrophobicContact CE3-CG 3.59Å; W51-Y150 AromaticContact CE3-CZ 3.85Å; W51-Y150 HydrophobicContact CZ3-CD1 4.24Å; W51-Y150 HydrophobicContact CZ3-CD2 4.01Å; W51-Y150 AromaticContact CZ3-CG 3.84Å; W51-Y150 HydrophobicContact CZ3-CG 3.84Å; I52-Y150 HydrophobicContact CG2-CE1 4.09Å; F64-Y150 PolarHBondContact O-OH 2.91Å; G65-Y150 WeakPolarHBondContact O-CE2 3.38Å; G65-Y150 PolarHBondContact O-OH 3.45Å; L66-Y150 HydrophobicContact CD2-CD2 3.86Å; L66-Y150 HydrophobicContact CD2-CE2 4.15Å; F96-Y150 AromaticContact CD1-CD2 3.55Å; F96-Y150 HydrophobicContact CD1-CD2 3.55Å; F96-Y150 AromaticContact CD1-CE2 3.5Å; F96-Y150 HydrophobicContact CD1-CE2 3.5Å; F96-Y150 HydrophobicContact CD1-CG 4.27Å; F96-Y150 HydrophobicContact CE1-CD1 4.31Å; F96-Y150 AromaticContact CE1-CD2 3.73Å; F96-Y150 HydrophobicContact CE1-CD2 3.73Å; F96-Y150 HydrophobicContact CE1-CE1 4.1Å; F96-Y150 AromaticContact CE1-CE2 3.48Å; F96-Y150 HydrophobicContact CE1-CE2 3.48Å; F96-Y150 VanDerWaalsContact CE1-CE2 3.48Å; F96-Y150 HydrophobicContact CE1-CG 4.13Å; F96-Y150 AromaticContact CE1-CZ 3.69Å; F96-Y150 VanDerWaalsContact CE1-O 3.24Å; F96-Y150 WeakPolarHBondContact CE1-O 3.42Å; F96-Y150 HydrophobicContact CG-CE2 4.24Å; F96-Y150 HydrophobicContact CZ-CE2 4.23Å; A99-Y150 HydrophobicContact CB-CD2 4.27Å; G146-Y150 WeakPolarHBondContact O-CB 3.03Å; G146-Y150 PolarHBondContact O-N 2.82Å; Y150-D152 PolarHBondContact O-N 3.04Å; Y150-G153 PolarHBondContact O-N 3.04Å; Y150-W154 AromaticContact CD1-NE1 3.56Å; Y150-W154 AromaticContact CE1-NE1 3.55Å; Y150-Y181 HydrophobicContact CD1-CD2 4.39Å; Y150-Y181 HydrophobicContact CD1-CE2 4.15Å
151P96.8Very high96Very high4 Ų444 Ų443%0.02622%0.22CC..G310 helixtrans-57.3-23.6173.5-27.533.9000117C147 M148 G153 W154 Y170 Y181C147-P151 WeakPolarHBondContact O-CD 3.45Å; M148-P151 WeakPolarHBondContact O-CD 3.37Å; P151-G153 PolarHBondContact O-N 3.08Å; P151-W154 VanDerWaalsContact CA-CE2 3.49Å; P151-W154 HydrophobicContact CB-CD2 4.06Å; P151-W154 HydrophobicContact CB-CE3 4.17Å; P151-W154 HydrophobicContact CB-CH2 4.06Å; P151-W154 HydrophobicContact CB-CZ2 3.93Å; P151-W154 HydrophobicContact CB-CZ3 4.17Å; P151-W154 HydrophobicContact CG-CH2 4.12Å; P151-W154 HydrophobicContact CG-CZ2 3.85Å; P151-W154 WeakPolarHBondContact O-CB 3.49Å; P151-W154 PolarHBondContact O-N 3.43Å; P151-Y170 HydrophobicContact CB-CD1 3.52Å; P151-Y170 HydrophobicContact CB-CD2 4.17Å; P151-Y170 HydrophobicContact CB-CE1 3.68Å; P151-Y170 HydrophobicContact CB-CE2 4.3Å; P151-Y170 HydrophobicContact CB-CG 3.79Å; P151-Y170 HydrophobicContact CG-CD1 4.04Å; P151-Y170 HydrophobicContact CG-CE1 3.94Å; P151-Y170 PolarHBondContact O-N 2.95Å; P151-Y181 WeakPolarHBondContact CG-OH 3.24Å
152D96Very high95.6Very high52 Ų5239.6 Ų39.628%0.27819%0.193SC..G310 helixtrans-67.8-20.8174.4-76.5-37.1000112.3A95 I149 Y150 W154 N155 Y170A95-D152 HydrophobicContact CB-CB 3.82Å; I149-D152 WeakPolarHBondContact O-CB 3.35Å; I149-D152 PolarHBondContact O-N 3.35Å; Y150-D152 PolarHBondContact O-N 3.04Å; D152-W154 VanDerWaalsContact C-N 3.34Å; D152-N155 PolarHBondContact O-OD1 3.49Å; D152-N155 VanDerWaalsContact O-OD1 3.05Å; D152-Y170 WeakPolarHBondContact OD1-CE2 3.48Å
153G95.1Very high95.3Very high0 Ų038.2 Ų38.20%019%0.186CC..G310 helixtrans-82.6-7.6177.900000114.8S93 Y150 P151 N155 A156S93-G153 WeakPolarHBondContact OG-CA 3.48Å; Y150-G153 PolarHBondContact O-N 3.04Å; P151-G153 PolarHBondContact O-N 3.08Å; G153-N155 PolarHBondContact O-N 3.02Å; G153-A156 WeakPolarHBondContact O-CB 3.34Å; G153-A156 PolarHBondContact O-N 3.11Å
154W95.7Very high95Very high18 Ų1839.3 Ų39.37%0.06820%0.198CC..G310 helixtrans-68.7-17.5-176.2-62.6-7.4000113.8I52 Y150 P151 D152 A156 V159 T167 L172I52-W154 HydrophobicContact CG2-CZ2 4.33Å; Y150-W154 AromaticContact CD1-NE1 3.56Å; Y150-W154 AromaticContact CE1-NE1 3.55Å; P151-W154 VanDerWaalsContact CA-CE2 3.49Å; P151-W154 HydrophobicContact CB-CD2 4.06Å; P151-W154 HydrophobicContact CB-CE3 4.17Å; P151-W154 HydrophobicContact CB-CH2 4.06Å; P151-W154 HydrophobicContact CB-CZ2 3.93Å; P151-W154 HydrophobicContact CB-CZ3 4.17Å; P151-W154 HydrophobicContact CG-CH2 4.12Å; P151-W154 HydrophobicContact CG-CZ2 3.85Å; P151-W154 WeakPolarHBondContact O-CB 3.49Å; P151-W154 PolarHBondContact O-N 3.43Å; D152-W154 VanDerWaalsContact C-N 3.34Å; W154-A156 PolarHBondContact O-N 3.07Å; W154-V159 WeakPolarHBondContact O-CB 3.47Å; W154-V159 WeakPolarHBondContact O-CG1 3.42Å; W154-T167 HydrophobicContact CB-CG2 4.23Å; W154-T167 VanDerWaalsContact O-CG2 3.24Å; W154-T167 WeakPolarHBondContact O-CG2 3.48Å; W154-L172 HydrophobicContact CB-CD1 4.33Å; W154-L172 HydrophobicContact CD2-CD1 3.21Å; W154-L172 HydrophobicContact CD2-CG 4.46Å; W154-L172 VanDerWaalsContact CE2-CD1 3.44Å; W154-L172 HydrophobicContact CE3-CB 3.89Å; W154-L172 HydrophobicContact CE3-CD1 3.42Å; W154-L172 VanDerWaalsContact CE3-CD1 3.42Å; W154-L172 HydrophobicContact CE3-CG 4.27Å; W154-L172 HydrophobicContact CG-CD1 3.65Å; W154-L172 HydrophobicContact CH2-CB 4.27Å; W154-L172 HydrophobicContact CH2-CD1 4.04Å; W154-L172 HydrophobicContact CZ2-CD1 3.86Å; W154-L172 HydrophobicContact CZ3-CB 3.73Å; W154-L172 HydrophobicContact CZ3-CD1 3.83Å; W154-L172 HydrophobicContact CZ3-CG 4.35Å
155N94.6Very high94.6Very high47 Ų4746 Ų4625%0.25123%0.226SC..G310 helixtrans-80.30.4177.975.2-26.6000114.1D152 G153 K160 K169D152-N155 PolarHBondContact O-OD1 3.49Å; D152-N155 VanDerWaalsContact O-OD1 3.05Å; G153-N155 PolarHBondContact O-N 3.02Å; N155-K160 WeakPolarHBondContact O-CD 3.37Å; N155-K160 WeakPolarHBondContact O-CE 3.34Å; N155-K160 PolarHBondContact O-NZ 3.05Å; N155-K169 HydrophobicContact CB-CG 4.02Å; N155-K169 WeakPolarHBondContact ND2-CE 3.34Å
156A94.2Very high94.2Very high10 Ų1054.1 Ų54.18%0.08325%0.253CS..SBendtrans-63.7150177.100000112.2P92 G153 W154 E158 V159 K160P92-A156 HydrophobicContact CB-CB 4.18Å; G153-A156 WeakPolarHBondContact O-CB 3.34Å; G153-A156 PolarHBondContact O-N 3.11Å; W154-A156 PolarHBondContact O-N 3.07Å; A156-E158 VanDerWaalsContact C-N 3.28Å; A156-E158 PolarHBondContact O-N 3.37Å; A156-V159 HydrophobicContact CB-CG2 4.26Å; A156-V159 PolarHBondContact O-N 3.41Å; A156-V159 VanDerWaalsContact O-N 3.12Å; A156-K160 PolarHBondContact O-N 3.32Å
157D93.5Very high93.9Very high126 Ų12654.2 Ų54.267%0.67425%0.253SS*.Hα-helixtrans-64.1-35.1-174.6-67.7-33.3000112.1K160 R161D157-K160 PolarHBondContact O-N 2.99Å; D157-R161 VanDerWaalsContact O-CB 3.22Å; D157-R161 WeakPolarHBondContact O-CB 3.27Å; D157-R161 PolarHBondContact O-N 3.17Å
158E92.3Very high93.7Very high64 Ų6458.1 Ų58.130%0.29927%0.274SS..Hα-helixtrans-62.8-42.2175.4-65.579.3-179.500111.5F64 Y69 I71 P92 A156 M162F64-E158 HydrophobicContact CE1-CB 4.07Å; F64-E158 HydrophobicContact CZ-CB 4.42Å; Y69-E158 HydrophobicContact CE2-CG 4.38Å; I71-E158 HydrophobicContact CD1-CB 4.2Å; P92-E158 HydrophobicContact CB-CB 4.08Å; P92-E158 HydrophobicContact CB-CG 3.91Å; P92-E158 WeakPolarHBondContact CB-OE2 3.24Å; A156-E158 VanDerWaalsContact C-N 3.28Å; A156-E158 PolarHBondContact O-N 3.37Å; E158-M162 PolarHBondContact O-N 3.47Å
159V93.4Very high93.5Very high0 Ų057.1 Ų57.10%027%0.266CS..Hα-helixtrans-70.9-45.8178.1-176.50000109.6I52 F64 F96 W154 A156 R161 M162 C163 T167I52-V159 HydrophobicContact CD1-CG1 4.07Å; F64-V159 HydrophobicContact CD1-CG2 4.16Å; F64-V159 HydrophobicContact CE1-CG2 3.92Å; F64-V159 HydrophobicContact CE2-CG2 4.38Å; F64-V159 HydrophobicContact CZ-CB 4.47Å; F64-V159 HydrophobicContact CZ-CG2 4.05Å; F96-V159 HydrophobicContact CE2-CG2 3.99Å; F96-V159 HydrophobicContact CZ-CG2 4.08Å; W154-V159 WeakPolarHBondContact O-CB 3.47Å; W154-V159 WeakPolarHBondContact O-CG1 3.42Å; A156-V159 HydrophobicContact CB-CG2 4.26Å; A156-V159 PolarHBondContact O-N 3.41Å; A156-V159 VanDerWaalsContact O-N 3.12Å; V159-R161 VanDerWaalsContact C-N 3.31Å; V159-R161 PolarHBondContact O-N 3.3Å; V159-M162 PolarHBondContact O-N 3.32Å; V159-M162 VanDerWaalsContact O-N 3.11Å; V159-C163 HydrophobicContact CG1-CB 4.32Å; V159-C163 VanDerWaalsContact O-CB 3.25Å; V159-C163 WeakPolarHBondContact O-CB 3.44Å; V159-C163 PolarHBondContact O-N 2.85Å; V159-C163 PolarHBondContact O-SG 3.44Å; V159-C163 VanDerWaalsContact O-SG 3.35Å; V159-T167 HydrophobicContact CG1-CG2 4.16Å
160K93.6Very high93.3Very high46 Ų4661.8 Ų61.820%0.228%0.282CS..Hα-helixtrans-61-36.9176-76.9172.7173.2160.90113.2N155 A156 D157 M162 G164 T167N155-K160 WeakPolarHBondContact O-CD 3.37Å; N155-K160 WeakPolarHBondContact O-CE 3.34Å; N155-K160 PolarHBondContact O-NZ 3.05Å; A156-K160 PolarHBondContact O-N 3.32Å; D157-K160 PolarHBondContact O-N 2.99Å; K160-M162 PolarHBondContact O-N 2.82Å; K160-G164 CarbonylContact O-C 3.49Å; K160-G164 WeakPolarHBondContact O-CA 3.47Å; K160-G164 PolarHBondContact O-N 3.3Å; K160-T167 WeakPolarHBondContact CE-O 3.44Å
161R90.6Very high93.2Very high178 Ų17864 Ų6467%0.67230%0.301SS*.Hα-helixtrans-60.1-35.6175.9180176.9175.9160.20.7111.5Q60 D157 V159Q60-R161 PolarHBondContact NE2-O 3.02Å; D157-R161 VanDerWaalsContact O-CB 3.22Å; D157-R161 WeakPolarHBondContact O-CB 3.27Å; D157-R161 PolarHBondContact O-N 3.17Å; V159-R161 VanDerWaalsContact C-N 3.31Å; V159-R161 PolarHBondContact O-N 3.3Å
162M90.4Very high92.7Very high0 Ų065.6 Ų65.60%031%0.308CS..Hα-helixtrans-89.7-48.5-179.1-171.8-174.2159.900112.9D54 Q60 G62 F64 E158 V159 K160D54-M162 HydrophobicContact CB-CE 3.37Å; Q60-M162 HydrophobicContact CG-CG 4.16Å; G62-M162 VanDerWaalsContact C-CE 3.43Å; G62-M162 VanDerWaalsContact CA-CE 3.42Å; G62-M162 VanDerWaalsContact O-CE 3.31Å; G62-M162 WeakPolarHBondContact O-CE 3.47Å; F64-M162 HydrophobicContact CD2-SD 4.23Å; F64-M162 HydrophobicContact CE2-CB 4.23Å; F64-M162 HydrophobicContact CE2-CG 4.5Å; F64-M162 HydrophobicContact CE2-SD 3.44Å; F64-M162 WeakPolarHBondContact CE2-SD 3.45Å; F64-M162 HydrophobicContact CZ-CB 4.43Å; F64-M162 HydrophobicContact CZ-SD 4.23Å; E158-M162 PolarHBondContact O-N 3.47Å; V159-M162 PolarHBondContact O-N 3.32Å; V159-M162 VanDerWaalsContact O-N 3.11Å; K160-M162 PolarHBondContact O-N 2.82Å
163C92Very high92.5Very high1 Ų164.6 Ų64.61%0.00731%0.311CS..Hα-helixtrans-88.8-5.8-172.4-53.50000113.5V159 T167 N174 C175V159-C163 HydrophobicContact CG1-CB 4.32Å; V159-C163 VanDerWaalsContact O-CB 3.25Å; V159-C163 WeakPolarHBondContact O-CB 3.44Å; V159-C163 PolarHBondContact O-N 2.85Å; V159-C163 PolarHBondContact O-SG 3.44Å; V159-C163 VanDerWaalsContact O-SG 3.35Å; C163-T167 HydrophobicContact CB-CG2 4.33Å; C163-T167 VanDerWaalsContact CB-OG1 3.3Å; C163-T167 WeakPolarHBondContact CB-OG1 3.36Å; C163-T167 PolarHBondContact O-OG1 3.29Å; C163-N174 WeakPolarHBondContact O-CB 3.25Å; C163-N174 PolarHBondContact O-N 3Å; C163-C175 WeakPolarHBondContact CA-SG 3.3Å; C163-C175 HydrophobicContact CB-CB 3.67Å; C163-C175 WeakPolarHBondContact CB-SG 3.25Å; C163-C175 WeakPolarHBondContact SG-CB 3.35Å; C163-C175 CovalentContact SG-SG 2.02Å; C163-C175 PolarHBondContact SG-SG 3.07Å
164G91.9Very high92.4Very high25 Ų2568.3 Ų68.326%0.25833%0.33SS..  trans96.5157.4-179.800000113.4K160 R166 T167K160-G164 CarbonylContact O-C 3.49Å; K160-G164 WeakPolarHBondContact O-CA 3.47Å; K160-G164 PolarHBondContact O-N 3.3Å; G164-R166 PolarHBondContact O-N 2.9Å; G164-T167 VanDerWaalsContact O-CB 3.29Å; G164-T167 WeakPolarHBondContact O-CB 3.46Å; G164-T167 PolarHBondContact O-N 2.82Å; G164-T167 VanDerWaalsContact O-N 3.07Å; G164-T167 PolarHBondContact O-OG1 3.45Å
165Q91.4Very high92.4Very high154 Ų15467.8 Ų67.872%0.7233%0.33SS*.THydrogen-bonded Turntrans-68-15.5-174.3-64.7-59.1-41.200114.5T167Q165-T167 PolarHBondContact O-N 3.35Å
166R89.1Confident92.4Very high237 Ų23768.9 Ų68.989%0.89434%0.338SS*.THydrogen-bonded Turntrans-78.3-3.3173.6-63.7-176.7-175.8165.81.1113.2G164G164-R166 PolarHBondContact O-N 2.9Å
167T92.1Very high92.5Very high2 Ų271.4 Ų71.41%0.01235%0.352CS..  trans-71.2129.2177.8-51.10000109.9W154 V159 K160 C163 G164 Q165 A171W154-T167 HydrophobicContact CB-CG2 4.23Å; W154-T167 VanDerWaalsContact O-CG2 3.24Å; W154-T167 WeakPolarHBondContact O-CG2 3.48Å; V159-T167 HydrophobicContact CG1-CG2 4.16Å; K160-T167 WeakPolarHBondContact CE-O 3.44Å; C163-T167 HydrophobicContact CB-CG2 4.33Å; C163-T167 VanDerWaalsContact CB-OG1 3.3Å; C163-T167 WeakPolarHBondContact CB-OG1 3.36Å; C163-T167 PolarHBondContact O-OG1 3.29Å; G164-T167 VanDerWaalsContact O-CB 3.29Å; G164-T167 WeakPolarHBondContact O-CB 3.46Å; G164-T167 PolarHBondContact O-N 2.82Å; G164-T167 VanDerWaalsContact O-N 3.07Å; G164-T167 PolarHBondContact O-OG1 3.45Å; Q165-T167 PolarHBondContact O-N 3.35Å; T167-A171 WeakPolarHBondContact CA-O 3.39Å; T167-A171 WeakPolarHBondContact CG2-O 3.24Å
168D93.6Very high92.6Very high89 Ų8967.9 Ų67.948%0.47633%0.33SS..BIsolated β-bridgetrans-140.6179.1176-156.7-2.1000110.1Y170 A171D168-Y170 PolarHBondContact O-N 3.29Å; D168-A171 HydrophobicContact CB-CB 4.36Å; D168-A171 PolarHBondContact N-O 2.94Å; D168-A171 VanDerWaalsContact N-O 3.08Å; D168-A171 CarbonylContact O-C 2.96Å; D168-A171 PolarHBondContact O-N 3.16Å; D168-A171 VanDerWaalsContact O-O 3.1Å
169K93.1Very high92.8Very high108 Ų10870.1 Ų70.147%0.4734%0.335SS..THydrogen-bonded Turntrans-53.9129176.6-59.2-175.1176.9-173.40110.3N155 A171N155-K169 HydrophobicContact CB-CG 4.02Å; N155-K169 WeakPolarHBondContact ND2-CE 3.34Å; K169-A171 PolarHBondContact O-N 3.08Å
170Y93.1Very high93Very high137 Ų13770.1 Ų70.154%0.53734%0.335SS..THydrogen-bonded Turntrans59.24.8-174.9-62.7-96.4000116.1M148 P151 D152 D168M148-Y170 PolarHBondContact O-OH 2.85Å; P151-Y170 HydrophobicContact CB-CD1 3.52Å; P151-Y170 HydrophobicContact CB-CD2 4.17Å; P151-Y170 HydrophobicContact CB-CE1 3.68Å; P151-Y170 HydrophobicContact CB-CE2 4.3Å; P151-Y170 HydrophobicContact CB-CG 3.79Å; P151-Y170 HydrophobicContact CG-CD1 4.04Å; P151-Y170 HydrophobicContact CG-CE1 3.94Å; P151-Y170 PolarHBondContact O-N 2.95Å; D152-Y170 WeakPolarHBondContact OD1-CE2 3.48Å; D168-Y170 PolarHBondContact O-N 3.29Å
171A94.2Very high93.2Very high47 Ų4769.2 Ų69.239%0.38833%0.331SS..BIsolated β-bridgetrans-119.987.6177.700000109.6T167 D168 K169 G173T167-A171 WeakPolarHBondContact CA-O 3.39Å; T167-A171 WeakPolarHBondContact CG2-O 3.24Å; D168-A171 HydrophobicContact CB-CB 4.36Å; D168-A171 PolarHBondContact N-O 2.94Å; D168-A171 VanDerWaalsContact N-O 3.08Å; D168-A171 CarbonylContact O-C 2.96Å; D168-A171 PolarHBondContact O-N 3.16Å; D168-A171 VanDerWaalsContact O-O 3.1Å; K169-A171 PolarHBondContact O-N 3.08Å; A171-G173 PolarHBondContact O-N 3.23Å
172L87.4Confident93.5Very high36 Ų3664.9 Ų64.919%0.18832%0.32CS..  trans-72.6110174.2-143.576.8000107.7I52 W154 C175 V177I52-L172 HydrophobicContact CB-CD1 4.46Å; I52-L172 HydrophobicContact CB-CD2 4.27Å; I52-L172 HydrophobicContact CD1-CD1 4.11Å; I52-L172 HydrophobicContact CG2-CD1 3.95Å; I52-L172 HydrophobicContact CG2-CD2 3.87Å; W154-L172 HydrophobicContact CB-CD1 4.33Å; W154-L172 HydrophobicContact CD2-CD1 3.21Å; W154-L172 HydrophobicContact CD2-CG 4.46Å; W154-L172 VanDerWaalsContact CE2-CD1 3.44Å; W154-L172 HydrophobicContact CE3-CB 3.89Å; W154-L172 HydrophobicContact CE3-CD1 3.42Å; W154-L172 VanDerWaalsContact CE3-CD1 3.42Å; W154-L172 HydrophobicContact CE3-CG 4.27Å; W154-L172 HydrophobicContact CG-CD1 3.65Å; W154-L172 HydrophobicContact CH2-CB 4.27Å; W154-L172 HydrophobicContact CH2-CD1 4.04Å; W154-L172 HydrophobicContact CZ2-CD1 3.86Å; W154-L172 HydrophobicContact CZ3-CB 3.73Å; W154-L172 HydrophobicContact CZ3-CD1 3.83Å; W154-L172 HydrophobicContact CZ3-CG 4.35Å; L172-C175 HydrophobicContact CD2-CB 3.96Å; L172-C175 WeakPolarHBondContact CD2-O 2.96Å; L172-C175 HydrophobicContact CG-CB 3.97Å; L172-V177 HydrophobicContact CD2-CG2 4.23Å
173G91.4Very high93.8Very high32 Ų3267.6 Ų67.633%0.3333%0.334SS..  trans-64.4-101.2-173.700000113.2A171A171-G173 PolarHBondContact O-N 3.23Å
174N93.3Very high94.1Very high77 Ų7767.5 Ų67.541%0.41233%0.334SS..SBendtrans-87.3-8.7178.4-67.1-6.1000113S55 N57 T58 C163S55-N174 WeakPolarHBondContact CB-O 3.26Å; S55-N174 PolarHBondContact OG-O 3.08Å; N57-N174 HydrophobicContact CB-CB 4.15Å; N57-N174 PolarHBondContact O-ND2 3.05Å; T58-N174 HydrophobicContact CG2-CB 3.91Å; T58-N174 WeakPolarHBondContact CG2-O 3.2Å; C163-N174 WeakPolarHBondContact O-CB 3.25Å; C163-N174 PolarHBondContact O-N 3Å
175C94.4Very high94.4Very high8 Ų870.5 Ų70.55%0.05434%0.343CS..  trans-80.5164.8177.8-74.80000112.3G53 C163 L172G53-C175 WeakPolarHBondContact O-CA 2.99Å; G53-C175 VanDerWaalsContact O-CB 3.24Å; G53-C175 WeakPolarHBondContact O-CB 3.3Å; C163-C175 WeakPolarHBondContact CA-SG 3.3Å; C163-C175 HydrophobicContact CB-CB 3.67Å; C163-C175 WeakPolarHBondContact CB-SG 3.25Å; C163-C175 WeakPolarHBondContact SG-CB 3.35Å; C163-C175 CovalentContact SG-SG 2.02Å; C163-C175 PolarHBondContact SG-SG 3.07Å; L172-C175 HydrophobicContact CD2-CB 3.96Å; L172-C175 WeakPolarHBondContact CD2-O 2.96Å; L172-C175 HydrophobicContact CG-CB 3.97Å
176T95.1Very high94.6Very high69 Ų6967.9 Ų67.942%0.42333%0.333SS..EExtended strand (participates in β ladder)trans-123.4149.6176.151.80000111.7I52 G53 D54I52-T176 WeakPolarHBondContact CA-O 3.34Å; G53-T176 PolarHBondContact N-O 3.15Å; G53-T176 PolarHBondContact O-N 2.77Å; D54-T176 PolarHBondContact O-OG1 3.29Å
177V96.2Very high95Very high63 Ų6356.8 Ų56.838%0.38229%0.292SS..EExtended strand (participates in β ladder)trans-63.3139.4167.9172.70000109.6L172 Y181 I182L172-V177 HydrophobicContact CD2-CG2 4.23Å; V177-Y181 HydrophobicContact CG1-CD1 3.58Å; V177-Y181 HydrophobicContact CG1-CG 4.19Å; V177-Y181 HydrophobicContact CG2-CD1 4.35Å; V177-I182 HydrophobicContact CG1-CG1 4.16Å
178R96.6Very high95.3Very high53 Ų5358.9 Ų58.920%0.230%0.302CS..  trans-110.3170.2178.3-73.6-168176.4-165.73.4111.7Y50 W51 D54 G62 A180 Y181Y50-R178 CarbonylContact O-C 3.57Å; Y50-R178 WeakPolarHBondContact O-CB 3.35Å; W51-R178 PolarHBondContact O-N 2.56Å; D54-R178 VanDerWaalsContact CG-NH2 3.25Å; D54-R178 PolarHBondContact O-NH2 3.23Å; D54-R178 IonicContact OD1-CZ 2.58Å; D54-R178 IonicContact OD1-NH2 3.49Å; D54-R178 PolarHBondContact OD1-NH2 2.91Å; D54-R178 IonicContact OD2-NH2 3.8Å; G62-R178 PolarHBondContact O-NH2 3.5Å; R178-A180 VanDerWaalsContact C-N 3.28Å; R178-A180 PolarHBondContact O-N 3.01Å; R178-Y181 PolarHBondContact O-N 3.41Å
179W96.8Very high95.4Very high110 Ų11060 Ų6042%0.41731%0.308SS..Hα-helixtrans-58.3-31.7-169.362.1-95.1000114.4V44 Q48 Y50 Y181 I182 L183V44-W179 HydrophobicContact CG1-CH2 3.68Å; V44-W179 HydrophobicContact CG1-CZ3 3.78Å; Q48-W179 HydrophobicContact CB-CH2 3.84Å; Q48-W179 HydrophobicContact CB-CZ2 4.08Å; Q48-W179 HydrophobicContact CG-CH2 3.78Å; Q48-W179 HydrophobicContact CG-CZ2 4.2Å; Y50-W179 AromaticContact CD2-CZ2 3.71Å; Y50-W179 HydrophobicContact CD2-CZ2 3.71Å; Y50-W179 AromaticContact CD2-NE1 3.84Å; Y50-W179 HydrophobicContact CG-CZ2 4.33Å; Y50-W179 AromaticContact CG-NE1 3.71Å; W179-Y181 VanDerWaalsContact C-N 3.33Å; W179-Y181 PolarHBondContact O-N 2.63Å; W179-I182 PolarHBondContact O-N 2.87Å; W179-L183 HydrophobicContact CE3-CD1 3.55Å; W179-L183 HydrophobicContact CE3-CG 4.31Å; W179-L183 HydrophobicContact CZ3-CD1 3.65Å; W179-L183 WeakPolarHBondContact O-CG 3.19Å; W179-L183 PolarHBondContact O-N 3.34Å
180A97.1Very high95.6Very high0 Ų057.4 Ų57.40%030%0.299CS..Hα-helixtrans-67.4-36.4-177.600000111.5Y50 W51 R178 L183 A184Y50-A180 WeakPolarHBondContact O-CB 3.23Å; Y50-A180 PolarHBondContact O-N 2.02Å; Y50-A180 VanDerWaalsContact O-N 3.09Å; W51-A180 HydrophobicContact CG-CB 4.45Å; R178-A180 VanDerWaalsContact C-N 3.28Å; R178-A180 PolarHBondContact O-N 3.01Å; A180-L183 PolarHBondContact O-N 2.75Å; A180-A184 WeakPolarHBondContact O-CB 3.38Å; A180-A184 PolarHBondContact O-N 3.13Å
181Y97.3Very high95.8Very high27 Ų2751 Ų5111%0.10627%0.274CS..Hα-helixtrans-69-35.6175.2-170-117.7000112W51 C147 Y150 P151 V177 R178 W179 A184 I185W51-Y181 HydrophobicContact CD2-CD2 4.17Å; W51-Y181 AromaticContact CE3-CD2 3.3Å; W51-Y181 HydrophobicContact CE3-CD2 3.3Å; W51-Y181 AromaticContact CE3-CE2 3.95Å; W51-Y181 HydrophobicContact CE3-CE2 3.95Å; W51-Y181 HydrophobicContact CE3-CG 4.25Å; W51-Y181 HydrophobicContact CH2-CD2 4.29Å; W51-Y181 AromaticContact CZ3-CD2 3.39Å; W51-Y181 HydrophobicContact CZ3-CD2 3.39Å; W51-Y181 AromaticContact CZ3-CE2 3.74Å; W51-Y181 HydrophobicContact CZ3-CE2 3.74Å; C147-Y181 HydrophobicContact CB-CE2 4.17Å; C147-Y181 PolarHBondContact O-OH 3.35Å; Y150-Y181 HydrophobicContact CD1-CD2 4.39Å; Y150-Y181 HydrophobicContact CD1-CE2 4.15Å; P151-Y181 WeakPolarHBondContact CG-OH 3.24Å; V177-Y181 HydrophobicContact CG1-CD1 3.58Å; V177-Y181 HydrophobicContact CG1-CG 4.19Å; V177-Y181 HydrophobicContact CG2-CD1 4.35Å; R178-Y181 PolarHBondContact O-N 3.41Å; W179-Y181 VanDerWaalsContact C-N 3.33Å; W179-Y181 PolarHBondContact O-N 2.63Å; Y181-A184 WeakPolarHBondContact O-CB 3.29Å; Y181-A184 PolarHBondContact O-N 3.01Å; Y181-I185 HydrophobicContact CD1-CD1 4.12Å; Y181-I185 HydrophobicContact CE1-CD1 3.92Å; Y181-I185 WeakPolarHBondContact O-CG1 3.45Å; Y181-I185 PolarHBondContact O-N 3.43Å; Y181-I185 VanDerWaalsContact O-N 3.1Å
182I97.3Very high95.9Very high87 Ų8751.1 Ų51.145%0.44627%0.27SS..Hα-helixtrans-65.1-45.1175.1-57.5172.7000110.2V177 W179 A184 I185 I186V177-I182 HydrophobicContact CG1-CG1 4.16Å; W179-I182 PolarHBondContact O-N 2.87Å; I182-A184 VanDerWaalsContact C-N 3.29Å; I182-A184 PolarHBondContact O-N 3.38Å; I182-I185 PolarHBondContact O-N 3.01Å; I182-I186 HydrophobicContact CG2-CD1 3.96Å; I182-I186 WeakPolarHBondContact O-CG1 3.43Å; I182-I186 PolarHBondContact O-N 3.37Å
183L97.3Very high96.4Very high57 Ų5753.5 Ų53.530%0.29828%0.282SS..Hα-helixtrans-62.3-36.1174-70.2-177.8000112.1V45 W179 A180 I185 I186 S187V45-L183 HydrophobicContact CG2-CB 3.59Å; V45-L183 HydrophobicContact CG2-CD1 4.49Å; W179-L183 HydrophobicContact CE3-CD1 3.55Å; W179-L183 HydrophobicContact CE3-CG 4.31Å; W179-L183 HydrophobicContact CZ3-CD1 3.65Å; W179-L183 WeakPolarHBondContact O-CG 3.19Å; W179-L183 PolarHBondContact O-N 3.34Å; A180-L183 PolarHBondContact O-N 2.75Å; L183-I185 VanDerWaalsContact C-N 3.33Å; L183-I185 PolarHBondContact O-N 3.23Å; L183-I186 PolarHBondContact O-N 3.02Å; L183-S187 VanDerWaalsContact O-CB 3.25Å; L183-S187 WeakPolarHBondContact O-CB 3.23Å; L183-S187 PolarHBondContact O-N 3.18Å; L183-S187 PolarHBondContact O-OG 2.9Å
184A97.8Very high96.6Very high0 Ų052.1 Ų52.10%027%0.267CS..Hα-helixtrans-59.5-44.1174.200000111.1V45 W51 M143 A180 Y181 I182 S187 I188V45-A184 HydrophobicContact CG1-CB 3.67Å; W51-A184 HydrophobicContact CH2-CB 3.9Å; W51-A184 HydrophobicContact CZ2-CB 4.08Å; M143-A184 HydrophobicContact SD-CB 4.02Å; A180-A184 WeakPolarHBondContact O-CB 3.38Å; A180-A184 PolarHBondContact O-N 3.13Å; Y181-A184 WeakPolarHBondContact O-CB 3.29Å; Y181-A184 PolarHBondContact O-N 3.01Å; I182-A184 VanDerWaalsContact C-N 3.29Å; I182-A184 PolarHBondContact O-N 3.38Å; A184-S187 PolarHBondContact O-N 2.76Å; A184-S187 PolarHBondContact O-OG 3.37Å; A184-I188 PolarHBondContact O-N 2.86Å
185I97.1Very high96.7Very high87 Ų8748.4 Ų48.445%0.44625%0.248SC..Hα-helixtrans-66.5-45.7177.9-65.3167.3000111.4Y181 I182 L183 S187 I188Y181-I185 HydrophobicContact CD1-CD1 4.12Å; Y181-I185 HydrophobicContact CE1-CD1 3.92Å; Y181-I185 WeakPolarHBondContact O-CG1 3.45Å; Y181-I185 PolarHBondContact O-N 3.43Å; Y181-I185 VanDerWaalsContact O-N 3.1Å; I182-I185 PolarHBondContact O-N 3.01Å; L183-I185 VanDerWaalsContact C-N 3.33Å; L183-I185 PolarHBondContact O-N 3.23Å; I185-S187 PolarHBondContact O-N 2.89Å; I185-I188 WeakPolarHBondContact O-CB 3.37Å; I185-I188 PolarHBondContact O-N 3.33Å
186I97.1Very high96.8Very high99 Ų9952.8 Ų52.851%0.50827%0.27SS..Hα-helixtrans-61.1-36.7177.5-65.7168.1000110.6I182 L183 I188 L189 D190I182-I186 HydrophobicContact CG2-CD1 3.96Å; I182-I186 WeakPolarHBondContact O-CG1 3.43Å; I182-I186 PolarHBondContact O-N 3.37Å; L183-I186 PolarHBondContact O-N 3.02Å; I186-I188 PolarHBondContact O-N 3.3Å; I186-L189 PolarHBondContact O-N 2.94Å; I186-L189 VanDerWaalsContact O-N 3.15Å; I186-D190 PolarHBondContact O-N 3.25Å; I186-D190 VanDerWaalsContact O-N 3.14Å
187S96.6Very high96.7Very high4 Ų452.7 Ų52.73%0.02827%0.267CS..Hα-helixtrans-63.7-25.3-178.573.20000113.7F38 L183 A184 I185 A191F38-S187 WeakPolarHBondContact CE2-O 3.47Å; F38-S187 VanDerWaalsContact CZ-O 3.3Å; F38-S187 WeakPolarHBondContact CZ-O 3.15Å; L183-S187 VanDerWaalsContact O-CB 3.25Å; L183-S187 WeakPolarHBondContact O-CB 3.23Å; L183-S187 PolarHBondContact O-N 3.18Å; L183-S187 PolarHBondContact O-OG 2.9Å; A184-S187 PolarHBondContact O-N 2.76Å; A184-S187 PolarHBondContact O-OG 3.37Å; I185-S187 PolarHBondContact O-N 2.89Å; S187-A191 VanDerWaalsContact O-CB 3.3Å; S187-A191 WeakPolarHBondContact O-CB 3.46Å; S187-A191 PolarHBondContact O-N 3.44Å
188I98.1Very high96.6Very high46 Ų4649.7 Ų49.724%0.23625%0.248CC..Hα-helixtrans-64.5-47.2174.7-60.3163.7000110.5A140 M143 A184 I185 I186 V192A140-I188 HydrophobicContact CB-CG2 4.44Å; M143-I188 HydrophobicContact CB-CG1 3.99Å; M143-I188 HydrophobicContact CG-CD1 4.35Å; M143-I188 HydrophobicContact CG-CG1 3.66Å; A184-I188 PolarHBondContact O-N 2.86Å; I185-I188 WeakPolarHBondContact O-CB 3.37Å; I185-I188 PolarHBondContact O-N 3.33Å; I186-I188 PolarHBondContact O-N 3.3Å; I188-V192 WeakPolarHBondContact O-CG2 3.1Å; I188-V192 PolarHBondContact O-N 3.38Å
189L96.8Very high96.5Very high113 Ų11349.2 Ų49.259%0.59225%0.248SC*.Hα-helixtrans-66.3-43.2179.2179.662.5000110.7I186 A191 V192 L193I186-L189 PolarHBondContact O-N 2.94Å; I186-L189 VanDerWaalsContact O-N 3.15Å; L189-A191 PolarHBondContact O-N 2.83Å; L189-V192 PolarHBondContact O-N 2.92Å; L189-L193 HydrophobicContact CD1-CG 4.43Å; L189-L193 HydrophobicContact CG-CD1 4.21Å; L189-L193 HydrophobicContact CG-CG 4.48Å; L189-L193 WeakPolarHBondContact O-CG 3.26Å; L189-L193 PolarHBondContact O-N 3.33Å
190D96.1Very high96.3Very high54 Ų5447 Ų4729%0.28925%0.247SC..Hα-helixtrans-61.6-43.3179.2-16452.6000111.7F38 I186 V192 L193 L194F38-D190 HydrophobicContact CD2-CB 4.15Å; F38-D190 WeakPolarHBondContact CD2-OD2 3.42Å; F38-D190 HydrophobicContact CE2-CB 3.92Å; I186-D190 PolarHBondContact O-N 3.25Å; I186-D190 VanDerWaalsContact O-N 3.14Å; D190-V192 VanDerWaalsContact C-N 3.32Å; D190-V192 PolarHBondContact O-N 3.22Å; D190-L193 PolarHBondContact O-N 3.46Å; D190-L194 WeakPolarHBondContact O-CB 3.4Å; D190-L194 WeakPolarHBondContact O-CG 3.29Å; D190-L194 PolarHBondContact O-N 3.15Å
191A97.2Very high95.9Very high1 Ų147 Ų471%0.00825%0.247CC..Hα-helixtrans-59-40.9174.300000112.7F38 A140 S187 L189 A195F38-A191 HydrophobicContact CE1-CB 3.92Å; F38-A191 HydrophobicContact CZ-CB 3.71Å; A140-A191 HydrophobicContact CB-CB 3.72Å; S187-A191 VanDerWaalsContact O-CB 3.3Å; S187-A191 WeakPolarHBondContact O-CB 3.46Å; S187-A191 PolarHBondContact O-N 3.44Å; L189-A191 PolarHBondContact O-N 2.83Å; A191-A195 VanDerWaalsContact O-CB 3.3Å; A191-A195 WeakPolarHBondContact O-CB 3.41Å; A191-A195 PolarHBondContact O-N 3.46Å
192V97.6Very high95.6Very high51 Ų5145.8 Ų45.831%0.30924%0.242SC..Hα-helixtrans-66.1-43.8176.2172.50000111A140 I188 L189 D190 A195 L196A140-V192 HydrophobicContact CB-CG2 3.94Å; I188-V192 WeakPolarHBondContact O-CG2 3.1Å; I188-V192 PolarHBondContact O-N 3.38Å; L189-V192 PolarHBondContact O-N 2.92Å; D190-V192 VanDerWaalsContact C-N 3.32Å; D190-V192 PolarHBondContact O-N 3.22Å; V192-A195 PolarHBondContact O-N 3.16Å; V192-L196 HydrophobicContact CG1-CD1 4.22Å; V192-L196 HydrophobicContact CG1-CG 4.5Å; V192-L196 WeakPolarHBondContact O-CG 3.27Å; V192-L196 PolarHBondContact O-N 3.11Å
193L96.5Very high95.1Very high85 Ų8545.4 Ų45.445%0.44524%0.241SC..Hα-helixtrans-63.4-44.9178.7-69.1176.1000111.8L189 D190 A195 L196 L197L189-L193 HydrophobicContact CD1-CG 4.43Å; L189-L193 HydrophobicContact CG-CD1 4.21Å; L189-L193 HydrophobicContact CG-CG 4.48Å; L189-L193 WeakPolarHBondContact O-CG 3.26Å; L189-L193 PolarHBondContact O-N 3.33Å; D190-L193 PolarHBondContact O-N 3.46Å; L193-A195 VanDerWaalsContact C-N 3.31Å; L193-A195 PolarHBondContact O-N 3.18Å; L193-L196 PolarHBondContact O-N 3.23Å; L193-L197 WeakPolarHBondContact O-CG 3.45Å; L193-L197 PolarHBondContact O-N 3.27Å
194L96Very high94.6Very high3 Ų347.1 Ų47.12%0.01624%0.243CC..Hα-helixtrans-63.9-37.1175.8-68174.7000111.7W31 F34 F38 Q136 D190 L197 S198W31-L194 PolarHBondContact NE1-O 2.96Å; F34-L194 HydrophobicContact CB-CD2 3.68Å; F38-L194 HydrophobicContact CB-CD1 3.88Å; F38-L194 HydrophobicContact CD1-CD1 3.93Å; F38-L194 HydrophobicContact CG-CD1 3.92Å; Q136-L194 PolarHBondContact OE1-O 3.33Å; D190-L194 WeakPolarHBondContact O-CB 3.4Å; D190-L194 WeakPolarHBondContact O-CG 3.29Å; D190-L194 PolarHBondContact O-N 3.15Å; L194-L197 HydrophobicContact CD2-CD1 4.5Å; L194-L197 PolarHBondContact O-N 2.88Å; L194-S198 WeakPolarHBondContact O-CB 3.31Å; L194-S198 PolarHBondContact O-N 2.95Å
195A96.7Very high93.9Very high0 Ų049.4 Ų49.40%025%0.254CS..Hα-helixtrans-65.4-43.8176.300000111.9A133 Q136 L137 A191 V192 L193 S198 F199A133-A195 WeakPolarHBondContact CB-O 3.44Å; A133-A195 WeakPolarHBondContact O-CB 3.08Å; Q136-A195 HydrophobicContact CB-CB 3.86Å; L137-A195 HydrophobicContact CD2-CB 3.61Å; L137-A195 HydrophobicContact CG-CB 3.68Å; A191-A195 VanDerWaalsContact O-CB 3.3Å; A191-A195 WeakPolarHBondContact O-CB 3.41Å; A191-A195 PolarHBondContact O-N 3.46Å; V192-A195 PolarHBondContact O-N 3.16Å; L193-A195 VanDerWaalsContact C-N 3.31Å; L193-A195 PolarHBondContact O-N 3.18Å; A195-S198 PolarHBondContact O-N 3.42Å; A195-F199 VanDerWaalsContact O-CD2 3.3Å; A195-F199 WeakPolarHBondContact O-CD2 3.46Å; A195-F199 PolarHBondContact O-N 2.91Å
196L95.7Very high93.2Very high99 Ų9947.7 Ų47.752%0.51825%0.245SC..Hα-helixtrans-61.2-45.7175.6-69.9173.8000111.1V192 L193 S198 F199 T200V192-L196 HydrophobicContact CG1-CD1 4.22Å; V192-L196 HydrophobicContact CG1-CG 4.5Å; V192-L196 WeakPolarHBondContact O-CG 3.27Å; V192-L196 PolarHBondContact O-N 3.11Å; L193-L196 PolarHBondContact O-N 3.23Å; L196-S198 VanDerWaalsContact C-N 3.3Å; L196-S198 PolarHBondContact O-N 3.34Å; L196-F199 PolarHBondContact O-N 2.93Å; L196-T200 WeakPolarHBondContact O-CG2 3.42Å; L196-T200 PolarHBondContact O-N 2.91Å
197L94Very high92.2Very high68 Ų6849.3 Ų49.336%0.35626%0.255SS..Hα-helixtrans-57.5-45.2174.2-73.6173.4000111.1L193 L194 F199 T200 L201L193-L197 WeakPolarHBondContact O-CG 3.45Å; L193-L197 PolarHBondContact O-N 3.27Å; L194-L197 HydrophobicContact CD2-CD1 4.5Å; L194-L197 PolarHBondContact O-N 2.88Å; L197-F199 PolarHBondContact O-N 3.35Å; L197-T200 PolarHBondContact O-N 3.28Å; L197-T200 PolarHBondContact O-OG1 3.29Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 2.91Å
198S93.6Very high90.9Very high0 Ų050.3 Ų50.30%026%0.26CS..Hα-helixtrans-63.2-42.2178-1610000112.4Y129 L194 A195 L196 T200 L201 G202Y129-S198 PolarHBondContact O-OG 3.12Å; L194-S198 WeakPolarHBondContact O-CB 3.31Å; L194-S198 PolarHBondContact O-N 2.95Å; A195-S198 PolarHBondContact O-N 3.42Å; L196-S198 VanDerWaalsContact C-N 3.3Å; L196-S198 PolarHBondContact O-N 3.34Å; S198-T200 PolarHBondContact O-N 3.26Å; S198-L201 PolarHBondContact O-N 3.11Å; S198-G202 PolarHBondContact O-N 2.82Å
199F94.4Very high89.1Confident43 Ų4350.9 Ų50.919%0.18926%0.263CS..Hα-helixtrans-61.5-43.9173.2-84.3-59.6000112.3A133 W134 L137 A195 L196 L197 L201 G202 N203A133-F199 HydrophobicContact CB-CB 4.44Å; A133-F199 HydrophobicContact CB-CD1 3.79Å; A133-F199 HydrophobicContact CB-CD2 3.47Å; A133-F199 VanDerWaalsContact CB-CD2 3.47Å; A133-F199 HydrophobicContact CB-CE1 3.77Å; A133-F199 HydrophobicContact CB-CE2 3.43Å; A133-F199 VanDerWaalsContact CB-CE2 3.43Å; A133-F199 HydrophobicContact CB-CG 3.63Å; A133-F199 HydrophobicContact CB-CZ 3.58Å; W134-F199 AromaticContact CD1-CZ 3.96Å; W134-F199 AromaticContact CD2-CZ 3.81Å; W134-F199 HydrophobicContact CD2-CZ 3.81Å; W134-F199 AromaticContact CE2-CZ 3.61Å; W134-F199 HydrophobicContact CE3-CZ 4.4Å; W134-F199 HydrophobicContact CG-CZ 4.03Å; W134-F199 HydrophobicContact CZ2-CE1 4.49Å; W134-F199 HydrophobicContact CZ2-CZ 4.05Å; W134-F199 AromaticContact NE1-CE1 3.72Å; W134-F199 AromaticContact NE1-CZ 3.7Å; L137-F199 HydrophobicContact CD1-CE2 3.7Å; L137-F199 HydrophobicContact CD1-CZ 4.38Å; L137-F199 HydrophobicContact CG-CE2 4.35Å; A195-F199 VanDerWaalsContact O-CD2 3.3Å; A195-F199 WeakPolarHBondContact O-CD2 3.46Å; A195-F199 PolarHBondContact O-N 2.91Å; L196-F199 PolarHBondContact O-N 2.93Å; L197-F199 PolarHBondContact O-N 3.35Å; F199-L201 VanDerWaalsContact C-N 3.3Å; F199-L201 PolarHBondContact O-N 3.44Å; F199-G202 PolarHBondContact O-N 3.32Å; F199-N203 WeakPolarHBondContact O-CB 3.06Å; F199-N203 VanDerWaalsContact O-CG 3.24Å; F199-N203 PolarHBondContact O-N 3.39Å; F199-N203 PolarHBondContact O-ND2 3.38Å
200T92.4Very high87Confident64 Ų6449.4 Ų49.439%0.39326%0.26SS..Hα-helixtrans-62.6-40.2177.764.80000111.3L196 L197 S198 R204L196-T200 WeakPolarHBondContact O-CG2 3.42Å; L196-T200 PolarHBondContact O-N 2.91Å; L197-T200 PolarHBondContact O-N 3.28Å; L197-T200 PolarHBondContact O-OG1 3.29Å; S198-T200 PolarHBondContact O-N 3.26Å; T200-R204 VanDerWaalsContact O-CB 3.29Å; T200-R204 WeakPolarHBondContact O-CB 3.37Å; T200-R204 WeakPolarHBondContact O-CG 3.38Å; T200-R204 PolarHBondContact O-N 2.76Å
201L89.7Confident84.9Confident0 Ų055.6 Ų55.60%029%0.294CS..Hα-helixtrans-65.1-44.8175.5-75.1171.7000112.2I27 W31 Y129 L197 S198 F199 R204 Q205I27-L201 HydrophobicContact CB-CD2 3.94Å; I27-L201 HydrophobicContact CG2-CD1 4.17Å; I27-L201 HydrophobicContact CG2-CD2 3.71Å; I27-L201 HydrophobicContact CG2-CG 4.1Å; W31-L201 HydrophobicContact CB-CD1 4Å; W31-L201 HydrophobicContact CG-CD1 4.21Å; Y129-L201 HydrophobicContact CD1-CB 4.01Å; Y129-L201 HydrophobicContact CD1-CD1 4.19Å; Y129-L201 HydrophobicContact CD2-CB 4.11Å; Y129-L201 HydrophobicContact CE1-CB 4.22Å; Y129-L201 HydrophobicContact CE1-CD1 3.82Å; Y129-L201 HydrophobicContact CE2-CB 4.32Å; Y129-L201 HydrophobicContact CG-CB 3.98Å; L197-L201 WeakPolarHBondContact O-CG 3.36Å; L197-L201 PolarHBondContact O-N 2.91Å; S198-L201 PolarHBondContact O-N 3.11Å; F199-L201 VanDerWaalsContact C-N 3.3Å; F199-L201 PolarHBondContact O-N 3.44Å; L201-R204 PolarHBondContact O-N 3.22Å; L201-Q205 WeakPolarHBondContact O-CB 3.22Å; L201-Q205 PolarHBondContact O-N 2.9Å
202G89.2Confident82.5Confident0 Ų058.6 Ų58.60%033%0.325CS..Hα-helixtrans-58.1-50.9176.200000111.9S198 F199 R204 Q205 D206S198-G202 PolarHBondContact O-N 2.82Å; F199-G202 PolarHBondContact O-N 3.32Å; G202-R204 VanDerWaalsContact C-N 3.31Å; G202-R204 PolarHBondContact O-N 2.92Å; G202-Q205 WeakPolarHBondContact O-CB 3.4Å; G202-Q205 PolarHBondContact O-N 3.07Å; G202-Q205 VanDerWaalsContact O-N 3.11Å; G202-D206 PolarHBondContact O-N 3.43Å
203N88.5Confident80Confident79 Ų7963.9 Ų63.942%0.42234%0.344SS..Hα-helixtrans-64.3-36178.3-65.9-16.9000112.2F199 Q205 D206 N207F199-N203 WeakPolarHBondContact O-CB 3.06Å; F199-N203 VanDerWaalsContact O-CG 3.24Å; F199-N203 PolarHBondContact O-N 3.39Å; F199-N203 PolarHBondContact O-ND2 3.38Å; N203-Q205 VanDerWaalsContact C-N 3.3Å; N203-Q205 PolarHBondContact O-N 2.04Å; N203-D206 PolarHBondContact O-N 2.87Å; N203-N207 PolarHBondContact O-N 2.92Å; N203-N207 PolarHBondContact O-ND2 2.59Å; N203-N207 VanDerWaalsContact O-ND2 3.16Å
204R86.3Confident77.4Confident94 Ų9468.1 Ų68.136%0.35536%0.362SS..Hα-helixtrans-66.7-32.6174.8-77.3-174.7-177.2-166.82.8112.4Y20 T200 L201 G202 L208Y20-R204 HydrophobicContact CE1-CB 4.36Å; Y20-R204 VanDerWaalsContact OH-CA 3.27Å; Y20-R204 WeakPolarHBondContact OH-CA 3.09Å; Y20-R204 WeakPolarHBondContact OH-CB 3.5Å; Y20-R204 WeakPolarHBondContact OH-CG 3.4Å; Y20-R204 PolarHBondContact OH-O 3.08Å; T200-R204 VanDerWaalsContact O-CB 3.29Å; T200-R204 WeakPolarHBondContact O-CB 3.37Å; T200-R204 WeakPolarHBondContact O-CG 3.38Å; T200-R204 PolarHBondContact O-N 2.76Å; L201-R204 PolarHBondContact O-N 3.22Å; G202-R204 VanDerWaalsContact C-N 3.31Å; G202-R204 PolarHBondContact O-N 2.92Å; R204-L208 WeakPolarHBondContact O-CG 3.3Å; R204-L208 PolarHBondContact O-N 3.35Å
205Q82.6Confident75.1Confident48 Ų4874.6 Ų74.622%0.22440%0.401CS..Hα-helixtrans-75.2-35.2178.5-169.565.123.100111.8A125 L201 G202 N203 L208 L209A125-Q205 HydrophobicContact CB-CG 3.94Å; L201-Q205 WeakPolarHBondContact O-CB 3.22Å; L201-Q205 PolarHBondContact O-N 2.9Å; G202-Q205 WeakPolarHBondContact O-CB 3.4Å; G202-Q205 PolarHBondContact O-N 3.07Å; G202-Q205 VanDerWaalsContact O-N 3.11Å; N203-Q205 VanDerWaalsContact C-N 3.3Å; N203-Q205 PolarHBondContact O-N 2.04Å; Q205-L208 WeakPolarHBondContact O-CB 3.11Å; Q205-L208 PolarHBondContact O-N 3.07Å; Q205-L209 PolarHBondContact O-N 3.13Å
206D82.6Confident72.5Confident50 Ų5084.3 Ų84.327%0.26745%0.446SS..Hα-helixtrans-62.4-45.2172.2-59-31.4000111K130 G202 N203 L208 L209K130-D206 WeakPolarHBondContact CE-OD2 3.04Å; K130-D206 IonicContact NZ-OD1 2.63Å; K130-D206 PolarHBondContact NZ-OD1 3.37Å; K130-D206 IonicContact NZ-OD2 3.7Å; K130-D206 PolarHBondContact NZ-OD2 3.33Å; G202-D206 PolarHBondContact O-N 3.43Å; N203-D206 PolarHBondContact O-N 2.87Å; D206-L208 PolarHBondContact O-N 3.36Å; D206-L208 VanDerWaalsContact O-N 3.09Å; D206-L209 PolarHBondContact O-N 3.05Å; D206-L209 VanDerWaalsContact O-N 3.14Å
207N76.7Confident70.2Confident134 Ų13482.7 Ų82.772%0.71745%0.453SS*.THydrogen-bonded Turntrans-64.9-13.3177-68.6-33.6000113.9N203N203-N207 PolarHBondContact O-N 2.92Å; N203-N207 PolarHBondContact O-ND2 2.59Å; N203-N207 VanDerWaalsContact O-ND2 3.16Å
208L68.9Low67.7Low24 Ų2484.7 Ų84.713%0.12648%0.48CS..THydrogen-bonded Turntrans-93-21.6177.3-83.9168.2000113.4H17 Y20 V21 R204 Q205 D206 P210H17-L208 VanDerWaalsContact NE2-CD2 3.32Å; H17-L208 WeakPolarHBondContact NE2-CD2 3.36Å; Y20-L208 HydrophobicContact CD1-CD1 3.86Å; Y20-L208 HydrophobicContact CD1-CD2 3.69Å; Y20-L208 HydrophobicContact CD1-CG 3.88Å; Y20-L208 HydrophobicContact CE1-CD1 3.55Å; Y20-L208 HydrophobicContact CE1-CD2 3.85Å; Y20-L208 HydrophobicContact CE1-CG 3.52Å; V21-L208 HydrophobicContact CG2-CD1 4.15Å; V21-L208 HydrophobicContact CG2-CD2 3.5Å; V21-L208 VanDerWaalsContact CG2-CD2 3.5Å; V21-L208 HydrophobicContact CG2-CG 4.48Å; R204-L208 WeakPolarHBondContact O-CG 3.3Å; R204-L208 PolarHBondContact O-N 3.35Å; Q205-L208 WeakPolarHBondContact O-CB 3.11Å; Q205-L208 PolarHBondContact O-N 3.07Å; D206-L208 PolarHBondContact O-N 3.36Å; D206-L208 VanDerWaalsContact O-N 3.09Å; L208-P210 WeakPolarHBondContact O-CD 3.42Å
209L60.4Low65.1Low58 Ų5888.1 Ų88.130%0.30452%0.515SS..SBendtrans-87.8102.7174.5-68.4166.4000106.4N124 Q205 D206N124-L209 VanDerWaalsContact ND2-CD1 3.33Å; N124-L209 WeakPolarHBondContact ND2-CD1 3.47Å; Q205-L209 PolarHBondContact O-N 3.13Å; D206-L209 PolarHBondContact O-N 3.05Å; D206-L209 VanDerWaalsContact O-N 3.14Å
210P52.8Low62.1Low82 Ų8299.1 Ų99.153%0.53257%0.567SS.*  trans-58145169.924-30.7000108.6L208 G212 F213L208-P210 WeakPolarHBondContact O-CD 3.42Å; P210-G212 PolarHBondContact O-N 3.18Å; P210-F213 HydrophobicContact CG-CD2 3.86Å; P210-F213 HydrophobicContact CG-CE2 3.98Å; P210-F213 PolarHBondContact O-N 3.14Å
211D51.5Low60.6Low184 Ų184100.9 Ų100.998%0.98458%0.576SS**THydrogen-bonded Turntrans-54.46.5-174.2-68.2-47.5000116.1
212G46.8Very low59.1Low65 Ų65106.2 Ų106.267%0.6761%0.606SS**THydrogen-bonded Turntrans-118.89.4-178.400000116.5P210 E214P210-G212 PolarHBondContact O-N 3.18Å; G212-E214 PolarHBondContact O-N 2.96Å; G212-E214 VanDerWaalsContact O-N 3.08Å
213F44.6Very low57.4Low162 Ų162112.1 Ų112.171%0.71164%0.64SS**  trans-82.169.6165.2-85.6-83.4000110.1P210P210-F213 HydrophobicContact CG-CD2 3.86Å; P210-F213 HydrophobicContact CG-CE2 3.98Å; P210-F213 PolarHBondContact O-N 3.14Å
214E41.8Very low55.6Low174 Ų174114 Ų11481%0.81365%0.653SS**  trans-61.1132.3149.4-70.4-170.9143.500106.8G212 E216G212-E214 PolarHBondContact O-N 2.96Å; G212-E214 VanDerWaalsContact O-N 3.08Å; E214-E216 PolarHBondContact O-N 3.31Å
215V46.8Very low53.6Low139 Ų139115.3 Ų115.384%0.84267%0.671SS**  trans-65.692.1168.6178.60000105.9G217V215-G217 VanDerWaalsContact C-N 3.27Å; V215-G217 PolarHBondContact O-N 2.87Å
216E43.2Very low51.7Low204 Ų204119.7 Ų119.795%0.95370%0.701SS**  trans-66.494.4169.1-154.4175.6-174.800106.5E214E214-E216 PolarHBondContact O-N 3.31Å
217G48.3Very low49.5Very low64 Ų64124.7 Ų124.766%0.6673%0.732SS**  trans-173.452.1-168.800000113.6V215V215-G217 VanDerWaalsContact C-N 3.27Å; V215-G217 PolarHBondContact O-N 2.87Å
218A40.2Very low47.4Very low111 Ų111124 Ų12492%0.91773%0.733SS**  trans-162.276.615100000109.4
219G40.2Very low45.6Very low72 Ų72132.3 Ų132.374%0.74278%0.784SS**  trans-166.459.2178.500000111.7
220E30.8Very low44.3Very low273 Ų273139.1 Ų139.1100%1.27683%0.827SS**  trans178.70136.7-95.4179144.100110.1

Retrieved 220 of 220 residues in 431.5 ms (Link to these results)

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